#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 0.24 -0.57 3.17 5.85 -2.07 -2.82 115.31 119.11 2k74 h LEU 2 Ca 0.00 -0.14 0.12 0.00 0.84 0.00 0.00 57.88 58.70 2k74 h LEU 2 Cb 0.00 -0.06 -0.10 0.00 0.37 0.00 0.00 40.66 40.87 2k74 h LEU 2 CO 0.00 0.32 -0.05 0.03 -0.34 0.00 0.00 178.44 178.40 2k74 h ARG 3 N 0.16 0.07 -0.64 1.25 3.08 -2.06 0.49 114.38 116.73 2k74 h ARG 3 Ca 0.06 -0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.22 2k74 h ARG 3 Cb 0.14 -0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.09 2k74 h ARG 3 CO -0.01 0.05 0.22 0.74 -1.07 0.00 0.00 179.97 179.90 2k74 h PHE 4 N 0.07 0.38 -0.84 3.04 -1.00 -1.94 0.18 116.94 116.83 2k74 h PHE 4 Ca 0.29 0.03 0.19 0.00 2.81 0.00 0.00 57.97 61.29 2k74 h PHE 4 Cb 0.46 -0.07 -0.12 0.00 3.61 0.00 0.00 35.95 39.83 2k74 h PHE 4 CO -0.39 0.06 0.32 1.25 -1.61 0.00 0.00 178.31 177.94 2k74 h LEU 5 N 0.39 0.23 -1.23 1.54 5.85 -0.67 1.13 115.31 122.55 2k74 h LEU 5 Ca 0.34 0.15 -0.06 0.00 0.84 0.00 0.00 57.88 59.14 2k74 h LEU 5 Cb 0.46 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 2k74 h LEU 5 CO -0.35 0.01 -0.30 -1.13 -0.34 0.00 0.00 178.44 176.32 2k74 h ASN 6 N 0.38 0.00 0.01 1.25 -0.73 -0.73 -1.54 115.58 114.22 2k74 h ASN 6 Ca 0.50 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.67 2k74 h ASN 6 Cb 0.90 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.49 2k74 h ASN 6 CO -0.51 0.30 -0.00 -0.61 -0.37 0.00 0.00 177.43 176.24 2k74 h GLN 7 N 0.00 -0.01 0.00 6.67 4.15 0.19 -1.23 115.11 124.88 2k74 h GLN 7 Ca -0.00 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 2k74 h GLN 7 Cb 0.71 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.40 2k74 h GLN 7 CO 0.04 0.75 -0.09 0.00 -1.93 0.00 0.00 178.83 177.60 2k74 h ALA 8 N 0.14 1.84 0.05 3.38 0.00 0.04 -2.29 119.26 122.41 2k74 h ALA 8 Ca -0.00 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.59 2k74 h ALA 8 Cb 0.77 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.57 2k74 h ALA 8 CO 0.00 0.11 -0.97 0.66 0.00 0.00 0.00 179.25 179.05 2k74 h SER 9 N 0.00 0.76 0.00 0.00 4.64 -1.31 -3.04 113.55 114.61 2k74 h SER 9 Ca -0.00 -0.79 0.00 0.00 -0.47 0.00 0.00 61.79 60.53 2k74 h SER 9 Cb 0.16 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 2k74 h SER 9 CO 0.01 1.47 0.00 1.67 -0.87 0.00 0.00 176.83 179.11 2k74 n GLN 10 N -3.96 0.41 -4.00 4.77 -0.06 -0.47 -4.63 117.38 109.45 2k74 n GLN 10 Ca -0.12 0.00 -0.36 0.00 -2.00 0.00 0.00 57.00 54.52 2k74 n GLN 10 Cb 0.85 -1.22 -0.07 0.00 -4.06 0.00 0.00 30.24 25.75 2k74 n GLN 10 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 2k74 s GLY 11 N -1.77 2.09 -0.03 1.69 0.00 -1.10 -4.97 107.32 103.24 2k74 s GLY 11 Ca 0.09 -0.70 -0.26 0.00 0.00 0.00 0.00 44.72 43.84 2k74 s GLY 11 CO 0.07 -0.47 1.25 0.07 0.00 0.00 0.00 173.10 174.01 2k74 h ARG 12 N 4.84 0.01 -0.91 2.90 0.11 -1.86 -3.01 114.38 116.46 2k74 h ARG 12 Ca -0.53 -0.00 0.24 0.00 0.10 0.00 0.00 59.98 59.78 2k74 h ARG 12 Cb 1.21 0.00 -0.16 0.00 1.11 0.00 0.00 29.97 32.13 2k74 h ARG 12 CO 0.59 0.52 0.06 0.78 0.10 0.00 0.00 179.97 182.01 2k74 h GLY 13 N -0.50 1.17 0.99 0.08 0.00 -1.95 0.71 103.07 103.57 2k74 h GLY 13 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2k74 h GLY 13 CO 0.00 -0.44 0.22 0.00 0.00 0.00 0.00 176.54 176.33 2k74 h ALA 14 N 1.88 0.44 -0.65 3.60 0.00 -1.77 -0.56 119.26 122.21 2k74 h ALA 14 Ca 0.55 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.40 2k74 h ALA 14 Cb 1.09 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 2k74 h ALA 14 CO -0.81 -0.08 0.34 -1.49 0.00 0.00 0.00 179.25 177.20 2k74 h TRP 15 N 0.47 0.90 -0.07 0.00 4.06 0.35 -1.09 115.95 120.56 2k74 h TRP 15 Ca 0.13 -0.02 -0.07 0.00 2.06 0.00 0.00 58.89 60.99 2k74 h TRP 15 Cb -0.03 -0.29 -0.01 0.00 -1.00 0.00 0.00 29.16 27.83 2k74 h TRP 15 CO -0.05 0.64 -0.27 1.25 -3.56 0.00 0.00 178.44 176.45 2k74 h LEU 16 N 0.91 0.12 -0.97 -4.49 5.85 0.26 -2.24 115.31 114.76 2k74 h LEU 16 Ca 0.23 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 2k74 h LEU 16 Cb 0.06 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 2k74 h LEU 16 CO -0.03 0.40 -0.52 0.25 -0.34 0.00 0.00 178.44 178.20 2k74 h LEU 17 N 0.12 0.00 -0.47 2.25 5.85 0.16 -2.24 115.31 120.97 2k74 h LEU 17 Ca 0.02 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.57 2k74 h LEU 17 Cb 0.54 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 2k74 h LEU 17 CO 0.04 0.52 -0.71 0.24 -0.34 0.00 0.00 178.44 178.18 2k74 h MET 18 N 0.00 0.30 0.25 1.25 2.86 -0.90 -2.99 114.93 115.69 2k74 h MET 18 Ca -0.01 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.38 2k74 h MET 18 Cb 0.91 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.62 2k74 h MET 18 CO 0.07 0.89 -0.12 0.00 1.06 0.00 0.00 176.91 178.81 2k74 h ALA 19 N 1.04 -0.33 -0.72 6.32 0.00 -1.27 -2.92 119.26 121.38 2k74 h ALA 19 Ca -0.02 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 54.85 2k74 h ALA 19 Cb 1.27 0.13 -0.13 0.00 0.00 0.00 0.00 17.79 19.06 2k74 h ALA 19 CO 0.11 -0.41 -0.01 0.35 0.00 0.00 0.00 179.25 179.29 2k74 h PHE 20 N -0.88 -0.07 0.23 0.00 3.04 -1.49 -0.89 116.94 116.88 2k74 h PHE 20 Ca -0.03 0.05 0.01 0.00 3.98 0.00 0.00 57.97 61.98 2k74 h PHE 20 Cb 0.51 0.14 -0.04 0.00 2.56 0.00 0.00 35.95 39.12 2k74 h PHE 20 CO 0.05 -0.23 -0.44 1.79 -2.02 0.00 0.00 178.31 177.47 2k74 h THR 21 N 0.10 0.13 -1.10 4.41 1.35 -1.57 0.43 112.91 116.67 2k74 h THR 21 Ca 0.39 0.00 0.30 0.00 -0.55 0.00 0.00 66.41 66.55 2k74 h THR 21 Cb 0.67 0.13 -0.08 0.00 -1.73 0.00 0.00 68.15 67.14 2k74 h THR 21 CO -0.64 0.00 0.73 0.00 -0.25 0.00 0.00 175.52 175.36 2k74 h ALA 22 N -0.35 2.51 0.02 6.62 0.00 -1.00 0.29 119.26 127.36 2k74 h ALA 22 Ca -0.00 0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 2k74 h ALA 22 Cb 0.72 0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.59 2k74 h ALA 22 CO -0.19 -0.92 -0.88 1.25 0.00 0.00 0.00 179.25 178.51 2k74 h LEU 23 N 0.26 0.73 -1.79 0.00 5.85 -0.11 -2.91 115.31 117.35 2k74 h LEU 23 Ca 0.61 -0.77 0.21 0.00 0.84 0.00 0.00 57.88 58.77 2k74 h LEU 23 Cb 1.80 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 42.56 2k74 h LEU 23 CO -0.23 1.41 0.57 0.00 -0.34 0.00 0.00 178.44 179.85 2k74 h ALA 24 N 0.34 2.50 0.12 1.25 0.00 0.35 0.26 119.26 124.09 2k74 h ALA 24 Ca -0.12 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.50 2k74 h ALA 24 Cb 1.57 0.02 0.02 0.00 0.00 0.00 0.00 17.79 19.39 2k74 h ALA 24 CO 0.17 -0.75 -1.23 -0.07 0.00 0.00 0.00 179.25 177.38 2k74 h LEU 25 N 0.18 0.64 0.26 0.00 4.07 -1.37 -2.74 115.31 116.35 2k74 h LEU 25 Ca 0.41 -0.63 -0.01 0.00 0.08 0.00 0.00 57.88 57.73 2k74 h LEU 25 Cb 1.34 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.87 