#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 0.81 -0.92 4.03 3.38 -2.07 -1.88 115.31 118.66 2k73 h LEU 2 Ca 0.00 -0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.02 2k73 h LEU 2 Cb 0.00 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.47 2k73 h LEU 2 CO 0.00 0.63 0.57 -0.09 0.09 0.00 0.00 178.44 179.63 2k73 h ARG 3 N 0.94 0.93 -0.45 1.13 2.43 -2.06 -1.43 114.38 115.87 2k73 h ARG 3 Ca 0.25 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.34 2k73 h ARG 3 Cb -0.04 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.28 2k73 h ARG 3 CO -0.05 0.62 0.22 0.35 -1.51 0.00 0.00 179.97 179.60 2k73 h PHE 4 N 0.96 0.65 -0.95 2.20 3.57 -1.79 -2.41 116.94 119.16 2k73 h PHE 4 Ca 0.43 -0.03 0.22 0.00 3.53 0.00 0.00 57.97 62.12 2k73 h PHE 4 Cb 0.34 -0.20 -0.12 0.00 2.79 0.00 0.00 35.95 38.76 2k73 h PHE 4 CO -0.03 0.52 0.52 1.25 -2.23 0.00 0.00 178.31 178.35 2k73 h LEU 5 N 0.59 0.58 -1.32 0.59 7.12 -1.06 0.91 115.31 122.71 2k73 h LEU 5 Ca 0.15 0.13 -0.07 0.00 0.13 0.00 0.00 57.88 58.22 2k73 h LEU 5 Cb 0.12 0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 40.28 2k73 h LEU 5 CO -0.02 0.12 -0.34 -1.13 -0.13 0.00 0.00 178.44 176.94 2k73 h ASN 6 N 0.57 0.00 0.00 1.25 -1.24 -1.18 -0.56 115.58 114.42 2k73 h ASN 6 Ca 0.59 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.59 2k73 h ASN 6 Cb 1.04 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.09 2k73 h ASN 6 CO -0.46 0.34 -0.04 1.56 -1.29 0.00 0.00 177.43 177.54 2k73 h GLN 7 N 0.00 0.02 -0.06 6.67 4.20 0.89 -1.66 115.11 125.18 2k73 h GLN 7 Ca -0.00 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 2k73 h GLN 7 Cb 0.61 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 2k73 h GLN 7 CO 0.04 0.88 -0.10 0.00 -0.67 0.00 0.00 178.83 178.98 2k73 h ALA 8 N 0.15 1.73 0.03 3.87 0.00 -0.40 -2.59 119.26 122.05 2k73 h ALA 8 Ca -0.01 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.56 2k73 h ALA 8 Cb 0.89 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.66 2k73 h ALA 8 CO 0.01 0.21 -0.86 0.77 0.00 0.00 0.00 179.25 179.38 2k73 h SER 9 N 0.08 0.70 0.00 0.00 0.02 -1.15 -3.03 113.55 110.17 2k73 h SER 9 Ca 0.02 -0.78 0.00 0.00 -0.84 0.00 0.00 61.79 60.19 2k73 h SER 9 Cb 0.24 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2k73 h SER 9 CO 0.01 1.40 0.00 0.00 -1.14 0.00 0.00 176.83 177.10 2k73 n GLN 10 N -4.03 0.38 -3.91 3.45 3.00 -0.63 -4.63 117.38 111.02 2k73 n GLN 10 Ca -0.11 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.51 2k73 n GLN 10 Cb 0.80 -1.22 -0.06 0.00 0.00 0.00 0.00 30.24 29.76 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 -1.78 2.15 -0.01 1.08 0.00 -1.12 -4.87 107.32 102.76 2k73 s GLY 11 Ca 0.08 -0.67 -0.26 0.00 0.00 0.00 0.00 44.72 43.87 2k73 s GLY 11 CO 0.06 -0.44 1.29 0.07 0.00 0.00 0.00 173.10 174.08 2k73 h ARG 12 N 4.79 -0.02 -0.91 2.90 0.11 -1.86 -3.00 114.38 116.39 2k73 h ARG 12 Ca -0.54 0.00 0.24 0.00 0.10 0.00 0.00 59.98 59.78 2k73 h ARG 12 Cb 1.22 0.01 -0.16 0.00 1.11 0.00 0.00 29.97 32.14 2k73 h ARG 12 CO 0.60 0.42 0.07 0.78 0.10 0.00 0.00 179.97 181.94 2k73 h GLY 13 N -0.48 1.18 0.99 0.08 0.00 -1.95 0.63 103.07 103.52 2k73 h GLY 13 Ca -0.00 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2k73 h GLY 13 CO 0.00 -0.43 0.20 0.00 0.00 0.00 0.00 176.54 176.32 2k73 h ALA 14 N 1.87 0.41 -0.91 3.60 0.00 -1.77 0.16 119.26 122.61 2k73 h ALA 14 Ca 0.54 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.43 2k73 h ALA 14 Cb 1.09 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 2k73 h ALA 14 CO -0.80 -0.10 0.60 -1.49 0.00 0.00 0.00 179.25 177.46 2k73 h TRP 15 N 0.42 1.14 -0.01 0.00 4.06 0.25 -0.27 115.95 121.54 2k73 h TRP 15 Ca 0.12 0.03 -0.07 0.00 2.06 0.00 0.00 58.89 61.02 2k73 h TRP 15 Cb -0.01 -0.38 -0.01 0.00 -1.00 0.00 0.00 29.16 27.75 2k73 h TRP 15 CO -0.05 0.71 -0.34 -0.07 -3.56 0.00 0.00 178.44 175.14 2k73 h LEU 16 N 1.22 0.02 -1.11 -4.49 3.38 0.04 -2.14 115.31 112.23 2k73 h LEU 16 Ca 0.34 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.22 2k73 h LEU 16 Cb -0.12 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2k73 h LEU 16 CO -0.08 0.35 -0.39 0.25 0.09 0.00 0.00 178.44 178.66 2k73 h LEU 17 N 0.01 0.00 -0.25 1.67 5.85 0.78 -2.64 115.31 120.73 2k73 h LEU 17 Ca -0.00 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.51 2k73 h LEU 17 Cb 0.60 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 2k73 h LEU 17 CO 0.04 0.39 -0.89 0.24 -0.34 0.00 0.00 178.44 177.88 2k73 h MET 18 N 0.00 0.28 0.28 1.25 2.86 -0.74 -2.61 114.93 116.24 2k73 h MET 18 Ca -0.00 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.32 2k73 h MET 18 Cb 0.80 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.54 2k73 h MET 18 CO 0.05 1.01 -0.13 0.00 1.06 0.00 0.00 176.91 178.89 2k73 h ALA 19 N 0.89 -0.37 -0.11 6.32 0.00 -1.22 -2.91 119.26 121.87 2k73 h ALA 19 Ca -0.06 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.71 2k73 h ALA 19 Cb 1.52 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 2k73 h ALA 19 CO 0.14 -0.57 -0.04 0.74 0.00 0.00 0.00 179.25 179.53 2k73 h PHE 20 N -0.65 -0.08 -0.69 0.00 -1.00 -1.57 -2.38 116.94 110.56 2k73 h PHE 20 Ca -0.04 0.01 0.07 0.00 2.81 0.00 0.00 57.97 60.82 2k73 h PHE 20 Cb 0.46 0.05 -0.10 0.00 3.61 0.00 0.00 35.95 39.98 2k73 h PHE 20 CO 0.01 -0.06 -0.56 1.15 -1.61 0.00 0.00 178.31 177.24 2k73 h THR 21 N -0.02 0.00 -0.23 -1.55 2.02 -1.48 1.39 112.91 113.04 2k73 h THR 21 Ca 0.06 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.30 2k73 h THR 21 Cb 0.10 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.50 2k73 h THR 21 CO -0.12 0.00 0.24 0.00 0.37 0.00 0.00 175.52 176.01 2k73 h ALA 22 N 0.19 1.89 0.18 6.16 0.00 -1.33 -0.46 119.26 125.89 2k73 h ALA 22 Ca 0.11 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.71 2k73 h ALA 22 Cb 0.49 0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.33 2k73 h ALA 22 CO -0.75 -0.36 -1.29 1.25 0.00 0.00 0.00 179.25 178.10 2k73 h LEU 23 N 0.00 0.82 -1.16 0.00 7.12 0.20 -3.16 115.31 119.13 2k73 h LEU 23 Ca 0.11 -0.88 0.15 0.00 0.13 0.00 0.00 57.88 57.39 2k73 h LEU 23 Cb 0.59 -0.26 -0.08 0.00 -0.53 0.00 0.00 40.66 40.38 2k73 h LEU 23 CO -0.00 1.63 0.60 0.00 -0.13 0.00 0.00 178.44 180.54 2k73 h ALA 24 N 0.20 1.73 -0.18 1.25 0.00 0.21 0.10 119.26 122.58 2k73 h ALA 24 Ca -0.21 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 2k73 h ALA 24 Cb 1.99 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.63 2k73 h ALA 24 CO 0.24 0.00 -0.50 -0.07 0.00 0.00 0.00 179.25 178.93 2k73 h LEU 25 N 0.79 0.52 -0.02 0.00 3.38 -1.57 -1.81 115.31 116.60 2k73 h LEU 25 Ca 0.49 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 2k73 h LEU 25 Cb 0.70 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 2k73 h LEU 25 CO -0.25 0.93 -0.01 -0.33 0.09 0.00 0.00 178.44 178.87 2k73 h GLU 26 N 0.38 0.04 0.76 1.13 4.39 -0.87 -2.58 114.58 117.83 2k73 h GLU 26 Ca 0.02 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 2k73 h GLU 26 Cb 1.01 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.67 2k73 h GLU 26 CO 0.09 0.45 -0.37 1.25 -1.16 0.00 0.00 179.01 179.27 2k73 h LEU 27 N -0.37 -0.87 -1.21 1.33 5.85 -0.96 0.47 115.31 119.55 2k73 h LEU 27 Ca 0.00 0.02 0.31 0.00 0.84 0.00 0.00 57.88 59.06 2k73 h LEU 27 Cb 0.44 0.22 -0.12 0.00 0.37 0.00 0.00 40.66 41.57 2k73 h LEU 27 CO 0.00 -0.59 0.67 0.71 -0.34 0.00 0.00 178.44 178.89 2k73 h THR 28 N -1.08 0.38 0.19 1.05 1.35 -1.42 0.27 112.91 113.67 2k73 h THR 28 Ca -0.10 -0.12 -0.32 0.00 -0.55 0.00 0.00 66.41 65.32 2k73 h THR 28 Cb 0.80 0.01 0.03 0.00 -1.73 0.00 0.00 68.15 67.26 2k73 h THR 28 CO 0.17 0.06 -1.37 0.00 -0.25 0.00 0.00 175.52 174.13 2k73 h ALA 29 N 1.70 -0.08 0.00 6.62 0.00 -1.09 -3.10 119.26 123.30 2k73 h ALA 29 Ca 0.69 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2k73 h ALA 29 Cb 1.72 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.65 2k73 h ALA 29 CO -0.44 0.72 0.20 1.25 0.00 0.00 0.00 179.25 180.98 2k73 h LEU 30 N 0.19 0.00 0.04 0.00 6.46 0.36 -0.33 115.31 122.03 2k73 h LEU 30 Ca -0.22 0.00 -0.36 0.00 -0.12 0.00 0.00 57.88 57.18 2k73 h LEU 30 Cb 2.06 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 41.94 2k73 h LEU 30 CO 0.26 0.00 -2.20 1.87 -0.62 0.00 0.00 178.44 177.75 2k73 n TRP 31 N -2.53 0.53 -0.18 1.25 -0.00 -0.86 -3.75 117.44 111.91 2k73 n TRP 31 Ca -0.02 0.14 -0.01 0.00 -0.00 0.00 0.00 57.50 57.61 2k73 n TRP 31 Cb 0.24 -1.08 0.09 0.00 -0.00 0.00 0.00 31.31 30.56 2k73 n TRP 31 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 177.69 178.43 2k73 h PHE 32 N 0.02 0.35 -0.38 5.87 0.04 -0.98 -1.06 116.94 120.80 2k73 h PHE 32 Ca -0.48 0.03 -0.14 0.00 2.80 0.00 0.00 57.97 60.17 2k73 h PHE 32 Cb 2.03 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 40.10 2k73 h PHE 32 CO 0.03 0.10 -0.33 -0.56 -0.60 0.00 0.00 178.31 176.96 2k73 h GLN 33 N 0.38 0.89 0.00 1.51 3.07 -1.71 0.86 115.11 120.11 2k73 h GLN 33 Ca 0.28 -0.45 -0.00 0.00 0.09 0.00 0.00 58.65 58.57 2k73 h GLN 33 Cb 0.32 0.01 -0.00 0.00 0.08 0.00 0.00 27.48 27.89 2k73 h GLN 33 CO -0.28 1.10 -0.00 1.25 0.09 0.00 0.00 178.83 180.99 2k73 h HIS 34 N 0.70 0.00 0.00 0.06 2.76 -1.45 0.69 115.15 117.91 2k73 h HIS 34 Ca 0.07 0.00 -0.26 0.00 -2.20 0.00 0.00 60.37 57.98 2k73 h HIS 34 Cb 0.91 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.82 2k73 h HIS 34 CO 0.06 0.00 -1.98 0.28 -1.30 0.00 0.00 177.93 174.99 2k73 n VAL 35 N -3.09 0.99 1.43 5.26 0.31 -0.48 -4.43 118.33 118.32 2k73 n VAL 35 Ca -0.03 -0.48 0.11 0.00 -0.01 0.00 0.00 64.34 63.93 2k73 n VAL 35 Cb 0.07 -0.90 0.45 0.00 -0.91 0.00 0.00 33.84 32.55 2k73 n VAL 35 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 2k73 n MET 36 N -2.78 1.57 -3.85 5.55 2.81 0.30 -4.93 117.12 115.78 2k73 n MET 36 Ca -0.27 -0.85 -0.24 0.00 -1.81 0.00 0.00 57.70 54.53 2k73 n MET 36 Cb 0.89 -1.39 0.00 0.00 -0.71 0.00 0.00 33.22 32.01 2k73 n MET 36 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2k73 n LEU 37 N 0.06 -2.59 -4.89 4.03 4.77 0.23 -4.97 117.00 113.64 2k73 n LEU 37 Ca 0.16 -0.93 -0.25 0.00 -0.03 0.00 0.00 56.01 54.96 2k73 n LEU 37 Cb 0.28 -2.41 -0.04 0.00 -2.33 0.00 0.00 43.42 38.92 2k73 n LEU 37 CO 0.13 0.42 -0.14 -0.76 -1.33 0.00 0.00 177.39 175.72 2k73 s LEU 38 N -6.85 4.12 -0.00 2.23 1.43 -0.89 -5.05 118.68 113.66 2k73 s LEU 38 Ca 0.01 0.03 0.05 0.00 -1.03 0.00 0.00 54.13 53.19 2k73 s LEU 38 Cb -0.01 -2.69 -0.01 0.00 0.03 0.00 0.00 46.19 43.51 2k73 s LEU 38 CO 0.86 0.04 -0.14 -1.59 0.23 0.00 0.00 176.35 175.74 2k73 s LYS 39 N -3.30 1.14 1.11 1.70 -2.85 -1.26 -4.78 119.74 111.49 2k73 s LYS 39 Ca 0.33 -0.56 -0.18 0.00 -1.00 0.00 0.00 55.97 54.57 2k73 s LYS 39 Cb -0.10 -1.11 0.25 0.00 -2.06 0.00 0.00 37.83 34.80 2k73 s LYS 39 CO 0.27 0.30 1.18 -1.25 0.10 0.00 0.00 175.35 175.95 2k73 s PRO 40 N -0.47 -0.47 0.00 1.78 0.04 -1.26 -4.94 135.00 129.68 2k73 s PRO 40 Ca 0.05 -0.17 0.00 0.00 0.04 0.00 0.00 61.00 60.92 2k73 s PRO 40 Cb -0.06 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.79 2k73 s PRO 40 CO -0.00 -3.20 0.00 0.00 0.04 0.00 0.00 177.00 173.84 2k73 h VAL 42 N 0.64 1.06 0.01 0.00 2.07 -1.85 -2.58 116.25 115.61 2k73 h VAL 42 Ca 0.00 -0.60 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 2k73 h VAL 42 Cb 0.00 1.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2k73 h VAL 42 CO 0.00 0.15 -0.00 -0.07 0.02 0.00 0.00 177.57 177.66 2k73 h LEU 43 N -0.41 -0.01 -0.78 2.57 4.07 -1.97 -1.69 115.31 117.10 2k73 h LEU 43 Ca -0.01 -0.29 0.18 0.00 0.08 0.00 0.00 57.88 57.83 2k73 h LEU 43 Cb 0.34 0.00 -0.12 0.00 1.08 0.00 0.00 40.66 41.97 2k73 h LEU 43 CO 0.02 0.29 0.21 0.28 -1.08 0.00 0.00 178.44 178.16 2k73 h SER 44 N -0.31 0.05 -0.38 -0.43 0.02 -1.96 0.42 113.55 110.96 2k73 h SER 44 Ca -0.00 0.15 -0.11 0.00 -0.84 0.00 0.00 61.79 60.99 2k73 h SER 44 Cb 0.30 0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 2k73 h SER 44 CO 0.00 -0.04 -0.15 0.40 -1.14 0.00 0.00 176.83 175.89 2k73 h ILE 45 N 0.28 1.27 -0.17 3.27 2.04 -1.37 -1.39 117.51 121.43 2k73 h ILE 45 Ca 0.45 -1.