#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 0.34 -1.81 4.03 -0.00 -2.04 -2.83 115.31 113.01 2k74 h LEU 2 Ca 0.00 -0.85 0.21 0.00 -0.00 0.00 0.00 57.88 57.25 2k74 h LEU 2 Cb 0.00 -0.11 -0.04 0.00 -0.00 0.00 0.00 40.66 40.51 2k74 h LEU 2 CO 0.00 1.15 0.57 0.03 -0.00 0.00 0.00 178.44 180.19 2k74 h ARG 3 N -0.42 0.16 0.02 0.17 3.08 -2.01 0.79 114.38 116.16 2k74 h ARG 3 Ca -0.07 -0.01 -0.22 0.00 0.07 0.00 0.00 59.98 59.75 2k74 h ARG 3 Cb 1.26 -0.04 0.02 0.00 0.08 0.00 0.00 29.97 31.29 2k74 h ARG 3 CO 0.09 0.10 -0.86 0.35 -1.07 0.00 0.00 179.97 178.58 2k74 h PHE 4 N 0.16 0.83 -1.02 3.04 3.04 -2.01 -3.24 116.94 117.76 2k74 h PHE 4 Ca 0.40 -0.47 0.29 0.00 3.98 0.00 0.00 57.97 62.18 2k74 h PHE 4 Cb 1.34 -0.09 -0.14 0.00 2.56 0.00 0.00 35.95 39.63 2k74 h PHE 4 CO -0.00 1.30 0.59 1.25 -2.02 0.00 0.00 178.31 179.43 2k74 h LEU 5 N 0.13 0.57 -1.74 0.59 5.85 -0.58 2.08 115.31 122.21 2k74 h LEU 5 Ca -0.11 0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 2k74 h LEU 5 Cb 1.55 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.66 2k74 h LEU 5 CO 0.17 -0.03 -0.13 -1.13 -0.34 0.00 0.00 178.44 176.98 2k74 h ASN 6 N 0.42 0.00 0.10 1.25 -0.00 -1.52 -1.97 115.58 113.86 2k74 h ASN 6 Ca 0.69 0.00 -0.15 0.00 -0.00 0.00 0.00 56.30 56.84 2k74 h ASN 6 Cb 1.51 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 39.85 2k74 h ASN 6 CO -0.53 0.13 -0.71 -0.61 -0.00 0.00 0.00 177.43 175.71 2k74 h GLN 7 N 0.00 0.21 -0.74 6.67 4.15 0.32 -2.08 115.11 123.64 2k74 h GLN 7 Ca -0.00 -0.37 -0.03 0.00 0.77 0.00 0.00 58.65 59.02 2k74 h GLN 7 Cb 0.43 0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.22 2k74 h GLN 7 CO 0.02 1.18 0.35 0.00 -1.93 0.00 0.00 178.83 178.44 2k74 h ALA 8 N 0.03 1.22 0.02 3.38 0.00 -0.96 -2.73 119.26 120.21 2k74 h ALA 8 Ca -0.13 -0.15 -0.25 0.00 0.00 0.00 0.00 54.91 54.38 2k74 h ALA 8 Cb 1.50 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 19.00 2k74 h ALA 8 CO 0.09 0.59 -1.02 0.66 0.00 0.00 0.00 179.25 179.58 2k74 h SER 9 N 1.05 0.67 0.00 0.00 4.64 -1.48 -3.01 113.55 115.43 2k74 h SER 9 Ca 0.26 -0.56 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2k74 h SER 9 Cb 0.12 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2k74 h SER 9 CO -0.03 1.36 0.00 0.00 -0.87 0.00 0.00 176.83 177.29 2k74 n GLN 10 N -3.77 0.35 -3.83 4.77 6.02 -0.78 -4.64 117.38 115.50 2k74 n GLN 10 Ca -0.09 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.56 2k74 n GLN 10 Cb 0.87 -1.23 -0.05 0.00 1.02 0.00 0.00 30.24 30.85 2k74 n GLN 10 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2k74 s GLY 11 N -1.81 2.21 0.01 1.08 0.00 -1.14 -4.84 107.32 102.82 2k74 s GLY 11 Ca 0.08 -0.67 -0.24 0.00 0.00 0.00 0.00 44.72 43.89 2k74 s GLY 11 CO 0.06 -0.53 1.31 3.21 0.00 0.00 0.00 173.10 177.16 2k74 h ARG 12 N 3.85 0.15 -0.92 2.90 3.08 -1.87 -2.97 114.38 118.60 2k74 h ARG 12 Ca -0.49 -0.07 0.26 0.00 0.07 0.00 0.00 59.98 59.74 2k74 h ARG 12 Cb 1.19 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 31.08 2k74 h ARG 12 CO 0.68 0.58 0.15 0.78 -1.07 0.00 0.00 179.97 181.08 2k74 h GLY 13 N -0.28 1.33 0.91 0.04 0.00 -1.95 0.63 103.07 103.75 2k74 h GLY 13 Ca 0.01 0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 2k74 h GLY 13 CO 0.01 -0.46 0.08 0.00 0.00 0.00 0.00 176.54 176.18 2k74 h ALA 14 N 1.87 0.23 -0.33 3.60 0.00 -1.78 -0.92 119.26 121.93 2k74 h ALA 14 Ca 0.58 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.43 2k74 h ALA 14 Cb 1.21 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 2k74 h ALA 14 CO -0.78 -0.21 0.16 -1.49 0.00 0.00 0.00 179.25 176.93 2k74 h TRP 15 N 0.16 0.29 0.00 0.00 4.06 0.23 -0.25 115.95 120.44 2k74 h TRP 15 Ca 0.06 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 61.02 2k74 h TRP 15 Cb 0.12 -0.08 -0.00 0.00 -1.00 0.00 0.00 29.16 28.20 2k74 h TRP 15 CO -0.03 0.15 -0.01 1.25 -3.56 0.00 0.00 178.44 176.25 2k74 h LEU 16 N 0.33 0.00 -1.07 -4.49 5.85 -0.27 0.02 115.31 115.67 2k74 h LEU 16 Ca 0.14 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.77 2k74 h LEU 16 Cb 0.06 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2k74 h LEU 16 CO -0.10 0.01 -0.45 0.25 -0.34 0.00 0.00 178.44 177.81 2k74 h LEU 17 N 0.00 0.00 -0.38 2.25 5.85 0.38 -2.38 115.31 121.04 2k74 h LEU 17 Ca -0.00 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.54 2k74 h LEU 17 Cb 0.02 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2k74 h LEU 17 CO 0.00 0.45 -0.80 0.24 -0.34 0.00 0.00 178.44 177.99 2k74 h MET 18 N 0.00 0.22 0.17 1.25 2.86 -0.40 -2.96 114.93 116.08 2k74 h MET 18 Ca -0.00 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.41 2k74 h MET 18 Cb 0.83 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.54 2k74 h MET 18 CO 0.06 0.91 -0.08 0.00 1.06 0.00 0.00 176.91 178.86 2k74 h ALA 19 N 1.02 -0.23 -0.29 6.32 0.00 -1.23 -2.95 119.26 121.90 2k74 h ALA 19 Ca -0.03 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.73 2k74 h ALA 19 Cb 1.40 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 19.20 2k74 h ALA 19 CO 0.12 -0.38 -0.23 0.35 0.00 0.00 0.00 179.25 179.11 2k74 h PHE 20 N -0.73 -0.61 -0.25 0.00 3.04 -1.52 -1.79 116.94 115.07 2k74 h PHE 20 Ca -0.02 0.04 0.05 0.00 3.98 0.00 0.00 57.97 62.02 2k74 h PHE 20 Cb 0.51 0.31 -0.08 0.00 2.56 0.00 0.00 35.95 39.26 2k74 h PHE 20 CO 0.07 -0.31 -0.46 1.79 -2.02 0.00 0.00 178.31 177.37 2k74 h THR 21 N -0.21 0.09 -0.78 4.41 1.35 -1.59 0.57 112.91 116.74 2k74 h THR 21 Ca 0.15 0.00 0.22 0.00 -0.55 0.00 0.00 66.41 66.23 2k74 h THR 21 Cb 0.45 0.09 -0.03 0.00 -1.73 0.00 0.00 68.15 66.92 2k74 h THR 21 CO -0.41 0.00 0.56 0.00 -0.25 0.00 0.00 175.52 175.41 2k74 h ALA 22 N 0.12 2.70 0.21 6.62 0.00 -1.24 -0.11 119.26 127.55 2k74 h ALA 22 Ca 0.09 -0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.64 2k74 h ALA 22 Cb 0.62 0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.49 2k74 h ALA 22 CO -0.49 -0.92 -1.51 1.25 0.00 0.00 0.00 179.25 177.58 2k74 h LEU 23 N 0.03 0.71 -0.91 0.00 6.46 0.30 -3.27 115.31 118.62 2k74 h LEU 23 Ca 0.37 -0.82 0.18 0.00 -0.12 0.00 0.00 57.88 57.49 2k74 h LEU 23 Cb 1.45 -0.23 -0.11 0.00 -0.73 0.00 0.00 40.66 41.04 2k74 h LEU 23 CO -0.01 1.65 0.49 0.00 -0.62 0.00 0.00 178.44 179.95 2k74 h ALA 24 N 0.24 1.45 -0.14 1.25 0.00 0.19 0.20 