#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 0.25 -1.15 4.03 5.85 -2.05 -2.65 115.31 119.60 2k74 h LEU 2 Ca 0.00 -0.82 0.08 0.00 0.84 0.00 0.00 57.88 57.98 2k74 h LEU 2 Cb 0.00 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 40.89 2k74 h LEU 2 CO 0.00 1.05 0.59 -0.09 -0.34 0.00 0.00 178.44 179.65 2k74 h ARG 3 N -0.51 0.95 -0.16 1.25 2.43 -2.01 -1.87 114.38 114.47 2k74 h ARG 3 Ca -0.04 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.04 2k74 h ARG 3 Cb 1.11 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 2k74 h ARG 3 CO 0.06 0.63 0.00 0.35 -1.51 0.00 0.00 179.97 179.50 2k74 h PHE 4 N 0.98 0.31 -1.07 2.20 3.04 -2.01 -2.83 116.94 117.56 2k74 h PHE 4 Ca 0.41 -0.05 0.31 0.00 3.98 0.00 0.00 57.97 62.61 2k74 h PHE 4 Cb 0.30 -0.08 -0.12 0.00 2.56 0.00 0.00 35.95 38.60 2k74 h PHE 4 CO -0.00 0.50 0.66 1.25 -2.02 0.00 0.00 178.31 178.70 2k74 h LEU 5 N 0.04 0.47 -1.74 0.59 5.85 -0.96 2.36 115.31 121.91 2k74 h LEU 5 Ca 0.05 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 2k74 h LEU 5 Cb 0.37 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 2k74 h LEU 5 CO 0.01 -0.02 -0.05 -1.13 -0.34 0.00 0.00 178.44 176.91 2k74 h ASN 6 N 0.35 0.00 0.08 1.25 -0.00 -1.24 -2.44 115.58 113.59 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 1.69 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 40.02 2k74 h ASN 6 CO -0.44 0.05 -0.70 -0.61 -0.00 0.00 0.00 177.43 175.73 2k74 h GLN 7 N 0.00 0.18 -0.94 6.67 4.15 0.40 -2.04 115.11 123.53 2k74 h GLN 7 Ca -0.00 -0.31 0.01 0.00 0.77 0.00 0.00 58.65 59.12 2k74 h GLN 7 Cb 0.43 0.11 -0.05 0.00 0.21 0.00 0.00 27.48 28.19 2k74 h GLN 7 CO 0.01 1.15 0.62 0.00 -1.93 0.00 0.00 178.83 178.67 2k74 h ALA 8 N -0.01 1.34 0.03 3.38 0.00 -1.10 -2.30 119.26 120.60 2k74 h ALA 8 Ca -0.14 -0.06 -0.23 0.00 0.00 0.00 0.00 54.91 54.48 2k74 h ALA 8 Cb 1.44 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 2k74 h ALA 8 CO 0.06 0.62 -0.99 0.77 0.00 0.00 0.00 179.25 179.71 2k74 h SER 9 N 1.27 0.40 0.00 0.00 0.02 -1.56 -3.02 113.55 110.66 2k74 h SER 9 Ca 0.34 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k74 h SER 9 Cb -0.14 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.27 2k74 h SER 9 CO -0.08 1.17 0.00 1.67 -1.14 0.00 0.00 176.83 178.46 2k74 n GLN 10 N -3.66 0.40 -3.83 3.45 7.27 -0.77 -4.63 117.38 115.61 2k74 n GLN 10 Ca -0.06 0.00 -0.33 0.00 0.07 0.00 0.00 57.00 56.68 2k74 n GLN 10 Cb 0.87 -1.34 -0.05 0.00 2.41 0.00 0.00 30.24 32.13 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 -1.87 2.21 -0.01 1.69 0.00 -1.09 -4.93 107.32 103.33 2k74 s GLY 11 Ca 0.13 -0.69 -0.24 0.00 0.00 0.00 0.00 44.72 43.92 2k74 s GLY 11 CO 0.10 -0.57 1.28 -0.09 0.00 0.00 0.00 173.10 173.82 2k74 h ARG 12 N 3.60 0.11 -0.91 2.90 2.43 -1.87 -2.96 114.38 117.68 2k74 h ARG 12 Ca -0.48 -0.06 0.25 0.00 -0.81 0.00 0.00 59.98 58.87 2k74 h ARG 12 Cb 1.18 0.00 -0.16 0.00 -0.42 0.00 0.00 29.97 30.58 2k74 h ARG 12 CO 0.70 0.58 0.11 0.78 -1.51 0.00 0.00 179.97 180.63 2k74 h GLY 13 N -0.35 1.24 0.89 2.80 0.00 -1.95 0.52 103.07 106.23 2k74 h GLY 13 Ca 0.01 0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 2k74 h GLY 13 CO 0.01 -0.43 0.07 0.00 0.00 0.00 0.00 176.54 176.19 2k74 h ALA 14 N 1.86 0.21 -0.36 3.60 0.00 -1.78 -1.00 119.26 121.78 2k74 h ALA 14 Ca 0.56 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.42 2k74 h ALA 14 Cb 1.13 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 2k74 h ALA 14 CO -0.78 -0.22 0.10 -1.49 0.00 0.00 0.00 179.25 176.87 2k74 h TRP 15 N 0.12 0.18 0.00 0.00 4.06 0.03 0.11 115.95 120.45 2k74 h TRP 15 Ca 0.05 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.02 2k74 h TRP 15 Cb 0.15 -0.03 -0.00 0.00 -1.00 0.00 0.00 29.16 28.28 2k74 h TRP 15 CO -0.02 0.06 -0.04 1.25 -3.56 0.00 0.00 178.44 176.13 2k74 h LEU 16 N 0.24 0.00 -1.06 -4.49 7.12 -0.41 -0.40 115.31 116.31 2k74 h LEU 16 Ca 0.17 0.00 -0.10 0.00 0.13 0.00 0.00 57.88 58.08 2k74 h LEU 16 Cb 0.17 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.29 2k74 h LEU 16 CO -0.20 0.04 -0.45 0.25 -0.13 0.00 0.00 178.44 177.95 2k74 h LEU 17 N 0.00 0.00 -0.26 2.25 6.46 0.58 -2.44 115.31 121.91 2k74 h LEU 17 Ca -0.00 0.00 -0.21 0.00 -0.12 0.00 0.00 57.88 57.55 2k74 h LEU 17 Cb 0.09 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.01 2k74 h LEU 17 CO 0.01 0.45 -0.89 0.24 -0.62 0.00 0.00 178.44 177.63 2k74 h MET 18 N 0.00 0.29 0.17 1.25 2.86 -0.40 -2.88 114.93 116.23 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 0.84 0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.59 2k74 h MET 18 CO 0.06 1.01 -0.08 0.00 1.06 0.00 0.00 176.91 178.96 2k74 h ALA 19 N 0.89 -0.23 -0.35 6.32 0.00 -1.28 -2.98 119.26 121.63 2k74 h ALA 19 Ca -0.06 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.71 2k74 h ALA 19 Cb 1.51 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.33 2k74 h ALA 19 CO 0.14 -0.41 -0.00 0.35 0.00 0.00 0.00 179.25 179.33 2k74 h PHE 20 N -0.65 -0.02 -0.38 0.00 3.04 -1.54 -2.41 116.94 114.97 2k74 h PHE 20 Ca -0.02 0.03 0.06 0.00 3.98 0.00 0.00 57.97 62.01 2k74 h PHE 20 Cb 0.48 0.06 -0.08 0.00 2.56 0.00 0.00 35.95 38.97 2k74 h PHE 20 CO 0.05 -0.06 -0.50 1.15 -2.02 0.00 0.00 178.31 176.92 2k74 h THR 21 N 0.10 0.04 -0.72 4.41 2.02 -1.54 0.60 112.91 117.81 2k74 h THR 21 Ca 0.17 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.56 2k74 h THR 21 Cb 0.23 0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 66.66 2k74 h THR 21 CO -0.28 0.00 0.54 0.00 0.37 0.00 0.00 175.52 176.15 2k74 h ALA 22 N 0.13 2.65 0.14 6.16 0.00 -1.30 0.85 119.26 127.88 2k74 h ALA 22 Ca 0.10 -0.03 -0.30 0.00 0.00 0.00 0.00 54.91 54.68 2k74 h ALA 22 Cb 0.60 0.05 0.03 0.00 0.00 0.00 0.00 17.79 18.48 2k74 h ALA 22 CO -0.57 -0.91 -1.29 1.25 0.00 0.00 0.00 179.25 177.73 2k74 h LEU 23 N 0.00 0.84 -1.52 0.00 5.85 0.46 -3.13 115.31 117.80 2k74 h LEU 23 Ca 0.34 -0.80 0.14 0.00 0.84 0.00 0.00 57.88 58.40 2k74 h LEU 23 Cb 1.43 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 2k74 h LEU 23 CO -0.00 1.61 0.51 0.00 -0.34 0.00 0.00 178.44 180.21 2k74 h ALA 24 N 0.30 2.04 -0.09 1.25 0.00 0.21 0.15 119.26 123.11 2k74 h ALA 24 Ca -0.20 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.50 2k74 h ALA 