#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k73 h LEU 2 N 0.00 0.91 -1.39 3.17 4.07 -2.01 -2.61 115.31 117.44 2k73 h LEU 2 Ca 0.00 -0.27 0.23 0.00 0.08 0.00 0.00 57.88 57.92 2k73 h LEU 2 Cb 0.00 -0.24 -0.08 0.00 1.08 0.00 0.00 40.66 41.41 2k73 h LEU 2 CO 0.00 1.00 0.64 -0.09 -1.08 0.00 0.00 178.44 178.91 2k73 h ARG 3 N 0.84 0.43 -0.03 1.13 2.43 -2.02 0.15 114.38 117.31 2k73 h ARG 3 Ca 0.14 -0.03 -0.25 0.00 -0.81 0.00 0.00 59.98 59.03 2k73 h ARG 3 Cb 0.59 -0.10 0.02 0.00 -0.42 0.00 0.00 29.97 30.06 2k73 h ARG 3 CO 0.04 0.28 -0.98 0.74 -1.51 0.00 0.00 179.97 178.54 2k73 h PHE 4 N 0.44 1.04 -0.99 2.20 -1.00 -1.92 -3.23 116.94 113.48 2k73 h PHE 4 Ca 0.54 -0.54 0.31 0.00 2.81 0.00 0.00 57.97 61.09 2k73 h PHE 4 Cb 1.31 -0.13 -0.15 0.00 3.61 0.00 0.00 35.95 40.60 2k73 h PHE 4 CO -0.00 1.38 0.54 1.25 -1.61 0.00 0.00 178.31 179.86 2k73 h LEU 5 N 0.40 0.47 -1.39 1.54 5.85 -0.46 2.38 115.31 124.11 2k73 h LEU 5 Ca -0.11 0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2k73 h LEU 5 Cb 1.63 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.80 2k73 h LEU 5 CO 0.19 -0.12 -0.09 0.78 -0.34 0.00 0.00 178.44 178.86 2k73 h ASN 6 N 0.33 0.00 0.08 1.25 2.35 -1.51 -1.97 115.58 116.10 2k73 h ASN 6 Ca 0.71 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 56.36 2k73 h ASN 6 Cb 1.59 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.97 2k73 h ASN 6 CO -0.60 0.09 -0.44 -0.61 -1.65 0.00 0.00 177.43 174.21 2k73 h GLN 7 N 0.00 0.17 -0.12 0.81 4.15 0.39 -2.01 115.11 118.50 2k73 h GLN 7 Ca -0.00 -0.28 -0.06 0.00 0.77 0.00 0.00 58.65 59.08 2k73 h GLN 7 Cb 0.58 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.36 2k73 h GLN 7 CO 0.01 1.13 -0.18 0.00 -1.93 0.00 0.00 178.83 177.86 2k73 h ALA 8 N 0.05 1.48 0.01 3.38 0.00 -1.00 -2.88 119.26 120.29 2k73 h ALA 8 Ca -0.08 -0.23 -0.23 0.00 0.00 0.00 0.00 54.91 54.37 2k73 h ALA 8 Cb 1.35 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 19.08 2k73 h ALA 8 CO 0.08 0.37 -0.91 0.77 0.00 0.00 0.00 179.25 179.57 2k73 h SER 9 N 0.18 0.78 0.00 0.00 0.02 -1.44 -3.06 113.55 110.04 2k73 h SER 9 Ca 0.04 -0.75 0.00 0.00 -0.84 0.00 0.00 61.79 60.23 2k73 h SER 9 Cb 0.43 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.73 2k73 h SER 9 CO 0.03 1.44 0.00 0.00 -1.14 0.00 0.00 176.83 177.15 2k73 n GLN 10 N -3.98 0.52 -3.82 3.45 -0.00 -0.75 -4.53 117.38 108.26 2k73 n GLN 10 Ca -0.11 0.00 -0.36 0.00 -0.00 0.00 0.00 57.00 56.53 2k73 n GLN 10 Cb 0.82 -1.05 -0.06 0.00 -0.00 0.00 0.00 30.24 29.95 2k73 n GLN 10 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 2k73 s GLY 11 N -1.54 2.22 0.59 2.61 0.00 -1.16 -4.94 107.32 105.11 2k73 s GLY 11 Ca 0.03 -0.61 0.37 0.00 0.00 0.00 0.00 44.72 44.51 2k73 s GLY 11 CO 0.02 -0.39 2.14 3.21 0.00 0.00 0.00 173.10 178.08 2k73 h ARG 12 N 4.46 0.00 -0.11 2.90 3.08 -1.87 -2.84 114.38 120.01 2k73 h ARG 12 Ca -0.52 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.49 2k73 h ARG 12 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.26 2k73 h ARG 12 CO 0.63 0.02 -0.07 0.78 -1.07 0.00 0.00 179.97 180.26 2k73 h GLY 13 N 1.13 0.26 0.99 0.04 0.00 -1.92 -1.69 103.07 101.87 2k73 h GLY 13 Ca -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 2k73 h GLY 13 CO 0.00 0.22 -0.08 0.00 0.00 0.00 0.00 176.54 176.69 2k73 h ALA 14 N 0.62 -0.22 -0.50 3.60 0.00 -1.66 0.16 119.26 121.27 2k73 h ALA 14 Ca 0.02 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.94 2k73 h ALA 14 Cb 0.55 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 2k73 h ALA 14 CO 0.02 -0.61 0.20 -1.49 0.00 0.00 0.00 179.25 177.37 2k73 h TRP 15 N -0.23 0.36 -0.12 0.00 4.06 -1.58 -0.26 115.95 118.16 2k73 h TRP 15 Ca -0.02 0.02 -0.05 0.00 2.06 0.00 0.00 58.89 60.90 2k73 h TRP 15 Cb 0.18 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.24 2k73 h TRP 15 CO -0.06 0.13 -0.16 1.25 -3.56 0.00 0.00 178.44 176.04 2k73 h LEU 16 N 0.39 0.19 -1.16 -4.49 5.85 -1.05 -1.95 115.31 113.09 2k73 h LEU 16 Ca 0.24 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.84 2k73 h LEU 16 Cb 0.22 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 2k73 h LEU 16 CO -0.22 0.37 -0.38 -0.07 -0.34 0.00 0.00 178.44 177.80 2k73 h LEU 17 N 0.19 0.00 -0.34 2.25 -0.00 0.99 -2.72 115.31 115.67 2k73 h LEU 17 Ca 0.04 0.00 -0.19 0.00 -0.00 0.00 0.00 57.88 57.72 2k73 h LEU 17 Cb 0.40 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.06 2k73 h LEU 17 CO 0.03 0.38 -0.82 0.24 -0.00 0.00 0.00 178.44 178.27 2k73 h MET 18 N 0.00 0.29 0.26 1.13 2.86 -0.45 -2.82 114.93 116.20 2k73 h MET 18 Ca -0.00 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.34 2k73 h MET 18 Cb 0.76 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.50 2k73 h MET 18 CO 0.05 0.96 -0.13 0.00 1.06 0.00 0.00 176.91 178.86 2k73 h ALA 19 N 0.94 -0.35 -0.03 6.32 0.00 -1.21 -2.93 119.26 122.01 2k73 h ALA 19 Ca -0.04 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.74 2k73 h ALA 19 Cb 1.42 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.30 2k73 h ALA 19 CO 0.13 -0.56 -0.22 0.35 0.00 0.00 0.00 179.25 178.94 2k73 h PHE 20 N -0.62 -0.60 -0.86 0.00 3.57 -1.57 -2.07 116.94 114.80 2k73 h PHE 20 Ca -0.04 0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.67 2k73 h PHE 20 Cb 0.44 0.27 -0.16 0.00 2.79 0.00 0.00 35.95 39.29 2k73 h PHE 20 CO 0.01 -0.31 -0.14 1.79 -2.23 0.00 0.00 178.31 177.43 2k73 h THR 21 N -0.34 0.16 -0.58 4.41 1.35 -1.52 1.35 112.91 117.75 2k73 h THR 21 Ca 0.07 -0.01 0.06 0.00 -0.55 0.00 0.00 66.41 65.98 2k73 h THR 21 Cb 0.43 0.14 -0.03 0.00 -1.73 0.00 0.00 68.15 66.96 2k73 h THR 21 CO -0.23 0.00 0.38 0.00 -0.25 0.00 0.00 175.52 175.43 2k73 h ALA 22 N 1.85 1.84 0.06 6.62 0.00 -1.19 -1.77 119.26 126.67 2k73 h ALA 22 Ca 0.44 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 55.06 2k73 h ALA 22 Cb 0.73 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.41 2k73 h ALA 22 CO -0.85 0.06 -1.12 1.25 0.00 0.00 0.00 179.25 178.59 2k73 h LEU 23 N 0.55 0.79 -0.81 0.00 6.46 0.19 -2.90 115.31 119.59 2k73 h LEU 23 Ca 0.25 -0.68 0.18 0.00 -0.12 0.00 0.00 57.88 57.50 2k73 h LEU 23 Cb 0.29 -0.25 -0.11 0.00 -0.73 0.00 0.00 40.66 39.86 2k73 h LEU 23 CO -0.07 1.49 0.29 0.00 -0.62 0.00 0.00 178.44 179.53 2k73 h ALA 24 N 0.44 1.16 -0.00 1.25 0.00 0.63 