119.26 122.45 2k74 h ALA 24 Ca -0.26 0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 2k74 h ALA 24 Cb 2.12 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.89 2k74 h ALA 24 CO 0.24 -0.14 -0.40 -0.07 0.00 0.00 0.00 179.25 178.88 2k74 h LEU 25 N 0.62 0.32 -0.69 0.00 4.07 -1.60 -1.61 115.31 116.42 2k74 h LEU 25 Ca 0.53 -0.14 -0.04 0.00 0.08 0.00 0.00 57.88 58.31 2k74 h LEU 25 Cb 0.84 -0.09 -0.03 0.00 1.08 0.00 0.00 40.66 42.46 2k74 h LEU 25 CO -0.41 0.70 0.26 -0.08 -1.08 0.00 0.00 178.44 177.83 2k74 h GLU 26 N 0.26 1.03 0.00 1.13 4.22 -0.68 -2.33 114.58 118.21 2k74 h GLU 26 Ca 0.02 -0.19 -0.00 0.00 0.08 0.00 0.00 59.36 59.27 2k74 h GLU 26 Cb 0.83 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.91 2k74 h GLU 26 CO 0.07 0.87 -0.00 1.25 -2.18 0.00 0.00 179.01 179.01 2k74 h LEU 27 N 0.98 -0.00 -0.72 1.64 5.85 -1.21 -2.36 115.31 119.49 2k74 h LEU 27 Ca 0.23 -0.70 0.16 0.00 0.84 0.00 0.00 57.88 58.41 2k74 h LEU 27 Cb 0.23 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 41.14 2k74 h LEU 27 CO -0.02 0.70 0.05 0.74 -0.34 0.00 0.00 178.44 179.58 2k74 h THR 28 N -0.71 0.42 0.00 1.05 2.02 -1.28 0.43 112.91 114.84 2k74 h THR 28 Ca -0.00 -0.05 -0.10 0.00 0.77 0.00 0.00 66.41 67.02 2k74 h THR 28 Cb 0.70 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 2k74 h THR 28 CO 0.00 0.03 -0.50 0.00 0.37 0.00 0.00 175.52 175.42 2k74 h ALA 29 N 1.65 1.07 0.00 6.16 0.00 -1.49 -2.74 119.26 123.92 2k74 h ALA 29 Ca 0.40 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2k74 h ALA 29 Cb 0.69 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2k74 h ALA 29 CO -0.59 0.62 -0.01 1.25 0.00 0.00 0.00 179.25 180.51 2k74 h LEU 30 N 0.00 0.00 0.11 0.00 5.85 0.39 -2.91 115.31 118.75 2k74 h LEU 30 Ca -0.00 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.40 2k74 h LEU 30 Cb 0.94 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 2k74 h LEU 30 CO 0.06 0.01 -1.67 -0.25 -0.34 0.00 0.00 178.44 176.26 2k74 h TRP 31 N 0.00 0.42 -0.62 1.25 7.01 -1.03 -3.15 115.95 119.83 2k74 h TRP 31 Ca -0.00 -0.31 0.12 0.00 2.11 0.00 0.00 58.89 60.81 2k74 h TRP 31 Cb 0.33 -0.02 -0.09 0.00 -2.10 0.00 0.00 29.16 27.28 2k74 h TRP 31 CO 0.00 1.66 0.14 0.74 -2.79 0.00 0.00 178.44 178.18 2k74 h PHE 32 N -0.21 0.22 0.00 2.65 0.04 -1.39 0.22 116.94 118.47 2k74 h PHE 32 Ca -0.36 0.04 -0.10 0.00 2.80 0.00 0.00 57.97 60.35 2k74 h PHE 32 Cb 1.84 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.97 2k74 h PHE 32 CO 0.10 -0.03 -0.46 0.37 -0.60 0.00 0.00 178.31 177.69 2k74 h GLN 33 N 0.27 0.00 0.00 1.51 -0.00 -1.68 0.88 115.11 116.09 2k74 h GLN 33 Ca 0.33 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.92 2k74 h GLN 33 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.96 2k74 h GLN 33 CO -0.41 0.46 -0.28 1.25 0.00 0.00 0.00 178.83 179.85 2k74 h HIS 34 N 0.00 0.00 0.00 3.99 2.76 -0.59 -0.51 115.15 120.80 2k74 h HIS 34 Ca -0.00 0.00 -0.24 0.00 -2.20 0.00 0.00 60.37 57.93 2k74 h HIS 34 Cb 0.86 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.78 2k74 h HIS 34 CO 0.00 0.28 -1.71 0.28 -1.30 0.00 0.00 177.93 175.48 2k74 n VAL 35 N -3.76 1.26 1.54 5.26 0.31 -0.29 -4.49 118.33 118.16 2k74 n VAL 35 Ca -0.01 -0.13 0.08 0.00 -0.01 0.00 0.00 64.34 64.27 2k74 n VAL 35 Cb 0.38 -1.92 0.47 0.00 -0.91 0.00 0.00 33.84 31.86 2k74 n VAL 35 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 2k74 n MET 36 N -4.04 0.77 -4.18 5.55 2.81 0.30 -4.87 117.12 113.46 2k74 n MET 36 Ca -0.31 0.00 -0.31 0.00 -1.81 0.00 0.00 57.70 55.27 2k74 n MET 36 Cb 0.66 -1.32 -0.05 0.00 -0.71 0.00 0.00 33.22 31.79 2k74 n MET 36 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2k74 n LEU 37 N -0.82 -1.59 -4.83 4.03 0.00 -0.21 -4.90 117.00 108.68 2k74 n LEU 37 Ca 0.12 -1.12 -0.32 0.00 0.00 0.00 0.00 56.01 54.69 2k74 n LEU 37 Cb 0.05 -1.94 -0.01 0.00 0.00 0.00 0.00 43.42 41.53 2k74 n LEU 37 CO 0.09 0.39 0.70 -0.76 0.00 0.00 0.00 177.39 177.81 2k74 s LEU 38 N -7.19 3.56 -0.15 -1.96 1.43 -1.17 -5.04 118.68 108.16 2k74 s LEU 38 Ca 0.22 1.67 0.00 0.00 -1.03 0.00 0.00 54.13 54.99 2k74 s LEU 38 Cb -0.12 -4.52 -0.00 0.00 0.03 0.00 0.00 46.19 41.58 2k74 s LEU 38 CO 0.95 -0.84 -0.15 -0.54 0.23 0.00 0.00 176.35 175.99 2k74 s LYS 39 N -4.10 3.24 0.96 1.70 1.02 -1.26 -4.86 119.74 116.44 2k74 s LYS 39 Ca 0.61 -0.74 -0.15 0.00 0.02 0.00 0.00 55.97 55.71 2k74 s LYS 39 Cb -0.13 -2.62 0.18 0.00 -0.52 0.00 0.00 37.83 34.75 2k74 s LYS 39 CO 0.34 0.05 1.22 -1.25 -0.92 0.00 0.00 175.35 174.80 2k74 s PRO 40 N 0.72 0.73 0.24 -1.68 0.04 -1.24 -4.84 135.00 128.98 2k74 s PRO 40 Ca -0.07 -0.11 0.03 0.00 0.04 0.00 0.00 61.00 60.89 2k74 s PRO 40 Cb -0.16 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.55 2k74 s PRO 40 CO 0.01 -2.40 0.10 0.00 0.04 0.00 0.00 177.00 174.76 2k74 h VAL 42 N 1.44 1.23 -0.00 0.00 2.07 -1.87 -2.59 116.25 116.52 2k74 h VAL 42 Ca -0.19 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.56 2k74 h VAL 42 Cb 0.74 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 31.47 2k74 h VAL 42 CO 0.29 0.27 -0.00 -0.07 0.02 0.00 0.00 177.57 178.08 2k74 h LEU 43 N 0.51 0.00 -0.53 2.57 3.38 -1.97 -2.22 115.31 117.05 2k74 h LEU 43 Ca 0.13 -0.41 0.11 0.00 0.09 0.00 0.00 57.88 57.79 2k74 h LEU 43 Cb 0.30 -0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.94 2k74 h LEU 43 CO -0.00 0.41 -0.14 -1.28 0.09 0.00 0.00 178.44 177.52 2k74 h SER 44 N -0.41 -0.53 -0.79 -0.43 0.87 -1.96 0.13 113.55 110.44 2k74 h SER 44 Ca 0.00 0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.71 2k74 h SER 44 Cb 0.41 0.34 -0.04 0.00 -0.44 0.00 0.00 62.40 62.68 2k74 h SER 44 CO 0.00 -0.19 0.43 0.40 -0.53 0.00 0.00 176.83 176.95 2k74 h ILE 45 N -0.01 1.23 -0.60 2.23 2.04 -1.48 -1.36 117.51 119.57 2k74 h ILE 45 Ca 0.26 -0.58 0.07 0.00 1.00 0.00 0.00 64.86 65.61 2k74 h ILE 45 Cb 0.40 0.19 -0.06 0.00 -0.74 0.00 0.00 36.82 36.61 2k74 h ILE 45 CO -0.56 0.26 0.27 0.22 0.00 0.00 0.00 178.15 178.35 2k74 h TYR 46 N 1.09 0.49 -0.45 1.37 5.03 -0.20 0.15 116.97 124.44 2k74 h TYR 46 Ca 0.28 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.56 2k74 h TYR 46 Cb 0.03 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.16 2k74 h TYR 46 CO 0.00 0.19 0.07 0.93 -1.32 0.00 0.00 178.16 178.03 2k74 h GLU 47 N 0.50 0.70 -0.57 1.82 5.08 -0.38 -0.44 114.58 121.29 2k74 h GLU 47 Ca 0.29 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.43 2k74 h GLU 47 Cb 0.28 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2k74 h GLU 47 CO -0.24 0.67 0.09 -0.09 -1.00 0.00 0.00 179.01 178.44 2k74 h ARG 48 N 0.67 0.96 -0.30 2.33 2.43 0.08 -2.80 114.38 117.74 2k74 h ARG 48 Ca 0.15 -0.26 -0.13 0.00 -0.81 0.00 0.00 59.98 58.93 2k74 h ARG 48 Cb 0.32 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2k74 h ARG 48 CO 0.00 0.91 -0.33 0.00 -1.51 0.00 0.00 179.97 179.05 2k74 h ALA 49 N 1.00 0.86 -0.53 2.80 0.00 -0.33 0.11 119.26 123.18 2k74 h ALA 49 Ca 0.17 -0.41 0.07 0.00 0.00 0.00 0.00 54.91 54.75 2k74 h ALA 49 Cb 0.43 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 2k74 h ALA 49 CO 0.01 0.63 0.19 0.00 0.00 0.00 0.00 179.25 180.08 2k74 h ALA 50 N 1.08 0.65 0.04 0.00 0.00 -0.84 0.98 119.26 121.17 2k74 h ALA 50 Ca 0.06 0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 2k74 h ALA 50 Cb 0.84 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.69 2k74 h ALA 50 CO 0.07 -0.21 -0.50 1.25 0.00 0.00 0.00 179.25 179.86 2k74 h LEU 51 N 0.36 0.37 -1.14 0.00 5.85 -1.39 -2.84 115.31 116.53 2k74 h LEU 51 Ca 0.26 -0.84 0.28 0.00 0.84 0.00 0.00 57.88 58.41 2k74 h LEU 51 Cb 0.28 -0.12 -0.12 0.00 0.37 0.00 0.00 40.66 41.08 2k74 h LEU 51 CO -0.26 1.17 0.63 0.15 -0.34 0.00 0.00 178.44 179.79 2k74 h PHE 52 N -0.39 0.86 -0.25 1.25 3.04 -0.45 0.86 116.94 121.86 2k74 h PHE 52 Ca -0.07 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 61.86 2k74 h PHE 52 Cb 1.28 -0.24 -0.01 0.00 2.56 0.00 0.00 35.95 39.54 2k74 h PHE 52 CO 0.18 -0.00 -0.05 0.78 -2.02 0.00 0.00 178.31 177.20 2k74 h GLY 53 N 0.44 0.51 0.91 2.40 0.00 -0.81 -2.89 103.07 103.63 2k74 h GLY 53 Ca 0.66 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.56 2k74 h GLY 53 CO -0.45 0.38 0.10 -2.08 0.00 0.00 0.00 176.54 174.49 2k74 h VAL 54 N 0.22 1.15 -0.90 4.60 2.07 0.17 -2.50 116.25 121.07 2k74 h VAL 54 Ca 0.06 -0.45 0.22 0.00 0.82 0.00 0.00 66.70 67.36 2k74 h VAL 54 Cb 0.51 1.05 -0.16 0.00 -1.52 0.00 0.00 31.29 31.17 2k74 h VAL 54 CO 0.02 0.15 0.00 0.25 0.02 0.00 0.00 177.57 178.01 2k74 h LEU 55 N 0.21 -0.45 -1.27 2.57 5.85 0.51 2.08 115.31 124.81 2k74 h LEU 55 Ca 0.07 0.25 -0.01 0.00 0.84 0.00 0.00 57.88 59.03 2k74 h LEU 55 Cb 0.15 0.44 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2k74 h LEU 55 CO -0.01 -0.28 0.32 1.23 -0.34 0.00 0.00 178.44 179.37 2k74 h GLY 56 N 0.06 0.88 0.59 3.75 0.00 -1.25 -2.02 103.07 105.08 2k74 h GLY 56 Ca 0.51 -0.38 0.08 0.00 0.00 0.00 0.00 47.33 47.54 2k74 h GLY 56 CO -0.82 0.37 0.40 0.00 0.00 0.00 0.00 176.54 176.48 2k74 h ALA 57 N 1.53 0.99 -0.60 3.60 0.00 0.37 -0.29 119.26 124.86 2k74 h ALA 57 Ca 0.21 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2k74 h ALA 57 Cb 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2k74 h ALA 57 CO -0.03 0.04 0.27 0.00 0.00 0.00 0.00 179.25 179.53 2k74 h ALA 58 N 1.40 1.36 -0.69 0.00 0.00 -0.57 0.15 119.26 120.90 2k74 h ALA 58 Ca 0.34 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.13 2k74 h ALA 58 Cb 0.27 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2k74 h ALA 58 CO -0.22 0.49 0.45 1.25 0.00 0.00 0.00 179.25 181.23 2k74 h LEU 59 N 0.84 0.77 -0.06 0.00 5.85 -0.82 0.16 115.31 122.05 2k74 h LEU 59 Ca 0.21 -0.02 -0.16 0.00 0.84 0.00 0.00 57.88 58.76 2k74 h LEU 59 Cb 0.11 -0.19 0.01 0.00 0.37 0.00 0.00 40.66 40.96 2k74 h LEU 59 CO -0.03 0.55 -0.57 0.40 -0.34 0.00 0.00 178.44 178.46 2k74 h ILE 60 N 0.91 1.38 0.00 4.05 1.08 -0.83 -3.17 117.51 120.93 2k74 h ILE 60 Ca 0.26 -1.94 -0.02 0.00 -0.39 0.00 0.00 64.86 62.77 2k74 h ILE 60 Cb -0.08 2.34 -0.00 0.00 -3.07 0.00 0.00 36.82 36.01 2k74 h ILE 60 CO -0.07 0.58 -0.08 1.23 -0.69 0.00 0.00 178.15 179.11 2k74 h GLY 61 N 0.06 0.00 0.56 5.37 0.00 -0.49 -0.47 103.07 108.11 2k74 h GLY 61 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 2k74 h GLY 61 CO 0.11 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.65 2k74 n ALA 62 N -2.35 2.52 0.04 3.60 0.00 0.56 -3.06 120.51 121.82 2k74 n ALA 62 Ca -0.02 -0.10 -0.19 0.00 0.00 0.00 0.00 53.44 53.12 2k74 n ALA 62 Cb 0.18 -1.27 -0.14 0.00 0.00 0.00 0.00 19.45 18.22 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 1.52 -0.14 0.00 2.04 -1.17 -3.45 117.51 116.30 2k74 h ILE 63 Ca 0.00 -2.47 -0.05 0.00 1.00 0.00 0.00 64.86 63.34 2k74 h ILE 63 Cb 0.00 3.13 -0.14 0.00 -0.74 0.00 0.00 36.82 39.07 2k74 h ILE 63 CO 0.00 0.70 -0.14 0.00 0.00 0.00 0.00 178.15 178.70 2k74 n ALA 64 N -2.66 -3.36 0.93 1.87 0.00 -1.22 -5.01 120.51 111.06 2k74 n ALA 64 Ca -0.13 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.01 2k74 n ALA 64 Cb 0.79 -2.98 0.00 0.00 0.00 0.00 0.00 19.45 17.26 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 2.06 0.80 0.00 0.00 -0.04 -1.17 -2.72 135.00 133.93 2k74 n PRO 65 Ca 0.07 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.61 2k74 n PRO 65 Cb 0.67 -1.33 -0.05 0.00 -0.04 0.00 0.00 33.50 32.74 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 0.00 1.67 -4.22 0.54 2.85 -1.26 -4.78 118.16 112.96 2k74 n LYS 66 Ca 0.00 -0.37 -0.28 0.00 -1.05 0.00 0.00 58.31 56.61 2k74 n LYS 66 Cb 0.17 -1.28 -0.04 0.00 -0.65 0.00 0.00 35.03 33.23 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 -2.28 1.62 -1.25 0.58 -4.23 -1.10 -4.95 115.64 104.03 2k74 s THR 67 Ca 0.10 -1.70 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 2k74 s THR 67 Cb 0.13 -2.31 0.00 0.00 1.34 0.00 0.00 72.50 71.65 2k74 s THR 67 CO 0.56 0.00 0.27 -2.65 -0.54 0.00 0.00 174.62 172.26 2k74 n PRO 68 N -1.50 0.00 -0.18 3.99 -0.02 -1.26 -2.55 135.00 133.48 2k74 n PRO 68 Ca -0.07 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.54 2k74 n PRO 68 Cb 0.65 -1.44 0.47 0.00 -0.02 0.00 0.00 33.50 33.16 2k74 n PRO 68 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2k74 h LEU 69 N 0.00 0.46 -0.28 2.45 5.85 -1.93 -3.01 115.31 118.86 2k74 h LEU 69 Ca 0.00 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2k74 h LEU 69 Cb 0.00 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2k74 h LEU 69 CO 0.00 0.25 -0.16 0.54 -0.34 0.00 0.00 178.44 178.72 2k74 n ARG 70 N -4.49 -0.12 0.26 1.25 1.74 -1.06 0.22 116.66 114.45 2k74 n ARG 70 Ca 0.14 1.05 0.17 0.00 -0.77 0.00 0.00 57.85 58.45 2k74 n ARG 70 Cb 0.48 -1.57 0.81 0.00 -1.02 0.00 0.00 32.46 31.16 2k74 n ARG 70 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 2k74 h TYR 71 N 0.00 0.00 0.03 -1.55 0.05 -1.84 0.53 116.97 114.19 2k74 h TYR 71 Ca 0.04 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.77 2k74 h TYR 71 Cb 0.11 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.86 2k74 h TYR 71 CO -0.88 0.00 -0.24 0.28 -1.05 0.00 0.00 178.16 176.27 2k74 h VAL 72 N 0.00 1.68 0.04 -2.88 2.07 0.26 -3.12 116.25 114.30 2k74 h VAL 72 Ca 0.06 -2.29 -0.24 0.00 0.82 0.00 0.00 66.70 65.05 2k74 h VAL 72 Cb 0.76 3.21 0.00 0.00 -1.52 0.00 0.00 31.29 33.74 2k74 h VAL 72 CO -0.00 0.61 -1.02 0.00 0.02 0.00 0.00 177.57 177.18 2k74 h ALA 73 N 0.08 0.31 0.00 1.67 0.00 0.13 -2.98 119.26 118.47 2k74 h ALA 73 Ca -0.04 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.11 2k74 h ALA 73 Cb 1.