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.04 2k73 h ILE 45 Cb 0.80 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 2k73 h ILE 45 CO -0.53 0.43 0.09 0.22 0.00 0.00 0.00 178.15 178.36 2k73 h TYR 46 N 0.76 0.24 -0.75 1.37 5.03 0.59 -2.02 116.97 122.19 2k73 h TYR 46 Ca 0.12 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.41 2k73 h TYR 46 Cb 0.67 -0.08 -0.04 0.00 1.55 0.00 0.00 36.73 38.84 2k73 h TYR 46 CO 0.04 0.25 0.42 1.49 -1.32 0.00 0.00 178.16 179.03 2k73 h GLU 47 N 0.17 1.04 -1.00 1.82 4.81 -0.26 -1.88 114.58 119.27 2k73 h GLU 47 Ca 0.06 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 2k73 h GLU 47 Cb 0.09 -0.21 -0.06 0.00 0.63 0.00 0.00 28.75 29.20 2k73 h GLU 47 CO -0.01 0.75 0.66 0.00 -0.73 0.00 0.00 179.01 179.68 2k73 h ARG 48 N 1.05 1.25 -0.65 1.92 2.47 -0.82 -1.28 114.38 118.32 2k73 h ARG 48 Ca 0.27 -0.08 -0.02 0.00 -1.26 0.00 0.00 59.98 58.89 2k73 h ARG 48 Cb 0.01 -0.28 -0.03 0.00 -1.65 0.00 0.00 29.97 28.02 2k73 h ARG 48 CO -0.04 0.83 0.32 0.00 0.56 0.00 0.00 179.97 181.63 2k73 h ALA 49 N 1.40 1.34 -0.62 0.04 0.00 -0.63 0.47 119.26 121.26 2k73 h ALA 49 Ca 0.39 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.22 2k73 h ALA 49 Cb -0.03 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.44 2k73 h ALA 49 CO -0.12 0.52 0.35 0.00 0.00 0.00 0.00 179.25 180.00 2k73 h ALA 50 N 1.44 0.82 0.02 0.00 0.00 -0.94 0.11 119.26 120.70 2k73 h ALA 50 Ca 0.23 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2k73 h ALA 50 Cb 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2k73 h ALA 50 CO -0.03 0.04 -0.01 1.25 0.00 0.00 0.00 179.25 180.50 2k73 h LEU 51 N 0.66 -0.02 -1.04 0.00 5.85 -1.19 -2.74 115.31 116.83 2k73 h LEU 51 Ca 0.27 -0.71 0.31 0.00 0.84 0.00 0.00 57.88 58.60 2k73 h LEU 51 Cb 0.14 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.03 2k73 h LEU 51 CO -0.16 0.81 0.59 -0.26 -0.34 0.00 0.00 178.44 179.09 2k73 h PHE 52 N -0.96 0.91 -0.36 1.25 -1.00 0.01 0.88 116.94 117.67 2k73 h PHE 52 Ca -0.00 0.04 -0.07 0.00 2.81 0.00 0.00 57.97 60.75 2k73 h PHE 52 Cb 0.72 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 40.03 2k73 h PHE 52 CO 0.19 -0.13 -0.04 0.78 -1.61 0.00 0.00 178.31 177.51 2k73 h GLY 53 N 0.36 0.71 0.91 -1.45 0.00 -0.84 -2.86 103.07 99.90 2k73 h GLY 53 Ca 0.72 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 2k73 h GLY 53 CO -0.56 0.51 0.10 -2.08 0.00 0.00 0.00 176.54 174.51 2k73 h VAL 54 N 0.46 1.15 -0.87 4.60 2.07 0.82 -2.42 116.25 122.06 2k73 h VAL 54 Ca 0.10 -0.44 0.23 0.00 0.82 0.00 0.00 66.70 67.41 2k73 h VAL 54 Cb 0.52 1.03 -0.15 0.00 -1.52 0.00 0.00 31.29 31.17 2k73 h VAL 54 CO 0.03 0.15 0.12 0.25 0.02 0.00 0.00 177.57 178.13 2k73 h LEU 55 N 0.22 -0.21 -1.59 2.57 7.12 -0.03 2.11 115.31 125.49 2k73 h LEU 55 Ca 0.08 0.22 -0.04 0.00 0.13 0.00 0.00 57.88 58.26 2k73 h LEU 55 Cb 0.14 0.34 -0.01 0.00 -0.53 0.00 0.00 40.66 40.60 2k73 h LEU 55 CO -0.01 -0.21 -0.20 1.23 -0.13 0.00 0.00 178.44 179.12 2k73 h GLY 56 N 0.13 0.01 1.08 3.75 0.00 -1.22 -2.24 103.07 104.57 2k73 h GLY 56 Ca 0.52 -0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.76 2k73 h GLY 56 CO -0.72 0.00 0.05 0.00 0.00 0.00 0.00 176.54 175.87 2k73 h ALA 57 N 1.80 0.86 0.00 3.60 0.00 0.38 -0.09 119.26 125.80 2k73 h ALA 57 Ca -0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 2k73 h ALA 57 Cb 0.36 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2k73 h ALA 57 CO 0.03 0.67 -0.34 0.00 0.00 0.00 0.00 179.25 179.61 2k73 h ALA 58 N 1.02 0.96 0.18 0.00 0.00 -0.68 0.95 119.26 121.69 2k73 h ALA 58 Ca 0.19 -0.31 -0.30 0.00 0.00 0.00 0.00 54.91 54.49 2k73 h ALA 58 Cb 0.51 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.27 2k73 h ALA 58 CO 0.02 0.42 -1.33 -0.07 0.00 0.00 0.00 179.25 178.30 2k73 h LEU 59 N 0.00 0.67 0.13 0.00 -0.00 -1.01 -2.04 115.31 113.06 2k73 h LEU 59 Ca -0.00 -0.69 -0.27 0.00 -0.00 0.00 0.00 57.88 56.91 2k73 h LEU 59 Cb 0.91 -0.22 0.01 0.00 -0.00 0.00 0.00 40.66 41.36 2k73 h LEU 59 CO 0.04 1.53 -1.24 0.40 -0.00 0.00 0.00 178.44 179.18 2k73 h ILE 60 N 0.14 1.50 0.00 1.22 2.04 -0.95 -3.26 117.51 118.20 2k73 h ILE 60 Ca -0.19 -3.05 -0.05 0.00 1.00 0.00 0.00 64.86 62.57 2k73 h ILE 60 Cb 2.03 2.94 -0.01 0.00 -0.74 0.00 0.00 36.82 41.04 2k73 h ILE 60 CO 0.24 0.89 -0.24 1.23 0.00 0.00 0.00 178.15 180.27 2k73 h GLY 61 N 1.56 0.00 0.34 5.37 0.00 -0.91 -2.98 103.07 106.44 2k73 h GLY 61 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2k73 h GLY 61 CO 0.21 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.75 2k73 n ALA 62 N -2.18 2.29 0.07 3.60 0.00 -0.77 -2.93 120.51 120.60 2k73 n ALA 62 Ca 0.02 -0.05 -0.10 0.00 0.00 0.00 0.00 53.44 53.31 2k73 n ALA 62 Cb 0.54 -1.13 -0.13 0.00 0.00 0.00 0.00 19.45 18.74 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 1.63 0.00 0.00 5.03 -1.67 -3.45 117.51 119.05 2k73 h ILE 63 Ca 0.00 -3.29 0.00 0.00 -0.12 0.00 0.00 64.86 61.45 2k73 h ILE 63 Cb 0.00 2.87 0.00 0.00 -3.03 0.00 0.00 36.82 36.66 2k73 h ILE 63 CO 0.00 0.94 0.00 0.00 -0.68 0.00 0.00 178.15 178.41 2k73 n ALA 64 N -2.42 0.00 0.94 1.87 0.00 -1.15 -5.02 120.51 114.74 2k73 n ALA 64 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2k73 n ALA 64 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.42 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 0.94 0.00 0.00 -0.04 -1.19 -3.12 135.00 131.59 2k73 n PRO 65 Ca 0.00 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.53 2k73 n PRO 65 Cb 0.00 -1.17 -0.08 0.00 -0.04 0.00 0.00 33.50 32.22 2k73 n PRO 65 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k73 n LYS 66 N 0.37 2.37 -4.25 0.54 5.02 -1.26 -4.81 118.16 116.14 2k73 n LYS 66 Ca 0.00 -0.03 -0.28 0.00 -2.02 0.00 0.00 58.31 55.97 2k73 n LYS 66 Cb 0.40 -1.16 -0.04 0.00 -0.02 0.00 0.00 35.03 34.20 2k73 n LYS 66 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2k73 s THR 67 N -2.29 1.59 -0.60 -0.18 -4.23 -1.18 -4.95 115.64 103.79 2k73 s THR 67 Ca 0.06 -1.71 0.00 0.00 -1.18 0.00 0.00 61.69 58.85 2k73 s THR 67 Cb 0.11 -2.31 0.00 0.00 1.34 0.00 0.00 72.50 71.64 2k73 s THR 67 CO 0.56 0.00 0.49 -2.65 -0.54 0.00 0.00 174.62 172.48 2k73 n PRO 68 N -1.49 0.00 -0.37 3.99 -0.02 -1.26 -2.45 135.00 133.40 2k73 n PRO 68 Ca -0.08 0.12 0.29 0.00 -2.02 0.00 0.00 63.50 61.81 2k73 n PRO 68 Cb 0.65 -1.66 0.55 0.00 -0.02 0.00 0.00 33.50 33.03 2k73 n PRO 68 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2k73 h LEU 69 N 0.00 0.39 0.00 2.45 6.46 -1.93 -2.23 115.31 120.45 2k73 h LEU 69 Ca 0.00 0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.91 2k73 h LEU 69 Cb 0.32 0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.37 2k73 h LEU 69 CO 0.00 -0.12 0.00 0.54 -0.62 0.00 0.00 178.44 178.24 2k73 n ARG 70 N -4.83 0.00 -0.21 1.25 1.74 -1.02 0.60 116.66 114.19 2k73 n ARG 70 Ca 0.33 0.94 0.26 0.00 -0.77 0.00 0.00 57.85 58.61 2k73 n ARG 70 Cb 1.15 -1.46 0.66 0.00 -1.02 0.00 0.00 32.46 31.79 2k73 n ARG 70 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 2k73 h TYR 71 N 0.00 0.16 -0.10 -1.55 3.20 -1.72 0.62 116.97 117.59 2k73 h TYR 71 Ca 0.00 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 2k73 h TYR 71 Cb 0.00 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.22 2k73 h TYR 71 CO -0.82 0.03 -0.15 0.28 -1.64 0.00 0.00 178.16 175.87 2k73 h VAL 72 N 0.12 1.38 0.05 1.81 2.07 0.20 -2.94 116.25 118.93 2k73 h VAL 72 Ca 0.45 -1.37 -0.23 0.00 0.82 0.00 0.00 66.70 66.37 2k73 h VAL 72 Cb 1.59 2.04 -0.00 0.00 -1.52 0.00 0.00 31.29 33.40 2k73 h VAL 72 CO -0.06 0.39 -1.03 0.00 0.02 0.00 0.00 177.57 176.88 2k73 h ALA 73 N 0.55 0.32 0.00 1.67 0.00 0.11 -3.08 119.26 118.82 2k73 h ALA 73 Ca 0.01 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.12 2k73 h ALA 73 Cb 0.70 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2k73 h ALA 73 CO 0.03 0.95 0.00 1.98 0.00 0.00 0.00 179.25 182.21 2k73 h MET 74 N 0.11 0.00 -0.95 0.00 -1.53 0.16 -2.01 114.93 110.71 2k73 h MET 74 Ca -0.08 0.00 0.14 0.00 -3.44 0.00 0.00 59.70 56.32 2k73 h MET 74 Cb 1.71 0.00 -0.09 0.00 -0.55 0.00 0.00 31.60 32.67 2k73 h MET 74 CO 0.16 0.00 0.57 0.28 0.14 0.00 0.00 176.91 178.06 2k73 h VAL 75 N 0.00 0.83 0.06 -5.77 2.07 -1.42 0.30 116.25 112.31 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 0.01 -0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 29.67 2k73 h VAL 75 CO 0.00 0.15 -1.52 0.40 0.02 0.00 0.00 177.57 176.62 2k73 h ILE 76 N 0.84 1.12 0.55 4.57 2.04 -1.60 -2.87 117.51 122.17 2k73 h ILE 76 Ca 0.50 -2.85 -0.03 0.00 1.00 0.00 0.00 64.86 63.48 2k73 h ILE 76 Cb 0.60 2.64 0.01 0.00 -0.74 0.00 0.00 36.82 39.33 2k73 h ILE 76 CO -0.31 0.75 -0.26 -0.25 0.00 0.00 0.00 178.15 178.07 2k73 h TRP 77 N 0.03 -0.68 -0.12 1.37 2.91 -1.19 -2.24 115.95 116.04 2k73 h TRP 77 Ca -0.23 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 59.77 2k73 h TRP 77 Cb 1.97 0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 30.84 2k73 h TRP 77 CO 0.03 -0.39 0.04 1.25 -1.03 0.00 0.00 178.44 178.35 2k73 h LEU 78 N -0.82 0.17 -0.83 0.65 6.46 -0.62 -0.40 115.31 119.91 2k73 h LEU 78 Ca -0.07 -0.18 0.21 0.00 -0.12 0.00 0.00 57.88 57.72 2k73 h LEU 78 Cb 0.60 -0.04 -0.14 0.00 -0.73 0.00 0.00 40.66 40.35 2k73 h LEU 78 CO 0.12 0.30 0.15 1.88 -0.62 0.00 0.00 178.44 180.27 2k73 h TYR 79 N 0.03 0.20 0.00 1.25 -1.99 -1.50 0.87 116.97 115.83 2k73 h TYR 79 Ca 0.04 0.05 -0.09 0.00 2.00 0.00 0.00 58.73 60.73 2k73 h TYR 79 Cb 0.18 0.05 -0.01 0.00 2.00 0.00 0.00 36.73 38.95 2k73 h TYR 79 CO -0.01 -0.22 -0.45 0.66 -0.00 0.00 0.00 178.16 178.14 2k73 h SER 80 N 0.17 0.00 0.89 3.88 4.64 -1.18 -2.38 113.55 119.57 2k73 h SER 80 Ca 0.50 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.77 2k73 h SER 80 Cb 0.96 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.06 2k73 h SER 80 CO -0.66 0.45 -0.43 0.00 -0.87 0.00 0.00 176.83 175.32 2k73 h ALA 81 N 1.55 -1.20 0.15 5.18 0.00 0.25 0.64 119.26 125.83 2k73 h ALA 81 Ca -0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2k73 h ALA 81 Cb 1.19 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2k73 h ALA 81 CO 0.06 -1.16 -0.07 0.74 0.00 0.00 0.00 179.25 178.82 2k73 h PHE 82 N -1.23 -0.18 -0.29 0.00 0.04 -1.42 -2.71 116.94 111.15 2k73 h PHE 82 Ca -0.12 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.60 2k73 h PHE 82 Cb 0.92 0.06 -0.01 0.00 2.20 0.00 0.00 35.95 39.12 2k73 h PHE 82 CO -0.01 0.27 0.00 0.00 -0.60 0.00 0.00 178.31 177.97 2k73 h ARG 83 N -0.87 0.51 -0.36 1.51 3.08 -1.54 0.39 114.38 117.10 2k73 h ARG 83 Ca -0.02 -0.16 0.03 0.00 0.07 0.00 0.00 59.98 59.90 2k73 h ARG 83 Cb 0.53 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 2k73 h ARG 83 CO 0.03 0.65 0.16 0.78 -1.07 0.00 0.00 179.97 180.53 2k73 h GLY 84 N 0.30 0.48 0.57 0.04 0.00 0.19 -0.42 103.07 104.22 2k73 h GLY 84 Ca 0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 2k73 h GLY 84 CO 0.01 0.07 -0.07 -2.08 0.00 0.00 0.00 176.54 174.48 2k73 h VAL 85 N 0.34 1.03 -0.45 4.60 2.07 -1.41 -1.59 116.25 120.83 2k73 h VAL 85 Ca 0.16 -0.89 0.13 0.00 0.82 0.00 0.00 66.70 66.92 2k73 h VAL 85 Cb 0.10 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 2k73 h VAL 85 CO -0.13 0.20 0.54 1.56 0.02 0.00 0.00 177.57 179.76 2k73 h GLN 86 N -0.62 0.00 0.19 1.57 1.08 -0.07 0.20 115.11 117.46 2k73 h GLN 86 Ca -0.02 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 56.85 2k73 h GLN 86 Cb 0.47 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.92 2k73 h GLN 86 CO 0.03 0.00 -1.58 1.25 -0.95 0.00 0.00 178.83 177.58 2k73 h LEU 87 N 0.00 0.62 -2.06 1.46 5.85 -0.83 -3.29 115.31 117.06 2k73 h LEU 87 Ca 0.22 -0.92 0.09 0.00 0.84 0.00 0.00 57.88 58.10 2k73 h LEU 87 Cb 1.30 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 2k73 h LEU 87 CO -0.00 1.72 0.36 0.71 -0.34 0.00 0.00 178.44 180.89 2k73 h THR 88 N 0.02 0.35 -0.03 1.05 1.35 0.40 -0.08 112.91 115.98 2k73 h THR 88 Ca -0.31 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.51 2k73 h THR 88 Cb 2.03 0.71 0.00 0.00 -1.73 0.00 0.00 68.15 69.16 2k73 h THR 88 CO 0.18 0.00 -0.14 1.88 -0.25 0.00 0.00 175.52 177.18 2k73 h TYR 89 N 0.00 0.20 -0.92 4.73 -1.99 -1.54 -2.78 116.97 114.68 2k73 h TYR 89 Ca 0.14 -0.09 0.24 0.00 2.00 0.00 0.00 58.73 61.02 2k73 h TYR 89 Cb 0.86 -0.03 -0.06 0.00 2.00 0.00 0.00 36.73 39.50 2k73 h TYR 89 CO 0.00 0.79 0.63 0.93 -0.00 0.00 0.00 178.16 180.51 2k73 h GLU 90 N -0.45 0.21 -0.08 4.88 4.39 -1.10 0.55 114.58 122.98 2k73 h GLU 90 Ca -0.01 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.57 2k73 h GLU 90 Cb 0.81 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 2k73 h GLU 90 CO 0.03 0.14 -0.37 1.25 -1.16 0.00 0.00 179.01 178.90 2k73 h HIS 91 N 0.21 0.52 -0.19 4.33 2.76 -1.45 -2.89 115.15 118.44 2k73 h HIS 91 Ca 0.46 -0.23 -0.06 0.00 -2.20 0.00 0.00 60.37 58.35 2k73 h HIS 91 Cb 1.47 -0.08 -0.00 0.00 1.55 0.00 0.00 27.41 30.34 2k73 h HIS 91 CO -0.00 0.98 -0.11 1.79 -1.30 0.00 0.00 177.93 179.29 2k73 h THR 92 N -0.09 1.31 -0.44 6.26 1.35 -0.66 0.00 112.91 120.64 2k73 h THR 92 Ca -0.02 -1.19 0.09 0.00 -0.55 0.00 0.00 66.41 64.74 2k73 h THR 92 Cb 1.02 1.69 -0.08 0.00 -1.73 0.00 0.00 68.15 69.04 2k73 h THR 92 CO 0.08 0.36 -0.09 -0.03 -0.25 0.00 0.00 175.52 175.58 2k73 h MET 93 N 0.10 0.02 -0.01 4.72 -1.53 -0.11 0.51 114.93 118.63 2k73 h MET 93 Ca 0.04 -0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.30 2k73 h MET 93 Cb 0.61 -0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.65 2k73 h MET 93 CO 0.03 0.01 -0.01 1.25 0.14 0.00 0.00 176.91 178.34 2k73 h LEU 94 N 0.02 0.02 -0.46 3.39 6.46 -1.50 1.85 115.31 125.10 2k73 h LEU 94 Ca 0.22 -0.45 0.09 0.00 -0.12 0.00 0.00 57.88 57.62 2k73 h LEU 94 Cb 0.33 -0.01 -0.08 0.00 -0.73 0.00 0.00 40.66 40.18 2k73 h LEU 94 CO -0.44 0.46 -0.01 -0.61 -0.62 0.00 0.00 178.44 177.22 2k73 h GLN 95 N -0.43 0.10 0.00 1.25 4.15 -0.47 -0.46 115.11 119.25 2k73 h GLN 95 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2k73 h GLN 95 Cb 0.46 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.12 2k73 h GLN 95 CO 0.00 0.06 -0.80 1.25 -1.93 0.00 0.00 178.83 177.41 2k73 h LEU 96 N 0.10 0.00 -6.45 -2.39 5.85 -0.00 -3.41 115.31 109.00 2k73 h LEU 96 Ca 0.23 -0.02 -0.59 0.00 0.84 0.00 0.00 57.88 58.34 2k73 h LEU 96 Cb 0.34 0.00 -0.38 0.00 0.37 0.00 0.00 40.66 40.98 2k73 h LEU 96 CO -0.39 0.01 -0.93 -0.47 -0.34 0.00 0.00 178.44 176.33 2k73 s TYR 97 N -3.32 1.01 -1.22 1.25 6.14 0.63 -5.04 117.35 116.80 2k73 s TYR 97 Ca 0.01 -2.11 -0.19 0.00 0.64 0.00 0.00 57.07 55.43 2k73 s TYR 97 Cb 0.09 -0.95 0.08 0.00 0.42 0.00 0.00 41.96 41.60 2k73 s TYR 97 CO 0.76 -0.82 1.62 -1.25 0.64 0.00 0.00 175.55 176.50 2k73 s PRO 98 N 0.38 3.90 0.12 4.97 0.04 -0.26 -3.77 135.00 140.38 2k73 s PRO 98 Ca 0.28 -1.87 -0.15 0.00 0.04 0.00 0.00 61.00 59.30 2k73 s PRO 98 Cb -0.05 -5.43 -0.04 0.00 0.04 0.00 0.00 34.50 29.02 2k73 s PRO 98 CO -0.13 -2.18 1.51 0.77 0.04 0.00 0.00 177.00 177.02 2k73 h SER 99 N 8.05 0.73 -0.12 6.66 0.02 -1.89 -2.86 113.55 124.13 2k73 h SER 99 Ca 0.37 -0.38 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2k73 h SER 99 Cb 0.91 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.25 2k73 h SER 99 CO 1.42 0.94 0.00 -0.81 -1.14 0.00 0.00 176.83 177.23 2k73 n PRO 100 N -4.36 1.37 -2.27 3.45 -0.04 -1.26 -4.98 135.00 126.91 2k73 n PRO 100 Ca -0.02 -0.48 -0.00 0.00 -0.04 0.00 0.00 63.50 62.96 2k73 n PRO 100 Cb 0.36 -1.20 -0.00 0.00 -0.04 0.00 0.00 33.50 32.62 2k73 n PRO 100 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2k73 n PHE 101 N -0.08 -3.58 -3.54 0.54 3.72 -1.08 -4.80 117.46 108.64 2k73 n PHE 101 Ca 0.04 2.13 0.00 0.00 -0.05 0.00 0.00 57.45 59.57 2k73 n PHE 101 Cb 0.17 -3.10 0.00 0.00 -0.94 0.00 0.00 39.48 35.61 2k73 n PHE 101 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2k73 n ALA 102 N 1.90 0.00 0.00 4.37 0.00 -1.26 -4.83 120.51 120.68 2k73 n ALA 102 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k73 n ALA 102 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2k73 n ALA 102 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2k73 n THR 103 N -1.07 0.00 0.00 0.00 5.66 -1.26 -4.97 114.28 112.64 2k73 n THR 103 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2k73 n THR 103 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2k73 n THR 103 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2k73 n SER 104 N -0.34 0.00 0.00 1.09 2.88 -1.26 -4.72 113.62 111.27 2k73 n SER 104 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2k73 n SER 104 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2k73 n SER 104 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2k73 n ASP 105 N 5.68 0.00 0.00 -3.46 -0.08 -1.26 -4.68 116.55 112.75 2k73 n ASP 105 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2k73 n ASP 105 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2k73 n ASP 105 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 2k73 n PHE 106 N 0.00 0.00 -3.16 -0.67 -0.00 -1.25 -4.76 117.46 107.62 2k73 n PHE 106 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.45 57.12 2k73 n PHE 106 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 39.48 39.42 2k73 n PHE 106 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2k73 s MET 107 N 0.00 4.05 0.01 -4.13 0.23 -1.26 -4.01 119.30 114.18 2k73 s MET 107 Ca 0.00 0.68 0.06 0.00 -1.03 0.00 0.00 55.69 55.40 2k73 s MET 107 Cb 0.00 -2.58 -0.02 0.00 -1.53 0.00 0.00 34.83 30.71 2k73 s MET 107 CO 0.00 0.24 -0.18 0.54 -2.03 0.00 0.00 175.02 173.59 2k73 s VAL 108 N -1.84 1.45 -0.60 5.16 0.11 -1.26 -5.07 120.40 118.34 2k73 s VAL 108 Ca 0.50 -0.91 -0.24 0.00 -2.93 0.00 0.00 61.98 58.41 2k73 s VAL 108 Cb -0.12 -1.23 0.05 0.00 -1.53 0.00 0.00 36.38 33.55 2k73 s VAL 108 CO 0.19 0.31 0.98 -0.13 -3.33 0.00 0.00 175.10 173.12 2k73 s ARG 109 N -0.70 3.25 0.53 1.54 0.52 -1.26 -4.91 118.95 117.92 2k73 s ARG 109 Ca 0.07 -0.45 -0.22 0.00 -0.52 0.00 0.00 55.73 54.61 2k73 s ARG 109 Cb -0.07 -4.12 -0.05 0.00 0.52 0.00 0.00 34.95 31.22 2k73 s ARG 109 CO 0.00 -1.66 1.31 -0.59 0.02 0.00 0.00 175.30 174.38 2k73 s PHE 110 N 4.16 2.42 0.42 -0.53 -0.71 -1.26 -4.96 117.98 117.52 2k73 s PHE 110 Ca 0.28 1.42 -0.25 0.00 -1.04 0.00 0.00 56.93 57.34 2k73 s PHE 110 Cb -0.14 -3.69 -0.08 0.00 -1.21 0.00 0.00 43.02 37.90 2k73 s PHE 110 CO 0.16 -2.56 1.20 -1.25 -1.34 0.00 0.00 175.22 171.43 2k73 s PRO 111 N -2.88 3.92 0.00 1.99 0.04 -1.26 -4.94 135.00 131.87 2k73 s PRO 111 Ca 0.70 1.89 0.22 0.00 0.04 0.00 0.00 61.00 63.85 2k73 s PRO 111 Cb -0.37 -2.60 0.41 0.00 0.04 0.00 0.00 34.50 31.98 2k73 s PRO 111 CO 0.44 -0.45 1.37 0.39 0.04 0.00 0.00 177.00 178.79 2k73 n GLU 112 N -0.12 2.44 0.00 4.56 1.02 -1.26 -4.18 120.64 123.10 2k73 n GLU 112 Ca 0.05 -2.24 0.00 0.00 -0.02 0.00 0.00 57.16 54.95 2k73 n GLU 112 Cb 0.46 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 2k73 n GLU 112 CO 0.00 0.00 0.00 -2.67 1.18 0.00 0.00 177.13 175.64 2k73 n TRP 113 N 1.40 0.00 -3.89 -0.32 4.27 -1.26 -4.88 117.44 112.75 2k73 n TRP 113 Ca 0.18 0.00 -0.28 0.00 -3.89 0.00 0.00 57.50 53.51 2k73 n TRP 113 Cb 0.58 0.00 -0.12 0.00 -1.36 0.00 0.00 31.31 30.41 2k73 n TRP 113 CO 0.00 0.00 0.00 -1.17 -2.29 0.00 0.00 177.69 174.23 2k73 s LEU 114 N -0.79 4.85 0.00 5.67 2.96 -1.26 -4.93 118.68 125.17 2k73 s LEU 114 Ca 0.00 -3.83 0.00 0.00 -0.22 0.00 