2k74 h LEU 25 CO -0.08 1.46 -0.12 -0.08 -1.08 0.00 0.00 178.44 178.54 2k74 h GLU 26 N 0.17 -0.33 0.02 1.13 4.81 -0.36 -2.23 114.58 117.79 2k74 h GLU 26 Ca -0.16 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2k74 h GLU 26 Cb 1.91 0.08 0.00 0.00 0.63 0.00 0.00 28.75 31.37 2k74 h GLU 26 CO 0.22 -0.15 -0.01 -0.07 -0.73 0.00 0.00 179.01 178.27 2k74 h LEU 27 N -0.45 -0.03 -0.83 1.64 3.38 -1.17 0.19 115.31 118.04 2k74 h LEU 27 Ca -0.04 -0.01 0.19 0.00 0.09 0.00 0.00 57.88 58.11 2k74 h LEU 27 Cb 0.34 0.01 -0.12 0.00 0.09 0.00 0.00 40.66 40.98 2k74 h LEU 27 CO 0.06 -0.01 0.30 0.71 0.09 0.00 0.00 178.44 179.59 2k74 h THR 28 N -0.04 0.50 -0.01 0.22 1.35 -1.45 -0.89 112.91 112.58 2k74 h THR 28 Ca -0.00 -0.12 -0.10 0.00 -0.55 0.00 0.00 66.41 65.64 2k74 h THR 28 Cb 0.04 0.12 0.01 0.00 -1.73 0.00 0.00 68.15 66.58 2k74 h THR 28 CO 0.01 0.06 -0.37 0.00 -0.25 0.00 0.00 175.52 174.96 2k74 h ALA 29 N 1.67 0.06 0.00 6.62 0.00 -1.05 -2.67 119.26 123.89 2k74 h ALA 29 Ca 0.49 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k74 h ALA 29 Cb 0.89 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2k74 h ALA 29 CO -0.52 0.19 0.34 -0.07 0.00 0.00 0.00 179.25 179.18 2k74 h LEU 30 N -0.31 0.00 0.09 0.00 -0.00 0.38 0.82 115.31 116.29 2k74 h LEU 30 Ca -0.04 0.00 -0.37 0.00 -0.00 0.00 0.00 57.88 57.47 2k74 h LEU 30 Cb 1.10 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.73 2k74 h LEU 30 CO 0.07 0.00 -2.08 1.87 -0.00 0.00 0.00 178.44 178.30 2k74 n TRP 31 N -2.81 1.00 -0.21 1.13 -0.00 -0.44 -3.46 117.44 112.65 2k74 n TRP 31 Ca -0.02 0.22 0.28 0.00 -0.00 0.00 0.00 57.50 57.98 2k74 n TRP 31 Cb 0.38 -1.13 0.70 0.00 -0.00 0.00 0.00 31.31 31.25 2k74 n TRP 31 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 177.69 178.04 2k74 h PHE 32 N 0.05 0.09 0.17 5.87 3.04 -0.48 0.23 116.94 125.91 2k74 h PHE 32 Ca -0.45 0.00 -0.29 0.00 3.98 0.00 0.00 57.97 61.21 2k74 h PHE 32 Cb 2.01 -0.03 0.01 0.00 2.56 0.00 0.00 35.95 40.51 2k74 h PHE 32 CO 0.06 0.02 -1.43 0.37 -2.02 0.00 0.00 178.31 175.32 2k74 h GLN 33 N 0.06 0.35 0.00 1.11 4.15 -1.65 0.11 115.11 119.25 2k74 h GLN 33 Ca 0.46 -0.60 0.00 0.00 0.77 0.00 0.00 58.65 59.28 2k74 h GLN 33 Cb 1.72 0.22 0.00 0.00 0.21 0.00 0.00 27.48 29.64 2k74 h GLN 33 CO -0.04 1.29 0.00 0.72 -1.93 0.00 0.00 178.83 178.87 2k74 n HIS 34 N -3.82 0.77 -0.07 3.99 8.25 -0.03 0.19 115.22 124.50 2k74 n HIS 34 Ca -0.22 0.31 -0.09 0.00 -0.26 0.00 0.00 57.72 57.46 2k74 n HIS 34 Cb 0.98 -1.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.02 2k74 n HIS 34 CO 0.00 0.00 0.00 1.55 0.64 0.00 0.00 176.34 178.53 2k74 n VAL 35 N -2.21 0.81 -0.14 1.59 3.14 0.60 -4.56 118.33 117.56 2k74 n VAL 35 Ca 0.02 -0.32 0.10 0.00 -2.96 0.00 0.00 64.34 61.17 2k74 n VAL 35 Cb 0.21 -0.98 0.30 0.00 -1.06 0.00 0.00 33.84 32.31 2k74 n VAL 35 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 2k74 n MET 36 N -2.87 2.79 -4.26 1.45 0.00 0.38 -4.93 117.12 109.67 2k74 n MET 36 Ca -0.24 -2.38 -0.34 0.00 -0.00 0.00 0.00 57.70 54.73 2k74 n MET 36 Cb 0.77 -1.60 -0.06 0.00 0.00 0.00 0.00 33.22 32.33 2k74 n MET 36 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 2k74 n LEU 37 N 1.26 -1.44 -4.82 -0.89 4.32 0.13 -4.89 117.00 110.67 2k74 n LEU 37 Ca 0.22 -1.13 -0.33 0.00 -0.02 0.00 0.00 56.01 54.75 2k74 n