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2k74 h ALA 73 CO 0.05 0.88 0.00 -1.33 0.00 0.00 0.00 179.25 178.84 2k74 n MET 74 N -3.67 0.01 -0.06 0.00 2.00 0.18 -1.95 117.12 113.63 2k74 n MET 74 Ca -0.07 0.37 0.00 0.00 0.00 0.00 0.00 57.70 58.00 2k74 n MET 74 Cb 0.89 -1.50 0.29 0.00 0.00 0.00 0.00 33.22 32.90 2k74 n MET 74 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 175.97 175.73 2k74 h VAL 75 N 0.00 1.19 0.06 2.03 3.04 -1.45 0.10 116.25 121.22 2k74 h VAL 75 Ca 0.00 -0.62 -0.31 0.00 -1.01 0.00 0.00 66.70 64.76 2k74 h VAL 75 Cb 0.12 0.69 -0.03 0.00 -2.01 0.00 0.00 31.29 30.06 2k74 h VAL 75 CO 0.00 0.24 -1.68 0.40 -1.01 0.00 0.00 177.57 175.52 2k74 h ILE 76 N 0.65 0.94 0.04 3.17 1.08 -1.60 -2.92 117.51 118.87 2k74 h ILE 76 Ca 0.15 -2.70 -0.00 0.00 -0.39 0.00 0.00 64.86 61.92 2k74 h ILE 76 Cb 0.19 2.56 0.00 0.00 -3.07 0.00 0.00 36.82 36.50 2k74 h ILE 76 CO -0.01 0.70 -0.02 -0.25 -0.69 0.00 0.00 178.15 177.88 2k74 h TRP 77 N 0.03 -0.05 -0.28 1.37 2.91 -1.39 -2.51 115.95 116.03 2k74 h TRP 77 Ca -0.29 -0.00 -0.06 0.00 1.13 0.00 0.00 58.89 59.68 2k74 h TRP 77 Cb 2.00 0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 30.66 2k74 h TRP 77 CO 0.03 0.02 -0.04 -0.07 -1.03 0.00 0.00 178.44 177.36 2k74 h LEU 78 N -0.11 0.52 -0.88 0.65 4.07 -0.95 -1.68 115.31 116.93 2k74 h LEU 78 Ca -0.01 -0.34 0.23 0.00 0.08 0.00 0.00 57.88 57.85 2k74 h LEU 78 Cb 0.09 -0.14 -0.14 0.00 1.08 0.00 0.00 40.66 41.55 2k74 h LEU 78 CO 0.01 0.74 0.20 0.22 -1.08 0.00 0.00 178.44 178.54 2k74 h TYR 79 N 0.30 0.29 0.00 1.13 3.20 -1.38 0.88 116.97 121.38 2k74 h TYR 79 Ca 0.08 0.05 -0.07 0.00 3.14 0.00 0.00 58.73 61.93 2k74 h TYR 79 Cb 0.50 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 2k74 h TYR 79 CO 0.04 -0.23 -0.33 0.66 -1.64 0.00 0.00 178.16 176.66 2k74 h SER 80 N 0.18 0.00 0.96 -2.11 4.64 -1.32 -2.68 113.55 113.22 2k74 h SER 80 Ca 0.55 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.82 2k74 h SER 80 Cb 1.10 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.20 2k74 h SER 80 CO -0.67 0.33 -0.46 0.00 -0.87 0.00 0.00 176.83 175.16 2k74 h ALA 81 N 1.67 -1.33 0.27 5.18 0.00 0.17 0.58 119.26 125.80 2k74 h ALA 81 Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2k74 h ALA 81 Cb 1.25 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.54 2k74 h ALA 81 CO 0.04 -1.24 -0.13 0.35 0.00 0.00 0.00 179.25 178.28 2k74 h PHE 82 N -1.30 -0.33 0.07 0.00 3.57 -1.51 -2.81 116.94 114.63 2k74 h PHE 82 Ca -0.13 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.36 2k74 h PHE 82 Cb 0.99 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.84 2k74 h PHE 82 CO 0.01 0.01 -0.03 -0.09 -2.23 0.00 0.00 178.31 175.98 2k74 h ARG 83 N -0.94 -0.09 -0.54 1.11 9.65 -1.59 -0.85 114.38 121.12 2k74 h ARG 83 Ca -0.04 0.01 0.10 0.00 -1.10 0.00 0.00 59.98 58.95 2k74 h ARG 83 Cb 0.49 0.02 -0.08 0.00 -1.39 0.00 0.00 29.97 29.01 2k74 h ARG 83 CO 0.06 0.22 0.06 0.78 2.80 0.00 0.00 179.97 183.89 2k74 h GLY 84 N -0.42 0.63 1.81 2.80 0.00 0.07 0.19 103.07 108.15 2k74 h GLY 84 Ca -0.01 0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.28 2k74 h GLY 84 CO 0.02 -0.12 -0.19 -2.08 0.00 0.00 0.00 176.54 174.16 2k74 h VAL 85 N 0.18 1.21 -0.28 4.60 2.07 -1.35 -2.04 116.25 120.64 2k74 h VAL 85 Ca 0.28 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 2k74 h VAL 85 Cb 0.42 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 2k74 h VAL 85 CO -0.41 0.29 0.04 -0.61 0.02 0.00 0.00 177.57 176.91 2k74 h GLN 86 N 0.21 0.40 0.12 1.57 4.15 0.84 -2.62 115.11 119.79 2k74 h GLN 86 Ca 0.04 -0.06 -0.28 0.00 0.77 0.00 0.00 58.65 59.11 2k74 h GLN 86 Cb 0.47 -0.07 0.03 0.00 0.21 0.00 0.00 27.48 28.11 2k74 h GLN 86 CO 0.03 0.40 -1.19 -0.07 -1.93 0.00 0.00 178.83 176.07 2k74 h LEU 87 N 0.40 0.83 -1.48 -2.39 3.38 -0.60 -3.17 115.31 112.28 2k74 h LEU 87 Ca 0.09 -0.83 0.18 0.00 0.09 0.00 0.00 57.88 57.41 2k74 h LEU 87 Cb 0.20 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 2k74 h LEU 87 CO -0.00 1.58 0.57 0.71 0.09 0.00 0.00 178.44 181.40 2k74 h THR 88 N 0.20 0.73 0.10 0.22 1.35 -1.04 -1.76 112.91 112.71 2k74 h THR 88 Ca -0.18 -0.16 -0.01 0.00 -0.55 0.00 0.00 66.41 65.51 2k74 h THR 88 Cb 1.87 0.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 2k74 h THR 88 CO 0.23 0.08 -0.05 1.88 -0.25 0.00 0.00 175.52 177.41 2k74 h TYR 89 N 0.46 -0.13 -1.35 4.73 0.05 -1.53 -2.68 116.97 116.52 2k74 h TYR 89 Ca 0.45 -0.00 0.39 0.00 0.05 0.00 0.00 58.73 59.62 2k74 h TYR 89 Cb 1.03 0.04 -0.06 0.00 1.01 0.00 0.00 36.73 38.75 2k74 h TYR 89 CO -0.00 0.33 0.96 0.93 -1.05 0.00 0.00 178.16 179.32 2k74 h GLU 90 N -0.66 0.04 0.00 4.88 4.39 -1.31 0.56 114.58 122.49 2k74 h GLU 90 Ca -0.01 -0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.56 2k74 h GLU 90 Cb 0.52 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.17 2k74 h GLU 90 CO 0.02 0.03 -0.47 1.25 -1.16 0.00 0.00 179.01 178.69 2k74 h HIS 91 N 0.04 0.47 -0.01 4.33 2.76 -1.35 -2.91 115.15 118.48 2k74 h HIS 91 Ca 0.66 -0.25 -0.00 0.00 -2.20 0.00 0.00 60.37 58.58 2k74 h HIS 91 Cb 2.53 -0.05 -0.00 0.00 1.55 0.00 0.00 27.41 31.44 2k74 h HIS 91 CO -0.00 1.07 -0.00 1.79 -1.30 0.00 0.00 177.93 179.48 2k74 h THR 92 N -0.27 1.30 -0.35 6.26 1.35 0.19 0.87 112.91 122.27 2k74 h THR 92 Ca -0.06 -0.89 0.08 0.00 -0.55 0.00 0.00 66.41 64.98 2k74 h THR 