0.00 54.13 50.08 2k73 s LEU 114 Cb 0.00 -1.65 0.00 0.00 0.50 0.00 0.00 46.19 45.04 2k73 s LEU 114 CO 0.00 -0.09 0.51 -2.65 -1.32 0.00 0.00 176.35 172.80 2k73 n PRO 115 N 2.01 0.00 0.18 0.98 -0.02 -1.26 -1.71 135.00 135.17 2k73 n PRO 115 Ca 0.19 0.13 0.14 0.00 -2.02 0.00 0.00 63.50 61.94 2k73 n PRO 115 Cb 0.35 -1.64 0.71 0.00 -0.02 0.00 0.00 33.50 32.89 2k73 n PRO 115 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2k73 h LEU 116 N 0.00 0.00 0.04 2.45 3.38 -1.93 0.91 115.31 120.16 2k73 h LEU 116 Ca 0.00 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.59 2k73 h LEU 116 Cb 0.29 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 2k73 h LEU 116 CO 0.00 0.00 -2.30 -0.67 0.09 0.00 0.00 178.44 175.56 2k73 n ASP 117 N -4.33 1.93 -0.08 -0.43 -0.08 -0.69 -3.13 116.55 109.75 2k73 n ASP 117 Ca 0.02 -0.01 -0.12 0.00 -1.51 0.00 0.00 54.79 53.17 2k73 n ASP 117 Cb 0.28 -0.50 -0.05 0.00 2.34 0.00 0.00 41.12 43.19 2k73 n ASP 117 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 2k73 h LYS 118 N 0.02 0.47 0.00 -0.67 3.64 -1.59 0.05 116.57 118.49 2k73 h LYS 118 Ca -0.52 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 58.65 2k73 h LYS 118 Cb 1.96 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.77 2k73 h LYS 118 CO -0.02 0.76 0.00 -1.49 -2.27 0.00 0.00 179.45 176.43 2k73 h TRP 119 N 0.17 0.00 -2.00 1.91 4.06 0.62 -3.38 115.95 117.33 2k73 h TRP 119 Ca 0.05 0.00 -0.52 0.00 2.06 0.00 0.00 58.89 60.48 2k73 h TRP 119 Cb 0.63 0.00 -0.35 0.00 -1.00 0.00 0.00 29.16 28.44 2k73 h TRP 119 CO 0.07 0.00 -0.95 0.28 -3.56 0.00 0.00 178.44 174.28 2k73 n VAL 120 N -2.87 -0.89 0.39 1.49 0.31 -1.11 -4.95 118.33 110.71 2k73 n VAL 120 Ca 0.04 -3.28 0.12 0.00 -0.01 0.00 0.00 64.34 61.21 2k73 n VAL 120 Cb 0.45 -1.34 0.25 0.00 -0.91 0.00 0.00 33.84 32.30 2k73 n VAL 120 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2k73 h PRO 121 N 4.99 0.00 -0.33 5.55 0.13 -1.17 -3.34 132.00 137.83 2k73 h PRO 121 Ca 0.17 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.37 2k73 h PRO 121 Cb 0.93 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.99 2k73 h PRO 121 CO 0.36 0.00 -0.13 0.37 -0.23 0.00 0.00 178.00 178.37 2k73 h GLN 122 N 0.00 -0.07 -2.00 0.86 5.75 -1.92 -1.35 115.11 116.37 2k73 h GLN 122 Ca 0.00 0.00 -0.66 0.00 -0.15 0.00 0.00 58.65 57.84 2k73 h GLN 122 Cb 0.88 0.02 -0.37 0.00 1.07 0.00 0.00 27.48 29.08 2k73 h GLN 122 CO 0.00 -0.05 -0.06 0.28 -2.65 0.00 0.00 178.83 176.36 2k73 n VAL 123 N -5.31 3.54 0.00 2.39 0.31 -1.25 -4.55 118.33 113.46 2k73 n VAL 123 Ca 0.01 -5.26 0.00 0.00 -0.01 0.00 0.00 64.34 59.08 2k73 n VAL 123 Cb 0.23 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 31.79 2k73 n VAL 123 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 2k73 n PHE 124 N -0.33 -0.92 -1.68 3.52 -0.00 -1.07 -5.05 117.46 111.93 2k73 n PHE 124 Ca 0.40 0.00 -0.45 0.00 -0.00 0.00 0.00 57.45 57.40 2k73 n PHE 124 Cb 0.42 0.21 -0.04 0.00 -0.00 0.00 0.00 39.48 40.07 2k73 n PHE 124 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.76 178.31 2k73 n VAL 125 N -1.92 0.11 -3.61 -2.13 3.14 -0.53 -4.97 118.33 108.42 2k73 n VAL 125 Ca 0.00 -0.03 -0.34 0.00 -2.96 0.00 0.00 64.34 61.02 2k73 n VAL 125 Cb 0.00 -1.61 -0.05 0.00 -1.06 0.00 0.00 33.84 31.12 2k73 n VAL 125 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2k73 s ALA 126 N 0.84 3.74 -0.29 1.55 0.00 -1.26 -4.99 121.76 121.35 2k73 s ALA 126 Ca 0.77 -0.43 0.06 0.00 0.00 0.00 0.00 51.96 52.35 2k73 s ALA 126 Cb -0.65 -2.23 0.19 0.00 0.00 0.00 0.00 23.12 20.44 2k73 s ALA 126 CO 0.38 0.60 0.57 0.45 0.00 0.00 0.00 175.76 177.76 2k73 s SER 127 N -1.95 -1.39 0.00 0.00 0.15 -1.26 -4.60 113.70 104.65 2k73 s SER 127 Ca 0.35 0.10 0.00 0.00 0.70 0.00 0.00 55.95 57.10 2k73 s SER 127 Cb -0.13 1.92 0.00 0.00 -1.71 0.00 0.00 66.02 66.10 2k73 s SER 127 CO 0.20 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.94 2k73 n GLY 128 N 5.39 0.84 3.97 9.45 0.00 -1.26 -4.45 105.19 119.13 2k73 n GLY 128 Ca 0.05 -2.01 -0.21 0.00 0.00 0.00 0.00 46.02 43.84 2k73 n GLY 128 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k73 s ASP 129 N -3.38 6.29 -0.12 1.61 1.11 -1.26 -3.91 116.67 117.01 2k73 s ASP 129 Ca 0.00 0.12 -0.03 0.00 0.18 0.00 0.00 52.55 52.82 2k73 s ASP 129 Cb 0.00 -1.85 -0.03 0.00 1.07 0.00 0.00 42.92 42.11 2k73 s ASP 129 CO 0.00 -0.14 -0.02 0.00 1.18 0.00 0.00 175.17 176.19 2k73 n ALA 131 N 2.85 0.00 -2.15 0.00 0.00 -1.26 -4.80 120.51 115.15 2k73 n ALA 131 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 2k73 n ALA 131 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.95 2k73 n ALA 131 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2k73 s GLU 132 N -0.92 4.30 0.13 0.00 -1.05 -1.26 -4.94 118.70 114.96 2k73 s GLU 132 Ca 0.00 2.10 -0.31 0.00 -0.15 0.00 0.00 54.97 56.60 2k73 s GLU 132 Cb 0.00 -3.29 -0.09 0.00 -0.44 0.00 0.00 34.13 30.31 2k73 s GLU 132 CO 0.00 -0.48 1.53 -0.98 0.95 0.00 0.00 175.26 176.28 2k73 s ARG 133 N 1.32 4.24 0.00 -4.83 1.70 -1.26 -4.86 118.95 115.26 2k73 s ARG 133 Ca 0.65 2.27 0.00 0.00 -0.47 0.00 0.00 55.73 58.18 2k73 s ARG 133 Cb -0.37 -3.25 0.00 0.00 -0.57 0.00 0.00 34.95 30.76 2k73 s ARG 133 CO 0.30 -0.58 0.00 1.04 -1.08 0.00 0.00 175.30 174.98 2k73 n GLN 134 N 4.23 3.06 -3.64 3.89 6.02 -1.26 -5.09 117.38 124.59 2k73 n GLN 134 Ca 0.13 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 57.08 2k73 n GLN 134 Cb 0.40 -0.90 -0.07 0.00 1.02 0.00 0.00 30.24 30.69 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 -1.78 -0.27 0.07 1.08 -0.00 -1.26 -5.06 118.94 111.73 2k73 s TRP 135 Ca 0.00 0.62 -0.03 0.00 -0.00 0.00 0.00 56.10 56.68 2k73 s TRP 135 Cb 0.00 0.38 -0.03 0.00 -0.00 0.00 0.00 33.47 33.82 2k73 s TRP 135 CO 0.00 -0.13 0.05 0.16 -0.00 0.00 0.00 176.95 177.03 2k73 s ASP 136 N 0.36 0.36 -0.04 5.86 1.47 -1.26 -3.37 116.67 120.05 2k73 s ASP 136 Ca 0.02 -0.91 0.07 0.00 1.18 0.00 0.00 52.55 52.91 2k73 s ASP 136 Cb -0.05 0.25 -0.02 0.00 -0.34 0.00 0.00 42.92 42.77 2k73 s ASP 136 CO -0.12 -0.65 -0.24 0.12 0.68 0.00 0.00 175.17 174.97 2k73 s PHE 137 N -3.91 2.43 -0.96 2.11 5.36 0.10 -4.59 117.98 118.52 2k73 s PHE 137 Ca 0.08 -0.48 0.00 0.00 -0.96 0.00 0.00 56.93 55.56 2k73 s PHE 137 Cb 0.07 -1.56 0.00 0.00 -0.34 0.00 0.00 43.02 