LEU 37 Cb 0.63 -1.88 -0.03 0.00 -1.62 0.00 0.00 43.42 40.52 2k74 n LEU 37 CO 0.17 0.33 0.69 -0.22 -1.22 0.00 0.00 177.39 177.14 2k74 s LEU 38 N -7.23 3.68 -0.16 2.23 2.96 -0.99 -5.04 118.68 114.14 2k74 s LEU 38 Ca 0.40 1.72 -0.04 0.00 -0.22 0.00 0.00 54.13 55.99 2k74 s LEU 38 Cb -0.22 -4.53 -0.03 0.00 0.50 0.00 0.00 46.19 41.91 2k74 s LEU 38 CO 0.96 -0.74 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.68 2k74 s LYS 39 N -3.78 3.69 0.85 1.98 1.02 -1.26 -4.85 119.74 117.38 2k74 s LYS 39 Ca 0.62 -0.51 -0.12 0.00 0.02 0.00 0.00 55.97 55.98 2k74 s LYS 39 Cb -0.12 -2.93 0.10 0.00 -0.52 0.00 0.00 37.83 34.35 2k74 s LYS 39 CO 0.28 0.24 1.15 -1.25 -0.92 0.00 0.00 175.35 174.85 2k74 s PRO 40 N 0.37 1.66 0.14 -1.68 0.04 -1.20 -4.86 135.00 129.47 2k74 s PRO 40 Ca -0.04 0.26 0.04 0.00 0.04 0.00 0.00 61.00 61.31 2k74 s PRO 40 Cb -0.14 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 2k74 s PRO 40 CO 0.03 -1.84 -0.10 0.00 0.04 0.00 0.00 177.00 175.13 2k74 h VAL 42 N 2.86 0.65 -0.34 0.00 -1.51 -1.91 -0.53 116.25 115.46 2k74 h VAL 42 Ca -0.37 -0.19 -0.04 0.00 -1.23 0.00 0.00 66.70 64.87 2k74 h VAL 42 Cb 1.19 0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 30.37 2k74 h VAL 42 CO 0.63 0.10 0.07 -0.07 -1.23 0.00 0.00 177.57 177.07 2k74 h LEU 43 N 0.56 0.53 -0.85 4.19 4.07 -1.97 -2.48 115.31 119.37 2k74 h LEU 43 Ca 0.50 -0.25 0.16 0.00 0.08 0.00 0.00 57.88 58.38 2k74 h LEU 43 Cb 0.80 -0.14 -0.10 0.00 1.08 0.00 0.00 40.66 42.30 2k74 h LEU 43 CO -0.41 0.64 0.41 0.28 -1.08 0.00 0.00 178.44 178.27 2k74 h SER 44 N 0.40 0.45 -0.43 -0.43 0.02 -1.51 0.21 113.55 112.25 2k74 h SER 44 Ca 0.11 0.11 -0.07 0.00 -0.84 0.00 0.00 61.79 61.10 2k74 h SER 44 Cb 0.33 0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 2k74 h SER 44 CO 0.00 0.15 -0.00 0.40 -1.14 0.00 0.00 176.83 176.24 2k74 h ILE 45 N 0.54 1.26 -0.54 3.27 2.04 -1.24 -1.77 117.51 121.07 2k74 h ILE 45 Ca 0.48 -1.03 0.02 0.00 1.00 0.00 0.00 64.86 65.33 2k74 h ILE 45 Cb 0.75 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.88 2k74 h ILE 45 CO -0.41 0.35 0.33 1.88 0.00 0.00 0.00 178.15 180.30 2k74 h TYR 46 N 0.59 0.62 -0.08 1.37 0.05 -0.50 -0.72 116.97 118.31 2k74 h TYR 46 Ca 0.12 0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.93 2k74 h TYR 46 Cb 0.49 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 38.02 2k74 h TYR 46 CO 0.04 0.36 0.01 0.93 -1.05 0.00 0.00 178.16 178.44 2k74 h GLU 47 N 0.66 0.04 -0.10 4.88 5.08 -0.50 -1.28 114.58 123.36 2k74 h GLU 47 Ca 0.22 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.60 2k74 h GLU 47 Cb 0.01 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2k74 h GLU 47 CO -0.09 0.03 0.07 -0.09 -1.00 0.00 0.00 179.01 177.93 2k74 h ARG 48 N 0.04 0.01 -0.44 2.33 2.43 -0.93 -0.85 114.38 116.96 2k74 h ARG 48 Ca 0.03 -0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 2k74 h ARG 48 Cb 0.03 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2k74 h ARG 48 CO -0.05 0.01 -0.23 0.00 -1.51 0.00 0.00 179.97 178.19 2k74 h ALA 49 N 1.95 0.76 -0.15 2.80 0.00 -0.04 0.51 119.26 125.08 2k74 h ALA 49 Ca 0.05 -0.39 0.03 0.00 0.00 0.00 0.00 54.91 54.59 2k74 h ALA 49 Cb 0.17 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2k74 h ALA 49 CO -0.00 0.66 -0.01 0.00 0.00 0.00 0.00 179.25 179.90 2k74 h ALA 50 N 0.95 