#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kua n PRO -4 N 0.00 0.00 -1.82 1.61 -0.04 -1.26 -4.75 135.00 128.74 2kua n PRO -4 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2kua n PRO -4 Cb 0.00 -0.24 0.00 0.00 -0.04 0.00 0.00 33.50 33.22 2kua n PRO -4 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2kua n LEU -3 N 0.00 0.00 0.00 1.53 7.94 -1.26 -3.37 117.00 121.84 2kua n LEU -3 Ca 0.00 0.29 0.00 0.00 -1.11 0.00 0.00 56.01 55.19 2kua n LEU -3 Cb 0.00 -0.76 0.00 0.00 0.53 0.00 0.00 43.42 43.19 2kua n LEU -3 CO 0.00 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 176.89 2kua n GLY -2 N -0.29 0.00 3.31 -3.96 0.00 -1.26 -5.13 105.19 97.86 2kua n GLY -2 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2kua n GLY -2 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kua s SER 0 N 0.00 5.69 -0.20 1.61 0.01 -1.22 -4.93 113.70 114.66 2kua s SER 0 Ca 0.00 -1.35 -0.18 0.00 1.31 0.00 0.00 55.95 55.73 2kua s SER 0 Cb 0.00 -2.01 -0.20 0.00 0.21 0.00 0.00 66.02 64.03 2kua s SER 0 CO 0.00 -0.50 0.18 1.15 0.41 0.00 0.00 173.24 174.48 2kua n MET 1 N 4.95 0.60 -3.60 12.44 0.00 -1.26 -5.03 117.12 125.22 2kua n MET 1 Ca -0.11 0.49 -0.09 0.00 0.00 0.00 0.00 57.70 57.99 2kua n MET 1 Cb 0.44 -1.72 -0.06 0.00 0.00 0.00 0.00 33.22 31.88 2kua n MET 1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2kua s ALA 2 N -2.41 -1.97 -0.14 3.17 0.00 -1.26 -5.04 121.76 114.11 2kua s ALA 2 Ca -0.29 1.71 -0.20 0.00 0.00 0.00 0.00 51.96 53.18 2kua s ALA 2 Cb 0.07 -1.05 -0.18 0.00 0.00 0.00 0.00 23.12 21.96 2kua s ALA 2 CO 0.61 -0.27 0.47 0.22 0.00 0.00 0.00 175.76 176.79 2kua h ASP 3 N 3.18 0.00 0.13 0.00 3.58 -2.03 -3.35 116.42 117.93 2kua h ASP 3 Ca -0.22 -0.65 -0.12 0.00 0.42 0.00 0.00 57.03 56.46 2kua h ASP 3 Cb 1.17 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.21 2kua h ASP 3 CO 0.23 0.94 -0.41 0.77 -2.88 0.00 0.00 179.24 177.89 2kua h SER 4 N -1.00 0.38 -3.45 2.28 4.64 -2.06 -3.45 113.55 110.89 2kua h SER 4 Ca -0.05 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 2kua h SER 4 Cb 0.79 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2kua h SER 4 CO -0.03 0.75 0.00 0.00 -0.87 0.00 0.00 176.83 176.68 2kua n GLN 5 N -4.02 -2.00 -2.30 4.77 10.64 -1.26 -4.80 117.38 118.41 2kua n GLN 5 Ca -0.02 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.74 2kua n GLN 5 Cb 0.49 -3.98 -0.03 0.00 -0.86 0.00 0.00 30.24 25.87 2kua n GLN 5 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 2kua s ASP 6 N -1.45 6.97 0.32 2.61 2.15 -1.26 -4.91 116.67 121.10 2kua s ASP 6 Ca 0.00 2.23 0.26 0.00 0.43 0.00 0.00 52.55 55.46 2kua s ASP 6 Cb 0.00 -2.59 1.07 0.00 -0.30 0.00 0.00 42.92 41.10 2kua s ASP 6 CO 0.00 -0.52 1.77 1.55 -0.17 0.00 0.00 175.17 177.80 2kua h PRO 7 N 6.24 0.00 -0.02 4.34 0.13 -2.04 -2.25 132.00 138.40 2kua h PRO 7 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2kua h PRO 7 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2kua h PRO 7 CO 0.81 0.00 -0.11 -0.11 -0.23 0.00 0.00 178.00 178.36 2kua n LEU 8 N -2.41 2.49 0.07 1.56 7.94 -1.26 -4.10 117.00 121.28 2kua n LEU 8 Ca 0.02 -0.84 -0.11 0.00 -1.11 0.00 0.00 56.01 53.96 2kua n LEU 8 Cb 0.24 -0.01 -0.08 0.00 0.53 0.00 0.00 43.42 44.11 2kua n LEU 8 CO 0.21 0.42 0.43 1.12 -1.11 0.00 0.00 177.39 178.47 2kua h HIS 9 N 3.74 -0.23 0.00 1.96 2.07 -1.79 -2.77 115.15 118.13 2kua h HIS 9 Ca 0.00 -0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.51 2kua h HIS 9 Cb 0.85 0.08 0.00 0.00 2.57 0.00 0.00 27.41 30.91 2kua h HIS 9 CO 0.00 0.19 0.00 1.49 -3.07 0.00 0.00 177.93 176.54 2kua h GLU 10 N -0.83 0.00 -0.04 5.12 4.22 -1.77 -2.94 114.58 118.35 2kua h GLU 10 Ca -0.03 0.00 -0.25 0.00 0.08 0.00 0.00 59.36 59.17 2kua h GLU 10 Cb 0.52 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.78 2kua h GLU 10 CO 0.04 0.00 -0.96 -0.09 -2.18 0.00 0.00 179.01 175.83 2kua h ARG 11 N 0.00 0.66 0.10 1.92 2.43 -1.70 -2.74 114.38 115.05 2kua h ARG 11 Ca 0.00 -0.66 -0.00 0.00 -0.81 0.00 0.00 59.98 58.50 2kua h ARG 11 Cb 0.57 0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 2kua h ARG 11 CO 0.00 1.26 -0.05 1.15 -1.51 0.00 0.00 179.97 180.82 2kua h THR 12 N 0.40 0.92 -0.04 0.20 2.02 -1.42 -2.65 112.91 112.34 2kua h THR 12 Ca -0.10 -1.37 0.03 0.00 0.77 0.00 0.00 66.41 65.74 2kua h THR 12 Cb 1.60 1.63 -0.06 0.00 -1.74 0.00 0.00 68.15 69.58 2kua h THR 12 CO 0.18 0.27 -0.40 -0.09 0.37 0.00 0.00 175.52 175.86 2kua h ARG 13 N -0.91 -0.51 -0.55 6.66 9.65 -1.66 0.15 114.38 127.21 2kua h ARG 13 Ca -0.01 0.03 0.08 0.00 -1.10 0.00 0.00 59.98 58.98 2kua h ARG 13 Cb 0.54 0.12 -0.06 0.00 -1.39 0.00 0.00 29.97 29.17 2kua h ARG 13 CO 0.02 -0.34 0.21 0.07 2.80 0.00 0.00 179.97 182.73 2kua h ARG 14 N -0.53 0.38 0.04 0.20 -0.00 -1.63 0.71 114.38 113.56 2kua h ARG 14 Ca 0.06 -0.02 0.01 0.00 -0.00 0.00 0.00 59.98 60.03 2kua h ARG 14 Cb 0.63 -0.09 -0.02 0.00 -0.00 0.00 0.00 29.97 30.49 2kua h ARG 14 CO -0.33 0.25 -0.11 1.25 -0.00 0.00 0.00 179.97 181.04 2kua h LEU 15 N 0.39 -0.30 0.27 0.08 5.85 -0.98 -0.70 115.31 119.93 2kua h LEU 15 Ca 0.27 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 2kua h LEU 15 Cb 0.31 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2kua h LEU 15 CO -0.27 -0.16 -0.18 -0.07 -0.34 0.00 0.00 178.44 177.42 2kua h LEU 16 N -0.20 -0.46 -1.70 2.25 4.07 -0.22 -2.11 115.31 116.94 2kua h LEU 16 Ca 0.03 0.03 0.18 0.00 0.08 0.00 0.00 57.88 58.19 2kua h LEU 16 Cb 0.23 0.14 -0.05 0.00 1.08 0.00 0.00 40.66 42.07 2kua h LEU 16 CO -0.08 -0.29 0.52 -1.28 -1.08 0.00 0.00 178.44 176.23 2kua h SER 17 N -0.45 0.27 -0.58 -0.43 0.87 -0.74 0.89 113.55 113.38 2kua h SER 17 Ca -0.02 