41.19 2k73 s PHE 137 CO -0.09 -0.06 0.00 1.28 -1.46 0.00 0.00 175.22 174.89 2k73 n LEU 138 N 2.59 -0.50 0.00 6.12 7.99 -1.26 0.11 117.00 132.05 2k73 n LEU 138 Ca -0.17 0.22 0.00 0.00 -0.01 0.00 0.00 56.01 56.06 2k73 n LEU 138 Cb 0.51 -1.83 0.00 0.00 -0.11 0.00 0.00 43.42 41.99 2k73 n LEU 138 CO 0.24 -0.63 0.00 0.61 -1.51 0.00 0.00 177.39 176.11 2k73 n GLY 139 N -0.01 0.73 3.19 -0.72 0.00 -1.26 -5.07 105.19 102.04 2k73 n GLY 139 Ca -0.09 -0.64 -0.28 0.00 0.00 0.00 0.00 46.02 45.01 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 1.98 0.47 0.99 1.02 0.31 -5.07 118.68 118.38 2k73 s LEU 140 Ca 0.00 -0.41 -0.23 0.00 0.02 0.00 0.00 54.13 53.51 2k73 s LEU 140 Cb 0.00 -1.11 -0.07 0.00 0.02 0.00 0.00 46.19 45.03 2k73 s LEU 140 CO 0.00 0.20 1.19 -1.61 0.02 0.00 0.00 176.35 176.14 2k73 s GLU 141 N -0.09 3.69 0.18 1.70 2.02 -1.26 0.02 118.70 124.96 2k73 s GLU 141 Ca -0.02 1.83 -0.19 0.00 0.02 0.00 0.00 54.97 56.60 2k73 s GLU 141 Cb -0.12 -2.39 0.11 0.00 0.10 0.00 0.00 34.13 31.83 2k73 s GLU 141 CO 0.02 -0.62 1.62 0.52 0.02 0.00 0.00 175.26 176.82 2k73 h MET 142 N 1.99 -0.14 -1.16 1.61 2.86 -1.94 0.20 114.93 118.34 2k73 h MET 142 Ca -0.49 0.01 0.36 0.00 -2.06 0.00 0.00 59.70 57.52 2k73 h MET 142 Cb 1.25 0.03 -0.12 0.00 0.06 0.00 0.00 31.60 32.82 2k73 h MET 142 CO 0.60 -0.09 0.73 -1.35 1.06 0.00 0.00 176.91 177.86 2k73 h PRO 143 N -0.14 0.21 -0.02 -0.22 0.11 -1.91 0.30 132.00 130.32 2k73 h PRO 143 Ca 0.21 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.30 2k73 h PRO 143 Cb 0.48 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.54 2k73 h PRO 143 CO -0.54 0.14 -0.03 0.37 -0.21 0.00 0.00 178.00 177.72 2k73 h GLN 144 N 0.22 0.06 0.65 1.05 -0.00 -1.33 -2.73 115.11 113.02 2k73 h GLN 144 Ca 0.74 -0.04 -0.03 0.00 -0.00 0.00 0.00 58.65 59.32 2k73 h GLN 144 Cb 2.08 0.00 0.00 0.00 0.00 0.00 0.00 27.48 29.57 2k73 h GLN 144 CO -0.44 0.59 -0.34 -1.49 0.00 0.00 0.00 178.83 177.16 2k73 h TRP 145 N -0.46 -0.87 -1.04 3.99 4.06 -0.25 -1.99 115.95 119.39 2k73 h TRP 145 Ca 0.00 -0.02 0.34 0.00 2.06 0.00 0.00 58.89 61.28 2k73 h TRP 145 Cb 0.58 0.30 -0.15 0.00 -1.00 0.00 0.00 29.16 28.89 2k73 h TRP 145 CO 0.11 -0.53 0.60 -0.07 -3.56 0.00 0.00 178.44 175.00 2k73 h LEU 146 N -0.91 0.46 -1.28 -4.49 3.38 -0.67 2.81 115.31 114.61 2k73 h LEU 146 Ca -0.09 0.19 0.06 0.00 0.09 0.00 0.00 57.88 58.13 2k73 h LEU 146 Cb 0.71 0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 2k73 h LEU 146 CO 0.13 -0.17 0.52 0.25 0.09 0.00 0.00 178.44 179.26 2k73 h LEU 147 N 0.26 0.78 -0.68 1.67 6.46 -1.04 -0.75 115.31 122.01 2k73 h LEU 147 Ca 0.75 0.00 0.02 0.00 -0.12 0.00 0.00 57.88 58.53 2k73 h LEU 147 Cb 1.84 -0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 41.57 2k73 h LEU 147 CO -0.59 0.51 0.44 1.23 -0.62 0.00 0.00 178.44 179.41 2k73 h GLY 148 N 0.89 0.97 2.00 3.75 0.00 0.53 -1.18 103.07 110.03 2k73 h GLY 148 Ca 0.33 -0.34 -0.07 0.00 0.00 0.00 0.00 47.33 47.25 2k73 h GLY 148 CO -0.11 0.31 -0.32 -2.22 0.00 0.00 0.00 176.54 174.20 2k73 h ILE 149 N 0.88 0.90 -0.50 2.60 2.04 -0.79 -2.88 117.51 119.76 2k73 h ILE 149 Ca 0.26 -1.26 -0.05 0.00 1.00 0.00 0.00 64.86 64.81 2k73 h ILE 149 Cb -0.04 1.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 2k73 h ILE 149 CO -0.08 0.32 0.11 0.15 0.00 0.00 0.00 178.15 178.64 2k73 h PHE 150 N 0.00 0.86 -0.20 1.37 3.04 0.01 -0.65 116.94 121.37 2k73 h PHE 150 Ca -0.00 -0.11 -0.00 0.00 3.98 0.00 0.00 57.97 61.84 2k73 h PHE 150 Cb 0.73 -0.24 -0.01 0.00 2.56 0.00 0.00 35.95 38.99 2k73 h PHE 150 CO 0.00 0.77 0.12 0.82 -2.02 0.00 0.00 178.31 178.00 2k73 h ILE 151 N 0.69 1.07 0.02 1.41 2.04 -1.22 0.25 117.51 121.78 2k73 h ILE 151 Ca 0.15 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2k73 h ILE 151 Cb 0.36 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2k73 h ILE 151 CO 0.00 0.07 -0.04 0.00 0.00 0.00 0.00 178.15 178.19 2k73 h ALA 152 N 1.04 -0.05 -0.54 1.87 0.00 -1.42 -0.25 119.26 119.91 2k73 h ALA 152 Ca 0.07 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2k73 h ALA 152 Cb 0.01 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2k73 h ALA 152 CO -0.01 -0.54 0.33 1.88 0.00 0.00 0.00 179.25 180.91 2k73 h TYR 153 N -0.07 0.71 -0.00 0.00 -1.99 -0.94 -1.29 116.97 113.38 2k73 h TYR 153 Ca 0.01 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 2k73 h TYR 153 Cb 0.08 -0.23 -0.00 0.00 2.00 0.00 0.00 36.73 38.58 2k73 h TYR 153 CO -0.10 0.48 -0.07 1.25 -0.00 0.00 0.00 178.16 179.73 2k73 h LEU 154 N 0.73 0.00 -0.18 3.88 6.46 -0.23 -1.99 115.31 123.98 2k73 h LEU 154 Ca 0.19 -0.00 -0.22 0.00 -0.12 0.00 0.00 57.88 57.73 2k73 h LEU 154 Cb -0.02 -0.00 0.01 0.00 -0.73 0.00 0.00 40.66 39.92 2k73 h LEU 154 CO -0.04 0.07 -0.79 0.40 -0.62 0.00 0.00 178.44 177.46 2k73 h ILE 155 N 0.00 1.29 -0.84 4.05 2.04 -0.08 -2.69 117.51 121.27 2k73 h ILE 155 Ca -0.00 -2.00 0.03 0.00 1.00 0.00 0.00 64.86 63.89 2k73 h ILE 155 Cb 0.12 2.01 -0.05 0.00 -0.74 0.00 0.00 36.82 38.16 2k73 h ILE 155 CO 0.01 0.63 0.56 0.58 0.00 0.00 0.00 178.15 179.93 2k73 h VAL 156 N 0.51 1.16 -0.07 1.67 2.07 -0.51 -1.92 116.25 119.16 2k73 h VAL 156 Ca -0.05 -0.37 -0.15 0.00 0.82 0.00 0.00 66.70 66.94 2k73 h VAL 156 Cb 1.41 -0.01 0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2k73 h VAL 156 CO 0.16 0.20 -0.55 0.00 0.02 0.00 0.00 177.57 177.39 2k73 h ALA 157 N 1.50 0.17 -0.81 1.67 0.00 -1.50 -2.12 119.26 118.17 2k73 h ALA 157 Ca 0.33 -0.53 0.03 0.00 0.00 0.00 0.00 54.91 54.74 2k73 h ALA 157 Cb -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2k73 h ALA 157 CO -0.09 0.39 0.53 0.28 0.00 0.00 0.00 179.25 180.36 2k73 h VAL 158 N 0.09 1.14 0.00 0.00 2.07 -1.18 -0.47 116.25 117.89 2k73 h VAL 158 Ca -0.05 -0.35 -0.11 0.00 0.82 0.00 0.00 66.70 67.02 2k73 h VAL 158 Cb 1.22 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2k73 h VAL 158 CO 0.11 0.18 -0.56 -0.07 0.02 0.00 0.00 177.57 177.26 2k73 h LEU 159 N 1.01 0.00 -0.20 2.57 -0.00 -1.40 -3.00 115.31 114.28 2k73 h LEU 159 Ca 0.32 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 58.09 2k73 h LEU 159 Cb 0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.66 2k73 h LEU 159 CO -0.09 0.50 -0.50 0.58 -0.00 0.00 0.00 178.44 178.93 2k73 h VAL 160 N 0.00 0.91 0.11 1.22 2.07 -0.59 -2.57 