0.54 119.26 123.28 2k73 h ALA 24 Ca -0.14 0.15 -0.18 0.00 0.00 0.00 0.00 54.91 54.74 2k73 h ALA 24 Cb 1.78 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.73 2k73 h ALA 24 CO 0.21 -0.31 -0.83 -0.07 0.00 0.00 0.00 179.25 178.26 2k73 h LEU 25 N 0.36 0.13 -0.01 0.00 4.07 -1.57 -2.37 115.31 115.93 2k73 h LEU 25 Ca 0.47 -0.11 -0.00 0.00 0.08 0.00 0.00 57.88 58.32 2k73 h LEU 25 Cb 0.82 -0.04 -0.00 0.00 1.08 0.00 0.00 40.66 42.52 2k73 h LEU 25 CO -0.50 0.90 -0.00 -0.08 -1.08 0.00 0.00 178.44 177.68 2k73 h GLU 26 N 0.06 0.01 0.62 1.13 4.81 -0.39 -2.57 114.58 118.24 2k73 h GLU 26 Ca -0.03 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 2k73 h GLU 26 Cb 1.44 -0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.83 2k73 h GLU 26 CO 0.12 0.38 -0.30 1.25 -0.73 0.00 0.00 179.01 179.73 2k73 h LEU 27 N -0.36 -0.70 -1.52 1.64 6.46 -0.17 0.32 115.31 120.99 2k73 h LEU 27 Ca 0.00 -0.02 0.37 0.00 -0.12 0.00 0.00 57.88 58.11 2k73 h LEU 27 Cb 0.38 0.18 -0.10 0.00 -0.73 0.00 0.00 40.66 40.39 2k73 h LEU 27 CO 0.00 -0.38 0.83 0.71 -0.62 0.00 0.00 178.44 178.98 2k73 h THR 28 N -1.03 0.29 0.08 1.05 1.35 -1.52 0.67 112.91 113.81 2k73 h THR 28 Ca -0.08 -0.06 -0.17 0.00 -0.55 0.00 0.00 66.41 65.55 2k73 h THR 28 Cb 0.68 0.11 0.00 0.00 -1.73 0.00 0.00 68.15 67.21 2k73 h THR 28 CO 0.14 0.03 -0.83 0.00 -0.25 0.00 0.00 175.52 174.61 2k73 h ALA 29 N 1.54 0.05 0.00 6.62 0.00 -1.20 -3.26 119.26 123.01 2k73 h ALA 29 Ca 0.71 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2k73 h ALA 29 Cb 2.25 0.26 0.00 0.00 0.00 0.00 0.00 17.79 20.30 2k73 h ALA 29 CO -0.29 0.45 0.40 1.25 0.00 0.00 0.00 179.25 181.06 2k73 h LEU 30 N -0.60 0.00 0.00 0.00 7.12 0.20 1.19 115.31 123.22 2k73 h LEU 30 Ca -0.18 0.00 -0.19 0.00 0.13 0.00 0.00 57.88 57.64 2k73 h LEU 30 Cb 1.46 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 41.56 2k73 h LEU 30 CO 0.04 0.00 -1.76 1.87 -0.13 0.00 0.00 178.44 178.46 2k73 n TRP 31 N -2.19 0.58 -0.08 1.25 -0.00 -0.84 -3.24 117.44 112.93 2k73 n TRP 31 Ca -0.01 0.20 -0.14 0.00 -0.00 0.00 0.00 57.50 57.55 2k73 n TRP 31 Cb 0.42 -0.97 -0.05 0.00 -0.00 0.00 0.00 31.31 30.71 2k73 n TRP 31 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 177.69 178.04 2k73 h PHE 32 N 0.00 0.77 -0.03 5.87 3.04 0.14 -2.89 116.94 123.84 2k73 h PHE 32 Ca -0.23 -0.25 -0.05 0.00 3.98 0.00 0.00 57.97 61.42 2k73 h PHE 32 Cb 1.66 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 40.02 2k73 h PHE 32 CO 0.00 0.98 -0.16 0.37 -2.02 0.00 0.00 178.31 177.48 2k73 h GLN 33 N 0.35 0.16 -0.86 1.11 4.15 -1.65 0.81 115.11 119.17 2k73 h GLN 33 Ca 0.03 -0.13 0.25 0.00 0.77 0.00 0.00 58.65 59.57 2k73 h GLN 33 Cb 0.87 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.56 2k73 h GLN 33 CO 0.07 0.80 0.69 1.25 -1.93 0.00 0.00 178.83 179.71 2k73 h HIS 34 N -0.45 0.00 0.00 3.99 2.76 -1.62 2.24 115.15 122.07 2k73 h HIS 34 Ca -0.01 0.00 -0.41 0.00 -2.20 0.00 0.00 60.37 57.75 2k73 h HIS 34 Cb 0.84 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 29.73 2k73 h HIS 34 CO 0.15 0.00 -2.44 0.28 -1.30 0.00 0.00 177.93 174.63 2k73 n VAL 35 N -4.04 1.43 1.86 5.26 0.31 -1.09 -4.34 118.33 117.72 2k73 n VAL 35 Ca 0.18 -0.45 0.12 0.00 -0.01 0.00 0.00 64.34 64.18 2k73 n VAL 35 Cb 0.99 -1.63 0.70 0.00 -0.91 0.00 0.00 33.84 33.00 2k73 n VAL 35 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2k73 n MET 36 N -3.73 0.93 -4.32 5.55 0.00 0.28 -4.88 117.12 110.96 2k73 n MET 36 Ca -0.48 0.00 -0.36 0.00 -0.00 0.00 0.00 57.70 56.86 2k73 n MET 36 Cb 0.91 -1.40 -0.06 0.00 0.00 0.00 0.00 33.22 32.68 2k73 n MET 36 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 2k73 n LEU 37 N -0.90 -1.31 -4.75 -0.89 4.77 0.75 -4.85 117.00 109.83 2k73 n LEU 37 Ca 0.18 -1.15 -0.36 0.00 -0.03 0.00 0.00 56.01 54.64 2k73 n LEU 37 Cb 0.08 -1.83 0.04 0.00 -2.33 0.00 0.00 43.42 39.39 2k73 n LEU 37 CO 0.13 0.29 0.87 -0.22 -1.33 0.00 0.00 177.39 177.13 2k73 s LEU 38 N -7.25 3.66 -0.63 2.23 0.20 -1.14 -4.99 118.68 110.76 2k73 s LEU 38 Ca 0.51 2.49 0.00 0.00 0.69 0.00 0.00 54.13 57.82 2k73 s LEU 38 Cb -0.29 -4.57 0.16 0.00 -0.43 0.00 0.00 46.19 41.06 2k73 s LEU 38 CO 0.97 -1.71 0.42 -0.54 -0.29 0.00 0.00 176.35 175.21 2k73 s LYS 39 N -3.30 2.45 1.11 1.98 1.02 -1.26 -4.97 119.74 116.77 2k73 s LYS 39 Ca 0.78 -2.72 -0.17 0.00 0.02 0.00 0.00 55.97 53.88 2k73 s LYS 39 Cb -0.33 -3.60 0.16 0.00 -0.52 0.00 0.00 37.83 33.54 2k73 s LYS 39 CO 0.36 -1.17 0.22 -2.30 -0.92 0.00 0.00 175.35 171.54 2k73 n PRO 40 N 3.10 -2.25 -2.65 -1.68 -0.02 -1.22 -4.34 135.00 125.95 2k73 n PRO 40 Ca 0.09 -0.65 -0.07 0.00 -2.02 0.00 0.00 63.50 60.85 2k73 n PRO 40 Cb 0.36 -1.62 -0.02 0.00 -0.02 0.00 0.00 33.50 32.20 2k73 n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k73 h VAL 42 N 1.19 1.24 -0.06 0.00 -1.51 -1.92 -1.22 116.25 113.97 2k73 h VAL 42 Ca -0.08 -0.83 -0.01 0.00 -1.23 0.00 0.00 66.70 64.54 2k73 h VAL 42 Cb 0.33 0.80 -0.00 0.00 -2.13 0.00 0.00 31.29 30.29 2k73 h VAL 42 CO 0.13 0.30 0.01 -0.07 -1.23 0.00 0.00 177.57 176.72 2k73 h LEU 43 N 0.71 0.10 0.01 4.19 3.38 -1.98 0.98 115.31 122.70 2k73 h LEU 43 Ca 0.16 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.89 2k73 h LEU 43 Cb 0.32 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2k73 h LEU 43 CO -0.00 0.32 -0.04 0.28 0.09 0.00 0.00 178.44 179.09 2k73 h SER 44 N -0.13 -0.11 -0.22 -0.43 0.02 -1.95 0.27 113.55 111.01 2k73 h SER 44 Ca 0.02 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2k73 h SER 44 Cb 0.26 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 2k73 h SER 44 CO 0.00 -0.06 0.13 0.40 -1.14 0.00 0.00 176.83 176.16 2k73 h ILE 45 N -0.07 1.10 -0.63 3.27 1.08 -1.21 0.02 117.51 121.06 2k73 h ILE 45 Ca 0.01 -0.25 0.04 0.00 -0.39 0.00 0.00 64.86 64.28 2k73 h ILE 45 Cb 0.09 0.86 -0.05 0.00 -3.07 0.00 0.00 36.82 34.65 2k73 h ILE 45 CO -0.03 0.09 0.37 1.88 -0.69 0.00 0.00 178.15 179.77 2k73 h TYR 46 N 0.27 0.69 -0.77 1.37 -1.99 -0.56 -1.42 116.97 114.56 2k73 h TYR 46 Ca 0.08 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.81 2k73 h TYR 46 Cb 0.04 -0.22 -0.04 0.00 2.00 0.00 0.00 36.73 38.52 2k73 h TYR 46 CO -0.04 0.36 0.40 1.49 -0.00 0.00 0.00 178.16 180.37 2k73 h GLU 47 N 0.71 1.08 -0.33 4.88 4.22 -0.06 -1.61 114.58 123.46 2k73 h GLU 47 Ca 0.27 -0.13 -0.01 