0.12 0.01 0.00 0.00 -0.25 0.01 119.26 120.09 2k74 h ALA 50 Ca 0.10 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2k74 h ALA 50 Cb 0.78 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2k74 h ALA 50 CO 0.06 -0.46 -0.09 -0.07 0.00 0.00 0.00 179.25 178.70 2k74 h LEU 51 N 0.03 0.07 -0.96 0.00 3.38 -1.46 -2.76 115.31 113.61 2k74 h LEU 51 Ca 0.07 -0.85 0.27 0.00 0.09 0.00 0.00 57.88 57.47 2k74 h LEU 51 Cb 0.10 -0.02 -0.14 0.00 0.09 0.00 0.00 40.66 40.69 2k74 h LEU 51 CO -0.13 0.91 0.48 0.15 0.09 0.00 0.00 178.44 179.93 2k74 h PHE 52 N -0.77 0.79 -0.43 1.13 3.57 0.06 0.83 116.94 122.12 2k74 h PHE 52 Ca -0.01 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.44 2k74 h PHE 52 Cb 0.93 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.46 2k74 h PHE 52 CO 0.22 -0.12 -0.06 0.78 -2.23 0.00 0.00 178.31 176.90 2k74 h GLY 53 N 0.36 0.87 0.83 2.40 0.00 -1.03 -2.90 103.07 103.61 2k74 h GLY 53 Ca 0.65 -0.69 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 2k74 h GLY 53 CO -0.58 0.63 0.03 -2.08 0.00 0.00 0.00 176.54 174.54 2k74 h VAL 54 N 0.64 1.21 -0.87 4.60 2.07 0.56 -2.34 116.25 122.11 2k74 h VAL 54 Ca 0.11 -0.69 0.23 0.00 0.82 0.00 0.00 66.70 67.18 2k74 h VAL 54 Cb 0.58 1.36 -0.14 0.00 -1.52 0.00 0.00 31.29 31.57 2k74 h VAL 54 CO 0.03 0.21 0.20 0.25 0.02 0.00 0.00 177.57 178.29 2k74 h LEU 55 N 0.07 -0.06 -1.01 2.57 6.46 0.39 1.53 115.31 125.26 2k74 h LEU 55 Ca 0.05 0.20 -0.05 0.00 -0.12 0.00 0.00 57.88 57.96 2k74 h LEU 55 Cb 0.29 0.29 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 2k74 h LEU 55 CO 0.00 -0.17 0.10 1.23 -0.62 0.00 0.00 178.44 178.98 2k74 h GLY 56 N 0.18 0.88 1.26 3.75 0.00 -1.28 -2.21 103.07 105.66 2k74 h GLY 56 Ca 0.54 -0.52 -0.06 0.00 0.00 0.00 0.00 47.33 47.29 2k74 h GLY 56 CO -0.67 0.49 0.15 0.00 0.00 0.00 0.00 176.54 176.50 2k74 h ALA 57 N 1.33 1.14 -0.35 3.60 0.00 0.25 -1.62 119.26 123.60 2k74 h ALA 57 Ca 0.17 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2k74 h ALA 57 Cb 0.32 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2k74 h ALA 57 CO 0.00 0.58 0.08 0.00 0.00 0.00 0.00 179.25 179.91 2k74 h ALA 58 N 1.27 1.49 0.00 0.00 0.00 0.07 0.23 119.26 122.32 2k74 h ALA 58 Ca 0.19 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2k74 h ALA 58 Cb 0.31 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2k74 h ALA 58 CO -0.00 0.38 -0.56 -0.07 0.00 0.00 0.00 179.25 179.00 2k74 h LEU 59 N 0.50 0.00 0.24 0.00 3.38 -1.07 -2.20 115.31 116.17 2k74 h LEU 59 Ca 0.12 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.76 2k74 h LEU 59 Cb 0.21 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.99 2k74 h LEU 59 CO -0.00 0.56 -1.45 0.40 0.09 0.00 0.00 178.44 178.04 2k74 h ILE 60 N 0.00 1.28 0.00 1.22 2.04 -0.35 -3.29 117.51 118.41 2k74 h ILE 60 Ca -0.01 -2.67 -0.08 0.00 1.00 0.00 0.00 64.86 63.11 2k74 h ILE 60 Cb 1.22 3.04 -0.01 0.00 -0.74 0.00 0.00 36.82 40.33 2k74 h ILE 60 CO 0.07 0.80 -0.36 1.23 0.00 0.00 0.00 178.15 179.90 2k74 h GLY 61 N 0.14 0.00 0.07 5.37 0.00 -0.61 -2.56 103.07 105.48 2k74 h GLY 61 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2k74 h GLY 61 CO 0.26 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.80 2k74 n ALA 62 N -2.33 2.16 0.12 3.60 0.00 -0.83 -2.97 120.51 120.26 2k74 n ALA 62 Ca -0.01 -0.01 -0.23 0.00 0.00 0.00 0.00 