24 Cb 1.96 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 19.68 2k74 h ALA 24 CO 0.24 -0.24 -0.82 -0.07 0.00 0.00 0.00 179.25 178.36 2k74 h LEU 25 N 0.48 0.75 0.03 0.00 3.38 -1.53 -2.50 115.31 115.92 2k74 h LEU 25 Ca 0.37 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2k74 h LEU 25 Cb 0.77 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2k74 h LEU 25 CO -0.13 1.30 -0.01 -0.33 0.09 0.00 0.00 178.44 179.36 2k74 h GLU 26 N 0.40 -0.04 -0.66 1.13 5.08 -1.03 -2.41 114.58 117.05 2k74 h GLU 26 Ca -0.06 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 2k74 h GLU 26 Cb 1.44 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.65 2k74 h GLU 26 CO 0.16 0.38 0.39 1.25 -1.00 0.00 0.00 179.01 180.19 2k74 h LEU 27 N -0.47 0.62 -0.65 1.33 5.85 -0.88 0.23 115.31 121.34 2k74 h LEU 27 Ca -0.00 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.74 2k74 h LEU 27 Cb 0.44 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 2k74 h LEU 27 CO 0.01 0.42 0.42 0.74 -0.34 0.00 0.00 178.44 179.69 2k74 h THR 28 N 0.76 1.13 0.00 1.05 2.02 -1.45 -1.94 112.91 114.48 2k74 h THR 28 Ca 0.28 -0.29 -0.13 0.00 0.77 0.00 0.00 66.41 67.04 2k74 h THR 28 Cb 0.08 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 2k74 h THR 28 CO -0.13 0.15 -0.62 0.00 0.37 0.00 0.00 175.52 175.29 2k74 h ALA 29 N 1.26 0.90 0.00 6.16 0.00 -0.89 -2.79 119.26 123.90 2k74 h ALA 29 Ca 0.25 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2k74 h ALA 29 Cb -0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 2k74 h ALA 29 CO -0.07 0.78 -0.06 -0.07 0.00 0.00 0.00 179.25 179.82 2k74 h LEU 30 N 0.00 0.00 0.12 0.00 -0.00 0.18 -2.96 115.31 112.66 2k74 h LEU 30 Ca -0.01 0.00 -0.32 0.00 -0.00 0.00 0.00 57.88 57.55 2k74 h LEU 30 Cb 1.15 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.80 2k74 h LEU 30 CO 0.08 0.06 -1.68 -0.25 -0.00 0.00 0.00 178.44 176.65 2k74 h TRP 31 N 0.00 0.46 -1.00 1.13 2.91 -1.20 -3.21 115.95 115.03 2k74 h TRP 31 Ca -0.00 -0.33 0.18 0.00 1.13 0.00 0.00 58.89 59.87 2k74 h TRP 31 Cb 0.45 -0.02 -0.10 0.00 -0.51 0.00 0.00 29.16 28.97 2k74 h TRP 31 CO 0.00 1.66 0.62 0.74 -1.03 0.00 0.00 178.44 180.43 2k74 h PHE 32 N -0.17 1.08 -0.20 2.65 -1.00 -1.35 0.23 116.94 118.18 2k74 h PHE 32 Ca -0.36 0.03 -0.17 0.00 2.81 0.00 0.00 57.97 60.28 2k74 h PHE 32 Cb 1.87 -0.33 -0.00 0.00 3.61 0.00 0.00 35.95 41.10 2k74 h PHE 32 CO 0.10 0.26 -0.57 0.37 -1.61 0.00 0.00 178.31 176.86 2k74 h GLN 33 N 0.79 0.64 0.00 1.51 4.15 -1.66 0.64 115.11 121.18 2k74 h GLN 33 Ca 0.57 -0.42 0.00 0.00 0.77 0.00 0.00 58.65 59.58 2k74 h GLN 33 Cb 0.86 0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.60 2k74 h GLN 33 CO -0.37 1.03 0.00 0.72 -1.93 0.00 0.00 178.83 178.28 2k74 n HIS 34 N -3.96 0.10 -0.07 3.99 8.25 0.29 -0.77 115.22 123.05 2k74 n HIS 34 Ca -0.04 0.03 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 2k74 n HIS 34 Cb 0.63 -0.56 -0.06 0.00 1.12 0.00 0.00 29.99 31.12 2k74 n HIS 34 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2k74 n VAL 35 N -1.59 0.82 0.20 1.59 0.31 0.56 -4.60 118.33 115.62 2k74 n VAL 35 Ca 0.05 -0.23 0.08 0.00 -0.01 0.00 0.00 64.34 64.23 2k74 n VAL 35 Cb 0.28 -1.56 0.24 0.00 -0.91 0.00 0.00 33.84 31.89 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 -3.52 2.52 -4.24 5.55 2.81 0.22 -4.93 117.12 115.53 2k74 n MET 36 Ca -0.29 -1.96 -0.34 0.00 -1.81 0.00 0.00 57.70 53.30 2k74 n MET 36 Cb 0.72 -1.53 -0.05 0.00 -0.71 0.00 0.00 33.22 31.65 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 0.93 -1.53 -4.79 4.03 7.94 0.05 -4.89 117.00 118.74 2k74 n LEU 37 Ca 0.18 -1.10 -0.35 0.00 -1.11 0.00 0.00 56.01 53.63 2k74 n LEU 37 Cb 0.54 -1.94 -0.04 0.00 0.53 0.00 0.00 43.42 42.51 2k74 n LEU 37 CO 0.14 0.32 0.72 -0.76 -1.11 0.00 0.00 177.39 176.71 2k74 s LEU 38 N -7.22 3.98 -0.15 -1.96 1.43 -1.09 -5.03 118.68 108.64 2k74 s LEU 38 Ca 0.45 1.98 -0.03 0.00 -1.03 0.00 0.00 54.13 55.49 2k74 s LEU 38 Cb -0.25 -4.39 -0.03 0.00 0.03 0.00 0.00 46.19 41.55 2k74 s LEU 38 CO 0.95 -0.64 -0.05 -0.54 0.23 0.00 0.00 176.35 176.30 2k74 s LYS 39 N -2.90 3.61 0.97 1.70 1.02 -1.26 -4.81 119.74 118.08 2k74 s LYS 39 Ca 0.63 -0.54 -0.15 0.00 0.02 0.00 0.00 55.97 55.93 2k74 s LYS 39 Cb -0.19 -2.87 0.18 0.00 -0.52 0.00 0.00 37.83 34.43 2k74 s LYS 39 CO 0.23 0.26 1.20 -1.25 -0.92 0.00 0.00 175.35 174.87 2k74 s PRO 40 N 0.31 0.60 0.35 -1.68 0.04 -1.11 -4.73 135.00 128.79 2k74 s PRO 40 Ca -0.04 -0.05 0.04 0.00 0.04 0.00 0.00 61.00 60.99 2k74 s PRO 40 Cb -0.14 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.57 2k74 s PRO 40 CO 0.03 -2.50 0.15 0.00 0.04 0.00 0.00 177.00 174.72 2k74 h VAL 42 N 1.65 1.25 0.01 0.00 2.07 -1.88 -1.96 116.25 117.39 2k74 h VAL 42 Ca -0.27 -0.90 -0.20 0.00 0.82 0.00 0.00 66.70 66.15 2k74 h VAL 42 Cb 1.08 1.25 0.02 0.00 -1.52 0.00 0.00 31.29 32.11 2k74 h VAL 42 CO 0.43 0.29 -0.77 -0.07 0.02 0.00 0.00 177.57 177.47 2k74 h LEU 43 N 0.33 0.66 0.12 2.57 4.07 -1.97 -2.37 115.31 118.72 2k74 h LEU 43 Ca 0.09 -0.76 0.00 0.00 0.08 0.00 0.00 57.88 57.29 2k74 h LEU 43 Cb 0.41 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 2k74 h LEU 43 CO 0.01 1.34 -0.11 0.28 -1.08 0.00 0.00 178.44 178.89 2k74 h SER 44 N 0.06 -0.28 -0.33 -0.43 0.02 -1.95 -0.46 113.55 110.17 2k74 h SER 44 Ca -0.10 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.81 2k74 h SER 44 Cb 1.46 0.09 -0.02 0.00 0.14 0.00 0.00 62.40 64.08 2k74 h SER 44 CO 0.15 -0.17 -0.00 -0.29 -1.14 0.00 0.00 176.83 175.38 2k74 h ILE 45 N -0.25 1.23 -0.40 3.27 2.10 -1.47 -2.58 117.51 119.41 2k74 h ILE 45 Ca -0.00 -0.93 0.03 0.00 1.08 0.00 0.00 64.86 65.03 2k74 h ILE 45 Cb 0.23 0.91 -0.03 0.00 -1.09 0.00 0.00 36.82 36.83 2k74 h ILE 45 CO -0.02 0.33 0.20 0.22 -1.08 0.00 0.00 178.15 177.80 2k74 h TYR 46 N 0.65 0.37 -0.82 2.19 3.20 -0.94 -1.27 116.97 120.36 2k74 h TYR 46 Ca 0.13 0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.10 2k74 h TYR 46 Cb 0.41 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.52 2k74 h TYR 46 CO 0.02 0.20 0.53 0.93 -1.64 0.00 0.00 178.16 178.20 2k74 h GLU 47 N 0.41 0.79 -0.36 1.82 5.08 -0.71 0.46 114.58 122.08 2k74 h GLU 47 Ca 0.17 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2k74 h GLU 47 Cb 0.07 