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 2kua h SER 17 Cb 0.38 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.28 2kua h SER 17 CO 0.01 0.13 0.16 0.44 -0.53 0.00 0.00 176.83 177.04 2kua h ASP 18 N 0.28 0.89 1.14 6.23 5.19 -0.44 -1.92 116.42 127.80 2kua h ASP 18 Ca 0.38 -0.17 -0.00 0.00 -0.62 0.00 0.00 57.03 56.62 2kua h ASP 18 Cb 1.06 -0.23 -0.00 0.00 0.18 0.00 0.00 39.33 40.34 2kua h ASP 18 CO -0.09 0.86 -0.01 0.22 -3.12 0.00 0.00 179.24 177.10 2kua h TYR 19 N 0.92 0.00 0.03 4.55 3.20 -0.55 -2.99 116.97 122.13 2kua h TYR 19 Ca 0.20 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.91 2kua h TYR 19 Cb 0.31 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.60 2kua h TYR 19 CO 0.02 0.01 -0.64 0.82 -1.64 0.00 0.00 178.16 176.72 2kua h ILE 20 N 0.00 1.45 -0.15 1.81 1.08 -1.02 -2.95 117.51 117.73 2kua h ILE 20 Ca -0.00 -2.17 -0.00 0.00 -0.39 0.00 0.00 64.86 62.29 2kua h ILE 20 Cb 0.58 2.72 -0.01 0.00 -3.07 0.00 0.00 36.82 37.05 2kua h ILE 20 CO 0.00 0.63 0.08 -0.26 -0.69 0.00 0.00 178.15 177.91 2kua h PHE 21 N -0.16 0.20 -0.07 1.37 -1.00 -1.40 -2.25 116.94 113.63 2kua h PHE 21 Ca -0.09 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.72 2kua h PHE 21 Cb 1.38 -0.06 -0.03 0.00 3.61 0.00 0.00 35.95 40.84 2kua h PHE 21 CO 0.16 0.19 -0.12 0.74 -1.61 0.00 0.00 178.31 177.67 2kua h PHE 22 N 0.14 -0.31 0.00 -0.55 -1.00 -1.64 0.30 116.94 113.88 2kua h PHE 22 Ca 0.05 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.85 2kua h PHE 22 Cb 0.06 0.15 0.00 0.00 3.61 0.00 0.00 35.95 39.77 2kua h PHE 22 CO -0.04 -0.19 0.00 0.00 -1.61 0.00 0.00 178.31 176.47 2kua n ALA 24 N -1.38 3.33 -2.23 0.00 0.00 0.25 -4.94 120.51 115.54 2kua n ALA 24 Ca 0.02 -0.33 -0.43 0.00 0.00 0.00 0.00 53.44 52.71 2kua n ALA 24 Cb 0.06 -0.43 -0.02 0.00 0.00 0.00 0.00 19.45 19.06 2kua n ALA 24 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2kua s ARG 25 N -2.26 3.71 0.13 0.00 1.81 0.80 -4.92 118.95 118.22 2kua s ARG 25 Ca 0.03 1.36 -0.11 0.00 -1.72 0.00 0.00 55.73 55.28 2kua s ARG 25 Cb 0.09 -4.02 -0.07 0.00 -0.45 0.00 0.00 34.95 30.50 2kua s ARG 25 CO 0.49 -1.39 0.15 0.39 -0.68 0.00 0.00 175.30 174.26 2kua n GLU 26 N 7.77 0.00 0.20 3.54 -0.58 -1.26 -4.76 120.64 125.55 2kua n GLU 26 Ca 0.18 0.00 0.15 0.00 -0.42 0.00 0.00 57.16 57.06 2kua n GLU 26 Cb 0.46 -0.44 0.60 0.00 -0.57 0.00 0.00 31.44 31.49 2kua n GLU 26 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2kua h PRO 27 N 0.31 0.00 0.00 3.49 0.13 -1.96 -2.64 132.00 131.33 2kua h PRO 27 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 2kua h PRO 27 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2kua h PRO 27 CO 0.23 0.00 0.00 -3.47 -0.23 0.00 0.00 178.00 174.53 2kua n ASP 28 N -2.65 0.00 -3.68 1.44 2.03 -1.26 -4.63 116.55 107.80 2kua n ASP 28 Ca 0.01 -1.20 -0.10 0.00 0.52 0.00 0.00 54.79 54.02 2kua n ASP 28 Cb 0.26 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.55 2kua n ASP 28 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2kua s THR 29 N -2.00 -0.31 0.21 5.18 -1.32 -1.00 -5.15 115.64 111.25 2kua s THR 29 Ca 0.21 0.15 -0.30 0.00 -1.21 0.00 0.00 61.69 60.55 2kua s THR 29 Cb 0.10 -0.59 -0.09 0.00 -1.51 0.00 0.00 72.50 70.41 2kua s THR 29 CO 0.16 0.06 1.30 -2.16 -2.21 0.00 0.00 174.62 171.78 2kua s PRO 30 N 1.98 4.40 0.61 7.08 0.04 -1.26 -4.67 135.00 143.18 2kua s PRO 30 Ca -0.05 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 62.89 2kua s PRO 30 Cb -0.10 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.22 2kua s PRO 30 CO -0.12 -0.23 1.06 -1.21 0.04 0.00 0.00 177.00 176.54 2kua s GLU 31 N -0.25 3.23 1.03 4.56 8.01 -1.26 -5.04 118.70 128.98 2kua s GLU 31 Ca 0.56 1.16 -0.13 0.00 0.01 0.00 0.00 54.97 56.56 2kua s GLU 31 Cb -0.36 -2.02 0.20 0.00 -4.31 0.00 0.00 34.13 27.64 2kua s GLU 31 CO 0.39 -0.87 1.09 -1.25 0.01 0.00 0.00 175.26 174.63 2kua s PRO 32 N -4.26 0.18 1.04 0.39 0.04 -1.26 -5.04 135.00 126.09 2kua s PRO 32 Ca 0.62 0.44 -0.13 0.00 0.04 0.00 0.00 61.00 61.97 2kua s PRO 32 Cb -0.16 -1.72 0.21 0.00 0.04 0.00 0.00 34.50 32.88 2kua s PRO 32 CO 0.40 -2.88 1.09 -1.25 0.04 0.00 0.00 177.00 174.41 2kua s PRO 33 N -5.00 0.09 1.18 0.56 0.04 -1.26 -5.05 135.00 125.57 2kua s PRO 33 Ca 0.66 0.41 -0.19 0.00 0.04 0.00 0.00 61.00 61.93 2kua s PRO 33 Cb -0.18 -1.71 0.28 0.00 0.04 0.00 0.00 34.50 32.93 2kua s PRO 33 CO 0.58 -2.94 1.11 -1.25 0.04 0.00 0.00 177.00 174.54 2kua s PRO 34 N -5.01 -1.08 -0.02 0.56 0.04 -1.26 -5.02 135.00 123.20 2kua s PRO 34 Ca 0.66 -0.02 0.02 0.00 0.04 0.00 0.00 61.00 61.71 2kua s PRO 34 Cb -0.18 -1.61 -0.03 0.00 0.04 0.00 0.00 34.50 32.72 2kua s PRO 34 CO 0.58 -3.63 0.02 -2.37 0.04 0.00 0.00 177.00 171.64 2kua n THR 35 N -4.71 0.14 -4.22 1.26 5.66 -1.26 -4.97 114.28 106.18 2kua n THR 35 Ca 0.12 -0.10 -0.13 0.00 -3.05 0.00 0.00 64.05 60.90 2kua n THR 35 Cb 0.59 -0.69 -0.10 0.00 -1.55 0.00 0.00 70.33 68.58 2kua n THR 35 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2kua s SER 36 N -3.13 0.74 0.20 1.09 1.04 -1.26 -4.83 113.70 107.54 2kua s SER 36 Ca -0.01 -1.27 -0.13 0.00 0.48 0.00 0.00 55.95 55.02 2kua s SER 36 Cb 0.01 0.23 0.22 0.00 0.10 0.00 0.00 66.02 66.58 2kua s SER 36 CO 0.10 -0.70 1.66 0.58 0.98 0.00 0.00 173.24 175.87 2kua h VAL 37 N 2.67 0.53 -0.24 5.02 2.07 -1.94 0.19 116.25 124.54 2kua h VAL 37 Ca -0.36 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.12 2kua h VAL 37 Cb 1.22 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 2kua h VAL 37 CO 0.59 0.01 0.13 1.05 0.02 0.00 0.00 177.57 179.38 2kua h GLU 38 N 0.08 0.33 -0.08 1.57 9.09 -1.97 -0.85 114.58 122.75 2kua h GLU 38 Ca 0.28 -0.03 -0.14 0.00 0.05 0.00 0.00 59.36 59.52 2kua h GLU 38 Cb 0.43 -0.07 -0.01 0.00 -1.65 0.00 0.00 28.75 27.45 2kua h GLU 38 CO -0.49 0.25 -0.58 0.00 0.05 0.00 0.00 179.01 178.23 2kua h ALA 39 N 1.81 0.86 0.06 1.06 0.00 -1.08 -1.66 119.26 120.31 2kua h ALA 39 Ca 0.09 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 2kua h ALA 39 Cb 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2kua h ALA 39 CO -0.01 0.71 -0.03 0.00 0.00 0.00 0.00 179.25 179.92 2kua h ALA 40 N 1.19 -0.08 0.41 0.00 0.00 -0.13 -2.90 119.26 117.75 2kua h ALA 40 Ca -0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 2kua h ALA 40 Cb 1.08 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2kua h ALA 40 CO 0.09 -0.17 -0.20 1.25 0.00 0.00 0.00 179.25 180.22 2kua h LEU 41 N -0.83 -0.48 -0.68 0.00 7.12 -1.27 -2.46 115.31 116.72 2kua h LEU 41 Ca -0.01 0.02 0.14 0.00 0.13 0.00 0.00 57.88 58.16 2kua h LEU 41 Cb 0.64 0.12 -0.11 0.00 -0.53 0.00 0.00 40.66 40.78 2kua h LEU 41 CO 0.01 -0.34 0.10 -0.07 -0.13 0.00 0.00 178.44 178.01 2kua h LEU 42 N -0.56 -0.11 -2.34 2.25 3.38 -1.44 0.68 115.31 117.17 2kua h LEU 42 Ca -0.06 0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2kua h LEU 42 Cb 0.43 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2kua h LEU 42 CO 0.09 -0.07 -0.01 -0.09 0.09 0.00 0.00 178.44 178.45 2kua h ARG 43 N 0.20 0.00 0.15 1.13 1.12 -1.29 2.49 114.38 118.18 2kua h ARG 43 Ca 0.37 0.00 -0.35 0.00 -1.11 0.00 0.00 59.98 58.89 2kua h ARG 43 Cb 0.62 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.58 2kua h ARG 43 CO -0.52 0.01 -1.85 1.03 -3.11 0.00 0.00 179.97 175.54 2kua h SER 44 N 0.00 0.49 0.00 -3.80 0.87 0.54 -3.29 113.55 108.37 2kua h SER 44 Ca -0.00 -0.94 -0.09 0.00 -1.23 0.00 0.00 61.79 59.53 2kua h SER 44 Cb 0.03 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 2kua h SER 44 CO 0.00 1.81 -0.79 1.33 -0.53 0.00 0.00 176.83 178.65 2kua n VAL 45 N -3.58 1.46 -0.30 2.23 0.24 0.17 -4.03 118.33 114.53 2kua n VAL 45 Ca -0.29 0.13 0.20 0.00 -2.04 0.00 0.00 64.34 62.34 2kua n VAL 45 Cb 1.04 -2.26 0.48 0.00 -1.47 0.00 0.00 33.84 31.63 2kua n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2kua h THR 46 N -1.00 0.60 -0.21 3.34 1.03 0.41 0.43 112.91 117.52 2kua h THR 46 Ca -0.13 -0.16 -0.02 0.00 -0.01 0.00 0.00 66.41 66.09 2kua h THR 46 Cb 0.80 0.11 -0.01 0.00 -1.07 0.00 0.00 68.15 67.98 2kua h THR 46 CO -0.08 0.08 0.04 0.08 -0.01 0.00 0.00 175.52 175.63 2kua h ARG 47 N 0.45 0.29 0.05 0.00 -0.00 -1.59 -2.14 114.38 111.44 2kua h ARG 47 Ca 0.55 -0.04 -0.23 0.00 -0.00 0.00 0.00 59.98 60.26 2kua h ARG 47 Cb 1.30 -0.06 -0.02 0.00 -0.00 0.00 0.00 29.97 31.20 2kua h ARG 47 CO -0.26 0.28 -1.08 -0.56 -0.00 0.00 0.00 179.97 178.35 2kua h GLN 48 N 0.29 0.12 -0.17 0.08 -0.00 -0.32 -2.97 115.11 112.13 2kua h GLN 48 Ca 0.07 -0.19 -0.02 0.00 -0.00 0.00 0.00 58.65 58.51 2kua h GLN 48 Cb 0.14 0.07 -0.01 0.00 -0.00 0.00 0.00 27.48 27.68 2kua h GLN 48 CO -0.00 1.08 0.02 0.82 -0.00 0.00 0.00 178.83 180.75 2kua h ILE 49 N 0.04 1.10 0.00 1.86 1.08 -0.68 -2.25 117.51 118.66 2kua h ILE 49 Ca -0.06 -0.38 0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2kua h ILE 49 Cb 1.82 0.95 0.00 0.00 -3.07 0.00 0.00 36.82 36.53 2kua h ILE 49 CO 0.16 0.13 -0.04 1.56 -0.69 0.00 0.00 178.15 179.27 2kua h GLN 50 N 0.25 0.00 -0.04 2.37 4.20 -1.54 -1.11 115.11 119.24 2kua h GLN 50 Ca 0.06 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.78 2kua h GLN 50 Cb 0.14 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 2kua h GLN 50 CO 0.00 0.00 0.63 -0.56 -0.67 0.00 0.00 178.83 178.23 2kua h GLN 51 N -0.93 0.00 0.03 1.46 3.07 -1.53 5.44 115.11 122.66 2kua h GLN 51 Ca 0.00 0.00 -0.39 0.00 0.09 0.00 0.00 58.65 58.35 2kua h GLN 51 Cb 0.04 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 27.55 2kua h GLN 51 CO 0.00 0.00 -2.33 -0.85 0.09 0.00 0.00 178.83 175.74 2kua n GLU 52 N -2.76 0.67 -0.11 0.06 0.28 -0.85 -4.61 120.64 113.32 2kua n GLU 52 Ca -0.00 0.20 -0.20 0.00 -0.16 0.00 0.00 57.16 57.00 2kua n GLU 52 Cb 0.67 -1.57 -0.09 0.00 1.43 0.00 0.00 31.44 31.87 2kua n GLU 52 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2kua n HIS 53 N -3.44 0.00 -0.11 -1.84 8.25 0.89 -4.42 115.22 114.55 2kua n HIS 53 Ca -0.43 0.00 0.21 0.00 -0.26 0.00 0.00 57.72 57.24 2kua n HIS 53 Cb 0.99 -0.85 0.32 0.00 1.12 0.00 0.00 29.99 31.57 2kua n HIS 53 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2kua n GLN 54 N -3.56 0.02 -0.36 -0.41 -0.00 1.74 0.28 117.38 115.08 2kua n GLN 54 Ca -0.43 0.91 0.34 0.00 -0.00 0.00 0.00 57.00 57.82 2kua n GLN 54 Cb 0.88 -2.31 0.68 0.00 -0.00 0.00 0.00 30.24 29.49 2kua n GLN 54 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 2kua h GLU 55 N 0.00 0.11 0.00 2.61 5.08 -1.76 0.62 114.58 121.23 2kua h GLU 55 Ca 0.37 -0.01 -0.33 0.00 -1.00 0.00 0.00 59.36 58.40 2kua h GLU 55 Cb 2.52 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 31.69 2kua h GLU 55 CO -0.00 0.07 -2.23 1.19 -1.00 0.00 0.00 179.01 177.04 2kua n PHE 56 N -4.33 0.00 -0.03 4.33 3.01 0.14 -4.41 117.46 116.18 2kua n PHE 56 Ca 0.28 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.66 2kua n PHE 56 Cb 1.23 -0.83 -0.02 0.00 -0.01 0.00 0.00 39.48 39.84 2kua n PHE 56 CO 0.00 0.00 0.00 0.74 1.01 0.00 0.00 176.76 178.51 2kua h PHE 57 N -0.02 -0.50 -0.67 1.38 0.04 -1.35 -1.87 116.94 113.96 2kua h PHE 57 Ca -0.48 0.03 0.14 0.00 2.80 0.00 0.00 57.97 60.46 2kua h PHE 57 Cb 1.74 0.25 -0.10 0.00 2.20 0.00 0.00 35.95 40.04 2kua h PHE 57 CO 0.02 -0.27 0.11 1.03 -0.60 0.00 0.00 178.31 178.60 2kua h SER 58 N -0.21 -0.08 -0.92 2.17 0.87 -1.16 0.21 113.55 114.43 2kua h SER 58 Ca 0.12 0.14 0.19 0.00 -1.23 0.00 0.00 61.79 61.01 2kua h SER 58 Cb 0.39 0.21 -0.08 0.00 -0.44 0.00 0.00 62.40 