0.00 0.08 0.00 0.00 59.36 59.57 2k73 h GLU 47 Cb 0.10 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 2k73 h GLU 47 CO -0.14 0.80 0.17 -0.09 -2.18 0.00 0.00 179.01 177.57 2k73 h ARG 48 N 1.08 0.45 -0.22 1.92 2.43 0.06 -1.24 114.38 118.86 2k73 h ARG 48 Ca 0.27 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.28 2k73 h ARG 48 Cb 0.06 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 2k73 h ARG 48 CO -0.04 0.35 -0.35 0.00 -1.51 0.00 0.00 179.97 178.42 2k73 h ALA 49 N 1.73 1.00 -0.11 2.80 0.00 -0.65 0.32 119.26 124.35 2k73 h ALA 49 Ca 0.12 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2k73 h ALA 49 Cb 0.04 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2k73 h ALA 49 CO -0.02 0.60 0.04 0.00 0.00 0.00 0.00 179.25 179.88 2k73 h ALA 50 N 1.24 0.15 0.19 0.00 0.00 -0.90 -1.23 119.26 118.70 2k73 h ALA 50 Ca 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2k73 h ALA 50 Cb 0.79 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2k73 h ALA 50 CO 0.06 -0.27 -0.09 1.25 0.00 0.00 0.00 179.25 180.20 2k73 h LEU 51 N 0.03 -0.22 -1.16 0.00 6.46 -1.37 -2.71 115.31 116.34 2k73 h LEU 51 Ca 0.04 -0.29 0.39 0.00 -0.12 0.00 0.00 57.88 57.90 2k73 h LEU 51 Cb 0.17 0.06 -0.15 0.00 -0.73 0.00 0.00 40.66 40.01 2k73 h LEU 51 CO -0.00 0.31 0.67 0.15 -0.62 0.00 0.00 178.44 178.95 2k73 h PHE 52 N -0.91 0.74 -0.53 1.25 3.04 -0.41 1.77 116.94 121.90 2k73 h PHE 52 Ca -0.03 0.03 -0.09 0.00 3.98 0.00 0.00 57.97 61.87 2k73 h PHE 52 Cb 0.50 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 38.81 2k73 h PHE 52 CO 0.07 -0.27 -0.01 0.78 -2.02 0.00 0.00 178.31 176.86 2k73 h GLY 53 N 0.14 1.02 0.94 2.40 0.00 -1.17 -2.89 103.07 103.51 2k73 h GLY 53 Ca 0.80 -0.76 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 2k73 h GLY 53 CO -0.58 0.70 0.11 -2.08 0.00 0.00 0.00 176.54 174.69 2k73 h VAL 54 N 0.81 1.11 -0.81 4.60 2.07 0.29 -2.28 116.25 122.05 2k73 h VAL 54 Ca 0.15 -0.31 0.20 0.00 0.82 0.00 0.00 66.70 67.56 2k73 h VAL 54 Cb 0.55 0.93 -0.13 0.00 -1.52 0.00 0.00 31.29 31.12 2k73 h VAL 54 CO 0.03 0.11 0.12 0.25 0.02 0.00 0.00 177.57 178.10 2k73 h LEU 55 N 0.23 -0.16 -1.95 2.57 6.46 -0.84 1.98 115.31 123.60 2k73 h LEU 55 Ca 0.07 0.19 -0.02 0.00 -0.12 0.00 0.00 57.88 58.00 2k73 h LEU 55 Cb 0.07 0.29 -0.00 0.00 -0.73 0.00 0.00 40.66 40.30 2k73 h LEU 55 CO -0.01 -0.15 -0.10 1.23 -0.62 0.00 0.00 178.44 178.79 2k73 h GLY 56 N 0.17 0.00 1.90 3.75 0.00 -1.22 -0.85 103.07 106.82 2k73 h GLY 56 Ca 0.47 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.71 2k73 h GLY 56 CO -0.64 0.00 -0.36 0.00 0.00 0.00 0.00 176.54 175.54 2k73 h ALA 57 N 1.90 1.29 -0.00 3.60 0.00 0.36 -2.05 119.26 124.36 2k73 h ALA 57 Ca -0.00 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.38 2k73 h ALA 57 Cb 0.21 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2k73 h ALA 57 CO 0.01 0.50 -0.81 0.00 0.00 0.00 0.00 179.25 178.96 2k73 h ALA 58 N 1.53 0.65 -0.24 0.00 0.00 -0.27 -1.46 119.26 119.49 2k73 h ALA 58 Ca 0.01 -0.71 -0.17 0.00 0.00 0.00 0.00 54.91 54.04 2k73 h ALA 58 Cb 0.69 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2k73 h ALA 58 CO 0.05 0.95 -0.54 -0.07 0.00 0.00 0.00 179.25 179.64 2k73 h LEU 59 N 0.04 0.79 -0.09 0.00 4.07 -1.13 0.67 115.31 119.65 2k73 h LEU 59 Ca -0.02 -0.42 -0.24 0.00 0.08 0.00 0.00 57.88 57.28 2k73 h LEU 59 Cb 1.41 -0.23 0.01 0.00 1.08 0.00 0.00 40.66 42.93 2k73 h LEU 59 CO 0.11 1.17 -1.03 0.40 -1.08 0.00 0.00 178.44 178.01 2k73 h ILE 60 N 0.54 1.41 0.00 1.22 2.04 -1.37 -3.23 117.51 118.12 2k73 h ILE 60 Ca 0.01 -2.56 -0.11 0.00 1.00 0.00 0.00 64.86 63.20 2k73 h ILE 60 Cb 1.12 2.54 -0.02 0.00 -0.74 0.00 0.00 36.82 39.72 2k73 h ILE 60 CO 0.11 0.76 -0.52 1.23 0.00 0.00 0.00 178.15 179.73 2k73 h GLY 61 N 1.19 0.00 0.82 5.37 0.00 -1.24 -2.97 103.07 106.24 2k73 h GLY 61 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2k73 h GLY 61 CO 0.18 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.72 2k73 n ALA 62 N -2.28 2.21 0.05 3.60 0.00 0.22 -2.48 120.51 121.83 2k73 n ALA 62 Ca 0.01 -0.10 -0.05 0.00 0.00 0.00 0.00 53.44 53.30 2k73 n ALA 62 Cb 0.66 -1.26 -0.09 0.00 0.00 0.00 0.00 19.45 18.75 2k73 n ALA 62 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2k73 h ILE 63 N 0.00 1.26 0.00 0.00 2.04 -1.62 -3.45 117.51 115.74 2k73 h ILE 63 Ca 0.00 -2.92 0.00 0.00 1.00 0.00 0.00 64.86 62.94 2k73 h ILE 63 Cb 0.00 2.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 2k73 h ILE 63 CO 0.00 0.72 0.00 0.00 0.00 0.00 0.00 178.15 178.87 2k73 n ALA 64 N -2.38 0.00 0.89 1.87 0.00 -1.04 -5.02 120.51 114.84 2k73 n ALA 64 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2k73 n ALA 64 Cb 0.92 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.37 2k73 n ALA 64 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2k73 n PRO 65 N 0.00 0.89 0.00 0.00 -0.04 -1.06 -2.70 135.00 132.10 2k73 n PRO 65 Ca 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.50 2k73 n PRO 65 Cb 0.00 -1.36 -0.02 0.00 -0.04 0.00 0.00 33.50 32.08 2k73 n PRO 65 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2k73 n LYS 66 N 0.16 3.54 -4.15 0.54 4.81 -1.26 -4.85 118.16 116.96 2k73 n LYS 66 Ca 0.00 -0.24 -0.22 0.00 -0.87 0.00 0.00 58.31 56.98 2k73 n LYS 66 Cb 0.27 -0.91 -0.06 0.00 0.02 0.00 0.00 35.03 34.35 2k73 n LYS 66 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2k73 s THR 67 N -1.43 3.66 0.37 3.15 -4.23 -1.10 -4.95 115.64 111.11 2k73 s THR 67 Ca 0.04 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 58.90 2k73 s THR 67 Cb 0.06 -3.07 0.00 0.00 1.34 0.00 0.00 72.50 70.82 2k73 s THR 67 CO 0.25 -0.30 0.77 -2.65 -0.54 0.00 0.00 174.62 172.14 2k73 n PRO 68 N -1.09 0.02 -0.49 3.99 -0.02 -1.26 -1.44 135.00 134.71 2k73 n PRO 68 Ca -0.06 0.53 0.43 0.00 -2.02 0.00 0.00 63.50 62.38 2k73 n PRO 68 Cb 0.59 -2.28 0.78 0.00 -0.02 0.00 0.00 33.50 32.58 2k73 n PRO 68 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2k73 h LEU 69 N 0.00 0.00 -0.22 2.45 4.07 -1.93 -2.18 115.31 117.51 2k73 h LEU 69 Ca 0.00 0.00 0.02 0.00 0.08 0.00 0.00 57.88 57.98 2k73 h LEU 69 Cb 1.53 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 43.25 2k73 h LEU 69 CO 0.00 0.00 -0.14 -0.09 -1.08 0.00 0.00 178.44 177.13 2k73 h ARG 70 N 0.00 -0.01 -0.35 1.13 2.43 -1.52 1.11 114.38 