#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q94 s ILE 3 N 0.00 5.33 0.12 0.00 -1.09 -1.26 -4.85 121.20 119.44 2q94 s ILE 3 Ca 0.00 0.47 -0.30 0.00 -2.23 0.00 0.00 60.65 58.59 2q94 s ILE 3 Cb 0.00 -3.60 -0.07 0.00 -1.58 0.00 0.00 42.46 37.22 2q94 s ILE 3 CO 0.00 0.40 1.23 -0.94 -1.23 0.00 0.00 174.94 174.40 2q94 s SER 4 N 0.41 7.04 -0.45 3.58 1.04 -1.26 -4.99 113.70 119.07 2q94 s SER 4 Ca 0.15 2.14 -0.15 0.00 0.48 0.00 0.00 55.95 58.57 2q94 s SER 4 Cb -0.13 -2.59 0.06 0.00 0.10 0.00 0.00 66.02 63.46 2q94 s SER 4 CO 0.03 -0.46 0.36 -0.63 0.98 0.00 0.00 173.24 173.52 2q94 s ILE 5 N 0.64 5.18 0.38 -1.02 -1.09 -1.26 -4.47 121.20 119.57 2q94 s ILE 5 Ca 0.57 -0.98 -0.27 0.00 -2.23 0.00 0.00 60.65 57.74 2q94 s ILE 5 Cb -0.32 -4.05 -0.10 0.00 -1.58 0.00 0.00 42.46 36.42 2q94 s ILE 5 CO 0.32 -0.51 1.40 -0.54 -1.23 0.00 0.00 174.94 174.39 2q94 s LYS 6 N 1.64 4.06 0.58 2.79 3.01 -0.68 -4.98 119.74 126.16 2q94 s LYS 6 Ca 0.04 2.39 -0.09 0.00 -1.01 0.00 0.00 55.97 57.30 2q94 s LYS 6 Cb -0.23 -2.90 -0.03 0.00 -1.01 0.00 0.00 37.83 33.66 2q94 s LYS 6 CO 0.07 -0.50 0.95 0.95 0.51 0.00 0.00 175.35 177.33 2q94 s THR 7 N -1.16 4.67 0.33 2.17 -4.23 -1.26 -4.78 115.64 111.37 2q94 s THR 7 Ca 0.54 0.61 0.10 0.00 -1.18 0.00 0.00 61.69 61.76 2q94 s THR 7 Cb -0.43 -3.83 0.33 0.00 1.34 0.00 0.00 72.50 69.90 2q94 s THR 7 CO 0.57 -1.00 1.77 -0.65 -0.54 0.00 0.00 174.62 174.77 2q94 h PRO 8 N -0.16 0.61 -0.33 3.99 0.11 -1.99 0.21 132.00 134.44 2q94 h PRO 8 Ca -0.45 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 2q94 h PRO 8 Cb 1.20 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2q94 h PRO 8 CO 0.62 0.40 -0.03 0.93 -0.21 0.00 0.00 178.00 179.70 2q94 h GLU 9 N 0.62 0.61 -0.46 1.05 3.07 -2.00 -1.95 114.58 115.54 2q94 h GLU 9 Ca 0.59 -0.21 -0.02 0.00 -0.50 0.00 0.00 59.36 59.21 2q94 h GLU 9 Cb 1.11 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.96 2q94 h GLU 9 CO -0.37 0.76 0.20 -0.44 -1.40 0.00 0.00 179.01 177.75 2q94 h ASP 10 N 0.41 0.62 -0.91 1.42 3.32 -1.29 -2.26 116.42 117.72 2q94 h ASP 10 Ca 0.09 -0.15 0.03 0.00 0.02 0.00 0.00 57.03 57.02 2q94 h ASP 10 Cb 0.51 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.85 2q94 h ASP 10 CO 0.02 0.60 0.60 0.40 -1.72 0.00 0.00 179.24 179.14 2q94 h ILE 11 N 0.59 1.17 -0.36 0.35 2.04 -0.60 -0.05 117.51 120.66 2q94 h ILE 11 Ca 0.15 -0.40 -0.08 0.00 1.00 0.00 0.00 64.86 65.53 2q94 h ILE 11 Cb 0.16 -0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.14 2q94 h ILE 11 CO -0.02 0.21 -0.12 -0.08 0.00 0.00 0.00 178.15 178.14 2q94 h GLU 12 N 1.16 0.64 -0.06 2.37 4.57 -1.03 0.06 114.58 122.30 2q94 h GLU 12 Ca 0.35 -0.20 -0.11 0.00 -1.18 0.00 0.00 59.36 58.22 2q94 h GLU 12 Cb -0.02 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 2q94 h GLU 12 CO -0.10 0.75 -0.46 0.87 -1.18 0.00 0.00 179.01 178.88 2q94 h LYS 13 N 0.59 0.14 -0.12 1.92 1.57 -0.67 -2.45 116.57 117.55 2q94 h LYS 13 Ca 0.10 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.68 2q94 h LYS 13 Cb 0.55 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 2q94 h LYS 13 CO 0.03 0.58 -0.52 0.52 -0.57 0.00 0.00 179.45 179.50 2q94 h MET 14 N 0.11 0.32 -0.62 3.15 2.86 -0.18 -1.78 114.93 118.80 2q94 h MET 14 Ca 0.01 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.41 2q94 h MET 14 Cb 0.87 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.52 2q94 h MET 14 CO 0.07 0.76 0.22 0.00 1.06 0.00 0.00 176.91 179.02 2q94 h ARG 15 N 0.25 0.95 -0.13 1.72 3.08 -0.57 0.30 114.38 119.97 2q94 h ARG 15 Ca 0.01 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.85 2q94 h ARG 15 Cb 1.00 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.90 2q94 h ARG 15 CO 0.08 0.82 0.02 0.28 -1.07 0.00 0.00 179.97 180.11 2q94 h VAL 16 N 0.87 1.22 -0.69 2.04 2.07 -1.27 -0.49 116.25 120.01 2q94 h VAL 16 Ca 0.20 -0.71 -0.06 0.00 0.82 0.00 0.00 66.70 66.96 2q94 h VAL 16 Cb 0.25 1.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 2q94 h VAL 16 CO -0.01 0.21 0.21 0.00 0.02 0.00 0.00 177.57 177.99 2q94 h ALA 17 N 0.80 0.91 -0.55 1.67 0.00 -1.15 -1.72 119.26 119.21 2q94 h ALA 17 Ca 0.04 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2q94 h ALA 17 Cb 0.30 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2q94 h ALA 17 CO 0.00 0.59 0.19 0.78 0.00 0.00 0.00 179.25 180.81 2q94 h GLY 18 N 1.02 0.91 1.00 0.00 0.00 -0.31 -1.66 103.07 104.03 2q94 h GLY 18 Ca 0.22 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 2q94 h GLY 18 CO -0.00 0.50 0.28 -0.09 0.00 0.00 0.00 176.54 177.23 2q94 h ARG 19 N 0.77 0.90 -0.54 4.80 2.43 -0.87 -1.66 114.38 120.20 2q94 h ARG 19 Ca 0.18 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 2q94 h ARG 19 Cb 0.26 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 2q94 h ARG 19 CO -0.01 0.73 0.27 -0.07 -1.51 0.00 0.00 179.97 179.38 2q94 h LEU 20 N 0.85 0.70 -0.24 3.80 3.38 -1.09 0.12 115.31 122.83 2q94 h LEU 20 Ca 0.21 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.07 2q94 h LEU 20 Cb 0.14 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2q94 h LEU 20 CO -0.02 0.62 0.13 0.00 0.09 0.00 0.00 178.44 179.26 2q94 h ALA 21 N 1.11 0.29 -0.84 1.53 0.00 -1.04 -2.09 119.26 118.21 2q94 h ALA 21 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.13 2q94 h ALA 21 Cb 0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 2q94 h ALA 21 CO -0.03 -0.27 0.54 0.00 0.00 0.00 0.00 179.25 179.49 2q94 h ALA 22 N 1.11 1.10 0.00 0.00 0.00 -1.03 -2.08 119.26 118.37 2q94 h ALA 22 Ca 0.09 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2q94 h ALA 22 Cb 0.01 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2q94 h ALA 22 CO -0.06 0.39 -0.09 0.93 0.00 0.00 0.00 179.25 180.42 2q94 h GLU 23 N 1.06 0.00 -0.36 0.00 5.08 -0.42 -1.64 114.58 118.30 2q94 h GLU 23 Ca 0.33 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.58 2q94 h GLU 23 Cb -0.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2q94 h GLU 23 CO -0.11 0.09 -0.20 0.28 -1.00 0.00 0.00 179.01 178.07 2q94 h VAL 24 N 0.00 1.29 -0.60 3.13 2.07 -0.72 -0.66 116.25 120.75 2q94 h VAL 24 Ca -0.00 -1.33 -0.10 0.00 0.82 0.00 0.00 66.70 66.09 2q94 h VAL 24 Cb 0.37 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 2q94 h VAL 24 CO 0.01 0.44 0.00 -0.07 0.02 0.00 0.00 177.57 177.97 2q94 h LEU 25 N 0.55 1.05 -0.87 2.57 3.38 -1.31 -1.24 115.31 119.43 2q94 h LEU 25 Ca 0.08 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 2q94 h LEU 25 Cb 0.75 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2q94 h LEU 25 CO 0.06 1.10 0.02 -0.33 0.09 0.00 0.00 178.44 179.38 2q94 h GLU 26 N 0.97 0.86 -0.43 1.13 5.08 -1.22 -2.88 114.58 118.09 2q94 h GLU 26 Ca 0.17 -0.23 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 2q94 h GLU 26 Cb 0.56 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2q94 h GLU 26 CO 0.03 0.84 -0.11 1.98 -1.00 0.00 0.00 179.01 180.75 2q94 h MET 27 N 0.80 0.84 0.00 2.33 4.05 -0.81 -3.24 114.93 118.89 2q94 h MET 27 Ca 0.16 -0.32 -0.00 0.00 -0.28 0.00 0.00 59.70 59.25 2q94 h MET 27 Cb 0.45 -0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.20 2q94 h MET 27 CO 0.02 0.95 -0.01 0.97 0.23 0.00 0.00 176.91 179.07 2q94 h ILE 28 N 0.66 0.02 -0.92 1.77 6.09 -1.17 -3.38 117.51 120.59 2q94 h ILE 28 Ca 0.11 -0.83 0.14 0.00 -1.37 0.00 0.00 64.86 62.91 2q94 h ILE 28 Cb 0.65 1.81 -0.15 0.00 0.47 0.00 0.00 36.82 39.60 2q94 h ILE 28 CO 0.04 0.01 -0.36 1.21 -3.07 0.00 0.00 178.15 175.99 2q94 n GLU 29 N -3.10 -0.22 0.27 2.19 4.07 -1.09 -0.58 120.64 122.17 2q94 n GLU 29 Ca 0.03 1.42 0.12 0.00 -0.06 0.00 0.00 57.16 58.66 2q94 n GLU 29 Cb 0.44 -2.10 0.76 0.00 -0.06 0.00 0.00 31.44 30.47 2q94 n GLU 29 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 2q94 h PRO 30 N 0.00 0.00 0.00 5.31 0.11 -1.82 -2.50 132.00 133.10 2q94 h PRO 30 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 2q94 h PRO 30 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 2q94 h PRO 30 CO -0.91 0.08 -0.03 1.88 -0.21 0.00 0.00 178.00 178.81 2q94 h TYR 31 N 0.00 0.00 -0.98 0.65 -1.99 -1.11 -3.41 116.97 110.13 2q94 h TYR 31 Ca -0.00 0.00 -0.64 0.00 2.00 0.00 0.00 58.73 60.09 2q94 h TYR 31 Cb 0.21 0.00 -0.09 0.00 2.00 0.00 0.00 36.73 38.85 2q94 h TYR 31 CO 0.00 0.00 1.85 0.08 -0.00 0.00 0.00 178.16 180.09 2q94 s VAL 32 N -3.17 4.02 0.17 -2.88 1.01 -0.94 -4.84 120.40 113.77 2q94 s VAL 32 Ca 0.08 -1.34 -0.03 0.00 0.00 0.00 0.00 61.98 60.69 2q94 s VAL 32 Cb 0.08 -5.12 -0.03 0.00 0.00 0.00 0.00 36.38 31.31 2q94 s VAL 32 CO 0.64 -1.98 0.15 -1.59 0.00 0.00 0.00 175.10 172.33 2q94 s LYS 33 N 4.62 1.12 0.24 2.72 -2.85 -1.26 -4.83 119.74 119.50 2q94 s LYS 33 Ca 0.50 -1.47 -0.31 0.00 -1.00 0.00 0.00 55.97 53.69 2q94 s LYS 33 Cb 0.02 0.29 -0.13 0.00 -2.06 0.00 0.00 37.83 35.95 2q94 s LYS 33 CO -0.01 -0.37 1.47 -2.30 0.10 0.00 0.00 