53.44 53.19 2k74 n ALA 62 Cb 0.47 -1.02 -0.15 0.00 0.00 0.00 0.00 19.45 18.74 2k74 n ALA 62 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2k74 h ILE 63 N 0.00 1.17 0.00 0.00 2.04 -1.60 -3.46 117.51 115.65 2k74 h ILE 63 Ca 0.00 -2.66 0.00 0.00 1.00 0.00 0.00 64.86 63.20 2k74 h ILE 63 Cb 0.00 2.93 0.00 0.00 -0.74 0.00 0.00 36.82 39.01 2k74 h ILE 63 CO 0.00 0.83 0.00 0.00 0.00 0.00 0.00 178.15 178.98 2k74 n ALA 64 N -2.76 0.00 0.87 1.87 0.00 -1.16 -5.02 120.51 114.31 2k74 n ALA 64 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2k74 n ALA 64 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.54 2k74 n ALA 64 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2k74 n PRO 65 N 0.00 0.87 0.00 0.00 -0.04 -1.19 -3.02 135.00 131.62 2k74 n PRO 65 Ca 0.00 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.52 2k74 n PRO 65 Cb 0.00 -1.18 -0.06 0.00 -0.04 0.00 0.00 33.50 32.22 2k74 n PRO 65 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2k74 n LYS 66 N 0.41 2.66 -4.19 0.54 4.81 -1.26 -4.82 118.16 116.31 2k74 n LYS 66 Ca 0.00 -0.13 -0.28 0.00 -0.87 0.00 0.00 58.31 57.03 2k74 n LYS 66 Cb 0.36 -1.11 -0.05 0.00 0.02 0.00 0.00 35.03 34.26 2k74 n LYS 66 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2k74 s THR 67 N -2.09 1.72 -0.66 3.15 -4.23 -1.17 -4.95 115.64 107.42 2k74 s THR 67 Ca 0.06 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 2k74 s THR 67 Cb 0.10 -2.41 0.00 0.00 1.34 0.00 0.00 72.50 71.52 2k74 s THR 67 CO 0.48 0.00 0.46 -2.65 -0.54 0.00 0.00 174.62 172.37 2k74 n PRO 68 N -1.47 0.00 -0.34 3.99 -0.02 -1.26 -2.41 135.00 133.49 2k74 n PRO 68 Ca -0.06 0.10 0.26 0.00 -2.02 0.00 0.00 63.50 61.79 2k74 n PRO 68 Cb 0.65 -1.64 0.56 0.00 -0.02 0.00 0.00 33.50 33.05 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 0.36 0.00 2.45 3.38 -1.93 -2.53 115.31 117.04 2k74 h LEU 69 Ca 0.00 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2k74 h LEU 69 Cb 0.27 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2k74 h LEU 69 CO 0.00 0.04 0.00 0.54 0.09 0.00 0.00 178.44 179.11 2k74 n ARG 70 N -4.57 0.00 0.32 1.13 1.74 -1.01 0.18 116.66 114.44 2k74 n ARG 70 Ca 0.27 0.96 0.12 0.00 -0.77 0.00 0.00 57.85 58.42 2k74 n ARG 70 Cb 1.00 -1.48 0.59 0.00 -1.02 0.00 0.00 32.46 31.56 2k74 n ARG 70 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 2k74 h TYR 71 N 0.00 0.00 0.07 -1.55 3.20 -1.77 0.11 116.97 117.04 2k74 h TYR 71 Ca 0.00 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.70 2k74 h TYR 71 Cb 0.00 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 2k74 h TYR 71 CO -0.85 0.00 -0.85 0.28 -1.64 0.00 0.00 178.16 175.10 2k74 h VAL 72 N 0.00 1.35 -0.12 1.81 2.07 0.18 -3.31 116.25 118.23 2k74 h VAL 72 Ca 0.01 -2.39 -0.22 0.00 0.82 0.00 0.00 66.70 64.92 2k74 h VAL 72 Cb 1.06 2.95 0.01 0.00 -1.52 0.00 0.00 31.29 33.79 2k74 h VAL 72 CO -0.00 0.62 -0.81 0.00 0.02 0.00 0.00 177.57 177.40 2k74 h ALA 73 N -0.07 0.34 0.00 1.67 0.00 0.11 -2.96 119.26 118.35 2k74 h ALA 73 Ca -0.19 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.10 2k74 h ALA 73 Cb 1.46 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.23 2k74 h ALA 73 CO 0.03 0.70 0.00 0.00 0.00 0.00 0.00 179.25 179.98 2k74 n MET 74 N -3.90 0.00 -0.32 0.00 3.85 0.21 -1.96 117.12 115.00 2k74 n MET 74 Ca -0.07 0.45 -0.00 0.00 -1.00 