#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p92 n LYS 2 N 0.00 0.43 0.00 0.03 4.81 -1.26 -4.65 118.16 117.52 1p92 n LYS 2 Ca 0.00 -1.27 0.00 0.00 -0.87 0.00 0.00 58.31 56.17 1p92 n LYS 2 Cb 0.00 -0.82 0.00 0.00 0.02 0.00 0.00 35.03 34.23 1p92 n LYS 2 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1p92 n ASP 3 N 1.84 0.00 0.00 3.14 2.03 -1.26 -4.90 116.55 117.41 1p92 n ASP 3 Ca 0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.38 1p92 n ASP 3 Cb 0.65 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.05 1p92 n ASP 3 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1p92 n LEU 4 N 0.00 0.00 -0.02 -2.67 7.94 -1.26 -4.89 117.00 116.10 1p92 n LEU 4 Ca 0.00 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.75 1p92 n LEU 4 Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 1p92 n LEU 4 CO 0.00 0.00 0.33 0.58 -1.11 0.00 0.00 177.39 177.19 1p92 h VAL 5 N 0.00 1.30 0.00 1.96 2.07 -1.94 -2.76 116.25 116.87 1p92 h VAL 5 Ca 0.00 -1.95 0.00 0.00 0.82 0.00 0.00 66.70 65.57 1p92 h VAL 5 Cb 0.00 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1p92 h VAL 5 CO 0.00 0.61 0.00 -2.24 0.02 0.00 0.00 177.57 175.96 1p92 h ASP 6 N 0.51 0.00 -0.19 0.57 2.03 -1.90 -1.13 116.42 116.31 1p92 h ASP 6 Ca -0.03 0.00 -0.09 0.00 -0.73 0.00 0.00 57.03 56.18 1p92 h ASP 6 Cb 1.33 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.82 1p92 h ASP 6 CO 0.14 0.00 -0.22 0.74 -1.03 0.00 0.00 179.24 178.87 1p92 h THR 7 N 0.00 1.34 -0.39 1.15 2.02 -1.85 -0.00 112.91 115.18 1p92 h THR 7 Ca 0.00 -1.40 0.04 0.00 0.77 0.00 0.00 66.41 65.82 1p92 h THR 7 Cb 0.63 1.82 -0.04 0.00 -1.74 0.00 0.00 68.15 68.82 1p92 h THR 7 CO 0.00 0.43 0.17 0.74 0.37 0.00 0.00 175.52 177.22 1p92 h THR 8 N 0.14 0.93 -0.92 3.16 2.02 -1.19 -0.21 112.91 116.84 1p92 h THR 8 Ca 0.03 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 1p92 h THR 8 Cb 0.78 0.55 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 1p92 h THR 8 CO 0.05 0.06 0.52 -0.33 0.37 0.00 0.00 175.52 176.20 1p92 h GLU 9 N 0.34 1.27 -0.51 6.66 5.08 -1.04 -0.91 114.58 125.47 1p92 h GLU 9 Ca 0.18 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1p92 h GLU 9 Cb 0.12 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 1p92 h GLU 9 CO -0.15 0.91 0.22 0.52 -1.00 0.00 0.00 179.01 179.51 1p92 h MET 10 N 1.28 0.75 -0.66 2.33 2.86 -0.15 -0.73 114.93 120.62 1p92 h MET 10 Ca 0.33 -0.13 -0.03 0.00 -2.06 0.00 0.00 59.70 57.81 1p92 h MET 10 Cb -0.01 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.49 1p92 h MET 10 CO -0.06 0.65 0.30 1.88 1.06 0.00 0.00 176.91 180.74 1p92 h TYR 11 N 0.69 0.96 -0.50 -0.22 -1.99 -0.56 -1.51 116.97 113.84 1p92 h TYR 11 Ca 0.17 -0.05 -0.07 0.00 2.00 0.00 0.00 58.73 60.78 1p92 h TYR 11 Cb 0.16 -0.29 -0.02 0.00 2.00 0.00 0.00 36.73 38.57 1p92 h TYR 11 CO 0.00 0.73 0.04 -0.07 -0.00 0.00 0.00 178.16 178.86 1p92 h LEU 12 N 0.91 0.77 -0.64 3.88 3.38 -0.92 -1.34 115.31 121.36 1p92 h LEU 12 Ca 0.22 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1p92 h LEU 12 Cb 0.14 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1p92 h LEU 12 CO -0.03 0.81 0.02 -0.09 0.09 0.00 0.00 178.44 179.25 1p92 h ARG 13 N 0.76 1.09 -0.43 1.13 2.43 -0.82 -1.76 114.38 116.78 1p92 h ARG 13 Ca 0.15 -0.33 -0.04 0.00 -0.81 0.00 0.00 59.98 58.95 1p92 h ARG 13 Cb 0.41 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 1p92 h ARG 13 CO 0.01 1.04 0.12 1.15 -1.51 0.00 0.00 179.97 180.78 1p92 h THR 14 N 1.00 1.23 -0.56 0.20 2.02 -0.82 -0.22 112.91 115.77 1p92 h THR 14 Ca 0.18 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 1p92 h THR 14 Cb 0.54 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 1p92 h THR 14 CO 0.03 0.27 0.31 0.40 0.37 0.00 0.00 175.52 176.90 1p92 h ILE 15 N 0.55 1.18 -0.45 3.11 2.04 -1.15 -1.65 117.51 121.15 1p92 h ILE 15 Ca 0.14 -0.44 0.03 0.00 1.00 0.00 0.00 64.86 65.58 1p92 h ILE 15 Cb 0.30 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.80 1p92 h ILE 15 CO -0.00 0.19 0.24 0.22 0.00 0.00 0.00 178.15 178.80 1p92 h TYR 16 N 0.75 0.45 -0.61 1.37 3.20 -0.88 -1.82 116.97 119.43 1p92 h TYR 16 Ca 0.20 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 62.02 1p92 h TYR 16 Cb 0.03 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.14 1p92 h TYR 16 CO -0.02 0.24 0.14 0.93 -1.64 0.00 0.00 178.16 177.81 1p92 h GLU 17 N 0.48 0.96 -0.51 1.82 5.08 -0.75 -0.57 114.58 121.10 1p92 h GLU 17 Ca 0.19 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1p92 h GLU 17 Cb 0.06 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1p92 h GLU 17 CO -0.11 0.87 0.21 -0.07 -1.00 0.00 0.00 179.01 178.90 1p92 h LEU 18 N 0.92 0.70 -0.54 1.33 3.38 -0.84 0.17 115.31 120.43 1p92 h LEU 18 Ca 0.19 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1p92 h LEU 18 Cb 0.34 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1p92 h LEU 18 CO 0.00 0.67 0.26 -0.33 0.09 0.00 0.00 178.44 179.14 1p92 h GLU 19 N 0.68 0.77 -0.94 1.13 5.08 -1.03 0.20 114.58 120.47 1p92 h GLU 19 Ca 0.17 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.46 1p92 h GLU 19 Cb 0.19 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.24 1p92 h GLU 19 CO -0.01 0.63 0.62 1.49 -1.00 0.00 0.00 179.01 180.73 1p92 h GLU 20 N 0.72 1.15 -0.00 2.33 4.81 -0.64 -0.68 114.58 122.27 1p92 h GLU 20 Ca 0.18 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1p92 h GLU 20 Cb 0.11 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.23 1p92 h GLU 20 CO -0.02 0.76 -0.04 0.39 -0.73 0.00 0.00 179.01 179.37 1p92 n GLU 21 N -4.44 0.46 -0.84 1.92 1.02 0.56 -4.90 120.64 114.42 1p92 n GLU 21 Ca 0.13 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 1p92 n GLU 21 Cb 0.10 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 1p92 n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1p92 n GLY 22 N 1.30 0.52 3.83 0.62 0.00 -0.26 -5.05 105.19 106.15 1p92 n GLY 22 Ca 0.14 -0.50 -0.37 0.00 0.00 0.00 0.00 46.02 45.28 1p92 n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p92 s VAL 23 N -2.00 5.31 0.10 1.61 1.01 0.61 -5.00 120.40 122.05 1p92 s VAL 23 Ca 0.00 0.48 -0.31 0.00 0.00 0.00 0.00 61.98 62.15 1p92 s VAL 23 Cb 0.00 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.74 1p92 s VAL 23 CO 0.00 0.55 1.55 -0.89 0.00 0.00 0.00 175.10 176.31 1p92 s THR 24 N -0.65 3.02 -1.07 3.92 2.01 -1.26 -3.83 115.64 117.78 1p92 s THR 24 Ca 0.18 0.61 -0.23 0.00 0.31 0.00 0.00 61.69 62.56 1p92 s THR 24 Cb -0.14 -3.39 -0.05 0.00 0.01 0.00 0.00 72.50 68.93 1p92 s THR 24 CO 0.07 0.02 1.90 -2.84 -0.69 0.00 0.00 174.62 173.08 1p92 s PRO 25 N 1.86 2.68 0.12 4.92 0.02 -1.26 -4.96 135.00 138.37 1p92 s PRO 25 Ca 0.70 -0.86 0.02 0.00 0.02 0.00 0.00 61.00 60.89 1p92 s PRO 25 Cb -0.40 -5.19 -0.04 0.00 0.02 0.00 0.00 34.50 28.89 1p92 s PRO 25 CO 0.31 -3.52 0.20 -0.51 -0.33 0.00 0.00 177.00 173.14 1p92 s LEU 26 N 9.86 4.13 0.18 -5.54 1.43 -1.26 -0.51 118.68 126.97 1p92 s LEU 26 Ca 0.67 0.10 -0.13 0.00 -1.03 0.00 0.00 54.13 53.74 1p92 s LEU 26 Cb -0.03 -2.74 0.11 0.00 0.03 0.00 0.00 46.19 43.57 1p92 s LEU 26 CO 0.06 0.11 1.81 0.03 0.23 0.00 0.00 176.35 178.59 1p92 h ARG 27 N 2.64 0.61 -0.64 1.70 3.08 -1.93 -0.82 114.38 119.01 1p92 h ARG 27 Ca -0.47 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.53 1p92 h ARG 27 Cb 1.18 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 31.06 1p92 h ARG 27 CO 0.69 0.40 0.36 0.00 -1.07 0.00 0.00 179.97 180.34 1p92 h ALA 28 N 1.24 1.43 -0.57 0.04 0.00 -1.97 0.22 119.26 119.65 1p92 h ALA 28 Ca 0.22 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1p92 h ALA 28 Cb 0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1p92 h ALA 28 CO -0.10 0.48 0.17 -0.09 0.00 0.00 0.00 179.25 179.71 1p92 h ARG 29 N 0.88 0.89 -0.14 0.00 9.65 -1.78 -1.85 114.38 122.04 1p92 h ARG 29 Ca 0.23 -0.20 -0.12 0.00 -1.10 0.00 0.00 59.98 58.79 1p92 h ARG 29 Cb 0.01 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.45 1p92 h ARG 29 CO -0.04 0.81 -0.44 0.82 2.80 0.00 0.00 179.97 183.92 1p92 h ILE 30 N 0.81 1.32 0.07 1.20 2.04 -0.05 -2.63 117.51 120.25 1p92 h ILE 30 Ca 0.18 -1.60 -0.00 0.00 1.00 0.00 0.00 64.86 64.44 1p92 h ILE 30 Cb 0.29 1.