62.49 2kua h SER 58 CO -0.33 -0.05 0.60 -1.28 -0.53 0.00 0.00 176.83 175.24 2kua h SER 59 N 0.22 0.54 0.03 6.23 0.87 -1.55 -0.84 113.55 119.04 2kua h SER 59 Ca 0.36 0.05 -0.22 0.00 -1.23 0.00 0.00 61.79 60.75 2kua h SER 59 Cb 0.59 -0.05 0.02 0.00 -0.44 0.00 0.00 62.40 62.52 2kua h SER 59 CO -0.49 0.22 -0.89 -0.26 -0.53 0.00 0.00 176.83 174.88 2kua h PHE 60 N 0.54 0.85 -0.27 2.24 0.04 -0.44 -3.10 116.94 116.79 2kua h PHE 60 Ca 0.49 -0.48 0.08 0.00 2.80 0.00 0.00 57.97 60.86 2kua h PHE 60 Cb 1.03 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 39.08 2kua h PHE 60 CO -0.00 1.31 0.54 0.00 -0.60 0.00 0.00 178.31 179.57 2kua n GLU 62 N -3.21 1.87 0.01 0.00 1.02 -1.08 -4.36 120.64 114.89 2kua n GLU 62 Ca 0.05 -3.38 -0.00 0.00 -0.02 0.00 0.00 57.16 53.81 2kua n GLU 62 Cb 0.66 -1.61 -0.00 0.00 -0.02 0.00 0.00 31.44 30.47 2kua n GLU 62 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2kua n SER 63 N -0.88 0.21 0.00 1.62 2.88 0.15 -4.86 113.62 112.75 2kua n SER 63 Ca 0.23 0.03 0.11 0.00 -1.33 0.00 0.00 58.87 57.90 2kua n SER 63 Cb 0.79 -0.10 -0.09 0.00 -0.75 0.00 0.00 64.21 64.05 2kua n SER 63 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2kua n ARG 64 N -2.69 0.27 -0.96 -1.46 5.12 -1.19 -4.96 116.66 110.79 2kua n ARG 64 Ca -0.00 -0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.86 2kua n ARG 64 Cb 0.01 -1.53 0.00 0.00 -1.16 0.00 0.00 32.46 29.78 2kua n ARG 64 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2kua n GLY 65 N 1.39 0.41 1.43 -0.13 0.00 -1.25 -4.87 105.19 102.18 2kua n GLY 65 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 2kua n GLY 65 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2kua n ASN 66 N -0.26 3.51 -0.34 1.61 5.03 -1.26 -4.60 115.26 118.96 2kua n ASN 66 Ca 0.00 -2.55 0.28 0.00 0.87 0.00 0.00 54.58 53.17 2kua n ASN 66 Cb 0.13 -0.65 0.45 0.00 -1.02 0.00 0.00 39.78 38.69 2kua n ASN 66 CO 0.00 0.00 0.00 -2.11 -1.83 0.00 0.00 177.26 173.32 2kua n ARG 67 N 0.04 -0.02 -0.06 3.52 0.00 -1.26 0.19 116.66 119.07 2kua n ARG 67 Ca 0.20 0.78 -0.12 0.00 -0.00 0.00 0.00 57.85 58.70 2kua n ARG 67 Cb 0.85 -1.59 -0.11 0.00 -0.00 0.00 0.00 32.46 31.62 2kua n ARG 67 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2kua h LEU 68 N 0.00 -0.01 -1.69 2.89 5.85 -1.93 -2.77 115.31 117.65 2kua h LEU 68 Ca 0.57 -0.81 0.25 0.00 0.84 0.00 0.00 57.88 58.73 2kua h LEU 68 Cb 1.95 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.92 2kua h LEU 68 CO -0.23 0.86 0.65 -0.33 -0.34 0.00 0.00 178.44 179.05 2kua h GLU 69 N -0.94 0.22 0.10 1.25 5.08 0.17 0.19 114.58 120.66 2kua h GLU 69 Ca -0.00 -0.01 -0.27 0.00 -1.00 0.00 0.00 59.36 58.08 2kua h GLU 69 Cb 0.82 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.03 2kua h GLU 69 CO 0.00 0.15 -1.18 -0.07 -1.00 0.00 0.00 179.01 176.91 2kua h LEU 70 N 0.23 0.57 -0.45 1.33 -0.00 -1.27 -2.56 115.31 113.16 2kua h LEU 70 Ca 0.49 -0.55 0.03 0.00 -0.00 0.00 0.00 57.88 57.85 2kua h LEU 70 Cb 1.52 -0.18 -0.04 0.00 -0.00 0.00 0.00 40.66 41.97 2kua h LEU 70 CO -0.13 1.39 0.24 1.62 -0.00 0.00 0.00 178.44 181.56 2kua h VAL 71 N 0.16 0.99 -0.13 1.22 3.04 -0.34 0.27 116.25 121.47 2kua h VAL 71 Ca -0.14 -0.16 -0.09 0.00 -1.01 0.00 0.00 66.70 65.30 2kua h VAL 71 Cb 1.87 0.48 0.00 0.00 -2.01 0.00 0.00 31.29 31.62 2kua h VAL 71 CO 0.20 0.09 -0.28 0.07 -1.01 0.00 0.00 177.57 176.64 2kua h LYS 72 N 0.47 0.41 0.17 4.17 2.10 -1.48 -2.76 116.57 119.65 2kua h LYS 72 Ca 0.19 -0.27 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 2kua h LYS 72 Cb 0.07 0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 31.43 2kua h LYS 72 CO -0.12 0.88 -0.14 1.96 -2.00 0.00 0.00 179.45 180.03 2kua h GLN 73 N -0.00 -0.31 -0.57 0.07 7.50 -1.25 -2.01 115.11 118.54 2kua h GLN 73 Ca 0.00 0.02 0.10 0.00 0.50 0.00 0.00 58.65 59.27 2kua h GLN 73 Cb 0.88 0.07 -0.03 0.00 0.05 0.00 0.00 27.48 28.44 2kua h GLN 73 CO 0.06 -0.21 0.39 0.52 -1.50 0.00 0.00 178.83 178.09 2kua h MET 74 N -0.32 0.33 0.00 1.46 2.86 -0.54 0.83 114.93 119.55 2kua h MET 74 Ca -0.00 -0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.54 2kua h MET 74 Cb 0.29 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 2kua h MET 74 CO -0.02 0.22 -0.37 0.00 1.06 0.00 0.00 176.91 177.80 2kua h ALA 75 N 1.71 1.26 -0.06 6.32 0.00 -1.07 -3.01 119.26 124.40 2kua h ALA 75 Ca 0.26 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2kua h ALA 75 Cb 0.59 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2kua h ALA 75 CO -0.07 0.46 -0.13 0.22 0.00 0.00 0.00 179.25 179.73 2kua h ASP 76 N 0.00 0.23 -0.53 0.00 3.58 -0.28 1.30 116.42 120.72 2kua h ASP 76 Ca -0.00 -0.57 0.09 0.00 0.42 0.00 0.00 57.03 56.97 2kua h ASP 76 Cb 0.71 -0.07 -0.07 0.00 1.72 0.00 0.00 39.33 41.62 2kua h ASP 76 CO 0.05 0.76 0.12 0.11 -2.88 0.00 0.00 179.24 177.40 2kua h LYS 77 N -0.29 0.26 0.00 0.28 1.79 -1.42 -3.32 116.57 113.87 2kua h LYS 77 Ca 0.00 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2kua h LYS 77 Cb 0.72 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.31 2kua h LYS 77 CO 0.03 0.17 -0.36 1.47 -1.08 0.00 0.00 179.45 179.68 2kua n LEU 78 N -5.10 1.25 -4.87 2.94 -0.00 -1.14 -4.96 117.00 105.12 2kua n LEU 78 Ca 0.06 0.51 -0.30 0.00 -0.00 0.00 0.00 56.01 56.28 2kua n LEU 78 Cb 0.26 -0.76 -0.03 0.00 -0.00 0.00 0.00 43.42 42.89 2kua n LEU 78 CO 0.20 -0.48 0.48 -0.76 -0.00 0.00 0.00 177.39 176.83 2kua s LEU 79 N -7.08 3.78 0.00 1.47 2.01 0.45 -4.69 118.68 114.61 2kua s LEU 79 Ca -0.10 1.20 0.00 0.00 0.01 0.00 0.00 54.13 55.23 2kua s LEU 79 Cb 0.01 -4.09 0.00 0.00 0.01 0.00 0.00 46.19 42.12 2kua s LEU 79 CO 0.15 -0.44 0.00 -0.24 1.01 0.00 0.00 176.35 176.83 2kua n SER 80 N -1.40 