175.35 174.24 2q94 n PRO 34 N -0.21 2.20 0.00 1.78 -0.02 -1.26 -2.70 135.00 134.79 2q94 n PRO 34 Ca -0.02 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 2q94 n PRO 34 Cb 0.64 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 2q94 n PRO 34 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q94 n GLY 35 N 2.33 2.71 3.78 -1.23 0.00 -0.42 -4.99 105.19 107.37 2q94 n GLY 35 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 2q94 n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q94 s VAL 36 N -2.74 3.64 0.26 1.61 0.11 -1.10 -4.70 120.40 117.49 2q94 s VAL 36 Ca 0.00 1.29 -0.08 0.00 -2.93 0.00 0.00 61.98 60.27 2q94 s VAL 36 Cb 0.00 -3.69 -0.06 0.00 -1.53 0.00 0.00 36.38 31.10 2q94 s VAL 36 CO 0.00 0.04 0.56 -0.94 -3.33 0.00 0.00 175.10 171.44 2q94 s SER 37 N -1.47 6.54 0.43 3.54 1.04 -1.26 -1.08 113.70 121.45 2q94 s SER 37 Ca 0.57 0.85 0.21 0.00 0.48 0.00 0.00 55.95 58.05 2q94 s SER 37 Cb -0.24 -2.20 0.96 0.00 0.10 0.00 0.00 66.02 64.65 2q94 s SER 37 CO 0.30 -0.14 1.87 0.71 0.98 0.00 0.00 173.24 176.96 2q94 h THR 38 N 1.68 0.80 -0.43 2.02 1.35 -1.21 -2.75 112.91 114.37 2q94 h THR 38 Ca -0.47 -1.10 -0.04 0.00 -0.55 0.00 0.00 66.41 64.25 2q94 h THR 38 Cb 1.18 1.68 -0.02 0.00 -1.73 0.00 0.00 68.15 69.26 2q94 h THR 38 CO 0.68 0.27 0.12 1.23 -0.25 0.00 0.00 175.52 177.57 2q94 h GLY 39 N 1.51 0.73 1.10 5.82 0.00 -1.50 -1.94 103.07 108.80 2q94 h GLY 39 Ca -0.00 -0.44 -0.12 0.00 0.00 0.00 0.00 47.33 46.77 2q94 h GLY 39 CO 0.04 0.41 -0.13 -2.09 0.00 0.00 0.00 176.54 174.77 2q94 h GLU 40 N 0.56 1.03 -0.99 4.80 4.81 -1.78 -2.43 114.58 120.58 2q94 h GLU 40 Ca 0.14 -0.39 0.08 0.00 -0.13 0.00 0.00 59.36 59.06 2q94 h GLU 40 Cb 0.28 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.53 2q94 h GLU 40 CO -0.00 1.08 0.64 -0.07 -0.73 0.00 0.00 179.01 179.93 2q94 h LEU 41 N 0.91 0.98 -0.43 1.64 3.38 -1.30 -0.45 115.31 120.03 2q94 h LEU 41 Ca 0.14 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 2q94 h LEU 41 Cb 0.70 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2q94 h LEU 41 CO 0.05 0.59 0.11 -0.78 0.09 0.00 0.00 178.44 178.51 2q94 h ASP 42 N 1.09 0.65 -0.52 -0.43 3.58 -1.00 -1.71 116.42 118.09 2q94 h ASP 42 Ca 0.45 -0.23 -0.07 0.00 0.42 0.00 0.00 57.03 57.60 2q94 h ASP 42 Cb 0.28 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.14 2q94 h ASP 42 CO -0.20 0.70 0.06 0.03 -2.88 0.00 0.00 179.24 176.95 2q94 h ARG 43 N 0.56 0.93 -0.63 0.28 3.08 -0.87 -0.31 114.38 117.41 2q94 h ARG 43 Ca 0.14 -0.24 -0.06 0.00 0.07 0.00 0.00 59.98 59.89 2q94 h ARG 43 Cb 0.30 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 2q94 h ARG 43 CO 0.00 0.88 0.17 0.82 -1.07 0.00 0.00 179.97 180.77 2q94 h ILE 44 N 0.87 1.25 -0.32 2.04 2.04 -0.96 -0.75 117.51 121.68 2q94 h ILE 44 Ca 0.17 -0.90 -0.05 0.00 1.00 0.00 0.00 64.86 65.08 2q94 h ILE 44 Cb 0.43 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 2q94 h ILE 44 CO 0.01 0.34 -0.00 0.00 0.00 0.00 0.00 178.15 178.50 2q94 h ASN 46 N 0.38 0.60 -0.96 0.00 -0.73 -0.89 -0.99 115.58 113.00 2q94 h ASN 46 Ca 0.09 -0.24 0.02 0.00 1.87 0.00 0.00 56.30 58.04 2q94 h ASN 46 Cb 0.45 -0.16 -0.05 0.00 0.27 0.00 0.00 38.32 38.83 2q94 h ASN 46 CO 0.02 0.69 0.63 0.44 -0.37 0.00 0.00 177.43 178.84 2q94 h ASP 47 N 0.49 1.07 -0.28 1.15 3.32 -1.13 -0.58 116.42 120.45 2q94 h ASP 47 Ca 0.12 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.11 2q94 h ASP 47 Cb 0.33 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 2q94 h ASP 47 CO 0.00 0.75 0.03 0.22 -1.72 0.00 0.00 179.24 178.53 2q94 h TYR 48 N 1.25 0.52 -0.29 4.55 3.20 -1.14 0.89 116.97 125.95 2q94 h TYR 48 Ca 0.36 -0.08 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 2q94 h TYR 48 Cb -0.07 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.04 2q94 h TYR 48 CO -0.00 0.60 0.12 0.82 -1.64 0.00 0.00 178.16 178.06 2q94 h ILE 49 N 0.29 1.17 0.13 1.81 2.04 -0.72 -1.03 117.51 121.20 2q94 h ILE 49 Ca 0.08 -0.50 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 2q94 h ILE 49 Cb 0.38 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2q94 h ILE 49 CO 0.01 0.18 -0.06 0.58 0.00 0.00 0.00 178.15 178.85 2q94 h VAL 50 N 0.32 0.94 0.08 1.67 2.07 -1.10 -0.69 116.25 119.55 2q94 h VAL 50 Ca 0.10 -1.23 -0.25 0.00 0.82 0.00 0.00 66.70 66.13 2q94 h VAL 50 Cb 0.16 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2q94 h VAL 50 CO -0.01 0.25 -1.20 0.78 0.02 0.00 0.00 177.57 177.42 2q94 h ASN 51 N -0.85 0.26 0.00 0.57 2.35 -0.92 -3.07 115.58 113.93 2q94 h ASN 51 Ca -0.02 -0.29 -0.42 0.00 -0.55 0.00 0.00 56.30 55.03 2q94 h ASN 51 Cb 0.55 -0.08 -0.07 0.00 0.05 0.00 0.00 38.32 38.77 2q94 h ASN 51 CO 0.03 1.23 -2.46 -0.62 -1.65 0.00 0.00 177.43 173.95 2q94 n GLU 52 N -3.44 0.63 0.09 0.81 -0.58 -0.49 -4.52 120.64 113.13 2q94 n GLU 52 Ca -0.06 0.21 0.12 0.00 -0.42 0.00 0.00 57.16 57.01 2q94 n GLU 52 Cb 1.00 -1.52 0.20 0.00 -0.57 0.00 0.00 31.44 30.55 2q94 n GLU 52 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 2q94 h GLN 53 N -0.42 0.00 -6.04 3.49 4.20 -1.23 -3.48 115.11 111.63 2q94 h GLN 53 Ca -0.62 0.00 -0.41 0.00 0.06 0.00 0.00 58.65 57.68 2q94 h GLN 53 Cb 1.78 0.00 0.06 0.00 0.30 0.00 0.00 27.48 29.62 2q94 h GLN 53 CO -0.22 0.00 -0.80 0.72 -0.67 0.00 0.00 178.83 177.86 2q94 n HIS 54 N -2.29 -2.10 -3.84 2.96 8.25 -0.78 -4.98 115.22 112.44 2q94 n HIS 54 Ca 0.03 0.88 0.00 0.00 -0.26 0.00 0.00 57.72 58.38 2q94 n HIS 54 Cb 0.46 -4.48 0.00 0.00 1.12 0.00 0.00 29.99 27.09 2q94 n HIS 54 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2q94 n ALA 55 N -4.38 0.00 -2.98 -1.41 0.00 -0.34 -4.95 120.51 106.45 2q94 n ALA 55 Ca -0.21 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.12 2q94 n ALA 55 Cb 0.64 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.97 2q94 n ALA 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2q94 s VAL 56 N -1.32 0.07 0.02 0.00 -7.23 -1.01 -3.87 120.40 107.06 2q94 s VAL 56 Ca 0.00 -0.58 -0.30 0.00 -1.81 0.00 0.00 61.98 59.28 2q94 s VAL 56 Cb 0.00 -0.23 -0.05 0.00 0.56 0.00 0.00 36.38 36.66 2q94 s VAL 56 CO 0.00 -0.32 1.18 -0.55 -0.31 0.00 0.00 175.10 175.10 2q94 s SER 57 N -0.98 7.10 0.24 4.85 0.15 -1.26 -0.82 113.70 122.98 2q94 s SER 57 Ca -0.11 1.92 0.26 0.00 0.70 0.00 0.00 55.95 58.72 2q94 s SER 57 Cb -0.07 -2.57 0.81 0.00 -1.71 0.00 0.00 66.02 62.48 2q94 s SER 57 CO -0.00 -0.49 1.76 0.00 1.20 0.00 0.00 173.24 175.71 2q94 h ALA 58 N 7.03 1.00 -0.01 5.45 0.00 -1.32 -3.30 119.26 128.11 2q94 h ALA 58 Ca -0.39 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.41 2q94 h ALA 58 Cb 1.20 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.00 2q94 h ALA 58 CO 0.83 0.00 -0.41 0.00 0.00 0.00 0.00 179.25 179.67 2q94 n LEU 60 N -4.37 2.24 0.00 0.00 7.94 -0.82 -0.55 117.00 121.44 2q94 n LEU 60 Ca -0.10 0.21 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 2q94 n LEU 60 Cb 0.58 -1.34 0.00 0.00 0.53 0.00 0.00 43.42 43.18 2q94 n LEU 60 CO 0.43 -0.85 0.00 0.61 -1.11 0.00 0.00 177.39 176.47 2q94 n GLY 61 N 6.32 1.17 3.64 -3.96 0.00 0.27 -4.97 105.19 107.65 2q94 n GLY 61 Ca 0.40 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.00 2q94 n GLY 61 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2q94 s TYR 62 N -2.71 1.87 -2.10 1.61 5.04 0.29 -1.44 117.35 119.91 2q94 s TYR 62 Ca 0.00 0.35 0.00 0.00 -2.44 0.00 0.00 57.07 54.98 2q94 s TYR 62 Cb 0.00 -3.99 0.00 0.00 0.35 0.00 0.00 41.96 38.32 2q94 s TYR 62 CO 0.00 -3.57 0.00 0.72 -1.34 0.00 0.00 175.55 171.36 2q94 n HIS 63 N 8.46 -0.03 -0.35 4.97 8.25 -1.26 -1.15 115.22 134.11 2q94 n HIS 63 Ca 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 2q94 n HIS 63 Cb 0.44 -3.38 0.00 0.00 1.12 0.00 0.00 29.99 28.17 2q94 n HIS 63 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2q94 n GLY 64 N -0.34 0.74 3.72 -1.41 0.00 -0.52 -5.04 105.19 102.34 2q94 n GLY 64 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 2q94 n GLY 64 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2q94 s TYR 65 N -2.38 2.85 -0.27 1.61 5.04 -0.30 -4.76 117.35 119.13 2q94 s TYR 65 Ca 0.00 0.31 0.28 0.00 -2.44 0.00 0.00 57.07 55.22 2q94 s TYR 65 Cb 0.00 -4.15 0.90 0.00 0.35 0.00 0.00 41.96 39.06 2q94 s TYR 65 CO 0.00 -4.38 1.79 -1.00 -1.34 0.00 0.00 175.55 170.63 2q94 h PRO 66 N 6.94 0.00 -5.30 4.97 0.13 -1.91 0.77 132.00 137.60 2q94 h PRO 66 Ca -0.43 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.03 2q94 h PRO 66 Cb 1.20 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.21 2q94 h PRO 66 CO 0.96 0.00 -0.49 0.15 -0.23 0.00 0.00 178.00 178.38 2q94 s LYS 67 N -3.39 2.20 0.03 0.86 -0.14 -1.26 -4.80 119.74 113.23 2q94 s LYS 67 Ca 0.05 -2.35 0.10 0.00 -1.36 0.00 0.00 55.97 52.41 2q94 s LYS 67 Cb 0.08 -1.60 -0.22 0.00 -1.68 0.00 0.00 37.83 34.41 2q94 s LYS 67 CO 0.57 -0.38 0.92 0.77 -0.76 0.00 0.00 175.35 176.48 2q94 h