#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k74 h LEU 2 N 0.00 0.29 -0.72 -0.89 -0.00 -2.06 -2.85 115.31 109.08 2k74 h LEU 2 Ca 0.00 -0.75 0.15 0.00 -0.00 0.00 0.00 57.88 57.27 2k74 h LEU 2 Cb 0.00 -0.09 -0.10 0.00 -0.00 0.00 0.00 40.66 40.47 2k74 h LEU 2 CO 0.00 1.00 0.19 0.03 -0.00 0.00 0.00 178.44 179.66 2k74 h ARG 3 N -0.40 0.29 -0.52 1.13 2.47 -2.02 0.44 114.38 115.76 2k74 h ARG 3 Ca -0.04 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.64 2k74 h ARG 3 Cb 1.04 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 29.27 2k74 h ARG 3 CO 0.06 0.19 0.22 0.74 0.56 0.00 0.00 179.97 181.74 2k74 h PHE 4 N 0.30 0.79 -0.91 3.04 -1.00 -2.00 -2.56 116.94 114.60 2k74 h PHE 4 Ca 0.40 -0.05 0.22 0.00 2.81 0.00 0.00 57.97 61.35 2k74 h PHE 4 Cb 0.65 -0.24 -0.12 0.00 3.61 0.00 0.00 35.95 39.85 2k74 h PHE 4 CO -0.24 0.64 0.42 1.25 -1.61 0.00 0.00 178.31 178.77 2k74 h LEU 5 N 0.70 0.37 -1.45 1.54 6.46 -0.67 1.50 115.31 123.76 2k74 h LEU 5 Ca 0.18 0.15 -0.04 0.00 -0.12 0.00 0.00 57.88 58.05 2k74 h LEU 5 Cb 0.18 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.23 2k74 h LEU 5 CO -0.02 0.01 -0.18 -1.13 -0.62 0.00 0.00 178.44 176.50 2k74 h ASN 6 N 0.42 0.00 0.02 1.25 -0.00 -1.03 -1.71 115.58 114.54 2k74 h ASN 6 Ca 0.57 0.00 -0.06 0.00 -0.00 0.00 0.00 56.30 56.82 2k74 h ASN 6 Cb 1.08 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 39.41 2k74 h ASN 6 CO -0.52 0.18 -0.23 -0.61 -0.00 0.00 0.00 177.43 176.24 2k74 h GLN 7 N 0.00 0.11 -0.59 6.67 4.15 0.22 -0.71 115.11 124.95 2k74 h GLN 7 Ca -0.00 -0.15 -0.05 0.00 0.77 0.00 0.00 58.65 59.22 2k74 h GLN 7 Cb 0.58 0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.29 2k74 h GLN 7 CO 0.02 0.99 0.18 0.00 -1.93 0.00 0.00 178.83 178.09 2k74 h ALA 8 N 0.13 1.19 0.04 3.38 0.00 -0.61 -2.81 119.26 120.58 2k74 h ALA 8 Ca -0.04 -0.20 -0.25 0.00 0.00 0.00 0.00 54.91 54.42 2k74 h ALA 8 Cb 1.09 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.65 2k74 h ALA 8 CO 0.04 0.56 -1.06 0.77 0.00 0.00 0.00 179.25 179.57 2k74 h SER 9 N 0.87 0.67 0.00 0.00 0.02 -1.41 -3.03 113.55 110.67 2k74 h SER 9 Ca 0.20 -0.57 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 2k74 h SER 9 Cb 0.27 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.60 2k74 h SER 9 CO -0.01 1.38 0.00 1.67 -1.14 0.00 0.00 176.83 178.73 2k74 n GLN 10 N -3.75 0.31 -3.87 3.45 7.27 -0.27 -4.62 117.38 115.90 2k74 n GLN 10 Ca -0.09 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.67 2k74 n GLN 10 Cb 0.89 -1.41 -0.04 0.00 2.41 0.00 0.00 30.24 32.10 2k74 n GLN 10 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 2k74 s GLY 11 N -1.94 2.20 -0.02 1.69 0.00 -1.14 -4.84 107.32 103.27 2k74 s GLY 11 Ca 0.12 -0.78 -0.25 0.00 0.00 0.00 0.00 44.72 43.82 2k74 s GLY 11 CO 0.09 -0.73 1.23 3.21 0.00 0.00 0.00 173.10 176.90 2k74 h ARG 12 N 3.12 0.09 -0.92 2.90 3.08 -1.87 -2.99 114.38 117.79 2k74 h ARG 12 Ca -0.46 -0.05 0.25 0.00 0.07 0.00 0.00 59.98 59.80 2k74 h ARG 12 Cb 1.16 0.01 -0.16 0.00 0.08 0.00 0.00 29.97 31.06 2k74 h ARG 12 CO 0.74 0.61 0.12 0.78 -1.07 0.00 0.00 179.97 181.16 2k74 h GLY 13 N -0.42 1.29 0.91 0.04 0.00 -1.95 0.67 103.07 103.61 2k74 h GLY 13 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 2k74 h GLY 13 CO 0.01 -0.46 0.10 0.00 0.00 0.00 0.00 176.54 176.19 2k74 h ALA 14 N 1.88 0.28 -0.31 3.60 0.00 -1.76 -0.84 119.26 122.12 2k74 h ALA 14 Ca 0.57 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.40 2k74 h ALA 14 Cb 1.19 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2k74 h ALA 14 CO -0.79 -0.14 0.18 -1.49 0.00 0.00 0.00 179.25 177.01 2k74 h TRP 15 N 0.21 0.35 -0.06 0.00 4.06 0.24 -0.26 115.95 120.49 2k74 h TRP 15 Ca 0.07 0.01 0.02 0.00 2.06 0.00 0.00 58.89 61.05 2k74 h TRP 15 Cb 0.15 -0.11 -0.00 0.00 -1.00 0.00 0.00 29.16 28.19 2k74 h TRP 15 CO -0.02 0.21 0.05 -0.07 -3.56 0.00 0.00 178.44 175.05 2k74 h LEU 16 N 0.38 0.00 -1.01 -4.49 -0.00 -0.02 0.93 115.31 111.09 2k74 h LEU 16 Ca 0.12 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.91 2k74 h LEU 16 Cb -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.63 2k74 h LEU 16 CO -0.05 0.00 -0.42 0.25 -0.00 0.00 0.00 178.44 178.22 2k74 h LEU 17 N 0.00 0.00 -0.37 1.67 5.85 0.43 -2.58 115.31 120.32 2k74 h LEU 17 Ca 0.03 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.56 2k74 h LEU 17 Cb 0.13 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2k74 h LEU 17 CO -0.00 0.42 -0.78 0.24 -0.34 0.00 0.00 178.44 177.98 2k74 h MET 18 N 0.00 0.34 0.21 1.25 2.86 -0.20 -2.79 114.93 116.61 2k74 h MET 18 Ca -0.00 -0.31 -0.01 0.00 -2.06 0.00 0.00 59.70 57.32 2k74 h MET 18 Cb 0.87 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.60 2k74 h MET 18 CO 0.05 0.97 -0.10 0.00 1.06 0.00 0.00 176.91 178.89 2k74 h ALA 19 N 0.94 -0.29 -0.16 6.32 0.00 -1.27 -2.99 119.26 121.82 2k74 h ALA 19 Ca -0.04 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.72 2k74 h ALA 19 Cb 1.37 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 19.21 2k74 h ALA 19 CO 0.13 -0.45 -0.20 0.35 0.00 0.00 0.00 179.25 179.08 2k74 h PHE 20 N -0.71 -0.54 -0.66 0.00 3.57 -1.55 -1.92 116.94 115.13 2k74 h PHE 20 Ca -0.03 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.61 2k74 h PHE 20 Cb 0.49 0.26 -0.12 0.00 2.79 0.00 0.00 35.95 39.37 2k74 h PHE 20 CO 0.05 -0.28 -0.35 1.79 -2.23 0.00 0.00 178.31 177.29 2k74 h THR 21 N -0.24 0.14 0.00 4.41 1.35 -1.55 1.43 112.91 118.45 2k74 h THR 21 Ca 0.11 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.97 2k74 h THR 21 Cb 0.41 0.14 -0.00 0.00 -1.73 0.00 0.00 68.15 66.97 2k74 h THR 21 CO -0.30 0.00 -0.00 0.00 -0.25 0.00 0.00 175.52 174.96 2k74 h ALA 22 N 1.06 1.22 0.16 6.62 0.00 -1.25 -2.07 119.26 125.00 2k74 h ALA 22 Ca 0.25 -0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.83 2k74 h ALA 22 Cb 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2k74 h ALA 22 CO -0.73 0.00 -1.64 1.25 0.00 0.00 0.00 179.25 178.13 2k74 h LEU 23 N 0.00 0.54 -1.01 0.00 5.85 0.23 -3.26 115.31 117.66 2k74 h LEU 23 Ca -0.00 -0.91 0.15 0.00 0.84 0.00 0.00 57.88 57.95 2k74 h LEU 23 Cb 0.02 -0.17 -0.09 0.00 0.37 0.00 0.00 40.66 40.78 2k74 h LEU 23 CO 0.00 1.74 0.63 0.00 -0.34 0.00 0.00 178.44 180.46 2k74 h ALA 24 N 0.06 1.59 0.00 1.25 0.00 0.96 0.12 119.26 