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 1p92 h ILE 30 CO -0.00 0.48 -0.03 0.00 0.00 0.00 0.00 178.15 178.60 1p92 h ALA 31 N 1.28 -0.09 -0.51 1.87 0.00 -0.01 -2.06 119.26 119.74 1p92 h ALA 31 Ca 0.02 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 1p92 h ALA 31 Cb 0.88 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1p92 h ALA 31 CO 0.07 -0.43 -0.14 1.05 0.00 0.00 0.00 179.25 179.80 1p92 h GLU 32 N -0.32 0.99 -0.93 0.00 4.11 -1.39 0.12 114.58 117.16 1p92 h GLU 32 Ca -0.01 -0.38 0.13 0.00 0.07 0.00 0.00 59.36 59.17 1p92 h GLU 32 Cb 0.28 -0.05 -0.09 0.00 0.50 0.00 0.00 28.75 29.39 1p92 h GLU 32 CO 0.01 1.06 0.54 -0.09 0.07 0.00 0.00 179.01 180.61 1p92 h ARG 33 N 0.85 0.79 -0.07 1.06 9.65 -1.43 -1.26 114.38 123.97 1p92 h ARG 33 Ca 0.13 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.96 1p92 h ARG 33 Cb 0.70 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 29.11 1p92 h ARG 33 CO 0.05 0.52 0.00 1.28 2.80 0.00 0.00 179.97 184.62 1p92 n LEU 34 N -4.74 2.72 -3.71 3.80 4.77 -0.78 -4.96 117.00 114.10 1p92 n LEU 34 Ca 0.18 -0.95 -0.23 0.00 -0.03 0.00 0.00 56.01 54.99 1p92 n LEU 34 Cb 0.40 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.50 1p92 n LEU 34 CO 0.24 0.47 0.01 -0.62 -1.33 0.00 0.00 177.39 176.17 1p92 n GLU 35 N 1.11 -5.45 -4.53 3.23 1.02 0.29 -4.99 120.64 111.31 1p92 n GLU 35 Ca 0.16 0.65 -0.27 0.00 -0.02 0.00 0.00 57.16 57.68 1p92 n GLU 35 Cb 0.55 -5.37 -0.08 0.00 -0.02 0.00 0.00 31.44 26.52 1p92 n GLU 35 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1p92 s GLN 36 N -6.08 2.01 0.00 3.49 -1.52 -0.45 -5.03 119.66 112.08 1p92 s GLN 36 Ca 0.19 -2.24 0.00 0.00 -1.95 0.00 0.00 55.36 51.36 1p92 s GLN 36 Cb -0.09 -0.58 0.00 0.00 -0.22 0.00 0.00 33.01 32.12 1p92 s GLN 36 CO 0.80 -0.54 0.00 0.45 -0.25 0.00 0.00 175.29 175.75 1p92 n SER 37 N -1.47 0.00 0.00 5.90 2.88 -1.26 -4.47 113.62 115.20 1p92 n SER 37 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1p92 n SER 37 Cb 0.64 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 1p92 n SER 37 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1p92 n GLY 38 N 0.37 0.00 2.48 0.46 0.00 -1.26 -4.60 105.19 102.64 1p92 n GLY 38 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1p92 n GLY 38 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1p92 n PRO 39 N -0.00 1.04 -0.78 1.61 -0.02 -1.26 -5.12 135.00 130.47 1p92 n PRO 39 Ca 0.00 -2.79 -0.34 0.00 -2.02 0.00 0.00 63.50 58.35 1p92 n PRO 39 Cb 0.00 -1.25 0.13 0.00 -0.02 0.00 0.00 33.50 32.36 1p92 n PRO 39 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1p92 n THR 40 N 0.13 0.00 0.22 3.45 -1.04 -1.26 -4.82 114.28 110.97 1p92 n THR 40 Ca 0.14 -0.25 0.09 0.00 -2.04 0.00 0.00 64.05 61.99 1p92 n THR 40 Cb 0.72 -0.48 0.51 0.00 -1.82 0.00 0.00 70.33 69.26 1p92 n THR 40 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1p92 h VAL 41 N -1.68 0.74 -0.38 12.58 2.07 -1.92 -3.16 116.25 124.51 1p92 h VAL 41 Ca -0.48 -1.03 0.07 0.00 0.82 0.00 0.00 66.70 66.08 1p92 h VAL 41 Cb 1.33 1.64 -0.06 0.00 -1.52 0.00 0.00 31.29 32.69 1p92 h VAL 41 CO 0.34 0.24 0.00 -1.28 0.02 0.00 0.00 177.57 176.89 1p92 h SER 42 N 0.00 -0.16 -0.44 0.57 0.87 -1.95 0.69 113.55 113.15 1p92 h SER 42 Ca -0.00 0.09 -0.11 0.00 -1.23 0.00 0.00 61.79 60.53 1p92 h SER 42 Cb 0.63 0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.73 1p92 h SER 42 CO 0.03 -0.04 -0.15 1.56 -0.53 0.00 0.00 176.83 177.70 1p92 h GLN 43 N 0.10 0.92 -0.32 2.24 4.20 -1.89 -1.42 115.11 118.94 1p92 h GLN 43 Ca 0.19 -0.35 -0.14 0.00 0.06 0.00 0.00 58.65 58.41 1p92 h GLN 43 Cb 0.26 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.98 1p92 h GLN 43 CO -0.31 1.00 -0.33 1.15 -0.67 0.00 0.00 178.83 179.66 1p92 h THR 44 N 0.81 1.29 -0.70 -0.54 2.02 -1.42 -2.68 112.91 111.70 1p92 h THR 44 Ca 0.12 -1.51 -0.08 0.00 0.77 0.00 0.00 66.41 65.72 1p92 h THR 44 Cb 0.69 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.59 1p92 h THR 44 CO 0.05 0.49 0.14 0.58 0.37 0.00 0.00 175.52 177.15 1p92 h VAL 45 N 0.57 1.26 -0.24 3.16 2.07 0.46 -1.70 116.25 121.83 1p92 h VAL 45 Ca 0.05 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.54 1p92 h VAL 45 Cb 0.92 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1p92 h VAL 45 CO 0.08 0.39 0.08 0.00 0.02 0.00 0.00 177.57 178.13 1p92 h ALA 46 N 1.08 1.68 -0.33 1.67 0.00 -1.20 -0.49 119.26 121.66 1p92 h ALA 46 Ca 0.22 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 1p92 h ALA 46 Cb 0.41 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1p92 h ALA 46 CO 0.01 0.25 -0.43 -0.09 0.00 0.00 0.00 179.25 178.99 1p92 h ARG 47 N 0.34 0.88 0.00 0.00 9.65 -1.07 -2.57 114.38 121.61 1p92 h ARG 47 Ca 0.08 -0.50 -0.10 0.00 -1.10 0.00 0.00 59.98 58.37 1p92 h ARG 47 Cb 0.11 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.71 1p92 h ARG 47 CO -0.01 1.14 -0.45 0.52 2.80 0.00 0.00 179.97 183.97 1p92 h MET 48 N 0.67 0.00 -0.35 0.20 2.86 -0.43 -2.05 114.93 115.83 1p92 h MET 48 Ca 0.04 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.53 1p92 h MET 48 Cb 1.03 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.68 1p92 h MET 48 CO 0.10 0.45 -0.37 1.49 1.06 0.00 0.00 176.91 179.64 1p92 h GLU 49 N 0.00 0.82 -0.63 1.72 4.81 -1.02 0.25 114.58 120.54 1p92 h GLU 49 Ca -0.00 -0.42 -0.06 0.00 -0.13 0.00 0.00 59.36 58.74 1p92 h GLU 49 Cb 0.81 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 1p92 h GLU 49 CO 0.06 1.06 0.15 0.00 -0.73 0.00 0.00 179.01 179.54 1p92 h ARG 50 N 0.68 1.01 0.00 1.92 2.47 -1.11 -2.15 114.38 117.20 1p92 h ARG 50 Ca 0.06 -0.25 0.00 0.00 -1.26 0.00 0.00 59.98 58.53 1p92 h ARG 50 Cb 0.93 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 29.12 1p92 h ARG 50 CO 0.09 0.92 0.00 -0.25 0.56 0.00 0.00 179.97 181.29 1p92 n ASP 51 N -4.32 0.00 -0.31 7.04 8.00 -0.80 -4.90 116.55 121.27 1p92 n ASP 51 Ca 0.04 -0.32 -0.03 0.00 0.71 0.00 0.00 54.79 55.19 1p92 n ASP 51 Cb 0.25 -0.18 -0.00 0.00 -0.02 0.00 0.00 41.12 41.16 1p92 n ASP 51 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1p92 n GLY 52 N 0.70 0.29 0.07 0.44 0.00 -0.81 -4.96 105.19 100.93 1p92 n GLY 52 Ca 0.14 -0.79 0.01 0.00 0.00 0.00 0.00 46.02 45.38 1p92 n GLY 52 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p92 n LEU 53 N -0.39 0.29 -3.67 0.99 4.77 0.02 -4.45 117.00 114.56 1p92 n LEU 53 Ca -0.03 0.12 -0.10 0.00 -0.03 0.00 0.00 56.01 55.97 1p92 n LEU 53 Cb 0.48 0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.71 1p92 n LEU 53 CO 0.04 0.19 0.35 0.68 -1.33 0.00 0.00 177.39 177.31 1p92 s VAL 54 N -3.02 0.01 0.03 4.08 -7.23 -1.23 -2.12 120.40 110.93 1p92 s VAL 54 Ca -0.07 -0.59 0.04 0.00 -1.81 0.00 0.00 61.98 59.56 1p92 s VAL 54 Cb 0.10 -1.48 -0.02 0.00 0.56 0.00 0.00 36.38 35.54 1p92 s VAL 54 CO 0.85 -0.06 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.76 1p92 s VAL 55 N -3.84 0.99 -0.35 1.32 1.01 0.45 -4.18 120.40 115.80 1p92 s VAL 55 Ca 0.07 -0.90 -0.17 0.00 0.00 0.00 0.00 61.98 60.98 1p92 s VAL 55 Cb -0.02 -0.90 -0.00 0.00 0.00 0.00 