SER 68 N 1.30 0.00 -5.07 2.83 0.02 -1.90 -2.18 113.55 108.55 2q94 h SER 68 Ca -0.43 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.31 2q94 h SER 68 Cb 1.31 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.70 2q94 h SER 68 CO 0.73 0.98 -0.66 0.68 -1.14 0.00 0.00 176.83 177.42 2q94 s VAL 69 N -2.65 0.33 -0.14 2.27 -7.23 -1.26 -4.29 120.40 107.42 2q94 s VAL 69 Ca -0.02 -1.92 -0.06 0.00 -1.81 0.00 0.00 61.98 58.17 2q94 s VAL 69 Cb 0.09 -1.96 -0.04 0.00 0.56 0.00 0.00 36.38 35.03 2q94 s VAL 69 CO 0.82 -0.58 0.05 0.00 -0.31 0.00 0.00 175.10 175.08 2q94 s ILE 71 N -0.19 0.97 -0.12 0.00 1.01 -0.45 -0.92 121.20 121.49 2q94 s ILE 71 Ca 0.07 -0.48 0.03 0.00 0.00 0.00 0.00 60.65 60.27 2q94 s ILE 71 Cb -0.12 -1.14 0.00 0.00 0.01 0.00 0.00 42.46 41.21 2q94 s ILE 71 CO 0.01 0.16 -0.22 -0.44 0.00 0.00 0.00 174.94 174.46 2q94 s SER 72 N 1.70 3.21 -0.10 3.58 0.01 -0.50 -3.84 113.70 117.76 2q94 s SER 72 Ca 0.02 -0.55 -0.01 0.00 1.31 0.00 0.00 55.95 56.72 2q94 s SER 72 Cb -0.15 -1.45 -0.03 0.00 0.21 0.00 0.00 66.02 64.61 2q94 s SER 72 CO -0.08 0.13 -0.07 -0.63 0.41 0.00 0.00 173.24 173.00 2q94 s ILE 73 N 0.55 3.63 0.00 1.44 1.01 -1.26 -0.69 121.20 125.88 2q94 s ILE 73 Ca -0.13 -0.48 0.00 0.00 0.00 0.00 0.00 60.65 60.04 2q94 s ILE 73 Cb -0.17 -2.52 0.00 0.00 0.01 0.00 0.00 42.46 39.78 2q94 s ILE 73 CO 0.04 0.55 0.00 0.59 0.00 0.00 0.00 174.94 176.13 2q94 n ASN 74 N 2.84 0.00 0.01 3.58 3.02 -0.21 -1.15 115.26 123.34 2q94 n ASN 74 Ca -0.18 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.47 2q94 n ASN 74 Cb 0.53 0.00 0.43 0.00 -0.61 0.00 0.00 39.78 40.12 2q94 n ASN 74 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2q94 n GLU 75 N 0.00 0.01 -2.41 3.52 0.00 -1.26 -1.57 120.64 118.92 2q94 n GLU 75 Ca 0.00 0.17 -0.42 0.00 0.00 0.00 0.00 57.16 56.90 2q94 n GLU 75 Cb 0.00 -1.52 -0.03 0.00 0.00 0.00 0.00 31.44 29.90 2q94 n GLU 75 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2q94 s VAL 76 N -3.01 4.15 -0.07 3.84 1.01 -0.30 -1.77 120.40 124.25 2q94 s VAL 76 Ca 0.09 1.49 -0.21 0.00 0.00 0.00 0.00 61.98 63.35 2q94 s VAL 76 Cb 0.13 -3.96 -0.30 0.00 0.00 0.00 0.00 36.38 32.25 2q94 s VAL 76 CO 0.37 0.00 0.81 0.58 0.00 0.00 0.00 175.10 176.86 2q94 h VAL 77 N 4.97 1.44 -2.43 2.92 2.07 -0.15 -3.40 116.25 121.67 2q94 h VAL 77 Ca -0.35 -2.50 0.16 0.00 0.82 0.00 0.00 66.70 64.83 2q94 h VAL 77 Cb 1.17 3.11 -0.07 0.00 -1.52 0.00 0.00 31.29 33.98 2q94 h VAL 77 CO 0.88 0.70 0.48 0.00 0.02 0.00 0.00 177.57 179.65 2q94 n HIS 79 N -0.52 -0.63 -1.75 0.00 8.25 -1.26 -2.61 115.22 116.70 2q94 n HIS 79 Ca -0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.99 2q94 n HIS 79 Cb 0.60 -3.53 -0.02 0.00 1.12 0.00 0.00 29.99 28.17 2q94 n HIS 79 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2q94 s GLY 80 N -2.31 1.89 -0.30 -1.41 0.00 -1.25 -3.94 107.32 100.00 2q94 s GLY 80 Ca 0.00 1.59 -0.16 0.00 0.00 0.00 0.00 44.72 46.15 2q94 s GLY 80 CO 0.00 2.65 0.43 -0.42 0.00 0.00 0.00 173.10 175.75 2q94 s ILE 81 N 0.27 5.12 0.18 0.90 1.01 -1.26 -1.34 121.20 126.08 2q94 s ILE 81 Ca 0.66 0.47 -0.33 0.00 0.00 0.00 0.00 60.65 61.45 2q94 s ILE 81 Cb -0.49 -3.81 -0.15 0.00 0.01 0.00 0.00 42.46 38.03 2q94 s ILE 81 CO 0.45 0.01 1.28 -2.65 0.00 0.00 0.00 174.94 174.02 2q94 n PRO 82 N 5.48 1.47 -3.89 2.79 -0.02 -1.26 -4.93 135.00 134.64 2q94 n PRO 82 Ca -0.07 0.53 -0.14 0.00 -2.02 0.00 0.00 63.50 61.80 2q94 n PRO 82 Cb 0.50 -2.10 -0.15 0.00 -0.02 0.00 0.00 33.50 31.73 2q94 n PRO 82 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2q94 s ASP 83 N 0.19 0.16 0.59 2.55 -1.08 -1.26 -4.64 116.67 113.17 2q94 s ASP 83 Ca 0.73 -0.01 0.38 0.00 -0.52 0.00 0.00 52.55 53.14 2q94 s ASP 83 Cb -0.79 -0.06 1.89 0.00 -1.46 0.00 0.00 42.92 42.50 2q94 s ASP 83 CO 0.50 -0.04 2.16 0.44 0.52 0.00 0.00 175.17 178.75 2q94 h ASP 84 N 6.58 0.00 0.23 -0.34 3.32 -1.91 -1.29 116.42 123.01 2q94 h ASP 84 Ca -0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2q94 h ASP 84 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2q94 h ASP 84 CO 0.50 0.00 -0.67 0.00 -1.72 0.00 0.00 179.24 177.35 2q94 n ALA 85 N -2.05 3.97 -2.53 3.45 0.00 -1.26 -4.82 120.51 117.27 2q94 n ALA 85 Ca -0.01 -0.48 -0.42 0.00 0.00 0.00 0.00 53.44 52.53 2q94 n ALA 85 Cb 0.17 -0.96 -0.08 0.00 0.00 0.00 0.00 19.45 18.58 2q94 n ALA 85 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2q94 s LYS 86 N -2.90 3.39 -0.10 0.00 2.47 -1.00 -5.04 119.74 116.57 2q94 s LYS 86 Ca 0.12 -0.37 -0.03 0.00 -1.56 0.00 0.00 55.97 54.13 2q94 s LYS 86 Cb 0.17 -3.89 -0.03 0.00 -1.46 0.00 0.00 37.83 32.62 2q94 s LYS 86 CO 0.73 -0.80 0.03 -0.51 0.16 0.00 0.00 175.35 174.97 2q94 s LEU 87 N 2.45 3.76 0.48 5.43 1.43 -1.26 -1.31 118.68 129.66 2q94 s LEU 87 Ca 0.18 0.21 -0.21 0.00 -1.03 0.00 0.00 54.13 53.28 2q94 s LEU 87 Cb -0.15 -1.88 -0.08 0.00 0.03 0.00 0.00 46.19 44.11 2q94 s LEU 87 CO 0.15 0.38 1.07 -0.76 0.23 0.00 0.00 176.35 177.41 2q94 s LEU 88 N -0.86 3.88 0.07 1.79 1.43 -0.24 -4.89 118.68 119.86 2q94 s LEU 88 Ca 0.13 2.02 0.00 0.00 -1.03 0.00 0.00 54.13 55.25 2q94 s LEU 88 Cb -0.12 -4.49 -0.04 0.00 0.03 0.00 0.00 46.19 41.58 2q94 s LEU 88 CO 0.03 -0.84 -0.04 -1.59 0.23 0.00 0.00 176.35 174.14 2q94 s LYS 89 N -3.10 0.72 0.05 1.70 -2.85 -1.26 -1.30 119.74 113.70 2q94 s LYS 89 Ca 0.67 -1.28 -0.37 0.00 -1.00 0.00 0.00 55.97 53.99 2q94 s LYS 89 Cb -0.20 0.05 -0.17 0.00 -2.06 0.00 0.00 37.83 35.46 2q94 s LYS 89 CO 0.23 -0.08 1.37 -3.47 0.10 0.00 0.00 175.35 173.50 2q94 n ASP 90 N 0.04 1.67 0.00 0.03 2.03 -1.26 -1.47 116.55 117.58 2q94 n ASP 90 Ca -0.13 1.12 0.00 0.00 0.52 0.00 0.00 54.79 56.30 2q94 n ASP 90 Cb 0.61 -1.18 0.00 0.00 -0.72 0.00 0.00 41.12 39.83 2q94 n ASP 90 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2q94 n GLY 91 N 2.64 3.38 3.74 0.27 0.00 0.20 -4.90 105.19 110.52 2q94 n GLY 91 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2q94 n GLY 91 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2q94 s ASP 92 N -0.97 4.82 -0.09 1.61 1.01 -0.54 -4.61 116.67 117.90 2q94 s ASP 92 Ca 0.00 2.59 0.03 0.00 0.71 0.00 0.00 52.55 55.88 2q94 s ASP 92 Cb 0.00 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.30 2q94 s ASP 92 CO 0.00 -1.86 -0.19 0.27 0.21 0.00 0.00 175.17 173.61 2q94 s ILE 93 N -1.43 2.57 -0.03 0.77 -4.36 -1.26 -0.30 121.20 117.16 2q94 s ILE 93 Ca 0.80 -0.86 0.01 0.00 -0.26 0.00 0.00 60.65 60.34 2q94 s ILE 93 Cb -0.36 -2.01 0.02 0.00 1.25 0.00 0.00 42.46 41.35 2q94 s ILE 93 CO 0.39 0.55 -0.04 -0.69 0.24 0.00 0.00 174.94 175.40 2q94 s VAL 94 N 0.04 0.44 -0.15 8.37 1.01 0.50 -1.04 120.40 129.57 2q94 s VAL 94 Ca -0.07 -0.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.73 2q94 s VAL 94 Cb -0.15 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 2q94 s VAL 94 CO 0.05 0.18 0.07 0.21 0.00 0.00 0.00 175.10 175.61 2q94 s ASN 95 N 0.61 5.73 -0.16 3.32 3.84 0.14 0.02 114.94 128.44 2q94 s ASN 95 Ca -0.07 0.19 0.02 0.00 0.21 0.00 0.00 52.86 53.20 2q94 s ASN 95 Cb -0.11 -1.88 0.02 0.00 -0.55 0.00 0.00 41.25 38.73 2q94 s ASN 95 CO -0.00 0.28 -0.21 -0.63 -2.79 0.00 0.00 177.10 173.75 2q94 s ILE 96 N -0.24 2.07 -0.20 -5.21 1.01 -1.02 -1.41 121.20 116.20 2q94 s ILE 96 Ca 0.08 -0.95 -0.03 0.00 0.00 0.00 0.00 60.65 59.75 2q94 s ILE 96 Cb -0.12 -1.85 -0.01 0.00 0.01 0.00 0.00 42.46 40.49 2q94 s ILE 96 CO 0.01 0.54 -0.06 -0.62 0.00 0.00 0.00 174.94 174.81 2q94 s ASP 97 N 1.09 4.24 0.00 3.58 -1.08 -0.10 -2.79 116.67 121.62 2q94 s ASP 97 Ca 0.00 -0.37 0.06 0.00 -0.52 0.00 0.00 52.55 51.72 2q94 s ASP 97 Cb -0.14 -1.71 -0.03 0.00 -1.46 0.00 0.00 42.92 39.58 2q94 s ASP 97 CO -0.08 0.03 -0.18 -0.69 0.52 0.00 0.00 175.17 174.77 2q94 s VAL 98 N 1.18 2.79 -0.13 1.11 1.01 0.28 -2.32 120.40 124.33 2q94 s VAL 98 Ca 0.02 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 60.94 2q94 s VAL 98 Cb -0.14 -2.13 0.06 0.00 0.00 0.00 0.00 36.38 34.17 2q94 s VAL 98 CO -0.02 0.45 0.20 -0.89 0.00 0.00 0.00 175.10 174.85 2q94 s THR 99 N -0.82 -0.32 0.09 3.92 2.01 -1.26 -1.28 115.64 117.97 2q94 s THR 99 Ca 0.13 0.22 0.08 0.00 0.31 0.00 0.00 61.69 62.43 2q94 s THR 99 Cb -0.10 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.94 2q94 s THR 99 CO 0.03 0.05 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.15 2q94 s VAL 100 N 2.34 2.89 -0.14 3.82 1.01 -0.46 -0.91 120.40 128.95 2q94 s VAL 100 Ca 0.03 -1.35 0.01 0.00 0.00 0.00 0.00 61.98 60.67 2q94 s VAL 100 Cb -0.13 -2.