123.24 2k74 h ALA 24 Ca -0.33 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.51 2k74 h ALA 24 Cb 1.98 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 2k74 h ALA 24 CO 0.14 0.12 -0.51 -0.07 0.00 0.00 0.00 179.25 178.92 2k74 h LEU 25 N 0.90 0.00 -0.76 0.00 -0.00 -1.65 -1.97 115.31 111.83 2k74 h LEU 25 Ca 0.53 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 58.33 2k74 h LEU 25 Cb 0.65 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.29 2k74 h LEU 25 CO -0.31 0.51 0.04 -0.08 -0.00 0.00 0.00 178.44 178.60 2k74 h GLU 26 N 0.00 0.98 0.18 1.13 4.81 -0.81 -2.89 114.58 117.97 2k74 h GLU 26 Ca -0.01 -0.27 -0.28 0.00 -0.13 0.00 0.00 59.36 58.67 2k74 h GLU 26 Cb 1.05 -0.11 0.03 0.00 0.63 0.00 0.00 28.75 30.35 2k74 h GLU 26 CO 0.07 0.94 -1.20 -0.07 -0.73 0.00 0.00 179.01 178.01 2k74 h LEU 27 N 0.91 0.75 -0.87 1.64 3.38 -1.35 -2.67 115.31 117.10 2k74 h LEU 27 Ca 0.17 -0.89 0.21 0.00 0.09 0.00 0.00 57.88 57.46 2k74 h LEU 27 Cb 0.48 -0.24 -0.12 0.00 0.09 0.00 0.00 40.66 40.86 2k74 h LEU 27 CO 0.02 1.58 0.35 0.74 0.09 0.00 0.00 178.44 181.22 2k74 h THR 28 N 0.04 0.47 0.05 0.22 2.02 -1.29 0.57 112.91 115.00 2k74 h THR 28 Ca -0.20 -0.13 -0.25 0.00 0.77 0.00 0.00 66.41 66.60 2k74 h THR 28 Cb 1.93 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 2k74 h THR 28 CO 0.23 0.07 -1.21 0.00 0.37 0.00 0.00 175.52 174.98 2k74 h ALA 29 N 1.70 0.30 -0.04 6.16 0.00 -1.60 -3.23 119.26 122.55 2k74 h ALA 29 Ca 0.53 -0.98 0.01 0.00 0.00 0.00 0.00 54.91 54.48 2k74 h ALA 29 Cb 1.00 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 2k74 h ALA 29 CO -0.53 1.18 0.16 1.25 0.00 0.00 0.00 179.25 181.30 2k74 h LEU 30 N 0.03 0.00 0.11 0.00 5.85 -0.53 -1.14 115.31 119.63 2k74 h LEU 30 Ca -0.10 0.00 -0.36 0.00 0.84 0.00 0.00 57.88 58.26 2k74 h LEU 30 Cb 1.89 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.90 2k74 h LEU 30 CO 0.15 0.00 -1.97 1.87 -0.34 0.00 0.00 178.44 178.16 2k74 n TRP 31 N -3.19 1.25 -0.25 1.25 -0.00 -0.85 -3.76 117.44 111.88 2k74 n TRP 31 Ca -0.02 0.28 0.06 0.00 -0.00 0.00 0.00 57.50 57.82 2k74 n TRP 31 Cb 0.23 -1.17 0.19 0.00 -0.00 0.00 0.00 31.31 30.56 2k74 n TRP 31 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 177.69 178.43 2k74 h PHE 32 N 0.07 0.30 0.00 5.87 -1.00 -1.22 0.47 116.94 121.42 2k74 h PHE 32 Ca -0.41 0.04 -0.06 0.00 2.81 0.00 0.00 57.97 60.35 2k74 h PHE 32 Cb 2.03 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 41.57 2k74 h PHE 32 CO 0.07 -0.08 -0.30 -0.56 -1.61 0.00 0.00 178.31 175.83 2k74 h GLN 33 N 0.28 0.00 0.00 1.51 3.07 -1.69 0.41 115.11 118.69 2k74 h GLN 33 Ca 0.43 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 59.14 2k74 h GLN 33 Cb 0.74 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.29 2k74 h GLN 33 CO -0.52 0.30 -0.11 0.45 0.09 0.00 0.00 178.83 179.04 2k74 h HIS 34 N 0.00 0.00 0.00 0.06 3.86 -0.24 -0.92 115.15 117.91 2k74 h HIS 34 Ca -0.00 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 58.96 2k74 h HIS 34 Cb 0.79 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.22 2k74 h HIS 34 CO 0.00 0.11 -1.94 1.55 0.86 0.00 0.00 177.93 178.51 2k74 n VAL 35 N -3.14 0.95 0.33 2.45 3.14 -0.20 -4.56 118.33 117.29 2k74 n VAL 35 Ca 0.03 -0.39 0.12 0.00 -2.96 0.00 0.00 64.34 61.14 2k74 n VAL 35 Cb 0.53 -1.03 0.24 0.00 -1.06 0.00 0.00 33.84 32.52 2k74 n VAL 35 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 2k74 n MET 36 N -2.92 2.46 -4.10 1.45 2.81 0.14 -4.95 117.12 112.00 2k74 n MET 36 Ca -0.28 -2.21 -0.31 0.00 -1.81 0.00 0.00 57.70 53.09 2k74 n MET 36 Cb 0.83 -1.51 -0.03 0.00 -0.71 0.00 0.00 33.22 31.80 2k74 n MET 36 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2k74 n LEU 37 N 1.40 -1.92 -4.84 4.03 7.99 -0.36 -4.91 117.00 118.39 2k74 n LEU 37 Ca 0.20 -1.02 -0.32 0.00 -0.01 0.00 0.00 56.01 54.86 2k74 n LEU 37 Cb 0.58 -2.13 -0.04 0.00 -0.11 0.00 0.00 43.42 41.71 2k74 n LEU 37 CO 0.16 0.37 0.67 -0.76 -1.51 0.00 0.00 177.39 176.32 2k74 s LEU 38 N -7.15 3.71 -0.12 2.23 1.43 -1.19 -5.03 118.68 112.56 2k74 s LEU 38 Ca 0.37 1.60 0.03 0.00 -1.03 0.00 0.00 54.13 55.10 2k74 s LEU 38 Cb -0.20 -4.52 0.01 0.00 0.03 0.00 0.00 46.19 41.51 2k74 s LEU 38 CO 0.91 -0.53 -0.21 -0.54 0.23 0.00 0.00 176.35 176.21 2k74 s LYS 39 N -3.83 2.85 0.53 1.70 1.02 -1.26 -4.76 119.74 115.98 2k74 s LYS 39 Ca 0.60 -0.80 -0.17 0.00 0.02 0.00 0.00 55.97 55.62 2k74 s LYS 39 Cb -0.10 -2.26 -0.07 0.00 -0.52 0.00 0.00 37.83 34.89 2k74 s LYS 39 CO 0.26 0.04 1.02 -1.25 -0.92 0.00 0.00 175.35 174.50 2k74 s PRO 40 N 0.69 3.71 0.29 -1.68 0.04 -1.25 -4.76 135.00 132.02 2k74 s PRO 40 Ca -0.11 1.13 0.05 0.00 0.04 0.00 0.00 61.00 62.11 2k74 s PRO 40 Cb -0.16 -2.09 0.05 0.00 0.04 0.00 0.00 34.50 32.33 2k74 s PRO 40 CO 0.02 -0.49 0.39 0.00 0.04 0.00 0.00 177.00 176.97 2k74 h VAL 42 N 0.06 1.26 -0.09 0.00 2.07 -1.88 -2.79 116.25 114.87 2k74 h VAL 42 Ca -0.13 -1.06 -0.20 0.00 0.82 0.00 0.00 66.70 66.13 2k74 h VAL 42 Cb 0.62 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2k74 h VAL 42 CO 0.19 0.38 -0.76 -0.07 0.02 0.00 0.00 177.57 177.33 2k74 h LEU 43 N 0.78 0.62 -0.32 2.57 -0.00 -1.95 -2.80 115.31 114.20 2k74 h LEU 43 Ca 0.15 -0.41 0.03 0.00 -0.00 0.00 0.00 57.88 57.65 2k74 h LEU 43 Cb 0.50 -0.18 -0.03 0.00 -0.00 0.00 0.00 40.66 40.94 2k74 h LEU 43 CO 0.02 1.17 0.13 -1.28 -0.00 0.00 0.00 178.44 178.48 2k74 h SER 44 N 0.35 0.16 -0.25 -0.43 0.87 -1.92 -1.49 113.55 110.84 2k74 h SER 44 Ca -0.04 0.03 -0.09 0.00 -1.23 0.00 0.00 61.79 60.45 2k74 h SER 44 Cb 1.36 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.30 2k74 h SER 44 CO 0.14 0.13 -0.16 0.16 -0.53 0.00 0.00 176.83 176.57 2k74 h ILE 45 N 0.28 1.26 -0.38 2.23 3.07 -1.54 -2.74 117.51 119.69 2k74 h ILE 45 Ca 0.14 -1.19 0.06 0.00 1.55 0.00 0.00 64.86 65.41 2k74 h ILE 45 Cb 0.09 1.14 -0.05 0.00 -0.27 0.00 0.00 36.82 37.73 2k74 h ILE 45 CO -0.13 0.40 0.06 0.22 -1.05 0.00 0.00 178.15 177.65 2k74 h TYR 46 N 0.61 0.09 -0.69 0.16 5.03 -1.09 0.11 116.97 121.19 2k74 h TYR 46 Ca 0.10 0.02 0.05 0.00 2.58 0.00 0.00 58.73 61.48 2k74 h TYR 46 Cb 0.61 0.02 -0.04 0.00 1.55 0.00 0.00 36.73 38.87 2k74 h TYR 46 CO 0.03 -0.01 0.45 0.93 -1.32 0.00 0.00 178.16 178.25 2k74 h GLU 47 N 0.18 0.75 -0.67 1.82 3.07 -1.04 -0.59 114.58 118.09 2k74 h GLU 47 Ca 0.18 