117.18 2k73 h ARG 70 Ca 0.72 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.99 2k73 h ARG 70 Cb 2.92 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 32.46 2k73 h ARG 70 CO -0.01 -0.01 0.27 -0.92 -1.51 0.00 0.00 179.97 177.80 2k73 h TYR 71 N -0.01 0.00 -0.18 2.20 5.03 -1.70 0.31 116.97 122.62 2k73 h TYR 71 Ca 0.04 0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.28 2k73 h TYR 71 Cb 0.10 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.38 2k73 h TYR 71 CO -0.92 0.00 -0.13 0.28 -1.32 0.00 0.00 178.16 176.06 2k73 h VAL 72 N 0.00 1.32 0.12 1.81 2.07 0.96 -2.82 116.25 119.71 2k73 h VAL 72 Ca 0.16 -1.25 -0.27 0.00 0.82 0.00 0.00 66.70 66.16 2k73 h VAL 72 Cb 0.71 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 2k73 h VAL 72 CO -0.00 0.38 -1.24 0.00 0.02 0.00 0.00 177.57 176.72 2k73 h ALA 73 N 0.66 0.13 0.00 1.67 0.00 0.56 -3.15 119.26 119.13 2k73 h ALA 73 Ca 0.04 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 54.04 2k73 h ALA 73 Cb 0.65 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2k73 h ALA 73 CO 0.04 1.01 0.00 -0.12 0.00 0.00 0.00 179.25 180.18 2k73 n MET 74 N -3.51 0.11 -0.20 0.00 0.00 0.10 -1.68 117.12 111.95 2k73 n MET 74 Ca -0.08 0.56 0.05 0.00 -0.00 0.00 0.00 57.70 58.23 2k73 n MET 74 Cb 1.02 -1.83 0.32 0.00 0.00 0.00 0.00 33.22 32.73 2k73 n MET 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2k73 h VAL 75 N 0.00 1.06 0.03 1.12 2.07 -1.45 0.24 116.25 119.32 2k73 h VAL 75 Ca 0.00 -0.29 -0.29 0.00 0.82 0.00 0.00 66.70 66.94 2k73 h VAL 75 Cb 0.06 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 29.94 2k73 h VAL 75 CO 0.00 0.15 -1.62 0.40 0.02 0.00 0.00 177.57 176.52 2k73 h ILE 76 N 0.84 0.98 0.23 4.57 1.08 -1.55 -2.84 117.51 120.82 2k73 h ILE 76 Ca 0.32 -2.77 -0.01 0.00 -0.39 0.00 0.00 64.86 62.01 2k73 h ILE 76 Cb 0.18 2.53 0.00 0.00 -3.07 0.00 0.00 36.82 36.46 2k73 h ILE 76 CO -0.10 0.64 -0.11 -0.25 -0.69 0.00 0.00 178.15 177.64 2k73 h TRP 77 N 0.02 -0.28 -0.18 1.37 2.91 -1.29 -2.66 115.95 115.83 2k73 h TRP 77 Ca -0.26 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 59.73 2k73 h TRP 77 Cb 1.98 0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 30.72 2k73 h TRP 77 CO 0.02 -0.03 0.03 1.25 -1.03 0.00 0.00 178.44 178.68 2k73 h LEU 78 N -0.51 0.29 -0.92 0.65 5.85 -0.72 -1.36 115.31 118.60 2k73 h LEU 78 Ca -0.03 -0.26 0.27 0.00 0.84 0.00 0.00 57.88 58.70 2k73 h LEU 78 Cb 0.38 -0.08 -0.15 0.00 0.37 0.00 0.00 40.66 41.18 2k73 h LEU 78 CO 0.05 0.48 0.29 0.22 -0.34 0.00 0.00 178.44 179.14 2k73 h TYR 79 N 0.10 0.43 0.00 1.25 3.20 -1.50 1.35 116.97 121.80 2k73 h TYR 79 Ca 0.06 0.05 -0.06 0.00 3.14 0.00 0.00 58.73 61.92 2k73 h TYR 79 Cb 0.31 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 2k73 h TYR 79 CO 0.02 -0.26 -0.28 0.66 -1.64 0.00 0.00 178.16 176.67 2k73 h SER 80 N 0.18 0.00 0.92 -2.11 4.64 -1.27 -2.63 113.55 113.28 2k73 h SER 80 Ca 0.61 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.89 2k73 h SER 80 Cb 1.31 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.41 2k73 h SER 80 CO -0.69 0.28 -0.44 0.00 -0.87 0.00 0.00 176.83 175.10 2k73 h ALA 81 N 1.72 -1.33 0.08 5.18 0.00 0.29 0.51 119.26 125.72 2k73 h ALA 81 Ca -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 2k73 h ALA 81 Cb 1.21 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.48 2k73 h ALA 81 CO 0.04 -1.24 -0.04 0.35 0.00 0.00 0.00 179.25 178.36 2k73 h PHE 82 N -1.23 -0.10 -0.23 0.00 3.04 -1.55 -2.83 116.94 114.04 2k73 h PHE 82 Ca -0.13 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.78 2k73 h PHE 82 Cb 0.94 0.03 -0.01 0.00 2.56 0.00 0.00 35.95 39.48 2k73 h PHE 82 CO 0.02 0.45 -0.01 -0.09 -2.02 0.00 0.00 178.31 176.67 2k73 h ARG 83 N -0.86 0.40 -0.40 1.11 9.65 -1.59 0.14 114.38 122.83 2k73 h ARG 83 Ca -0.01 -0.13 0.03 0.00 -1.10 0.00 0.00 59.98 58.77 2k73 h ARG 83 Cb 0.60 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.10 2k73 h ARG 83 CO 0.02 0.60 0.19 0.78 2.80 0.00 0.00 179.97 184.35 2k73 h GLY 84 N 0.16 0.54 0.86 2.80 0.00 -0.08 -0.64 103.07 106.71 2k73 h GLY 84 Ca 0.06 -0.13 -0.06 0.00 0.00 0.00 0.00 47.33 47.20 2k73 h GLY 84 CO 0.01 0.08 -0.08 -2.08 0.00 0.00 0.00 176.54 174.47 2k73 h VAL 85 N 0.38 1.29 -0.14 4.60 2.07 -1.41 -1.40 116.25 121.64 2k73 h VAL 85 Ca 0.17 -1.12 0.04 0.00 0.82 0.00 0.00 66.70 66.61 2k73 h VAL 85 Cb 0.10 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 2k73 h VAL 85 CO -0.13 0.35 0.13 -0.61 0.02 0.00 0.00 177.57 177.33 2k73 h GLN 86 N 0.26 0.00 0.14 1.57 5.75 -0.40 -1.78 115.11 120.65 2k73 h GLN 86 Ca 0.06 0.00 -0.22 0.00 -0.15 0.00 0.00 58.65 58.35 2k73 h GLN 86 Cb 0.57 0.00 0.02 0.00 1.07 0.00 0.00 27.48 29.14 2k73 h GLN 86 CO 0.03 0.00 -0.99 1.25 -2.65 0.00 0.00 178.83 176.47 2k73 h LEU 87 N 0.00 0.48 -1.96 -2.39 5.85 -0.80 -3.26 115.31 113.23 2k73 h LEU 87 Ca 0.07 -0.93 0.11 0.00 0.84 0.00 0.00 57.88 57.97 2k73 h LEU 87 Cb 0.32 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2k73 h LEU 87 CO -0.00 1.46 0.45 0.71 -0.34 0.00 0.00 178.44 180.72 2k73 h THR 88 N -0.32 0.35 -0.05 1.05 1.35 -0.39 0.24 112.91 115.14 2k73 h THR 88 Ca -0.19 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.65 2k73 h THR 88 Cb 1.71 0.64 -0.00 0.00 -1.73 0.00 0.00 68.15 68.77 2k73 h THR 88 CO 0.14 0.00 -0.08 0.22 -0.25 0.00 0.00 175.52 175.55 2k73 h TYR 89 N 0.00 0.17 -0.97 4.73 3.20 -1.51 -2.85 116.97 119.74 2k73 h TYR 89 Ca 0.19 -0.06 0.19 0.00 3.14 0.00 0.00 58.73 62.18 2k73 h TYR 89 Cb 1.08 -0.03 -0.09 0.00 1.54 0.00 0.00 36.73 39.23 2k73 h TYR 89 CO 0.00 0.65 0.61 0.93 -1.64 0.00 0.00 178.16 178.71 2k73 h GLU 90 N -0.35 0.66 -0.21 1.82 5.08 -1.02 0.29 114.58 120.84 2k73 h GLU 90 Ca 0.00 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2k73 h GLU 90 Cb 0.63 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2k73 h GLU 90 CO 0.02 0.44 0.02 1.25 -1.00 0.00 0.00 179.01 179.74 2k73 h HIS 91 N 0.68 0.39 -0.20 4.33 2.76 -1.47 -2.92 115.15 118.72 2k73 h HIS 91 Ca 0.53 -0.06 -0.02 0.00 -2.20 0.00 0.00 60.37 58.62 2k73 h HIS 91 Cb 0.93 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.78 2k73 h HIS 91 CO -0.00 0.52 0.03 1.79 -1.30 0.00 0.00 177.93 178.96 2k73 h THR 92 N 0.14 1.23 -0.82 6.26 1.35 -0.87 -2.92 112.91 117.28 2k73 h THR 92 Ca 