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 2q94 s VAL 100 CO -0.08 0.19 -0.15 -0.63 0.00 0.00 0.00 175.10 174.43 2q94 s ILE 101 N -1.07 2.73 -0.04 2.22 1.01 -0.00 -1.21 121.20 124.84 2q94 s ILE 101 Ca 0.17 -0.76 -0.02 0.00 0.00 0.00 0.00 60.65 60.04 2q94 s ILE 101 Cb -0.11 -2.14 0.03 0.00 0.01 0.00 0.00 42.46 40.26 2q94 s ILE 101 CO 0.09 0.52 0.07 -0.75 0.00 0.00 0.00 174.94 174.87 2q94 s LYS 102 N 0.59 -0.03 -1.42 2.79 2.47 -0.34 -2.41 119.74 121.39 2q94 s LYS 102 Ca -0.09 0.33 -0.07 0.00 -1.56 0.00 0.00 55.97 54.58 2q94 s LYS 102 Cb -0.16 -0.34 0.04 0.00 -1.46 0.00 0.00 37.83 35.91 2q94 s LYS 102 CO 0.03 -0.25 0.55 -3.47 0.16 0.00 0.00 175.35 172.38 2q94 n ASP 103 N 4.74 -4.97 0.00 1.43 2.03 -1.26 -1.81 116.55 116.71 2q94 n ASP 103 Ca -0.16 -0.33 0.00 0.00 0.52 0.00 0.00 54.79 54.82 2q94 n ASP 103 Cb 0.50 -4.05 0.00 0.00 -0.72 0.00 0.00 41.12 36.85 2q94 n ASP 103 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2q94 n GLY 104 N -1.36 2.15 3.67 0.27 0.00 -1.26 -5.04 105.19 103.62 2q94 n GLY 104 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 2q94 n GLY 104 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2q94 s PHE 105 N -2.36 2.92 -0.07 1.61 0.40 -0.75 -4.18 117.98 115.56 2q94 s PHE 105 Ca 0.00 -0.07 -0.07 0.00 -0.60 0.00 0.00 56.93 56.19 2q94 s PHE 105 Cb 0.00 -1.49 -0.04 0.00 0.51 0.00 0.00 43.02 42.00 2q94 s PHE 105 CO 0.00 0.48 0.19 -1.01 0.70 0.00 0.00 175.22 175.58 2q94 s HIS 106 N -1.39 3.60 -0.13 0.36 3.76 -0.20 -1.20 115.29 120.09 2q94 s HIS 106 Ca 0.26 0.54 0.02 0.00 -0.15 0.00 0.00 55.06 55.72 2q94 s HIS 106 Cb -0.11 -1.96 0.02 0.00 1.11 0.00 0.00 32.58 31.64 2q94 s HIS 106 CO 0.18 0.69 -0.17 0.20 -0.85 0.00 0.00 174.74 174.79 2q94 s GLY 107 N -1.33 1.17 -0.12 -2.22 0.00 -0.35 -4.64 107.32 99.83 2q94 s GLY 107 Ca 0.20 -0.91 -0.00 0.00 0.00 0.00 0.00 44.72 44.02 2q94 s GLY 107 CO 0.10 0.23 -0.09 -0.35 0.00 0.00 0.00 173.10 172.99 2q94 s ASP 108 N 1.07 2.29 0.07 1.64 2.15 -1.26 -1.36 116.67 121.27 2q94 s ASP 108 Ca -0.03 -0.34 -0.25 0.00 0.43 0.00 0.00 52.55 52.36 2q94 s ASP 108 Cb -0.14 -0.91 0.06 0.00 -0.30 0.00 0.00 42.92 41.63 2q94 s ASP 108 CO -0.05 -0.11 0.59 0.28 -0.17 0.00 0.00 175.17 175.72 2q94 s THR 109 N 1.66 0.01 0.08 1.71 -1.32 -0.40 -3.17 115.64 114.21 2q94 s THR 109 Ca 0.05 -0.10 -0.15 0.00 -1.21 0.00 0.00 61.69 60.28 2q94 s THR 109 Cb -0.13 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 69.89 2q94 s THR 109 CO -0.09 -0.05 0.36 -0.94 -2.21 0.00 0.00 174.62 171.69 2q94 s SER 110 N -2.09 -0.19 0.11 8.08 1.04 -1.07 -0.55 113.70 119.03 2q94 s SER 110 Ca -0.04 -0.23 -0.09 0.00 0.48 0.00 0.00 55.95 56.07 2q94 s SER 110 Cb -0.01 0.42 -0.00 0.00 0.10 0.00 0.00 66.02 66.53 2q94 s SER 110 CO -0.03 -0.73 0.22 -1.59 0.98 0.00 0.00 173.24 172.09 2q94 s LYS 111 N -3.15 0.94 0.01 4.02 -2.85 -1.12 -1.60 119.74 116.00 2q94 s LYS 111 Ca -0.01 -1.01 -0.09 0.00 -1.00 0.00 0.00 55.97 53.86 2q94 s LYS 111 Cb 0.01 0.36 -0.05 0.00 -2.06 0.00 0.00 37.83 36.09 2q94 s LYS 111 CO -0.07 -0.32 0.31 -1.64 0.10 0.00 0.00 175.35 173.73 2q94 s MET 112 N -3.89 3.66 -0.03 1.78 -1.94 -1.26 -2.44 119.30 115.18 2q94 s MET 112 Ca 0.08 0.06 0.05 0.00 -1.71 0.00 0.00 55.69 54.17 2q94 s MET 112 Cb 0.04 -3.09 -0.01 0.00 2.01 0.00 0.00 34.83 33.78 2q94 s MET 112 CO -0.08 0.65 -0.19 -0.06 -0.01 0.00 0.00 175.02 175.33 2q94 s PHE 113 N -1.26 1.82 -0.19 -0.03 0.40 0.10 -4.95 117.98 113.87 2q94 s PHE 113 Ca 0.27 -0.46 -0.07 0.00 -0.60 0.00 0.00 56.93 56.07 2q94 s PHE 113 Cb -0.14 -1.20 -0.04 0.00 0.51 0.00 0.00 43.02 42.16 2q94 s PHE 113 CO 0.15 -0.12 0.05 0.42 0.70 0.00 0.00 175.22 176.41 2q94 s ILE 114 N -0.17 4.58 -0.11 0.64 1.01 -1.26 -0.37 121.20 125.53 2q94 s ILE 114 Ca 0.00 -0.10 -0.17 0.00 0.00 0.00 0.00 60.65 60.38 2q94 s ILE 114 Cb -0.10 -3.07 -0.04 0.00 0.01 0.00 0.00 42.46 39.25 2q94 s ILE 114 CO 0.01 0.45 0.44 -0.69 0.00 0.00 0.00 174.94 175.15 2q94 s VAL 115 N 0.56 5.18 0.00 2.92 1.01 0.58 -4.95 120.40 125.70 2q94 s VAL 115 Ca 0.02 0.88 0.00 0.00 0.00 0.00 0.00 61.98 62.88 2q94 s VAL 115 Cb -0.13 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2q94 s VAL 115 CO 0.01 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.10 2q94 n GLY 116 N 3.07 2.20 3.65 4.51 0.00 -1.26 0.58 105.19 117.95 2q94 n GLY 116 Ca -0.09 -0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.04 2q94 n GLY 116 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2q94 s LYS 117 N 0.00 4.05 0.50 1.61 2.20 -1.26 -4.70 119.74 122.14 2q94 s LYS 117 Ca 0.00 1.85 -0.20 0.00 -0.36 0.00 0.00 55.97 57.25 2q94 s LYS 117 Cb 0.00 -3.95 -0.07 0.00 -1.51 0.00 0.00 37.83 32.30 2q94 s LYS 117 CO 0.00 -0.98 1.10 -1.25 -0.36 0.00 0.00 175.35 173.85 2q94 s PRO 118 N 4.15 3.62 -0.04 4.03 0.04 -1.26 -3.02 135.00 142.51 2q94 s PRO 118 Ca 0.68 1.54 -0.07 0.00 0.04 0.00 0.00 61.00 63.19 2q94 s PRO 118 Cb -0.27 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 2q94 s PRO 118 CO 0.26 -0.62 0.23 0.95 0.04 0.00 0.00 177.00 177.86 2q94 s THR 119 N -1.81 5.36 0.30 1.26 -4.23 -1.26 -4.99 115.64 110.28 2q94 s THR 119 Ca 0.69 0.21 0.03 0.00 -1.18 0.00 0.00 61.69 61.44 2q94 s THR 119 Cb -0.22 -3.52 0.29 0.00 1.34 0.00 0.00 72.50 70.40 2q94 s THR 119 CO 0.25 0.47 1.85 0.40 -0.54 0.00 0.00 174.62 177.06 2q94 h ILE 120 N 3.41 0.92 -0.23 2.99 5.03 -1.98 -0.01 117.51 127.64 2q94 h ILE 120 Ca -0.52 -0.32 -0.11 0.00 -0.12 0.00 0.00 64.86 63.79 2q94 h ILE 120 Cb 1.21 -0.10 -0.00 0.00 -3.03 0.00 0.00 36.82 34.90 2q94 h ILE 120 CO 0.63 0.17 -0.29 -0.03 -0.68 0.00 0.00 178.15 177.95 2q94 h MET 121 N 0.93 0.60 -0.68 2.37 4.05 -1.98 0.29 114.93 120.51 2q94 h MET 121 Ca 0.48 -0.34 0.01 0.00 -0.28 0.00 0.00 59.70 59.57 2q94 h MET 121 Cb 0.51 0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.30 2q94 h MET 121 CO -0.24 0.94 0.45 0.78 0.23 0.00 0.00 176.91 179.07 2q94 h GLY 122 N 0.29 0.96 1.20 1.39 0.00 -1.81 0.17 103.07 105.28 2q94 h GLY 122 Ca 0.03 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 2q94 h GLY 122 CO 0.07 0.34 0.27 -2.09 0.00 0.00 0.00 176.54 175.14 2q94 h GLU 123 N 0.92 1.01 -0.11 4.80 4.22 -0.89 -1.72 114.58 122.81 2q94 h GLU 123 Ca 0.25 -0.17 -0.04 0.00 0.08 0.00 0.00 59.36 59.48 2q94 h GLU 123 Cb -0.09 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 28.98 2q94 h GLU 123 CO -0.06 0.83 -0.09 -0.09 -2.18 0.00 0.00 179.01 177.41 2q94 h ARG 124 N 0.99 0.26 -0.69 1.92 2.43 -0.04 -1.87 114.38 117.39 2q94 h ARG 124 Ca 0.23 -0.13 0.02 0.00 -0.81 0.00 0.00 59.98 59.30 2q94 h ARG 124 Cb 0.19 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 2q94 h ARG 124 CO -0.02 0.65 0.44 1.25 -1.51 0.00 0.00 179.97 180.78 2q94 h LEU 125 N -0.13 0.73 -0.53 3.80 5.85 -0.54 -0.14 115.31 124.35 2q94 h LEU 125 Ca 0.02 -0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.63 2q94 h LEU 125 Cb 0.60 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 2q94 h LEU 125 CO 0.02 0.51 -0.08 0.00 -0.34 0.00 0.00 178.44 178.55 2q94 h ARG 127 N 0.87 0.23 -0.72 0.00 2.43 -0.97 -1.52 114.38 114.70 2q94 h ARG 127 Ca 0.14 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2q94 h ARG 127 Cb 0.64 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 2q94 h ARG 127 CO 0.04 0.42 0.40 0.82 -1.51 0.00 0.00 179.97 180.14 2q94 h ILE 128 N 0.01 1.22 -0.46 1.20 1.08 -1.00 -0.19 117.51 119.37 2q94 h ILE 128 Ca 0.04 -0.55 -0.01 0.00 -0.39 0.00 0.00 64.86 63.95 2q94 h ILE 128 Cb 0.30 0.27 -0.02 0.00 -3.07 0.00 0.00 36.82 34.30 2q94 h ILE 128 CO 0.00 0.24 0.23 0.74 -0.69 0.00 0.00 178.15 178.67 2q94 h THR 129 N 1.00 1.18 -0.63 -0.27 2.02 -1.11 0.43 112.91 115.52 2q94 h THR 129 Ca 0.25 -0.49 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 2q94 h THR 129 Cb 0.03 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 2q94 h THR 129 CO -0.04 0.19 0.15 -0.61 0.37 0.00 0.00 175.52 175.58 2q94 h GLN 130 N 0.60 1.00 -0.07 6.66 4.15 -0.92 -2.15 115.11 124.37 2q94 h GLN 130 Ca 0.16 -0.22 -0.07 0.00 0.77 0.00 0.00 58.65 59.28 2q94 h GLN 130 Cb 0.10 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 2q94 h GLN 130 CO -0.02 0.89 -0.29 1.49 -1.93 0.00 0.00 178.83 178.96 2q94 h GLU 131 N 0.95 0.13 -0.19 1.69 4.57 -0.55 -0.12 114.58 121.06 2q94 h GLU 131 Ca 0.20 -0.04 -0.11 0.00 -1.18 0.00 0.00 59.36 58.23 2q94 h GLU 131 Cb 0.34 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 2q94 h GLU 131 CO 0.00 0.42 -0.34 0.66 -1.18 0.00 0.00 179.01 178.57 2q94 h SER 132 N 0.12 0.41 -0.18 1.04 4.64 -0.30 0.07 113.55 119.35 2q94 h SER 132 Ca 0.02 -0.16 -0.12 0.00 -0.47 0.00 0.00 61.79 61.06 2q94 h SER 132 Cb 0.59 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2q94 h SER 132 CO 0.04 0.73 -0.34 0.25 -0.87 0.00 0.00 176.83 176.64 2q94 h LEU 133 N 0.34 0.60 -0.55 5.97 5.85 -0.85 -2.88 115.31 123.79 2q94 h LEU 133 Ca 0.04 -0.55 -0.01 0.00 0.84 0.00 0.00 57.88 58.20 2q94 h LEU 133 Cb 0.77 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 2q94 h LEU 133 CO 0.06 1.04 0.29 1.88 -0.34 0.00 0.00 178.44 181.37 2q94 h TYR 134 N 0.19 0.78 -0.31 1.25 0.05 -0.76 -0.59 116.97 117.58 2q94 h TYR 134 Ca 0.01 -0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.72 2q94 h TYR 134 Cb 0.94 