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.99 2k74 h GLU 47 Cb 0.22 -0.17 -0.03 0.00 -0.84 0.00 0.00 28.75 27.93 2k74 h GLU 47 CO -0.25 0.49 0.40 -0.09 -1.40 0.00 0.00 179.01 178.16 2k74 h ARG 48 N 0.77 0.91 -0.44 2.33 2.43 -0.72 -1.91 114.38 117.75 2k74 h ARG 48 Ca 0.28 -0.08 -0.11 0.00 -0.81 0.00 0.00 59.98 59.27 2k74 h ARG 48 Cb 0.16 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 2k74 h ARG 48 CO -0.09 0.64 -0.15 0.00 -1.51 0.00 0.00 179.97 178.87 2k74 h ALA 49 N 1.51 0.90 -0.25 2.80 0.00 -0.39 0.53 119.26 124.37 2k74 h ALA 49 Ca 0.24 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.82 2k74 h ALA 49 Cb -0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2k74 h ALA 49 CO -0.04 0.63 0.13 0.00 0.00 0.00 0.00 179.25 179.96 2k74 h ALA 50 N 1.09 0.31 0.00 0.00 0.00 -0.93 0.30 119.26 120.02 2k74 h ALA 50 Ca 0.11 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2k74 h ALA 50 Cb 0.66 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2k74 h ALA 50 CO 0.05 -0.27 -0.04 1.25 0.00 0.00 0.00 179.25 180.24 2k74 h LEU 51 N 0.27 0.03 -0.89 0.00 5.85 -1.36 -2.86 115.31 116.35 2k74 h LEU 51 Ca 0.10 -0.88 0.23 0.00 0.84 0.00 0.00 57.88 58.17 2k74 h LEU 51 Cb 0.02 -0.01 -0.13 0.00 0.37 0.00 0.00 40.66 40.91 2k74 h LEU 51 CO -0.07 0.91 0.33 0.15 -0.34 0.00 0.00 178.44 179.42 2k74 h PHE 52 N -0.85 0.53 -0.34 1.25 3.57 0.10 0.38 116.94 121.57 2k74 h PHE 52 Ca -0.01 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 2k74 h PHE 52 Cb 0.92 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 2k74 h PHE 52 CO 0.24 -0.13 0.10 0.78 -2.23 0.00 0.00 178.31 177.06 2k74 h GLY 53 N 0.30 0.57 0.83 2.40 0.00 -0.99 -2.77 103.07 103.42 2k74 h GLY 53 Ca 0.57 -0.34 0.03 0.00 0.00 0.00 0.00 47.33 47.58 2k74 h GLY 53 CO -0.59 0.32 0.20 -2.08 0.00 0.00 0.00 176.54 174.39 2k74 h VAL 54 N 0.40 0.99 -0.88 4.60 2.07 -0.18 -1.28 116.25 121.97 2k74 h VAL 54 Ca 0.11 -0.14 0.22 0.00 0.82 0.00 0.00 66.70 67.70 2k74 h VAL 54 Cb 0.26 0.54 -0.12 0.00 -1.52 0.00 0.00 31.29 30.45 2k74 h VAL 54 CO -0.00 0.08 0.37 0.25 0.02 0.00 0.00 177.57 178.29 2k74 h LEU 55 N 0.41 0.30 -1.73 2.57 5.85 -0.42 1.84 115.31 124.13 2k74 h LEU 55 Ca 0.16 0.15 -0.03 0.00 0.84 0.00 0.00 57.88 59.01 2k74 h LEU 55 Cb 0.06 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 2k74 h LEU 55 CO -0.10 -0.01 -0.14 1.23 -0.34 0.00 0.00 178.44 179.08 2k74 h GLY 56 N 0.39 0.00 1.84 3.75 0.00 -0.98 -2.02 103.07 106.04 2k74 h GLY 56 Ca 0.55 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.69 2k74 h GLY 56 CO -0.53 0.00 -0.85 0.00 0.00 0.00 0.00 176.54 175.16 2k74 h ALA 57 N 1.86 0.58 0.00 3.60 0.00 0.34 -2.28 119.26 123.35 2k74 h ALA 57 Ca -0.00 -0.72 -0.07 0.00 0.00 0.00 0.00 54.91 54.13 2k74 h ALA 57 Cb 0.44 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2k74 h ALA 57 CO 0.02 0.93 -0.32 0.00 0.00 0.00 0.00 179.25 179.88 2k74 h ALA 58 N 1.04 0.80 0.18 0.00 0.00 -0.48 -0.29 119.26 120.51 2k74 h ALA 58 Ca -0.03 -0.28 -0.26 0.00 0.00 0.00 0.00 54.91 54.34 2k74 h ALA 58 Cb 1.46 -0.05 0.03 0.00 0.00 0.00 0.00 17.79 19.24 2k74 h ALA 58 CO 0.12 0.39 -1.12 1.25 0.00 0.00 0.00 179.25 179.89 2k74 h LEU 59 N 0.00 0.67 0.16 0.00 5.85 -1.33 -2.34 115.31 118.31 2k74 h LEU 59 Ca -0.00 -0.92 -0.30 0.00 0.84 0.00 0.00 57.88 57.50 2k74 h LEU 59 Cb 1.24 -0.22 0.02 0.00 0.37 0.00 0.00 40.66 42.07 2k74 h LEU 59 CO 0.04 1.54 -1.31 0.16 -0.34 0.00 0.00 178.44 178.53 2k74 h ILE 60 N -0.09 1.41 -0.15 4.05 -0.00 -1.48 -3.30 117.51 117.96 2k74 h ILE 60 Ca -0.19 -2.89 -0.12 0.00 -0.00 0.00 0.00 64.86 61.66 2k74 h ILE 60 Cb 1.87 2.95 -0.01 0.00 -0.00 0.00 0.00 36.82 41.63 2k74 h ILE 60 CO 0.21 0.85 -0.45 1.23 -0.00 0.00 0.00 178.15 180.00 2k74 h GLY 61 N 1.03 0.38 0.40 0.16 0.00 -1.17 -2.60 103.07 101.27 2k74 h GLY 61 Ca -0.18 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.76 2k74 h GLY 61 CO 0.23 0.35 0.00 0.00 0.00 0.00 0.00 176.54 177.12 2k74 n ALA 62 N -2.48 1.78 0.13 3.60 0.00 -0.88 -1.88 120.51 120.78 2k74 n ALA 62 Ca -0.02 -0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.42 2k74 n ALA 62 Cb 0.52 -1.05 0.02 0.00 0.00 0.00 0.00 19.45 18.94 2k74 n ALA 62 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2k74 h ILE 63 N 0.00 0.95 0.00 0.00 2.04 -1.62 -3.43 117.51 115.44 2k74 h ILE 63 Ca 0.00 -2.31 0.00 0.00 1.00 0.00 0.00 64.86 63.55 2k74 h ILE 63 Cb 0.00 2.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.53 2k74 h ILE 63 CO 0.00 0.53 0.00 0.00 0.00 0.00 0.00 178.15 178.68 2k74 n ALA 64 N -2.24 0.00 1.31 1.87 0.00 -0.79 -5.01 120.51 115.65 2k74 n ALA 64 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2k74 n ALA 64 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.20 2k74 n ALA 64 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2k74 n PRO 65 N 0.00 0.84 0.00 0.00 -0.04 -1.10 -2.68 135.00 132.02 2k74 n PRO 65 Ca 0.00 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.54 2k74 n PRO 65 Cb 0.00 -1.19 -0.08 0.00 -0.04 0.00 0.00 33.50 32.20 2k74 n PRO 65 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2k74 n LYS 66 N -0.24 1.33 -4.13 0.54 2.85 -1.26 -4.76 118.16 112.48 2k74 n LYS 66 Ca 0.00 -0.20 -0.23 0.00 -1.05 0.00 0.00 58.31 56.84 2k74 n LYS 66 Cb 0.09 -1.32 -0.06 0.00 -0.65 0.00 0.00 35.03 33.09 2k74 n LYS 66 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 2k74 s THR 67 N -2.52 3.50 0.08 0.58 -4.23 -1.09 -4.95 115.64 107.01 2k74 s THR 67 Ca 0.08 -1.67 0.01 0.00 -1.18 0.00 0.00 61.69 58.94 2k74 s THR 67 Cb 0.13 -3.04 0.01 0.00 1.34 0.00 0.00 72.50 70.94 2k74 s THR 67 CO 0.66 -0.28 0.69 -2.65 -0.54 0.00 0.00 174.62 172.50 2k74 n PRO 68 N -1.10 0.01 -0.17 3.99 -0.02 -1.26 -1.32 135.00 135.12 2k74 n PRO 68 Ca -0.05 0.26 0.29 0.00 -2.02 0.00 0.00 63.50 61.98 2k74 n PRO 68 Cb 0.60 -2.10 0.73 0.00 -0.02 0.00 0.00 33.50 32.71 2k74 n PRO 68 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2k74 h LEU 69 N 0.00 0.00 -0.90 2.45 4.07 -1.93 -2.43 115.31 116.58 2k74 h LEU 69 Ca 0.00 0.00 0.10 0.00 0.08 0.00 0.00 57.88 58.06 2k74 h LEU 69 Cb 1.12 0.00 -0.12 0.00 1.08 0.00 0.00 40.66 42.73 2k74 h LEU 69 CO 0.00 0.00 -0.46 -2.11 -1.08 0.00 0.00 178.44 174.79 2k74 n ARG 70 N -4.14 -0.33 -0.23 1.13 1.85 -0.44 0.27 116.66 114.77 2k74 n ARG 70 Ca 0.19 1.36 