#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 0.75 -1.55 4.03 7.12 -2.07 -2.81 115.31 120.78 2k74 h LEU 2 Ca 0.00 -0.40 0.17 0.00 0.13 0.00 0.00 57.88 57.77 2k74 h LEU 2 Cb 0.00 -0.21 -0.06 0.00 -0.53 0.00 0.00 40.66 39.87 2k74 h LEU 2 CO 0.00 0.98 0.54 0.03 -0.13 0.00 0.00 178.44 179.86 2k74 h ARG 3 N 0.51 0.41 -0.19 1.25 2.47 -2.02 -0.62 114.38 116.19 2k74 h ARG 3 Ca 0.08 -0.02 -0.17 0.00 -1.26 0.00 0.00 59.98 58.60 2k74 h ARG 3 Cb 0.70 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.93 2k74 h ARG 3 CO 0.05 0.27 -0.55 0.35 0.56 0.00 0.00 179.97 180.65 2k74 h PHE 4 N 0.42 0.93 -0.81 3.04 3.04 -1.95 -3.15 116.94 118.46 2k74 h PHE 4 Ca 0.40 -0.37 0.17 0.00 3.98 0.00 0.00 57.97 62.16 2k74 h PHE 4 Cb 0.95 -0.16 -0.11 0.00 2.56 0.00 0.00 35.95 39.19 2k74 h PHE 4 CO -0.00 1.17 0.33 -0.07 -2.02 0.00 0.00 178.31 177.71 2k74 h LEU 5 N 0.42 0.28 -1.58 0.59 3.38 -0.87 0.73 115.31 118.26 2k74 h LEU 5 Ca -0.01 0.13 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 2k74 h LEU 5 Cb 1.17 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2k74 h LEU 5 CO 0.12 0.06 -0.22 0.78 0.09 0.00 0.00 178.44 179.27 2k74 h ASN 6 N 0.42 0.00 0.04 -0.43 2.35 -1.50 -0.44 115.58 116.02 2k74 h ASN 6 Ca 0.47 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 56.15 2k74 h ASN 6 Cb 0.78 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.16 2k74 h ASN 6 CO -0.46 0.22 -0.30 -0.61 -1.65 0.00 0.00 177.43 174.64 2k74 h GLN 7 N 0.00 0.14 -0.61 0.81 4.15 0.26 -1.44 115.11 118.41 2k74 h GLN 7 Ca -0.00 -0.20 -0.04 0.00 0.77 0.00 0.00 58.65 59.18 2k74 h GLN 7 Cb 0.41 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.14 2k74 h GLN 7 CO 0.03 1.03 0.20 0.00 -1.93 0.00 0.00 178.83 178.17 2k74 h ALA 8 N 0.11 1.21 0.02 3.38 0.00 -0.08 -2.73 119.26 121.18 2k74 h ALA 8 Ca -0.05 -0.19 -0.23 0.00 0.00 0.00 0.00 54.91 54.44 2k74 h ALA 8 Cb 1.17 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2k74 h ALA 8 CO 0.06 0.56 -0.99 0.66 0.00 0.00 0.00 179.25 179.54 2k74 h SER 9 N 0.89 0.49 0.00 0.00 4.64 -1.18 -2.99 113.55 115.40 2k74 h SER 9 Ca 0.20 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 2k74 h SER 9 Cb 0.24 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2k74 h SER 9 CO -0.01 1.23 0.00 1.67 -0.87 0.00 0.00 176.83 178.85 2k74 n GLN 10 N -3.70 0.44 -3.98 4.77 7.27 -0.54 -4.66 117.38 116.99 2k74 n GLN 10 Ca -0.07 0.00 -0.33 0.00 0.07 0.00 0.00 57.00 56.68 2k74 n GLN 10 Cb 0.87 -1.25 -0.05 0.00 2.41 0.00 0.00 30.24 32.21 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 -1.78 2.12 0.00 1.69 0.00 -1.13 -4.93 107.32 103.28 2k74 s GLY 11 Ca 0.11 -0.83 -0.24 0.00 0.00 0.00 0.00 44.72 43.75 2k74 s GLY 11 CO 0.08 -0.74 1.30 3.21 0.00 0.00 0.00 173.10 176.96 2k74 h ARG 12 N 3.72 0.11 -0.90 2.90 3.08 -1.87 -3.00 114.38 118.41 2k74 h ARG 12 Ca -0.48 -0.06 0.24 0.00 0.07 0.00 0.00 59.98 59.75 2k74 h ARG 12 Cb 1.18 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 31.07 2k74 h ARG 12 CO 0.68 0.55 0.07 0.78 -1.07 0.00 0.00 179.97 180.98 2k74 h GLY 13 N -0.33 1.18 0.94 0.04 0.00 -1.95 0.54 103.07 103.50 2k74 h GLY 13 Ca 0.01 0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 2k74 h GLY 13 CO 0.01 -0.43 0.14 0.00 0.00 0.00 0.00 176.54 176.26 2k74 h ALA 14 N 1.87 0.34 -0.80 3.60 0.00 -1.77 -0.71 119.26 121.79 2k74 h ALA 14 Ca 0.54 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.40 2k74 h ALA 14 Cb 1.08 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 2k74 h ALA 14 CO -0.80 -0.11 0.52 -1.49 0.00 0.00 0.00 179.25 177.37 2k74 h TRP 15 N 0.31 0.97 0.00 0.00 4.06 0.05 0.53 115.95 121.87 2k74 h TRP 15 Ca 0.09 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 61.04 2k74 h TRP 15 Cb 0.09 -0.32 -0.00 0.00 -1.00 0.00 0.00 29.16 27.92 2k74 h TRP 15 CO -0.03 0.58 -0.15 -0.07 -3.56 0.00 0.00 178.44 175.21 2k74 h LEU 16 N 1.03 0.00 -1.11 -4.49 -0.00 -0.19 -1.16 115.31 109.38 2k74 h LEU 16 Ca 0.31 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 58.11 2k74 h LEU 16 Cb -0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.61 2k74 h LEU 16 CO -0.10 0.15 -0.39 0.25 -0.00 0.00 0.00 178.44 178.36 2k74 h LEU 17 N 0.00 0.00 -0.20 1.67 5.85 0.63 -2.44 115.31 120.81 2k74 h LEU 17 Ca -0.00 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.50 2k74 h LEU 17 Cb 0.31 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 2k74 h LEU 17 CO 0.02 0.39 -0.93 0.24 -0.34 0.00 0.00 178.44 177.81 2k74 h MET 18 N 0.00 0.27 0.27 1.25 2.86 -0.63 -2.94 114.93 116.02 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 0.80 0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.55 2k74 h MET 18 CO 0.05 1.03 -0.13 0.00 1.06 0.00 0.00 176.91 178.92 2k74 h ALA 19 N 0.86 -0.36 -0.28 6.32 0.00 -1.24 -2.99 119.26 121.57 2k74 h ALA 19 Ca -0.06 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.72 2k74 h ALA 19 Cb 1.58 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 19.44 2k74 h ALA 19 CO 0.15 -0.50 -0.18 0.35 0.00 0.00 0.00 179.25 179.07 2k74 h PHE 20 N -0.77 -0.45 -0.38 0.00 3.04 -1.55 -1.53 116.94 115.30 2k74 h PHE 20 Ca -0.04 0.03 0.04 0.00 3.98 0.00 0.00 57.97 61.99 2k74 h PHE 20 Cb 0.50 0.24 -0.07 0.00 2.56 0.00 0.00 35.95 39.18 2k74 h PHE 20 CO 0.04 -0.25 -0.47 1.79 -2.02 0.00 0.00 178.31 177.40 2k74 h THR 21 N -0.15 0.00 -0.97 4.41 1.35 -1.56 0.58 112.91 116.57 2k74 h THR 21 Ca 0.15 0.00 0.20 0.00 -0.55 0.00 0.00 66.41 66.21 2k74 h THR 21 Cb 0.38 0.00 -0.09 0.00 -1.73 0.00 0.00 68.15 66.71 2k74 h THR 21 CO -0.37 0.00 0.61 0.00 -0.25 0.00 0.00 175.52 175.51 2k74 h ALA 22 N -0.22 1.95 -0.46 6.62 0.00 -1.31 0.83 119.26 126.67 2k74 h ALA 22 Ca 0.07 0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 2k74 h ALA 22 Cb 0.48 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2k74 h ALA 22 CO -0.52 -0.28 -0.26 1.25 0.00 0.00 0.00 179.25 179.44 2k74 h LEU 23 N 0.59 1.03 -1.21 0.00 5.85 0.44 -2.54 115.31 119.46 2k74 h LEU 23 Ca 0.53 -0.42 0.17 0.00 0.84 0.00 0.00 57.88 59.01 2k74 h LEU 23 Cb 1.06 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.72 2k74 h LEU 23 CO -0.28 1.22 0.60 0.00 -0.34 0.00 0.00 178.44 179.64 2k74 h ALA 24 N 0.84 1.84 -0.02 1.25 0.00 0.25 0.22 119.26 123.64 2k74 h ALA 24 Ca 0.10 