0.06 -0.76 0.19 0.00 -0.55 0.00 0.00 66.41 65.36 2k73 h THR 92 Cb 0.35 1.35 -0.15 0.00 -1.73 0.00 0.00 68.15 67.97 2k73 h THR 92 CO 0.01 0.23 -0.01 0.24 -0.25 0.00 0.00 175.52 175.74 2k73 h MET 93 N 0.12 0.07 -0.16 4.72 2.07 -0.48 0.44 114.93 121.71 2k73 h MET 93 Ca 0.06 -0.00 0.03 0.00 -2.07 0.00 0.00 59.70 57.72 2k73 h MET 93 Cb 0.33 -0.02 -0.03 0.00 -1.87 0.00 0.00 31.60 30.01 2k73 h MET 93 CO 0.00 0.05 -0.05 -0.07 1.07 0.00 0.00 176.91 177.91 2k73 h LEU 94 N 0.08 -0.18 -1.98 1.22 -0.00 -1.35 1.45 115.31 114.54 2k73 h LEU 94 Ca 0.45 0.05 0.29 0.00 -0.00 0.00 0.00 57.88 58.67 2k73 h LEU 94 Cb 0.82 0.11 -0.04 0.00 -0.00 0.00 0.00 40.66 41.55 2k73 h LEU 94 CO -0.74 -0.07 0.73 -0.61 -0.00 0.00 0.00 178.44 177.75 2k73 h GLN 95 N -0.02 0.00 0.00 1.13 4.15 0.02 0.77 115.11 121.16 2k73 h GLN 95 Ca 0.08 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.50 2k73 h GLN 95 Cb 0.14 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.83 2k73 h GLN 95 CO -0.18 0.00 -1.53 1.28 -1.93 0.00 0.00 178.83 176.47 2k73 n LEU 96 N -4.17 0.44 -3.51 -2.39 4.77 0.01 -4.64 117.00 107.50 2k73 n LEU 96 Ca 0.21 -0.23 -0.27 0.00 -0.03 0.00 0.00 56.01 55.70 2k73 n LEU 96 Cb 1.07 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 42.07 2k73 n LEU 96 CO 0.39 0.11 -0.13 -1.22 -1.33 0.00 0.00 177.39 175.21 2k73 n TYR 97 N -1.91 1.63 -0.63 -1.77 4.02 0.48 -5.08 117.16 113.90 2k73 n TYR 97 Ca -0.00 -3.88 -0.22 0.00 -0.01 0.00 0.00 57.90 53.79 2k73 n TYR 97 Cb 0.45 -0.34 0.13 0.00 -0.02 0.00 0.00 39.34 39.56 2k73 n TYR 97 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 2k73 n PRO 98 N 1.77 -1.69 -2.69 -0.72 -0.02 -0.82 -4.48 135.00 126.34 2k73 n PRO 98 Ca 0.25 -0.50 -0.06 0.00 -2.02 0.00 0.00 63.50 61.18 2k73 n PRO 98 Cb 0.43 -1.43 0.08 0.00 -0.02 0.00 0.00 33.50 32.56 2k73 n PRO 98 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2k73 n SER 99 N -0.46 -1.83 -4.24 2.55 2.88 -1.26 -5.05 113.62 106.21 2k73 n SER 99 Ca 0.03 -2.38 -0.37 0.00 -1.33 0.00 0.00 58.87 54.82 2k73 n SER 99 Cb 0.43 1.19 0.04 0.00 -0.75 0.00 0.00 64.21 65.12 2k73 n SER 99 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2k73 n PRO 100 N 1.31 0.07 -3.84 -1.46 -0.02 -1.26 -5.02 135.00 124.78 2k73 n PRO 100 Ca 0.03 0.04 -0.09 0.00 -2.02 0.00 0.00 63.50 61.45 2k73 n PRO 100 Cb 0.69 -1.26 -0.05 0.00 -0.02 0.00 0.00 33.50 32.86 2k73 n PRO 100 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2k73 s PHE 101 N -1.99 0.08 0.00 6.00 -0.12 -1.26 -5.04 117.98 115.65 2k73 s PHE 101 Ca 0.54 -0.44 0.16 0.00 -0.05 0.00 0.00 56.93 57.15 2k73 s PHE 101 Cb -0.35 0.29 0.33 0.00 -0.63 0.00 0.00 43.02 42.65 2k73 s PHE 101 CO 0.69 -0.92 1.56 0.00 -0.05 0.00 0.00 175.22 176.51 2k73 h ALA 102 N 2.26 0.79 -3.87 1.99 0.00 -2.06 -3.44 119.26 114.93 2k73 h ALA 102 Ca -0.28 -0.43 -0.44 0.00 0.00 0.00 0.00 54.91 53.76 2k73 h ALA 102 Cb 1.25 -0.08 -0.26 0.00 0.00 0.00 0.00 17.79 18.71 2k73 h ALA 102 CO 0.38 0.59 -0.79 -0.08 0.00 0.00 0.00 179.25 179.35 2k73 s THR 103 N -3.22 1.03 0.00 0.00 -1.32 -1.26 -5.09 115.64 105.77 2k73 s THR 103 Ca 0.02 -0.82 0.00 0.00 -1.21 0.00 0.00 61.69 59.68 2k73 s THR 103 Cb 0.09 -0.91 0.00 0.00 -1.51 0.00 0.00 72.50 70.17 2k73 s THR 103 CO 0.72 0.09 0.00 -1.54 -2.21 0.00 0.00 174.62 171.68 2k73 n SER 104 N 2.21 0.00 -4.49 8.08 3.41 -1.26 -4.76 113.62 116.82 2k73 n SER 104 Ca -0.17 0.08 -0.17 0.00 -0.26 0.00 0.00 58.87 58.36 2k73 n SER 104 Cb 0.55 -0.22 -0.15 0.00 -0.26 0.00 0.00 64.21 64.13 2k73 n SER 104 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2k73 n ASP 105 N -1.65 -0.23 -4.31 4.04 5.68 -1.26 -4.63 116.55 114.19 2k73 n ASP 105 Ca 0.00 -1.05 -0.44 0.00 -0.50 0.00 0.00 54.79 52.80 2k73 n ASP 105 Cb 0.00 -1.00 0.00 0.00 -1.14 0.00 0.00 41.12 38.99 2k73 n ASP 105 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 2k73 n PHE 106 N 10.82 4.52 -1.91 2.11 3.72 -1.26 -4.90 117.46 130.55 2k73 n PHE 106 Ca 0.54 -3.30 -0.41 0.00 -0.05 0.00 0.00 57.45 54.23 2k73 n PHE 106 Cb 0.29 -2.03 -0.01 0.00 -0.94 0.00 0.00 39.48 36.79 2k73 n PHE 106 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 2k73 s MET 107 N 0.72 4.15 0.22 -1.08 -2.45 -1.26 -4.93 119.30 114.66 2k73 s MET 107 Ca 0.40 2.43 0.07 0.00 -1.25 0.00 0.00 55.69 57.34 2k73 s MET 107 Cb -0.01 -2.97 -0.05 0.00 1.25 0.00 0.00 34.83 33.05 2k73 s MET 107 CO -0.00 -0.45 -0.10 0.14 1.05 0.00 0.00 175.02 175.66 2k73 s VAL 108 N -1.14 1.55 -0.32 10.11 -7.23 -1.26 -5.13 120.40 116.99 2k73 s VAL 108 Ca 0.52 -2.15 -0.00 0.00 -1.81 0.00 0.00 61.98 58.54 2k73 s VAL 108 Cb -0.44 -2.15 0.10 0.00 0.56 0.00 0.00 36.38 34.45 2k73 s VAL 108 CO 0.59 -0.51 0.10 -0.13 -0.31 0.00 0.00 175.10 174.83 2k73 s ARG 109 N -3.70 0.81 0.61 4.82 0.52 -1.26 -4.93 118.95 115.80 2k73 s ARG 109 Ca 0.24 -1.18 -0.12 0.00 -0.52 0.00 0.00 55.73 54.15 2k73 s ARG 109 Cb 0.02 -2.12 -0.04 0.00 0.52 0.00 0.00 34.95 33.32 2k73 s ARG 109 CO 0.07 -0.99 1.02 -0.06 0.02 0.00 0.00 175.30 175.37 2k73 s PHE 110 N 1.51 3.54 0.71 -0.53 0.40 -1.26 -4.99 117.98 117.36 2k73 s PHE 110 Ca 0.10 1.34 -0.13 0.00 -0.60 0.00 0.00 56.93 57.64 2k73 s PHE 110 Cb -0.18 -2.75 -0.12 0.00 0.51 0.00 0.00 43.02 40.48 2k73 s PHE 110 CO -0.23 -0.68 -0.54 -2.30 0.70 0.00 0.00 175.22 172.17 2k73 n PRO 111 N -2.54 0.00 -0.48 0.24 -0.02 -1.26 -4.88 135.00 126.06 2k73 n PRO 111 Ca 0.06 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.62 2k73 n PRO 111 Cb 0.54 -0.78 0.29 0.00 -0.02 0.00 0.00 33.50 33.53 2k73 n PRO 111 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2k73 n GLU 112 N 1.81 3.38 0.00 -0.52 4.71 -1.26 -4.34 120.64 124.42 2k73 n GLU 112 Ca -0.00 -2.70 0.14 0.00 -0.01 0.00 0.00 57.16 54.60 2k73 n GLU 112 Cb 0.42 -1.75 0.59 0.00 -1.01 0.00 0.00 31.44 29.70 2k73 n GLU 112 CO 0.00 0.00 0.00 -2.67 0.09 0.00 0.00 177.13 174.55 2k73 n TRP 113 N 0.51 0.00 -3.81 -0.32 4.27 -1.26 -4.41 117.44 112.42 2k73 n TRP 113 Ca 0.21 0.00 -0.28 0.00 -3.89 0.00 0.00 57.50 53.55 2k73 n TRP 113 Cb 0.80 -0.04 -0.12 0.00 -1.36 0.00 0.00 31.31 30.59 2k73 n TRP 113 CO 0.00 0.00 0.00 1.47 -2.29 0.00 0.00 177.69 176.87 2k73 n LEU 114 N -0.29 2.53 0.00 5.67 -0.00 -1.26 -4.94 117.00 118.71 2k73 n LEU 114 Ca 0.18 -5.10 0.00 0.00 -0.00 0.00 0.00 56.01 51.10 2k73 n LEU 114 Cb 0.30 -0.56 0.00 