0.18 0.00 -1.00 0.00 0.00 57.85 58.57 2k74 n ARG 70 Cb 1.00 -2.01 0.50 0.00 -1.05 0.00 0.00 32.46 30.89 2k74 n ARG 70 CO 0.00 0.00 0.00 -0.92 -0.01 0.00 0.00 177.63 176.70 2k74 h TYR 71 N 0.00 0.56 -0.40 2.89 5.03 -1.73 0.27 116.97 123.59 2k74 h TYR 71 Ca 0.20 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.50 2k74 h TYR 71 Cb 0.43 -0.17 -0.02 0.00 1.55 0.00 0.00 36.73 38.52 2k74 h TYR 71 CO -0.87 0.17 0.12 0.28 -1.32 0.00 0.00 178.16 176.54 2k74 h VAL 72 N 0.44 1.22 0.07 1.81 2.07 0.35 -2.18 116.25 120.03 2k74 h VAL 72 Ca 0.45 -0.71 -0.24 0.00 0.82 0.00 0.00 66.70 67.01 2k74 h VAL 72 Cb 1.05 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2k74 h VAL 72 CO -0.17 0.25 -1.09 0.00 0.02 0.00 0.00 177.57 176.58 2k74 h ALA 73 N 0.97 0.26 0.00 1.67 0.00 -0.46 -3.14 119.26 118.57 2k74 h ALA 73 Ca 0.13 -0.83 -0.00 0.00 0.00 0.00 0.00 54.91 54.21 2k74 h ALA 73 Cb 0.26 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2k74 h ALA 73 CO -0.00 0.98 -0.00 0.52 0.00 0.00 0.00 179.25 180.74 2k74 h MET 74 N 0.09 0.00 -0.99 0.00 2.07 -0.41 -2.26 114.93 113.43 2k74 h MET 74 Ca -0.09 0.00 0.18 0.00 -2.07 0.00 0.00 59.70 57.72 2k74 h MET 74 Cb 1.79 0.00 -0.10 0.00 -1.87 0.00 0.00 31.60 31.42 2k74 h MET 74 CO 0.17 0.00 0.61 0.28 1.07 0.00 0.00 176.91 179.05 2k74 h VAL 75 N 0.00 0.73 0.00 -2.22 2.07 -1.34 0.51 116.25 116.01 2k74 h VAL 75 Ca -0.00 -0.25 -0.28 0.00 0.82 0.00 0.00 66.70 66.99 2k74 h VAL 75 Cb 0.13 -0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 29.79 2k74 h VAL 75 CO 0.00 0.13 -1.61 0.40 0.02 0.00 0.00 177.57 176.51 2k74 h ILE 76 N 0.73 0.97 0.08 4.57 2.04 -1.63 -2.86 117.51 121.40 2k74 h ILE 76 Ca 0.55 -2.80 -0.00 0.00 1.00 0.00 0.00 64.86 63.60 2k74 h ILE 76 Cb 0.90 2.48 0.00 0.00 -0.74 0.00 0.00 36.82 39.46 2k74 h ILE 76 CO -0.33 0.55 -0.04 -0.25 0.00 0.00 0.00 178.15 178.09 2k74 h TRP 77 N 0.00 -0.10 0.02 1.37 2.91 -1.00 -2.83 115.95 116.33 2k74 h TRP 77 Ca -0.25 -0.00 -0.00 0.00 1.13 0.00 0.00 58.89 59.77 2k74 h TRP 77 Cb 1.98 0.03 0.00 0.00 -0.51 0.00 0.00 29.16 30.66 2k74 h TRP 77 CO 0.00 0.25 -0.01 1.25 -1.03 0.00 0.00 178.44 178.90 2k74 h LEU 78 N -0.45 -0.02 -0.97 0.65 5.85 -0.22 -1.91 115.31 118.24 2k74 h LEU 78 Ca -0.01 -0.35 0.32 0.00 0.84 0.00 0.00 57.88 58.68 2k74 h LEU 78 Cb 0.39 0.01 -0.17 0.00 0.37 0.00 0.00 40.66 41.26 2k74 h LEU 78 CO 0.02 0.34 0.36 0.22 -0.34 0.00 0.00 178.44 179.04 2k74 h TYR 79 N -0.39 0.55 0.00 1.25 3.20 -1.57 2.07 116.97 122.08 2k74 h TYR 79 Ca -0.00 0.05 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 2k74 h TYR 79 Cb 0.37 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 2k74 h TYR 79 CO 0.05 -0.34 -0.31 0.66 -1.64 0.00 0.00 178.16 176.58 2k74 h SER 80 N 0.12 0.00 0.91 -2.11 4.64 -1.37 -2.80 113.55 112.94 2k74 h SER 80 Ca 0.70 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.98 2k74 h SER 80 Cb 1.64 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.74 2k74 h SER 80 CO -0.74 0.31 -0.44 0.00 -0.87 0.00 0.00 176.83 175.09 2k74 h ALA 81 N 1.69 -1.22 0.05 5.18 0.00 0.42 0.69 119.26 126.07 2k74 h ALA 81 Ca -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2k74 h ALA 81 Cb 1.19 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.46 2k74 h ALA 81 CO 0.04 -1.19 -0.02 0.35 0.00 0.00 0.00 179.25 178.43 2k74 h PHE 82 N -1.23 -0.06 -0.50 0.00 3.57 -1.60 -2.62 116.94 114.50 2k74 h PHE 82 Ca -0.13 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.31 2k74 h PHE 82 Cb 0.94 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.68 2k74 h PHE 82 CO -0.01 0.56 0.05 -0.09 -2.23 0.00 0.00 178.31 176.59 2k74 h ARG 83 N -0.80 0.85 -0.29 1.11 2.43 -1.60 0.22 114.38 116.30 2k74 h ARG 83 Ca -0.01 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 58.90 2k74 h ARG 83 Cb 0.65 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 2k74 h ARG 83 CO 0.01 0.86 0.13 0.78 -1.51 0.00 0.00 179.97 180.24 2k74 h GLY 84 N 0.73 0.45 1.40 2.80 0.00 0.28 0.43 103.07 109.16 2k74 h GLY 84 Ca 0.15 -0.24 -0.10 0.00 0.00 0.00 0.00 47.33 47.15 2k74 h GLY 84 CO 0.02 0.22 -0.16 -2.08 0.00 0.00 0.00 176.54 174.54 2k74 h VAL 85 N 0.33 1.26 0.00 4.60 2.07 -1.39 0.35 116.25 123.47 2k74 h VAL 85 Ca 0.10 -1.21 -0.12 0.00 0.82 0.00 0.00 66.70 66.29 2k74 h VAL 85 Cb 0.15 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2k74 h VAL 85 CO -0.01 0.40 -0.55 -0.61 0.02 0.00 0.00 177.57 176.82 2k74 h GLN 86 N 0.64 0.00 0.04 1.57 4.15 -0.73 -2.72 115.11 118.06 2k74 h GLN 86 Ca 0.10 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 59.37 2k74 h GLN 86 Cb 0.62 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.30 2k74 h GLN 86 CO 0.04 0.55 -0.78 1.25 -1.93 0.00 0.00 178.83 177.96 2k74 h LEU 87 N 0.00 0.12 -0.20 -2.39 7.12 -0.60 -3.27 115.31 116.09 2k74 h LEU 87 Ca -0.01 -0.80 0.06 0.00 0.13 0.00 0.00 57.88 57.26 2k74 h LEU 87 Cb 1.03 -0.04 -0.07 0.00 -0.53 0.00 0.00 40.66 41.05 2k74 h LEU 87 CO 0.07 1.33 -0.31 0.71 -0.13 0.00 0.00 178.44 180.11 2k74 h THR 88 N -0.80 0.29 -0.91 1.05 1.35 -0.37 0.14 112.91 113.66 2k74 h THR 88 Ca -0.19 0.00 0.21 0.00 -0.55 0.00 0.00 66.41 65.88 2k74 h THR 88 Cb 1.32 0.29 -0.07 0.00 -1.73 0.00 0.00 68.15 67.96 2k74 h THR 88 CO -0.04 0.00 0.61 0.22 -0.25 0.00 0.00 175.52 176.05 2k74 h TYR 89 N -0.34 0.51 -0.99 4.73 3.20 -1.65 0.31 116.97 122.74 2k74 h TYR 89 Ca 0.12 0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.05 2k74 h TYR 89 Cb 0.53 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.58 2k74 h TYR 89 CO -0.43 0.13 0.65 1.49 -1.64 0.00 0.00 178.16 178.35 2k74 h GLU 90 N 0.38 1.17 -0.42 1.82 4.81 -0.77 0.86 114.58 122.43 2k74 h GLU 90 Ca 0.48 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.51 2k74 h GLU 90 Cb 1.23 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 2k74 h GLU 90 CO -0.18 0.78 -0.23 1.25 -0.73 0.00 0.00 179.01 179.90 2k74 h HIS 91 N 1.21 0.99 0.04 0.92 2.76 -0.09 -2.82 115.15 118.16 2k74 h HIS 91 Ca 0.41 -0.24 -0.00 0.00 -2.20 0.00 0.00 60.37 58.34 2k74 h HIS 91 Cb 0.09 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 28.82 2k74 h HIS 91 CO -0.00 1.01 -0.02 1.79 -1.30 0.00 0.00 177.93 179.40 2k74 h THR 92 N 0.75 1.13 -1.00 6.26 1.35 -0.78 -1.72 112.91 118.90 2k74 h THR 92 Ca 0.10 -0.58 0.22 0.00 -0.55 0.00 0.00 66.41 