0.00 -0.12 2.29 2.88 -1.26 -3.38 113.62 112.63 2kua n SER 80 Ca 0.03 -0.19 -0.24 0.00 -1.33 0.00 0.00 58.87 57.14 2kua n SER 80 Cb 0.54 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.92 2kua n SER 80 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2kua n LYS 81 N 0.00 0.56 -0.41 -1.46 2.85 -1.26 -4.52 118.16 113.92 2kua n LYS 81 Ca 0.00 0.24 0.09 0.00 -1.05 0.00 0.00 58.31 57.59 2kua n LYS 81 Cb 0.00 -1.44 0.29 0.00 -0.65 0.00 0.00 35.03 33.22 2kua n LYS 81 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2kua n ASP 82 N -4.26 3.68 -4.67 -5.58 8.00 -1.26 -4.86 116.55 107.60 2kua n ASP 82 Ca -0.44 -2.18 -0.36 0.00 0.71 0.00 0.00 54.79 52.53 2kua n ASP 82 Cb 0.79 -0.47 -0.09 0.00 -0.02 0.00 0.00 41.12 41.33 2kua n ASP 82 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2kua s GLN 83 N -1.47 4.07 -0.72 -1.24 1.11 -1.26 -4.99 119.66 115.16 2kua s GLN 83 Ca 0.42 -0.28 -0.21 0.00 0.01 0.00 0.00 55.36 55.30 2kua s GLN 83 Cb 0.24 -3.42 -0.17 0.00 -1.01 0.00 0.00 33.01 28.66 2kua s GLN 83 CO 0.25 0.18 1.91 -0.40 0.01 0.00 0.00 175.29 177.23 2kua n ASP 84 N 3.88 2.54 -4.66 5.90 5.75 -1.26 -4.56 116.55 124.13 2kua n ASP 84 Ca -0.16 -2.64 -0.53 0.00 -0.01 0.00 0.00 54.79 51.46 2kua n ASP 84 Cb 0.52 -1.06 -0.06 0.00 -1.03 0.00 0.00 41.12 39.49 2kua n ASP 84 CO 0.00 0.00 0.00 2.22 -0.11 0.00 0.00 177.20 179.31 2kua n PHE 85 N 7.34 2.10 -2.59 2.11 -1.74 -1.26 -4.94 117.46 118.48 2kua n PHE 85 Ca 0.49 0.29 -0.29 0.00 -0.56 0.00 0.00 57.45 57.37 2kua n PHE 85 Cb 0.38 -2.55 -0.01 0.00 1.52 0.00 0.00 39.48 38.82 2kua n PHE 85 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 2kua s SER 86 N 4.32 6.36 0.36 5.98 1.04 -1.26 -4.93 113.70 125.57 2kua s SER 86 Ca 0.98 1.10 0.14 0.00 0.48 0.00 0.00 55.95 58.65 2kua s SER 86 Cb -0.90 -2.32 1.00 0.00 0.10 0.00 0.00 66.02 63.90 2kua s SER 86 CO 0.58 -0.56 1.75 -0.50 0.98 0.00 0.00 173.24 175.49 2kua h TRP 87 N 0.53 0.83 -0.03 5.02 -0.00 -2.01 0.65 115.95 120.94 2kua h TRP 87 Ca -0.47 0.03 0.01 0.00 -0.00 0.00 0.00 58.89 58.46 2kua h TRP 87 Cb 1.20 -0.24 -0.00 0.00 -0.00 0.00 0.00 29.16 30.11 2kua h TRP 87 CO 0.61 0.07 0.02 1.03 -0.00 0.00 0.00 178.44 180.16 2kua h SER 88 N 0.49 0.00 -0.06 -3.49 0.87 -2.00 -2.36 113.55 107.00 2kua h SER 88 Ca 0.62 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 61.12 2kua h SER 88 Cb 1.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.33 2kua h SER 88 CO -0.38 0.00 -0.21 1.56 -0.53 0.00 0.00 176.83 177.27 2kua h GLN 89 N 0.00 0.25 -0.19 2.24 1.08 -0.05 -2.49 115.11 115.95 2kua h GLN 89 Ca 0.01 -0.19 0.05 0.00 -1.45 0.00 0.00 58.65 57.08 2kua h GLN 89 Cb 0.06 0.03 -0.07 0.00 -0.05 0.00 0.00 27.48 27.45 2kua h GLN 89 CO -0.00 0.82 -0.35 -0.07 -0.95 0.00 0.00 178.83 178.28 2kua h LEU 90 N -0.26 -1.10 -1.67 1.46 -0.00 -1.21 0.16 115.31 112.68 2kua h LEU 90 Ca -0.01 0.16 -0.03 0.00 -0.00 0.00 0.00 57.88 58.01 2kua h LEU 90 Cb 0.84 0.47 -0.01 0.00 -0.00 0.00 0.00 40.66 41.97 2kua h LEU 90 CO 0.04 -0.37 -0.10 -0.37 -0.00 0.00 0.00 178.44 177.64 2kua h VAL 91 N -0.39 1.11 -0.41 1.22 -1.51 -1.60 -2.50 116.25 112.17 2kua h VAL 91 Ca 0.11 -0.48 -0.09 0.00 -1.23 0.00 0.00 66.70 65.00 2kua h VAL 91 Cb 0.56 1.18 -0.01 0.00 -2.13 0.00 0.00 31.29 30.90 2kua h VAL 91 CO -0.41 0.14 -0.10 -0.03 -1.23 0.00 0.00 177.57 175.94 2kua h MET 92 N 0.08 0.79 -0.56 5.19 -1.53 -0.51 -2.03 114.93 116.36 2kua h MET 92 Ca 0.02 -0.31 0.00 0.00 -3.44 0.00 0.00 59.70 55.98 2kua h MET 92 Cb 0.23 -0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.21 2kua h MET 92 CO 0.01 0.92 0.37 1.37 0.14 0.00 0.00 176.91 179.72 2kua h LEU 93 N 0.61 0.64 -0.12 3.39 8.10 -0.34 -1.98 115.31 125.61 2kua h LEU 93 Ca 0.10 -0.02 -0.10 0.00 0.11 0.00 0.00 57.88 57.97 2kua h LEU 93 Cb 0.63 -0.16 0.00 0.00 -0.44 0.00 0.00 40.66 40.70 2kua h LEU 93 CO 0.04 0.47 -0.31 -0.07 -4.11 0.00 0.00 178.44 174.46 2kua h LEU 94 N 0.76 0.49 0.40 0.17 3.38 -1.35 -2.85 115.31 116.30 2kua h LEU 94 Ca 0.20 -0.59 -0.00 0.00 0.09 0.00 0.00 57.88 57.58 2kua h LEU 94 Cb -0.08 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 2kua h LEU 94 CO -0.04 0.98 -0.42 0.00 0.09 0.00 0.00 178.44 179.05 2kua h ALA 95 N 0.51 -0.92 0.06 1.53 0.00 -0.97 -2.59 119.26 116.88 2kua h ALA 95 Ca -0.00 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.78 2kua h ALA 95 Cb 0.92 0.62 -0.05 0.00 0.00 0.00 0.00 17.79 19.28 2kua h ALA 95 CO 0.07 -1.06 -0.52 0.35 0.00 0.00 0.00 179.25 178.09 2kua h PHE 96 N -0.84 -1.51 -0.93 0.00 3.57 -1.47 -1.79 116.94 113.97 2kua h PHE 96 Ca -0.03 0.04 0.18 0.00 3.53 0.00 0.00 57.97 61.69 2kua h PHE 96 Cb 0.76 0.65 -0.17 0.00 2.79 0.00 0.00 35.95 39.98 2kua h PHE 96 CO -0.24 -0.58 -0.26 0.00 -2.23 0.00 0.00 178.31 175.01 2kua n ALA 97 N -2.94 0.16 0.22 2.41 0.00 -1.07 0.22 120.51 119.51 2kua n ALA 97 Ca -0.08 1.00 0.06 0.00 0.00 0.00 0.00 53.44 54.42 2kua n ALA 97 Cb 0.40 -0.58 0.51 0.00 0.00 0.00 0.00 19.45 19.79 2kua n ALA 97 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2kua h GLY 98 N 0.00 0.00 2.00 0.00 0.00 -0.96 -2.11 103.07 102.00 2kua h GLY 98 Ca 0.42 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.65 2kua h GLY 98 CO -0.95 0.00 -0.50 0.00 0.00 0.00 0.00 176.54 175.09 2kua h THR 99 N 0.00 1.10 0.16 4.70 1.03 0.35 -3.17 112.91 117.08 2kua h THR 99 Ca -0.00 -1.91 -0.29 0.00 -0.01 0.00 0.00 66.41 64.20 2kua h THR 99 Cb 0.39 2.11 0.01 0.00 -1.07 0.00 0.00 68.15 69.59 2kua h THR 99 CO 0.03 0.49 -1.31 -0.07 -0.01 0.00 0.00 175.52 174.65 2kua h LEU 100 N 0.00 0.51 -5.29 0.00 3.38 -0.48 -3.43 115.31 110.00 2kua h LEU 100 Ca -0.01 -0.56 -0.32 0.00 0.09 0.00 0.00 57.88 57.09 2kua h LEU 100 Cb 1.07 