116.25 117.40 2k73 h VAL 160 Ca -0.01 -2.14 -0.21 0.00 0.82 0.00 0.00 66.70 65.16 2k73 h VAL 160 Cb 1.39 2.35 0.01 0.00 -1.52 0.00 0.00 31.29 33.52 2k73 h VAL 160 CO 0.06 0.49 -1.00 1.62 0.02 0.00 0.00 177.57 178.77 2k73 h VAL 161 N 0.00 1.31 0.00 2.57 3.04 -1.16 -3.32 116.25 118.70 2k73 h VAL 161 Ca -0.01 -2.44 -0.05 0.00 -1.01 0.00 0.00 66.70 63.19 2k73 h VAL 161 Cb 1.30 2.97 -0.01 0.00 -2.01 0.00 0.00 31.29 33.55 2k73 h VAL 161 CO 0.07 0.68 -0.23 0.40 -1.01 0.00 0.00 177.57 177.47 2k73 h ILE 162 N -0.45 1.02 0.00 3.17 1.08 -1.62 -2.15 117.51 118.56 2k73 h ILE 162 Ca -0.20 -0.83 0.00 0.00 -0.39 0.00 0.00 64.86 63.43 2k73 h ILE 162 Cb 1.61 1.47 0.00 0.00 -3.07 0.00 0.00 36.82 36.82 2k73 h ILE 162 CO 0.08 0.23 0.00 -1.54 -0.69 0.00 0.00 178.15 176.22 2k73 n SER 163 N -4.06 0.00 -3.28 1.72 3.41 -0.97 -2.66 113.62 107.78 2k73 n SER 163 Ca -0.02 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.33 2k73 n SER 163 Cb 0.30 0.00 -0.07 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 -0.93 2.27 0.00 4.33 1.13 -0.81 -4.91 117.38 118.46 2k73 n GLN 164 Ca 0.00 -4.39 0.00 0.00 -1.94 0.00 0.00 57.00 50.67 2k73 n GLN 164 Cb 0.00 -2.05 0.00 0.00 0.11 0.00 0.00 30.24 28.30 2k73 n GLN 164 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2k73 n PRO 165 N 0.72 0.58 0.00 -1.09 -0.04 -1.09 -4.39 135.00 129.70 2k73 n PRO 165 Ca 0.28 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 2k73 n PRO 165 Cb 0.44 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 2k73 n PRO 165 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2k73 n PHE 166 N 0.11 0.00 0.00 0.54 7.35 -1.26 -4.91 117.46 119.29 2k73 n PHE 166 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2k73 n PHE 166 Cb 0.13 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.96 2k73 n PHE 166 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 2k73 n LYS 167 N 0.00 0.00 0.00 -4.13 4.76 -1.26 -4.82 118.16 112.71 2k73 n LYS 167 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2k73 n LYS 167 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2k73 n LYS 167 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2k73 n ALA 168 N 9.68 0.00 -3.64 7.82 0.00 -1.26 -5.14 120.51 127.96 2k73 n ALA 168 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2k73 n ALA 168 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 2k73 n ALA 168 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2k73 s LYS 169 N -0.82 0.71 -0.11 0.00 -2.85 -1.26 -5.07 119.74 110.34 2k73 s LYS 169 Ca 0.00 1.10 -0.04 0.00 -1.00 0.00 0.00 55.97 56.02 2k73 s LYS 169 Cb 0.00 0.21 -0.05 0.00 -2.06 0.00 0.00 37.83 35.93 2k73 s LYS 169 CO 0.00 -0.13 -0.14 1.63 0.10 0.00 0.00 175.35 176.82 2k73 n LYS 170 N 3.73 0.25 -1.54 1.78 5.02 -1.26 -5.14 118.16 121.00 2k73 n LYS 170 Ca -0.18 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 2k73 n LYS 170 Cb 0.58 -0.97 0.00 0.00 -0.02 0.00 0.00 35.03 34.62 2k73 n LYS 170 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2k73 n ARG 171 N -3.38 -4.42 -2.95 1.97 0.63 -1.26 -5.00 116.66 102.25 2k73 n ARG 171 Ca -0.22 3.28 -0.18 0.00 -0.92 0.00 0.00 57.85 59.82 2k73 n ARG 171 Cb 0.67 -3.68 0.02 0.00 0.45 0.00 0.00 32.46 29.91 2k73 n ARG 171 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 2k73 s ASP 172 N -3.19 5.55 1.17 6.15 -4.77 -1.26 -5.11 116.67 115.20 2k73 s ASP 172 Ca 0.00 -0.38 -0.11 0.00 -3.30 0.00 0.00 52.55 48.76 2k73 s ASP 172 Cb 0.00 -0.62 0.16 0.00 -1.09 0.00 0.00 42.92 41.37 2k73 s ASP 172 CO 0.00 -0.87 0.49 0.18 0.70 0.00 0.00 175.17 175.67 2k73 n LEU 173 N -1.96 0.00 -4.63 2.11 4.32 -1.26 -4.77 117.00 110.81 2k73 n LEU 173 Ca 0.09 -0.51 -0.64 0.00 -0.02 0.00 0.00 56.01 54.92 2k73 n LEU 173 Cb 0.59 -0.49 -0.10 0.00 -1.62 0.00 0.00 43.42 41.81 2k73 n LEU 173 CO 0.40 -1.79 1.32 0.49 -1.22 0.00 0.00 177.39 176.59 2k73 n PHE 174 N -3.93 1.68 0.07 -1.77 3.01 -1.26 -4.77 117.46 110.49 2k73 n PHE 174 Ca 0.07 0.94 0.00 0.00 1.01 0.00 0.00 57.45 59.47 2k73 n PHE 174 Cb 0.29 -2.29 0.00 0.00 -0.01 0.00 0.00 39.48 37.47 2k73 n PHE 174 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2k73 n GLY 175 N 4.83 -0.14 7.00 1.37 0.00 -1.26 -5.13 105.19 111.87 2k73 n GLY 175 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.37 2k73 n GLY 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k73 n ARG 176 N -3.18 0.00 0.00 1.61 5.12 -1.26 -5.00 116.66 113.95 2k73 n ARG 176 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2k73 n ARG 176 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2k73 n ARG 176 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2k73 n GLY 177 N 0.00 3.18 4.00 -0.13 0.00 -1.26 -5.18 105.19 105.80 2k73 n GLY 177 Ca 0.00 -0.51 -0.21 0.00 0.00 0.00 0.00 46.02 45.31 2k73 n GLY 177 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2k73 s HIS 178 N -1.38 1.69 -0.81 1.61 2.46 -1.26 -5.04 115.29 112.56 2k73 s HIS 178 Ca 0.00 -0.69 -0.23 0.00 0.47 0.00 0.00 55.06 54.61 2k73 s HIS 178 Cb 0.00 -2.18 0.07 0.00 -0.13 0.00 0.00 32.58 30.34 2k73 s HIS 178 CO 0.00 -0.89 1.17 -1.01 -2.47 0.00 0.00 174.74 171.55 2k73 s HIS 179 N -2.64 2.64 0.00 3.88 0.09 -1.26 -4.73 115.29 113.28 2k73 s HIS 179 Ca 0.55 -0.66 0.00 0.00 -0.00 0.00 0.00 55.06 54.95 2k73 s HIS 179 Cb -0.05 -4.46 0.00 0.00 -0.00 0.00 0.00 32.58 28.07 2k73 s HIS 179 CO 0.34 -1.78 0.00 0.72 -0.00 0.00 0.00 174.74 174.02 2k73 n HIS 180 N 8.12 0.00 -2.25 1.40 8.25 -1.26 -4.59 115.22 124.89 2k73 n HIS 180 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2k73 n HIS 180 Cb 0.48 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.59 2k73 n HIS 180 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2k73 n HIS 181 N 0.00 0.00 -2.87 4.41 1.44 -1.26 -5.16 115.22 111.78 2k73 n HIS 181 Ca 0.00 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.39 2k73 n HIS 181 Cb 0.00 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.05 2k73 n HIS 181 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2k73 s HIS 182 N -2.31 3.38 -0.56 -1.40 2.46 -1.26 -5.02 115.29 110.58 2k73 s HIS 182 Ca 0.00 1.37 0.00 0.00 0.47 0.00 0.00 55.06 56.90 2k73 s HIS 182 Cb 0.00 -2.67 0.00 0.00 -0.13 0.00 0.00 32.58 29.78 2k73 s HIS 182 CO 0.00 -0.08 0.14 1.58 -2.47 0.00 0.00 174.74 173.91