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 2k74 h GLU 47 CO -0.11 0.52 0.16 -0.09 -1.00 0.00 0.00 179.01 178.49 2k74 h ARG 48 N 0.82 0.49 -0.38 2.33 2.43 -0.98 -2.07 114.38 117.01 2k74 h ARG 48 Ca 0.37 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 59.33 2k74 h ARG 48 Cb 0.35 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2k74 h ARG 48 CO -0.14 0.39 -0.38 0.00 -1.51 0.00 0.00 179.97 178.33 2k74 h ALA 49 N 1.69 0.61 -0.34 2.80 0.00 -0.53 0.51 119.26 124.00 2k74 h ALA 49 Ca 0.13 -0.45 0.06 0.00 0.00 0.00 0.00 54.91 54.64 2k74 h ALA 49 Cb 0.07 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 2k74 h ALA 49 CO -0.02 0.68 0.02 0.00 0.00 0.00 0.00 179.25 179.93 2k74 h ALA 50 N 0.81 0.32 -0.09 0.00 0.00 -0.89 -0.34 119.26 119.08 2k74 h ALA 50 Ca 0.06 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 2k74 h ALA 50 Cb 0.97 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2k74 h ALA 50 CO 0.09 -0.38 -0.33 -0.07 0.00 0.00 0.00 179.25 178.56 2k74 h LEU 51 N 0.12 0.44 -0.99 0.00 3.38 -1.47 -2.79 115.31 114.00 2k74 h LEU 51 Ca 0.16 -0.63 0.29 0.00 0.09 0.00 0.00 57.88 57.79 2k74 h LEU 51 Cb 0.21 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 40.69 2k74 h LEU 51 CO -0.25 0.99 0.56 0.15 0.09 0.00 0.00 178.44 179.98 2k74 h PHE 52 N -0.09 0.93 -0.25 1.13 3.57 -0.54 0.52 116.94 122.22 2k74 h PHE 52 Ca -0.02 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 2k74 h PHE 52 Cb 0.97 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 2k74 h PHE 52 CO 0.12 -0.08 -0.06 0.78 -2.23 0.00 0.00 178.31 176.85 2k74 h GLY 53 N 0.43 0.52 0.92 2.40 0.00 -0.98 -2.90 103.07 103.45 2k74 h GLY 53 Ca 0.69 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 47.58 2k74 h GLY 53 CO -0.55 0.39 0.09 -2.08 0.00 0.00 0.00 176.54 174.38 2k74 h VAL 54 N 0.23 1.12 -0.88 4.60 2.07 -0.09 -2.36 116.25 120.94 2k74 h VAL 54 Ca 0.06 -0.36 0.24 0.00 0.82 0.00 0.00 66.70 67.47 2k74 h VAL 54 Cb 0.52 1.04 -0.14 0.00 -1.52 0.00 0.00 31.29 31.19 2k74 h VAL 54 CO 0.02 0.12 0.22 0.25 0.02 0.00 0.00 177.57 178.20 2k74 h LEU 55 N 0.16 -0.03 -1.51 2.57 6.46 -0.16 1.93 115.31 124.72 2k74 h LEU 55 Ca 0.06 0.20 -0.05 0.00 -0.12 0.00 0.00 57.88 57.97 2k74 h LEU 55 Cb 0.11 0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.31 2k74 h LEU 55 CO -0.01 -0.17 -0.25 1.23 -0.62 0.00 0.00 178.44 178.62 2k74 h GLY 56 N 0.19 0.00 1.31 3.75 0.00 -1.23 -2.36 103.07 104.73 2k74 h GLY 56 Ca 0.56 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.81 2k74 h GLY 56 CO -0.67 0.00 0.02 0.00 0.00 0.00 0.00 176.54 175.88 2k74 h ALA 57 N 1.75 1.08 0.00 3.60 0.00 0.35 -2.30 119.26 123.74 2k74 h ALA 57 Ca -0.00 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 2k74 h ALA 57 Cb 0.45 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2k74 h ALA 57 CO 0.03 0.58 -0.54 0.00 0.00 0.00 0.00 179.25 179.32 2k74 h ALA 58 N 1.23 0.82 -0.37 0.00 0.00 -0.81 -0.78 119.26 119.36 2k74 h ALA 58 Ca 0.15 -0.49 -0.17 0.00 0.00 0.00 0.00 54.91 54.40 2k74 h ALA 58 Cb 0.45 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2k74 h ALA 58 CO 0.02 0.68 -0.42 1.25 0.00 0.00 0.00 179.25 180.77 2k74 h LEU 59 N 0.00 1.00 0.04 0.00 6.46 -1.08 -1.57 115.31 120.16 2k74 h LEU 59 Ca -0.01 -0.48 -0.25 0.00 -0.12 0.00 0.00 57.88 57.02 2k74 h LEU 59 Cb 1.17 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.80 2k74 h LEU 59 CO 0.07 1.28 -1.26 0.16 -0.62 0.00 0.00 178.44 178.07 2k74 h ILE 60 N 0.75 1.43 -0.05 4.05 3.07 -1.41 -3.30 117.51 122.04 2k74 h ILE 60 Ca 0.05 -3.13 -0.12 0.00 1.55 0.00 0.00 64.86 63.22 2k74 h ILE 60 Cb 1.02 2.78 -0.01 0.00 -0.27 0.00 0.00 36.82 40.34 2k74 h ILE 60 CO 0.10 0.85 -0.50 1.23 -1.05 0.00 0.00 178.15 178.79 2k74 h GLY 61 N 2.59 0.15 0.26 0.16 0.00 -1.13 -2.71 103.07 102.40 2k74 h GLY 61 Ca -0.12 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2k74 h GLY 61 CO 0.14 0.14 0.00 0.00 0.00 0.00 0.00 176.54 176.82 2k74 n ALA 62 N -2.46 2.07 0.07 3.60 0.00 -0.60 -2.57 120.51 120.63 2k74 n ALA 62 Ca -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 53.44 53.38 2k74 n ALA 62 Cb 0.53 -1.07 -0.06 0.00 0.00 0.00 0.00 19.45 18.85 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 0.97 0.00 0.00 5.03 -1.65 -3.45 117.51 118.41 2k74 h ILE 63 Ca 0.00 -2.51 0.00 0.00 -0.12 0.00 0.00 64.86 62.23 2k74 h ILE 63 Cb 0.00 2.42 0.00 0.00 -3.03 0.00 0.00 36.82 36.21 2k74 h ILE 63 CO 0.00 0.55 0.00 0.00 -0.68 0.00 0.00 178.15 178.02 2k74 n ALA 64 N -2.34 0.00 0.52 1.87 0.00 -1.06 -5.01 120.51 114.50 2k74 n ALA 64 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2k74 n ALA 64 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.30 2k74 n ALA 64 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2k74 n PRO 65 N 0.00 0.42 0.00 0.00 -0.02 -1.14 -1.82 135.00 132.44 2k74 n PRO 65 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.52 2k74 n PRO 65 Cb 0.00 -1.16 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 2k74 n PRO 65 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2k74 n LYS 66 N 0.09 1.94 -4.26 -0.52 5.02 -1.26 -4.83 118.16 114.35 2k74 n LYS 66 Ca 0.00 -0.62 -0.23 0.00 -2.02 0.00 0.00 58.31 55.44 2k74 n LYS 66 Cb 0.08 -1.06 -0.07 0.00 -0.02 0.00 0.00 35.03 33.96 2k74 n LYS 66 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2k74 s THR 67 N -1.19 3.53 0.39 -0.18 -4.23 -0.75 -4.95 115.64 108.25 2k74 s THR 67 Ca 0.08 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 58.75 2k74 s THR 67 Cb 0.07 -2.92 0.00 0.00 1.34 0.00 0.00 72.50 70.99 2k74 s THR 67 CO 0.21 -0.36 0.74 -2.65 -0.54 0.00 0.00 174.62 172.02 2k74 n PRO 68 N -0.95 0.02 -0.49 3.99 -0.02 -1.26 -1.44 135.00 134.85 2k74 n PRO 68 Ca -0.06 0.56 0.40 0.00 -2.02 0.00 0.00 63.50 62.38 2k74 n PRO 68 Cb 0.59 -2.11 0.70 0.00 -0.02 0.00 0.00 33.50 32.66 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 0.15 -0.29 2.45 5.85 -1.93 -2.01 115.31 119.53 2k74 h LEU 69 Ca 0.00 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.82 2k74 h LEU 69 Cb 1.48 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.54 2k74 h LEU 69 CO 0.00 -0.08 -0.18 0.08 -0.34 0.00 0.00 178.44 177.92 2k74 h ARG 70 N 0.07 -0.00 -0.75 1.25 0.11 -1.52 1.10 114.38 114.64 2k74 h ARG 70 Ca 0.79 