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.59 2kua h LEU 100 CO 0.07 1.44 1.19 0.80 0.09 0.00 0.00 178.44 182.03 2kua n MET 101 N -3.57 0.00 -2.14 1.13 1.56 -0.86 -4.82 117.12 108.42 2kua n MET 101 Ca -0.11 0.00 -0.33 0.00 -0.27 0.00 0.00 57.70 56.99 2kua n MET 101 Cb 1.04 -0.94 0.01 0.00 2.15 0.00 0.00 33.22 35.48 2kua n MET 101 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 2kua s ASN 102 N 5.01 5.79 -0.34 6.12 4.22 -1.26 -4.86 114.94 129.62 2kua s ASN 102 Ca 0.90 1.93 0.01 0.00 -2.14 0.00 0.00 52.86 53.55 2kua s ASN 102 Cb -0.79 -2.55 0.14 0.00 1.28 0.00 0.00 41.25 39.33 2kua s ASN 102 CO 0.33 -1.17 0.28 -1.10 -2.04 0.00 0.00 177.10 173.41 2kua s GLN 103 N -3.76 0.50 -0.44 3.55 -1.52 -1.26 -4.44 119.66 112.29 2kua s GLN 103 Ca 0.66 -0.84 0.07 0.00 -1.95 0.00 0.00 55.36 53.30 2kua s GLN 103 Cb -0.18 -0.94 0.24 0.00 -0.22 0.00 0.00 33.01 31.91 2kua s GLN 103 CO 0.32 -1.15 0.69 0.41 -0.25 0.00 0.00 175.29 175.31 2kua n GLY 104 N 4.48 1.32 0.00 3.09 0.00 -1.26 -5.14 105.19 107.68 2kua n GLY 104 Ca 0.07 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2kua n GLY 104 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2kua n PRO 105 N 1.71 0.41 0.01 1.61 -0.04 -1.26 -5.03 135.00 132.42 2kua n PRO 105 Ca 0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2kua n PRO 105 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 2kua n PRO 105 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2kua n TYR 106 N -1.10 -0.09 -3.42 0.54 4.11 -1.26 -4.98 117.16 110.96 2kua n TYR 106 Ca 0.00 0.02 -0.26 0.00 -0.00 0.00 0.00 57.90 57.65 2kua n TYR 106 Cb 0.00 0.09 -0.09 0.00 -0.00 0.00 0.00 39.34 39.34 2kua n TYR 106 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.86 176.74 2kua n MET 107 N -2.71 1.38 -2.41 -3.48 0.00 -1.26 -5.06 117.12 103.59 2kua n MET 107 Ca 0.00 -3.89 -0.39 0.00 -0.00 0.00 0.00 57.70 53.42 2kua n MET 107 Cb 0.00 -1.81 -0.03 0.00 0.00 0.00 0.00 33.22 31.38 2kua n MET 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2kua s ALA 108 N -1.42 2.53 0.09 -5.12 0.00 -1.26 -4.39 121.76 112.19 2kua s ALA 108 Ca 0.34 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.87 2kua s ALA 108 Cb 0.10 -4.36 0.00 0.00 0.00 0.00 0.00 23.12 18.87 2kua s ALA 108 CO -0.11 -3.62 0.00 1.55 0.00 0.00 0.00 175.76 173.59 2kua n VAL 109 N 6.79 0.00 -3.26 0.00 3.14 -1.26 -5.00 118.33 118.73 2kua n VAL 109 Ca 0.16 0.00 -0.44 0.00 -2.96 0.00 0.00 64.34 61.10 2kua n VAL 109 Cb 0.50 -0.21 0.00 0.00 -1.06 0.00 0.00 33.84 33.07 2kua n VAL 109 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2kua n LYS 110 N -2.71 3.77 -4.22 1.45 5.02 -1.26 -5.00 118.16 115.21 2kua n LYS 110 Ca 0.00 -4.48 -0.13 0.00 -2.02 0.00 0.00 58.31 51.68 2kua n LYS 110 Cb 0.00 -2.54 -0.10 0.00 -0.02 0.00 0.00 35.03 32.37 2kua n LYS 110 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2kua s GLN 111 N -1.66 1.00 -0.37 1.97 -1.52 -1.26 -5.13 119.66 112.69 2kua s GLN 111 Ca 0.31 -1.44 0.01 0.00 -1.95 0.00 0.00 55.36 52.29 2kua s GLN 111 Cb -0.06 -0.38 0.12 0.00 -0.22 0.00 0.00 33.01 32.46 2kua s GLN 111 CO -0.03 -0.02 0.16 0.21 -0.25 0.00 0.00 175.29 175.36 2kua s LYS 112 N -3.83 0.94 -0.74 2.91 2.47 -1.26 -5.06 119.74 115.18 2kua s LYS 112 Ca 0.17 -1.49 -0.19 0.00 -1.56 0.00 0.00 55.97 52.90 2kua s LYS 112 Cb 0.05 -2.09 -0.18 0.00 -1.46 0.00 0.00 37.83 34.14 2kua s LYS 112 CO -0.00 -1.08 1.91 -2.13 0.16 0.00 0.00 175.35 174.21 2kua n ARG 113 N 4.24 0.00 0.05 4.03 0.63 -1.26 -4.61 116.66 119.74 2kua n ARG 113 Ca 0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 2kua n ARG 113 Cb 0.38 -1.03 0.00 0.00 0.45 0.00 0.00 32.46 32.27 2kua n ARG 113 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2kua n ASP 114 N 6.95 0.67 -0.00 6.15 -0.08 -1.26 -4.85 116.55 124.13 2kua n ASP 114 Ca 0.49 0.16 0.10 0.00 -1.51 0.00 0.00 54.79 54.03 2kua n ASP 114 Cb 0.04 -0.15 -0.13 0.00 2.34 0.00 0.00 41.12 43.22 2kua n ASP 114 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2kua n LEU 115 N -3.36 0.76 0.00 -2.67 -0.00 -1.26 -5.07 117.00 105.40 2kua n LEU 115 Ca 0.00 -0.38 0.00 0.00 -0.00 0.00 0.00 56.01 55.63 2kua n LEU 115 Cb 0.09 -0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.51 2kua n LEU 115 CO 0.00 0.19 0.00 0.61 -0.00 0.00 0.00 177.39 178.19 2kua n GLY 116 N 1.44 -0.77 0.05 1.47 0.00 -1.26 -4.92 105.19 101.20 2kua n GLY 116 Ca 0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 46.02 45.88 2kua n GLY 116 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2kua n ASN 117 N 0.00 2.65 -3.84 1.61 6.94 -1.26 -4.50 115.26 116.87 2kua n ASN 117 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 54.58 54.46 2kua n ASN 117 Cb 0.00 0.75 -0.05 0.00 -2.36 0.00 0.00 39.78 38.12 2kua n ASN 117 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 2kua s ARG 118 N -2.24 1.63 -0.04 -3.83 6.06 -1.26 -4.98 118.95 114.29 2kua s ARG 118 Ca -0.05 -1.34 -0.22 0.00 -2.50 0.00 0.00 55.73 51.62 2kua s ARG 118 Cb 0.03 0.47 -0.27 0.00 0.06 0.00 0.00 34.95 35.24 2kua s ARG 118 CO 0.39 -0.68 0.97 -0.39 -2.50 0.00 0.00 175.30 173.09 2kua h VAL 119 N 2.23 1.51 -0.14 7.11 -1.51 -1.98 -2.29 116.25 121.18 2kua h VAL 119 Ca -0.27 -2.30 -0.12 0.00 -1.23 0.00 0.00 66.70 62.79 2kua h VAL 119 Cb 1.25 2.96 -0.01 0.00 -2.13 0.00 0.00 31.29 33.36 2kua h VAL 119 CO 0.36 0.65 -0.43 0.16 -1.23 0.00 0.00 177.57 177.08 2kua h ILE 120 N -0.35 1.32 -0.06 7.19 -2.65 -1.95 0.18 117.51 121.19 2kua h ILE 120 Ca -0.10 -1.58 -0.05 0.00 1.03 0.00 0.00 64.86 64.17 2kua h ILE 120 Cb 1.41 1.68 0.00 0.00 -2.05 0.00 0.00 36.82 37.86 2kua h ILE 120 CO 0.12 0.48 -0.14 1.62 0.03 0.00 0.00 178.15 180.25 2kua h VAL 121 N 0.27 1.43 -0.24 0.16 3.04 -1.78 -2.09 116.25 117.03 2kua h VAL 121 Ca 0.02 -1.49 -0.07 0.00 -1.01 0.00 0.00 66.70 64.15 2kua h VAL 121 Cb 0.87 2.27 -0.01 0.00 -2.01 0.00 0.00 31.29 32.42 2kua h VAL 121 CO 0.07 0.41 -0.11 0.00 -1.01 0.00 0.00 177.57 176.94 2kua h THR 122 N -0.31 1.30 -0.19 3.17 1.03 -1.40 0.41 112.91 116.91 2kua h THR 122 Ca -0.00 -1.17 0.01 0.00 -0.01 0.00 0.00 66.41 65.24 2kua h THR 122 Cb 0.74 1.55 -0.02 0.00 -1.07 0.00 0.00 68.15 69.36 2kua h THR 122 CO 0.03 0.36 0.08 0.08 -0.01 0.00 0.00 175.52 176.07 2kua h ARG 123 N 0.23 0.18 0.00 0.00 0.11 -1.04 -1.83 114.38 112.02 2kua h ARG 123 Ca 0.06 -0.01 -0.10 0.00 0.10 0.00 0.00 59.98 60.02 2kua h ARG 123 Cb 0.60 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 31.63 2kua h ARG 123 CO 0.03 0.12 -0.48 0.22 0.10 0.00 0.00 179.97 179.96 2kua h ASP 124 N 0.19 0.00 -0.12 0.08 3.58 -1.38 -2.89 116.42 115.88 2kua h ASP 124 Ca 0.08 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 2kua h ASP 124 Cb 0.03 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 2kua h ASP 124 CO -0.06 0.48 0.06 0.00 -2.88 0.00 0.00 179.24 176.83 2kua h LEU 127 N 0.57 0.13 -0.20 0.00 4.07 -1.36 0.42 115.31 118.94 2kua h LEU 127 Ca 0.04 -0.35 -0.02 0.00 0.08 0.00 0.00 57.88 57.63 2kua h LEU 127 Cb 1.00 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 42.69 2kua h LEU 127 CO 0.09 0.45 0.05 -0.29 -1.08 0.00 0.00 178.44 177.66 2kua h ILE 128 N -0.19 1.21 -0.09 1.22 2.10 -0.40 -2.87 117.51 118.48 2kua h ILE 128 Ca 0.02 -0.67 -0.11 0.00 1.08 0.00 0.00 64.86 65.18 2kua h ILE 128 Cb 0.39 1.26 -0.01 0.00 -1.09 0.00 0.00 36.82 37.37 2kua h ILE 128 CO 0.01 0.21 -0.42 1.62 -1.08 0.00 0.00 178.15 178.48 2kua h VAL 129 N 0.15 1.31 -0.38 2.19 3.04 -1.19 -3.00 116.25 118.37 2kua h VAL 129 Ca 0.06 -1.54 0.04 0.00 -1.01 0.00 0.00 66.70 64.26 2kua h VAL 129 Cb 0.27 1.72 -0.04 0.00 -2.01 0.00 0.00 31.29 31.24 2kua h VAL 129 CO 0.00 0.46 0.15 -1.13 -1.01 0.00 0.00 177.57 176.03 2kua h ASN 130 N 0.16 0.17 0.47 3.17 -0.73 0.04 0.62 115.58 119.49 2kua h ASN 130 Ca 0.01 0.04 -0.02 0.00 1.87 0.00 0.00 56.30 58.20 2kua h ASN 130 Cb 0.82 0.01 0.00 0.00 0.27 0.00 0.00 38.32 39.43 2kua h ASN 130 CO 0.06 0.14 -0.23 0.15 -0.37 0.00 0.00 177.43 177.18 2kua h PHE 131 N 0.31 -0.59 0.38 0.67 3.57 -1.44 -2.52 116.94 117.32 2kua h PHE 131 Ca 0.17 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 2kua h PHE 131 Cb 0.14 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 2kua h PHE 131 CO -0.14 -0.29 -0.27 -0.07 -2.23 0.00 0.00 178.31 175.32 2kua h LEU 132 N -0.82 -0.70 -0.81 0.59 4.07 -1.39 0.22 115.31 116.47 2kua h LEU 132 Ca -0.06 0.05 0.14 0.00 0.08 0.00 0.00 57.88 58.09 2kua h LEU 132 Cb 0.57 0.22 -0.15 0.00 1.08 0.00 0.00 40.66 42.38 2kua h LEU 132 CO 0.11 -0.42 -0.31 0.22 -1.08 0.00 0.00 178.44 176.96 2kua h TYR 133 N -0.64 -0.83 0.00 1.13 5.03 0.21 0.91 116.97 122.77 2kua h TYR 133 Ca -0.03 0.09 -0.07 0.00 2.58 0.00 0.00 58.73 61.29 2kua h TYR 133 Cb 0.55 0.48 -0.01 0.00 1.55 0.00 0.00 36.73 39.30 2kua h TYR 133 CO -0.12 -0.38 -0.32 -0.91 -1.32 0.00 0.00 178.16 175.10 2kua h ASN 134 N -0.06 0.00 -0.80 -2.11 2.35 -1.23 0.50 115.58 114.23 2kua h ASN 134 Ca 0.33 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 56.14 2kua h ASN 134 Cb 0.59 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.90 2kua h ASN 134 CO -0.85 0.32 0.48 0.25 -1.65 0.00 0.00 177.43 175.97 2kua h LEU 135 N 0.00 0.73 0.00 1.61 7.12 0.30 -2.66 115.31 122.41 2kua h LEU 135 Ca -0.00 0.02 -0.10 0.00 0.13 0.00 0.00 57.88 57.93 2kua h LEU 135 Cb 0.67 -0.12 -0.02 0.00 -0.53 0.00 0.00 40.66 40.65 2kua h LEU 135 CO 0.04 0.46 -2.03 0.00 -0.13 0.00 0.00 178.44 176.78 2kua n LEU 136 N -4.69 0.00 -0.85 2.25 -0.00 -0.88 -4.29 117.00 108.55 2kua n LEU 136 Ca 0.11 0.00 -0.00 0.00 -0.00 0.00 0.00 56.01 56.12 2kua n LEU 136 Cb 0.19 0.14 0.04 0.00 -0.00 0.00 0.00 43.42 43.79 2kua n LEU 136 CO 0.30 0.14 0.43 0.23 -0.00 0.00 0.00 177.39 178.48 2kua n MET 137 N -2.35 1.39 -2.37 1.47 2.81 0.17 0.07 117.12 118.32 2kua n MET 137 Ca -0.12 -0.41 -0.25 0.00 -1.81 0.00 0.00 57.70 55.12 2kua n MET 137 Cb 0.70 -1.45 0.09 0.00 -0.71 0.00 0.00 33.22 31.85 2kua n MET 137 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2kua s GLY 138 N 0.18 1.75 0.07 3.03 0.00 -1.02 -4.73 107.32 106.60 2kua s GLY 138 Ca 0.07 -1.26 -0.28 0.00 0.00 0.00 0.00 44.72 43.25 2kua s GLY 138 CO 0.02 -0.80 1.65 3.21 0.00 0.00 0.00 173.10 177.18 2kua h ARG 139 N -0.56 -0.47 0.16 2.90 3.08 -1.91 0.51 114.38 118.09 2kua h ARG 139 Ca -0.42 0.03 -0.30 0.00 0.07 0.00 0.00 59.98 59.36 2kua h ARG 139 Cb 1.29 0.11 0.03 0.00 0.08 0.00 0.00 29.97 31.47 2kua h ARG 139 CO 0.50 -0.29 -1.30 0.07 -1.07 0.00 0.00 179.97 177.88 2kua h ARG 140 N -0.51 0.53 0.59 0.04 0.11 -1.94 -2.09 114.38 111.11 2kua h ARG 140 Ca -0.05 -0.78 -0.03 0.00 0.10 0.00 0.00 59.98 59.22 2kua h ARG 140 Cb 0.39 0.27 0.01 0.00 1.11 0.00 0.00 29.97 31.75 2kua h ARG 140 CO 0.08 1.36 -0.28 0.45 0.10 0.00 0.00 179.97 181.68 2kua h HIS 141 N 0.21 -0.73 -0.12 4.08 3.86 -1.79 -1.97 115.15 118.69 2kua h HIS 141 Ca -0.19 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.00 2kua h HIS 141 Cb 1.98 0.24 -0.01 0.00 1.06 0.00 0.00 27.41 30.69 2kua h HIS 141 CO 0.11 -0.40 0.06 -0.09 0.86 0.00 0.00 177.93 178.47 2kua h ARG 142 N -1.01 0.16 -0.83 2.45 1.12 0.40 0.25 114.38 116.93 2kua h ARG 142 Ca -0.08 -0.02 0.18 0.00 -1.11 0.00 0.00 59.98 58.95 2kua h ARG 142 Cb 0.66 -0.03 -0.11 0.00 -0.01 0.00 0.00 29.97 30.48 2kua h ARG 142 CO 0.13 0.20 0.34 0.00 -3.11 0.00 0.00 179.97 177.53 2kua h ALA 143 N 0.95 1.23 0.01 2.80 0.00 -1.42 -1.60 119.26 121.23 2kua h ALA 143 Ca 0.04 