0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.80 2k74 h ALA 24 Cb 0.85 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.56 2k74 h ALA 24 CO 0.08 -0.15 -0.97 -0.07 0.00 0.00 0.00 179.25 178.14 2k74 h LEU 25 N 0.68 0.79 -0.26 0.00 4.07 -1.31 -1.89 115.31 117.38 2k74 h LEU 25 Ca 0.51 -0.61 -0.02 0.00 0.08 0.00 0.00 57.88 57.83 2k74 h LEU 25 Cb 0.88 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.37 2k74 h LEU 25 CO -0.27 1.41 0.08 -0.08 -1.08 0.00 0.00 178.44 178.50 2k74 h GLU 26 N 0.36 0.41 0.33 1.13 4.22 -0.61 -2.46 114.58 117.96 2k74 h GLU 26 Ca -0.10 -0.09 -0.02 0.00 0.08 0.00 0.00 59.36 59.23 2k74 h GLU 26 Cb 1.61 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.81 2k74 h GLU 26 CO 0.18 0.49 -0.16 1.25 -2.18 0.00 0.00 179.01 178.60 2k74 h LEU 27 N 0.26 -0.37 -0.98 1.64 5.85 -0.73 -0.96 115.31 120.03 2k74 h LEU 27 Ca 0.08 -0.17 0.30 0.00 0.84 0.00 0.00 57.88 58.93 2k74 h LEU 27 Cb 0.25 0.10 -0.14 0.00 0.37 0.00 0.00 40.66 41.23 2k74 h LEU 27 CO -0.00 0.02 0.51 0.71 -0.34 0.00 0.00 178.44 179.34 2k74 h THR 28 N -0.82 0.34 -0.01 1.05 1.35 -1.38 0.17 112.91 113.61 2k74 h THR 28 Ca -0.04 -0.12 -0.21 0.00 -0.55 0.00 0.00 66.41 65.49 2k74 h THR 28 Cb 0.52 -0.04 0.02 0.00 -1.73 0.00 0.00 68.15 66.92 2k74 h THR 28 CO 0.07 0.06 -0.80 0.00 -0.25 0.00 0.00 175.52 174.61 2k74 h ALA 29 N 1.82 0.11 0.00 6.62 0.00 -1.39 -3.12 119.26 123.30 2k74 h ALA 29 Ca 0.69 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2k74 h ALA 29 Cb 1.51 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.34 2k74 h ALA 29 CO -0.60 0.51 0.28 1.25 0.00 0.00 0.00 179.25 180.69 2k74 h LEU 30 N 0.14 0.00 0.08 0.00 6.46 0.76 0.17 115.31 122.92 2k74 h LEU 30 Ca -0.10 0.00 -0.32 0.00 -0.12 0.00 0.00 57.88 57.34 2k74 h LEU 30 Cb 1.48 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.38 2k74 h LEU 30 CO 0.16 0.00 -1.79 -0.25 -0.62 0.00 0.00 178.44 175.94 2k74 h TRP 31 N 0.00 0.29 -0.22 1.25 2.91 -1.32 -3.24 115.95 115.62 2k74 h TRP 31 Ca 0.00 -0.22 -0.00 0.00 1.13 0.00 0.00 58.89 59.80 2k74 h TRP 31 Cb 0.55 -0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 29.18 2k74 h TRP 31 CO 0.00 1.41 0.13 0.74 -1.03 0.00 0.00 178.44 179.68 2k74 h PHE 32 N 0.04 0.28 -0.04 2.65 0.04 -0.64 -0.04 116.94 119.24 2k74 h PHE 32 Ca -0.33 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.39 2k74 h PHE 32 Cb 2.02 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 40.08 2k74 h PHE 32 CO 0.05 0.19 -0.18 0.37 -0.60 0.00 0.00 178.31 178.14 2k74 h GLN 33 N 0.30 0.19 0.00 1.51 5.75 -1.61 0.51 115.11 121.76 2k74 h GLN 33 Ca 0.08 -0.15 0.00 0.00 -0.15 0.00 0.00 58.65 58.42 2k74 h GLN 33 Cb -0.00 0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.58 2k74 h GLN 33 CO -0.01 0.81 0.00 1.58 -2.65 0.00 0.00 178.83 178.56 2k74 n HIS 34 N -4.57 0.00 -0.07 3.99 -0.00 -0.96 -0.11 115.22 113.50 2k74 n HIS 34 Ca -0.09 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 57.98 2k74 n HIS 34 Cb 0.43 -0.37 -0.06 0.00 -0.12 0.00 0.00 29.99 29.87 2k74 n HIS 34 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 2k74 n VAL 35 N -1.37 0.81 -0.49 3.57 0.31 -0.07 -4.60 118.33 116.49 2k74 n VAL 35 Ca 0.06 -0.29 0.11 0.00 -0.01 0.00 0.00 64.34 64.21 2k74 n VAL 35 Cb 0.15 -1.15 0.35 0.00 -0.91 0.00 0.00 33.84 32.28 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 -3.08 3.26 -4.04 5.55 2.81 0.18 -4.93 117.12 116.87 2k74 n MET 36 Ca -0.26 -2.79 -0.33 0.00 -1.81 0.00 0.00 57.70 52.51 2k74 n MET 36 Cb 0.75 -1.75 -0.05 0.00 -0.71 0.00 0.00 33.22 31.47 2k74 n MET 36 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2k74 n LEU 37 N 1.42 -1.03 -4.81 4.03 4.32 0.84 -4.87 117.00 116.90 2k74 n LEU 37 Ca 0.26 -0.84 -0.32 0.00 -0.02 0.00 0.00 56.01 55.08 2k74 n LEU 37 Cb 0.77 -1.71 0.02 0.00 -1.62 0.00 0.00 43.42 40.88 2k74 n LEU 37 CO 0.21 0.14 0.71 -0.76 -1.22 0.00 0.00 177.39 176.47 2k74 s LEU 38 N -6.85 3.39 -0.15 2.23 1.43 -1.13 -5.05 118.68 112.55 2k74 s LEU 38 Ca 0.65 1.75 -0.00 0.00 -1.03 0.00 0.00 54.13 55.50 2k74 s LEU 38 Cb -0.37 -4.52 -0.01 0.00 0.03 0.00 0.00 46.19 41.32 2k74 s LEU 38 CO 0.80 -1.24 -0.14 -0.54 0.23 0.00 0.00 176.35 175.46 2k74 s LYS 39 N -4.37 3.28 0.20 1.70 3.01 -1.26 -4.87 119.74 117.43 2k74 s LYS 39 Ca 0.62 -0.72 -0.30 0.00 -1.01 0.00 0.00 55.97 54.56 2k74 s LYS 39 Cb -0.15 -2.65 -0.08 0.00 -1.01 0.00 0.00 37.83 33.94 2k74 s LYS 39 CO 0.42 0.06 1.04 -1.25 0.51 0.00 0.00 175.35 176.14 2k74 s PRO 40 N 0.71 4.68 0.61 -1.68 0.04 -1.25 -4.77 135.00 133.34 2k74 s PRO 40 Ca -0.06 1.64 -0.00 0.00 0.04 0.00 0.00 61.00 62.61 2k74 s PRO 40 Cb -0.15 -3.28 0.12 0.00 0.04 0.00 0.00 34.50 31.23 2k74 s PRO 40 CO 0.02 0.23 0.83 0.00 0.04 0.00 0.00 177.00 178.12 2k74 h VAL 42 N -0.58 1.20 -0.16 0.00 2.07 -1.88 -2.90 116.25 114.00 2k74 h VAL 42 Ca -0.28 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 66.61 2k74 h VAL 42 Cb 1.01 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 2k74 h VAL 42 CO 0.29 0.21 0.09 -0.07 0.02 0.00 0.00 177.57 178.12 2k74 h LEU 43 N 0.27 0.19 -0.75 2.57 -0.00 -1.95 -2.42 115.31 113.21 2k74 h LEU 43 Ca 0.09 -0.06 0.17 0.00 -0.00 0.00 0.00 57.88 58.08 2k74 h LEU 43 Cb 0.24 -0.05 -0.11 0.00 -0.00 0.00 0.00 40.66 40.74 2k74 h LEU 43 CO -0.00 0.19 0.17 0.28 -0.00 0.00 0.00 178.44 179.08 2k74 h SER 44 N 0.18 -0.01 -0.61 -0.43 0.02 -1.93 0.21 113.55 110.97 2k74 h SER 44 Ca 0.06 0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 2k74 h SER 44 Cb 0.04 0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 2k74 h SER 44 CO -0.01 -0.06 0.34 0.40 -1.14 0.00 0.00 176.83 176.36 2k74 h ILE 45 N 0.25 1.19 -0.40 3.27 2.04 -1.28 -0.88 117.51 121.70 2k74 h ILE 45 Ca 0.43 -0.47 0.06 0.00 1.00 0.00 0.00 64.86 65.89 2k74 h ILE 45 Cb 0.75 0.40 -0.06 0.00 -0.74 0.00 0.00 36.82 37.17 2k74 h ILE 45 CO -0.54 0.20 0.06 0.22 0.00 0.00 0.00 178.15 178.10 2k74 h TYR 46 N 0.82 0.10 -0.52 1.37 5.03 -0.17 0.24 116.97 123.85 2k74 h TYR 46 Ca 0.22 0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.51 2k74 h TYR 46 Cb 0.02 0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.30 2k74 h TYR 46 CO -0.01 -0.01 0.15 0.93 -1.32 0.00 0.00 178.16 177.90 2k74 h GLU 47 N 0.19 0.77 -0.40 1.82 5.08 -0.75 -1.07 114.58 