0.00 0.17 0.00 0.10 0.00 0.00 59.98 61.04 2k74 h ARG 70 Cb 2.76 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 33.80 2k74 h ARG 70 CO -0.23 -0.00 0.51 -0.92 0.10 0.00 0.00 179.97 179.43 2k74 h TYR 71 N -0.00 0.35 0.42 4.08 3.20 -1.66 0.59 116.97 123.94 2k74 h TYR 71 Ca 0.05 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 2k74 h TYR 71 Cb 0.12 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.29 2k74 h TYR 71 CO -0.96 0.12 -0.20 0.28 -1.64 0.00 0.00 178.16 175.76 2k74 h VAL 72 N 0.29 0.51 -0.33 1.81 2.07 0.95 -1.61 116.25 119.94 2k74 h VAL 72 Ca 0.37 -0.46 -0.15 0.00 0.82 0.00 0.00 66.70 67.28 2k74 h VAL 72 Cb 1.03 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2k74 h VAL 72 CO -0.09 0.07 -0.40 0.00 0.02 0.00 0.00 177.57 177.17 2k74 h ALA 73 N -0.44 0.49 0.00 1.67 0.00 0.25 -2.51 119.26 118.71 2k74 h ALA 73 Ca -0.06 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2k74 h ALA 73 Cb 0.56 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2k74 h ALA 73 CO 0.09 0.59 0.00 -1.33 0.00 0.00 0.00 179.25 178.61 2k74 n MET 74 N -4.12 0.07 0.15 0.00 2.00 0.20 -1.32 117.12 114.11 2k74 n MET 74 Ca -0.03 0.52 0.04 0.00 0.00 0.00 0.00 57.70 58.23 2k74 n MET 74 Cb 0.55 -1.70 0.45 0.00 0.00 0.00 0.00 33.22 32.51 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 1.14 0.01 2.03 3.04 -0.82 0.18 116.25 121.83 2k74 h VAL 75 Ca 0.00 -0.58 -0.30 0.00 -1.01 0.00 0.00 66.70 64.81 2k74 h VAL 75 Cb 0.05 1.14 -0.05 0.00 -2.01 0.00 0.00 31.29 30.43 2k74 h VAL 75 CO 0.00 0.18 -1.72 -0.38 -1.01 0.00 0.00 177.57 174.64 2k74 n ILE 76 N -4.34 1.62 0.00 3.17 5.41 -0.43 -2.64 119.36 122.15 2k74 n ILE 76 Ca -0.01 -0.79 -0.12 0.00 1.00 0.00 0.00 62.75 62.83 2k74 n ILE 76 Cb 0.22 -1.09 -0.08 0.00 -0.71 0.00 0.00 39.64 37.97 2k74 n ILE 76 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 176.55 176.30 2k74 h TRP 77 N 0.00 0.04 -0.29 1.39 2.91 -1.29 -2.64 115.95 116.06 2k74 h TRP 77 Ca -0.29 -0.01 -0.07 0.00 1.13 0.00 0.00 58.89 59.65 2k74 h TRP 77 Cb 2.01 -0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 30.64 2k74 h TRP 77 CO 0.01 0.31 -0.09 1.25 -1.03 0.00 0.00 178.44 178.88 2k74 h LEU 78 N -0.24 0.59 -0.82 0.65 5.85 -0.82 -2.06 115.31 118.46 2k74 h LEU 78 Ca 0.01 -0.38 0.20 0.00 0.84 0.00 0.00 57.88 58.55 2k74 h LEU 78 Cb 0.29 -0.16 -0.13 0.00 0.37 0.00 0.00 40.66 41.03 2k74 h LEU 78 CO 0.00 0.83 0.19 0.22 -0.34 0.00 0.00 178.44 179.34 2k74 h TYR 79 N 0.34 0.28 0.00 1.25 3.20 -1.48 0.68 116.97 121.23 2k74 h TYR 79 Ca 0.07 0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.95 2k74 h TYR 79 Cb 0.59 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.86 2k74 h TYR 79 CO 0.05 -0.17 -0.18 0.66 -1.64 0.00 0.00 178.16 176.89 2k74 h SER 80 N 0.22 0.00 0.97 -2.11 4.64 -1.37 -2.69 113.55 113.21 2k74 h SER 80 Ca 0.49 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.76 2k74 h SER 80 Cb 0.92 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.02 2k74 h SER 80 CO -0.61 0.18 -0.46 0.00 -0.87 0.00 0.00 176.83 175.07 2k74 h ALA 81 N 1.82 -1.30 0.09 5.18 0.00 0.11 0.69 119.26 125.85 2k74 h ALA 81 Ca -0.00 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2k74 h ALA 81 Cb 1.05 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.34 2k74 h ALA 81 CO 0.02 -1.23 -0.04 0.35 0.00 0.00 0.00 179.25 178.35 2k74 h PHE 82 N -1.30 -0.11 -0.25 0.00 3.57 -1.58 -2.84 116.94 114.44 2k74 h PHE 82 Ca -0.13 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.32 2k74 h PHE 82 Cb 1.00 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.76 2k74 h PHE 82 CO -0.00 0.44 -0.03 -0.09 -2.23 0.00 0.00 178.31 176.39 2k74 h ARG 83 N -0.84 0.46 -0.34 1.11 2.43 -1.59 0.24 114.38 115.85 2k74 h ARG 83 Ca -0.01 -0.16 0.02 0.00 -0.81 0.00 0.00 59.98 59.02 2k74 h ARG 83 Cb 0.59 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 2k74 h ARG 83 CO 0.02 0.66 0.18 0.78 -1.51 0.00 0.00 179.97 180.10 2k74 h GLY 84 N 0.21 0.46 0.68 2.80 0.00 0.27 -1.91 103.07 105.58 2k74 h GLY 84 Ca 0.07 -0.13 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 2k74 h GLY 84 CO 0.02 0.11 -0.11 -2.08 0.00 0.00 0.00 176.54 174.48 2k74 h VAL 85 N 0.37 1.36 -0.10 4.60 2.07 -1.43 -1.87 116.25 121.25 2k74 h VAL 85 Ca 0.14 -1.27 0.03 0.00 0.82 0.00 0.00 66.70 66.42 2k74 h VAL 85 Cb 0.04 1.96 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2k74 h VAL 85 CO -0.09 0.36 0.37 1.56 0.02 0.00 0.00 177.57 179.80 2k74 h GLN 86 N -0.14 0.00 0.13 1.57 1.08 -0.37 0.10 115.11 117.48 2k74 h GLN 86 Ca 0.02 0.00 -0.36 0.00 -1.45 0.00 0.00 58.65 56.86 2k74 h GLN 86 Cb 0.63 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.04 2k74 h GLN 86 CO 0.03 0.00 -1.92 -0.07 -0.95 0.00 0.00 178.83 175.91 2k74 h LEU 87 N 0.00 0.43 -1.98 1.46 -0.00 -1.05 -3.34 115.31 110.82 2k74 h LEU 87 Ca 0.05 -0.93 0.12 0.00 -0.00 0.00 0.00 57.88 57.11 2k74 h LEU 87 Cb 0.80 -0.14 -0.02 0.00 -0.00 0.00 0.00 40.66 41.30 2k74 h LEU 87 CO -0.00 1.83 0.44 0.71 -0.00 0.00 0.00 178.44 181.42 2k74 h THR 88 N 0.02 0.39 -0.24 0.22 1.35 0.03 0.74 112.91 115.43 2k74 h THR 88 Ca -0.41 0.00 -0.07 0.00 -0.55 0.00 0.00 66.41 65.38 2k74 h THR 88 Cb 2.01 0.65 -0.01 0.00 -1.73 0.00 0.00 68.15 69.07 2k74 h THR 88 CO 0.09 0.00 -0.14 0.22 -0.25 0.00 0.00 175.52 175.44 2k74 h TYR 89 N 0.00 0.60 -0.46 4.73 3.20 -1.61 -1.94 116.97 121.49 2k74 h TYR 89 Ca 0.20 -0.16 0.05 0.00 3.14 0.00 0.00 58.73 61.97 2k74 h TYR 89 Cb 1.07 -0.14 -0.05 0.00 1.54 0.00 0.00 36.73 39.16 2k74 h TYR 89 CO 0.00 0.80 0.19 0.93 -1.64 0.00 0.00 178.16 178.44 2k74 h GLU 90 N 0.23 0.36 0.01 1.82 3.07 -1.01 0.46 114.58 119.51 2k74 h GLU 90 Ca 0.05 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 58.89 2k74 h GLU 90 Cb 0.66 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 2k74 h GLU 90 CO 0.04 0.24 -0.00 1.25 -1.40 0.00 0.00 179.01 179.14 2k74 h HIS 91 N 0.37 -0.01 0.02 4.33 2.76 -1.47 -0.24 115.15 120.91 2k74 h HIS 91 Ca 0.22 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 2k74 h HIS 91 Cb 0.19 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 2k74 h HIS 91 CO -0.14 0.07 -0.04 1.79 -1.30 0.00 0.00 177.93 178.31 2k74 h THR 92 N -0.08 0.91 -0.35 6.26 1.35 -0.90 -0.10 112.91 120.00 2k74 h THR 92 Ca -0.00 