0.00 36.38 35.46 1p92 s VAL 55 CO -0.04 0.01 0.48 -0.69 0.00 0.00 0.00 175.10 174.86 1p92 s VAL 56 N -0.78 5.05 1.19 2.92 1.01 -1.26 -1.02 120.40 127.51 1p92 s VAL 56 Ca 0.01 0.24 -0.19 0.00 0.00 0.00 0.00 61.98 62.03 1p92 s VAL 56 Cb -0.07 -3.94 0.28 0.00 0.00 0.00 0.00 36.38 32.65 1p92 s VAL 56 CO 0.01 -0.21 1.14 0.00 0.00 0.00 0.00 175.10 176.03 1p92 s ALA 57 N 2.31 0.76 0.12 5.51 0.00 -0.31 -4.95 121.76 125.21 1p92 s ALA 57 Ca 0.17 -1.02 -0.28 0.00 0.00 0.00 0.00 51.96 50.83 1p92 s ALA 57 Cb -0.16 -2.85 -0.06 0.00 0.00 0.00 0.00 23.12 20.05 1p92 s ALA 57 CO 0.13 -3.52 1.61 0.77 0.00 0.00 0.00 175.76 174.75 1p92 h SER 58 N -2.53 -0.96 0.14 0.00 0.02 -1.97 -3.18 113.55 105.06 1p92 h SER 58 Ca -0.44 0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.63 1p92 h SER 58 Cb 1.28 0.38 -0.00 0.00 0.14 0.00 0.00 62.40 64.20 1p92 h SER 58 CO 0.33 -0.39 -0.11 -2.24 -1.14 0.00 0.00 176.83 173.28 1p92 h ASP 59 N -0.49 -0.28 0.00 3.07 -0.00 -2.04 -3.46 116.42 113.21 1p92 h ASP 59 Ca 0.05 0.02 0.00 0.00 -0.00 0.00 0.00 57.03 57.10 1p92 h ASP 59 Cb 0.57 0.09 0.00 0.00 -0.00 0.00 0.00 39.33 39.99 1p92 h ASP 59 CO -0.25 -0.15 0.00 -1.14 -0.00 0.00 0.00 179.24 177.70 1p92 n ARG 60 N -2.90 0.00 -1.60 4.15 0.00 -1.20 -5.15 116.66 109.96 1p92 n ARG 60 Ca -0.03 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.49 1p92 n ARG 60 Cb 0.10 0.00 0.07 0.00 0.00 0.00 0.00 32.46 32.63 1p92 n ARG 60 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1p92 s SER 61 N 0.00 4.75 -0.23 6.15 1.04 -1.26 -4.45 113.70 119.70 1p92 s SER 61 Ca 0.00 2.09 -0.09 0.00 0.48 0.00 0.00 55.95 58.43 1p92 s SER 61 Cb 0.00 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.52 1p92 s SER 61 CO 0.00 -1.87 0.12 -0.76 0.98 0.00 0.00 173.24 171.71 1p92 s LEU 62 N -5.07 3.89 -0.19 2.42 1.43 0.33 -1.16 118.68 120.33 1p92 s LEU 62 Ca 0.68 0.02 -0.05 0.00 -1.03 0.00 0.00 54.13 53.75 1p92 s LEU 62 Cb -0.23 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 43.93 1p92 s LEU 62 CO 0.44 0.06 0.00 -1.10 0.23 0.00 0.00 176.35 175.98 1p92 s GLN 63 N 1.10 3.67 0.18 1.70 -0.21 -0.19 -4.76 119.66 121.15 1p92 s GLN 63 Ca 0.06 -0.50 -0.29 0.00 0.02 0.00 0.00 55.36 54.65 1p92 s GLN 63 Cb -0.14 -3.08 -0.08 0.00 1.00 0.00 0.00 33.01 30.72 1p92 s GLN 63 CO 0.04 0.08 0.91 -1.64 -2.12 0.00 0.00 175.29 172.55 1p92 s MET 64 N 0.84 4.75 0.80 2.91 -1.94 -1.26 -0.41 119.30 124.98 1p92 s MET 64 Ca 0.01 1.40 -0.12 0.00 -1.71 0.00 0.00 55.69 55.27 1p92 s MET 64 Cb -0.14 -3.30 0.07 0.00 2.01 0.00 0.00 34.83 33.47 1p92 s MET 64 CO 0.02 0.44 1.11 0.95 -0.01 0.00 0.00 175.02 177.53 1p92 s THR 65 N -0.83 2.87 0.38 2.05 -4.23 -0.90 -4.75 115.64 110.24 1p92 s THR 65 Ca 0.41 0.28 0.09 0.00 -1.18 0.00 0.00 61.69 61.30 1p92 s THR 65 Cb -0.25 -3.10 0.31 0.00 1.34 0.00 0.00 72.50 70.81 1p92 s THR 65 CO 0.30 -0.37 1.93 -0.65 -0.54 0.00 0.00 174.62 175.29 1p92 h PRO 66 N -1.08 0.63 -0.29 3.99 0.11 -1.90 -0.39 132.00 133.06 1p92 h PRO 66 Ca -0.47 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.45 1p92 h PRO 66 Cb 1.28 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1p92 h PRO 66 CO 0.61 0.41 -0.42 1.79 -0.21 0.00 0.00 178.00 180.19 1p92 h THR 67 N 0.64 1.29 -0.65 -1.15 1.35 -1.91 -2.12 112.91 110.37 1p92 h THR 67 Ca 0.35 -1.60 0.01 0.00 -0.55 0.00 0.00 66.41 64.62 1p92 h THR 67 Cb 0.50 1.61 -0.04 0.00 -1.73 0.00 0.00 68.15 68.49 1p92 h THR 67 CO -0.13 0.52 0.42 1.23 -0.25 0.00 0.00 175.52 177.31 1p92 h GLY 68 N 0.57 0.91 1.43 5.82 0.00 -1.50 -1.86 103.07 108.45 1p92 h GLY 68 Ca 0.03 -0.33 -0.05 0.00 0.00 0.00 0.00 47.33 46.99 1p92 h GLY 68 CO 0.10 0.30 0.11 -0.09 0.00 0.00 0.00 176.54 176.96 1p92 h ARG 69 N 0.84 0.72 -0.50 4.80 2.43 -0.98 0.16 114.38 121.86 1p92 h ARG 69 Ca 0.24 -0.14 -0.09 0.00 -0.81 0.00 0.00 59.98 59.18 1p92 h ARG 69 Cb -0.06 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1p92 h ARG 69 CO -0.07 0.66 -0.06 1.15 -1.51 0.00 0.00 179.97 180.14 1p92 h THR 70 N 0.70 1.26 -0.11 0.20 2.02 -0.93 0.35 112.91 116.40 1p92 h THR 70 Ca 0.16 -1.15 -0.12 0.00 0.77 0.00 0.00 66.41 66.07 1p92 h THR 70 Cb 0.28 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1p92 h THR 70 CO -0.00 0.40 -0.40 0.25 0.37 0.00 0.00 175.52 176.14 1p92 h LEU 71 N 0.80 0.54 -0.90 2.58 5.85 -0.74 -2.65 115.31 120.80 1p92 h LEU 71 Ca 0.14 -0.62 0.06 0.00 0.84 0.00 0.00 57.88 58.30 1p92 h LEU 71 Cb 0.57 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 1p92 h LEU 71 CO 0.03 1.07 0.57 0.00 -0.34 0.00 0.00 178.44 179.77 1p92 h ALA 72 N 0.49 1.23 -0.60 1.25 0.00 -0.56 -1.96 119.26 119.10 1p92 h ALA 72 Ca -0.02 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1p92 h ALA 72 Cb 1.03 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1p92 h ALA 72 CO 0.08 0.35 0.12 1.15 0.00 0.00 0.00 179.25 180.95 1p92 h THR 73 N 1.05 1.25 -0.58 0.00 2.02 -0.88 -1.65 112.91 114.11 1p92 h THR 73 Ca 0.38 -0.92 -0.09 0.00 0.77 0.00 0.00 66.41 66.55 1p92 h THR 73 Cb 0.14 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 1p92 h THR 73 CO -0.16 0.35 -0.01 0.00 0.37 0.00 0.00 175.52 176.06 1p92 h ALA 74 N 1.22 0.89 -0.33 6.16 0.00 -1.01 -0.73 119.26 125.45 1p92 h ALA 74 Ca 0.19 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1p92 h ALA 74 Cb 0.36 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1p92 h ALA 74 CO 0.00 0.65 0.16 0.28 0.00 0.00 0.00 179.25 180.35 1p92 h VAL 75 N 0.93 1.16 -0.45 0.00 2.07 -1.03 -0.16 116.25 118.77 1p92 h VAL 75 Ca 0.17 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.17 1p92 h VAL 75 Cb 0.55 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1p92 h VAL 75 CO 0.03 0.17 0.02 0.24 0.02 0.00 0.00 177.57 178.05 1p92 h MET 76 N 0.40 0.72 -0.14 1.57 2.86 -1.08 -0.08 114.93 119.19 1p92 h MET 76 Ca 0.11 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1p92 h MET 76 Cb 0.12 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1p92 h MET 76 CO -0.01 0.72 0.03 -0.09 1.06 0.00 0.00 176.91 178.62 1p92 h ARG 77 N 0.68 0.23 -0.49 1.72 2.43 -0.75 -0.97 114.38 117.23 1p92 h ARG 77 Ca 0.14 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 1p92 h ARG 77 Cb 0.39 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1p92 h ARG 77 CO 0.01 0.39 0.27 0.87 -1.51 0.00 0.00 179.97 180.00 1p92 h LYS 78 N 0.03 0.68 -0.18 0.20 1.57 -0.77 -0.96 116.57 117.14 1p92 h LYS 78 Ca 0.04 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1p92 h LYS 78 Cb 0.27 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1p92 h LYS 78 CO 0.00 0.53 0.11 0.00 -0.57 0.00 0.00 179.45 179.52 1p92 h ALA 79 N 1.11 0.22 0.00 3.86 0.00 -0.89 -1.15 119.26 122.41 1p92 h ALA 79 Ca 0.17 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1p92 h ALA 79 Cb 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1p92 h ALA 79 CO -0.03 -0.27 -0.40 0.00 0.00 0.00 0.00 179.25 178.55 1p92 h ARG 80 N 0.21 0.00 -0.02 0.00 3.08 -1.07 0.12 114.38 116.70 1p92 h ARG 80 Ca 0.06 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.93 1p92 h ARG 80 Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1p92 h ARG 80 CO -0.01 0.40 -0.79 -0.07 -1.07 0.00 0.00 179.97 178.43 1p92 h LEU 81 N 0.00 0.25 -0.23 3.04 3.38 -1.00 -1.72 115.31 119.04 1p92 h LEU 81 Ca -0.00 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 1p92 h LEU 81 Cb 0.80 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1p92 h LEU 81 CO 0.05 0.94 -0.05 0.00 0.09 0.00 0.00 178.44 179.47 1p92 h ALA 82 N 1.05 0.31 -0.38 1.53 0.00 -0.44 0.03 119.26 121.36 1p92 h ALA 82 Ca -0.03 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.67 