120.21 2k74 h GLU 47 Ca 0.19 -0.14 -0.13 0.00 -1.00 0.00 0.00 59.36 58.29 2k74 h GLU 47 Cb 0.24 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2k74 h GLU 47 CO -0.27 0.68 -0.25 -0.09 -1.00 0.00 0.00 179.01 178.08 2k74 h ARG 48 N 0.75 0.83 -0.41 2.33 2.43 0.21 -2.78 114.38 117.75 2k74 h ARG 48 Ca 0.17 -0.36 -0.13 0.00 -0.81 0.00 0.00 59.98 58.85 2k74 h ARG 48 Cb 0.24 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 2k74 h ARG 48 CO -0.01 0.99 -0.27 0.00 -1.51 0.00 0.00 179.97 179.18 2k74 h ALA 49 N 0.99 0.59 -0.22 2.80 0.00 -0.14 0.42 119.26 123.70 2k74 h ALA 49 Ca 0.09 -0.41 0.03 0.00 0.00 0.00 0.00 54.91 54.63 2k74 h ALA 49 Cb 0.79 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 2k74 h ALA 49 CO 0.07 0.61 0.02 0.00 0.00 0.00 0.00 179.25 179.94 2k74 h ALA 50 N 0.81 0.20 0.01 0.00 0.00 -1.12 0.69 119.26 119.85 2k74 h ALA 50 Ca 0.08 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2k74 h ALA 50 Cb 0.85 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2k74 h ALA 50 CO 0.07 -0.41 -0.00 1.25 0.00 0.00 0.00 179.25 180.16 2k74 h LEU 51 N 0.09 -0.01 -1.01 0.00 7.12 -1.47 -2.82 115.31 117.21 2k74 h LEU 51 Ca 0.10 -0.80 0.29 0.00 0.13 0.00 0.00 57.88 57.60 2k74 h LEU 51 Cb 0.11 0.00 -0.14 0.00 -0.53 0.00 0.00 40.66 40.11 2k74 h LEU 51 CO -0.15 0.81 0.59 0.15 -0.13 0.00 0.00 178.44 179.70 2k74 h PHE 52 N -0.84 0.96 -0.33 1.25 3.04 -0.10 0.49 116.94 121.41 2k74 h PHE 52 Ca -0.00 0.04 -0.06 0.00 3.98 0.00 0.00 57.97 61.92 2k74 h PHE 52 Cb 0.81 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 39.04 2k74 h PHE 52 CO 0.21 -0.07 -0.04 0.78 -2.02 0.00 0.00 178.31 177.17 2k74 h GLY 53 N 0.44 0.66 0.92 2.40 0.00 -0.89 -2.86 103.07 103.73 2k74 h GLY 53 Ca 0.69 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 2k74 h GLY 53 CO -0.54 0.47 0.10 -2.08 0.00 0.00 0.00 176.54 174.49 2k74 h VAL 54 N 0.40 1.15 -0.74 4.60 2.07 0.03 -1.57 116.25 122.18 2k74 h VAL 54 Ca 0.09 -0.42 0.15 0.00 0.82 0.00 0.00 66.70 67.33 2k74 h VAL 54 Cb 0.52 1.01 -0.14 0.00 -1.52 0.00 0.00 31.29 31.16 2k74 h VAL 54 CO 0.02 0.14 -0.16 0.25 0.02 0.00 0.00 177.57 177.85 2k74 h LEU 55 N 0.23 -0.65 -0.03 2.57 6.46 -0.41 0.25 115.31 123.74 2k74 h LEU 55 Ca 0.08 0.22 0.00 0.00 -0.12 0.00 0.00 57.88 58.05 2k74 h LEU 55 Cb 0.13 0.44 -0.00 0.00 -0.73 0.00 0.00 40.66 40.50 2k74 h LEU 55 CO -0.01 -0.24 0.02 1.23 -0.62 0.00 0.00 178.44 178.82 2k74 h GLY 56 N 0.01 0.04 -0.02 3.75 0.00 -1.24 -1.89 103.07 103.71 2k74 h GLY 56 Ca 0.36 -0.02 0.26 0.00 0.00 0.00 0.00 47.33 47.93 2k74 h GLY 56 CO -0.75 0.02 0.67 0.00 0.00 0.00 0.00 176.54 176.48 2k74 h ALA 57 N 0.99 2.36 -0.22 3.60 0.00 0.39 0.73 119.26 127.10 2k74 h ALA 57 Ca 0.01 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2k74 h ALA 57 Cb 0.01 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2k74 h ALA 57 CO -0.00 -0.72 -0.33 0.00 0.00 0.00 0.00 179.25 178.20 2k74 h ALA 58 N 1.59 1.02 -0.33 0.00 0.00 -0.08 -1.54 119.26 119.92 2k74 h ALA 58 Ca 0.55 -0.39 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 2k74 h ALA 58 Cb 1.51 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2k74 h ALA 58 CO -0.21 0.59 -0.28 1.25 0.00 0.00 0.00 179.25 180.59 2k74 h LEU 59 N 0.40 0.72 -0.35 0.00 5.85 0.77 -0.26 115.31 122.44 2k74 h LEU 59 Ca 0.05 -0.28 -0.19 0.00 0.84 0.00 0.00 57.88 58.30 2k74 h LEU 59 Cb 0.77 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.60 2k74 h LEU 59 CO 0.06 0.96 -0.75 0.40 -0.34 0.00 0.00 178.44 178.78 2k74 h ILE 60 N 0.60 1.36 0.00 4.05 5.03 -1.11 -3.05 117.51 124.39 2k74 h ILE 60 Ca 0.07 -2.12 0.00 0.00 -0.12 0.00 0.00 64.86 62.69 2k74 h ILE 60 Cb 0.79 2.10 0.00 0.00 -3.03 0.00 0.00 36.82 36.68 2k74 h ILE 60 CO 0.06 0.64 0.00 1.23 -0.68 0.00 0.00 178.15 179.41 2k74 h GLY 61 N 1.16 0.00 0.09 5.37 0.00 -1.15 -3.13 103.07 105.41 2k74 h GLY 61 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2k74 h GLY 61 CO 0.13 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.67 2k74 n ALA 62 N -1.82 2.59 0.05 3.60 0.00 -0.12 -2.50 120.51 122.31 2k74 n ALA 62 Ca 0.05 -0.28 0.05 0.00 0.00 0.00 0.00 53.44 53.26 2k74 n ALA 62 Cb 0.44 -1.24 -0.06 0.00 0.00 0.00 0.00 19.45 18.59 2k74 n ALA 62 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2k74 n ILE 63 N -0.38 0.89 -2.67 0.00 -5.35 -1.18 -4.77 119.36 105.90 2k74 n ILE 63 Ca 0.16 -0.63 -0.04 0.00 -0.27 0.00 0.00 62.75 61.97 2k74 n ILE 63 Cb 0.17 -0.52 0.08 0.00 -1.74 0.00 0.00 39.64 37.63 2k74 n ILE 63 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2k74 n ALA 64 N -2.32 -3.35 1.42 -1.28 0.00 -1.22 -5.01 120.51 108.77 2k74 n ALA 64 Ca -0.06 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.99 2k74 n ALA 64 Cb 0.72 -3.10 0.00 0.00 0.00 0.00 0.00 19.45 17.07 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 1.27 0.99 0.00 0.00 -0.04 -1.04 -3.10 135.00 133.07 2k74 n PRO 65 Ca 0.00 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.55 2k74 n PRO 65 Cb 0.72 -1.28 -0.09 0.00 -0.04 0.00 0.00 33.50 32.81 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 -0.21 0.95 -4.17 0.54 2.85 -1.26 -4.79 118.16 112.06 2k74 n LYS 66 Ca 0.00 -0.18 -0.23 0.00 -1.05 0.00 0.00 58.31 56.85 2k74 n LYS 66 Cb 0.14 -1.38 -0.07 0.00 -0.65 0.00 0.00 35.03 33.07 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 -2.66 3.19 -0.90 0.58 -4.23 -1.18 -4.96 115.64 105.48 2k74 s THR 67 Ca 0.09 -1.76 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 2k74 s THR 67 Cb 0.14 -2.95 0.00 0.00 1.34 0.00 0.00 72.50 71.03 2k74 s THR 67 CO 0.71 -0.25 0.15 -2.65 -0.54 0.00 0.00 174.62 172.05 2k74 n PRO 68 N -1.07 0.00 0.18 3.99 -0.02 -1.26 -1.96 135.00 134.87 2k74 n PRO 68 Ca -0.04 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.46 2k74 n PRO 68 Cb 0.60 -1.34 0.37 0.00 -0.02 0.00 0.00 33.50 33.11 2k74 n PRO 68 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2k74 h LEU 69 N 0.00 0.02 -0.93 2.45 4.07 -1.93 -3.14 115.31 115.85 2k74 h LEU 69 Ca 0.00 -0.01 0.33 0.00 0.08 0.00 0.00 57.88 58.29 2k74 h LEU 69 Cb 0.00 -0.01 -0.17 0.00 1.08 0.00 0.00 40.66 41.56 2k74 h LEU 69 CO 0.00 0.37 0.30 -2.11 -1.08 0.00 0.00 178.44 175.91 2k74 n ARG 70 N -4.12 -0.06 -0.25 1.13 0.00 -0.83 0.33 116.66 112.85 2k74 n ARG 70 Ca -0.02 1.33 0.01 0.00 -0.00 0.00 0.00 57.85 59.17 2k74 n ARG 70 Cb 0.39 -2.27 0.23 0.00 -0.00 0.00 0.00 32.46 30.80 2k74 n ARG 70 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.63 176.71 2k74 h TYR 71 N 0.00 1.00 -0.83 2.89 3.20 -1.84 0.44 116.97 121.83 2k74 h TYR 71 Ca 0.70 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.61 2k74 h TYR 71 Cb 1.70 -0.34 -0.04 0.00 1.54 0.00 0.00 36.73 39.59 2k74 h TYR 71 CO -0.21 0.62 0.55 -0.39 -1.64 0.00 0.00 178.16 177.09 2k74 h VAL 72 N 1.07 1.19 0.01 1.81 -1.51 0.51 0.13 116.25 119.46 2k74 h VAL 72 Ca 0.30 -0.38 -0.26 0.00 -1.23 0.00 0.00 66.70 65.13 2k74 h VAL 72 Cb -0.09 -0.00 -0.04 0.00 -2.13 0.00 0.00 31.29 29.03 2k74 h VAL 72 CO -0.07 0.20 -1.44 0.00 -1.23 0.00 0.00 177.57 175.03 2k74 h ALA 73 N 1.49 0.58 -0.16 5.19 0.00 -1.15 -3.34 119.26 121.87 2k74 h ALA 73 Ca 0.31 -1.24 -0.10 0.00 0.00 0.00 0.00 54.91 53.89 2k74 h ALA 73 Cb -0.08 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2k74 h ALA 73 CO -0.08 1.43 -0.32 1.98 0.00 0.00 0.00 179.25 182.27 2k74 h MET 74 N 0.01 0.32 -0.85 0.00 -1.53 0.37 -2.75 114.93 110.49 2k74 h MET 74 Ca -0.18 -0.13 0.25 0.00 -3.44 0.00 0.00 59.70 56.19 2k74 h MET 74 Cb 1.93 -0.02 -0.03 0.00 -0.55 0.00 0.00 31.60 32.93 2k74 h MET 74 CO 0.10 0.61 0.69 -0.39 0.14 0.00 0.00 176.91 178.06 2k74 h VAL 75 N 0.28 0.43 0.02 -5.77 -1.51 -0.89 0.74 116.25 109.56 2k74 h VAL 75 Ca 0.04 0.00 -0.30 0.00 -1.23 0.00 0.00 66.70 65.20 2k74 h VAL 75 Cb 0.70 0.50 -0.05 0.00 -2.13 0.00 0.00 31.29 30.32 2k74 h VAL 75 CO 0.05 0.00 -1.76 -0.38 -1.23 0.00 0.00 177.57 174.26 2k74 n ILE 76 N -4.03 1.64 -0.05 7.19 5.41 -1.05 -2.63 119.36 125.83 2k74 n ILE 76 Ca 0.18 -0.77 -0.12 0.00 1.00 0.00 0.00 62.75 63.03 2k74 n ILE 76 Cb 0.99 -1.15 -0.06 0.00 -0.71 0.00 0.00 39.64 38.71 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 0.01 0.28 -0.10 1.39 2.91 0.44 -2.82 115.95 118.07 2k74 h TRP 77 Ca -0.31 -0.05 -0.03 0.00 1.13 0.00 0.00 58.89 59.63 2k74 h TRP 77 Cb 2.02 -0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 30.59 2k74 h TRP 77 CO 0.01 0.50 -0.05 1.25 -1.03 0.00 0.00 178.44 179.12 2k74 h LEU 78 N -0.01 0.22 -0.96 0.65 5.85 -0.45 -2.15 115.31 118.47 2k74 h LEU 78 Ca 0.04 -0.42 0.30 0.00 0.84 0.00 0.00 57.88 58.64 2k74 h LEU 78 Cb 0.39 -0.06 -0.15 0.00 0.37 0.00 0.00 40.66 41.21 2k74 h LEU 78 CO 0.01 0.59 0.40 0.22 -0.34 0.00 0.00 178.44 179.33 2k74 h TYR 79 N -0.15 0.63 0.00 1.25 3.20 -1.51 1.51 116.97 121.90 2k74 h TYR 79 Ca 0.02 0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.85 2k74 h TYR 79 Cb 0.51 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 2k74 h TYR 79 CO 0.07 -0.25 -0.41 0.66 -1.64 0.00 0.00 178.16 176.59 2k74 h SER 80 N 0.21 0.00 0.89 -2.11 4.64 -1.39 -2.72 113.55 113.07 2k74 h SER 80 Ca 0.68 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.95 2k74 h SER 80 Cb 1.52 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.62 2k74 h SER 80 CO -0.67 0.41 -0.43 0.00 -0.87 0.00 0.00 176.83 175.27 2k74 h ALA 81 N 1.59 -1.19 0.07 5.18 0.00 0.28 0.62 119.26 125.80 2k74 h ALA 81 Ca -0.00 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2k74 h ALA 81 Cb 1.28 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.53 2k74 h ALA 81 CO 0.05 -1.16 -0.03 0.35 0.00 0.00 0.00 179.25 178.46 2k74 h PHE 82 N -1.21 -0.09 -0.54 0.00 3.57 -1.56 -2.71 116.94 114.41 2k74 h PHE 82 Ca -0.12 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.28 2k74 h PHE 82 Cb 0.92 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.67 2k74 h PHE 82 CO -0.01 0.49 -0.04 -0.09 -2.23 0.00 0.00 178.31 176.43 2k74 h ARG 83 N -0.80 0.98 -0.30 1.11 2.43 -1.59 0.23 114.38 116.43 2k74 h ARG 83 Ca -0.01 -0.33 -0.02 0.00 -0.81 0.00 0.00 59.98 58.81 2k74 h ARG 83 Cb 0.61 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 2k74 h ARG 83 CO 0.02 1.01 0.12 0.78 -1.51 0.00 0.00 179.97 180.39 2k74 h GLY 84 N 0.85 0.49 1.44 2.80 0.00 0.12 0.31 103.07 109.08 2k74 h GLY 84 Ca 0.15 -0.26 -0.19 0.00 0.00 0.00 0.00 47.33 47.02 2k74 h GLY 84 CO 0.04 0.25 -0.69 -2.08 0.00 0.00 0.00 176.54 174.05 2k74 h VAL 85 N 0.34 1.33 -0.22 4.60 2.07 -1.42 -2.00 116.25 120.96 2k74 h VAL 85 Ca 0.10 -2.00 -0.05 0.00 0.82 0.00 0.00 66.70 65.57 2k74 h VAL 85 Cb 0.18 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 2k74 h VAL 85 CO -0.01 0.62 -0.06 -0.61 0.02 0.00 0.00 177.57 177.53 2k74 h GLN 86 N 0.40 0.42 -0.48 1.57 4.15 -0.43 -2.82 115.11 117.91 2k74 h GLN 86 Ca -0.03 -0.16 -0.06 0.00 0.77 0.00 0.00 58.65 59.18 2k74 h GLN 86 Cb 1.28 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.92 2k74 h GLN 86 CO 0.13 0.67 0.08 1.25 -1.93 0.00 0.00 178.83 179.02 2k74 h LEU 87 N 0.15 0.76 -0.56 -2.39 5.85 -0.98 -2.97 115.31 115.17 2k74 h LEU 87 Ca 0.05 -0.26 0.11 0.00 0.84 0.00 0.00 57.88 58.62 2k74 h LEU 87 Cb 0.51 -0.20 -0.09 0.00 0.37 0.00 0.00 40.66 41.25 2k74 h LEU 87 CO 0.02 0.83 0.06 0.71 -0.34 0.00 0.00 178.44 179.72 2k74 h THR 88 N 0.67 0.61 -0.93 1.05 1.35 -1.33 0.98 112.91 115.31 2k74 h THR 88 Ca 0.15 -0.06 0.23 0.00 -0.55 0.00 0.00 66.41 66.17 2k74 h THR 88 Cb 0.39 0.41 -0.12 0.00 -1.73 0.00 0.00 68.15 67.09 2k74 h THR 88 CO 0.01 0.03 0.46 1.88 -0.25 0.00 0.00 175.52 177.65 2k74 h TYR 89 N 0.19 0.77 -0.86 4.73 -1.99 -1.33 0.74 116.97 119.22 2k74 h TYR 89 Ca 0.29 0.04 0.01 0.00 2.00 0.00 0.00 58.73 61.07 2k74 h TYR 89 Cb 0.44 -0.19 -0.04 0.00 2.00 0.00 0.00 36.73 38.94 2k74 h TYR 89 CO -0.29 -0.02 0.57 1.49 -0.00 0.00 0.00 178.16 179.92 2k74 h GLU 90 N 0.45 1.12 0.33 4.88 4.57 -0.83 0.31 114.58 125.41 2k74 h GLU 90 Ca 0.59 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.69 2k74 h GLU 90 Cb 1.13 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 29.47 2k74 h GLU 90 CO -0.51 0.74 -0.16 1.25 -1.18 0.00 0.00 179.01 179.15 2k74 h HIS 91 N 1.16 -0.41 -0.04 0.92 2.76 0.65 -2.61 115.15 117.58 2k74 h HIS 91 Ca 0.32 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.51 2k74 h HIS 91 Cb -0.11 0.13 -0.04 0.00 1.55 0.00 0.00 27.41 28.95 2k74 h HIS 91 CO -0.00 -0.07 -0.15 1.79 -1.30 0.00 0.00 177.93 178.20 2k74 h THR 92 N -0.91 0.62 -0.77 6.26 1.35 -0.73 -0.47 112.91 118.25 2k74 h THR 92 Ca -0.04 0.00 0.17 0.00 -0.55 0.00 0.00 66.41 65.99 2k74 h THR 