0.00 -0.00 0.00 0.00 43.42 43.16 2k73 n LEU 114 CO 0.19 1.78 0.17 -2.65 -0.00 0.00 0.00 177.39 176.88 2k73 n PRO 115 N 2.05 0.00 -0.01 1.47 -0.02 -1.26 -2.03 135.00 135.20 2k73 n PRO 115 Ca 0.22 0.03 0.09 0.00 -2.02 0.00 0.00 63.50 61.82 2k73 n PRO 115 Cb 0.37 -1.54 0.51 0.00 -0.02 0.00 0.00 33.50 32.82 2k73 n PRO 115 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2k73 h LEU 116 N 0.00 0.33 0.03 2.45 6.46 -1.94 1.20 115.31 123.84 2k73 h LEU 116 Ca 0.00 0.00 -0.38 0.00 -0.12 0.00 0.00 57.88 57.38 2k73 h LEU 116 Cb 0.07 -0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 39.88 2k73 h LEU 116 CO 0.00 0.22 -2.22 0.47 -0.62 0.00 0.00 178.44 176.29 2k73 n ASP 117 N -4.47 2.00 -0.09 1.25 8.00 -0.86 -3.21 116.55 119.16 2k73 n ASP 117 Ca 0.06 0.13 -0.12 0.00 0.71 0.00 0.00 54.79 55.58 2k73 n ASP 117 Cb 0.25 -0.69 -0.04 0.00 -0.02 0.00 0.00 41.12 40.62 2k73 n ASP 117 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2k73 h LYS 118 N -0.35 0.51 0.00 -1.24 3.64 -1.68 1.15 116.57 118.60 2k73 h LYS 118 Ca -0.54 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 58.65 2k73 h LYS 118 Cb 1.79 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.58 2k73 h LYS 118 CO -0.14 0.71 0.00 2.35 -2.27 0.00 0.00 179.45 180.10 2k73 h TRP 119 N 0.26 0.00 -1.22 1.91 2.91 0.13 -3.35 115.95 116.59 2k73 h TRP 119 Ca 0.07 0.00 -0.42 0.00 1.13 0.00 0.00 58.89 59.67 2k73 h TRP 119 Cb 0.52 0.00 -0.29 0.00 -0.51 0.00 0.00 29.16 28.88 2k73 h TRP 119 CO 0.05 0.00 -0.87 0.28 -1.03 0.00 0.00 178.44 176.87 2k73 n VAL 120 N -2.59 -0.38 0.57 2.65 0.31 -0.95 -4.95 118.33 112.99 2k73 n VAL 120 Ca 0.03 -3.08 0.10 0.00 -0.01 0.00 0.00 64.34 61.38 2k73 n VAL 120 Cb 0.34 -0.48 0.42 0.00 -0.91 0.00 0.00 33.84 33.22 2k73 n VAL 120 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2k73 n PRO 121 N 1.35 0.08 0.00 5.55 -0.02 0.39 -2.86 135.00 139.49 2k73 n PRO 121 Ca 0.16 0.25 0.09 0.00 -2.02 0.00 0.00 63.50 61.98 2k73 n PRO 121 Cb 0.58 -1.63 0.43 0.00 -0.02 0.00 0.00 33.50 32.86 2k73 n PRO 121 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2k73 n GLN 122 N -1.77 0.21 -2.19 -0.52 -0.06 -1.26 -1.79 117.38 110.00 2k73 n GLN 122 Ca 0.04 0.13 0.01 0.00 -2.00 0.00 0.00 57.00 55.18 2k73 n GLN 122 Cb 0.24 -1.50 0.04 0.00 -4.06 0.00 0.00 30.24 24.96 2k73 n GLN 122 CO 0.00 0.00 0.00 1.33 -0.20 0.00 0.00 177.06 178.19 2k73 n VAL 123 N -1.32 0.83 0.00 1.69 0.24 -1.13 -4.85 118.33 113.79 2k73 n VAL 123 Ca 0.08 -2.20 0.00 0.00 -2.04 0.00 0.00 64.34 60.17 2k73 n VAL 123 Cb 0.15 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 33.56 2k73 n VAL 123 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 2k73 n PHE 124 N -0.17 0.00 -1.70 6.34 7.35 -1.15 -4.95 117.46 123.18 2k73 n PHE 124 Ca 0.08 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.34 2k73 n PHE 124 Cb 0.95 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.74 2k73 n PHE 124 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2k73 n VAL 125 N -1.44 0.13 -3.69 -2.13 0.31 -0.74 -4.89 118.33 105.88 2k73 n VAL 125 Ca 0.00 -0.02 -0.26 0.00 -0.01 0.00 0.00 64.34 64.04 2k73 n VAL 125 Cb 0.00 -1.92 -0.03 0.00 -0.91 0.00 0.00 33.84 30.99 2k73 n VAL 125 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k73 s ALA 126 N 1.67 3.83 -0.30 3.52 0.00 -1.26 -5.00 121.76 124.22 2k73 s ALA 126 Ca 0.79 -0.88 -0.06 0.00 0.00 0.00 0.00 51.96 51.81 2k73 s ALA 126 Cb -0.55 -1.98 0.19 0.00 0.00 0.00 0.00 23.12 20.78 2k73 s ALA 126 CO 0.36 0.36 0.81 0.45 0.00 0.00 0.00 175.76 177.74 2k73 s SER 127 N -3.35 -0.98 0.00 0.00 0.15 -1.16 -4.79 113.70 103.57 2k73 s SER 127 Ca 0.38 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.55 2k73 s SER 127 Cb -0.11 1.79 0.00 0.00 -1.71 0.00 0.00 66.02 65.99 2k73 s SER 127 CO 0.30 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.16 2k73 n GLY 128 N 5.42 1.42 3.74 9.45 0.00 -1.18 -3.39 105.19 120.65 2k73 n GLY 128 Ca -0.02 -2.03 -0.40 0.00 0.00 0.00 0.00 46.02 43.57 2k73 n GLY 128 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k73 s ASP 129 N 0.00 7.59 -0.06 1.61 1.47 -1.26 -4.13 116.67 121.89 2k73 s ASP 129 Ca 0.00 1.89 -0.20 0.00 1.18 0.00 0.00 52.55 55.42 2k73 s ASP 129 Cb 0.00 -2.60 -0.05 0.00 -0.34 0.00 0.00 42.92 39.93 2k73 s ASP 129 CO 0.00 0.08 0.55 0.00 0.68 0.00 0.00 175.17 176.48 2k73 n ALA 131 N 3.24 0.00 -2.12 0.00 0.00 -1.26 -5.02 120.51 115.34 2k73 n ALA 131 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.96 2k73 n ALA 131 Cb 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.93 2k73 n ALA 131 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2k73 s GLU 132 N -0.45 4.29 -0.30 0.00 2.56 -1.25 -4.85 118.70 118.70 2k73 s GLU 132 Ca 0.00 2.13 -0.25 0.00 0.00 0.00 0.00 54.97 56.85 2k73 s GLU 132 Cb 0.00 -3.29 0.00 0.00 2.00 0.00 0.00 34.13 32.84 2k73 s GLU 132 CO 0.00 -0.50 0.85 0.50 -0.56 0.00 0.00 175.26 175.55 2k73 s ARG 133 N 1.36 4.02 0.00 4.30 3.52 -1.26 -4.85 118.95 126.04 2k73 s ARG 133 Ca 0.66 0.74 0.00 0.00 -0.13 0.00 0.00 55.73 57.00 2k73 s ARG 133 Cb -0.38 -3.72 0.00 0.00 -1.56 0.00 0.00 34.95 29.30 2k73 s ARG 133 CO 0.30 -0.70 0.27 1.04 -0.81 0.00 0.00 175.30 175.40 2k73 n GLN 134 N 6.31 1.81 -3.62 5.12 6.02 -1.26 -5.04 117.38 126.72 2k73 n GLN 134 Ca 0.06 -0.27 -0.00 0.00 -0.01 0.00 0.00 57.00 56.77 2k73 n GLN 134 Cb 0.48 -0.75 -0.06 0.00 1.02 0.00 0.00 30.24 30.92 2k73 n GLN 134 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2k73 s TRP 135 N -0.34 -0.39 0.07 1.08 -0.00 -1.26 -5.15 118.94 112.94 2k73 s TRP 135 Ca 0.00 0.78 -0.07 0.00 -0.00 0.00 0.00 56.10 56.80 2k73 s TRP 135 Cb 0.00 0.24 -0.01 0.00 -0.00 0.00 0.00 33.47 33.70 2k73 s TRP 135 CO 0.00 -0.19 0.15 0.16 -0.00 0.00 0.00 176.95 177.06 2k73 s ASP 136 N 1.31 0.17 -0.02 5.86 -4.77 -1.26 -3.32 116.67 114.64 2k73 s ASP 136 Ca -0.08 -0.64 0.07 0.00 -3.30 0.00 0.00 52.55 48.59 2k73 s ASP 136 Cb -0.03 0.30 -0.02 0.00 -1.09 0.00 0.00 42.92 42.08 2k73 s ASP 136 CO -0.13 -0.66 -0.22 0.12 0.70 0.00 0.00 175.17 174.98 2k73 s PHE 137 N -3.51 1.99 -1.25 2.11 5.36 0.81 -4.61 117.98 118.88 2k73 s PHE 137 Ca 0.02 -0.39 0.00 0.00 -0.96 0.00 0.00 56.93 55.61 2k73 s PHE 137 Cb 0.04 -1.28 0.00 0.00 -0.34 0.00 0.00 43.02 41.43 2k73 s PHE 137 CO -0.09 -0.04 0.00 -0.11 -1.46 0.00 0.00 