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2kua h ALA 143 Cb 0.09 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2kua h ALA 143 CO -0.01 -0.26 -0.20 -0.09 0.00 0.00 0.00 179.25 178.69 2kua h ARG 144 N 0.43 0.12 -0.90 0.00 9.65 -1.08 -1.99 114.38 120.60 2kua h ARG 144 Ca 0.48 -0.14 0.23 0.00 -1.10 0.00 0.00 59.98 59.45 2kua h ARG 144 Cb 0.82 0.04 -0.16 0.00 -1.39 0.00 0.00 29.97 29.28 2kua h ARG 144 CO -0.47 0.93 0.05 1.25 2.80 0.00 0.00 179.97 184.53 2kua h LEU 145 N -0.62 -0.37 0.00 3.80 7.12 0.15 0.53 115.31 125.92 2kua h LEU 145 Ca -0.03 0.24 -0.22 0.00 0.13 0.00 0.00 57.88 58.01 2kua h LEU 145 Cb 1.00 0.41 -0.03 0.00 -0.53 0.00 0.00 40.66 41.51 2kua h LEU 145 CO 0.04 -0.27 -1.06 1.05 -0.13 0.00 0.00 178.44 178.07 2kua h GLU 146 N 0.07 0.01 0.00 1.25 4.11 -1.40 -0.79 114.58 117.82 2kua h GLU 146 Ca 0.54 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.95 2kua h GLU 146 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2kua h GLU 146 CO -0.80 0.96 0.00 0.00 0.07 0.00 0.00 179.01 179.24 2kua n ALA 147 N -2.37 1.17 -1.10 1.06 0.00 0.17 -0.91 120.51 118.54 2kua n ALA 147 Ca -0.02 0.17 0.04 0.00 0.00 0.00 0.00 53.44 53.63 2kua n ALA 147 Cb 0.95 -1.32 0.25 0.00 0.00 0.00 0.00 19.45 19.33 2kua n ALA 147 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2kua n LEU 148 N -2.23 4.25 0.00 0.00 -0.00 -0.51 -4.89 117.00 113.61 2kua n LEU 148 Ca -0.01 -3.21 0.00 0.00 -0.00 0.00 0.00 56.01 52.80 2kua n LEU 148 Cb 0.07 -0.59 0.00 0.00 -0.00 0.00 0.00 43.42 42.90 2kua n LEU 148 CO 0.11 0.81 0.00 0.61 -0.00 0.00 0.00 177.39 178.93 2kua n GLY 149 N -0.59 0.35 3.66 1.47 0.00 -0.09 -4.61 105.19 105.38 2kua n GLY 149 Ca 0.27 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.36 2kua n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kua n GLY 150 N -1.64 -1.04 0.53 -0.02 0.00 -0.30 -0.88 105.19 101.84 2kua n GLY 150 Ca 0.00 -0.76 0.31 0.00 0.00 0.00 0.00 46.02 45.56 2kua n GLY 150 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2kua n TRP 151 N -2.41 0.00 -0.04 1.61 7.02 -1.26 0.16 117.44 122.51 2kua n TRP 151 Ca 0.00 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.36 2kua n TRP 151 Cb 0.27 -0.28 -0.07 0.00 -2.42 0.00 0.00 31.31 28.80 2kua n TRP 151 CO 0.00 0.00 0.00 0.22 -2.02 0.00 0.00 177.69 175.89 2kua h ASP 152 N 0.00 0.22 0.37 -0.99 3.58 -1.88 -2.90 116.42 114.82 2kua h ASP 152 Ca 0.54 -0.35 -0.03 0.00 0.42 0.00 0.00 57.03 57.61 2kua h ASP 152 Cb 2.92 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 43.90 2kua h ASP 152 CO -0.01 0.51 -0.14 1.23 -2.88 0.00 0.00 179.24 177.96 2kua h GLY 153 N -0.08 0.00 0.65 -0.78 0.00 0.34 -2.98 103.07 100.22 2kua h GLY 153 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 2kua h GLY 153 CO 0.01 0.00 -0.24 -2.75 0.00 0.00 0.00 176.54 173.56 2kua h PHE 154 N 0.00 -0.62 -0.99 5.60 3.57 -1.34 0.38 116.94 123.55 2kua h PHE 154 Ca -0.00 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 61.67 2kua h PHE 154 Cb 0.36 0.20 -0.10 0.00 2.79 0.00 0.00 35.95 39.21 2kua h PHE 154 CO 0.00 -0.30 0.61 0.00 -2.23 0.00 0.00 178.31 176.40 2kua h ARG 156 N 0.75 0.00 -0.22 0.00 1.12 -1.49 0.99 114.38 115.53 2kua h ARG 156 Ca 0.55 0.00 -0.10 0.00 -1.11 0.00 0.00 59.98 59.33 2kua h ARG 156 Cb 0.89 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.84 2kua h ARG 156 CO -0.34 0.66 -0.24 0.35 -3.11 0.00 0.00 179.97 177.29 2kua h PHE 157 N 0.00 0.66 -0.00 2.20 3.04 0.28 -3.16 116.94 119.96 2kua h PHE 157 Ca -0.01 -0.21 0.00 0.00 3.98 0.00 0.00 57.97 61.74 2kua h PHE 157 Cb 1.50 -0.14 0.00 0.00 2.56 0.00 0.00 35.95 39.87 2kua h PHE 157 CO 0.00 0.90 -0.57 1.19 -2.02 0.00 0.00 178.31 177.81 2kua n PHE 158 N -4.38 0.00 -2.46 0.41 3.01 -0.00 -5.01 117.46 109.02 2kua n PHE 158 Ca -0.05 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.36 2kua n PHE 158 Cb 0.43 -0.17 0.01 0.00 -0.01 0.00 0.00 39.48 39.74 2kua n PHE 158 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2kua n LYS 159 N -1.34 -1.79 -1.57 -1.08 4.01 -0.12 -4.90 118.16 111.37 2kua n LYS 159 Ca 0.06 1.72 -0.45 0.00 -0.51 0.00 0.00 58.31 59.13 2kua n LYS 159 Cb 0.34 -4.46 -0.02 0.00 -0.51 0.00 0.00 35.03 30.38 2kua n LYS 159 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2kua n ASN 160 N -0.27 1.01 -0.10 4.39 5.15 0.16 -4.89 115.26 120.71 2kua n ASN 160 Ca 0.08 1.17 -0.12 0.00 -0.60 0.00 0.00 54.58 55.11 2kua n ASN 160 Cb 0.30 -1.25 0.01 0.00 -0.53 0.00 0.00 39.78 38.30 2kua n ASN 160 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2kua h PRO 161 N 1.86 0.87 -6.18 1.20 0.13 -1.90 -3.45 132.00 124.52 2kua h PRO 161 Ca -0.38 -0.45 -0.49 0.00 -0.87 0.00 0.00 66.00 63.80 2kua h PRO 161 Cb 1.35 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.46 2kua h PRO 161 CO 0.60 1.09 -0.48 -0.51 -0.23 0.00 0.00 178.00 178.47 2kua s LEU 162 N -8.81 4.08 0.00 1.56 1.02 -1.26 -5.10 118.68 110.17 2kua s LEU 162 Ca -0.10 -0.07 0.00 0.00 0.02 0.00 0.00 54.13 53.98 2kua s LEU 162 Cb 0.11 -2.62 0.00 0.00 0.02 0.00 0.00 46.19 43.70 2kua s LEU 162 CO 0.87 -0.04 0.00 -0.81 0.02 0.00 0.00 176.35 176.39 2kua n PRO 163 N -1.16 0.00 -3.53 1.29 -0.04 -1.26 -5.01 135.00 125.28 2kua n PRO 163 Ca -0.08 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.15 2kua n PRO 163 Cb 0.57 -0.25 0.00 0.00 -0.04 0.00 0.00 33.50 33.79 2kua n PRO 163 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2kua n LEU 164 N 0.00 0.00 0.00 1.53 4.32 -1.26 -4.99 117.00 116.60 2kua n LEU 164 Ca 0.00 -2.51 0.00 0.00 -0.02 0.00 0.00 56.01 53.48 2kua n LEU 164 Cb 0.00 -0.04 0.00 0.00 -1.62 0.00 0.00 43.42 41.76 2kua n LEU 164 CO 0.00 -0.55 0.00 0.61 -1.22 0.00 0.00 177.39 176.23