92 Cb 0.52 0.62 -0.11 0.00 -1.73 0.00 0.00 68.15 67.45 2k74 h THR 92 CO 0.07 0.00 0.21 -0.03 -0.25 0.00 0.00 175.52 175.53 2k74 h MET 93 N -0.23 0.28 -0.38 4.72 -1.53 -0.47 0.51 114.93 117.83 2k74 h MET 93 Ca 0.06 -0.02 -0.04 0.00 -3.44 0.00 0.00 59.70 56.27 2k74 h MET 93 Cb 0.32 -0.06 -0.02 0.00 -0.55 0.00 0.00 31.60 31.29 2k74 h MET 93 CO -0.18 0.18 0.10 1.25 0.14 0.00 0.00 176.91 178.41 2k74 h LEU 94 N 0.29 0.57 -0.64 3.39 5.85 -0.97 2.07 115.31 125.87 2k74 h LEU 94 Ca 0.45 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 2k74 h LEU 94 Cb 0.78 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 2k74 h LEU 94 CO -0.53 0.65 0.30 -0.61 -0.34 0.00 0.00 178.44 177.91 2k74 h GLN 95 N 0.47 0.93 0.00 1.25 4.15 0.68 0.35 115.11 122.94 2k74 h GLN 95 Ca 0.12 -0.14 -0.06 0.00 0.77 0.00 0.00 58.65 59.34 2k74 h GLN 95 Cb 0.29 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.81 2k74 h GLN 95 CO -0.00 0.75 -0.49 1.25 -1.93 0.00 0.00 178.83 178.40 2k74 h LEU 96 N 0.88 0.00 -6.01 -2.39 5.85 0.10 -3.38 115.31 110.37 2k74 h LEU 96 Ca 0.22 0.00 -0.56 0.00 0.84 0.00 0.00 57.88 58.38 2k74 h LEU 96 Cb 0.13 0.00 -0.40 0.00 0.37 0.00 0.00 40.66 40.77 2k74 h LEU 96 CO -0.03 0.24 -1.03 0.00 -0.34 0.00 0.00 178.44 177.29 2k74 n TYR 97 N -3.06 0.45 -0.84 1.25 9.36 0.70 -5.05 117.16 119.96 2k74 n TYR 97 Ca 0.01 -3.70 -0.34 0.00 3.32 0.00 0.00 57.90 57.20 2k74 n TYR 97 Cb 0.64 -0.40 0.10 0.00 -0.63 0.00 0.00 39.34 39.06 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 1.14 -0.25 -3.58 2.98 -0.02 0.12 -4.38 135.00 131.01 2k74 n PRO 98 Ca 0.23 -0.04 -0.08 0.00 -2.02 0.00 0.00 63.50 61.59 2k74 n PRO 98 Cb 0.52 -1.64 -0.04 0.00 -0.02 0.00 0.00 33.50 32.32 2k74 n PRO 98 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2k74 s SER 99 N -1.76 -0.29 0.90 2.55 1.04 -1.26 -5.05 113.70 109.84 2k74 s SER 99 Ca 0.52 0.27 -0.16 0.00 0.48 0.00 0.00 55.95 57.06 2k74 s SER 99 Cb -0.20 0.25 -0.14 0.00 0.10 0.00 0.00 66.02 66.03 2k74 s SER 99 CO 0.71 -0.30 -0.71 -2.65 0.98 0.00 0.00 173.24 171.27 2k74 n PRO 100 N 0.54 0.00 -3.91 4.02 -0.02 -1.26 -4.94 135.00 129.42 2k74 n PRO 100 Ca -0.07 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 61.06 2k74 n PRO 100 Cb 0.58 -0.95 -0.14 0.00 -0.02 0.00 0.00 33.50 32.98 2k74 n PRO 100 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2k74 s PHE 101 N -1.90 3.06 0.14 6.00 -0.71 -1.26 -4.82 117.98 118.49 2k74 s PHE 101 Ca 0.39 -1.35 0.00 0.00 -1.04 0.00 0.00 56.93 54.94 2k74 s PHE 101 Cb -0.20 -2.10 0.00 0.00 -1.21 0.00 0.00 43.02 39.51 2k74 s PHE 101 CO 0.77 -0.67 0.00 0.00 -1.34 0.00 0.00 175.22 173.98 2k74 n ALA 102 N 4.73 0.00 -2.15 1.99 0.00 -1.26 -5.11 120.51 118.71 2k74 n ALA 102 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 2k74 n ALA 102 Cb 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 2k74 n ALA 102 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2k74 s THR 103 N -2.00 3.45 -0.15 0.00 2.01 -1.26 -4.13 115.64 113.56 2k74 s THR 103 Ca 0.00 0.94 -0.00 0.00 0.31 0.00 0.00 61.69 62.93 2k74 s THR 103 Cb 0.00 -3.60 0.00 0.00 0.01 0.00 0.00 72.50 68.91 2k74 s THR 103 CO 0.00 0.02 0.00 -1.20 -0.69 0.00 0.00 174.62 172.76 2k74 n SER 104 N 4.90 -7.29 -3.84 3.53 7.64 -1.26 -5.04 113.62 112.26 2k74 n SER 104 Ca 0.13 0.90 -0.07 0.00 1.01 0.00 0.00 58.87 60.84 2k74 n SER 104 Cb 0.43 -3.41 -0.02 0.00 -1.01 0.00 0.00 64.21 60.19 2k74 n SER 104 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k74 s ASP 105 N -1.31 -0.27 0.00 6.43 2.15 -1.26 -5.15 116.67 117.26 2k74 s ASP 105 Ca 0.00 -0.59 0.00 0.00 0.43 0.00 0.00 52.55 52.40 2k74 s ASP 105 Cb -0.00 0.72 0.00 0.00 -0.30 0.00 0.00 42.92 43.34 2k74 s ASP 105 CO 0.39 -1.33 0.00 2.22 -0.17 0.00 0.00 175.17 176.28 2k74 n PHE 106 N -0.46 0.00 -3.64 -5.34 1.16 -1.26 -5.11 117.46 102.81 2k74 n PHE 106 Ca -0.04 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.45 2k74 n PHE 106 Cb 0.59 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.39 2k74 n PHE 106 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2k74 s MET 107 N -1.60 0.73 0.00 3.97 0.23 -1.26 -4.89 119.30 116.48 2k74 s MET 107 Ca 0.00 1.18 0.00 0.00 -1.03 0.00 0.00 55.69 55.84 2k74 s MET 107 Cb 0.00 0.19 0.00 0.00 -1.53 0.00 0.00 34.83 33.49 2k74 s MET 107 CO 0.00 -0.14 0.00 0.28 -2.03 0.00 0.00 175.02 173.13 2k74 n VAL 108 N 3.98 0.00 -2.85 5.16 0.31 -1.26 -4.86 118.33 118.81 2k74 n VAL 108 Ca -0.19 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.71 2k74 n VAL 108 Cb 0.58 -0.29 -0.04 0.00 -0.91 0.00 0.00 33.84 33.19 2k74 n VAL 108 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 2k74 s ARG 109 N -0.58 3.11 0.11 5.55 3.52 -1.26 -5.01 118.95 124.40 2k74 s ARG 109 Ca 0.00 -0.83 0.08 0.00 -0.13 0.00 0.00 55.73 54.85 2k74 s ARG 109 Cb 0.00 -4.23 -0.04 0.00 -1.56 0.00 0.00 34.95 29.12 2k74 s ARG 109 CO 0.00 -1.82 -0.15 -0.06 -0.81 0.00 0.00 175.30 172.46 2k74 s PHE 110 N 4.09 2.61 0.15 5.12 0.08 -1.26 -5.04 117.98 123.73 2k74 s PHE 110 Ca 0.22 -0.22 -0.27 0.00 0.12 0.00 0.00 56.93 56.78 2k74 s PHE 110 Cb -0.17 -1.38 -0.16 0.00 -0.57 0.00 0.00 43.02 40.75 2k74 s PHE 110 CO 0.10 0.40 0.56 -2.30 -0.10 0.00 0.00 175.22 173.88 2k74 n PRO 111 N 0.76 0.00 -0.81 0.24 -0.02 -1.26 -4.85 135.00 129.06 2k74 n PRO 111 Ca -0.15 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.41 2k74 n PRO 111 Cb 0.52 -0.98 0.39 0.00 -0.02 0.00 0.00 33.50 33.41 2k74 n PRO 111 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2k74 n GLU 112 N 0.98 4.53 0.00 -0.52 1.02 -1.26 -4.03 120.64 121.36 2k74 n GLU 112 Ca 0.17 -3.06 0.00 0.00 -0.02 0.00 0.00 57.16 54.25 2k74 n GLU 112 Cb 0.20 -2.15 0.00 0.00 -0.02 0.00 0.00 31.44 29.46 2k74 n GLU 112 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 2k74 n TRP 113 N 0.80 0.00 -3.92 -0.32 7.02 -1.26 -4.90 117.44 114.86 2k74 n TRP 113 Ca 0.27 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.46 2k74 n TRP 113 Cb 1.10 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 29.86 2k74 n TRP 113 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2k74 s LEU 114 N -0.89 4.63 0.00 -0.99 1.02 -1.26 -4.94 118.68 116.26 2k74 s LEU 114 Ca 0.00 -3.50 0.00 0.00 0.02 0.00 0.00 54.13 50.65 2k74 s LEU 114 Cb 0.00 -1.65 0.00 