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 65.92 2k74 h THR 92 Cb 0.08 0.91 -0.06 0.00 -1.73 0.00 0.00 68.15 67.35 2k74 h THR 92 CO 0.00 0.00 -0.03 -0.03 -0.25 0.00 0.00 175.52 175.21 2k74 h MET 93 N -0.07 0.06 -0.26 4.72 -1.53 0.02 -1.71 114.93 116.15 2k74 h MET 93 Ca 0.01 -0.00 0.02 0.00 -3.44 0.00 0.00 59.70 56.28 2k74 h MET 93 Cb 0.08 -0.01 -0.02 0.00 -0.55 0.00 0.00 31.60 31.10 2k74 h MET 93 CO -0.02 0.04 0.12 1.25 0.14 0.00 0.00 176.91 178.43 2k74 h LEU 94 N 0.06 0.17 -0.91 3.39 7.12 -0.77 2.57 115.31 126.94 2k74 h LEU 94 Ca 0.17 0.02 0.19 0.00 0.13 0.00 0.00 57.88 58.39 2k74 h LEU 94 Cb 0.24 -0.01 -0.11 0.00 -0.53 0.00 0.00 40.66 40.25 2k74 h LEU 94 CO -0.31 0.13 0.47 -0.61 -0.13 0.00 0.00 178.44 177.99 2k74 h GLN 95 N 0.25 0.54 -0.01 1.25 4.15 -0.28 0.30 115.11 121.32 2k74 h GLN 95 Ca 0.11 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.50 2k74 h GLN 95 Cb 0.04 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.61 2k74 h GLN 95 CO -0.08 0.36 -0.55 1.28 -1.93 0.00 0.00 178.83 177.90 2k74 n LEU 96 N -4.92 1.40 -3.75 -2.39 4.77 -0.71 -4.62 117.00 106.78 2k74 n LEU 96 Ca 0.21 -0.50 -0.28 0.00 -0.03 0.00 0.00 56.01 55.41 2k74 n LEU 96 Cb 0.58 -0.05 -0.12 0.00 -2.33 0.00 0.00 43.42 41.50 2k74 n LEU 96 CO 0.17 0.28 -0.13 -0.47 -1.33 0.00 0.00 177.39 175.92 2k74 s TYR 97 N -2.66 2.79 0.00 -1.77 6.14 0.86 -5.06 117.35 117.65 2k74 s TYR 97 Ca 0.17 -3.01 0.00 0.00 0.64 0.00 0.00 57.07 54.86 2k74 s TYR 97 Cb 0.18 -2.17 0.00 0.00 0.42 0.00 0.00 41.96 40.39 2k74 s TYR 97 CO 0.64 -0.64 0.00 -0.35 0.64 0.00 0.00 175.55 175.84 2k74 n PRO 98 N 2.31 1.35 -1.34 4.97 -0.04 -1.13 -4.36 135.00 136.77 2k74 n PRO 98 Ca 0.22 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 2k74 n PRO 98 Cb 0.38 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.84 2k74 n PRO 98 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2k74 n SER 99 N 0.00 -1.78 -4.21 3.54 7.64 -1.26 -5.02 113.62 112.52 2k74 n SER 99 Ca 0.00 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.53 2k74 n SER 99 Cb 0.00 -0.75 0.06 0.00 -1.01 0.00 0.00 64.21 62.52 2k74 n SER 99 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2k74 n PRO 100 N -1.03 -0.04 0.00 1.43 -0.02 -1.26 -4.91 135.00 129.17 2k74 n PRO 100 Ca 0.00 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 2k74 n PRO 100 Cb 0.45 -1.37 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 2k74 n PRO 100 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2k74 n PHE 101 N -2.68 0.00 0.00 6.00 -0.00 -1.26 -4.95 117.46 114.57 2k74 n PHE 101 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.48 2k74 n PHE 101 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.01 2k74 n PHE 101 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2k74 n ALA 102 N -0.21 1.44 -1.55 3.13 0.00 -1.26 -4.85 120.51 117.22 2k74 n ALA 102 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 2k74 n ALA 102 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2k74 n ALA 102 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2k74 n THR 103 N -1.08 4.03 -2.57 0.00 -1.04 -1.26 -4.93 114.28 107.43 2k74 n THR 103 Ca 0.00 -2.90 -0.43 0.00 -2.04 0.00 0.00 64.05 58.68 2k74 n THR 103 Cb 0.00 -2.58 -0.02 0.00 -1.82 0.00 0.00 70.33 65.91 2k74 n THR 103 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2k74 s SER 104 N 2.43 7.10 -0.16 8.00 1.04 -1.26 -4.40 113.70 126.45 2k74 s SER 104 Ca 0.59 1.60 -0.03 0.00 0.48 0.00 0.00 55.95 58.59 2k74 s SER 104 Cb 0.16 -2.55 0.01 0.00 0.10 0.00 0.00 66.02 63.74 2k74 s SER 104 CO -0.07 -0.60 0.06 0.47 0.98 0.00 0.00 173.24 174.07 2k74 n ASP 105 N 5.72 -5.87 -4.43 7.02 8.00 -1.26 -4.61 116.55 121.11 2k74 n ASP 105 Ca 0.11 1.09 -0.49 0.00 0.71 0.00 0.00 54.79 56.21 2k74 n ASP 105 Cb 0.47 -3.80 -0.08 0.00 -0.02 0.00 0.00 41.12 37.68 2k74 n ASP 105 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2k74 n PHE 106 N 1.36 1.38 -3.64 1.24 3.01 -1.26 -4.87 117.46 114.68 2k74 n PHE 106 Ca -0.10 0.35 -0.04 0.00 1.01 0.00 0.00 57.45 58.67 2k74 n PHE 106 Cb 0.28 -2.49 -0.06 0.00 -0.01 0.00 0.00 39.48 37.21 2k74 n PHE 106 CO 0.00 0.00 0.00 1.41 1.01 0.00 0.00 176.76 179.18 2k74 s MET 107 N 6.75 0.64 0.37 -1.08 1.75 -1.26 -4.84 119.30 121.63 2k74 s MET 107 Ca 1.13 1.32 -0.26 0.00 -1.25 0.00 0.00 55.69 56.63 2k74 s MET 107 Cb -0.94 0.49 -0.09 0.00 2.84 0.00 0.00 34.83 37.13 2k74 s MET 107 CO 0.49 -0.17 1.19 0.54 -0.65 0.00 0.00 175.02 176.42 2k74 s VAL 108 N 2.23 3.11 -0.29 10.11 0.11 -1.26 -5.02 120.40 129.39 2k74 s VAL 108 Ca -0.08 0.99 0.01 0.00 -2.93 0.00 0.00 61.98 59.97 2k74 s VAL 108 Cb -0.08 -3.58 0.15 0.00 -1.53 0.00 0.00 36.38 31.34 2k74 s VAL 108 CO -0.19 0.14 0.36 0.00 -3.33 0.00 0.00 175.10 172.08 2k74 s ARG 109 N -2.08 0.38 0.11 1.54 1.70 -1.26 -4.99 118.95 114.34 2k74 s ARG 109 Ca 0.54 0.01 0.08 0.00 -0.47 0.00 0.00 55.73 55.89 2k74 s ARG 109 Cb -0.33 -0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 33.56 2k74 s ARG 109 CO 0.42 -1.03 -0.15 0.12 -1.08 0.00 0.00 175.30 173.57 2k74 s PHE 110 N 2.47 2.61 0.01 5.89 5.36 -1.26 -5.07 117.98 127.99 2k74 s PHE 110 Ca 0.10 -0.22 -0.39 0.00 -0.96 0.00 0.00 56.93 55.45 2k74 s PHE 110 Cb -0.13 -1.39 -0.20 0.00 -0.34 0.00 0.00 43.02 40.97 2k74 s PHE 110 CO -0.31 0.39 1.03 -2.30 -1.46 0.00 0.00 175.22 172.57 2k74 n PRO 111 N 0.83 0.00 0.00 10.12 -0.02 -1.26 -4.77 135.00 139.89 2k74 n PRO 111 Ca -0.15 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.43 2k74 n PRO 111 Cb 0.52 -1.46 0.57 0.00 -0.02 0.00 0.00 33.50 33.11 2k74 n PRO 111 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2k74 n GLU 112 N 1.46 0.60 -0.00 -0.52 2.13 -1.26 -2.20 120.64 120.84 2k74 n GLU 112 Ca 0.20 0.00 0.15 0.00 0.66 0.00 0.00 57.16 58.17 2k74 n GLU 112 Cb 0.09 -1.50 0.75 0.00 0.27 0.00 0.00 31.44 31.05 2k74 n GLU 112 CO 0.00 0.00 0.00 1.87 -0.41 0.00 0.00 177.13 178.59 2k74 n TRP 113 N -1.00 0.00 -3.85 4.31 -0.00 -1.26 -4.41 117.44 111.22 2k74 n TRP 113 Ca 0.14 -0.00 -0.31 0.00 -0.00 0.00 0.00 57.50 57.34 2k74 n TRP 113 Cb 0.07 0.00 -0.11 0.00 -0.00 0.00 0.00 31.31 31.26 2k74 n TRP 113 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 2k74 s LEU 114 N -2.00 4.88 0.00 5.87 1.43 -0.93 -4.93 118.68 122.99 