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 38.41 2q94 h TYR 134 CO 0.09 0.58 0.01 1.37 -1.05 0.00 0.00 178.16 179.16 2q94 h LEU 135 N 0.75 0.44 -0.21 3.88 8.10 -1.04 -0.90 115.31 126.33 2q94 h LEU 135 Ca 0.19 -0.07 -0.07 0.00 0.11 0.00 0.00 57.88 58.04 2q94 h LEU 135 Cb 0.07 -0.11 -0.00 0.00 -0.44 0.00 0.00 40.66 40.18 2q94 h LEU 135 CO -0.03 0.50 -0.16 0.00 -4.11 0.00 0.00 178.44 174.64 2q94 h ALA 136 N 1.56 0.30 -0.57 0.17 0.00 -1.21 -3.06 119.26 116.44 2q94 h ALA 136 Ca 0.10 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 2q94 h ALA 136 Cb 0.29 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2q94 h ALA 136 CO 0.01 0.20 0.34 -0.07 0.00 0.00 0.00 179.25 179.72 2q94 h LEU 137 N 0.16 0.68 -0.34 0.00 3.38 -0.58 -1.05 115.31 117.56 2q94 h LEU 137 Ca 0.04 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2q94 h LEU 137 Cb 0.69 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2q94 h LEU 137 CO 0.04 0.53 0.00 0.54 0.09 0.00 0.00 178.44 179.64 2q94 n ARG 138 N -4.42 0.10 0.05 1.13 1.74 -0.39 -2.46 116.66 112.41 2q94 n ARG 138 Ca 0.05 0.32 0.11 0.00 -0.77 0.00 0.00 57.85 57.57 2q94 n ARG 138 Cb 0.07 -1.69 -0.04 0.00 -1.02 0.00 0.00 32.46 29.78 2q94 n ARG 138 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2q94 n MET 139 N -1.88 0.53 -1.91 5.56 2.81 -0.41 -4.94 117.12 116.87 2q94 n MET 139 Ca 0.03 -0.01 -0.42 0.00 -1.81 0.00 0.00 57.70 55.49 2q94 n MET 139 Cb 0.21 -1.67 -0.03 0.00 -0.71 0.00 0.00 33.22 31.02 2q94 n MET 139 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2q94 s VAL 140 N -3.36 3.32 -0.11 2.03 1.01 -1.03 -4.94 120.40 117.32 2q94 s VAL 140 Ca -0.01 0.50 -0.31 0.00 0.00 0.00 0.00 61.98 62.15 2q94 s VAL 140 Cb 0.12 -3.32 0.12 0.00 0.00 0.00 0.00 36.38 33.30 2q94 s VAL 140 CO 0.83 -0.03 1.03 -1.59 0.00 0.00 0.00 175.10 175.33 2q94 s LYS 141 N 3.77 0.59 0.47 2.72 -2.85 -1.26 -3.71 119.74 119.48 2q94 s LYS 141 Ca 0.77 -0.13 -0.24 0.00 -1.00 0.00 0.00 55.97 55.36 2q94 s LYS 141 Cb -0.37 0.27 -0.08 0.00 -2.06 0.00 0.00 37.83 35.59 2q94 s LYS 141 CO 0.33 -0.24 1.36 -2.30 0.10 0.00 0.00 175.35 174.60 2q94 n PRO 142 N 0.04 1.99 0.00 1.78 -0.02 -1.26 -2.96 135.00 134.57 2q94 n PRO 142 Ca -0.06 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 2q94 n PRO 142 Cb 0.60 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2q94 n PRO 142 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q94 n GLY 143 N 0.70 3.30 3.84 -1.23 0.00 -0.60 -4.95 105.19 106.26 2q94 n GLY 143 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 2q94 n GLY 143 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2q94 s ILE 144 N -2.51 4.64 -0.01 -0.61 2.07 -1.16 -4.73 121.20 118.89 2q94 s ILE 144 Ca 0.00 1.05 -0.14 0.00 -1.41 0.00 0.00 60.65 60.15 2q94 s ILE 144 Cb 0.00 -3.67 -0.06 0.00 0.13 0.00 0.00 42.46 38.87 2q94 s ILE 144 CO 0.00 -0.10 0.38 0.21 -1.91 0.00 0.00 174.94 173.52 2q94 s ASN 145 N -2.13 6.76 0.58 4.50 3.84 -1.26 -0.99 114.94 126.24 2q94 s ASN 145 Ca 0.52 0.91 0.27 0.00 0.21 0.00 0.00 52.86 54.77 2q94 s ASN 145 Cb -0.12 -2.23 1.66 0.00 -0.55 0.00 0.00 41.25 40.02 2q94 s ASN 145 CO 0.18 0.33 2.19 -0.07 -2.79 0.00 0.00 177.10 176.93 2q94 h LEU 146 N 4.69 0.00 -1.15 3.21 3.38 -1.40 -0.60 115.31 123.44 2q94 h LEU 146 Ca -0.52 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.44 2q94 h LEU 146 Cb 1.22 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 2q94 h LEU 146 CO 0.61 0.00 0.38 -0.09 0.09 0.00 0.00 178.44 179.43 2q94 h ARG 147 N 0.00 0.97 -0.37 1.13 2.43 -1.82 -0.18 114.38 116.55 2q94 h ARG 147 Ca 0.03 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2q94 h ARG 147 Cb 0.17 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 2q94 h ARG 147 CO -0.00 0.71 0.16 0.93 -1.51 0.00 0.00 179.97 180.26 2q94 h GLU 148 N 0.97 0.54 -0.57 0.20 5.08 -1.49 -0.38 114.58 118.94 2q94 h GLU 148 Ca 0.25 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.46 2q94 h GLU 148 Cb 0.03 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2q94 h GLU 148 CO -0.04 0.51 0.15 0.82 -1.00 0.00 0.00 179.01 179.45 2q94 h ILE 149 N 0.45 1.25 -0.78 3.13 2.04 -1.39 -0.51 117.51 121.69 2q94 h ILE 149 Ca 0.12 -0.87 -0.05 0.00 1.00 0.00 0.00 64.86 65.07 2q94 h ILE 149 Cb 0.17 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 2q94 h ILE 149 CO -0.01 0.32 0.30 1.23 0.00 0.00 0.00 178.15 179.99 2q94 h GLY 150 N 0.81 1.26 1.00 5.37 0.00 -0.86 -1.80 103.07 108.85 2q94 h GLY 150 Ca 0.18 -0.69 -0.04 0.00 0.00 0.00 0.00 47.33 46.78 2q94 h GLY 150 CO -0.00 0.65 0.24 0.00 0.00 0.00 0.00 176.54 177.43 2q94 h ALA 151 N 1.18 0.79 -0.62 3.60 0.00 -0.63 -2.42 119.26 121.15 2q94 h ALA 151 Ca 0.26 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2q94 h ALA 151 Cb 0.23 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2q94 h ALA 151 CO -0.02 0.41 0.12 0.00 0.00 0.00 0.00 179.25 179.76 2q94 h ALA 152 N 1.09 0.83 0.22 0.00 0.00 -0.79 -1.26 119.26 119.35 2q94 h ALA 152 Ca 0.20 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2q94 h ALA 152 Cb 0.22 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2q94 h ALA 152 CO -0.02 0.57 -0.10 0.82 0.00 0.00 0.00 179.25 180.52 2q94 h ILE 153 N 0.93 0.81 -0.40 0.00 2.04 -1.19 -2.12 117.51 117.58 2q94 h ILE 153 Ca 0.19 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 65.97 2q94 h ILE 153 Cb 0.41 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 2q94 h ILE 153 CO 0.01 0.03 0.18 -0.61 0.00 0.00 0.00 178.15 177.76 2q94 h GLN 154 N -0.35 0.35 -0.56 2.37 4.15 -1.37 -0.67 115.11 119.03 2q94 h GLN 154 Ca -0.03 -0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.40 2q94 h GLN 154 Cb 0.27 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 27.84 2q94 h GLN 154 CO 0.05 0.23 0.32 -0.22 -1.93 0.00 0.00 178.83 177.29 2q94 h LYS 155 N 0.37 0.61 0.03 1.69 3.64 -1.14 -0.15 116.57 121.62 2q94 h LYS 155 Ca 0.18 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.52 2q94 h LYS 155 Cb 0.12 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2q94 h LYS 155 CO -0.15 0.41 -0.01 0.35 -2.27 0.00 0.00 179.45 177.77 2q94 h PHE 156 N 0.63 -0.03 -0.61 1.91 3.57 -1.05 -2.08 116.94 119.29 2q94 h PHE 156 Ca 0.23 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.74 2q94 h PHE 156 Cb 0.06 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 2q94 h PHE 156 CO -0.07 0.22 0.39 0.28 -2.23 0.00 0.00 178.31 176.91 2q94 h VAL 157 N -0.29 1.14 0.00 1.41 2.07 -0.94 -2.58 116.25 117.05 2q94 h VAL 157 Ca -0.00 -0.27 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 2q94 h VAL 157 Cb 0.27 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 2q94 h VAL 157 CO 0.01 0.15 -0.33 -0.33 0.02 0.00 0.00 177.57 177.08 2q94 h GLU 158 N 0.80 0.00 0.00 1.57 5.08 -1.04 -2.14 114.58 118.85 2q94 h GLU 158 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2q94 h GLU 158 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 2q94 h GLU 158 CO -0.06 0.33 0.00 0.00 -1.00 0.00 0.00 179.01 178.28 2q94 n ALA 159 N -2.27 1.68 0.50 3.43 0.00 -0.78 -1.56 120.51 121.51 2q94 n ALA 159 Ca -0.00 0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.61 2q94 n ALA 159 Cb 0.49 -1.36 0.18 0.00 0.00 0.00 0.00 19.45 18.77 2q94 n ALA 159 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2q94 n GLU 160 N -2.06 2.47 -0.70 0.00 -0.58 -0.84 -4.93 120.64 113.99 2q94 n GLU 160 Ca 0.03 -2.20 0.00 0.00 -0.42 0.00 0.00 57.16 54.57 2q94 n GLU 160 Cb 0.22 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.59 2q94 n GLU 160 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2q94 n GLY 161 N 1.47 0.71 4.02 0.62 0.00 -0.60 -5.05 105.19 106.36 2q94 n GLY 161 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 2q94 n GLY 161 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2q94 s PHE 162 N -2.44 1.63 0.11 1.61 0.08 -0.98 -4.79 117.98 113.20 2q94 s PHE 162 Ca 0.00 -0.68 0.05 0.00 0.12 0.00 0.00 56.93 56.41 2q94 s PHE 162 Cb 0.00 -2.22 -0.04 0.00 -0.57 0.00 0.00 43.02 40.19 2q94 s PHE 162 CO 0.00 -1.01 -0.11 -1.54 -0.10 0.00 0.00 175.22 172.45 2q94 s SER 163 N -4.60 1.68 -0.17 1.36 1.04 -0.46 -3.76 113.70 108.79 2q94 s SER 163 Ca 0.60 -0.84 -0.06 0.00 0.48 0.00 0.00 55.95 56.12 2q94 s SER 163 Cb -0.06 -0.02 -0.04 0.00 0.10 0.00 0.00 66.02 66.00 2q94 s SER 163 CO 0.37 -0.23 0.03 -0.69 0.98 0.00 0.00 173.24 173.70 2q94 s VAL 164 N -2.47 4.52 0.03 5.02 1.01 -1.26 -0.62 120.40 126.62 2q94 s VAL 164 Ca 0.08 -0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.62 2q94 s VAL 164 Cb -0.03 -3.02 -0.06 0.00 0.00 0.00 0.00 36.38 33.28 2q94 s VAL 164 CO 0.01 0.48 1.33 -0.69 0.00 0.00 0.00 175.10 176.22 2q94 s VAL 165 N 0.33 3.77 0.01 2.92 1.01 -0.50 -4.84 120.40 123.10 2q94 s VAL 165 Ca 0.01 1.21 0.07 0.00 0.00 0.00 0.00 61.98 63.27 2q94 s VAL 165 Cb -0.13 -3.77 -0.23 0.00 0.00 0.00 0.00 36.38 32.24 