0.00 0.02 0.00 0.00 46.19 44.56 2k74 s LEU 114 CO 0.00 -0.15 0.00 -2.65 0.02 0.00 0.00 176.35 173.57 2k74 n PRO 115 N 2.46 0.00 0.08 1.29 -0.02 -1.26 -2.36 135.00 135.19 2k74 n PRO 115 Ca 0.13 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.57 2k74 n PRO 115 Cb 0.34 -0.99 0.15 0.00 -0.02 0.00 0.00 33.50 32.98 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 0.09 0.27 0.03 2.45 -0.00 -1.93 0.29 115.31 116.50 2k74 h LEU 116 Ca 0.00 -0.14 -0.38 0.00 -0.00 0.00 0.00 57.88 57.36 2k74 h LEU 116 Cb 0.00 -0.08 -0.06 0.00 -0.00 0.00 0.00 40.66 40.52 2k74 h LEU 116 CO 0.00 0.76 -2.35 -0.90 -0.00 0.00 0.00 178.44 175.96 2k74 n ASP 117 N -3.92 1.84 -0.04 -0.43 5.68 -1.00 -3.53 116.55 115.15 2k74 n ASP 117 Ca -0.02 -0.04 -0.14 0.00 -0.50 0.00 0.00 54.79 54.09 2k74 n ASP 117 Cb 0.57 -0.40 -0.08 0.00 -1.14 0.00 0.00 41.12 40.08 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 0.41 0.00 0.11 3.64 -1.70 -2.18 116.57 116.87 2k74 h LYS 118 Ca -0.54 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 58.56 2k74 h LYS 118 Cb 1.96 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.82 2k74 h LYS 118 CO -0.04 0.90 0.00 1.87 -2.27 0.00 0.00 179.45 179.91 2k74 n TRP 119 N -4.41 0.31 -3.21 1.91 -0.00 0.10 -3.98 117.44 108.17 2k74 n TRP 119 Ca -0.07 0.10 -0.24 0.00 -0.00 0.00 0.00 57.50 57.29 2k74 n TRP 119 Cb 0.48 -0.66 -0.07 0.00 -0.00 0.00 0.00 31.31 31.06 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 -1.76 -0.36 0.45 5.87 0.31 -1.15 -4.92 118.33 116.77 2k74 n VAL 120 Ca 0.05 -4.19 0.13 0.00 -0.01 0.00 0.00 64.34 60.32 2k74 n VAL 120 Cb 0.31 -1.79 0.32 0.00 -0.91 0.00 0.00 33.84 31.76 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 3.90 0.00 -0.90 5.55 0.13 -1.52 -3.29 132.00 135.86 2k74 h PRO 121 Ca 0.08 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 65.43 2k74 h PRO 121 Cb 0.87 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.94 2k74 h PRO 121 CO 0.50 0.00 0.61 1.96 -0.23 0.00 0.00 178.00 180.84 2k74 h GLN 122 N 0.00 0.31 -0.96 0.86 4.20 -1.91 -1.69 115.11 115.92 2k74 h GLN 122 Ca 0.00 -0.02 -0.43 0.00 0.06 0.00 0.00 58.65 58.27 2k74 h GLN 122 Cb 0.83 -0.07 -0.41 0.00 0.30 0.00 0.00 27.48 28.13 2k74 h GLN 122 CO 0.00 0.20 -0.99 1.33 -0.67 0.00 0.00 178.83 178.70 2k74 n VAL 123 N -4.47 1.68 0.00 -0.54 0.24 -1.24 -4.77 118.33 109.23 2k74 n VAL 123 Ca 0.19 -3.72 0.00 0.00 -2.04 0.00 0.00 64.34 58.78 2k74 n VAL 123 Cb 0.76 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.12 2k74 n VAL 123 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2k74 n PHE 124 N -0.41 0.00 -1.67 6.34 3.72 -0.85 -5.05 117.46 119.54 2k74 n PHE 124 Ca 0.23 0.00 -0.48 0.00 -0.05 0.00 0.00 57.45 57.15 2k74 n PHE 124 Cb 0.80 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.29 2k74 n PHE 124 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 2k74 n VAL 125 N -1.15 0.33 -3.31 -4.37 3.14 -0.69 -4.95 118.33 107.33 2k74 n VAL 125 Ca 0.00 -0.06 -0.33 0.00 -2.96 0.00 0.00 64.34 60.99 2k74 n VAL 125 Cb 0.00 -1.69 -0.06 0.00 -1.06 0.00 0.00 33.84 31.03 2k74 n VAL 125 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2k74 s ALA 126 N 2.70 3.49 -0.29 1.55 0.00 -1.26 -4.95 121.76 122.99 2k74 s ALA 126 Ca 0.87 -0.13 -0.01 0.00 0.00 0.00 0.00 51.96 52.69 2k74 s ALA 126 Cb -0.70 -2.57 0.19 0.00 0.00 0.00 0.00 23.12 20.04 2k74 s ALA 126 CO 0.46 0.44 0.75 0.45 0.00 0.00 0.00 175.76 177.86 2k74 s SER 127 N -2.20 -1.20 0.00 0.00 0.15 -0.78 -4.80 113.70 104.87 2k74 s SER 127 Ca 0.48 0.24 0.00 0.00 0.70 0.00 0.00 55.95 57.36 2k74 s SER 127 Cb -0.12 1.80 0.00 0.00 -1.71 0.00 0.00 66.02 65.99 2k74 s SER 127 CO 0.20 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.03 2k74 n GLY 128 N 5.34 0.94 3.89 9.45 0.00 -1.26 -3.77 105.19 119.78 2k74 n GLY 128 Ca 0.05 -2.00 -0.31 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.90 6.56 -0.18 1.61 1.11 -1.26 -4.77 116.67 117.83 2k74 s ASP 129 Ca 0.00 0.79 -0.09 0.00 0.18 0.00 0.00 52.55 53.44 2k74 s ASP 129 Cb 0.00 -2.17 -0.05 0.00 1.07 0.00 0.00 42.92 41.77 2k74 s ASP 129 CO 0.00 -0.06 0.12 0.00 1.18 0.00 0.00 175.17 176.40 2k74 n ALA 131 N 3.20 0.00 -1.73 0.00 0.00 -1.26 -5.06 120.51 115.67 2k74 n ALA 131 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.92 2k74 n ALA 131 Cb 0.53 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.00 2k74 n ALA 131 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2k74 s GLU 132 N -0.78 3.14 -0.13 0.00 -1.05 -1.26 -5.00 118.70 113.62 2k74 s GLU 132 Ca 0.00 1.67 -0.13 0.00 -0.15 0.00 0.00 54.97 56.36 2k74 s GLU 132 Cb 0.00 -1.97 -0.05 0.00 -0.44 0.00 0.00 34.13 31.67 2k74 s GLU 132 CO 0.00 -1.04 0.30 1.03 0.95 0.00 0.00 175.26 176.50 2k74 s ARG 133 N -3.39 4.09 0.00 -4.83 0.52 -1.26 -4.93 118.95 109.14 2k74 s ARG 133 Ca 0.74 0.13 0.00 0.00 -0.52 0.00 0.00 55.73 56.08 2k74 s ARG 133 Cb -0.26 -3.36 0.00 0.00 0.52 0.00 0.00 34.95 31.85 2k74 s ARG 133 CO 0.31 0.39 0.00 0.00 0.02 0.00 0.00 175.30 176.02 2k74 n GLN 134 N 3.05 2.49 -3.64 3.54 -0.00 -1.26 -5.09 117.38 116.46 2k74 n GLN 134 Ca -0.13 0.00 -0.04 0.00 -0.00 0.00 0.00 57.00 56.83 2k74 n GLN 134 Cb 0.52 -0.79 -0.07 0.00 -0.00 0.00 0.00 30.24 29.91 2k74 n GLN 134 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.06 176.60 2k74 s TRP 135 N -1.25 -0.30 0.04 2.61 -0.11 -1.26 -5.16 118.94 113.51 2k74 s TRP 135 Ca 0.00 0.68 -0.02 0.00 1.22 0.00 0.00 56.10 57.99 2k74 s TRP 135 Cb 0.00 0.35 -0.03 0.00 -1.50 0.00 0.00 33.47 32.29 2k74 s TRP 135 CO 0.00 -0.15 -0.00 0.16 -4.62 0.00 0.00 176.95 172.34 2k74 s ASP 136 N 0.52 0.38 -0.06 5.86 1.47 -1.26 -3.31 116.67 120.27 2k74 s ASP 136 Ca 0.00 -0.82 0.03 0.00 1.18 0.00 0.00 52.55 52.94 2k74 s ASP 136 Cb -0.04 0.19 -0.02 0.00 -0.34 0.00 0.00 42.92 42.70 2k74 s ASP 136 CO -0.12 -0.53 -0.14 0.12 0.68 0.00 0.00 175.17 175.18 2k74 s PHE 137 N -3.24 2.72 -0.81 2.11 5.36 0.18 -4.53 117.98 119.78 2k74 s PHE 137 Ca 0.01 -0.23 0.00 0.00 -0.96 0.00 0.00 56.93 55.75 2k74 s PHE 137 Cb 0.03 -1.66 0.00 0.00 -0.34 0.00 0.00 43.02 41.05 2k74 s PHE 137 CO -0.07 0.13 0.00 -0.11 -1.46 0.00 0.00 175.22 173.70 2k74 n LEU 138 N 2.49 -0.41 0.00 6.12 7.94 -1.26 0.13 117.00 132.01 2k74 n LEU 138 Ca -0.17 0.19 