0.00 0.00 57.70 57.08 2k74 n MET 74 Cb 0.76 -1.50 0.13 0.00 -1.05 0.00 0.00 33.22 31.56 2k74 n MET 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2k74 h VAL 75 N 0.00 1.09 0.04 3.17 2.07 -1.60 0.46 116.25 121.48 2k74 h VAL 75 Ca 0.00 -0.36 -0.29 0.00 0.82 0.00 0.00 66.70 66.86 2k74 h VAL 75 Cb 0.03 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 29.71 2k74 h VAL 75 CO 0.00 0.19 -1.62 0.40 0.02 0.00 0.00 177.57 176.56 2k74 h ILE 76 N 1.05 0.99 0.13 4.57 5.03 -1.62 -2.89 117.51 124.76 2k74 h ILE 76 Ca 0.37 -2.76 -0.01 0.00 -0.12 0.00 0.00 64.86 62.34 2k74 h ILE 76 Cb 0.09 2.56 0.00 0.00 -3.03 0.00 0.00 36.82 36.44 2k74 h ILE 76 CO -0.15 0.68 -0.06 -0.25 -0.68 0.00 0.00 178.15 177.69 2k74 h TRP 77 N 0.02 -0.16 -0.16 1.37 2.91 -1.39 -2.84 115.95 115.71 2k74 h TRP 77 Ca -0.26 -0.00 -0.02 0.00 1.13 0.00 0.00 58.89 59.73 2k74 h TRP 77 Cb 1.99 0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 30.68 2k74 h TRP 77 CO 0.02 0.12 0.01 1.25 -1.03 0.00 0.00 178.44 178.81 2k74 h LEU 78 N -0.43 0.27 -0.93 0.65 5.85 -0.26 -2.12 115.31 118.34 2k74 h LEU 78 Ca -0.02 -0.29 0.27 0.00 0.84 0.00 0.00 57.88 58.69 2k74 h LEU 78 Cb 0.34 -0.07 -0.15 0.00 0.37 0.00 0.00 40.66 41.15 2k74 h LEU 78 CO 0.03 0.49 0.29 1.88 -0.34 0.00 0.00 178.44 180.79 2k74 h TYR 79 N 0.04 0.44 0.00 1.25 -1.99 -1.53 1.63 116.97 116.81 2k74 h TYR 79 Ca 0.05 0.05 -0.02 0.00 2.00 0.00 0.00 58.73 60.81 2k74 h TYR 79 Cb 0.34 -0.04 -0.00 0.00 2.00 0.00 0.00 36.73 39.03 2k74 h TYR 79 CO 0.03 -0.26 -0.09 0.66 -0.00 0.00 0.00 178.16 178.49 2k74 h SER 80 N 0.18 0.00 0.95 3.88 4.64 -1.33 -2.70 113.55 119.16 2k74 h SER 80 Ca 0.62 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.89 2k74 h SER 80 Cb 1.34 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.44 2k74 h SER 80 CO -0.70 0.09 -0.45 0.00 -0.87 0.00 0.00 176.83 174.90 2k74 h ALA 81 N 1.91 -1.32 0.16 5.18 0.00 0.31 0.56 119.26 126.05 2k74 h ALA 81 Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2k74 h ALA 81 Cb 1.01 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.29 2k74 h ALA 81 CO 0.01 -1.23 -0.08 0.74 0.00 0.00 0.00 179.25 178.70 2k74 h PHE 82 N -1.29 -0.20 -0.35 0.00 0.04 -1.59 -2.64 116.94 110.91 2k74 h PHE 82 Ca -0.13 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.59 2k74 h PHE 82 Cb 0.97 0.07 -0.01 0.00 2.20 0.00 0.00 35.95 39.18 2k74 h PHE 82 CO 0.01 0.21 0.04 -0.09 -0.60 0.00 0.00 178.31 177.88 2k74 h ARG 83 N -0.91 0.59 -0.41 1.51 2.43 -1.60 0.32 114.38 116.31 2k74 h ARG 83 Ca -0.02 -0.17 -0.01 0.00 -0.81 0.00 0.00 59.98 58.97 2k74 h ARG 83 Cb 0.50 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 2k74 h ARG 83 CO 0.04 0.68 0.23 0.78 -1.51 0.00 0.00 179.97 180.19 2k74 h GLY 84 N 0.41 0.61 0.82 2.80 0.00 -0.00 -0.38 103.07 107.33 2k74 h GLY 84 Ca 0.10 -0.28 -0.13 0.00 0.00 0.00 0.00 47.33 47.03 2k74 h GLY 84 CO 0.01 0.26 -0.43 -2.08 0.00 0.00 0.00 176.54 174.30 2k74 h VAL 85 N 0.54 1.38 -0.79 4.60 2.07 -1.34 -1.32 116.25 121.39 2k74 h VAL 85 Ca 0.15 -1.77 -0.01 0.00 0.82 0.00 0.00 66.70 65.89 2k74 h VAL 85 Cb 0.05 2.