2q94 s VAL 165 CO 0.01 0.04 0.86 0.03 0.00 0.00 0.00 175.10 176.03 2q94 h ARG 166 N 7.35 0.06 0.00 2.72 2.47 -1.91 -3.38 114.38 121.70 2q94 h ARG 166 Ca -0.39 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 2q94 h ARG 166 Cb 1.19 0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.55 2q94 h ARG 166 CO 0.87 0.78 0.00 0.93 0.56 0.00 0.00 179.97 183.12 2q94 h GLU 167 N 0.02 0.00 -5.86 0.04 3.07 -1.94 -3.44 114.58 106.47 2q94 h GLU 167 Ca -0.21 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 58.15 2q94 h GLU 167 Cb 1.95 0.00 -0.21 0.00 -0.84 0.00 0.00 28.75 29.65 2q94 h GLU 167 CO 0.11 0.00 -0.80 0.71 -1.40 0.00 0.00 179.01 177.63 2q94 s TYR 168 N -3.62 1.62 0.24 4.33 1.51 -1.26 -5.15 117.35 115.02 2q94 s TYR 168 Ca -0.00 -0.45 -0.08 0.00 -1.01 0.00 0.00 57.07 55.53 2q94 s TYR 168 Cb 0.09 -0.87 -0.02 0.00 -0.11 0.00 0.00 41.96 41.05 2q94 s TYR 168 CO 0.36 0.19 0.35 0.00 -1.11 0.00 0.00 175.55 175.34 2q94 s GLY 170 N -3.09 1.71 0.04 0.00 0.00 0.45 -4.82 107.32 101.61 2q94 s GLY 170 Ca 0.29 -1.17 -0.27 0.00 0.00 0.00 0.00 44.72 43.57 2q94 s GLY 170 CO 0.11 -0.32 0.78 -2.38 0.00 0.00 0.00 173.10 171.29 2q94 s HIS 171 N -3.55 -0.44 0.81 1.90 -3.43 -1.22 -1.37 115.29 108.00 2q94 s HIS 171 Ca 0.74 0.34 -0.11 0.00 -0.80 0.00 0.00 55.06 55.23 2q94 s HIS 171 Cb -0.05 0.53 0.09 0.00 -1.43 0.00 0.00 32.58 31.72 2q94 s HIS 171 CO 0.54 -0.65 1.13 0.20 -2.00 0.00 0.00 174.74 173.97 2q94 s GLY 172 N -2.41 1.79 -0.04 -1.38 0.00 0.60 -0.69 107.32 105.19 2q94 s GLY 172 Ca 0.02 0.49 -0.23 0.00 0.00 0.00 0.00 44.72 45.00 2q94 s GLY 172 CO -0.09 0.87 0.50 -1.50 0.00 0.00 0.00 173.10 172.88 2q94 s ILE 173 N -2.66 0.03 0.00 0.90 2.07 -0.52 -0.66 121.20 120.35 2q94 s ILE 173 Ca 0.65 -0.22 0.00 0.00 -1.41 0.00 0.00 60.65 59.67 2q94 s ILE 173 Cb -0.21 -0.81 0.00 0.00 0.13 0.00 0.00 42.46 41.57 2q94 s ILE 173 CO 0.54 -0.12 0.00 0.61 -1.91 0.00 0.00 174.94 174.06 2q94 n GLY 174 N 1.12 -0.46 0.18 1.50 0.00 -1.26 -4.65 105.19 101.62 2q94 n GLY 174 Ca -0.20 0.64 0.14 0.00 0.00 0.00 0.00 46.02 46.60 2q94 n GLY 174 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2q94 h ARG 175 N 0.00 0.00 -6.21 1.61 3.08 -1.95 -0.51 114.38 110.40 2q94 h ARG 175 Ca 0.00 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.38 2q94 h ARG 175 Cb 0.00 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 29.89 2q94 h ARG 175 CO 0.00 0.00 -0.68 0.20 -1.07 0.00 0.00 179.97 178.42 2q94 s GLY 176 N -3.86 1.80 0.06 0.04 0.00 -1.26 -4.85 107.32 99.24 2q94 s GLY 176 Ca 0.06 -0.97 -0.31 0.00 0.00 0.00 0.00 44.72 43.49 2q94 s GLY 176 CO 0.54 -0.82 1.52 -2.75 0.00 0.00 0.00 173.10 171.59 2q94 h PHE 177 N 4.57 -0.78 -3.67 1.90 3.04 -1.91 -3.41 116.94 116.69 2q94 h PHE 177 Ca -0.49 -0.02 -0.68 0.00 3.98 0.00 0.00 57.97 60.77 2q94 h PHE 177 Cb 1.17 0.26 -0.34 0.00 2.56 0.00 0.00 35.95 39.60 2q94 h PHE 177 CO 0.59 -0.46 -0.75 -1.01 -2.02 0.00 0.00 178.31 174.66 2q94 s HIS 178 N -5.73 3.17 0.41 0.41 3.76 -1.26 -4.57 115.29 111.48 2q94 s HIS 178 Ca -0.17 -1.88 0.05 0.00 -0.15 0.00 0.00 55.06 52.92 2q94 s HIS 178 Cb 0.03 -2.03 -0.06 0.00 1.11 0.00 0.00 32.58 31.63 2q94 s HIS 178 CO 0.59 -0.80 0.02 -1.21 -0.85 0.00 0.00 174.74 172.49 2q94 s GLU 179 N 1.24 1.93 0.62 1.40 2.02 0.16 -4.96 118.70 121.11 2q94 s GLU 179 Ca -0.04 -2.12 -0.15 0.00 0.02 0.00 0.00 54.97 52.68 2q94 s GLU 179 Cb -0.18 -1.41 -0.02 0.00 0.10 0.00 0.00 34.13 32.61 2q94 s GLU 179 CO -0.04 -0.15 1.07 -1.21 0.02 0.00 0.00 175.26 174.95 2q94 s GLU 180 N -3.77 3.15 0.72 1.61 2.02 -1.26 -0.29 118.70 120.87 2q94 s GLU 180 Ca 0.30 1.20 -0.02 0.00 0.02 0.00 0.00 54.97 56.47 2q94 s GLU 180 Cb 0.08 -2.01 0.12 0.00 0.10 0.00 0.00 34.13 32.42 2q94 s GLU 180 CO 0.15 -0.95 0.99 -1.25 0.02 0.00 0.00 175.26 174.22 2q94 s PRO 181 N -4.23 1.74 0.08 0.39 0.04 -1.26 -3.82 135.00 127.94 2q94 s PRO 181 Ca 0.63 -0.97 -0.21 0.00 0.04 0.00 0.00 61.00 60.50 2q94 s PRO 181 Cb -0.16 -2.30 -0.07 0.00 0.04 0.00 0.00 34.50 32.00 2q94 s PRO 181 CO 0.41 -1.42 0.61 -0.65 0.04 0.00 0.00 177.00 175.99 2q94 s GLN 182 N -5.16 4.29 -0.58 4.56 -0.21 -1.26 -1.46 119.66 119.83 2q94 s GLN 182 Ca 0.65 0.82 0.01 0.00 0.02 0.00 0.00 55.36 56.87 2q94 s GLN 182 Cb -0.06 -3.26 0.15 0.00 1.00 0.00 0.00 33.01 30.84 2q94 s GLN 182 CO 0.44 0.59 0.36 0.08 -2.12 0.00 0.00 175.29 174.64 2q94 s VAL 183 N -1.00 3.08 0.43 1.09 1.01 -0.47 -4.92 120.40 119.62 2q94 s VAL 183 Ca 0.31 -3.27 -0.24 0.00 0.00 0.00 0.00 61.98 58.78 2q94 s VAL 183 Cb -0.20 -3.06 -0.08 0.00 0.00 0.00 0.00 36.38 33.04 2q94 s VAL 183 CO 0.20 -0.85 1.15 -0.76 0.00 0.00 0.00 175.10 174.84 2q94 s LEU 184 N -0.32 4.09 -0.34 3.92 1.02 -1.26 -0.41 118.68 125.37 2q94 s LEU 184 Ca 0.18 2.28 0.09 0.00 0.02 0.00 0.00 54.13 56.69 2q94 s LEU 184 Cb -0.22 -4.17 0.68 0.00 0.02 0.00 0.00 46.19 42.50 2q94 s LEU 184 CO -0.02 -0.78 1.77 1.41 0.02 0.00 0.00 176.35 178.74 2q94 n HIS 185 N -0.26 2.34 -3.93 0.29 8.25 -1.26 -4.06 115.22 116.59 2q94 n HIS 185 Ca 0.06 -1.41 -0.09 0.00 -0.26 0.00 0.00 57.72 56.01 2q94 n HIS 185 Cb 0.48 -0.71 -0.05 0.00 1.12 0.00 0.00 29.99 30.83 2q94 n HIS 185 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 2q94 s TYR 186 N -3.11 0.23 -0.10 4.41 -0.85 -1.13 -3.49 117.35 113.32 2q94 s TYR 186 Ca 0.53 -0.60 -0.28 0.00 -0.52 0.00 0.00 57.07 56.21 2q94 s TYR 186 Cb 0.44 0.24 -0.02 0.00 0.38 0.00 0.00 41.96 43.00 2q94 s TYR 186 CO 0.11 -0.96 0.93 0.34 -1.52 0.00 0.00 175.55 174.44 2q94 s ASP 187 N -2.98 7.17 -0.01 -0.18 2.15 -1.25 -4.20 116.67 117.37 2q94 s ASP 187 Ca 0.18 1.44 0.01 0.00 0.43 0.00 0.00 52.55 54.61 2q94 s ASP 187 Cb -0.01 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.10 2q94 s ASP 187 CO 0.05 -0.36 -0.03 -0.55 -0.17 0.00 0.00 175.17 174.11 2q94 s SER 188 N 1.06 0.44 0.00 -0.34 0.15 -1.26 -5.01 113.70 108.74 2q94 s SER 188 Ca 0.45 -0.06 0.12 0.00 0.70 0.00 0.00 55.95 57.16 2q94 s SER 188 Cb -0.18 -0.10 0.51 0.00 -1.71 0.00 0.00 66.02 64.54 2q94 s SER 188 CO 0.19 0.01 1.37 0.54 1.20 0.00 0.00 173.24 176.55 2q94 n ARG 189 N 3.26 0.01 0.08 5.44 1.74 -1.26 -2.35 116.66 123.60 2q94 n ARG 189 Ca -0.16 0.29 0.02 0.00 -0.77 0.00 0.00 57.85 57.22 2q94 n ARG 189 Cb 0.57 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.48 2q94 n ARG 189 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2q94 h GLU 190 N 0.00 0.00 -6.24 5.56 4.81 -2.01 -3.46 114.58 113.25 2q94 h GLU 190 Ca 0.00 0.00 -0.56 0.00 -0.13 0.00 0.00 59.36 58.67 2q94 h GLU 190 Cb 0.20 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 2q94 h GLU 190 CO 0.00 0.36 0.84 0.99 -0.73 0.00 0.00 179.01 180.47 2q94 s THR 191 N -2.97 4.17 -0.45 0.32 2.01 -0.99 -4.95 115.64 112.77 2q94 s THR 191 Ca 0.00 1.46 0.06 0.00 0.31 0.00 0.00 61.69 63.52 2q94 s THR 191 Cb 0.08 -3.94 0.18 0.00 0.01 0.00 0.00 72.50 68.83 2q94 s THR 191 CO 0.78 -0.07 0.55 0.21 -0.69 0.00 0.00 174.62 175.40 2q94 s ASN 192 N 1.88 -0.17 -0.12 3.53 3.84 -1.26 -4.61 114.94 118.02 2q94 s ASN 192 Ca 0.57 -2.04 -0.02 0.00 0.21 0.00 0.00 52.86 51.58 2q94 s ASN 192 Cb -0.24 0.98 0.04 0.00 -0.55 0.00 0.00 41.25 41.48 2q94 s ASN 192 CO 0.19 -0.13 0.03 -0.69 -2.79 0.00 0.00 177.10 173.71 2q94 s VAL 193 N 0.79 0.36 -0.20 -5.21 1.01 -1.26 -5.02 120.40 110.87 2q94 s VAL 193 Ca 0.28 -0.14 -0.18 0.00 0.00 0.00 0.00 61.98 61.94 2q94 s VAL 193 Cb -0.02 -0.70 -0.03 0.00 0.00 0.00 0.00 36.38 35.63 2q94 s VAL 193 CO -0.09 0.03 0.48 -0.69 0.00 0.00 0.00 175.10 174.83 2q94 s VAL 194 N 1.96 5.13 0.50 2.92 1.01 -1.26 -0.90 120.40 129.75 2q94 s VAL 194 Ca 0.03 0.88 -0.23 0.00 0.00 0.00 0.00 61.98 62.66 2q94 s VAL 194 Cb -0.14 -3.81 -0.06 0.00 0.00 0.00 0.00 36.38 32.36 2q94 s VAL 194 CO -0.07 0.20 1.31 -0.76 0.00 0.00 0.00 175.10 175.79 2q94 s LEU 195 N 1.52 3.97 0.03 3.92 1.02 -0.16 -4.84 118.68 124.14 2q94 s LEU 195 Ca 0.23 2.66 0.02 0.00 0.02 0.00 0.00 54.13 57.06 2q94 s LEU 195 Cb -0.15 -4.18 -0.02 0.00 0.02 0.00 0.00 46.19 41.86 2q94 s LEU 195 CO 0.09 -1.28 -0.08 -0.54 0.02 0.00 0.00 176.35 174.57 2q94 s LYS 196 N -2.72 0.55 0.41 1.70 1.02 -1.26 -1.55 119.74 117.89 2q94 s LYS 196 Ca 0.66 -0.65 -0.27 0.00 0.02 0.00 0.00 55.97 55.74 2q94 s LYS 196 Cb -0.38 -0.39 -0.10 0.00 -0.52 0.00 0.00 37.83 36.44 2q94 s LYS 196 CO 0.46 0.08 1.42 -2.30 -0.92 0.00 0.00 175.35 174.09 2q94 n PRO 197 N 1.79 2.35 0.00 -1.68 -0.02 -1.26 -2.62 135.00 133.56 2q94 n PRO 197 Ca -0.20 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2q94 n PRO 197 Cb 0.55 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 2q94 n PRO 197 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q94 n GLY 198 N 0.58 1.99 3.76 -1.23 0.00 0.74 -4.87 105.19 106.17 2q94 n GLY 198 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2q94 n GLY 198 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2q94 s MET 199 N -0.78 4.53 -0.10 