175.22 173.52 2k73 n LEU 138 N 2.56 -0.65 0.00 6.12 7.94 -1.26 0.74 117.00 132.46 2k73 n LEU 138 Ca -0.16 0.29 0.00 0.00 -1.11 0.00 0.00 56.01 55.04 2k73 n LEU 138 Cb 0.52 -2.25 0.00 0.00 0.53 0.00 0.00 43.42 42.22 2k73 n LEU 138 CO 0.24 -0.82 0.00 0.61 -1.11 0.00 0.00 177.39 176.30 2k73 n GLY 139 N -0.01 0.57 3.17 -3.96 0.00 -1.26 -5.06 105.19 98.64 2k73 n GLY 139 Ca -0.12 -0.82 -0.28 0.00 0.00 0.00 0.00 46.02 44.81 2k73 n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k73 s LEU 140 N 0.00 1.95 0.52 0.99 1.43 0.23 -5.07 118.68 118.73 2k73 s LEU 140 Ca 0.00 -0.42 -0.20 0.00 -1.03 0.00 0.00 54.13 52.48 2k73 s LEU 140 Cb 0.00 -1.12 -0.07 0.00 0.03 0.00 0.00 46.19 45.04 2k73 s LEU 140 CO 0.00 0.17 1.11 -1.83 0.23 0.00 0.00 176.35 176.03 2k73 s GLU 141 N 0.07 3.51 0.10 1.70 1.03 -1.26 -0.13 118.70 123.72 2k73 s GLU 141 Ca -0.06 1.57 -0.26 0.00 0.03 0.00 0.00 54.97 56.24 2k73 s GLU 141 Cb -0.13 -2.07 -0.09 0.00 -0.80 0.00 0.00 34.13 31.04 2k73 s GLU 141 CO 0.03 -0.71 1.43 0.52 -1.33 0.00 0.00 175.26 175.21 2k73 h MET 142 N 1.39 -0.30 -0.90 -4.83 2.86 -1.95 0.57 114.93 111.76 2k73 h MET 142 Ca -0.50 0.02 0.33 0.00 -2.06 0.00 0.00 59.70 57.50 2k73 h MET 142 Cb 1.25 0.07 -0.11 0.00 0.06 0.00 0.00 31.60 32.86 2k73 h MET 142 CO 0.58 -0.20 0.55 -2.30 1.06 0.00 0.00 176.91 176.59 2k73 n PRO 143 N -4.80 -0.03 -0.01 -0.22 -0.02 -1.26 0.28 135.00 128.94 2k73 n PRO 143 Ca -0.03 0.96 -0.18 0.00 -2.02 0.00 0.00 63.50 62.23 2k73 n PRO 143 Cb 0.27 -1.81 -0.09 0.00 -0.02 0.00 0.00 33.50 31.85 2k73 n PRO 143 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2k73 h GLN 144 N 0.00 0.68 0.55 -0.52 -0.00 -1.26 -2.74 115.11 111.81 2k73 h GLN 144 Ca 0.64 -0.62 -0.03 0.00 -0.00 0.00 0.00 58.65 58.64 2k73 h GLN 144 Cb 1.91 0.15 0.01 0.00 0.00 0.00 0.00 27.48 29.54 2k73 h GLN 144 CO -0.43 1.22 -0.26 -1.49 0.00 0.00 0.00 178.83 177.87 2k73 h TRP 145 N 0.36 -0.68 -1.11 3.99 4.06 0.44 -2.63 115.95 120.39 2k73 h TRP 145 Ca -0.07 -0.02 0.36 0.00 2.06 0.00 0.00 58.89 61.22 2k73 h TRP 145 Cb 1.42 0.22 -0.14 0.00 -1.00 0.00 0.00 29.16 29.67 2k73 h TRP 145 CO 0.10 -0.36 0.67 -0.07 -3.56 0.00 0.00 178.44 175.22 2k73 h LEU 146 N -1.08 0.40 -1.42 -4.49 3.38 -0.86 3.74 115.31 114.98 2k73 h LEU 146 Ca -0.07 0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2k73 h LEU 146 Cb 0.62 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2k73 h LEU 146 CO 0.12 -0.15 0.18 0.25 0.09 0.00 0.00 178.44 178.93 2k73 h LEU 147 N 0.22 0.51 -0.09 1.67 6.46 -1.29 0.20 115.31 123.00 2k73 h LEU 147 Ca 0.76 -0.05 -0.00 0.00 -0.12 0.00 0.00 57.88 58.47 2k73 h LEU 147 Cb 2.00 -0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 41.80 2k73 h LEU 147 CO -0.52 0.45 0.04 1.23 -0.62 0.00 0.00 178.44 179.02 2k73 h GLY 148 N 0.70 0.14 1.54 3.75 0.00 0.75 -2.10 103.07 107.86 2k73 h GLY 148 Ca 0.14 -0.07 -0.09 0.00 0.00 0.00 0.00 47.33 47.31 2k73 h GLY 148 CO -0.02 0.07 -0.22 -2.22 0.00 0.00 0.00 176.54 174.15 2k73 h ILE 149 N 0.01 1.26 -0.93 2.60 5.03 -0.74 -2.54 117.51 122.20 2k73 h ILE 149 Ca 0.03 -1.24 0.08 0.00 -0.12 0.00 0.00 64.86 63.62 2k73 h ILE 149 Cb 0.14 1.29 -0.07 0.00 -3.03 0.00 0.00 36.82 35.15 2k73 h ILE 149 CO -0.00 0.40 0.60 0.15 -0.68 0.00 0.00 178.15 178.62 2k73 h PHE 150 N 0.48 1.06 -0.62 1.37 3.04 -0.29 -0.55 116.94 121.43 2k73 h PHE 150 Ca 0.07 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.95 2k73 h PHE 150 Cb 0.65 -0.34 -0.02 0.00 2.56 0.00 0.00 35.95 38.79 2k73 h PHE 150 CO 0.02 0.51 0.00 0.82 -2.02 0.00 0.00 178.31 177.65 2k73 h ILE 151 N 1.00 1.27 -0.09 1.41 2.04 -0.96 -0.47 117.51 121.70 2k73 h ILE 151 Ca 0.42 -1.16 0.02 0.00 1.00 0.00 0.00 64.86 65.15 2k73 h ILE 151 Cb 0.31 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2k73 h ILE 151 CO -0.18 0.42 -0.05 0.00 0.00 0.00 0.00 178.15 178.34 2k73 h ALA 152 N 0.99 0.03 -0.65 1.87 0.00 -0.94 -2.00 119.26 118.56 2k73 h ALA 152 Ca 0.17 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 2k73 h ALA 152 Cb 0.56 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2k73 h ALA 152 CO 0.03 -0.52 0.21 1.88 0.00 0.00 0.00 179.25 180.85 2k73 h TYR 153 N -0.05 1.05 -0.85 0.00 -1.99 -1.22 -1.93 116.97 111.98 2k73 h TYR 153 Ca 0.05 -0.11 0.21 0.00 2.00 0.00 0.00 58.73 60.89 2k73 h TYR 153 Cb 0.13 -0.30 -0.05 0.00 2.00 0.00 0.00 36.73 38.50 2k73 h TYR 153 CO -0.17 0.85 0.58 1.25 -0.00 0.00 0.00 178.16 180.67 2k73 h LEU 154 N 0.94 0.27 0.20 3.88 6.46 -0.58 -0.94 115.31 125.53 2k73 h LEU 154 Ca 0.21 0.03 -0.33 0.00 -0.12 0.00 0.00 57.88 57.66 2k73 h LEU 154 Cb 0.29 -0.02 0.02 0.00 -0.73 0.00 0.00 40.66 40.22 2k73 h LEU 154 CO -0.01 0.11 -1.57 0.40 -0.62 0.00 0.00 178.44 176.76 2k73 h ILE 155 N 0.27 1.15 -0.97 4.05 2.04 -0.80 -2.98 117.51 120.28 2k73 h ILE 155 Ca 0.43 -2.69 0.15 0.00 1.00 0.00 0.00 64.86 63.75 2k73 h ILE 155 Cb 1.25 2.89 -0.09 0.00 -0.74 0.00 0.00 36.82 40.12 2k73 h ILE 155 CO -0.12 0.84 0.59 0.58 0.00 0.00 0.00 178.15 180.04 2k73 h VAL 156 N 0.11 0.81 0.04 1.67 2.07 -0.43 -0.16 116.25 120.36 2k73 h VAL 156 Ca -0.28 -0.29 -0.10 0.00 0.82 0.00 0.00 66.70 66.86 2k73 h VAL 156 Cb 2.10 -0.11 0.01 0.00 -1.52 0.00 0.00 31.29 31.78 2k73 h VAL 156 CO 0.22 0.15 -0.40 0.00 0.02 0.00 0.00 177.57 177.56 2k73 h ALA 157 N 1.58 -0.01 -0.35 1.67 0.00 -1.59 -2.63 119.26 117.93 2k73 h ALA 157 Ca 0.52 -0.55 0.07 0.00 0.00 0.00 0.00 54.91 54.95 2k73 h ALA 157 Cb 0.67 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.43 2k73 h ALA 157 CO -0.33 0.18 -0.10 0.28 0.00 0.00 0.00 179.25 179.29 2k73 h VAL 158 N -0.54 0.63 -0.22 0.00 2.07 -1.26 0.67 116.25 117.59 2k73 h VAL 158 Ca -0.06 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.37 2k73 h VAL 158 Cb 1.23 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2k73 h VAL 158 CO 0.08 0.00 -0.26 -0.07 0.02 0.00 0.00 177.57 177.33 2k73 h LEU 159 N -0.01 0.42 -0.51 2.57 -0.00 -1.16 -2.72 115.31 113.90 2k73 h LEU 159 Ca 0.17 -0.14 -0.10 0.00 -0.00 0.00 0.00 57.88 57.81 2k73 h LEU 159 Cb 0.28 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 40.81 2k73 h LEU 159 CO -0.37 0.68 -0.47 0.58 -0.00 0.00 0.00 178.44 178.85 2k73 h VAL 160 N 0.37 0.95 -0.21 1.22 2.07 -0.83 -2.50 116.25 117.32 2k73 h VAL 160 Ca 0.05 -1.94 -0.07 0.00 0.82 0.00 0.00 66.70 65.56 