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 2k74 n LEU 138 Cb 0.52 -1.67 0.00 0.00 0.53 0.00 0.00 43.42 42.80 2k74 n LEU 138 CO 0.26 -0.55 0.00 0.61 -1.11 0.00 0.00 177.39 176.60 2k74 n GLY 139 N 0.01 0.81 3.18 -3.96 0.00 -1.26 -5.08 105.19 98.88 2k74 n GLY 139 Ca -0.08 -0.49 -0.27 0.00 0.00 0.00 0.00 46.02 45.18 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 1.98 0.52 0.99 1.43 0.34 -5.05 118.68 118.89 2k74 s LEU 140 Ca 0.00 -0.37 -0.20 0.00 -1.03 0.00 0.00 54.13 52.52 2k74 s LEU 140 Cb 0.00 -1.03 -0.06 0.00 0.03 0.00 0.00 46.19 45.12 2k74 s LEU 140 CO 0.00 0.20 1.15 -1.61 0.23 0.00 0.00 176.35 176.32 2k74 s GLU 141 N -0.19 3.45 0.18 1.70 0.41 -1.26 0.50 118.70 123.48 2k74 s GLU 141 Ca 0.01 1.68 -0.20 0.00 -0.41 0.00 0.00 54.97 56.05 2k74 s GLU 141 Cb -0.10 -2.13 0.11 0.00 -1.78 0.00 0.00 34.13 30.23 2k74 s GLU 141 CO 0.01 -0.78 1.61 0.52 -0.49 0.00 0.00 175.26 176.12 2k74 h MET 142 N 1.44 -0.16 -1.17 1.61 2.86 -1.94 0.07 114.93 117.63 2k74 h MET 142 Ca -0.50 0.01 0.38 0.00 -2.06 0.00 0.00 59.70 57.54 2k74 h MET 142 Cb 1.26 0.04 -0.13 0.00 0.06 0.00 0.00 31.60 32.82 2k74 h MET 142 CO 0.58 -0.11 0.73 -1.35 1.06 0.00 0.00 176.91 177.82 2k74 h PRO 143 N -0.17 0.17 0.01 -0.22 0.11 -1.92 0.37 132.00 130.36 2k74 h PRO 143 Ca 0.21 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.31 2k74 h PRO 143 Cb 0.51 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.58 2k74 h PRO 143 CO -0.58 0.11 -0.01 1.96 -0.21 0.00 0.00 178.00 179.28 2k74 h GLN 144 N 0.18 -0.02 0.79 1.05 1.08 -1.35 -2.70 115.11 114.14 2k74 h GLN 144 Ca 0.77 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.93 2k74 h GLN 144 Cb 2.18 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 29.62 2k74 h GLN 144 CO -0.48 0.53 -0.38 -1.49 -0.95 0.00 0.00 178.83 176.07 2k74 h TRP 145 N -0.58 -0.98 -1.14 2.96 4.06 -0.37 -2.20 115.95 117.69 2k74 h TRP 145 Ca -0.00 -0.02 0.38 0.00 2.06 0.00 0.00 58.89 61.30 2k74 h TRP 145 Cb 0.56 0.32 -0.14 0.00 -1.00 0.00 0.00 29.16 28.91 2k74 h TRP 145 CO 0.12 -0.61 0.70 1.25 -3.56 0.00 0.00 178.44 176.34 2k74 h LEU 146 N -1.07 0.36 -1.42 -4.49 5.85 -0.53 3.20 115.31 117.22 2k74 h LEU 146 Ca -0.11 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2k74 h LEU 146 Cb 0.81 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 2k74 h LEU 146 CO 0.18 -0.17 0.24 0.25 -0.34 0.00 0.00 178.44 178.60 2k74 h LEU 147 N 0.19 0.56 -0.50 2.25 5.85 -1.05 0.41 115.31 123.02 2k74 h LEU 147 Ca 0.77 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 59.47 2k74 h LEU 147 Cb 2.12 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.97 2k74 h LEU 147 CO -0.51 0.47 0.30 1.23 -0.34 0.00 0.00 178.44 179.59 2k74 h GLY 148 N 0.73 0.71 1.85 3.75 0.00 0.62 -0.40 103.07 110.33 2k74 h GLY 148 Ca 0.16 -0.22 -0.18 0.00 0.00 0.00 0.00 47.33 47.09 2k74 h GLY 148 CO -0.03 0.19 -0.82 -2.22 0.00 0.00 0.00 176.54 173.66 2k74 h ILE 149 N 0.60 1.51 -0.22 2.60 5.03 -0.98 -3.03 117.51 123.02 2k74 h ILE 149 Ca 0.20 -2.59 0.03 0.00 -0.12 0.00 0.00 64.86 62.39 2k74 h ILE 149 Cb 0.02 2.42 -0.03 0.00 -3.03 0.00 0.00 36.82 36.20 2k74 h ILE 149 CO -0.09 0.75 0.02 0.15 -0.68 0.00 0.00 178.15 178.30 2k74 h PHE 150 N 0.08 0.03 -0.33 1.37 3.04 0.54 -1.89 116.94 119.78 2k74 h PHE 150 Ca -0.03 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.94 2k74 h PHE 150 Cb 1.43 0.02 -0.02 0.00 2.56 0.00 0.00 35.95 39.95 2k74 h PHE 150 CO 0.02 -0.01 0.21 0.82 -2.02 0.00 0.00 178.31 177.33 2k74 h ILE 151 N 0.10 1.10 -0.66 1.41 2.04 -1.12 -2.54 117.51 117.83 2k74 h ILE 151 Ca 0.10 -0.21 0.13 0.00 1.00 0.00 0.00 64.86 65.89 2k74 h ILE 151 Cb 0.11 0.65 -0.10 0.00 -0.74 0.00 0.00 36.82 36.74 2k74 h ILE 151 CO -0.15 0.10 0.14 0.00 0.00 0.00 0.00 178.15 178.23 2k74 h ALA 152 N 1.10 0.80 -0.76 1.87 0.00 -1.33 0.17 119.26 121.12 2k74 h ALA 152 Ca 0.12 0.15 0.09 0.00 0.00 0.00 0.00 54.91 55.27 2k74 h ALA 152 Cb -0.02 0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 2k74 h ALA 152 CO -0.02 -0.33 0.41 1.88 0.00 0.00 0.00 179.25 181.19 2k74 h TYR 153 N 0.25 0.75 -0.05 0.00 -1.99 -0.93 0.17 116.97 115.15 2k74 h TYR 153 Ca 0.36 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 61.11 2k74 h TYR 153 Cb 0.58 -0.22 -0.00 0.00 2.00 0.00 0.00 36.73 39.08 2k74 h TYR 153 CO -0.27 0.30 -0.02 -0.07 -0.00 0.00 0.00 178.16 178.10 2k74 h LEU 154 N 0.71 0.07 -0.17 3.88 3.38 -0.79 -1.86 115.31 120.52 2k74 h LEU 154 Ca 0.36 -0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.12 2k74 h LEU 154 Cb 0.34 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2k74 h LEU 154 CO -0.24 0.10 -0.95 0.40 0.09 0.00 0.00 178.44 177.84 2k74 h ILE 155 N 0.08 1.56 -0.55 1.22 2.04 -0.49 -2.18 117.51 119.19 2k74 h ILE 155 Ca 0.02 -2.90 -0.06 0.00 1.00 0.00 0.00 64.86 62.91 2k74 h ILE 155 Cb 0.09 2.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.78 2k74 h ILE 155 CO 0.00 0.84 0.08 0.58 0.00 0.00 0.00 178.15 179.65 2k74 h VAL 156 N 0.06 1.24 0.09 1.67 2.07 -0.42 -2.03 116.25 118.94 2k74 h VAL 156 Ca -0.04 -0.93 -0.13 0.00 0.82 0.00 0.00 66.70 66.42 2k74 h VAL 156 Cb 1.63 0.73 0.01 0.00 -1.52 0.00 0.00 31.29 32.14 2k74 h VAL 156 CO 0.14 0.34 -0.58 0.00 0.02 0.00 0.00 177.57 177.49 2k74 h ALA 157 N 1.26 -0.05 -0.73 1.67 0.00 -1.53 -2.40 119.26 117.48 2k74 h ALA 157 Ca 0.17 -0.65 0.11 0.00 0.00 0.00 0.00 54.91 54.54 2k74 h ALA 157 Cb 0.38 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.18 2k74 h ALA 157 CO 0.01 0.27 0.35 0.28 0.00 0.00 0.00 179.25 180.16 2k74 h VAL 158 N -0.58 0.80 0.05 0.00 2.07 -1.37 0.43 116.25 117.65 2k74 h VAL 158 Ca -0.10 -0.20 -0.23 0.00 0.82 0.00 0.00 66.70 66.99 2k74 h VAL 158 Cb 1.44 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 2k74 h VAL 158 CO 0.10 0.10 -1.04 0.25 0.02 0.00 0.00 177.57 177.00 2k74 h LEU 159 N 0.57 0.27 -0.70 2.57 5.85 -1.49 -2.63 115.31 119.74 2k74 h LEU 159 Ca 0.37 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 2k74 h LEU 159 Cb 0.44 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 2k74 h LEU 159 CO -0.30 1.14 -0.22 0.58 -0.34 0.00 0.00 178.44 179.30 2k74 h VAL 160 N 0.07 0.46 0.00 1.05 2.07 -0.82 -1.91 116.25 117.17 2k74 h VAL 160 Ca -0.07 -1.27 -0.05 0.00 0.82 0.00 0.00 66.70 66.13 2k74 h VAL 160 Cb 1.74 