1.61 -1.94 -1.08 -1.69 119.30 119.85 2q94 s MET 199 Ca 0.00 1.94 0.02 0.00 -1.71 0.00 0.00 55.69 55.94 2q94 s MET 199 Cb 0.00 -3.17 0.01 0.00 2.01 0.00 0.00 34.83 33.69 2q94 s MET 199 CO 0.00 0.03 -0.16 0.95 -0.01 0.00 0.00 175.02 175.83 2q94 s THR 200 N -0.91 1.50 0.36 2.05 -4.23 -1.26 -0.37 115.64 112.79 2q94 s THR 200 Ca 0.48 -0.65 -0.10 0.00 -1.18 0.00 0.00 61.69 60.23 2q94 s THR 200 Cb -0.34 -1.37 0.03 0.00 1.34 0.00 0.00 72.50 72.16 2q94 s THR 200 CO 0.43 0.44 0.66 0.72 -0.54 0.00 0.00 174.62 176.33 2q94 s PHE 201 N 0.91 0.49 0.27 3.99 -0.12 -0.82 -1.44 117.98 121.26 2q94 s PHE 201 Ca -0.08 -0.98 0.10 0.00 -0.05 0.00 0.00 56.93 55.92 2q94 s PHE 201 Cb -0.15 0.45 -0.04 0.00 -0.63 0.00 0.00 43.02 42.65 2q94 s PHE 201 CO -0.00 -1.38 -0.05 0.95 -0.05 0.00 0.00 175.22 174.69 2q94 s THR 202 N -2.70 3.22 -0.07 -4.49 -4.23 0.13 -0.88 115.64 106.62 2q94 s THR 202 Ca 0.21 -2.02 0.01 0.00 -1.18 0.00 0.00 61.69 58.72 2q94 s THR 202 Cb -0.03 -2.71 0.02 0.00 1.34 0.00 0.00 72.50 71.12 2q94 s THR 202 CO 0.15 -0.37 -0.08 -0.63 -0.54 0.00 0.00 174.62 173.15 2q94 s ILE 203 N -2.34 0.85 -0.45 2.99 1.01 -1.05 -3.41 121.20 118.80 2q94 s ILE 203 Ca 0.31 -0.27 0.07 0.00 0.00 0.00 0.00 60.65 60.76 2q94 s ILE 203 Cb -0.06 -0.84 0.29 0.00 0.01 0.00 0.00 42.46 41.86 2q94 s ILE 203 CO 0.19 0.31 0.92 -1.84 0.00 0.00 0.00 174.94 174.51 2q94 n GLU 204 N 4.26 0.89 -1.78 2.79 0.28 -1.26 -2.42 120.64 123.39 2q94 n GLU 204 Ca -0.20 -2.20 -0.41 0.00 -0.16 0.00 0.00 57.16 54.19 2q94 n GLU 204 Cb 0.51 -1.30 -0.01 0.00 1.43 0.00 0.00 31.44 32.08 2q94 n GLU 204 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 2q94 s PRO 205 N -0.10 4.10 -0.23 3.44 0.04 -1.24 -4.79 135.00 136.21 2q94 s PRO 205 Ca 0.29 2.59 -0.06 0.00 0.04 0.00 0.00 61.00 63.86 2q94 s PRO 205 Cb 0.26 -2.98 -0.02 0.00 0.04 0.00 0.00 34.50 31.80 2q94 s PRO 205 CO -0.13 -0.58 0.02 -1.64 0.04 0.00 0.00 177.00 174.71 2q94 s MET 206 N -1.63 3.55 -0.08 4.56 -1.94 -1.26 -3.67 119.30 118.83 2q94 s MET 206 Ca 0.56 -0.54 0.05 0.00 -1.71 0.00 0.00 55.69 54.05 2q94 s MET 206 Cb -0.47 -3.18 -0.01 0.00 2.01 0.00 0.00 34.83 33.18 2q94 s MET 206 CO 0.59 -0.17 -0.24 0.08 -0.01 0.00 0.00 175.02 175.26 2q94 s VAL 207 N 1.50 2.05 -0.01 -6.03 1.01 0.53 -1.41 120.40 118.05 2q94 s VAL 207 Ca 0.06 -1.04 -0.00 0.00 0.00 0.00 0.00 61.98 60.99 2q94 s VAL 207 Cb -0.15 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 2q94 s VAL 207 CO 0.01 0.56 0.08 0.20 0.00 0.00 0.00 175.10 175.95 2q94 s ASN 208 N 0.09 5.65 0.20 3.32 0.01 0.21 -0.11 114.94 124.30 2q94 s ASN 208 Ca -0.11 0.14 0.03 0.00 -0.71 0.00 0.00 52.86 52.20 2q94 s ASN 208 Cb -0.16 -1.62 0.12 0.00 0.41 0.00 0.00 41.25 40.00 2q94 s ASN 208 CO 0.06 0.27 1.47 0.00 -1.51 0.00 0.00 177.10 177.40 2q94 h ALA 209 N 4.12 0.68 -3.00 0.60 0.00 -0.98 -1.21 119.26 119.48 2q94 h ALA 209 Ca -0.49 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 53.80 2q94 h ALA 209 Cb 1.18 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2q94 h ALA 209 CO 0.62 0.80 0.00 0.41 0.00 0.00 0.00 179.25 181.08 2q94 n GLY 210 N 0.54 1.04 3.83 0.00 0.00 -1.26 -4.56 105.19 104.78 2q94 n GLY 210 Ca -0.03 -0.36 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 2q94 n GLY 210 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q94 s LYS 211 N 4.21 3.40 0.34 1.61 1.02 -1.26 -3.97 119.74 125.09 2q94 s LYS 211 Ca 0.00 0.96 0.17 0.00 0.02 0.00 0.00 55.97 57.11 2q94 s LYS 211 Cb 0.00 -2.05 0.54 0.00 -0.52 0.00 0.00 37.83 35.80 2q94 s LYS 211 CO 0.00 -0.73 1.67 1.57 -0.92 0.00 0.00 175.35 176.94 2q94 h LYS 212 N -0.03 0.00 -6.74 1.68 2.10 -1.90 -3.45 116.57 108.23 2q94 h LYS 212 Ca -0.45 0.00 -0.57 0.00 -2.00 0.00 0.00 60.65 57.63 2q94 h LYS 212 Cb 1.20 0.00 0.10 0.00 -0.90 0.00 0.00 32.23 32.64 2q94 h LYS 212 CO 0.59 0.45 0.56 0.39 -2.00 0.00 0.00 179.45 179.44 2q94 n GLU 213 N -3.55 2.18 -4.59 0.07 4.71 -1.26 -4.71 120.64 113.50 2q94 n GLU 213 Ca -0.00 0.77 -0.27 0.00 -0.01 0.00 0.00 57.16 57.65 2q94 n GLU 213 Cb 0.56 -2.38 -0.10 0.00 -1.01 0.00 0.00 31.44 28.51 2q94 n GLU 213 CO 0.00 0.00 0.00 0.96 0.09 0.00 0.00 177.13 178.18 2q94 s ILE 214 N -0.89 1.56 -0.03 -3.67 -4.36 -1.26 -0.55 121.20 112.00 2q94 s ILE 214 Ca 0.57 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.95 2q94 s ILE 214 Cb -0.57 -2.78 0.02 0.00 1.25 0.00 0.00 42.46 40.38 2q94 s ILE 214 CO 0.60 0.00 0.07 -0.13 0.24 0.00 0.00 174.94 175.72 2q94 s ARG 215 N -3.79 0.05 -0.17 0.37 1.81 0.11 -4.56 118.95 112.78 2q94 s ARG 215 Ca 0.30 0.15 -0.10 0.00 -1.72 0.00 0.00 55.73 54.37 2q94 s ARG 215 Cb 0.08 -0.05 -0.05 0.00 -0.45 0.00 0.00 34.95 34.48 2q94 s ARG 215 CO 0.15 -0.06 0.15 0.99 -0.68 0.00 0.00 175.30 175.85 2q94 s THR 216 N 0.40 5.42 0.46 0.02 2.01 -1.26 -0.07 115.64 122.62 2q94 s THR 216 Ca -0.03 0.23 -0.08 0.00 0.31 0.00 0.00 61.69 62.12 2q94 s THR 216 Cb -0.04 -3.47 0.11 0.00 0.01 0.00 0.00 72.50 69.11 2q94 s THR 216 CO -0.01 0.49 0.43 0.23 -0.69 0.00 0.00 174.62 175.06 2q94 n MET 217 N 3.09 -1.69 -0.08 4.92 0.00 0.10 -4.95 117.12 118.51 2q94 n MET 217 Ca -0.17 -0.68 0.11 0.00 0.00 0.00 0.00 57.70 56.95 2q94 n MET 217 Cb 0.53 -0.62 0.37 0.00 0.00 0.00 0.00 33.22 33.50 2q94 n MET 217 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2q94 n LYS 218 N -2.71 1.76 -0.06 0.03 4.76 -1.26 -3.63 118.16 117.05 2q94 n LYS 218 Ca 0.06 -1.14 0.12 0.00 -2.87 0.00 0.00 58.31 54.48 2q94 n LYS 218 Cb 0.23 -1.40 0.36 0.00 -1.84 0.00 0.00 35.03 32.37 2q94 n LYS 218 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2q94 n ASP 219 N 0.37 2.10 0.00 4.39 5.68 -1.26 -4.93 116.55 122.89 2q94 n ASP 219 Ca 0.16 -1.73 0.00 0.00 -0.50 0.00 0.00 54.79 52.72 2q94 n ASP 219 Cb 0.34 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.25 2q94 n ASP 219 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2q94 n GLY 220 N 1.24 0.42 2.00 6.12 0.00 -1.24 -4.79 105.19 108.95 2q94 n GLY 220 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2q94 n GLY 220 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2q94 n TRP 221 N -2.80 -0.66 -1.67 1.61 7.02 -1.26 -5.04 117.44 114.64 2q94 n TRP 221 Ca 0.00 0.10 -0.47 0.00 -1.02 0.00 0.00 57.50 56.11 2q94 n TRP 221 Cb 0.09 0.57 -0.04 0.00 -2.42 0.00 0.00 31.31 29.50 2q94 n TRP 221 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 2q94 n THR 222 N -2.67 0.24 -5.02 -0.99 -1.04 -1.25 -4.69 114.28 98.85 2q94 n THR 222 Ca 0.00 -0.04 -0.32 0.00 -2.04 0.00 0.00 64.05 61.64 2q94 n THR 222 Cb 0.00 -1.65 -0.16 0.00 -1.82 0.00 0.00 70.33 66.70 2q94 n THR 222 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2q94 s VAL 223 N 2.20 2.54 0.29 12.58 1.01 -1.07 0.03 120.40 137.98 2q94 s VAL 223 Ca 0.85 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 62.03 2q94 s VAL 223 Cb -0.69 -2.01 -0.06 0.00 0.00 0.00 0.00 36.38 33.61 2q94 s VAL 223 CO 0.44 0.55 -0.04 -0.54 0.00 0.00 0.00 175.10 175.51 2q94 s LYS 224 N 0.23 1.59 0.31 2.72 1.02 0.90 0.57 119.74 127.08 2q94 s LYS 224 Ca -0.12 -1.82 -0.28 0.00 0.02 0.00 0.00 55.97 53.76 2q94 s LYS 224 Cb -0.16 -1.14 -0.09 0.00 -0.52 0.00 0.00 37.83 35.92 2q94 s LYS 224 CO 0.07 -0.00 1.06 0.95 -0.92 0.00 0.00 175.35 176.51 2q94 s THR 225 N -3.04 3.64 0.19 2.17 -4.23 -0.73 0.09 115.64 113.73 2q94 s THR 225 Ca 0.31 1.53 -0.12 0.00 -1.18 0.00 0.00 61.69 62.23 2q94 s THR 225 Cb 0.05 -3.93 0.11 0.00 1.34 0.00 0.00 72.50 70.07 2q94 s THR 225 CO 0.13 0.28 1.84 0.50 -0.54 0.00 0.00 174.62 176.83 2q94 h LYS 226 N 3.49 0.77 -0.01 3.99 3.64 -1.07 -1.60 116.57 125.78 2q94 h LYS 226 Ca -0.47 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2q94 h LYS 226 Cb 1.21 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 2q94 h LYS 226 CO 0.66 0.51 0.00 -0.40 -2.27 0.00 0.00 179.45 177.95 2q94 n ASP 227 N -4.69 0.71 -1.82 4.20 5.68 -1.26 -4.92 116.55 114.44 2q94 n ASP 227 Ca 0.06 -1.26 -0.16 0.00 -0.50 0.00 0.00 54.79 52.92 2q94 n ASP 227 Cb 0.06 -0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.03 2q94 n ASP 227 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2q94 n ARG 228 N -0.43 -1.46 -2.29 0.11 5.12 -0.60 -5.02 116.66 112.09 2q94 n ARG 228 Ca 0.21 0.75 -0.27 0.00 -1.93 0.00 0.00 57.85 56.61 2q94 n ARG 228 Cb 0.22 -5.12 0.04 0.00 -1.16 0.00 0.00 32.46 26.44 2q94 n ARG 228 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2q94 s SER 229 N -2.34 5.53 0.65 0.55 1.04 -1.26 -4.77 113.70 113.10 2q94 s SER 229 Ca 0.02 0.78 -0.17 0.00 0.48 0.00 0.00 55.95 57.06 2q94 s SER 229 Cb -0.01 -1.72 -0.00 0.00 0.10 0.00 0.00 66.02 64.39 2q94 s SER 229 CO 0.02 -1.14 1.18 -0.76 0.98 0.00 0.00 173.24 173.52 2q94 s LEU 230 N -5.07 3.48 -0.01 2.42 1.43 -1.26 -4.26 118.68 115.41 2q94 s LEU 230 Ca 0.55 2.26 -0.01 0.00 -1.03 0.00 0.00 54.13 55.91 2q94 s LEU 230 Cb -0.11 -4.58 0.00 0.00 0.03 0.00 0.00 46.19 41.53 