2k74 s LEU 114 Ca 0.43 -3.54 0.00 0.00 -1.03 0.00 0.00 54.13 49.99 2k74 s LEU 114 Cb 0.22 -1.71 0.00 0.00 0.03 0.00 0.00 46.19 44.73 2k74 s LEU 114 CO 0.35 -0.16 0.26 -2.65 0.23 0.00 0.00 176.35 174.38 2k74 n PRO 115 N 2.44 0.00 0.21 1.29 -0.02 -1.26 -1.88 135.00 135.78 2k74 n PRO 115 Ca 0.15 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.69 2k74 n PRO 115 Cb 0.35 -1.50 0.52 0.00 -0.02 0.00 0.00 33.50 32.85 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 0.05 0.04 2.45 4.07 -1.94 1.05 115.31 121.02 2k74 h LEU 116 Ca 0.00 -0.01 -0.38 0.00 0.08 0.00 0.00 57.88 57.57 2k74 h LEU 116 Cb 0.00 -0.01 -0.05 0.00 1.08 0.00 0.00 40.66 41.68 2k74 h LEU 116 CO 0.00 0.17 -2.34 -0.90 -1.08 0.00 0.00 178.44 174.29 2k74 n ASP 117 N -4.38 1.99 -0.03 -0.43 5.68 -0.79 -3.41 116.55 115.19 2k74 n ASP 117 Ca -0.02 -0.03 -0.15 0.00 -0.50 0.00 0.00 54.79 54.08 2k74 n ASP 117 Cb 0.20 -0.52 -0.09 0.00 -1.14 0.00 0.00 41.12 39.56 2k74 n ASP 117 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 2k74 h LYS 118 N 0.02 0.36 0.00 0.11 3.11 -1.67 -1.26 116.57 117.24 2k74 h LYS 118 Ca -0.53 -0.30 0.00 0.00 -2.81 0.00 0.00 60.65 57.00 2k74 h LYS 118 Cb 1.94 0.07 0.00 0.00 -1.00 0.00 0.00 32.23 33.24 2k74 h LYS 118 CO -0.04 0.95 0.00 2.35 -2.81 0.00 0.00 179.45 179.90 2k74 h TRP 119 N -0.13 0.00 -1.94 1.91 2.91 0.92 -3.35 115.95 116.27 2k74 h TRP 119 Ca -0.03 0.00 -0.54 0.00 1.13 0.00 0.00 58.89 59.45 2k74 h TRP 119 Cb 1.03 0.00 -0.37 0.00 -0.51 0.00 0.00 29.16 29.31 2k74 h TRP 119 CO 0.13 0.00 -1.03 0.28 -1.03 0.00 0.00 178.44 176.79 2k74 n VAL 120 N -2.77 -0.77 0.40 2.65 0.31 -1.18 -4.94 118.33 112.04 2k74 n VAL 120 Ca 0.02 -3.66 0.13 0.00 -0.01 0.00 0.00 64.34 60.83 2k74 n VAL 120 Cb 0.35 -1.62 0.32 0.00 -0.91 0.00 0.00 33.84 31.98 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 4.41 0.00 -0.09 5.55 0.13 -1.37 -3.33 132.00 137.29 2k74 h PRO 121 Ca 0.10 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.27 2k74 h PRO 121 Cb 0.90 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.98 2k74 h PRO 121 CO 0.42 0.00 -0.19 0.37 -0.23 0.00 0.00 178.00 178.37 2k74 h GLN 122 N 0.00 -0.25 -2.05 0.86 4.15 -1.92 -1.45 115.11 114.45 2k74 h GLN 122 Ca 0.00 0.02 -0.71 0.00 0.77 0.00 0.00 58.65 58.73 2k74 h GLN 122 Cb 0.83 0.06 -0.33 0.00 0.21 0.00 0.00 27.48 28.24 2k74 h GLN 122 CO 0.00 -0.16 0.35 0.28 -1.93 0.00 0.00 178.83 177.37 2k74 n VAL 123 N -5.32 4.04 0.00 2.39 0.31 -1.25 -4.46 118.33 114.04 2k74 n VAL 123 Ca -0.03 -5.22 0.00 0.00 -0.01 0.00 0.00 64.34 59.07 2k74 n VAL 123 Cb 0.24 -1.38 0.00 0.00 -0.91 0.00 0.00 33.84 31.79 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 -0.32 -0.25 -1.76 3.52 -0.00 -1.10 -4.98 117.46 112.57 2k74 n PHE 124 Ca 0.44 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.47 2k74 n PHE 124 Cb 0.36 0.06 -0.03 0.00 -0.00 0.00 0.00 39.48 39.87 2k74 n PHE 124 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.76 176.90 2k74 s VAL 125 N -1.11 2.08 0.22 -2.13 -7.23 -0.57 -4.93 120.40 106.74 2k74 s VAL 125 Ca 0.00 0.06 0.03 0.00 -1.81 0.00 0.00 61.98 60.26 2k74 s VAL 125 Cb 0.00 -3.04 -0.03 0.00 0.56 0.00 0.00 36.38 33.87 2k74 s VAL 125 CO 0.00 0.01 0.36 0.00 -0.31 0.00 0.00 175.10 175.15 2k74 s ALA 126 N 0.82 3.91 -0.29 1.32 0.00 -1.26 -4.96 121.76 121.30 2k74 s ALA 126 Ca 0.71 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 51.57 2k74 s ALA 126 Cb -0.49 -1.81 0.19 0.00 0.00 0.00 0.00 23.12 21.02 2k74 s ALA 126 CO 0.37 0.33 0.74 -1.54 0.00 0.00 0.00 175.76 175.65 2k74 s SER 127 N -3.68 -1.24 0.00 0.00 1.04 -0.87 -4.86 113.70 104.10 2k74 s SER 127 Ca 0.35 0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.91 2k74 s SER 127 Cb -0.10 1.78 0.00 0.00 0.10 0.00 0.00 66.02 67.80 2k74 s SER 127 CO 0.29 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.90 2k74 n GLY 128 N 5.30 0.83 3.88 7.32 0.00 -0.95 -2.74 105.19 118.81 2k74 n GLY 128 Ca 0.07 -1.90 -0.30 0.00 0.00 0.00 0.00 46.02 43.88 2k74 n GLY 128 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k74 s ASP 129 N -1.23 6.44 -0.17 1.61 1.11 -1.26 -4.71 116.67 118.46 2k74 s ASP 129 Ca 0.00 1.20 -0.06 0.00 0.18 0.00 0.00 52.55 53.87 2k74 s ASP 129 Cb 0.00 -2.36 -0.04 0.00 1.07 0.00 0.00 42.92 41.60 2k74 s ASP 129 CO 0.00 -0.53 0.04 0.00 1.18 0.00 0.00 175.17 175.85 2k74 n ALA 131 N 3.48 0.00 -1.64 0.00 0.00 -1.26 -4.99 120.51 116.11 2k74 n ALA 131 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.93 2k74 n ALA 131 Cb 0.52 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.01 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 -0.53 2.95 -0.03 0.00 2.12 -1.26 -4.93 118.70 117.02 2k74 s GLU 132 Ca 0.00 1.62 -0.17 0.00 0.36 0.00 0.00 54.97 56.78 2k74 s GLU 132 Cb 0.00 -1.95 -0.05 0.00 0.26 0.00 0.00 34.13 32.39 2k74 s GLU 132 CO 0.00 -1.18 0.48 -0.98 -0.54 0.00 0.00 175.26 173.04 2k74 s ARG 133 N -3.61 4.17 0.00 4.30 3.03 -1.26 -4.93 118.95 120.65 2k74 s ARG 133 Ca 0.72 0.52 0.00 0.00 2.03 0.00 0.00 55.73 59.00 2k74 s ARG 133 Cb -0.25 -3.32 0.00 0.00 -1.03 0.00 0.00 34.95 30.35 2k74 s ARG 133 CO 0.35 0.45 0.00 1.04 -1.13 0.00 0.00 175.30 176.01 2k74 n GLN 134 N 2.59 2.30 -3.65 3.89 1.13 -1.26 -5.09 117.38 117.29 2k74 n GLN 134 Ca -0.10 0.00 -0.04 0.00 -1.94 0.00 0.00 57.00 54.92 2k74 n GLN 134 Cb 0.52 -0.83 -0.07 0.00 0.11 0.00 0.00 30.24 29.97 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 -1.47 -0.11 0.12 1.08 -0.00 -1.26 -5.15 118.94 112.15 2k74 s TRP 135 Ca 0.00 0.25 -0.05 0.00 -0.00 0.00 0.00 56.10 56.30 2k74 s TRP 135 Cb 0.00 0.47 -0.02 0.00 -0.00 0.00 0.00 33.47 33.92 2k74 s TRP 135 CO 0.00 -0.06 0.14 0.16 -0.00 0.00 0.00 176.95 177.19 2k74 s ASP 136 N -0.08 0.22 -0.01 5.86 1.47 -1.26 -3.30 116.67 119.57 2k74 s ASP 136 Ca 0.07 -0.96 0.04 0.00 1.18 0.00 0.00 52.55 52.88 2k74 s ASP 136 Cb -0.04 0.33 -0.01 0.00 -0.34 0.00 0.00 42.92 42.86 2k74 s ASP 136 CO -0.14 -0.76 -0.12 -0.36 0.68 0.00 0.00 175.17 174.48 2k74 s PHE 137 N -3.96 1.07 -1.37 2.11 0.40 0.47 -4.70 117.98 112.00 2k74 s PHE 137 Ca 0.15 -0.21 0.00 0.00 -0.60 0.00 0.00 56.93 56.27 2k74 s PHE 137 Cb 0.06 -0.70 0.00 0.00 0.51 0.00 0.00 43.02 42.89 2k74 s PHE 137 CO -0.03 -0.03 0.00 -0.11 0.70 0.00 0.00 175.22 175.75 2k74 n