92 Cb 1.20 1.88 -0.08 0.00 -1.73 0.00 0.00 68.15 69.41 2k74 h THR 92 CO 0.09 0.24 -0.26 0.24 -0.25 0.00 0.00 175.52 175.58 2k74 h MET 93 N -0.34 -0.20 -0.03 4.72 2.07 -0.29 0.19 114.93 121.04 2k74 h MET 93 Ca 0.00 0.01 -0.00 0.00 -2.07 0.00 0.00 59.70 57.65 2k74 h MET 93 Cb 0.38 0.05 -0.00 0.00 -1.87 0.00 0.00 31.60 30.16 2k74 h MET 93 CO 0.00 -0.14 0.01 1.25 1.07 0.00 0.00 176.91 179.11 2k74 h LEU 94 N -0.21 0.04 -1.42 1.22 5.85 -1.51 1.81 115.31 121.09 2k74 h LEU 94 Ca 0.17 -0.19 0.25 0.00 0.84 0.00 0.00 57.88 58.95 2k74 h LEU 94 Cb 0.48 -0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.41 2k74 h LEU 94 CO -0.47 0.22 0.66 -0.61 -0.34 0.00 0.00 178.44 177.90 2k74 h GLN 95 N -0.14 0.38 -0.00 1.25 5.75 -0.04 0.53 115.11 122.84 2k74 h GLN 95 Ca 0.01 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2k74 h GLN 95 Cb 0.19 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 28.66 2k74 h GLN 95 CO -0.00 0.25 -0.88 -0.11 -2.65 0.00 0.00 178.83 175.44 2k74 n LEU 96 N -4.58 1.23 -3.53 -2.39 7.94 0.59 -4.63 117.00 111.64 2k74 n LEU 96 Ca 0.24 -0.56 -0.27 0.00 -1.11 0.00 0.00 56.01 54.31 2k74 n LEU 96 Cb 0.84 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.69 2k74 n LEU 96 CO 0.28 0.28 -0.12 0.00 -1.11 0.00 0.00 177.39 176.71 2k74 n TYR 97 N -1.16 1.73 -1.67 1.96 9.36 0.61 -5.05 117.16 122.93 2k74 n TYR 97 Ca 0.05 -3.90 -0.57 0.00 3.32 0.00 0.00 57.90 56.79 2k74 n TYR 97 Cb 0.36 -0.35 -0.07 0.00 -0.63 0.00 0.00 39.34 38.64 2k74 n TYR 97 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 2k74 n PRO 98 N 1.77 1.06 -4.07 2.98 -0.02 -0.98 -4.41 135.00 131.33 2k74 n PRO 98 Ca 0.25 0.38 -0.10 0.00 -2.02 0.00 0.00 63.50 62.01 2k74 n PRO 98 Cb 0.43 -2.09 -0.11 0.00 -0.02 0.00 0.00 33.50 31.71 2k74 n PRO 98 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2k74 s SER 99 N 4.01 0.64 -0.95 2.55 0.01 -1.26 -5.08 113.70 113.62 2k74 s SER 99 Ca 1.01 -0.73 -0.24 0.00 1.31 0.00 0.00 55.95 57.29 2k74 s SER 99 Cb -1.09 0.11 -0.05 0.00 0.21 0.00 0.00 66.02 65.20 2k74 s SER 99 CO 0.65 -0.38 1.92 -2.16 0.41 0.00 0.00 173.24 173.68 2k74 s PRO 100 N -2.55 2.60 1.01 12.44 0.04 -1.26 -4.96 135.00 142.31 2k74 s PRO 100 Ca -0.03 -0.46 -0.18 0.00 0.04 0.00 0.00 61.00 60.37 2k74 s PRO 100 Cb -0.03 -5.10 -0.06 0.00 0.04 0.00 0.00 34.50 29.35 2k74 s PRO 100 CO -0.04 -3.41 -0.43 1.97 0.04 0.00 0.00 177.00 175.14 2k74 n PHE 101 N 13.79 -2.72 -1.89 0.56 1.16 -1.26 -4.94 117.46 122.16 2k74 n PHE 101 Ca 0.41 0.20 -0.31 0.00 -1.87 0.00 0.00 57.45 55.88 2k74 n PHE 101 Cb 0.47 -1.55 0.02 0.00 -1.61 0.00 0.00 39.48 36.81 2k74 n PHE 101 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2k74 s ALA 102 N -2.16 3.03 0.00 1.98 0.00 -1.26 -4.92 121.76 118.43 2k74 s ALA 102 Ca 0.47 -0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.24 2k74 s ALA 102 Cb -0.13 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 19.94 2k74 s ALA 102 CO 0.72 -0.85 1.75 0.25 0.00 0.00 0.00 175.76 177.63 2k74 n THR 103 N -2.84 1.75 0.03 0.00 -2.24 -1.26 -3.09 114.28 106.63 2k74 n THR 103 Ca 0.06 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 2k74 n THR 103 Cb 0.55 -1.40 -0.01 0.00 -2.10 0.00 0.00 70.33 67.38 2k74 n THR 103 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2k74 n SER 104 N 1.36 1.16 0.03 3.42 3.41 -1.26 -4.73 113.62 117.00 2k74 n SER 104 Ca 0.00 -0.40 -0.10 0.00 -0.26 0.00 0.00 58.87 58.11 2k74 n SER 104 Cb 0.48 1.01 -0.04 0.00 -0.26 0.00 0.00 64.21 65.40 2k74 n SER 104 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2k74 h ASP 105 N 0.00 -0.76 0.00 4.04 3.04 -1.94 -3.28 116.42 117.52 2k74 h ASP 105 Ca 0.00 0.11 0.00 0.00 -3.24 0.00 0.00 57.03 53.90 2k74 h ASP 105 Cb 0.03 0.32 0.00 0.00 -1.04 0.00 0.00 39.33 38.64 2k74 h ASP 105 CO 0.00 -0.31 0.00 0.49 -2.04 0.00 0.00 179.24 177.38 2k74 n PHE 106 N -5.37 0.00 -3.29 4.15 3.72 -1.26 -4.18 117.46 111.23 2k74 n PHE 106 Ca -0.04 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.94 2k74 n PHE 106 Cb 0.29 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.74 2k74 n PHE 106 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 2k74 s MET 107 N -0.44 3.39 -0.10 -1.08 -1.94 -1.24 -4.78 119.30 113.11 2k74 s MET 107 Ca 0.00 -0.44 -0.30 0.00 -1.71 0.00 0.00 55.69 53.24 2k74 s MET 107 Cb 0.00 -3.88 -0.03 0.00 2.01 0.00 0.00 34.83 32.93 2k74 s MET 107 CO 0.00 -0.73 1.35 0.14 -0.01 0.00 0.00 175.02 175.77 2k74 s VAL 108 N 2.28 4.05 -0.72 -6.03 -7.23 -1.25 -4.84 120.40 106.67 2k74 s VAL 108 Ca 0.15 1.32 -0.27 0.00 -1.81 0.00 0.00 61.98 61.38 2k74 s VAL 108 Cb -0.16 -3.85 0.02 0.00 0.56 0.00 0.00 36.38 32.95 2k74 s VAL 108 CO 0.14 -0.08 1.39 -0.60 -0.31 0.00 0.00 175.10 175.63 2k74 s ARG 109 N 3.25 3.09 0.25 4.82 3.52 -1.26 -4.99 118.95 127.63 2k74 s ARG 109 Ca 0.60 -0.10 -0.10 0.00 -0.13 0.00 0.00 55.73 56.00 2k74 s ARG 109 Cb -0.26 -4.24 -0.07 0.00 -1.56 0.00 0.00 34.95 28.82 2k74 s ARG 109 CO 0.20 -2.26 0.57 -0.59 -0.81 0.00 0.00 175.30 172.42 2k74 s PHE 110 N 6.34 3.42 0.60 5.12 -0.12 -1.26 -5.06 117.98 127.02 2k74 s PHE 110 Ca 0.41 0.90 -0.19 0.00 -0.05 0.00 0.00 56.93 58.01 2k74 s PHE 110 Cb -0.09 -2.28 -0.03 0.00 -0.63 0.00 0.00 43.02 39.99 2k74 s PHE 110 CO 0.16 0.24 1.21 -1.25 -0.05 0.00 0.00 175.22 175.52 2k74 s PRO 111 N -2.90 2.92 -0.01 1.99 0.04 -1.26 -4.96 135.00 130.83 2k74 s PRO 111 Ca 0.48 1.83 0.22 0.00 0.04 0.00 0.00 61.00 63.56 2k74 s PRO 111 Cb -0.11 -1.92 -0.25 0.00 0.04 0.00 0.00 34.50 32.25 2k74 s PRO 111 CO 0.21 -1.24 0.72 -1.91 0.04 0.00 0.00 177.00 174.82 2k74 n GLU 112 N -1.65 0.34 0.00 4.56 2.13 -1.26 -4.09 120.64 120.66 2k74 n GLU 112 Ca 0.14 -0.09 0.14 0.00 0.66 0.00 0.00 57.16 58.01 2k74 n GLU 112 Cb 0.50 -1.52 0.62 0.00 0.27 0.00 0.00 31.44 31.30 2k74 n GLU 112 CO 0.00 0.00 0.00 -2.67 -0.41 0.00 0.00 177.13 174.05 2k74 n TRP 113 N -1.91 0.00 -3.69 4.31 2.14 -1.26 -4.35 117.44 112.68 2k74 n TRP 113 Ca 0.00 0.00 -0.28 0.00 2.07 0.00 0.00 57.50 59.29 2k74 n TRP 113 Cb 0.45 -0.16 -0.11 0.00 -0.81 0.00 0.00 31.31 30.68 2k74 n TRP 113 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2k74 s LEU 114 N -2.42 3.35 0.00 5.67 1.43 -1.26 -4.95 118.68 120.51 2k74 s LEU 114 Ca 0.30 -3.47 0.00 0.00 -1.03 0.00 0.00 54.13 49.93 2k74 s LEU 114 Cb 0.20 -1.13 0.00 