65.60 2k74 h THR 92 Cb 0.78 1.52 -0.11 0.00 -1.73 0.00 0.00 68.15 68.60 2k74 h THR 92 CO 0.06 0.15 0.61 -0.03 -0.25 0.00 0.00 175.52 176.06 2k74 h MET 93 N -0.31 0.64 -0.26 4.72 -1.53 -0.85 0.25 114.93 117.59 2k74 h MET 93 Ca -0.01 -0.04 -0.05 0.00 -3.44 0.00 0.00 59.70 56.17 2k74 h MET 93 Cb 0.28 -0.15 -0.01 0.00 -0.55 0.00 0.00 31.60 31.18 2k74 h MET 93 CO 0.01 0.43 -0.03 1.25 0.14 0.00 0.00 176.91 178.71 2k74 h LEU 94 N 0.66 0.48 -0.52 3.39 7.12 -1.24 1.23 115.31 126.43 2k74 h LEU 94 Ca 0.60 -0.34 0.01 0.00 0.13 0.00 0.00 57.88 58.29 2k74 h LEU 94 Cb 1.07 -0.13 -0.03 0.00 -0.53 0.00 0.00 40.66 41.04 2k74 h LEU 94 CO -0.40 0.70 0.34 -0.61 -0.13 0.00 0.00 178.44 178.34 2k74 h GLN 95 N 0.25 0.67 0.00 1.25 4.15 0.15 -1.50 115.11 120.08 2k74 h GLN 95 Ca 0.07 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.45 2k74 h GLN 95 Cb 0.47 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.01 2k74 h GLN 95 CO 0.02 0.44 -0.01 -0.07 -1.93 0.00 0.00 178.83 177.28 2k74 h LEU 96 N 0.69 0.00 -6.92 -2.39 3.38 -0.54 -3.39 115.31 106.14 2k74 h LEU 96 Ca 0.19 -0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.57 2k74 h LEU 96 Cb -0.06 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.29 2k74 h LEU 96 CO -0.05 0.00 -0.77 -0.47 0.09 0.00 0.00 178.44 177.24 2k74 s TYR 97 N -3.20 1.54 0.82 1.13 6.14 0.42 -5.06 117.35 119.14 2k74 s TYR 97 Ca 0.07 -2.01 -0.12 0.00 0.64 0.00 0.00 57.07 55.66 2k74 s TYR 97 Cb 0.06 -1.57 0.08 0.00 0.42 0.00 0.00 41.96 40.96 2k74 s TYR 97 CO 0.66 -0.82 1.16 -1.25 0.64 0.00 0.00 175.55 175.94 2k74 s PRO 98 N 0.89 1.89 0.11 4.97 0.04 -0.85 -4.09 135.00 137.96 2k74 s PRO 98 Ca 0.16 0.22 0.01 0.00 0.04 0.00 0.00 61.00 61.42 2k74 s PRO 98 Cb -0.22 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 2k74 s PRO 98 CO -0.07 -1.67 -0.02 0.45 0.04 0.00 0.00 177.00 175.74 2k74 s SER 99 N -4.39 0.87 -0.54 6.66 0.15 -1.26 -5.09 113.70 110.10 2k74 s SER 99 Ca 0.62 -1.08 -0.26 0.00 0.70 0.00 0.00 55.95 55.92 2k74 s SER 99 Cb -0.12 0.16 -0.05 0.00 -1.71 0.00 0.00 66.02 64.29 2k74 s SER 99 CO 0.51 -0.57 2.23 -2.16 1.20 0.00 0.00 173.24 174.45 2k74 s PRO 100 N -3.91 2.26 0.51 5.44 0.04 -1.26 -4.78 135.00 133.30 2k74 s PRO 100 Ca 0.16 1.13 0.14 0.00 0.04 0.00 0.00 61.00 62.46 2k74 s PRO 100 Cb 0.06 -4.53 0.76 0.00 0.04 0.00 0.00 34.50 30.84 2k74 s PRO 100 CO -0.03 -3.12 1.36 0.27 0.04 0.00 0.00 177.00 175.52 2k74 h PHE 101 N 17.99 0.00 0.00 0.56 -0.00 -1.98 -3.44 116.94 130.06 2k74 h PHE 101 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.73 2k74 h PHE 101 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.18 2k74 h PHE 101 CO 0.99 0.00 0.00 0.00 -0.00 0.00 0.00 178.31 179.30 2k74 n ALA 102 N -1.61 0.00 -1.02 12.09 0.00 -1.26 -3.97 120.51 124.74 2k74 n ALA 102 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2k74 n ALA 102 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2k74 n ALA 102 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2k74 n THR 103 N 0.00 0.00 0.00 0.00 5.66 -1.26 -5.08 114.28 113.60 2k74 n THR 103 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2k74 n THR 103 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2k74 n THR 103 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2k74 n SER 104 N 0.00 0.00 0.00 1.09 2.88 -1.25 -5.18 113.62 111.16 2k74 n SER 104 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2k74 n SER 104 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2k74 n SER 104 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2k74 n ASP 105 N 0.00 0.00 -4.20 -3.46 8.00 -1.26 -4.96 116.55 110.68 2k74 n ASP 105 Ca 0.00 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.38 2k74 n ASP 105 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 2k74 n ASP 105 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2k74 s PHE 106 N -1.69 1.03 0.22 1.24 0.40 -1.26 -5.16 117.98 112.75 2k74 s PHE 106 Ca 0.00 -0.84 -0.02 0.00 -0.60 0.00 0.00 56.93 55.47 2k74 s PHE 106 Cb 0.00 -0.56 -0.04 0.00 0.51 0.00 0.00 43.02 42.92 2k74 s PHE 106 CO 0.00 -0.06 0.42 0.00 0.70 0.00 0.00 175.22 176.28 2k74 s MET 107 N -3.72 3.55 -0.40 0.44 0.23 -1.26 -4.98 119.30 113.16 2k74 s MET 107 Ca 0.13 -0.27 -0.40 0.00 -1.03 0.00 0.00 55.69 54.12 2k74 s MET 107 Cb 0.04 -2.80 -0.15 0.00 -1.53 0.00 0.00 34.83 30.38 2k74 s MET 107 CO -0.03 0.37 2.05 1.33 -2.03 0.00 0.00 175.02 176.71 2k74 n VAL 108 N -0.68 0.13 -3.86 5.16 0.24 -1.26 -4.90 118.33 113.17 2k74 n VAL 108 Ca -0.04 -0.11 -0.35 0.00 -2.04 0.00 0.00 64.34 61.80 2k74 n VAL 108 Cb 0.54 -1.08 -0.13 0.00 -1.47 0.00 0.00 33.84 31.70 2k74 n VAL 108 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k74 s ARG 109 N 5.43 2.08 0.03 7.34 1.70 -1.26 -5.08 118.95 129.19 2k74 s ARG 109 Ca 1.11 -1.63 0.02 0.00 -0.47 0.00 0.00 55.73 54.75 2k74 s ARG 109 Cb -1.17 -3.39 -0.02 0.00 -0.57 0.00 0.00 34.95 29.80 2k74 s ARG 109 CO 0.61 -0.90 -0.06 -0.06 -1.08 0.00 0.00 175.30 173.81 2k74 s PHE 110 N 1.15 0.54 0.88 5.89 0.40 -1.26 -5.14 117.98 120.43 2k74 s PHE 110 Ca 0.04 -0.49 -0.15 0.00 -0.60 0.00 0.00 56.93 55.73 2k74 s PHE 110 Cb -0.21 -0.33 -0.13 0.00 0.51 0.00 0.00 43.02 42.85 2k74 s PHE 110 CO -0.04 -0.11 -0.72 -2.30 0.70 0.00 0.00 175.22 172.76 2k74 n PRO 111 N 1.58 0.00 0.00 0.24 -0.02 -1.26 -4.89 135.00 130.65 2k74 n PRO 111 Ca -0.23 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.36 2k74 n PRO 111 Cb 0.55 -0.88 -0.01 0.00 -0.02 0.00 0.00 33.50 33.14 2k74 n PRO 111 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2k74 n GLU 112 N 2.19 1.20 -0.48 -0.52 0.28 -1.26 -4.13 120.64 117.92 2k74 n GLU 112 Ca -0.02 -0.96 0.11 0.00 -0.16 0.00 0.00 57.16 56.12 2k74 n GLU 112 Cb 0.49 -1.47 0.34 0.00 1.43 0.00 0.00 31.44 32.23 2k74 n GLU 112 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 177.13 174.30 2k74 n TRP 113 N -0.07 1.21 -3.83 -1.84 2.14 -1.26 -4.65 117.44 109.14 2k74 n TRP 113 Ca 0.09 -0.55 -0.28 0.00 2.07 0.00 0.00 57.50 58.83 2k74 n TRP 113 Cb 0.46 -0.12 -0.12 0.00 -0.81 0.00 0.00 31.31 30.73 2k74 n TRP 113 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2k74 n LEU 114 N 1.39 2.79 0.00 5.67 4.77 -1.26 -4.93 117.00 125.43 2k74 n LEU 114 Ca 0.25 -5.16 0.00 0.00 -0.03 0.00 0.00 56.01 51.07 2k74 n LEU 114 Cb 0.75 