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 33.43 2k74 h VAL 160 CO 0.16 0.22 -0.27 0.58 0.02 0.00 0.00 177.57 178.27 2k74 h VAL 161 N 0.00 1.57 0.00 2.57 2.07 -0.19 -3.31 116.25 118.97 2k74 h VAL 161 Ca -0.00 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.23 2k74 h VAL 161 Cb 0.91 3.08 0.00 0.00 -1.52 0.00 0.00 31.29 33.75 2k74 h VAL 161 CO 0.03 0.53 0.00 0.40 0.02 0.00 0.00 177.57 178.55 2k74 h ILE 162 N -1.00 0.00 -0.30 4.57 2.04 -1.52 -2.77 117.51 118.53 2k74 h ILE 162 Ca -0.08 -0.28 -0.18 0.00 1.00 0.00 0.00 64.86 65.33 2k74 h ILE 162 Cb 1.05 1.12 -0.00 0.00 -0.74 0.00 0.00 36.82 38.24 2k74 h ILE 162 CO -0.05 0.00 -0.51 0.77 0.00 0.00 0.00 178.15 178.37 2k74 h SER 163 N 0.00 0.92 -3.44 1.72 4.64 -1.43 -3.50 113.55 112.47 2k74 h SER 163 Ca 0.00 -0.48 0.20 0.00 -0.47 0.00 0.00 61.79 61.04 2k74 h SER 163 Cb 0.33 -0.26 -0.11 0.00 -0.31 0.00 0.00 62.40 62.05 2k74 h SER 163 CO 0.00 1.26 -1.07 0.00 -0.87 0.00 0.00 176.83 176.15 2k74 n GLN 164 N -4.01 -3.32 0.00 4.77 3.00 -1.05 -3.96 117.38 112.81 2k74 n GLN 164 Ca -0.04 2.66 0.00 0.00 -0.01 0.00 0.00 57.00 59.62 2k74 n GLN 164 Cb 0.60 -3.66 0.00 0.00 0.00 0.00 0.00 30.24 27.18 2k74 n GLN 164 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 2k74 n PRO 165 N -3.63 0.55 -1.40 -1.09 -0.04 -1.26 -4.89 135.00 123.25 2k74 n PRO 165 Ca -0.06 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.03 2k74 n PRO 165 Cb 0.56 -1.23 0.06 0.00 -0.04 0.00 0.00 33.50 32.84 2k74 n PRO 165 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2k74 n PHE 166 N 0.66 -0.40 -3.59 0.54 -0.00 -1.25 -5.01 117.46 108.42 2k74 n PHE 166 Ca 0.00 0.40 -0.20 0.00 -0.00 0.00 0.00 57.45 57.65 2k74 n PHE 166 Cb 0.26 -1.98 -0.15 0.00 -0.00 0.00 0.00 39.48 37.61 2k74 n PHE 166 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 2k74 s LYS 167 N -2.58 0.10 0.68 -4.13 1.02 -1.26 -5.06 119.74 108.50 2k74 s LYS 167 Ca 0.69 0.24 -0.10 0.00 0.02 0.00 0.00 55.97 56.82 2k74 s LYS 167 Cb -0.39 -1.06 0.01 0.00 -0.52 0.00 0.00 37.83 35.87 2k74 s LYS 167 CO 0.54 -0.54 1.06 0.00 -0.92 0.00 0.00 175.35 175.49 2k74 s ALA 168 N 2.26 2.99 0.00 5.17 0.00 -1.26 -5.07 121.76 125.84 2k74 s ALA 168 Ca 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.63 2k74 s ALA 168 Cb -0.14 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.02 2k74 s ALA 168 CO -0.09 -1.03 0.00 1.63 0.00 0.00 0.00 175.76 176.27 2k74 n LYS 169 N -2.90 0.00 0.00 0.00 4.76 -1.26 -5.00 118.16 113.76 2k74 n LYS 169 Ca 0.06 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 2k74 n LYS 169 Cb 0.57 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.76 2k74 n LYS 169 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2k74 n LYS 170 N 0.00 0.00 -2.65 1.97 5.02 -1.26 -5.12 118.16 116.12 2k74 n LYS 170 Ca 0.00 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.26 2k74 n LYS 170 Cb 0.00 -0.79 -0.02 0.00 -0.02 0.00 0.00 35.03 34.20 2k74 n LYS 170 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2k74 n ARG 171 N -2.43 -3.32 0.00 1.97 0.63 -1.26 -4.98 116.66 107.27 2k74 n ARG 171 Ca 0.00 2.55 0.00 0.00 -0.92 0.00 0.00 57.85 59.48 2k74 n ARG 171 Cb 0.40 -3.35 0.00 0.00 0.45 0.00 0.00 32.46 29.96 2k74 n ARG 171 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 2k74 n ASP 172 N 2.02 0.00 0.00 6.15 5.75 -1.26 -5.12 116.55 124.08 2k74 n ASP 172 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.58 2k74 n ASP 172 Cb 0.31 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 2k74 n ASP 172 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2k74 n LEU 173 N -0.36 0.00 -4.29 -2.12 4.77 -1.26 -3.24 117.00 110.51 2k74 n LEU 173 Ca 0.00 0.00 -0.45 0.00 -0.03 0.00 0.00 56.01 55.53 2k74 n LEU 173 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2k74 n LEU 173 CO 0.00 0.00 0.40 -0.36 -1.33 0.00 0.00 177.39 176.10 2k74 s PHE 174 N 0.00 3.77 0.00 -1.77 0.08 -1.26 -4.96 117.98 113.84 2k74 s PHE 174 Ca 0.00 -2.23 0.00 0.00 0.12 0.00 0.00 56.93 54.82 2k74 s PHE 174 Cb 0.00 -3.70 0.00 0.00 -0.57 0.00 0.00 43.02 38.75 2k74 s PHE 174 CO 0.00 -0.95 0.00 0.41 -0.10 0.00 0.00 175.22 174.58 2k74 n GLY 175 N 3.69 0.33 1.55 4.36 0.00 -1.20 -5.10 105.19 108.83 2k74 n GLY 175 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2k74 n GLY 175 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2k74 n ARG 176 N 0.00 -4.44 0.00 1.61 3.00 -1.26 -5.03 116.66 110.54 2k74 n ARG 176 Ca 0.00 3.29 0.00 0.00 -0.00 0.00 0.00 57.85 61.14 2k74 n ARG 176 Cb 0.00 -3.69 0.00 0.00 0.00 0.00 0.00 32.46 28.77 2k74 n ARG 176 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k74 n GLY 177 N -0.64 0.10 0.40 5.14 0.00 -1.26 -4.98 105.19 103.95 2k74 n GLY 177 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.21 2k74 n GLY 177 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2k74 h HIS 178 N 0.00 0.47 -3.75 1.61 3.86 -1.96 -3.40 115.15 111.98 2k74 h HIS 178 Ca 0.00 0.01 -0.49 0.00 -1.16 0.00 0.00 60.37 58.74 2k74 h HIS 178 Cb 0.06 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.36 2k74 h HIS 178 CO 0.00 0.14 0.21 -1.01 0.86 0.00 0.00 177.93 178.13 2k74 s HIS 179 N -5.38 3.58 0.26 2.45 3.76 -1.26 -5.06 115.29 113.64 2k74 s HIS 179 Ca -0.08 1.51 -0.13 0.00 -0.15 0.00 0.00 55.06 56.21 2k74 s HIS 179 Cb 0.22 -2.73 -0.08 0.00 1.11 0.00 0.00 32.58 31.10 2k74 s HIS 179 CO 0.78 0.20 0.64 -1.01 -0.85 0.00 0.00 174.74 174.50 2k74 s HIS 180 N -1.71 3.43 0.36 1.40 3.76 -1.26 -4.67 115.29 116.60 2k74 s HIS 180 Ca 0.49 1.07 0.00 0.00 -0.15 0.00 0.00 55.06 56.47 2k74 s HIS 180 Cb -0.15 -2.41 0.00 0.00 1.11 0.00 0.00 32.58 31.13 2k74 s HIS 180 CO 0.20 0.21 0.00 0.72 -0.85 0.00 0.00 174.74 175.02 2k74 n HIS 181 N -0.11 -2.67 0.00 1.40 8.25 -1.26 -4.58 115.22 116.25 2k74 n HIS 181 Ca 0.01 1.41 0.00 0.00 -0.26 0.00 0.00 57.72 58.88 2k74 n HIS 181 Cb 0.53 -2.43 0.00 0.00 1.12 0.00 0.00 29.99 29.21 2k74 n HIS 181 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k74 n HIS 182 N -3.67 0.00 -0.30 4.41 -0.00 -1.26 -5.14 115.22 109.26 2k74 n HIS 182 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.69 2k74 n HIS 182 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.60 2k74 n HIS 182 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06