1p92 h ALA 82 Cb 1.38 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.05 1p92 h ALA 82 CO 0.12 0.10 0.12 0.93 0.00 0.00 0.00 179.25 180.52 1p92 h GLU 83 N 0.17 0.26 -0.76 0.00 5.08 -0.72 0.28 114.58 118.89 1p92 h GLU 83 Ca 0.06 -0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1p92 h GLU 83 Cb 0.50 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.64 1p92 h GLU 83 CO 0.02 0.17 0.46 -0.09 -1.00 0.00 0.00 179.01 178.57 1p92 h ARG 84 N 0.27 0.82 -0.06 2.33 9.65 -1.13 -0.92 114.38 125.33 1p92 h ARG 84 Ca 0.18 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 59.00 1p92 h ARG 84 Cb 0.17 -0.18 -0.00 0.00 -1.39 0.00 0.00 29.97 28.56 1p92 h ARG 84 CO -0.19 0.54 0.00 1.25 2.80 0.00 0.00 179.97 184.37 1p92 h LEU 85 N 0.84 0.10 -1.76 3.80 5.85 0.07 0.46 115.31 124.67 1p92 h LEU 85 Ca 0.33 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1p92 h LEU 85 Cb 0.15 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1p92 h LEU 85 CO -0.16 0.37 0.15 -0.07 -0.34 0.00 0.00 178.44 178.38 1p92 h LEU 86 N -0.16 0.27 0.00 2.25 3.38 -0.24 -1.98 115.31 118.83 1p92 h LEU 86 Ca 0.02 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1p92 h LEU 86 Cb 0.31 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1p92 h LEU 86 CO 0.00 0.20 -0.60 0.74 0.09 0.00 0.00 178.44 178.87 1p92 h THR 87 N 0.32 0.44 -0.36 0.22 2.02 -1.06 0.11 112.91 114.60 1p92 h THR 87 Ca 0.09 -1.48 -0.12 0.00 0.77 0.00 0.00 66.41 65.67 1p92 h THR 87 Cb -0.03 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1p92 h THR 87 CO -0.02 0.15 -0.24 0.44 0.37 0.00 0.00 175.52 176.22 1p92 h ASP 88 N -1.00 0.84 0.00 4.18 3.32 -0.98 -3.15 116.42 119.63 1p92 h ASP 88 Ca -0.10 -0.43 -0.41 0.00 0.02 0.00 0.00 57.03 56.11 1p92 h ASP 88 Cb 0.71 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 39.97 1p92 h ASP 88 CO -0.06 1.09 -2.36 -0.38 -1.72 0.00 0.00 179.24 175.81 1p92 n ILE 89 N -4.23 1.47 -0.02 0.35 5.41 -0.88 -4.65 119.36 116.79 1p92 n ILE 89 Ca -0.02 -0.33 -0.16 0.00 1.00 0.00 0.00 62.75 63.24 1p92 n ILE 89 Cb 0.45 -1.90 -0.06 0.00 -0.71 0.00 0.00 39.64 37.42 1p92 n ILE 89 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 1p92 h ILE 90 N -0.96 1.28 -0.10 1.39 1.08 -1.48 -3.48 117.51 115.24 1p92 h ILE 90 Ca -0.62 -1.96 -0.02 0.00 -0.39 0.00 0.00 64.86 61.88 1p92 h ILE 90 Cb 1.54 1.95 -0.00 0.00 -3.07 0.00 0.00 36.82 37.23 1p92 h ILE 90 CO -0.38 0.62 -0.02 0.61 -0.69 0.00 0.00 178.15 178.29 1p92 n GLY 91 N 0.65 0.36 3.75 5.37 0.00 0.13 -5.00 105.19 110.44 1p92 n GLY 91 Ca -0.07 -0.89 -0.36 0.00 0.00 0.00 0.00 46.02 44.70 1p92 n GLY 91 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1p92 s LEU 92 N -0.23 3.66 0.05 0.99 2.96 0.14 -4.87 118.68 121.38 1p92 s LEU 92 Ca 0.00 2.44 -0.33 0.00 -0.22 0.00 0.00 54.13 56.02 1p92 s LEU 92 Cb 0.00 -4.59 -0.12 0.00 0.50 0.00 0.00 46.19 41.98 1p92 s LEU 92 CO 0.00 -1.66 1.78 -0.67 -1.32 0.00 0.00 176.35 174.47 1p92 n ASP 93 N -1.62 3.51 -0.27 3.68 2.03 -1.26 -4.73 116.55 117.88 1p92 n ASP 93 Ca 0.14 1.01 0.33 0.00 0.52 0.00 0.00 54.79 56.79 1p92 n ASP 93 Cb 0.49 -1.44 0.74 0.00 -0.72 0.00 0.00 41.12 40.20 1p92 n ASP 93 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1p92 h ILE 94 N 4.67 0.45 0.00 5.18 6.09 -1.96 0.54 117.51 132.48 1p92 h ILE 94 Ca -0.47 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 1p92 h ILE 94 Cb 1.25 0.45 0.00 0.00 0.47 0.00 0.00 36.82 39.00 1p92 h ILE 94 CO 0.93 0.00 0.00 0.78 -3.07 0.00 0.00 178.15 176.79 1p92 h ASN 95 N 0.00 0.00 -0.01 2.19 2.35 -2.03 -2.98 115.58 115.10 1p92 h ASN 95 Ca 0.52 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.27 1p92 h ASN 95 Cb 2.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.46 1p92 h ASN 95 CO -0.01 0.00 -0.41 0.29 -1.65 0.00 0.00 177.43 175.66 1p92 n LYS 96 N -2.59 2.12 -0.22 0.81 5.02 0.19 -4.68 118.16 118.80 1p92 n LYS 96 Ca 0.02 -0.47 -0.06 0.00 -2.02 0.00 0.00 58.31 55.77 1p92 n LYS 96 Cb 0.28 -1.18 0.04 0.00 -0.02 0.00 0.00 35.03 34.15 1p92 n LYS 96 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1p92 h VAL 97 N 1.00 1.19 0.13 -0.18 2.07 -1.33 -2.82 116.25 116.31 1p92 h VAL 97 Ca 0.00 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.06 1p92 h VAL 97 Cb 0.42 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1p92 h VAL 97 CO 0.00 0.21 -0.19 -0.74 0.02 0.00 0.00 177.57 176.86 1p92 h HIS 98 N 0.84 -0.51 -0.63 1.57 -0.00 -1.84 -1.22 115.15 113.36 1p92 h HIS 98 Ca 0.22 0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.56 1p92 h HIS 98 Cb 0.02 0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.61 1p92 h HIS 98 CO -0.01 -0.28 0.24 -0.44 -0.00 0.00 0.00 177.93 177.44 1p92 h ASP 99 N -0.38 0.88 -0.08 3.26 5.19 -1.87 -1.51 116.42 121.90 1p92 h ASP 99 Ca 0.02 -0.18 -0.00 0.00 -0.62 0.00 0.00 57.03 56.25 1p92 h ASP 99 Cb 0.39 -0.23 -0.00 0.00 0.18 0.00 0.00 39.33 39.67 1p92 h ASP 99 CO -0.09 0.82 0.04 -0.08 -3.12 0.00 0.00 179.24 176.81 1p92 h GLU 100 N 0.89 0.11 0.00 3.56 4.57 -1.41 -2.51 114.58 119.79 1p92 h GLU 100 Ca 0.21 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.35 1p92 h GLU 100 Cb 0.22 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.78 1p92 h GLU 100 CO -0.02 0.16 -0.12 0.00 -1.18 0.00 0.00 179.01 177.86 1p92 h ALA 101 N 0.94 1.61 0.00 2.92 0.00 -1.11 -0.54 119.26 123.09 1p92 h ALA 101 Ca 0.03 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1p92 h ALA 101 Cb 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1p92 h ALA 101 CO -0.00 0.15 -0.24 0.00 0.00 0.00 0.00 179.25 179.15 1p92 h ARG 103 N 0.00 0.36 -0.14 0.00 3.08 -0.96 -3.36 114.38 113.37 1p92 h ARG 103 Ca -0.00 -0.62 -0.05 0.00 0.07 0.00 0.00 59.98 59.38 1p92 h ARG 103 Cb 0.59 0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1p92 h ARG 103 CO 0.03 1.30 -0.12 -1.49 -1.07 0.00 0.00 179.97 178.62 1p92 h TRP 104 N 0.10 0.22 -0.47 3.04 4.06 -1.06 -3.00 115.95 118.83 1p92 h TRP 104 Ca -0.37 -0.02 0.14 0.00 2.06 0.00 0.00 58.89 60.70 1p92 h TRP 104 Cb 2.09 -0.06 -0.02 0.00 -1.00 0.00 0.00 29.16 30.16 1p92 h TRP 104 CO 0.10 0.34 0.36 1.05 -3.56 0.00 0.00 178.44 176.72 1p92 h GLU 105 N 0.20 0.00 -0.00 0.49 4.11 -1.45 -0.96 114.58 116.98 1p92 h GLU 105 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 1p92 h GLU 105 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1p92 h GLU 105 CO 0.02 0.00 -0.13 0.72 0.07 0.00 0.00 179.01 179.69 1p92 n HIS 106 N -4.30 0.00 -0.02 2.06 8.25 -1.13 -4.08 115.22 115.99 1p92 n HIS 106 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1p92 n HIS 106 Cb 0.56 -0.35 0.00 0.00 1.12 0.00 0.00 29.99 31.32 1p92 n HIS 106 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1p92 n VAL 107 N -1.36 0.00 -2.96 1.59 0.31 -0.39 -4.96 118.33 110.57 1p92 n VAL 107 Ca 0.09 -0.48 -0.41 0.00 -0.01 0.00 0.00 64.34 63.53 1p92 n VAL 107 Cb 0.31 1.02 -0.04 0.00 -0.91 0.00 0.00 33.84 34.22 1p92 n VAL 107 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1p92 s MET 108 N -0.45 4.40 0.72 5.55 -1.94 -1.07 -5.05 119.30 121.45 1p92 s MET 108 Ca 0.00 0.97 -0.10 0.00 -1.71 0.00 0.00 55.69 54.85 1p92 s MET 108 Cb 0.00 -3.50 0.03 0.00 2.01 0.00 0.00 34.83 33.38 1p92 s MET 108 CO 0.00 -0.09 1.08 -1.54 -0.01 0.00 0.00 175.02 174.46 1p92 s SER 109 N 0.96 5.17 0.26 3.03 1.04 -1.26 -4.95 113.70 117.95 1p92 s SER 109 Ca 0.39 0.92 -0.02 0.00 0.48 0.00 0.00 55.95 57.72 1p92 s SER 109 Cb -0.18 -1.65 0.33 0.00 0.10 0.00 0.00 66.02 64.62 1p92 s SER 109 CO 0.17 -1.47 1.76 0.44 0.98 0.00 0.00 173.24 175.13 1p92 h ASP 110 N -0.68 0.77 -0.75 7.02 3.32 -1.99 -2.63 116.42 121.48 1p92 h