0.00 0.03 0.00 0.00 46.19 45.29 2k74 s LEU 114 CO 0.46 -0.13 0.17 -2.65 0.23 0.00 0.00 176.35 174.43 2k74 n PRO 115 N 2.41 0.00 -0.02 1.29 -0.02 -1.26 -2.36 135.00 135.04 2k74 n PRO 115 Ca 0.23 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.81 2k74 n PRO 115 Cb 0.40 -1.32 0.50 0.00 -0.02 0.00 0.00 33.50 33.06 2k74 n PRO 115 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2k74 h LEU 116 N 0.00 0.34 0.02 2.45 -0.00 -1.92 1.30 115.31 117.50 2k74 h LEU 116 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 57.88 57.49 2k74 h LEU 116 Cb 0.00 -0.07 -0.06 0.00 -0.00 0.00 0.00 40.66 40.53 2k74 h LEU 116 CO 0.00 0.22 -2.22 0.47 -0.00 0.00 0.00 178.44 176.91 2k74 n ASP 117 N -4.47 1.98 -0.10 -0.43 8.00 -1.00 -3.36 116.55 117.16 2k74 n ASP 117 Ca 0.07 0.19 -0.11 0.00 0.71 0.00 0.00 54.79 55.64 2k74 n ASP 117 Cb 0.26 -0.73 -0.03 0.00 -0.02 0.00 0.00 41.12 40.60 2k74 n ASP 117 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2k74 h LYS 118 N -0.52 0.50 0.00 -1.24 3.64 -1.70 0.12 116.57 117.37 2k74 h LYS 118 Ca -0.56 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 58.67 2k74 h LYS 118 Cb 1.72 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.49 2k74 h LYS 118 CO -0.21 0.63 0.00 1.87 -2.27 0.00 0.00 179.45 179.47 2k74 n TRP 119 N -4.61 0.79 -3.23 1.91 -0.00 0.44 -4.03 117.44 108.72 2k74 n TRP 119 Ca -0.03 0.28 -0.23 0.00 -0.00 0.00 0.00 57.50 57.52 2k74 n TRP 119 Cb 0.23 -0.95 -0.07 0.00 -0.00 0.00 0.00 31.31 30.52 2k74 n TRP 119 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 2k74 n VAL 120 N -2.19 -0.86 0.44 5.87 0.31 -0.82 -4.94 118.33 116.13 2k74 n VAL 120 Ca 0.04 -3.47 0.13 0.00 -0.01 0.00 0.00 64.34 61.02 2k74 n VAL 120 Cb 0.30 -1.50 0.28 0.00 -0.91 0.00 0.00 33.84 32.02 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 4.76 0.00 0.03 5.55 0.13 -1.13 -3.34 132.00 137.99 2k74 h PRO 121 Ca 0.15 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.30 2k74 h PRO 121 Cb 0.91 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.00 2k74 h PRO 121 CO 0.39 0.00 -0.23 0.37 -0.23 0.00 0.00 178.00 178.30 2k74 h GLN 122 N 0.00 -0.37 -2.27 0.86 -0.00 -1.92 -1.29 115.11 110.13 2k74 h GLN 122 Ca 0.00 0.03 -0.75 0.00 -0.00 0.00 0.00 58.65 57.93 2k74 h GLN 122 Cb 0.86 0.08 -0.31 0.00 0.00 0.00 0.00 27.48 28.11 2k74 h GLN 122 CO 0.00 -0.25 0.57 1.55 0.00 0.00 0.00 178.83 180.70 2k74 n VAL 123 N -5.36 5.27 0.00 2.39 3.14 -1.25 -4.39 118.33 118.12 2k74 n VAL 123 Ca -0.05 -5.88 0.00 0.00 -2.96 0.00 0.00 64.34 55.45 2k74 n VAL 123 Cb 0.27 -1.51 0.00 0.00 -1.06 0.00 0.00 33.84 31.54 2k74 n VAL 123 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 2k74 n PHE 124 N -0.10 -0.47 -1.84 1.45 -0.00 -1.14 -5.02 117.46 110.35 2k74 n PHE 124 Ca 0.42 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.45 2k74 n PHE 124 Cb 0.30 0.09 -0.03 0.00 -0.00 0.00 0.00 39.48 39.84 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 -1.25 2.34 0.22 -2.13 0.11 -0.50 -5.00 120.40 114.20 2k74 s VAL 125 Ca 0.00 0.25 0.03 0.00 -2.93 0.00 0.00 61.98 59.33 2k74 s VAL 125 Cb 0.00 -3.16 -0.03 0.00 -1.53 0.00 0.00 36.38 31.66 2k74 s VAL 125 CO 0.00 0.02 0.36 0.00 -3.33 0.00 0.00 175.10 172.15 2k74 s ALA 126 N 1.11 3.91 -0.29 1.54 0.00 -1.26 -5.01 121.76 121.75 2k74 s ALA 126 Ca 0.72 -1.10 0.03 0.00 0.00 0.00 0.00 51.96 51.61 2k74 s ALA 126 Cb -0.46 -1.81 0.20 0.00 0.00 0.00 0.00 23.12 21.04 2k74 s ALA 126 CO 0.32 0.32 0.67 -1.54 0.00 0.00 0.00 175.76 175.54 2k74 s SER 127 N -3.69 -1.41 0.00 0.00 1.04 -1.23 -4.90 113.70 103.51 2k74 s SER 127 Ca 0.35 0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.92 2k74 s SER 127 Cb -0.10 1.89 0.00 0.00 0.10 0.00 0.00 66.02 67.91 2k74 s SER 127 CO 0.30 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.87 2k74 n GLY 128 N 5.33 0.59 3.90 7.32 0.00 -1.20 -3.73 105.19 117.40 2k74 n GLY 128 Ca 0.06 -1.83 -0.29 0.00 0.00 0.00 0.00 46.02 43.95 2k74 n GLY 128 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k74 s ASP 129 N -2.62 6.48 -0.19 1.61 2.15 -1.26 -4.75 116.67 118.09 2k74 s ASP 129 Ca 0.00 0.68 -0.07 0.00 0.43 0.00 0.00 52.55 53.59 2k74 s ASP 129 Cb 0.00 -2.13 -0.04 0.00 -0.30 0.00 0.00 42.92 40.45 2k74 s ASP 129 CO 0.00 -0.11 0.05 0.00 -0.17 0.00 0.00 175.17 174.94 2k74 n ALA 131 N 3.72 0.00 -1.77 0.00 0.00 -1.26 -5.05 120.51 116.16 2k74 n ALA 131 Ca -0.17 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.91 2k74 n ALA 131 Cb 0.52 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.98 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 -0.98 3.45 -0.05 0.00 -6.30 -1.26 -4.99 118.70 108.58 2k74 s GLU 132 Ca 0.00 1.80 -0.20 0.00 -2.50 0.00 0.00 54.97 54.07 2k74 s GLU 132 Cb 0.00 -2.21 -0.05 0.00 0.00 0.00 0.00 34.13 31.87 2k74 s GLU 132 CO 0.00 -0.81 0.57 0.50 0.02 0.00 0.00 175.26 175.54 2k74 s ARG 133 N -2.97 4.33 0.00 4.30 3.52 -1.26 -4.92 118.95 121.95 2k74 s ARG 133 Ca 0.69 0.66 0.00 0.00 -0.13 0.00 0.00 55.73 56.95 2k74 s ARG 133 Cb -0.29 -3.38 0.00 0.00 -1.56 0.00 0.00 34.95 29.72 2k74 s ARG 133 CO 0.34 0.27 0.00 1.04 -0.81 0.00 0.00 175.30 176.13 2k74 n GLN 134 N 3.16 2.84 -3.65 5.12 1.13 -1.26 -5.09 117.38 119.63 2k74 n GLN 134 Ca -0.06 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 54.97 2k74 n GLN 134 Cb 0.51 -0.75 -0.07 0.00 0.11 0.00 0.00 30.24 30.05 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 -1.08 -0.28 0.07 1.08 -0.00 -1.26 -5.12 118.94 112.34 2k74 s TRP 135 Ca 0.00 0.61 -0.02 0.00 -0.00 0.00 0.00 56.10 56.69 2k74 s TRP 135 Cb 0.00 0.29 -0.03 0.00 -0.00 0.00 0.00 33.47 33.72 2k74 s TRP 135 CO 0.00 -0.14 0.01 0.16 -0.00 0.00 0.00 176.95 176.98 2k74 s ASP 136 N 0.75 0.42 -0.01 5.86 -4.77 -1.26 -3.50 116.67 114.15 2k74 s ASP 136 Ca -0.03 -0.98 0.08 0.00 -3.30 0.00 0.00 52.55 48.32 2k74 s ASP 136 Cb -0.04 0.23 -0.02 0.00 -1.09 0.00 0.00 42.92 42.00 2k74 s ASP 136 CO -0.12 -0.63 -0.26 0.12 0.70 0.00 0.00 175.17 174.98 2k74 s PHE 137 N -3.93 2.34 -0.89 2.11 5.36 0.13 -4.61 117.98 118.51 2k74 s PHE 137 Ca 0.09 -0.43 0.00 0.00 -0.96 0.00 0.00 56.93 55.63 2k74 s PHE 137 Cb 0.07 -1.49 0.00 0.00 -0.34 0.00 0.00 43.02 41.26 2k74 s PHE 137 CO -0.09 -0.01 0.00 -0.11 -1.46 0.00 0.00 175.22 173.55 2k74 n LEU 138 N 2.36 -0.47 0.00 6.12 0.00 -1.26 0.14 