LEU 138 N 2.83 -0.69 0.00 -0.37 7.94 -1.26 0.38 117.00 125.83 2k74 n LEU 138 Ca -0.14 0.32 0.00 0.00 -1.11 0.00 0.00 56.01 55.08 2k74 n LEU 138 Cb 0.56 -2.46 0.00 0.00 0.53 0.00 0.00 43.42 42.04 2k74 n LEU 138 CO 0.25 -0.93 0.00 0.61 -1.11 0.00 0.00 177.39 176.21 2k74 n GLY 139 N 0.01 0.49 3.20 -3.96 0.00 -1.26 -5.05 105.19 98.61 2k74 n GLY 139 Ca -0.13 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.70 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 1.99 0.56 0.99 1.43 0.16 -5.08 118.68 118.73 2k74 s LEU 140 Ca 0.00 -0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 52.47 2k74 s LEU 140 Cb 0.00 -1.20 -0.05 0.00 0.03 0.00 0.00 46.19 44.97 2k74 s LEU 140 CO 0.00 0.19 1.11 -0.70 0.23 0.00 0.00 176.35 177.18 2k74 s GLU 141 N 0.01 3.32 0.15 1.70 2.56 -1.26 -0.40 118.70 124.79 2k74 s GLU 141 Ca -0.06 1.53 -0.25 0.00 0.00 0.00 0.00 54.97 56.19 2k74 s GLU 141 Cb -0.13 -2.01 0.02 0.00 2.00 0.00 0.00 34.13 34.01 2k74 s GLU 141 CO 0.04 -0.86 1.59 0.52 -0.56 0.00 0.00 175.26 176.00 2k74 h MET 142 N 1.03 -0.30 -1.18 4.30 2.86 -1.95 -0.27 114.93 119.42 2k74 h MET 142 Ca -0.49 0.02 0.43 0.00 -2.06 0.00 0.00 59.70 57.60 2k74 h MET 142 Cb 1.25 0.07 -0.15 0.00 0.06 0.00 0.00 31.60 32.83 2k74 h MET 142 CO 0.57 -0.20 0.71 -1.35 1.06 0.00 0.00 176.91 177.70 2k74 h PRO 143 N -0.31 0.05 0.04 -0.22 0.11 -1.92 0.43 132.00 130.18 2k74 h PRO 143 Ca 0.14 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.25 2k74 h PRO 143 Cb 0.56 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.65 2k74 h PRO 143 CO -0.50 0.03 -0.02 1.96 -0.21 0.00 0.00 178.00 179.26 2k74 h GLN 144 N 0.05 -0.06 0.71 1.05 1.08 -1.42 -2.77 115.11 113.76 2k74 h GLN 144 Ca 0.84 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 58.01 2k74 h GLN 144 Cb 2.44 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 29.89 2k74 h GLN 144 CO -0.59 0.44 -0.36 -1.49 -0.95 0.00 0.00 178.83 175.88 2k74 h TRP 145 N -0.59 -0.93 -0.97 2.96 4.06 0.05 -2.21 115.95 118.33 2k74 h TRP 145 Ca -0.01 -0.02 0.32 0.00 2.06 0.00 0.00 58.89 61.24 2k74 h TRP 145 Cb 0.52 0.31 -0.16 0.00 -1.00 0.00 0.00 29.16 28.84 2k74 h TRP 145 CO 0.10 -0.57 0.43 1.25 -3.56 0.00 0.00 178.44 176.09 2k74 h LEU 146 N -0.98 0.25 -1.32 -4.49 7.12 -0.75 3.33 115.31 118.47 2k74 h LEU 146 Ca -0.10 0.22 0.11 0.00 0.13 0.00 0.00 57.88 58.24 2k74 h LEU 146 Cb 0.76 0.23 -0.06 0.00 -0.53 0.00 0.00 40.66 41.06 2k74 h LEU 146 CO 0.15 -0.22 0.54 0.25 -0.13 0.00 0.00 178.44 179.02 2k74 h LEU 147 N 0.20 0.67 -0.93 2.25 6.46 -1.10 0.23 115.31 123.08 2k74 h LEU 147 Ca 0.70 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 58.53 2k74 h LEU 147 Cb 1.61 -0.11 -0.06 0.00 -0.73 0.00 0.00 40.66 41.37 2k74 h LEU 147 CO -0.68 0.38 0.60 1.23 -0.62 0.00 0.00 178.44 179.35 2k74 h GLY 148 N 0.73 1.39 2.00 3.75 0.00 0.65 -1.04 103.07 110.55 2k74 h GLY 148 Ca 0.39 -0.45 -0.13 0.00 0.00 0.00 0.00 47.33 47.14 2k74 h GLY 148 CO -0.16 0.35 -0.64 -2.22 0.00 0.00 0.00 176.54 173.87 2k74 h ILE 149 N 1.13 1.12 0.02 2.60 5.03 -0.50 -3.03 117.51 123.88 2k74 h ILE 149 Ca 0.39 -2.54 -0.00 0.00 -0.12 0.00 0.00 64.86 62.59 2k74 h ILE 149 Cb 0.09 2.53 0.00 0.00 -3.03 0.00 0.00 36.82 36.40 2k74 h ILE 149 CO -0.15 0.63 -0.01 0.15 -0.68 0.00 0.00 178.15 178.09 2k74 h PHE 150 N 0.00 -0.02 -0.42 1.37 3.04 0.52 -2.37 116.94 119.06 2k74 h PHE 150 Ca -0.01 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.92 2k74 h PHE 150 Cb 1.47 0.01 -0.02 0.00 2.56 0.00 0.00 35.95 39.97 2k74 h PHE 150 CO 0.00 0.14 0.16 0.97 -2.02 0.00 0.00 178.31 177.56 2k74 h ILE 151 N -0.18 1.20 -0.63 1.41 2.10 -1.32 -2.80 117.51 117.30 2k74 h ILE 151 Ca -0.00 -0.64 0.13 0.00 1.08 0.00 0.00 64.86 65.42 2k74 h ILE 151 Cb 0.17 0.83 -0.10 0.00 -1.09 0.00 0.00 36.82 36.64 2k74 h ILE 151 CO 0.00 0.23 0.08 0.00 -1.08 0.00 0.00 178.15 177.38 2k74 h ALA 152 N 1.01 0.70 -0.57 0.18 0.00 -1.44 0.02 119.26 119.16 2k74 h ALA 152 Ca 0.14 0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.29 2k74 h ALA 152 Cb 0.21 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 2k74 h ALA 152 CO -0.01 -0.36 0.22 1.88 0.00 0.00 0.00 179.25 180.99 2k74 h TYR 153 N 0.19 0.39 -0.22 0.00 -1.99 -1.16 0.51 116.97 114.68 2k74 h TYR 153 Ca 0.33 0.03 0.05 0.00 2.00 0.00 0.00 58.73 61.14 2k74 h TYR 153 Cb 0.53 -0.09 -0.01 0.00 2.00 0.00 0.00 36.73 39.16 2k74 h TYR 153 CO -0.30 0.12 0.16 -0.07 -0.00 0.00 0.00 178.16 178.06 2k74 h LEU 154 N 0.41 0.06 -0.51 3.88 3.38 -0.87 0.22 115.31 121.89 2k74 h LEU 154 Ca 0.28 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.13 2k74 h LEU 154 Cb 0.31 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2k74 h LEU 154 CO -0.27 0.04 -0.57 0.40 0.09 0.00 0.00 178.44 178.13 2k74 h ILE 155 N 0.07 1.14 -0.18 1.22 1.08 -0.32 -2.17 117.51 118.34 2k74 h ILE 155 Ca 0.10 -2.15 -0.16 0.00 -0.39 0.00 0.00 64.86 62.26 2k74 h ILE 155 Cb 0.33 2.26 -0.01 0.00 -3.07 0.00 0.00 36.82 36.33 2k74 h ILE 155 CO -0.01 0.55 -0.57 0.58 -0.69 0.00 0.00 178.15 178.02 2k74 h VAL 156 N 0.00 1.33 0.00 1.67 2.07 -0.18 -2.81 116.25 118.33 2k74 h VAL 156 Ca -0.01 -1.83 -0.00 0.00 0.82 0.00 0.00 66.70 65.68 2k74 h VAL 156 Cb 1.21 1.80 -0.00 0.00 -1.52 0.00 0.00 31.29 32.79 2k74 h VAL 156 CO 0.07 0.57 -0.03 0.00 0.02 0.00 0.00 177.57 178.20 2k74 h ALA 157 N 0.96 0.00 -0.97 1.67 0.00 -1.46 -2.35 119.26 117.12 2k74 h ALA 157 Ca 0.00 -0.38 0.16 0.00 0.00 0.00 0.00 54.91 54.70 2k74 h ALA 157 Cb 1.12 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.83 2k74 h ALA 157 CO 0.11 0.02 0.61 0.28 0.00 0.00 0.00 179.25 180.26 2k74 h VAL 158 N -1.00 0.78 0.06 0.00 2.07 -1.51 0.41 116.25 117.07 2k74 h VAL 158 Ca -0.01 -0.26 -0.25 0.00 0.82 0.00 0.00 66.70 67.00 2k74 h VAL 158 Cb 0.73 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 2k74 h VAL 158 CO -0.00 0.14 -1.23 -0.07 0.02 0.00 0.00 177.57 176.43 2k74 h LEU 159 N 0.77 0.18 -0.48 2.57 -0.00 -1.63 -2.96 115.31 113.76 2k74 h LEU 159 Ca 0.52 -0.22 -0.04 0.00 -0.00 0.00 0.00 57.88 58.14 2k74 h LEU 159 Cb 0.80 -0.06 -0.01 0.00 -0.00 0.00 0.00 40.66 41.39 2k74 h LEU 159 CO -0.29 1.17 -0.21 0.58 -0.00 0.00 0.00 178.44 179.70 2k74 h VAL 160 N 0.03 0.40 0.00 1.22 2.07 -0.65 -1.88 116.25 117.44 2k74 h VAL 160 Ca -0.11 