ASP 110 Ca -0.45 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 56.43 1p92 h ASP 110 Cb 1.28 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 40.58 1p92 h ASP 110 CO 0.64 0.83 0.49 -0.08 -1.72 0.00 0.00 179.24 179.39 1p92 h GLU 111 N 0.76 0.96 -0.57 3.56 4.57 -2.00 -0.59 114.58 121.27 1p92 h GLU 111 Ca 0.15 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.24 1p92 h GLU 111 Cb 0.43 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.78 1p92 h GLU 111 CO 0.02 0.63 0.21 0.28 -1.18 0.00 0.00 179.01 178.97 1p92 h VAL 112 N 0.99 1.21 -0.50 0.32 2.07 -1.88 -2.30 116.25 116.16 1p92 h VAL 112 Ca 0.28 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 1p92 h VAL 112 Cb -0.08 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 1p92 h VAL 112 CO -0.07 0.27 0.29 -0.33 0.02 0.00 0.00 177.57 177.75 1p92 h GLU 113 N 0.82 0.69 -0.74 1.57 5.08 -0.86 -1.41 114.58 119.73 1p92 h GLU 113 Ca 0.19 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1p92 h GLU 113 Cb 0.19 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.26 1p92 h GLU 113 CO -0.01 0.51 0.48 0.00 -1.00 0.00 0.00 179.01 178.99 1p92 h ARG 114 N 0.67 0.98 -0.25 2.33 3.08 -0.63 -1.93 114.38 118.63 1p92 h ARG 114 Ca 0.18 -0.06 -0.16 0.00 0.07 0.00 0.00 59.98 60.01 1p92 h ARG 114 Cb 0.01 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.84 1p92 h ARG 114 CO -0.03 0.65 -0.49 0.00 -1.07 0.00 0.00 179.97 179.03 1p92 h ARG 115 N 1.00 0.70 -0.50 0.04 2.47 -1.00 -3.09 114.38 114.01 1p92 h ARG 115 Ca 0.27 -0.41 -0.05 0.00 -1.26 0.00 0.00 59.98 58.53 1p92 h ARG 115 Cb -0.11 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.22 1p92 h ARG 115 CO -0.06 1.03 0.11 -0.07 0.56 0.00 0.00 179.97 181.54 1p92 h LEU 116 N 0.55 0.72 -1.44 3.04 3.38 -0.54 0.18 115.31 121.20 1p92 h LEU 116 Ca 0.03 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1p92 h LEU 116 Cb 1.05 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1p92 h LEU 116 CO 0.10 0.72 -0.20 0.58 0.09 0.00 0.00 178.44 179.74 1p92 h VAL 117 N 0.75 0.59 0.05 1.22 2.07 -1.37 0.23 116.25 119.78 1p92 h VAL 117 Ca 0.16 -0.91 -0.27 0.00 0.82 0.00 0.00 66.70 66.51 1p92 h VAL 117 Cb 0.29 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1p92 h VAL 117 CO -0.00 0.19 -1.37 0.50 0.02 0.00 0.00 177.57 176.91 1p92 h LYS 118 N 0.00 0.10 0.00 1.57 3.64 -1.05 -3.37 116.57 117.46 1p92 h LYS 118 Ca -0.00 -0.18 -0.29 0.00 -1.27 0.00 0.00 60.65 58.91 1p92 h LYS 118 Cb 0.58 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.42 1p92 h LYS 118 CO 0.03 0.93 -1.74 0.28 -2.27 0.00 0.00 179.45 176.68 1p92 n VAL 119 N -3.32 1.58 -2.62 2.00 0.31 0.50 -4.94 118.33 111.83 1p92 n VAL 119 Ca -0.10 -0.79 -0.35 0.00 -0.01 0.00 0.00 64.34 63.09 1p92 n VAL 119 Cb 1.01 -0.99 -0.05 0.00 -0.91 0.00 0.00 33.84 32.90 1p92 n VAL 119 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1p92 s LEU 120 N -6.04 3.98 0.01 7.52 1.43 0.78 -4.99 118.68 121.38 1p92 s LEU 120 Ca -0.05 1.90 -0.25 0.00 -1.03 0.00 0.00 54.13 54.70 1p92 s LEU 120 Cb 0.08 -4.41 -0.17 0.00 0.03 0.00 0.00 46.19 41.71 1p92 s LEU 120 CO 0.82 -0.56 1.31 0.50 0.23 0.00 0.00 176.35 178.65 1p92 h LYS 121 N 2.01 -0.26 -3.24 1.70 3.11 -1.91 -3.44 116.57 114.53 1p92 h LYS 121 Ca -0.49 0.02 -0.31 0.00 -2.81 0.00 0.00 60.65 57.06 1p92 h LYS 121 Cb 1.21 0.06 -0.36 0.00 -1.00 0.00 0.00 32.23 32.14 1p92 h LYS 121 CO 0.61 0.06 -0.68 0.34 -2.81 0.00 0.00 179.45 176.97 1p92 s ASP 122 N -5.22 0.67 -0.25 4.20 -1.08 -1.26 -5.01 116.67 108.71 1p92 s ASP 122 Ca -0.15 0.21 0.13 0.00 -0.52 0.00 0.00 52.55 52.22 1p92 s ASP 122 Cb 0.03 0.08 0.71 0.00 -1.46 0.00 0.00 42.92 42.27 1p92 s ASP 122 CO 0.59 -0.22 1.67 1.33 0.52 0.00 0.00 175.17 179.06 1p92 n VAL 123 N 5.01 2.69 0.25 1.11 0.24 -1.26 -4.63 118.33 121.74 1p92 n VAL 123 Ca -0.10 -1.69 -0.15 0.00 -2.04 0.00 0.00 64.34 60.37 1p92 n VAL 123 Cb 0.50 -0.30 -0.08 0.00 -1.47 0.00 0.00 33.84 32.49 1p92 n VAL 123 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1p92 h SER 124 N 2.84 -0.54 -3.63 -1.34 0.02 -1.94 -3.40 113.55 105.55 1p92 h SER 124 Ca 0.10 -0.08 -0.40 0.00 -0.84 0.00 0.00 61.79 60.57 1p92 h SER 124 Cb 1.94 0.14 -0.14 0.00 0.14 0.00 0.00 62.40 64.48 1p92 h SER 124 CO 0.49 -0.21 -0.68 -0.13 -1.14 0.00 0.00 176.83 175.16 1p92 s ARG 125 N -4.99 1.33 0.81 3.45 0.52 -1.26 -1.53 118.95 117.27 1p92 s ARG 125 Ca -0.15 -1.65 -0.10 0.00 -0.52 0.00 0.00 55.73 53.31 1p92 s ARG 125 Cb 0.02 -0.78 0.11 0.00 0.52 0.00 0.00 34.95 34.82 1p92 s ARG 125 CO 0.53 -0.01 1.15 -1.54 0.02 0.00 0.00 175.30 175.45 1p92 s SER 126 N -3.31 4.25 0.50 0.23 1.04 0.25 -4.86 113.70 111.81 1p92 s SER 126 Ca 0.26 0.47 0.33 0.00 0.48 0.00 0.00 55.95 57.49 1p92 s SER 126 Cb 0.04 -0.89 1.54 0.00 0.10 0.00 0.00 66.02 66.81 1p92 s SER 126 CO 0.08 -2.01 1.99 -0.65 0.98 0.00 0.00 173.24 173.63 1p92 h PRO 127 N -1.02 0.00 -0.49 4.02 0.11 -1.88 -2.06 132.00 130.68 1p92 h PRO 127 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1p92 h PRO 127 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1p92 h PRO 127 CO 0.55 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.53 1p92 n PHE 128 N -2.83 0.68 0.00 0.65 3.01 -1.26 -4.94 117.46 112.77 1p92 n PHE 128 Ca -0.00 -0.32 0.00 0.00 1.01 0.00 0.00 57.45 58.14 1p92 n PHE 128 Cb 0.20 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 1p92 n PHE 128 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1p92 n GLY 129 N 1.15 2.67 3.80 1.37 0.00 -0.77 -5.06 105.19 108.35 1p92 n GLY 129 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 1p92 n GLY 129 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1p92 s ASN 130 N -1.51 7.14 0.61 1.61 0.01 -1.26 -4.73 114.94 116.81 1p92 s ASN 130 Ca 0.00 1.59 -0.18 0.00 -0.71 0.00 0.00 52.86 53.56 1p92 s ASN 130 Cb 0.00 -2.48 -0.02 0.00 0.41 0.00 0.00 41.25 39.15 1p92 s ASN 130 CO 0.00 -0.04 1.19 -2.16 -1.51 0.00 0.00 177.10 174.58 1p92 s PRO 131 N -2.13 2.88 -0.38 -0.60 0.04 -1.26 -0.58 135.00 132.96 1p92 s PRO 131 Ca 0.47 1.76 -0.16 0.00 0.04 0.00 0.00 61.00 63.11 1p92 s PRO 131 Cb -0.17 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.46 1p92 s PRO 131 CO 0.21 -1.26 0.41 0.42 0.04 0.00 0.00 177.00 176.82 1p92 s ILE 132 N -1.73 5.12 0.72 0.56 1.01 -0.58 -4.76 121.20 121.54 1p92 s ILE 132 Ca 0.76 -0.16 -0.09 0.00 0.00 0.00 0.00 60.65 61.16 1p92 s ILE 132 Cb -0.29 -3.95 0.05 0.00 0.01 0.00 0.00 42.46 38.29 1p92 s ILE 132 CO 0.35 -0.28 1.07 -2.16 0.00 0.00 0.00 174.94 173.92 1p92 s PRO 133 N 2.09 2.35 -1.15 2.79 0.04 -1.26 -4.47 135.00 135.39 1p92 s PRO 133 Ca 0.12 0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.21 1p92 s PRO 133 Cb -0.17 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1p92 s PRO 133 CO 0.13 -1.24 0.00 0.41 0.04 0.00 0.00 177.00 176.34 1p92 n GLY 134 N -3.02 1.09 0.23 0.56 0.00 -1.26 -4.48 105.19 98.31 1p92 n GLY 134 Ca 0.07 -0.09 0.06 0.00 0.00 0.00 0.00 46.02 46.07 1p92 n GLY 134 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1p92 h LEU 135 N 0.00 0.00 0.57 0.99 3.38 -1.97 -2.37 115.31 115.92 1p92 h LEU 135 Ca -0.22 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1p92 h LEU 135 Cb 1.05 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.81 1p92 h LEU 135 CO 0.33 0.17 -0.27 -2.24 0.09 0.00 0.00 178.44 176.51 1p92 h ASP 136 N 0.00 -0.65 -1.30 -0.43 2.03 -1.89 -2.81 116.42 111.37 1p92 h ASP 136 Ca -0.00 -0.04 0.39 0.00 -0.73 0.00 0.00 57.03 56.65 1p92 h ASP 136 Cb 0.31 0.17 -0.10 0.00 -0.83 0.00 0.00 39.33 38.88 1p92 h ASP 136 CO 0.02 -0.30 0.87 -0.08 -1.03 0.00 0.00 179.24 178.72 1p92 h GLU 137 