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2k74 n LEU 114 CO 0.20 1.79 0.32 -2.65 -1.33 0.00 0.00 177.39 175.71 2k74 n PRO 115 N 1.95 0.00 -0.09 3.23 -0.02 -1.26 -1.82 135.00 136.99 2k74 n PRO 115 Ca 0.21 0.11 0.19 0.00 -2.02 0.00 0.00 63.50 62.00 2k74 n PRO 115 Cb 0.36 -1.65 0.61 0.00 -0.02 0.00 0.00 33.50 32.81 2k74 n PRO 115 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2k74 h LEU 116 N 0.00 0.17 0.03 2.45 5.85 -1.95 1.33 115.31 123.18 2k74 h LEU 116 Ca 0.00 0.01 -0.39 0.00 0.84 0.00 0.00 57.88 58.34 2k74 h LEU 116 Cb 0.30 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.25 2k74 h LEU 116 CO 0.00 0.08 -2.29 -0.90 -0.34 0.00 0.00 178.44 175.00 2k74 n ASP 117 N -4.41 2.00 -0.04 1.25 5.75 -0.76 -3.56 116.55 116.78 2k74 n ASP 117 Ca 0.12 0.08 -0.14 0.00 -0.01 0.00 0.00 54.79 54.84 2k74 n ASP 117 Cb 0.61 -0.64 -0.09 0.00 -1.03 0.00 0.00 41.12 39.97 2k74 n ASP 117 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 2k74 h LYS 118 N -0.26 0.36 0.00 0.11 3.64 -1.63 -2.53 116.57 116.25 2k74 h LYS 118 Ca -0.55 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 58.57 2k74 h LYS 118 Cb 1.83 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.69 2k74 h LYS 118 CO -0.13 0.87 0.00 2.35 -2.27 0.00 0.00 179.45 180.28 2k74 h TRP 119 N -0.09 0.00 -2.34 1.91 2.91 0.15 -3.33 115.95 115.16 2k74 h TRP 119 Ca -0.01 0.00 -0.59 0.00 1.13 0.00 0.00 58.89 59.43 2k74 h TRP 119 Cb 0.89 0.00 -0.40 0.00 -0.51 0.00 0.00 29.16 29.15 2k74 h TRP 119 CO 0.12 0.00 -0.89 0.28 -1.03 0.00 0.00 178.44 176.92 2k74 n VAL 120 N -2.90 0.03 0.11 2.65 0.31 -1.15 -4.92 118.33 112.45 2k74 n VAL 120 Ca 0.01 -4.16 -0.01 0.00 -0.01 0.00 0.00 64.34 60.18 2k74 n VAL 120 Cb 0.31 -1.92 -0.03 0.00 -0.91 0.00 0.00 33.84 31.30 2k74 n VAL 120 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2k74 h PRO 121 N 4.82 0.00 0.41 5.55 0.13 -1.57 -3.35 132.00 137.99 2k74 h PRO 121 Ca 0.17 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.28 2k74 h PRO 121 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2k74 h PRO 121 CO 0.54 0.65 -0.20 1.96 -0.23 0.00 0.00 178.00 180.72 2k74 h GLN 122 N 0.00 -0.53 -2.30 0.86 4.20 -1.91 -1.51 115.11 113.92 2k74 h GLN 122 Ca -0.01 0.04 -0.79 0.00 0.06 0.00 0.00 58.65 57.94 2k74 h GLN 122 Cb 1.52 0.12 -0.24 0.00 0.30 0.00 0.00 27.48 29.18 2k74 h GLN 122 CO 0.09 -0.31 1.29 0.28 -0.67 0.00 0.00 178.83 179.51 2k74 n VAL 123 N -5.29 5.81 0.00 -0.54 0.31 -1.26 -4.13 118.33 113.23 2k74 n VAL 123 Ca -0.11 -5.57 0.00 0.00 -0.01 0.00 0.00 64.34 58.65 2k74 n VAL 123 Cb 0.25 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.55 2k74 n VAL 123 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 2k74 n PHE 124 N 0.26 0.00 -1.75 3.52 -0.00 -1.21 -5.04 117.46 113.23 2k74 n PHE 124 Ca 0.50 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.53 2k74 n PHE 124 Cb 0.26 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 39.71 2k74 n PHE 124 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 2k74 s VAL 125 N -0.77 2.38 0.28 -2.13 0.11 -0.57 -4.99 120.40 114.71 2k74 s VAL 125 Ca 0.00 0.10 0.04 0.00 -2.93 0.00 0.00 61.98 59.19 2k74 s VAL 125 Cb 0.00 -3.06 -0.03 0.00 -1.53 0.00 0.00 36.38 31.76 2k74 s VAL 125 CO 0.00 0.00 0.43 0.00 -3.33 0.00 0.00 175.10 172.20 2k74 s ALA 126 N 1.99 3.89 -0.29 1.54 0.00 -1.26 -5.00 121.76 122.63 2k74 s ALA 126 Ca 0.77 -1.16 -0.01 0.00 0.00 0.00 0.00 51.96 51.56 2k74 s ALA 126 Cb -0.47 -1.83 0.19 0.00 0.00 0.00 0.00 23.12 21.01 2k74 s ALA 126 CO 0.34 0.13 0.78 0.45 0.00 0.00 0.00 175.76 177.46 2k74 s SER 127 N -4.02 -1.14 0.00 0.00 0.15 -0.72 -4.94 113.70 103.04 2k74 s SER 127 Ca 0.37 0.12 0.00 0.00 0.70 0.00 0.00 55.95 57.14 2k74 s SER 127 Cb -0.09 1.71 0.00 0.00 -1.71 0.00 0.00 66.02 65.93 2k74 s SER 127 CO 0.31 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.16 2k74 n GLY 128 N 5.27 0.73 3.88 9.45 0.00 -1.26 -3.95 105.19 119.32 2k74 n GLY 128 Ca 0.07 -1.87 -0.30 0.00 0.00 0.00 0.00 46.02 43.92 2k74 n GLY 128 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k74 s ASP 129 N -2.00 6.52 -0.17 1.61 1.47 -1.26 -4.76 116.67 118.08 2k74 s ASP 129 Ca 0.00 0.99 -0.08 0.00 1.18 0.00 0.00 52.55 54.64 2k74 s ASP 129 Cb 0.00 -2.26 -0.04 0.00 -0.34 0.00 0.00 42.92 40.28 2k74 s ASP 129 CO 0.00 -0.29 0.11 0.00 0.68 0.00 0.00 175.17 175.66 2k74 n ALA 131 N 3.04 0.00 -1.71 0.00 0.00 -1.26 -4.97 120.51 115.62 2k74 n ALA 131 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.92 2k74 n ALA 131 Cb 0.53 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.00 2k74 n ALA 131 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2k74 s GLU 132 N -0.41 3.09 -0.12 0.00 -6.30 -1.26 -4.80 118.70 108.91 2k74 s GLU 132 Ca 0.00 1.66 -0.24 0.00 -2.50 0.00 0.00 54.97 53.89 2k74 s GLU 132 Cb 0.00 -1.96 -0.03 0.00 0.00 0.00 0.00 34.13 32.14 2k74 s GLU 132 CO 0.00 -1.07 0.75 0.50 0.02 0.00 0.00 175.26 175.46 2k74 s ARG 133 N -3.45 4.36 0.00 4.30 3.52 -1.26 -4.89 118.95 121.53 2k74 s ARG 133 Ca 0.73 0.92 0.00 0.00 -0.13 0.00 0.00 55.73 57.25 2k74 s ARG 133 Cb -0.26 -3.51 0.00 0.00 -1.56 0.00 0.00 34.95 29.62 2k74 s ARG 133 CO 0.32 -0.12 0.00 1.04 -0.81 0.00 0.00 175.30 175.73 2k74 n GLN 134 N 4.47 2.43 -3.65 5.12 1.13 -1.26 -5.07 117.38 120.55 2k74 n GLN 134 Ca 0.01 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 55.05 2k74 n GLN 134 Cb 0.50 -0.97 -0.07 0.00 0.11 0.00 0.00 30.24 29.82 2k74 n GLN 134 CO 0.00 0.00 0.00 -0.46 -1.44 0.00 0.00 177.06 175.16 2k74 s TRP 135 N -1.91 -0.20 0.10 1.08 -0.11 -1.26 -5.14 118.94 111.49 2k74 s TRP 135 Ca 0.00 0.45 0.02 0.00 1.22 0.00 0.00 56.10 57.79 2k74 s TRP 135 Cb 0.00 0.31 -0.04 0.00 -1.50 0.00 0.00 33.47 32.24 2k74 s TRP 135 CO 0.00 -0.10 -0.07 0.16 -4.62 0.00 0.00 176.95 172.32 2k74 s ASP 136 N 0.56 1.19 -0.03 5.86 1.47 -1.26 -3.29 116.67 121.17 2k74 s ASP 136 Ca -0.00 -0.99 0.06 0.00 1.18 0.00 0.00 52.55 52.80 2k74 s ASP 136 Cb -0.04 0.08 -0.01 0.00 -0.34 0.00 0.00 42.92 42.61 2k74 s ASP 136 CO -0.12 -0.44 -0.21 0.12 0.68 0.00 0.00 175.17 175.20 2k74 s PHE 137 N -3.50 1.96 -1.14 2.11 5.36 0.15 -4.66 117.98 118.27 2k74 s PHE 137 Ca 0.11 -0.47 0.00 0.00 -0.96 0.00 0.00 56.93 55.62 2k74 s PHE 137 Cb 0.04 -1.28 0.00 0.00 -0.34 0.00 0.00 43.02 41.44 2k74 s PHE 137 CO -0.04 -0.11 0.00 1.28 -1.46 0.00 0.00 175.22 174.89 2k74 n LEU 138 N 2.79 -0.57 0.00 6.12 4.32 -1.26 0.65 117.00 129.05 2k74 n LEU 138 Ca -0.16 0.27 0.00 0.00 -0.02 0.00 0.00 56.01 56.09 2k74 n LEU 138 Cb 0.53 -2.13 0.00 0.00 -1.62 0.00 0.00 43.42 40.19 2k74 n LEU 138 CO 0.24 -0.77 0.00 0.61 -1.22 0.00 0.00 177.39 176.25 2k74 n GLY 139 N 0.01 0.71 3.37 -0.72 0.00 -1.26 -5.07 105.19 102.24 2k74 n GLY 139 Ca -0.11 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 2k74 n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k74 s LEU 140 N 0.00 2.28 0.44 0.99 1.43 0.21 -5.07 118.68 118.96 2k74 s LEU 140 Ca 0.00 -0.57 -0.22 0.00 -1.03 0.00 0.00 54.13 52.31 2k74 s LEU 140 Cb 0.00 -1.33 -0.09 0.00 0.03 0.00 0.00 46.19 44.80 2k74 s LEU 140 CO 0.00 0.25 1.03 -1.61 0.23 0.00 0.00 176.35 176.25 2k74 s GLU 141 N -1.35 4.04 0.13 1.70 8.01 -1.26 0.32 118.70 130.28 2k74 s GLU 141 Ca 0.13 1.39 -0.29 0.00 0.01 0.00 0.00 54.97 56.21 2k74 s GLU 141 Cb -0.10 -2.32 -0.06 0.00 -4.31 0.00 0.00 34.13 27.34 2k74 s GLU 141 CO 0.03 -0.23 1.58 0.52 0.01 0.00 0.00 175.26 177.17 2k74 h MET 142 N 2.06 -0.49 -0.98 1.61 2.86 -1.94 -0.73 114.93 117.33 2k74 h MET 142 Ca -0.49 0.03 0.38 0.00 -2.06 0.00 0.00 59.70 57.57 2k74 h MET 142 Cb 1.21 0.11 -0.14 0.00 0.06 0.00 0.00 31.60 32.84 2k74 h MET 142 CO 0.61 -0.33 0.57 -2.30 1.06 0.00 0.00 176.91 176.52 2k74 n PRO 143 N -5.44 -0.05 -0.03 -0.22 -0.02 -1.26 0.13 135.00 128.12 2k74 n PRO 143 Ca -0.04 1.16 -0.14 0.00 -2.02 0.00 0.00 63.50 62.45 2k74 n PRO 143 Cb 0.36 -2.16 -0.10 0.00 -0.02 0.00 0.00 33.50 31.59 2k74 n PRO 143 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2k74 h GLN 144 N 0.00 0.26 0.74 -0.52 4.15 -1.52 -2.85 115.11 115.36 2k74 h GLN 144 Ca 0.75 -0.20 -0.04 0.00 0.77 0.00 0.00 58.65 59.93 2k74 h GLN 144 Cb 2.13 0.04 0.01 0.00 0.21 0.00 0.00 27.48 29.87 2k74 h GLN 144 CO -0.58 0.84 -0.35 -1.49 -1.93 0.00 0.00 178.83 175.32 2k74 h TRP 145 N -0.26 -0.92 -0.98 3.99 4.06 0.16 -2.31 115.95 119.69 2k74 h TRP 145 Ca -0.01 -0.02 0.33 0.00 2.06 0.00 0.00 58.89 61.24 2k74 h TRP 145 Cb 0.88 0.30 -0.16 0.00 -1.00 0.00 0.00 29.16 29.19 2k74 h TRP 145 CO 0.13 -0.56 0.49 1.25 -3.56 0.00 0.00 178.44 176.19 2k74 h LEU 146 N -1.03 0.34 -1.51 -4.49 6.46 -0.72 3.90 115.31 118.27 2k74 h LEU 146 Ca -0.10 0.21 0.07 0.00 -0.12 0.00 0.00 57.88 57.94 2k74 h LEU 146 Cb 0.77 0.20 -0.04 0.00 -0.73 0.00 0.00 40.66 40.86 2k74 h LEU 146 CO 0.17 -0.22 0.42 0.25 -0.62 0.00 0.00 178.44 178.44 2k74 h LEU 147 N 0.22 0.52 -0.67 2.25 6.46 -1.18 0.92 115.31 123.84 2k74 h LEU 147 Ca 0.73 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 58.53 2k74 h LEU 147 Cb 1.70 -0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 41.48 2k74 h LEU 147 CO -0.67 0.33 0.41 1.23 -0.62 0.00 0.00 178.44 179.13 2k74 h GLY 148 N 0.59 0.97 1.31 3.75 0.00 0.79 -1.54 103.07 108.93 2k74 h GLY 148 Ca 0.28 -0.31 -0.20 0.00 0.00 0.00 0.00 47.33 47.10 2k74 h GLY 148 CO -0.08 0.25 -0.71 -2.22 0.00 0.00 0.00 176.54 173.78 2k74 h ILE 149 N 0.80 1.30 -0.59 2.60 5.03 -0.65 -3.00 117.51 123.00 2k74 h ILE 149 Ca 0.27 -1.95 0.11 0.00 -0.12 0.00 0.00 64.86 63.17 2k74 h ILE 149 Cb 0.05 1.93 -0.08 0.00 -3.03 0.00 0.00 36.82 35.68 2k74 h ILE 149 CO -0.12 0.61 0.12 0.15 -0.68 0.00 0.00 178.15 178.23 2k74 h PHE 150 N 0.49 0.18 -0.08 1.37 3.04 -0.31 0.17 116.94 121.80 2k74 h PHE 150 Ca -0.03 0.04 0.01 0.00 3.98 0.00 0.00 57.97 61.96 2k74 h PHE 150 Cb 1.31 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.82 2k74 h PHE 150 CO 0.07 -0.04 0.03 0.82 -2.02 0.00 0.00 178.31 177.17 2k74 h ILE 151 N 0.25 0.99 -0.22 1.41 2.04 -1.27 -0.90 117.51 119.81 2k74 h ILE 151 Ca 0.31 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 66.17 2k74 h ILE 151 Cb 0.45 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 2k74 h ILE 151 CO -0.40 0.01 0.05 0.00 0.00 0.00 0.00 178.15 177.82 2k74 h ALA 152 N 1.04 0.23 -0.56 1.87 0.00 -1.10 0.73 119.26 121.48 2k74 h ALA 152 Ca 0.03 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.00 2k74 h ALA 152 Cb 0.01 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2k74 h ALA 152 CO -0.03 -0.37 0.35 1.88 0.00 0.00 0.00 179.25 181.08 2k74 h TYR 153 N 0.14 0.66 -0.03 0.00 -1.99 -0.51 0.15 116.97 115.39 2k74 h TYR 153 Ca 0.10 0.02 -0.11 0.00 2.00 0.00 0.00 58.73 60.74 2k74 h TYR 153 Cb 0.09 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 38.59 2k74 h TYR 153 CO -0.14 0.39 -0.47 1.37 -0.00 0.00 0.00 178.16 179.31 2k74 h LEU 154 N 0.70 0.07 -0.19 3.88 8.10 -0.84 -2.91 115.31 124.13 2k74 h LEU 154 Ca 0.22 -0.03 -0.22 0.00 0.11 0.00 0.00 57.88 57.95 2k74 h LEU 154 Cb -0.02 -0.02 0.00 0.00 -0.44 0.00 0.00 40.66 40.19 2k74 h LEU 154 CO -0.08 0.54 -0.90 -0.29 -4.11 0.00 0.00 178.44 173.59 2k74 h ILE 155 N 0.06 1.37 -0.59 0.15 6.09 -0.31 -2.96 117.51 121.31 2k74 h ILE 155 Ca 0.00 -2.32 -0.02 0.00 -1.37 0.00 0.00 64.86 61.16 2k74 h ILE 155 Cb 0.86 2.32 -0.03 0.00 0.47 0.00 0.00 36.82 40.44 2k74 h ILE 155 CO 0.06 0.70 0.29 0.58 -3.07 0.00 0.00 178.15 176.72 2k74 h VAL 156 N 0.29 1.20 -0.14 2.19 2.07 -0.88 -2.68 116.25 118.31 2k74 h VAL 156 Ca -0.08 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 2k74 h VAL 156 Cb 1.53 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2k74 h VAL 156 CO 0.16 0.23 0.08 0.00 0.02 0.00 0.00 177.57 178.06 2k74 h ALA 157 N 1.13 0.18 -0.99 1.67 0.00 -1.55 0.19 119.26 119.89 2k74 h ALA 157 Ca 0.20 -0.06 0.17 0.00 0.00 0.00 0.00 54.91 55.23 2k74 h ALA 157 Cb 0.09 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 17.73 2k74 h ALA 157 CO -0.03 -0.28 0.61 0.28 0.00 0.00 0.00 179.25 179.84 2k74 h VAL 158 N 0.13 0.75 0.22 0.00 2.07 -1.34 -0.37 116.25 117.71 2k74 h VAL 158 Ca 0.05 -0.26 -0.29 0.00 0.82 0.00 0.00 66.70 67.01 2k74 h VAL 158 Cb 0.08 -0.08 0.03 0.00 -1.52 0.00 0.00 31.29 29.80 2k74 h VAL 158 CO -0.01 0.14 -1.29 -0.07 0.02 0.00 0.00 177.57 176.36 2k74 h LEU 159 N 0.77 0.73 -2.22 2.57 3.38 -1.14 -2.78 115.31 116.62 2k74 h LEU 159 Ca 0.54 -0.93 0.02 0.00 0.09 0.00 0.00 57.88 57.60 2k74 h LEU 159 Cb 0.84 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 2k74 h LEU 159 CO -0.32 1.62 0.05 0.58 0.09 0.00 0.00 178.44 180.46 2k74 h VAL 160 N -0.01 0.72 0.12 1.22 2.07 0.18 0.24 116.25 120.79 2k74 h VAL 160 