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.07 2k74 h VAL 160 Cb 1.89 2.00 -0.00 0.00 -1.52 0.00 0.00 31.29 33.66 2k74 h VAL 160 CO 0.15 0.20 -0.08 0.58 0.02 0.00 0.00 177.57 178.45 2k74 h VAL 161 N 0.00 1.65 0.00 2.57 2.07 -0.29 -3.29 116.25 118.95 2k74 h VAL 161 Ca -0.00 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.25 2k74 h VAL 161 Cb 0.99 3.14 0.00 0.00 -1.52 0.00 0.00 31.29 33.89 2k74 h VAL 161 CO 0.03 0.56 0.00 0.40 0.02 0.00 0.00 177.57 178.57 2k74 h ILE 162 N -1.00 0.00 0.00 4.57 2.04 -1.59 -2.94 117.51 118.60 2k74 h ILE 162 Ca -0.02 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.51 2k74 h ILE 162 Cb 0.96 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 2k74 h ILE 162 CO -0.01 0.00 0.16 -1.54 0.00 0.00 0.00 178.15 176.76 2k74 n SER 163 N -2.70 0.00 -4.79 1.72 3.41 -0.71 -4.55 113.62 106.00 2k74 n SER 163 Ca 0.01 0.28 -0.36 0.00 -0.26 0.00 0.00 58.87 58.54 2k74 n SER 163 Cb 0.24 -0.28 -0.04 0.00 -0.26 0.00 0.00 64.21 63.87 2k74 n SER 163 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2k74 s GLN 164 N -2.51 4.13 0.00 4.33 -1.52 -1.11 -4.86 119.66 118.12 2k74 s GLN 164 Ca 0.00 1.43 0.00 0.00 -1.95 0.00 0.00 55.36 54.84 2k74 s GLN 164 Cb 0.00 -2.44 0.00 0.00 -0.22 0.00 0.00 33.01 30.35 2k74 s GLN 164 CO 0.00 -0.15 0.43 -2.30 -0.25 0.00 0.00 175.29 173.02 2k74 n PRO 165 N -0.25 0.00 0.00 2.91 -0.02 -1.26 -3.89 135.00 132.49 2k74 n PRO 165 Ca 0.06 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 2k74 n PRO 165 Cb 0.51 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 2k74 n PRO 165 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2k74 n PHE 166 N -0.93 0.00 -1.51 6.00 7.35 -1.26 -3.77 117.46 123.33 2k74 n PHE 166 Ca 0.00 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.37 2k74 n PHE 166 Cb 0.14 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 39.83 2k74 n PHE 166 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 2k74 n LYS 167 N -0.63 0.22 0.00 -4.13 2.85 -1.25 -4.74 118.16 110.49 2k74 n LYS 167 Ca 0.00 -0.08 0.00 0.00 -1.05 0.00 0.00 58.31 57.18 2k74 n LYS 167 Cb 0.00 -1.89 0.00 0.00 -0.65 0.00 0.00 35.03 32.49 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 10.84 0.00 -2.11 0.58 0.00 -1.25 -5.11 120.51 123.46 2k74 n ALA 168 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 53.44 54.04 2k74 n ALA 168 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.63 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 0.00 -4.91 -2.01 0.00 5.02 -1.26 -5.00 118.16 110.01 2k74 n LYS 169 Ca 0.00 3.48 -0.02 0.00 -2.02 0.00 0.00 58.31 59.75 2k74 n LYS 169 Cb 0.00 -3.96 0.03 0.00 -0.02 0.00 0.00 35.03 31.08 2k74 n LYS 169 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2k74 n LYS 170 N 1.92 0.79 -2.51 1.97 2.85 -1.26 -5.07 118.16 116.85 2k74 n LYS 170 Ca 0.00 -1.82 -0.01 0.00 -1.05 0.00 0.00 58.31 55.43 2k74 n LYS 170 Cb 0.00 -0.09 -0.01 0.00 -0.65 0.00 0.00 35.03 34.29 2k74 n LYS 170 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 2k74 n ARG 171 N -0.50 -3.18 -3.70 -1.58 3.00 -1.26 -5.08 116.66 104.37 2k74 n ARG 171 Ca -0.10 2.57 0.01 0.00 -0.00 0.00 0.00 57.85 60.33 2k74 n ARG 171 Cb 0.87 -4.69 -0.00 0.00 0.00 0.00 0.00 32.46 28.63 2k74 n ARG 171 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.63 177.79 2k74 s ASP 172 N -1.23 -0.07 0.69 6.15 1.47 -1.26 -5.16 116.67 117.26 2k74 s ASP 172 Ca -0.05 -0.22 -0.12 0.00 1.18 0.00 0.00 52.55 53.34 2k74 s ASP 172 Cb 0.00 0.24 0.01 0.00 -0.34 0.00 0.00 42.92 42.83 2k74 s ASP 172 CO 0.67 -0.45 1.07 -0.76 0.68 0.00 0.00 175.17 176.38 2k74 s LEU 173 N -3.09 3.19 0.00 2.11 1.43 -1.26 -5.06 118.68 116.00 2k74 s LEU 173 Ca 0.16 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.95 2k74 s LEU 173 Cb 0.03 -4.51 0.00 0.00 0.03 0.00 0.00 46.19 41.74 2k74 s LEU 173 CO -0.02 -1.49 0.00 0.49 0.23 0.00 0.00 176.35 175.56 2k74 n PHE 174 N -2.98 0.00 0.00 0.29 3.72 -1.26 -5.13 117.46 112.11 2k74 n PHE 174 Ca 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 2k74 n PHE 174 Cb 0.53 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 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 4.89 1.94 0.63 1.37 0.00 -1.26 -5.06 105.19 107.70 2k74 n GLY 175 Ca 0.00 0.24 -0.02 0.00 0.00 0.00 0.00 46.02 46.24 2k74 n GLY 175 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2k74 n ARG 176 N 0.00 0.00 0.00 1.61 1.85 -1.26 -5.14 116.66 113.72 2k74 n ARG 176 Ca 0.00 -0.31 0.00 0.00 -1.00 0.00 0.00 57.85 56.54 2k74 n ARG 176 Cb 0.00 0.17 0.00 0.00 -1.05 0.00 0.00 32.46 31.58 2k74 n ARG 176 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2k74 n GLY 177 N 0.00 3.34 3.13 2.89 0.00 -1.26 -5.10 105.19 108.19 2k74 n GLY 177 Ca -0.09 -0.97 -0.35 0.00 0.00 0.00 0.00 46.02 44.61 2k74 n GLY 177 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2k74 s HIS 178 N -2.00 3.51 -0.18 1.61 3.76 -1.26 -4.95 115.29 115.78 2k74 s HIS 178 Ca 0.00 -2.29 -0.25 0.00 -0.15 0.00 0.00 55.06 52.37 2k74 s HIS 178 Cb 0.00 -2.85 -0.22 0.00 1.11 0.00 0.00 32.58 30.61 2k74 s HIS 178 CO 0.00 -0.92 0.47 0.45 -0.85 0.00 0.00 174.74 173.90 2k74 h HIS 179 N 8.00 0.01 -4.00 1.40 3.86 -2.08 -3.47 115.15 118.87 2k74 h HIS 179 Ca -0.15 -0.01 -0.45 0.00 -1.16 0.00 0.00 60.37 58.61 2k74 h HIS 179 Cb 1.05 -0.00 0.15 0.00 1.06 0.00 0.00 27.41 29.67 2k74 h HIS 179 CO 0.56 1.27 0.24 -3.38 0.86 0.00 0.00 177.93 177.48 2k74 s HIS 180 N -2.30 2.12 0.24 2.45 -3.43 -1.26 -5.09 115.29 108.02 2k74 s HIS 180 Ca -0.24 0.85 -0.06 0.00 -0.80 0.00 0.00 55.06 54.81 2k74 s HIS 180 Cb 0.02 -3.37 -0.02 0.00 -1.43 0.00 0.00 32.58 27.78 2k74 s HIS 180 CO 0.64 -2.76 0.31 -1.01 -2.00 0.00 0.00 174.74 169.91 2k74 s HIS 181 N -3.14 0.85 0.00 0.38 3.76 -1.26 -5.03 115.29 110.85 2k74 s HIS 181 Ca 0.65 -1.12 -0.04 0.00 -0.15 0.00 0.00 55.06 54.40 2k74 s HIS 181 Cb -0.16 -0.22 -0.20 0.00 1.11 0.00 0.00 32.58 33.12 2k74 s HIS 181 CO 0.55 -0.83 3.10 1.58 -0.85 0.00 0.00 174.74 178.29 2k74 n HIS 182 N -0.35 0.00 -1.90 1.40 -0.00 -1.26 -5.30 115.22 107.81 2k74 n HIS 182 Ca 0.01 -1.31 0.00 0.00 0.46 0.00 0.00 57.72 56.87 2k74 n HIS 182 Cb 0.64 -1.29 0.00 0.00 -0.12 0.00 0.00 29.99 29.22 2k74 n HIS 182 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38