N -1.04 0.14 0.06 4.15 4.57 -1.86 0.64 114.58 121.24 1p92 h GLU 137 Ca -0.08 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1p92 h GLU 137 Cb 0.65 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 1p92 h GLU 137 CO 0.13 0.09 -0.03 1.25 -1.18 0.00 0.00 179.01 179.27 1p92 h LEU 138 N 0.14 -0.06 0.00 1.64 5.85 -1.24 -3.50 115.31 118.14 1p92 h LEU 138 Ca 0.73 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 59.16 1p92 h LEU 138 Cb 2.38 0.02 0.00 0.00 0.37 0.00 0.00 40.66 43.43 1p92 h LEU 138 CO -0.27 0.26 0.00 0.61 -0.34 0.00 0.00 178.44 178.70 1p92 n GLY 139 N -0.26 3.83 1.38 3.75 0.00 0.22 -4.94 105.19 109.17 1p92 n GLY 139 Ca -0.08 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.29 1p92 n GLY 139 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1p92 n PRO 148 N -1.40 -0.04 -0.07 1.61 -0.02 -1.26 -4.78 135.00 129.04 1p92 n PRO 148 Ca 0.00 -0.02 -0.09 0.00 -2.02 0.00 0.00 63.50 61.37 1p92 n PRO 148 Cb 0.00 0.04 -0.03 0.00 -0.02 0.00 0.00 33.50 33.49 1p92 n PRO 148 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1p92 h GLY 149 N 0.62 -0.32 0.00 -1.23 0.00 -1.75 -3.47 103.07 96.93 1p92 h GLY 149 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.73 1p92 h GLY 149 CO 0.00 -0.21 0.00 2.41 0.00 0.00 0.00 176.54 178.74 1p92 n THR 150 N -5.41 0.00 -2.06 4.70 -1.04 -1.19 -4.86 114.28 104.42 1p92 n THR 150 Ca -0.01 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.58 1p92 n THR 150 Cb 0.33 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.81 1p92 n THR 150 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1p92 s ARG 151 N -2.00 4.25 0.23 -2.82 1.81 -1.26 -1.34 118.95 117.81 1p92 s ARG 151 Ca 0.00 2.17 -0.10 0.00 -1.72 0.00 0.00 55.73 56.08 1p92 s ARG 151 Cb 0.00 -3.49 0.34 0.00 -0.45 0.00 0.00 34.95 31.35 1p92 s ARG 151 CO 0.00 -0.62 1.64 0.28 -0.68 0.00 0.00 175.30 175.92 1p92 h VAL 152 N 4.67 0.38 -0.82 3.52 2.07 -0.96 -0.21 116.25 124.91 1p92 h VAL 152 Ca -0.41 -0.03 0.24 0.00 0.82 0.00 0.00 66.70 67.32 1p92 h VAL 152 Cb 1.20 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 1p92 h VAL 152 CO 0.91 0.01 0.65 -0.29 0.02 0.00 0.00 177.57 178.87 1p92 h ILE 153 N 0.07 0.47 0.02 4.57 2.10 -1.27 -2.18 117.51 121.30 1p92 h ILE 153 Ca 0.36 0.00 -0.30 0.00 1.08 0.00 0.00 64.86 66.00 1p92 h ILE 153 Cb 0.59 0.53 -0.04 0.00 -1.09 0.00 0.00 36.82 36.82 1p92 h ILE 153 CO -0.63 0.00 -1.64 0.47 -1.08 0.00 0.00 178.15 175.27 1p92 n ASP 154 N -4.08 1.92 0.00 2.19 8.00 -0.14 -4.27 116.55 120.16 1p92 n ASP 154 Ca 0.17 0.36 0.03 0.00 0.71 0.00 0.00 54.79 56.06 1p92 n ASP 154 Cb 0.94 -0.91 0.15 0.00 -0.02 0.00 0.00 41.12 41.28 1p92 n ASP 154 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1p92 n ALA 155 N -3.51 1.49 -2.26 2.24 0.00 -0.87 -4.73 120.51 112.85 1p92 n ALA 155 Ca -0.37 -0.03 -0.39 0.00 0.00 0.00 0.00 53.44 52.66 1p92 n ALA 155 Cb 0.78 -1.09 -0.06 0.00 0.00 0.00 0.00 19.45 19.07 1p92 n ALA 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p92 s ALA 156 N -2.50 3.56 0.09 0.00 0.00 -0.86 -5.04 121.76 117.01 1p92 s ALA 156 Ca 0.06 0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.11 1p92 s ALA 156 Cb 0.04 -2.68 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 1p92 s ALA 156 CO 0.09 0.36 -0.07 0.99 0.00 0.00 0.00 175.76 177.13 1p92 s THR 157 N -1.02 0.64 -0.42 0.00 2.01 -1.26 -4.84 115.64 110.75 1p92 s THR 157 Ca 0.30 -1.79 0.11 0.00 0.31 0.00 0.00 61.69 60.62 1p92 s THR 157 Cb -0.20 -1.50 0.11 0.00 0.01 0.00 0.00 72.50 70.92 1p92 s THR 157 CO 0.20 -0.80 1.28 -1.54 -0.69 0.00 0.00 174.62 173.06 1p92 n SER 158 N 0.21 0.28 -4.43 3.53 3.41 -1.26 -2.12 113.62 113.23 1p92 n SER 158 Ca -0.14 0.58 -0.40 0.00 -0.26 0.00 0.00 58.87 58.65 1p92 n SER 158 Cb 0.60 -0.59 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 1p92 n SER 158 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 1p92 s MET 159 N -3.21 3.13 0.74 4.33 -2.45 -1.26 -4.64 119.30 115.93 1p92 s MET 159 Ca -0.01 -0.88 -0.16 0.00 -1.25 0.00 0.00 55.69 53.39 1p92 s MET 159 Cb 0.03 -3.71 -0.02 0.00 1.25 0.00 0.00 34.83 32.38 1p92 s MET 159 CO 0.10 -0.56 0.65 -2.30 1.05 0.00 0.00 175.02 173.96 1p92 n PRO 160 N 5.03 0.31 -3.61 4.11 -0.02 -1.25 -4.84 135.00 134.73 1p92 n PRO 160 Ca -0.13 0.15 -0.04 0.00 -2.02 0.00 0.00 63.50 61.46 1p92 n PRO 160 Cb 0.48 -1.95 -0.03 0.00 -0.02 0.00 0.00 33.50 31.98 1p92 n PRO 160 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1p92 s ARG 161 N -2.99 0.25 0.29 -0.52 1.70 -1.12 -4.95 118.95 111.61 1p92 s ARG 161 Ca 0.67 -0.03 -0.12 0.00 -0.47 0.00 0.00 55.73 55.78 1p92 s ARG 161 Cb -0.34 0.12 -0.08 0.00 -0.57 0.00 0.00 34.95 34.08 1p92 s ARG 161 CO 0.56 -0.10 0.65 -1.59 -1.08 0.00 0.00 175.30 173.74 1p92 s LYS 162 N -1.81 3.88 0.22 3.89 0.00 -1.25 -0.91 119.74 123.76 1p92 s LYS 162 Ca 0.08 0.45 -0.15 0.00 0.00 0.00 0.00 55.97 56.35 1p92 s LYS 162 Cb -0.01 -2.53 0.01 0.00 0.00 0.00 0.00 37.83 35.30 1p92 s LYS 162 CO -0.05 0.22 0.49 0.08 0.00 0.00 0.00 175.35 176.09 1p92 s VAL 163 N -1.94 0.02 -0.05 1.79 1.01 -0.73 -4.64 120.40 115.86 1p92 s VAL 163 Ca 0.51 -1.14 0.04 0.00 0.00 0.00 0.00 61.98 61.38 1p92 s VAL 163 Cb -0.11 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 1p92 s VAL 163 CO 0.21 -0.08 -0.15 0.00 0.00 0.00 0.00 175.10 175.07 1p92 s ARG 164 N -3.95 2.49 -0.19 2.72 3.03 -0.53 -1.63 118.95 120.89 1p92 s ARG 164 Ca 0.16 -0.71 -0.26 0.00 2.03 0.00 0.00 55.73 56.96 1p92 s ARG 164 Cb -0.01 -2.36 -0.01 0.00 -1.03 0.00 0.00 34.95 31.54 1p92 s ARG 164 CO 0.03 0.62 0.86 0.42 -1.13 0.00 0.00 175.30 176.10 1p92 s ILE 165 N -0.72 4.84 -0.10 4.99 1.01 -1.25 -0.44 121.20 129.54 1p92 s ILE 165 Ca 0.11 1.68 0.12 0.00 0.00 0.00 0.00 60.65 62.55 1p92 s ILE 165 Cb -0.11 -4.16 -0.24 0.00 0.01 0.00 0.00 42.46 37.97 1p92 s ILE 165 CO 0.00 -0.03 0.46 0.52 0.00 0.00 0.00 174.94 175.90 1p92 n VAL 166 N 4.94 1.57 -3.62 2.92 0.31 0.14 -4.55 118.33 120.03 1p92 n VAL 166 Ca 0.06 -0.79 -0.10 0.00 -0.01 0.00 0.00 64.34 63.49 1p92 n VAL 166 Cb 0.48 -0.98 -0.07 0.00 -0.91 0.00 0.00 33.84 32.36 1p92 n VAL 166 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1p92 s GLN 167 N -2.57 0.58 -0.17 5.55 -2.07 -0.98 -4.93 119.66 115.08 1p92 s GLN 167 Ca -0.09 0.56 0.17 0.00 -1.82 0.00 0.00 55.36 54.19 1p92 s GLN 167 Cb 0.07 0.28 -0.25 0.00 -1.09 0.00 0.00 33.01 32.03 1p92 s GLN 167 CO 0.81 -0.10 0.12 -0.89 -1.32 0.00 0.00 175.29 173.92 1p92 n ILE 168 N 1.98 1.12 -3.62 3.63 5.41 -1.26 -1.14 119.36 125.48 1p92 n ILE 168 Ca -0.13 -0.76 -0.23 0.00 1.00 0.00 0.00 62.75 62.63 1p92 n ILE 168 Cb 0.56 -0.42 0.04 0.00 -0.71 0.00 0.00 39.64 39.12 1p92 n ILE 168 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1p92 n ASN 169 N -2.64 -3.28 0.25 4.38 3.02 -1.26 -4.21 115.26 111.53 1p92 n ASN 169 Ca -0.27 -0.86 0.12 0.00 -0.03 0.00 0.00 54.58 53.54 1p92 n ASN 169 Cb 1.04 -4.07 0.66 0.00 -0.61 0.00 0.00 39.78 36.80 1p92 n ASN 169 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 1p92 h GLU 170 N -1.74 0.00 -0.24 3.52 9.09 -1.97 -2.63 114.58 120.61 1p92 h GLU 170 Ca -0.63 0.00 0.04 0.00 0.05 0.00 0.00 59.36 58.82 1p92 h GLU 170 Cb 1.35 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.44 1p92 h GLU 170 CO 0.52 0.15 0.17 0.97 0.05 0.00 0.00 179.01 180.86 1p92 h ILE 171 N 0.00 0.97 -0.01 -1.06 2.10 -2.05 -1.50 117.51 115.96 1p92 h ILE 171 Ca -0.00 -0.06 0.00 0.00 1.08 0.00 0.00 64.86 65.88 1p92 h ILE 171 Cb 0.46 0.78 0.00 0.00 -1.09 0.00 0.00 36.82 36.98 1p92 h ILE 171 CO 0.02 0.03 -0.12 0.49 -1.08 0.00 0.00 178.15 177.49 1p92 n PHE 172 N -4.49 0.00 -3.01 2.19 0.99 -0.99 -4.94 117.46 107.21 1p92 n PHE 172 Ca 0.02 0.00 -0.32 0.00 -0.00 0.00 0.00 57.45 57.15 1p92 n PHE 172 Cb 0.20 -0.09 -0.06 0.00 -1.00 0.00 0.00 39.48 38.53 1p92 n PHE 172 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 1p92 s GLN 173 N -2.30 3.98 -0.10 -1.08 -1.52 -0.57 -4.96 119.66 113.11 1p92 s GLN 173 Ca 0.31 0.69 0.04 0.00 -1.95 0.00 0.00 55.36 54.45 1p92 s GLN 173 Cb 0.20 -2.38 -0.09 0.00 -0.22 0.00 0.00 33.01 30.52 1p92 s GLN 173 CO 0.44 0.08 -0.04 0.28 -0.25 0.00 0.00 175.29 175.80 1p92 n VAL 174 N -0.64 0.60 -2.77 1.09 0.31 -1.26 -4.86 118.33 110.80 1p92 n VAL 174 Ca 0.04 -0.29 -0.43 0.00 -0.01 0.00 0.00 64.34 63.65 1p92 n VAL 174 Cb 0.53 -0.84 -0.03 0.00 -0.91 0.00 0.00 33.84 32.60 1p92 n VAL 174 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1p92 s GLU 175 N -2.21 3.35 0.34 5.55 2.56 -1.26 -4.89 118.70 122.14 1p92 s GLU 175 Ca -0.10 -1.05 0.20 0.00 0.00 0.00 0.00 54.97 54.02 1p92 s GLU 175 Cb 0.03 -4.62 0.19 0.00 2.00 0.00 0.00 34.13 31.73 1p92 s GLU 175 CO 0.29 -1.93 1.46 1.15 -0.56 0.00 0.00 175.26 175.68 1p92 h THR 176 N 6.09 0.35 -1.18 -1.70 2.02 -1.99 -3.38 112.91 113.12 1p92 h THR 176 Ca -0.07 -1.51 0.34 0.00 0.77 0.00 0.00 66.41 65.93 1p92 h THR 176 Cb 1.04 2.12 -0.09 0.00 -1.74 0.00 0.00 68.15 69.48 1p92 h THR 176 CO 1.22 0.20 0.78 0.44 0.37 0.00 0.00 175.52 178.54 1p92 h ASP 177 N 0.00 0.28 1.29 4.18 3.32 -2.03 -0.63 116.42 122.82 1p92 h ASP 177 Ca -0.01 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1p92 h ASP 177 Cb 1.17 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1p92 h ASP 177 CO 0.03 -0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.54 1p92 n GLN 178 N -4.51 0.22 -0.02 3.56 6.02 -1.26 -3.99 117.38 117.39 1p92 n GLN 178 Ca 0.29 0.23 -0.09 0.00 -0.01 0.00 0.00 57.00 57.42 1p92 n GLN 178 Cb 1.14 -1.78 -0.02 0.00 1.02 0.00 0.00 30.24 30.60 1p92 n GLN 178 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 1p92 h PHE 179 N 0.00 -0.44 -0.15 1.08 0.04 -1.40 0.92 116.94 117.00 1p92 h PHE 179 Ca 0.00 0.03 -0.11 0.00 2.80 0.00 0.00 57.97 60.69 1p92 h PHE 179 Cb 0.64 0.22 -0.01 0.00 2.20 0.00 0.00 35.95 39.00 1p92 h PHE 179 CO 0.00 -0.24 -0.38 1.15 -0.60 0.00 0.00 178.31 178.23 1p92 h THR 180 N -0.19 1.30 -0.10 -1.55 2.02 -1.77 -1.00 112.91 111.62 1p92 h THR 180 Ca 0.11 -1.48 0.02 0.00 0.77 0.00 0.00 66.41 65.84 1p92 h THR 180 Cb 0.36 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.36 1p92 h THR 180 CO -0.30 0.45 -0.05 -0.61 0.37 0.00 0.00 175.52 175.38 1p92 h GLN 181 N 0.27 -0.04 0.09 6.66 4.15 -1.48 0.15 115.11 124.92 1p92 h GLN 181 Ca 0.03 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.45 1p92 h GLN 181 Cb 0.80 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.50 1p92 h GLN 181 CO 0.06 -0.03 -0.05 -0.07 -1.93 0.00 0.00 178.83 176.82 1p92 h LEU 182 N -0.04 -0.11 -1.35 -2.39 4.07 -0.54 -2.72 115.31 112.24 1p92 h LEU 182 Ca 0.06 -0.03 0.16 0.00 0.08 0.00 0.00 57.88 58.14 1p92 h LEU 182 Cb 0.13 0.03 -0.07 0.00 1.08 0.00 0.00 40.66 41.83 1p92 h LEU 182 CO -0.13 -0.04 0.57 0.25 -1.08 0.00 0.00 178.44 178.01 1p92 h LEU 183 N -0.16 0.59 -0.32 1.67 5.85 -0.71 0.10 115.31 122.32 1p92 h LEU 183 Ca -0.01 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 1p92 h LEU 183 Cb 0.13 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1p92 h LEU 183 CO 0.02 0.28 0.06 0.44 -0.34 0.00 0.00 178.44 178.91 1p92 h ASP 184 N 0.61 0.51 -0.26 1.25 3.32 -0.40 -1.42 116.42 120.04 1p92 h ASP 184 Ca 0.45 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1p92 h ASP 184 Cb 0.82 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.23 1p92 h ASP 184 CO -0.20 0.63 0.00 0.00 -1.72 0.00 0.00 179.24 177.95 1p92 n ALA 185 N -2.34 2.64 -0.31 3.45 0.00 -0.78 -4.97 120.51 118.21 1p92 n ALA 185 Ca -0.02 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.85 1p92 n ALA 185 Cb 0.21 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1p92 n ALA 185 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1p92 n ASP 186 N 0.30 0.00 -3.11 0.00 -0.08 0.29 -4.50 116.55 109.44 1p92 n ASP 186 Ca 0.10 0.00 -0.05 0.00 -1.51 0.00 0.00 54.79 53.32 1p92 n ASP 186 Cb 0.36 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.82 1p92 n ASP 186 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1p92 n ILE 187 N 0.00 -4.91 0.10 5.18 5.41 -1.24 -3.29 119.36 120.61 1p92 n ILE 187 Ca 0.00 0.77 0.00 0.00 1.00 0.00 0.00 62.75 64.52 1p92 n ILE 187 Cb 0.00 -4.14 0.00 0.00 -0.71 0.00 0.00 39.64 34.79 1p92 n ILE 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1p92 n ARG 188 N 0.90 0.00 -2.83 0.38 5.12 -1.26 -4.64 116.66 114.33 1p92 n ARG 188 Ca -0.01 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.80 1p92 n ARG 188 Cb 0.41 -0.21 0.05 0.00 -1.16 0.00 0.00 32.46 31.55 1p92 n ARG 188 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1p92 n VAL 189 N -3.44 -0.08 -3.98 1.55 0.31 -1.26 -4.81 118.33 106.62 1p92 n VAL 189 Ca 0.00 -2.12 -0.09 0.00 -0.01 0.00 0.00 64.34 62.12 1p92 n VAL 189 Cb 0.00 0.99 -0.04 0.00 -0.91 0.00 0.00 33.84 33.88 1p92 n VAL 189 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1p92 s GLY 190 N -1.54 0.55 0.51 2.92 0.00 -1.26 -4.74 107.32 103.75 1p92 s GLY 190 Ca 0.28 -0.87 -0.20 0.00 0.00 0.00 0.00 44.72 43.93 1p92 s GLY 190 CO -0.12 -0.57 0.72 1.44 0.00 0.00 0.00 173.10 174.57 1p92 n SER 191 N -0.59 -0.17 -3.50 1.64 7.64 -1.25 -3.82 113.62 113.56 1p92 n SER 191 Ca -0.02 0.85 -0.11 0.00 1.01 0.00 0.00 58.87 60.60 1p92 n SER 191 Cb 0.61 -1.24 -0.02 0.00 -1.01 0.00 0.00 64.21 62.55 1p92 n SER 191 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1p92 s GLU 192 N -2.09 1.36 -0.18 1.43 0.41 -0.64 -4.22 118.70 114.77 1p92 s GLU 192 Ca 0.68 -0.56 -0.14 0.00 -0.41 0.00 0.00 54.97 54.53 1p92 s GLU 192 Cb -0.50 0.59 -0.04 0.00 -1.78 0.00 0.00 34.13 32.40 1p92 s GLU 192 CO 0.54 -0.60 0.32 0.08 -0.49 0.00 0.00 175.26 175.11 1p92 s VAL 193 N -3.76 5.27 -0.05 2.63 1.01 -0.06 -1.78 120.40 123.67 1p92 s VAL 193 Ca 0.03 0.58 0.01 0.00 0.00 0.00 0.00 61.98 62.61 1p92 s VAL 193 Cb -0.02 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1p92 s VAL 193 CO -0.09 0.34 -0.06 -1.83 0.00 0.00 0.00 175.10 173.45 1p92 s GLU 194 N 0.81 2.70 -0.12 2.72 1.03 -0.09 -2.73 118.70 123.02 1p92 s GLU 194 Ca 0.17 -0.59 -0.30 0.00 0.03 0.00 0.00 54.97 54.27 1p92 s GLU 194 Cb -0.14 -2.58 0.09 0.00 -0.80 0.00 0.00 34.13 30.71 1p92 s GLU 194 CO 0.05 0.65 0.82 0.42 -1.33 0.00 0.00 175.26 175.87 1p92 s ILE 195 N -0.88 0.00 0.03 1.83 1.09 -1.24 -2.79 121.20 119.24 1p92 s ILE 195 Ca 0.14 0.00 0.00 0.00 -1.10 0.00 0.00 60.65 59.69 1p92 s ILE 195 Cb -0.11 -1.00 0.00 0.00 -1.06 0.00 0.00 42.46 40.29 1p92 s ILE 195 CO 0.04 0.00 0.01 0.52 -0.10 0.00 0.00 174.94 175.40 1p92 n VAL 196 N 1.05 0.00 0.00 2.92 0.31 -0.90 -2.60 118.33 119.11 1p92 n VAL 196 Ca -0.15 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1p92 n VAL 196 Cb 0.57 -0.15 0.00 0.00 -0.91 0.00 0.00 33.84 33.35 1p92 n VAL 196 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1p92 n ASP 197 N -1.37 0.00 -2.09 4.52 5.75 -1.26 -4.56 116.55 117.54 1p92 n ASP 197 Ca -0.01 0.00 -0.17 0.00 -0.01 0.00 0.00 54.79 54.60 1p92 n ASP 197 Cb 0.04 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.07 1p92 n ASP 197 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1p92 n ARG 198 N 0.00 1.97 -1.04 0.11 5.12 -1.26 -4.65 116.66 116.91 1p92 n ARG 198 Ca 0.00 -1.50 -0.01 0.00 -1.93 0.00 0.00 57.85 54.41 1p92 n ARG 198 Cb 0.00 -1.83 -0.01 0.00 -1.16 0.00 0.00 32.46 29.46 1p92 n ARG 198 