2q94 s LEU 230 CO 0.46 -1.81 0.02 -0.55 0.23 0.00 0.00 176.35 174.70 2q94 s SER 231 N -2.01 -0.01 0.10 2.29 0.15 -0.61 -0.33 113.70 113.29 2q94 s SER 231 Ca 0.73 0.02 0.03 0.00 0.70 0.00 0.00 55.95 57.44 2q94 s SER 231 Cb -0.27 0.04 -0.04 0.00 -1.71 0.00 0.00 66.02 64.04 2q94 s SER 231 CO 0.39 -0.02 -0.09 0.00 1.20 0.00 0.00 173.24 174.72 2q94 s ALA 232 N -0.04 1.09 -0.06 5.45 0.00 0.84 -4.73 121.76 124.30 2q94 s ALA 232 Ca -0.01 -1.25 -0.16 0.00 0.00 0.00 0.00 51.96 50.54 2q94 s ALA 232 Cb -0.00 0.07 0.03 0.00 0.00 0.00 0.00 23.12 23.22 2q94 s ALA 232 CO 0.00 -0.10 0.38 -1.14 0.00 0.00 0.00 175.76 174.90 2q94 s GLN 233 N -3.17 0.64 0.01 0.00 0.74 -1.26 -0.35 119.66 116.27 2q94 s GLN 233 Ca 0.08 0.11 0.01 0.00 0.05 0.00 0.00 55.36 55.60 2q94 s GLN 233 Cb -0.00 0.30 -0.01 0.00 1.10 0.00 0.00 33.01 34.40 2q94 s GLN 233 CO -0.01 -0.16 -0.03 0.71 -0.55 0.00 0.00 175.29 175.25 2q94 s TYR 234 N -0.79 0.23 -0.02 1.67 1.51 -1.24 -4.01 117.35 114.70 2q94 s TYR 234 Ca -0.09 -0.19 -0.03 0.00 -1.01 0.00 0.00 57.07 55.75 2q94 s TYR 234 Cb -0.04 -0.15 0.00 0.00 -0.11 0.00 0.00 41.96 41.66 2q94 s TYR 234 CO 0.04 -0.05 0.07 -2.00 -1.11 0.00 0.00 175.55 172.50 2q94 s GLU 235 N -0.53 0.21 0.02 -0.62 2.12 -0.62 -3.72 118.70 115.56 2q94 s GLU 235 Ca -0.04 -0.12 0.00 0.00 0.36 0.00 0.00 54.97 55.17 2q94 s GLU 235 Cb -0.04 0.09 -0.02 0.00 0.26 0.00 0.00 34.13 34.42 2q94 s GLU 235 CO -0.00 -0.04 -0.03 -1.01 -0.54 0.00 0.00 175.26 173.63 2q94 s HIS 236 N -0.51 0.30 -0.15 5.30 3.76 -1.02 -2.61 115.29 120.37 2q94 s HIS 236 Ca -0.06 -0.43 -0.07 0.00 -0.15 0.00 0.00 55.06 54.35 2q94 s HIS 236 Cb -0.04 -0.20 -0.04 0.00 1.11 0.00 0.00 32.58 33.41 2q94 s HIS 236 CO 0.00 -0.14 0.10 0.99 -0.85 0.00 0.00 174.74 174.85 2q94 s THR 237 N -1.19 5.19 0.21 1.30 2.01 -1.19 -2.54 115.64 119.43 2q94 s THR 237 Ca -0.12 0.10 0.01 0.00 0.31 0.00 0.00 61.69 61.99 2q94 s THR 237 Cb -0.08 -3.29 -0.05 0.00 0.01 0.00 0.00 72.50 69.09 2q94 s THR 237 CO -0.01 0.55 0.07 0.27 -0.69 0.00 0.00 174.62 174.81 2q94 s ILE 238 N -0.42 0.46 -0.06 1.82 -4.36 -0.06 -1.09 121.20 117.50 2q94 s ILE 238 Ca 0.11 -1.99 0.03 0.00 -0.26 0.00 0.00 60.65 58.54 2q94 s ILE 238 Cb -0.12 -2.41 0.01 0.00 1.25 0.00 0.00 42.46 41.19 2q94 s ILE 238 CO 0.02 -0.18 -0.13 0.54 0.24 0.00 0.00 174.94 175.43 2q94 s VAL 239 N -3.82 1.16 0.00 8.37 0.11 -0.85 -1.95 120.40 123.43 2q94 s VAL 239 Ca 0.33 -0.52 -0.30 0.00 -2.93 0.00 0.00 61.98 58.56 2q94 s VAL 239 Cb 0.07 -1.04 -0.04 0.00 -1.53 0.00 0.00 36.38 33.85 2q94 s VAL 239 CO 0.10 0.35 1.04 -0.69 -3.33 0.00 0.00 175.10 172.57 2q94 s VAL 240 N 0.47 4.64 0.18 2.04 1.01 0.50 -1.49 120.40 127.75 2q94 s VAL 240 Ca -0.11 1.89 0.03 0.00 0.00 0.00 0.00 61.98 63.79 2q94 s VAL 240 Cb -0.14 -4.21 0.03 0.00 0.00 0.00 0.00 36.38 32.06 2q94 s VAL 240 CO 0.03 0.13 0.25 0.35 0.00 0.00 0.00 175.10 175.86 2q94 n THR 241 N 3.98 0.00 0.19 3.92 -2.24 0.14 -0.18 114.28 120.09 2q94 n THR 241 Ca 0.07 -0.59 0.03 0.00 -2.27 0.00 0.00 64.05 61.30 2q94 n THR 241 Cb 0.50 -0.89 0.41 0.00 -2.10 0.00 0.00 70.33 68.25 2q94 n THR 241 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2q94 h ASP 242 N 0.01 0.02 0.00 3.42 3.32 -1.97 -3.29 116.42 117.93 2q94 h ASP 242 Ca -0.09 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 2q94 h ASP 242 Cb 0.38 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 2q94 h ASP 242 CO 0.12 0.31 -0.33 -0.46 -1.72 0.00 0.00 179.24 177.16 2q94 n ASN 243 N -4.19 1.13 0.00 6.45 6.94 -1.26 -4.61 115.26 119.73 2q94 n ASN 243 Ca -0.02 -2.56 0.00 0.00 -0.02 0.00 0.00 54.58 51.98 2q94 n ASN 243 Cb 0.34 -0.32 0.00 0.00 -2.36 0.00 0.00 39.78 37.44 2q94 n ASN 243 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2q94 n GLY 244 N -0.63 -0.51 3.66 4.83 0.00 -1.24 -2.06 105.19 109.24 2q94 n GLY 244 Ca 0.08 0.09 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 2q94 n GLY 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q94 s GLU 246 N -3.90 1.62 -0.33 0.00 2.12 -0.56 -1.26 118.70 116.40 2q94 s GLU 246 Ca 0.11 -0.35 -0.28 0.00 0.36 0.00 0.00 54.97 54.81 2q94 s GLU 246 Cb -0.03 -1.47 0.02 0.00 0.26 0.00 0.00 34.13 32.91 2q94 s GLU 246 CO 0.02 -0.09 1.04 0.42 -0.54 0.00 0.00 175.26 176.10 2q94 s ILE 247 N 1.08 4.53 -0.67 -3.70 1.01 0.76 -2.00 121.20 122.21 2q94 s ILE 247 Ca -0.07 1.63 0.25 0.00 0.00 0.00 0.00 60.65 62.46 2q94 s ILE 247 Cb -0.14 -4.39 0.17 0.00 0.01 0.00 0.00 42.46 38.11 2q94 s ILE 247 CO -0.01 -0.48 1.54 -0.07 0.00 0.00 0.00 174.94 175.92 2q94 h LEU 248 N 10.06 0.00 -3.18 2.97 3.38 -1.43 -3.34 115.31 123.76 2q94 h LEU 248 Ca -0.21 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.56 2q94 h LEU 248 Cb 1.06 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.76 2q94 h LEU 248 CO 1.02 0.05 -0.28 0.35 0.09 0.00 0.00 178.44 179.67 2q94 n THR 249 N -2.22 2.39 -1.92 0.22 -2.24 -1.23 -2.76 114.28 106.52 2q94 n THR 249 Ca 0.04 -2.98 -0.40 0.00 -2.27 0.00 0.00 64.05 58.45 2q94 n THR 249 Cb 0.44 -0.28 0.01 0.00 -2.10 0.00 0.00 70.33 68.39 2q94 n THR 249 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2q94 s LEU 250 N -3.24 4.15 0.34 3.22 2.96 -1.26 -4.63 118.68 120.23 2q94 s LEU 250 Ca 0.41 2.78 0.09 0.00 -0.22 0.00 0.00 54.13 57.20 2q94 s LEU 250 Cb 0.39 -3.93 -0.05 0.00 0.50 0.00 0.00 46.19 43.09 2q94 s LEU 250 CO -0.03 -1.03 0.00 -0.13 -1.32 0.00 0.00 176.35 173.84 2q94 s ARG 251 N -2.37 2.05 0.48 1.98 0.52 -1.26 -4.89 118.95 115.46 2q94 s ARG 251 Ca 0.59 -1.77 0.13 0.00 -0.52 0.00 0.00 55.73 54.17 2q94 s ARG 251 Cb -0.41 -1.91 1.12 0.00 0.52 0.00 0.00 34.95 34.27 2q94 s ARG 251 CO 0.52 0.14 2.10 1.57 0.02 0.00 0.00 175.30 179.65 2q94 h LYS 252 N 1.83 0.16 -0.00 3.54 2.10 -1.96 -1.93 116.57 120.31 2q94 h LYS 252 Ca -0.43 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 2q94 h LYS 252 Cb 1.25 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 2q94 h LYS 252 CO 0.67 0.13 -0.17 -0.40 -2.00 0.00 0.00 179.45 177.68 2q94 n ASP 253 N -4.50 0.56 -4.75 7.07 5.75 -1.26 -4.87 116.55 114.55 2q94 n ASP 253 Ca -0.01 -0.53 -0.41 0.00 -0.01 0.00 0.00 54.79 53.83 2q94 n ASP 253 Cb 0.10 -0.03 -0.02 0.00 -1.03 0.00 0.00 41.12 40.14 2q94 n ASP 253 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 2q94 s ASP 254 N -2.58 6.71 -0.67 -1.12 1.01 -0.73 -4.91 116.67 114.38 2q94 s ASP 254 Ca 0.25 2.65 0.00 0.00 0.71 0.00 0.00 52.55 56.16 2q94 s ASP 254 Cb 0.19 -2.63 0.40 0.00 1.01 0.00 0.00 42.92 41.90 2q94 s ASP 254 CO 0.51 -0.64 1.79 0.35 0.21 0.00 0.00 175.17 177.40 2q94 n THR 255 N 1.90 3.30 -3.73 -1.27 -2.24 -1.26 -4.91 114.28 106.07 2q94 n THR 255 Ca 0.05 -4.00 -0.13 0.00 -2.27 0.00 0.00 64.05 57.69 2q94 n THR 255 Cb 0.41 -1.21 -0.10 0.00 -2.10 0.00 0.00 70.33 67.33 2q94 n THR 255 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2q94 s ILE 256 N -5.03 0.01 0.54 2.28 2.07 -1.26 -5.16 121.20 114.65 2q94 s ILE 256 Ca 0.55 -0.07 -0.20 0.00 -1.41 0.00 0.00 60.65 59.52 2q94 s ILE 256 Cb 0.45 -0.61 -0.05 0.00 0.13 0.00 0.00 42.46 42.38 2q94 s ILE 256 CO -0.22 -0.04 1.21 -2.16 -1.91 0.00 0.00 174.94 171.83 2q94 s PRO 257 N -0.05 3.26 0.12 3.50 0.04 -1.26 -4.96 135.00 135.65 2q94 s PRO 257 Ca -0.02 1.85 -0.17 0.00 0.04 0.00 0.00 61.00 62.70 2q94 s PRO 257 Cb -0.03 -2.12 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 2q94 s PRO 257 CO 0.01 -0.98 1.68 0.00 0.04 0.00 0.00 177.00 177.75 2q94 h ALA 258 N 1.33 0.42 -2.98 8.56 0.00 -1.97 -3.41 119.26 121.22 2q94 h ALA 258 Ca -0.50 -0.11 -0.64 0.00 0.00 0.00 0.00 54.91 53.65 2q94 h ALA 258 Cb 1.28 -0.13 -0.20 0.00 0.00 0.00 0.00 17.79 18.75 2q94 h ALA 258 CO 0.57 0.01 -0.58 0.42 0.00 0.00 0.00 179.25 179.67 2q94 s ILE 259 N -5.62 4.74 -0.42 0.00 1.01 -1.26 -0.17 121.20 119.48 2q94 s ILE 259 Ca -0.13 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.43 2q94 s ILE 259 Cb 0.09 -3.22 0.10 0.00 0.01 0.00 0.00 42.46 39.44 2q94 s ILE 259 CO 0.73 0.33 0.24 -0.63 0.00 0.00 0.00 174.94 175.61 2q94 s ILE 260 N 1.48 3.74 0.03 2.92 1.01 -0.39 -5.03 121.20 124.96 2q94 s ILE 260 Ca 0.06 -1.76 -0.02 0.00 0.00 0.00 0.00 60.65 58.93 2q94 s ILE 260 Cb -0.15 -3.43 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 2q94 s ILE 260 CO 0.06 -0.62 0.22 -0.44 0.00 0.00 0.00 174.94 174.16 2q94 s SER 261 N 2.07 6.39 0.00 3.58 0.01 -1.26 -2.45 113.70 122.05 2q94 s SER 261 Ca 0.05 0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.68 2q94 s SER 261 Cb -0.23 -2.00 0.01 0.00 0.21 0.00 0.00 66.02 64.00 2q94 s SER 261 CO -0.01 0.21 0.97 1.41 0.41 0.00 0.00 173.24 176.22 2q94 n HIS 262 N 0.63 0.02 0.00 2.43 8.25 -0.87 -5.01 115.22 120.67 2q94 n HIS 262 Ca -0.08 -0.45 0.00 0.00 -0.26 0.00 0.00 57.72 56.93 2q94 n HIS 262 Cb 0.52 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.58 2q94 n HIS 262 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73