117.00 123.89 2k74 n LEU 138 Ca -0.16 0.21 0.00 0.00 0.00 0.00 0.00 56.01 56.06 2k74 n LEU 138 Cb 0.51 -1.72 0.00 0.00 0.00 0.00 0.00 43.42 42.21 2k74 n LEU 138 CO 0.23 -0.57 0.00 0.61 0.00 0.00 0.00 177.39 177.66 2k74 n GLY 139 N -0.02 0.68 3.21 -3.96 0.00 -1.26 -5.07 105.19 98.77 2k74 n GLY 139 Ca -0.08 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 45.00 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 2.01 0.45 0.99 2.01 0.37 -5.07 118.68 119.44 2k74 s LEU 140 Ca 0.00 -0.39 -0.23 0.00 0.01 0.00 0.00 54.13 53.52 2k74 s LEU 140 Cb 0.00 -1.10 -0.08 0.00 0.01 0.00 0.00 46.19 45.03 2k74 s LEU 140 CO 0.00 0.23 1.11 -1.83 1.01 0.00 0.00 176.35 176.87 2k74 s GLU 141 N -0.29 3.85 0.14 1.70 -1.05 -1.26 0.21 118.70 122.00 2k74 s GLU 141 Ca 0.03 1.64 -0.29 0.00 -0.15 0.00 0.00 54.97 56.20 2k74 s GLU 141 Cb -0.10 -2.38 -0.04 0.00 -0.44 0.00 0.00 34.13 31.18 2k74 s GLU 141 CO 0.01 -0.44 1.57 0.52 0.95 0.00 0.00 175.26 177.86 2k74 h MET 142 N 2.06 -0.37 -1.06 -4.83 2.86 -1.95 -0.27 114.93 111.37 2k74 h MET 142 Ca -0.49 0.03 0.41 0.00 -2.06 0.00 0.00 59.70 57.58 2k74 h MET 142 Cb 1.24 0.08 -0.15 0.00 0.06 0.00 0.00 31.60 32.83 2k74 h MET 142 CO 0.60 -0.25 0.62 -2.30 1.06 0.00 0.00 176.91 176.65 2k74 n PRO 143 N -5.41 -0.05 0.01 -0.22 -0.02 -1.26 0.08 135.00 128.13 2k74 n PRO 143 Ca -0.02 1.22 -0.12 0.00 -2.02 0.00 0.00 63.50 62.56 2k74 n PRO 143 Cb 0.35 -2.27 -0.09 0.00 -0.02 0.00 0.00 33.50 31.47 2k74 n PRO 143 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2k74 h GLN 144 N 0.00 -0.10 0.41 -0.52 4.20 -1.43 -2.73 115.11 114.95 2k74 h GLN 144 Ca 0.79 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 59.50 2k74 h GLN 144 Cb 2.28 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 30.06 2k74 h GLN 144 CO -0.59 0.45 -0.42 -1.49 -0.67 0.00 0.00 178.83 176.11 2k74 h TRP 145 N -0.77 -1.15 -1.04 2.96 4.06 0.03 -0.85 115.95 119.19 2k74 h TRP 145 Ca -0.01 0.01 0.35 0.00 2.06 0.00 0.00 58.89 61.29 2k74 h TRP 145 Cb 0.59 0.45 -0.15 0.00 -1.00 0.00 0.00 29.16 29.06 2k74 h TRP 145 CO 0.12 -0.58 0.60 1.25 -3.56 0.00 0.00 178.44 176.28 2k74 h LEU 146 N -0.85 0.46 -1.32 -4.49 5.85 -0.75 2.91 115.31 117.11 2k74 h LEU 146 Ca -0.04 0.19 0.12 0.00 0.84 0.00 0.00 57.88 59.00 2k74 h LEU 146 Cb 0.76 0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.87 2k74 h LEU 146 CO -0.07 -0.17 0.55 0.25 -0.34 0.00 0.00 178.44 178.66 2k74 h LEU 147 N 0.26 0.65 -0.59 2.25 6.46 -0.83 0.50 115.31 124.01 2k74 h LEU 147 Ca 0.75 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 58.53 2k74 h LEU 147 Cb 1.85 -0.10 -0.03 0.00 -0.73 0.00 0.00 40.66 41.65 2k74 h LEU 147 CO -0.59 0.35 0.31 1.23 -0.62 0.00 0.00 178.44 179.12 2k74 h GLY 148 N 0.70 0.89 2.00 3.75 0.00 0.56 -1.86 103.07 109.11 2k74 h GLY 148 Ca 0.41 -0.42 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 2k74 h GLY 148 CO -0.17 0.40 -0.44 -2.22 0.00 0.00 0.00 176.54 174.11 2k74 h ILE 149 N 0.80 0.86 -0.43 2.60 5.03 -0.58 -3.04 117.51 122.76 2k74 h ILE 149 Ca 0.21 -1.86 -0.05 0.00 -0.12 0.00 0.00 64.86 63.03 2k74 h ILE 149 Cb 0.07 2.17 -0.02 0.00 -3.03 0.00 0.00 36.82 36.01 2k74 h ILE 149 CO -0.03 0.43 0.06 0.15 -0.68 0.00 0.00 178.15 178.07 2k74 h PHE 150 N 0.00 0.77 -0.41 1.37 3.04 0.53 -1.72 116.94 120.51 2k74 h PHE 150 Ca -0.00 -0.11 -0.11 0.00 3.98 0.00 0.00 57.97 61.72 2k74 h PHE 150 Cb 1.13 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 39.42 2k74 h PHE 150 CO 0.00 0.75 -0.20 -0.84 -2.02 0.00 0.00 178.31 176.00 2k74 h ILE 151 N 0.57 1.27 0.03 1.41 3.07 -1.36 -2.78 117.51 119.73 2k74 h ILE 151 Ca 0.13 -1.31 -0.00 0.00 1.55 0.00 0.00 64.86 65.23 2k74 h ILE 151 Cb 0.40 1.16 0.00 0.00 -0.27 0.00 0.00 36.82 38.11 2k74 h ILE 151 CO 0.01 0.44 -0.02 0.00 -1.05 0.00 0.00 178.15 177.54 2k74 h ALA 152 N 1.07 -0.04 -0.63 0.16 0.00 -1.40 0.21 119.26 118.62 2k74 h ALA 152 Ca 0.10 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.07 2k74 h ALA 152 Cb 0.71 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 2k74 h ALA 152 CO 0.05 -0.50 0.27 1.88 0.00 0.00 0.00 179.25 180.95 2k74 h TYR 153 N -0.09 0.48 0.00 0.00 -1.99 -1.23 0.79 116.97 114.93 2k74 h TYR 153 Ca -0.00 0.03 -0.16 0.00 2.00 0.00 0.00 58.73 60.59 2k74 h TYR 153 Cb 0.08 -0.12 -0.02 0.00 2.00 0.00 0.00 36.73 38.67 2k74 h TYR 153 CO -0.06 0.15 -0.77 1.37 -0.00 0.00 0.00 178.16 178.85 2k74 h LEU 154 N 0.48 0.00 -0.56 3.88 8.10 -1.33 -2.87 115.31 123.01 2k74 h LEU 154 Ca 0.32 0.00 -0.16 0.00 0.11 0.00 0.00 57.88 58.15 2k74 h LEU 154 Cb 0.36 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.57 2k74 h LEU 154 CO -0.28 0.77 -0.54 0.40 -4.11 0.00 0.00 178.44 174.68 2k74 h ILE 155 N 0.00 1.33 -0.02 0.15 2.04 0.34 -2.60 117.51 118.75 2k74 h ILE 155 Ca -0.01 -1.80 -0.22 0.00 1.00 0.00 0.00 64.86 63.84 2k74 h ILE 155 Cb 1.39 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 39.25 2k74 h ILE 155 CO 0.10 0.55 -0.89 -0.37 0.00 0.00 0.00 178.15 177.55 2k74 h VAL 156 N 0.39 1.39 0.03 1.67 -1.51 -0.89 -2.92 116.25 114.40 2k74 h VAL 156 Ca 0.01 -2.35 -0.00 0.00 -1.23 0.00 0.00 66.70 63.12 2k74 h VAL 156 Cb 1.07 2.33 0.00 0.00 -2.13 0.00 0.00 31.29 32.56 2k74 h VAL 156 CO 0.10 0.71 -0.01 0.00 -1.23 0.00 0.00 177.57 177.13 2k74 h ALA 157 N 0.77 -0.04 -0.36 5.19 0.00 -1.48 0.03 119.26 123.37 2k74 h ALA 157 Ca -0.07 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.79 2k74 h ALA 157 Cb 1.51 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.27 2k74 h ALA 157 CO 0.15 -0.43 0.09 0.28 0.00 0.00 0.00 179.25 179.34 2k74 h VAL 158 N -0.23 0.83 -0.12 0.00 2.07 -1.53 -0.80 116.25 116.48 2k74 h VAL 158 Ca -0.00 -0.07 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 2k74 h VAL 158 Cb 0.21 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 2k74 h VAL 158 CO 0.01 0.04 -0.17 -0.07 0.02 0.00 0.00 177.57 177.40 2k74 h LEU 159 N 0.21 0.18 -1.23 2.57 -0.00 -1.43 -1.69 115.31 113.92 2k74 h LEU 159 Ca 0.17 -0.04 -0.07 0.00 -0.00 0.00 0.00 57.88 57.94 2k74 h LEU 159 Cb 0.19 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 40.79 2k74 h LEU 159 CO -0.21 0.37 -0.33 0.58 -0.00 0.00 0.00 178.44 178.84 2k74 h VAL 160 N 0.18 0.95 0.10 1.22 2.07 0.37 0.16 116.25 121.29 2k74 h VAL 160 Ca 0.03 -1.26 -0.15 0.00 0.82 0.00 0.00 