Ca -0.23 0.00 -0.22 0.00 0.82 0.00 0.00 66.70 67.08 2k74 h VAL 160 Cb 2.01 0.96 0.01 0.00 -1.52 0.00 0.00 31.29 32.75 2k74 h VAL 160 CO 0.24 0.00 -1.04 0.58 0.02 0.00 0.00 177.57 177.36 2k74 h VAL 161 N 0.00 1.30 0.00 2.57 2.07 -1.15 -3.27 116.25 117.78 2k74 h VAL 161 Ca 0.03 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 65.09 2k74 h VAL 161 Cb 0.12 2.97 0.00 0.00 -1.52 0.00 0.00 31.29 32.87 2k74 h VAL 161 CO -0.00 0.69 0.00 -0.38 0.02 0.00 0.00 177.57 177.90 2k74 n ILE 162 N -4.08 0.97 0.33 4.57 5.41 -0.89 -2.33 119.36 123.35 2k74 n ILE 162 Ca -0.19 0.24 0.06 0.00 1.00 0.00 0.00 62.75 63.87 2k74 n ILE 162 Cb 0.83 -1.01 0.28 0.00 -0.71 0.00 0.00 39.64 39.04 2k74 n ILE 162 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2k74 n SER 163 N -1.45 0.15 -2.73 4.38 7.64 0.02 -4.07 113.62 117.56 2k74 n SER 163 Ca 0.04 0.55 -0.04 0.00 1.01 0.00 0.00 58.87 60.43 2k74 n SER 163 Cb 0.14 -0.58 0.02 0.00 -1.01 0.00 0.00 64.21 62.79 2k74 n SER 163 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k74 n GLN 164 N -1.68 0.42 -0.08 1.43 10.64 -0.98 -5.01 117.38 122.12 2k74 n GLN 164 Ca 0.02 -1.62 -0.01 0.00 -1.83 0.00 0.00 57.00 53.57 2k74 n GLN 164 Cb 0.13 -0.98 0.02 0.00 -0.86 0.00 0.00 30.24 28.55 2k74 n GLN 164 CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88 2k74 n PRO 165 N 2.70 1.20 -2.58 2.61 -0.04 -1.26 -4.92 135.00 132.71 2k74 n PRO 165 Ca 0.15 -0.23 -0.02 0.00 -0.04 0.00 0.00 63.50 63.36 2k74 n PRO 165 Cb 0.59 -1.34 -0.02 0.00 -0.04 0.00 0.00 33.50 32.69 2k74 n PRO 165 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2k74 n PHE 166 N 0.20 -2.74 -2.00 0.54 3.01 -1.26 -4.97 117.46 110.23 2k74 n PHE 166 Ca 0.03 1.61 -0.28 0.00 1.01 0.00 0.00 57.45 59.82 2k74 n PHE 166 Cb 0.44 -2.71 0.10 0.00 -0.01 0.00 0.00 39.48 37.30 2k74 n PHE 166 CO 0.00 0.00 0.00 -1.59 1.01 0.00 0.00 176.76 176.18 2k74 s LYS 167 N -0.38 1.76 -0.30 -1.08 -2.85 -1.26 -5.09 119.74 110.54 2k74 s LYS 167 Ca -0.11 -0.11 -0.05 0.00 -1.00 0.00 0.00 55.97 54.70 2k74 s LYS 167 Cb 0.01 -1.99 0.19 0.00 -2.06 0.00 0.00 37.83 33.97 2k74 s LYS 167 CO 0.30 -1.67 0.86 0.00 0.10 0.00 0.00 175.35 174.94 2k74 s ALA 168 N -3.55 -3.27 -0.10 0.59 0.00 -1.26 -5.13 121.76 109.05 2k74 s ALA 168 Ca 0.64 1.31 -0.29 0.00 0.00 0.00 0.00 51.96 53.61 2k74 s ALA 168 Cb -0.09 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.34 2k74 s ALA 168 CO 0.49 -1.86 1.60 -1.59 0.00 0.00 0.00 175.76 174.39 2k74 s LYS 169 N 2.91 4.11 0.00 0.00 0.00 -1.26 -5.00 119.74 120.50 2k74 s LYS 169 Ca 0.17 2.02 0.00 0.00 0.00 0.00 0.00 55.97 58.16 2k74 s LYS 169 Cb -0.07 -3.97 0.00 0.00 0.00 0.00 0.00 37.83 33.80 2k74 s LYS 169 CO -0.22 -0.92 0.00 1.63 0.00 0.00 0.00 175.35 175.84 2k74 n LYS 170 N 7.16 1.47 -2.69 1.78 5.02 -1.26 -5.02 118.16 124.63 2k74 n LYS 170 Ca 0.17 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 56.03 2k74 n LYS 170 Cb 0.43 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.42 2k74 n LYS 170 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2k74 s ARG 171 N -0.39 3.55 -0.98 1.97 1.81 -1.26 -4.92 118.95 118.73 2k74 s ARG 171 Ca 0.00 0.24 -0.01 0.00 -1.72 0.00 0.00 55.73 54.24 2k74 s ARG 171 Cb 0.00 -3.97 0.32 0.00 -0.45 0.00 0.00 34.95 30.85 2k74 s ARG 171 CO 0.00 -1.45 1.92 -0.25 -0.68 0.00 0.00 175.30 174.84 2k74 n ASP 172 N 7.80 7.43 -4.35 0.23 8.00 -1.26 -4.96 116.55 129.43 2k74 n ASP 172 Ca 0.08 -3.70 -0.30 0.00 0.71 0.00 0.00 54.79 51.58 2k74 n ASP 172 Cb 0.49 -1.15 -0.14 0.00 -0.02 0.00 0.00 41.12 40.29 2k74 n ASP 172 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2k74 s LEU 173 N -4.15 2.19 0.00 0.64 1.43 -1.26 -5.01 118.68 112.52 2k74 s LEU 173 Ca 0.43 -0.62 0.30 0.00 -1.03 0.00 0.00 54.13 53.22 2k74 s LEU 173 Cb 0.26 -1.26 1.55 0.00 0.03 0.00 0.00 46.19 46.77 2k74 s LEU 173 CO -0.21 0.24 2.04 0.49 0.23 0.00 0.00 176.35 179.14 2k74 n PHE 174 N 1.62 0.00 0.00 0.29 3.72 -1.26 -4.31 117.46 117.53 2k74 n PHE 174 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 2k74 n PHE 174 Cb 0.52 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.94 2k74 n PHE 174 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2k74 n GLY 175 N 1.16 -3.11 3.94 1.37 0.00 -1.26 -4.72 105.19 102.57 2k74 n GLY 175 Ca 0.19 0.49 -0.21 0.00 0.00 0.00 0.00 46.02 46.48 2k74 n GLY 175 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k74 s ARG 176 N -2.51 2.47 -0.23 1.61 0.52 -1.26 -5.10 118.95 114.46 2k74 s ARG 176 Ca 0.00 -1.61 -0.15 0.00 -0.52 0.00 0.00 55.73 53.45 2k74 s ARG 176 Cb 0.00 -2.45 -0.04 0.00 0.52 0.00 0.00 34.95 32.98 2k74 s ARG 176 CO 0.00 -0.45 0.36 0.20 0.02 0.00 0.00 175.30 175.43 2k74 s GLY 177 N -4.32 1.99 0.60 -3.53 0.00 -1.26 -4.93 107.32 95.87 2k74 s GLY 177 Ca 0.49 -0.68 0.15 0.00 0.00 0.00 0.00 44.72 44.69 2k74 s GLY 177 CO 0.30 0.83 1.43 0.84 0.00 0.00 0.00 173.10 176.50 2k74 h HIS 178 N 7.69 0.00 -3.21 1.90 2.76 -1.96 -3.38 115.15 118.95 2k74 h HIS 178 Ca -0.35 0.00 -0.65 0.00 -2.20 0.00 0.00 60.37 57.17 2k74 h HIS 178 Cb 1.16 0.00 -0.10 0.00 1.55 0.00 0.00 27.41 30.02 2k74 h HIS 178 CO 0.71 0.00 -0.61 -1.01 -1.30 0.00 0.00 177.93 175.72 2k74 s HIS 179 N -3.88 3.18 0.00 5.26 3.76 -1.26 -5.12 115.29 117.23 2k74 s HIS 179 Ca -0.02 0.12 0.00 0.00 -0.15 0.00 0.00 55.06 55.01 2k74 s HIS 179 Cb 0.04 -1.67 0.00 0.00 1.11 0.00 0.00 32.58 32.07 2k74 s HIS 179 CO 0.14 0.52 0.00 0.72 -0.85 0.00 0.00 174.74 175.26 2k74 n HIS 180 N 0.92 0.00 -1.02 1.40 -0.00 -1.26 -4.80 115.22 110.46 2k74 n HIS 180 Ca -0.12 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.27 2k74 n HIS 180 Cb 0.52 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.41 2k74 n HIS 180 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2k74 n HIS 181 N 0.00 0.54 -1.65 4.41 8.25 -1.26 -4.75 115.22 120.75 2k74 n HIS 181 Ca 0.00 0.36 -0.42 0.00 -0.26 0.00 0.00 57.72 57.40 2k74 n HIS 181 Cb 0.00 -1.70 -0.00 0.00 1.12 0.00 0.00 29.99 29.41 2k74 n HIS 181 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k74 n HIS 182 N 6.89 1.77 1.96 4.41 -0.00 -1.26 -5.29 115.22 123.70 2k74 n HIS 182 Ca 0.45 0.58 0.16 0.00 -0.00 0.00 0.00 57.72 58.91 2k74 n HIS 182 Cb 0.01 -2.33 0.93 0.00 -0.00 0.00 0.00 29.99 28.60 2k74 n HIS 182 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06