2k73 h VAL 160 Cb 0.66 2.19 -0.00 0.00 -1.52 0.00 0.00 31.29 32.62 2k73 h VAL 160 CO 0.05 0.47 -0.14 0.58 0.02 0.00 0.00 177.57 178.55 2k73 h VAL 161 N 0.00 1.31 0.00 2.57 2.07 0.60 -2.98 116.25 119.82 2k73 h VAL 161 Ca -0.00 -1.24 -0.07 0.00 0.82 0.00 0.00 66.70 66.20 2k73 h VAL 161 Cb 1.15 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 2k73 h VAL 161 CO 0.06 0.38 -0.34 0.40 0.02 0.00 0.00 177.57 178.09 2k73 h ILE 162 N 0.16 0.82 0.00 4.57 2.04 -1.53 -2.91 117.51 120.65 2k73 h ILE 162 Ca 0.04 -1.42 0.00 0.00 1.00 0.00 0.00 64.86 64.48 2k73 h ILE 162 Cb 0.65 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.61 2k73 h ILE 162 CO 0.04 0.33 0.09 -1.54 0.00 0.00 0.00 178.15 177.08 2k73 n SER 163 N -3.52 0.00 -4.35 1.72 3.41 -0.94 -4.59 113.62 105.35 2k73 n SER 163 Ca -0.00 0.27 -0.39 0.00 -0.26 0.00 0.00 58.87 58.48 2k73 n SER 163 Cb 0.49 -0.27 0.02 0.00 -0.26 0.00 0.00 64.21 64.18 2k73 n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k73 n GLN 164 N -1.23 0.23 0.00 4.33 10.64 -1.10 -4.78 117.38 125.47 2k73 n GLN 164 Ca 0.00 0.09 0.09 0.00 -1.83 0.00 0.00 57.00 55.35 2k73 n GLN 164 Cb 0.09 -1.28 0.52 0.00 -0.86 0.00 0.00 30.24 28.72 2k73 n GLN 164 CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88 2k73 n PRO 165 N 0.89 0.55 0.06 2.61 -0.04 -1.26 -3.67 135.00 134.14 2k73 n PRO 165 Ca 0.10 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.54 2k73 n PRO 165 Cb 0.45 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.40 2k73 n PRO 165 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2k73 h PHE 166 N 0.00 -0.15 -3.45 0.54 3.04 -1.89 -3.46 116.94 111.57 2k73 h PHE 166 Ca 0.00 -0.00 -0.32 0.00 3.98 0.00 0.00 57.97 61.62 2k73 h PHE 166 Cb 0.00 0.05 -0.36 0.00 2.56 0.00 0.00 35.95 38.21 2k73 h PHE 166 CO 0.00 -0.10 -0.73 0.15 -2.02 0.00 0.00 178.31 175.61 2k73 s LYS 167 N -2.25 -0.04 0.00 1.11 -0.14 -1.24 -5.12 119.74 112.05 2k73 s LYS 167 Ca -0.02 0.25 0.00 0.00 -1.36 0.00 0.00 55.97 54.83 2k73 s LYS 167 Cb 0.00 -0.34 0.00 0.00 -1.68 0.00 0.00 37.83 35.81 2k73 s LYS 167 CO 0.07 -0.22 0.00 0.00 -0.76 0.00 0.00 175.35 174.44 2k73 n ALA 168 N 4.55 0.00 -1.28 5.17 0.00 -1.26 -4.66 120.51 123.03 2k73 n ALA 168 Ca -0.20 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.39 2k73 n ALA 168 Cb 0.50 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.88 2k73 n ALA 168 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2k73 n LYS 169 N 0.00 -2.64 -3.65 0.00 5.02 -1.26 -5.06 118.16 110.58 2k73 n LYS 169 Ca 0.00 2.08 -0.01 0.00 -2.02 0.00 0.00 58.31 58.36 2k73 n LYS 169 Cb 0.00 -3.21 -0.01 0.00 -0.02 0.00 0.00 35.03 31.79 2k73 n LYS 169 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2k73 s LYS 170 N -3.94 0.63 -0.37 1.97 -2.85 -1.26 -5.11 119.74 108.82 2k73 s LYS 170 Ca 0.00 -0.33 -0.42 0.00 -1.00 0.00 0.00 55.97 54.22 2k73 s LYS 170 Cb 0.00 0.23 -0.17 0.00 -2.06 0.00 0.00 37.83 35.83 2k73 s LYS 170 CO 0.00 -0.29 1.76 -2.13 0.10 0.00 0.00 175.35 174.79 2k73 n ARG 171 N -0.41 0.72 -2.73 1.78 3.00 -1.26 -4.85 116.66 112.90 2k73 n ARG 171 Ca -0.07 0.26 -0.07 0.00 -0.00 0.00 0.00 57.85 57.97 2k73 n ARG 171 Cb 0.62 -1.90 0.05 0.00 0.00 0.00 0.00 32.46 31.22 2k73 n ARG 171 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 2k73 n ASP 172 N 5.42 -2.59 0.00 6.15 5.68 -1.26 -4.96 116.55 124.99 2k73 n ASP 172 Ca 0.31 -2.90 0.00 0.00 -0.50 0.00 0.00 54.79 51.70 2k73 n ASP 172 Cb 0.07 1.57 0.00 0.00 -1.14 0.00 0.00 41.12 41.62 2k73 n ASP 172 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2k73 n LEU 173 N 1.76 0.00 -4.71 -2.12 4.77 -1.26 -5.07 117.00 110.37 2k73 n LEU 173 Ca 0.08 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.64 2k73 n LEU 173 Cb 0.64 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.70 2k73 n LEU 173 CO -0.01 0.00 0.93 0.72 -1.33 0.00 0.00 177.39 177.70 2k73 s PHE 174 N 0.00 3.38 -0.44 -1.77 -0.71 -1.26 -4.95 117.98 112.22 2k73 s PHE 174 Ca 0.00 1.22 0.09 0.00 -1.04 0.00 0.00 56.93 57.20 2k73 s PHE 174 Cb 0.00 -3.48 0.40 0.00 -1.21 0.00 0.00 43.02 38.73 2k73 s PHE 174 CO 0.00 -1.52 0.98 0.41 -1.34 0.00 0.00 175.22 173.75 2k73 n GLY 175 N 3.29 4.65 5.00 1.99 0.00 -1.26 -5.00 105.19 113.86 2k73 n GLY 175 Ca 0.10 -2.32 0.00 0.00 0.00 0.00 0.00 46.02 43.79 2k73 n GLY 175 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2k73 n ARG 176 N -0.22 0.00 0.00 1.61 0.63 -1.26 -4.86 116.66 112.56 2k73 n ARG 176 Ca 0.29 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.22 2k73 n ARG 176 Cb 0.62 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.53 2k73 n ARG 176 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k73 n GLY 177 N 0.00 2.43 0.00 5.14 0.00 -1.26 -4.34 105.19 107.16 2k73 n GLY 177 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2k73 n GLY 177 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2k73 n HIS 178 N 7.06 0.00 -1.35 1.61 8.25 -1.26 -5.05 115.22 124.47 2k73 n HIS 178 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2k73 n HIS 178 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2k73 n HIS 178 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2k73 n HIS 179 N 0.00 0.00 -2.62 4.41 1.44 -1.26 -5.12 115.22 112.07 2k73 n HIS 179 Ca 0.00 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.28 2k73 n HIS 179 Cb 0.00 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.09 2k73 n HIS 179 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2k73 s HIS 180 N -0.99 3.23 -0.34 -1.40 3.76 -1.26 -5.00 115.29 113.29 2k73 s HIS 180 Ca 0.00 1.35 -0.26 0.00 -0.15 0.00 0.00 55.06 56.00 2k73 s HIS 180 Cb 0.00 -3.40 0.01 0.00 1.11 0.00 0.00 32.58 30.30 2k73 s HIS 180 CO 0.00 -0.72 0.92 -1.01 -0.85 0.00 0.00 174.74 173.08 2k73 s HIS 181 N 3.36 3.13 -0.50 1.40 3.76 -1.26 -4.95 115.29 120.23 2k73 s HIS 181 Ca 0.46 0.87 -0.34 0.00 -0.15 0.00 0.00 55.06 55.90 2k73 s HIS 181 Cb -0.15 -3.54 -0.13 0.00 1.11 0.00 0.00 32.58 29.87 2k73 s HIS 181 CO 0.09 -0.74 2.31 0.72 -0.85 0.00 0.00 174.74 176.27 2k73 n HIS 182 N 6.63 1.35 1.95 1.40 8.25 -1.26 -5.32 115.22 128.23 2k73 n HIS 182 Ca 0.07 0.31 0.16 0.00 -0.26 0.00 0.00 57.72 58.00 2k73 n HIS 182 Cb 0.48 -2.50 0.93 0.00 1.12 0.00 0.00 29.99 30.01 2k73 n HIS 182 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70