66.70 66.15 2k74 h VAL 160 Cb 0.41 1.74 0.01 0.00 -1.52 0.00 0.00 31.29 31.93 2k74 h VAL 160 CO 0.03 0.32 -0.67 0.58 0.02 0.00 0.00 177.57 177.85 2k74 h VAL 161 N 0.00 1.52 0.00 2.57 2.07 -0.43 -3.30 116.25 118.68 2k74 h VAL 161 Ca -0.00 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 65.06 2k74 h VAL 161 Cb 0.71 3.17 0.00 0.00 -1.52 0.00 0.00 31.29 33.66 2k74 h VAL 161 CO 0.04 0.67 0.00 -0.38 0.02 0.00 0.00 177.57 177.93 2k74 n ILE 162 N -4.25 0.65 0.34 4.57 2.08 -0.71 -2.83 119.36 119.21 2k74 n ILE 162 Ca -0.15 -0.04 0.11 0.00 0.56 0.00 0.00 62.75 63.24 2k74 n ILE 162 Cb 0.73 -0.81 0.50 0.00 -0.75 0.00 0.00 39.64 39.31 2k74 n ILE 162 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 2k74 n SER 163 N -2.14 0.62 0.17 4.38 3.41 0.54 -2.67 113.62 117.94 2k74 n SER 163 Ca 0.04 0.68 -0.07 0.00 -0.26 0.00 0.00 58.87 59.26 2k74 n SER 163 Cb 0.33 -0.80 -0.03 0.00 -0.26 0.00 0.00 64.21 63.44 2k74 n SER 163 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2k74 h GLN 164 N 0.00 -0.45 -0.49 4.33 7.50 -1.69 -3.28 115.11 121.03 2k74 h GLN 164 Ca 0.00 0.03 -0.02 0.00 0.50 0.00 0.00 58.65 59.16 2k74 h GLN 164 Cb 0.28 0.10 -0.02 0.00 0.05 0.00 0.00 27.48 27.88 2k74 h GLN 164 CO 0.00 -0.30 0.22 -1.00 -1.50 0.00 0.00 178.83 176.25 2k74 h PRO 165 N -0.65 0.68 -3.43 1.46 0.13 -1.79 -3.49 132.00 124.92 2k74 h PRO 165 Ca -0.05 -0.08 0.01 0.00 -0.87 0.00 0.00 66.00 65.01 2k74 h PRO 165 Cb 0.36 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.35 2k74 h PRO 165 CO 0.08 0.55 -0.80 1.97 -0.23 0.00 0.00 178.00 179.57 2k74 n PHE 166 N -4.37 -3.46 -0.36 1.56 1.16 -1.09 -5.01 117.46 105.89 2k74 n PHE 166 Ca 0.04 1.87 0.00 0.00 -1.87 0.00 0.00 57.45 57.49 2k74 n PHE 166 Cb 0.13 -2.90 0.00 0.00 -1.61 0.00 0.00 39.48 35.10 2k74 n PHE 166 CO 0.00 0.00 0.00 0.36 -1.87 0.00 0.00 176.76 175.25 2k74 n LYS 167 N -2.58 0.00 -2.11 3.97 2.85 -1.26 -5.09 118.16 113.93 2k74 n LYS 167 Ca -0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2k74 n LYS 167 Cb 0.40 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.78 2k74 n LYS 167 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2k74 n ALA 168 N 0.00 -2.03 -0.66 0.58 0.00 -1.26 -4.95 120.51 112.19 2k74 n ALA 168 Ca 0.00 0.49 -0.07 0.00 0.00 0.00 0.00 53.44 53.86 2k74 n ALA 168 Cb 0.04 -1.47 0.11 0.00 0.00 0.00 0.00 19.45 18.13 2k74 n ALA 168 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2k74 n LYS 169 N 1.93 -1.66 -3.71 0.00 5.02 -1.26 -5.06 118.16 113.42 2k74 n LYS 169 Ca 0.00 -0.54 -0.10 0.00 -2.02 0.00 0.00 58.31 55.65 2k74 n LYS 169 Cb 0.00 -0.91 -0.03 0.00 -0.02 0.00 0.00 35.03 34.06 2k74 n LYS 169 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2k74 s LYS 170 N -3.11 1.40 0.14 1.97 1.02 -1.26 -5.12 119.74 114.77 2k74 s LYS 170 Ca 0.25 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.41 2k74 s LYS 170 Cb -0.04 0.53 0.00 0.00 -0.52 0.00 0.00 37.83 37.80 2k74 s LYS 170 CO 0.21 -0.60 0.00 -2.13 -0.92 0.00 0.00 175.35 171.91 2k74 n ARG 171 N -0.35 -2.65 0.00 1.68 3.00 -1.26 -5.05 116.66 112.02 2k74 n ARG 171 Ca -0.10 2.04 0.00 0.00 -0.00 0.00 0.00 57.85 59.79 2k74 n ARG 171 Cb 0.62 -2.05 0.00 0.00 0.00 0.00 0.00 32.46 31.03 2k74 n ARG 171 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2k74 n ASP 172 N 0.54 0.00 -0.08 6.15 9.92 -1.26 -5.05 116.55 126.77 2k74 n ASP 172 Ca 0.00 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.14 2k74 n ASP 172 Cb 0.00 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.44 2k74 n ASP 172 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2k74 n LEU 173 N 0.00 1.79 -2.36 0.64 4.32 -1.26 -5.10 117.00 115.03 2k74 n LEU 173 Ca 0.00 0.30 -0.01 0.00 -0.02 0.00 0.00 56.01 56.28 2k74 n LEU 173 Cb 0.00 -0.69 -0.01 0.00 -1.62 0.00 0.00 43.42 41.10 2k74 n LEU 173 CO 0.00 -0.13 -0.38 0.49 -1.22 0.00 0.00 177.39 176.15 2k74 n PHE 174 N -4.26 -3.45 -3.85 -1.77 3.72 -1.26 -5.04 117.46 101.54 2k74 n PHE 174 Ca -0.21 2.04 -0.12 0.00 -0.05 0.00 0.00 57.45 59.11 2k74 n PHE 174 Cb 0.55 -3.06 -0.13 0.00 -0.94 0.00 0.00 39.48 35.89 2k74 n PHE 174 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2k74 s GLY 175 N -0.44 -0.04 -0.14 1.37 0.00 -1.26 -5.07 107.32 101.75 2k74 s GLY 175 Ca -0.04 0.15 -0.15 0.00 0.00 0.00 0.00 44.72 44.68 2k74 s GLY 175 CO 0.12 0.12 0.30 -0.09 0.00 0.00 0.00 173.10 173.55 2k74 h ARG 176 N 5.91 0.00 -5.17 2.90 1.12 -2.09 -3.49 114.38 113.56 2k74 h ARG 176 Ca -0.25 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.62 2k74 h ARG 176 Cb 1.20 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.16 2k74 h ARG 176 CO 0.46 0.52 -0.26 0.41 -3.11 0.00 0.00 179.97 177.99 2k74 n GLY 177 N 1.65 -1.23 3.73 2.80 0.00 -1.26 -4.96 105.19 105.92 2k74 n GLY 177 Ca -0.09 0.84 -0.41 0.00 0.00 0.00 0.00 46.02 46.36 2k74 n GLY 177 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2k74 s HIS 178 N -2.73 3.74 0.36 1.61 2.46 -1.26 -5.06 115.29 114.41 2k74 s HIS 178 Ca 0.13 1.61 -0.04 0.00 0.47 0.00 0.00 55.06 57.22 2k74 s HIS 178 Cb -0.04 -2.95 0.08 0.00 -0.13 0.00 0.00 32.58 29.54 2k74 s HIS 178 CO 0.71 0.19 0.49 -2.39 -2.47 0.00 0.00 174.74 171.28 2k74 n HIS 179 N 3.04 -3.72 -4.64 3.88 1.44 -1.26 -5.12 115.22 108.84 2k74 n HIS 179 Ca 0.01 -0.56 -0.29 0.00 -2.01 0.00 0.00 57.72 54.87 2k74 n HIS 179 Cb 0.50 -0.37 -0.10 0.00 0.12 0.00 0.00 29.99 30.13 2k74 n HIS 179 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2k74 s HIS 180 N -1.81 2.36 1.44 -1.40 3.76 -1.26 -5.14 115.29 113.24 2k74 s HIS 180 Ca 0.29 -0.75 -0.23 0.00 -0.15 0.00 0.00 55.06 54.23 2k74 s HIS 180 Cb -0.01 -1.72 0.37 0.00 1.11 0.00 0.00 32.58 32.33 2k74 s HIS 180 CO 0.20 0.38 0.91 -3.38 -0.85 0.00 0.00 174.74 172.00 2k74 s HIS 181 N -2.77 -0.64 0.00 1.40 -3.43 -1.26 -5.00 115.29 103.58 2k74 s HIS 181 Ca 0.29 0.63 0.00 0.00 -0.80 0.00 0.00 55.06 55.18 2k74 s HIS 181 Cb 0.08 -2.84 0.00 0.00 -1.43 0.00 0.00 32.58 28.39 2k74 s HIS 181 CO 0.15 -5.07 0.19 0.72 -2.00 0.00 0.00 174.74 168.73 2k74 n HIS 182 N -5.71 0.00 0.26 0.38 -0.00 -1.26 -5.34 115.22 103.55 2k74 n HIS 182 Ca 0.12 0.00 0.02 0.00 -0.00 0.00 0.00 57.72 57.86 2k74 n HIS 182 Cb 0.60 -0.28 0.12 0.00 -0.00 0.00 0.00 29.99 30.43 2k74 n HIS 182 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06