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1p92 n ASP 199 N 1.26 -5.82 -4.43 0.55 8.00 -1.26 -4.94 116.55 109.90 1p92 n ASP 199 Ca 0.36 0.04 -0.39 0.00 0.71 0.00 0.00 54.79 55.51 1p92 n ASP 199 Cb 0.65 -3.45 -0.12 0.00 -0.02 0.00 0.00 41.12 38.18 1p92 n ASP 199 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1p92 s GLY 200 N -2.06 1.86 0.13 0.44 0.00 -1.26 -5.04 107.32 101.40 1p92 s GLY 200 Ca 0.00 -1.40 -0.29 0.00 0.00 0.00 0.00 44.72 43.03 1p92 s GLY 200 CO 0.00 0.69 0.93 0.30 0.00 0.00 0.00 173.10 175.03 1p92 s HIS 201 N 1.61 3.84 0.37 1.90 3.76 -1.26 -4.26 115.29 121.24 1p92 s HIS 201 Ca 0.04 1.79 0.08 0.00 -0.15 0.00 0.00 55.06 56.83 1p92 s HIS 201 Cb -0.17 -3.01 -0.06 0.00 1.11 0.00 0.00 32.58 30.45 1p92 s HIS 201 CO 0.06 0.27 0.04 0.42 -0.85 0.00 0.00 174.74 174.68 1p92 s ILE 202 N -0.26 2.44 -0.18 0.60 1.01 -1.07 -1.45 121.20 122.30 1p92 s ILE 202 Ca 0.45 -1.94 -0.13 0.00 0.00 0.00 0.00 60.65 59.03 1p92 s ILE 202 Cb -0.24 -2.86 0.05 0.00 0.01 0.00 0.00 42.46 39.43 1p92 s ILE 202 CO 0.29 -0.13 0.45 -0.89 0.00 0.00 0.00 174.94 174.66 1p92 s THR 203 N -2.57 -0.01 -0.10 2.92 2.01 -0.95 -3.71 115.64 113.23 1p92 s THR 203 Ca 0.36 0.04 0.01 0.00 0.31 0.00 0.00 61.69 62.41 1p92 s THR 203 Cb 0.02 -0.64 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 1p92 s THR 203 CO 0.20 0.02 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.25 1p92 s LEU 204 N 0.79 2.75 0.00 4.42 1.43 -1.10 -1.67 118.68 125.29 1p92 s LEU 204 Ca -0.04 -0.27 0.01 0.00 -1.03 0.00 0.00 54.13 52.80 1p92 s LEU 204 Cb -0.05 -1.60 0.01 0.00 0.03 0.00 0.00 46.19 44.58 1p92 s LEU 204 CO -0.06 0.24 0.10 -0.24 0.23 0.00 0.00 176.35 176.62 1p92 n SER 205 N 3.06 1.60 0.00 2.29 2.88 -1.21 -0.88 113.62 121.35 1p92 n SER 205 Ca -0.18 -1.55 0.00 0.00 -1.33 0.00 0.00 58.87 55.81 1p92 n SER 205 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 1p92 n SER 205 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1p92 n HIS 206 N -0.81 0.00 -3.41 0.66 8.25 -1.26 -2.69 115.22 115.96 1p92 n HIS 206 Ca -0.01 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.19 1p92 n HIS 206 Cb 0.18 -0.17 -0.08 0.00 1.12 0.00 0.00 29.99 31.03 1p92 n HIS 206 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1p92 n ASN 207 N -1.09 1.88 0.00 0.41 3.02 -1.26 -5.02 115.26 113.20 1p92 n ASN 207 Ca 0.00 -3.02 0.00 0.00 -0.03 0.00 0.00 54.58 51.53 1p92 n ASN 207 Cb 0.12 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.63 1p92 n ASN 207 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p92 n GLY 208 N 1.45 0.00 3.06 7.41 0.00 -1.10 -4.83 105.19 111.19 1p92 n GLY 208 Ca 0.25 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.12 1p92 n GLY 208 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p92 s LYS 209 N 0.00 0.60 -0.03 1.61 0.00 -1.26 -4.98 119.74 115.67 1p92 s LYS 209 Ca 0.00 -0.62 0.01 0.00 0.00 0.00 0.00 55.97 55.36 1p92 s LYS 209 Cb 0.00 -0.48 -0.03 0.00 0.00 0.00 0.00 37.83 37.32 1p92 s LYS 209 CO 0.00 0.11 -0.03 -0.51 0.00 0.00 0.00 175.35 174.92 1p92 s ASP 210 N -1.12 4.96 -0.16 0.03 1.01 -1.25 -3.35 116.67 116.78 1p92 s ASP 210 Ca -0.04 -0.01 -0.03 0.00 0.71 0.00 0.00 52.55 53.18 1p92 s ASP 210 Cb -0.07 -1.28 0.05 0.00 1.01 0.00 0.00 42.92 42.63 1p92 s ASP 210 CO 0.00 0.32 0.05 -0.69 0.21 0.00 0.00 175.17 175.06 1p92 s VAL 211 N -0.97 0.29 -0.56 -1.27 1.01 -0.67 -4.90 120.40 113.33 1p92 s VAL 211 Ca 0.16 -0.30 -0.25 0.00 0.00 0.00 0.00 61.98 61.60 1p92 s VAL 211 Cb -0.11 -0.78 0.04 0.00 0.00 0.00 0.00 36.38 35.52 1p92 s VAL 211 CO 0.06 -0.15 0.97 -0.70 0.00 0.00 0.00 175.10 175.29 1p92 s GLU 212 N 1.97 3.34 0.45 2.72 2.12 -1.26 -2.23 118.70 125.81 1p92 s GLU 212 Ca 0.01 -0.22 -0.22 0.00 0.36 0.00 0.00 54.97 54.89 1p92 s GLU 212 Cb -0.16 -4.06 -0.08 0.00 0.26 0.00 0.00 34.13 30.09 1p92 s GLU 212 CO -0.08 -1.52 1.08 -0.51 -0.54 0.00 0.00 175.26 173.69 1p92 s LEU 213 N 4.08 4.00 0.20 2.70 1.43 -0.52 -5.01 118.68 125.55 1p92 s LEU 213 Ca 0.32 2.07 -0.11 0.00 -1.03 0.00 0.00 54.13 55.38 1p92 s LEU 213 Cb -0.12 -4.34 -0.07 0.00 0.03 0.00 0.00 46.19 41.69 1p92 s LEU 213 CO 0.20 -0.72 0.54 -0.76 0.23 0.00 0.00 176.35 175.83 1p92 s LEU 214 N -3.06 4.23 0.12 1.79 1.43 -1.26 -4.53 118.68 117.39 1p92 s LEU 214 Ca 0.63 0.95 -0.14 0.00 -1.03 0.00 0.00 54.13 54.54 1p92 s LEU 214 Cb -0.22 -3.53 0.06 0.00 0.03 0.00 0.00 46.19 42.53 1p92 s LEU 214 CO 0.27 -0.01 0.92 0.47 0.23 0.00 0.00 176.35 178.23 1p92 n ASP 215 N 0.18 -0.50 -0.30 2.29 8.00 -1.26 -0.46 116.55 124.49 1p92 n ASP 215 Ca -0.02 1.05 -0.04 0.00 0.71 0.00 0.00 54.79 56.49 1p92 n ASP 215 Cb 0.52 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.43 1p92 n ASP 215 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1p92 h ASP 216 N 0.00 -1.44 -0.19 -2.24 3.32 -1.99 0.21 116.42 114.10 1p92 h ASP 216 Ca 0.16 0.28 -0.14 0.00 0.02 0.00 0.00 57.03 57.34 1p92 h ASP 216 Cb 0.30 0.71 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 1p92 h ASP 216 CO -0.58 -0.30 -0.37 0.25 -1.72 0.00 0.00 179.24 176.52 1p92 h LEU 217 N -0.09 0.75 -0.95 1.55 5.85 -1.15 -2.59 115.31 118.68 1p92 h LEU 217 Ca 0.27 -0.33 -0.09 0.00 0.84 0.00 0.00 57.88 58.57 1p92 h LEU 217 Cb 0.56 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1p92 h LEU 217 CO -0.84 1.04 -0.15 0.00 -0.34 0.00 0.00 178.44 178.15 1p92 h ALA 218 N 0.99 1.11 -0.01 1.25 0.00 -0.14 0.19 119.26 122.66 1p92 h ALA 218 Ca 0.05 -0.31 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 1p92 h ALA 218 Cb 0.90 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1p92 h ALA 218 CO 0.08 0.55 -0.72 0.45 0.00 0.00 0.00 179.25 179.61 1p92 h HIS 219 N 0.54 0.11 0.08 0.00 3.86 -0.62 -0.16 115.15 118.96 1p92 h HIS 219 Ca 0.09 -0.05 -0.35 0.00 -1.16 0.00 0.00 60.37 58.90 1p92 h HIS 219 Cb 0.57 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 29.00 1p92 h HIS 219 CO 0.02 0.77 -1.98 2.41 0.86 0.00 0.00 177.93 180.02 1p92 n THR 220 N -3.72 1.68 -1.82 2.45 -1.04 -0.96 -4.69 114.28 106.18 1p92 n THR 220 Ca -0.02 -0.52 -0.42 0.00 -2.04 0.00 0.00 64.05 61.06 1p92 n THR 220 Cb 0.70 -1.75 -0.03 0.00 -1.82 0.00 0.00 70.33 67.43 1p92 n THR 220 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1p92 s ILE 221 N -2.51 2.27 -0.16 12.58 1.01 0.64 -4.79 121.20 130.24 1p92 s ILE 221 Ca -0.26 0.20 -0.00 0.00 0.00 0.00 0.00 60.65 60.58 1p92 s ILE 221 Cb 0.07 -3.13 -0.00 0.00 0.01 0.00 0.00 42.46 39.41 1p92 s ILE 221 CO 0.70 0.02 -0.14 -0.13 0.00 0.00 0.00 174.94 175.38 1p92 s ARG 222 N 0.91 3.26 0.00 2.79 0.52 -0.29 -0.63 118.95 125.52 1p92 s ARG 222 Ca 0.71 -0.73 0.00 0.00 -0.52 0.00 0.00 55.73 55.20 1p92 s ARG 222 Cb -0.47 -2.66 0.00 0.00 0.52 0.00 0.00 34.95 32.34 1p92 s ARG 222 CO 0.34 0.03 0.00 0.44 0.02 0.00 0.00 175.30 176.13 1p92 n ILE 223 N 4.02 0.00 0.00 1.52 -5.35 -0.45 -0.68 119.36 118.42 1p92 n ILE 223 Ca -0.19 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 1p92 n ILE 223 Cb 0.52 -0.01 0.00 0.00 -1.74 0.00 0.00 39.64 38.41 1p92 n ILE 223 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1p92 n GLU 224 N 0.00 0.00 -0.92 6.28 2.13 0.42 -2.24 120.64 126.30 1p92 n GLU 224 Ca 0.00 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.50 1p92 n GLU 224 Cb 0.00 0.00 0.14 0.00 0.27 0.00 0.00 31.44 31.85 1p92 n GLU 224 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 1p92 s GLU 225 N 0.00 1.37 0.00 5.31 2.56 -1.26 -1.46 118.70 125.22 1p92 s GLU 225 Ca 0.00 1.62 0.00 0.00 0.00 0.00 0.00 54.97 56.59 1p92 s GLU 225 Cb 0.00 -1.76 0.00 0.00 2.00 0.00 0.00 34.13 34.37 1p92 s GLU 225 CO 0.00 -2.39 0.00 1.47 -0.56 0.00 0.00 175.26 173.78