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 2k74 h VAL 85 CO -0.02 0.53 0.47 -0.61 0.02 0.00 0.00 177.57 177.95 2k74 h GLN 86 N 0.04 1.08 -0.05 1.57 5.75 -0.30 -2.57 115.11 120.64 2k74 h GLN 86 Ca -0.03 -0.10 -0.11 0.00 -0.15 0.00 0.00 58.65 58.26 2k74 h GLN 86 Cb 1.07 -0.22 0.01 0.00 1.07 0.00 0.00 27.48 29.41 2k74 h GLN 86 CO 0.09 0.77 -0.40 1.25 -2.65 0.00 0.00 178.83 177.89 2k74 h LEU 87 N 1.09 0.44 -0.59 -2.39 5.85 -1.12 -3.27 115.31 115.31 2k74 h LEU 87 Ca 0.28 -0.69 0.12 0.00 0.84 0.00 0.00 57.88 58.44 2k74 h LEU 87 Cb -0.03 -0.13 -0.11 0.00 0.37 0.00 0.00 40.66 40.77 2k74 h LEU 87 CO -0.05 1.06 -0.09 0.71 -0.34 0.00 0.00 178.44 179.72 2k74 h THR 88 N -0.15 0.44 -0.98 1.05 1.35 -1.13 0.32 112.91 113.82 2k74 h THR 88 Ca -0.04 -0.01 0.18 0.00 -0.55 0.00 0.00 66.41 65.99 2k74 h THR 88 Cb 1.08 0.40 -0.09 0.00 -1.73 0.00 0.00 68.15 67.81 2k74 h THR 88 CO 0.08 0.01 0.61 0.22 -0.25 0.00 0.00 175.52 176.19 2k74 h TYR 89 N 0.04 0.93 -0.82 4.73 3.20 -1.53 0.18 116.97 123.70 2k74 h TYR 89 Ca 0.30 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.26 2k74 h TYR 89 Cb 0.46 -0.28 -0.06 0.00 1.54 0.00 0.00 36.73 38.39 2k74 h TYR 89 CO -0.44 0.25 0.50 1.49 -1.64 0.00 0.00 178.16 178.31 2k74 h GLU 90 N 0.70 0.87 -0.38 1.82 4.81 -0.41 0.25 114.58 122.24 2k74 h GLU 90 Ca 0.53 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.59 2k74 h GLU 90 Cb 0.91 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 2k74 h GLU 90 CO -0.30 0.58 -0.25 0.45 -0.73 0.00 0.00 179.01 178.76 2k74 h HIS 91 N 0.90 0.88 -0.47 0.92 3.86 -0.42 -2.94 115.15 117.87 2k74 h HIS 91 Ca 0.36 -0.21 -0.10 0.00 -1.16 0.00 0.00 60.37 59.26 2k74 h HIS 91 Cb 0.19 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 2k74 h HIS 91 CO -0.04 0.93 -0.10 1.79 0.86 0.00 0.00 177.93 181.37 2k74 h THR 92 N 0.67 1.27 -0.43 2.45 1.35 -0.21 -2.90 112.91 115.10 2k74 h THR 92 Ca 0.09 -1.22 0.08 0.00 -0.55 0.00 0.00 66.41 64.81 2k74 h THR 92 Cb 0.76 1.09 -0.07 0.00 -1.73 0.00 0.00 68.15 68.21 2k74 h THR 92 CO 0.06 0.42 0.03 -0.03 -0.25 0.00 0.00 175.52 175.75 2k74 h MET 93 N 0.74 0.14 -0.48 4.72 -1.53 -0.43 -1.23 114.93 116.86 2k74 h MET 93 Ca 0.12 -0.01 0.07 0.00 -3.44 0.00 0.00 59.70 56.44 2k74 h MET 93 Cb 0.64 -0.03 -0.06 0.00 -0.55 0.00 0.00 31.60 31.60 2k74 h MET 93 CO 0.04 0.09 0.16 1.25 0.14 0.00 0.00 176.91 178.59 2k74 h LEU 94 N 0.14 0.15 -0.93 3.39 5.85 -1.41 2.03 115.31 124.52 2k74 h LEU 94 Ca 0.21 0.06 0.19 0.00 0.84 0.00 0.00 57.88 59.18 2k74 h LEU 94 Cb 0.30 0.06 -0.11 0.00 0.37 0.00 0.00 40.66 41.28 2k74 h LEU 94 CO -0.33 0.11 0.51 -0.61 -0.34 0.00 0.00 178.44 177.78 2k74 h GLN 95 N 0.33 0.62 0.00 1.25 4.15 -1.04 0.35 115.11 120.76 2k74 h GLN 95 Ca 0.23 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.62 2k74 h GLN 95 Cb 0.26 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.81 2k74 h GLN 95 CO -0.25 0.41 -0.78 1.28 -1.93 0.00 0.00 178.83 177.56 2k74 n LEU 96 N -4.86 0.64 -3.89 -2.39 7.99 -0.28 -4.57 117.00 109.64 2k74 n LEU 96 Ca 0.21 0.08 -0.29 0.00 -0.01 0.00 0.00 56.01 56.00 2k74 n LEU 96 Cb 0.56 -0.15 -0.13 0.00 -0.11 0.00 0.00 43.42 43.58 2k74 n LEU 96 CO 0.19 0.02 -0.13 -0.47 -1.51 0.00 0.00 177.39 175.49 2k74 s TYR 97 N -3.15 3.18 0.00 -1.77 5.04 0.67 -5.08 117.35 116.24 2k74 s TYR 97 Ca 0.06 -3.16 0.00 0.00 -2.44 0.00 0.00 57.07 51.53 2k74 s TYR 97 Cb 0.14 -2.63 0.00 0.00 0.35 0.00 0.00 41.96 39.82 2k74 s TYR 97 CO 0.75 -0.66 0.00 -2.30 -1.34 0.00 0.00 175.55 172.00 2k74 n PRO 98 N 2.64 3.31 -3.21 4.97 -0.02 -1.11 -4.38 135.00 137.21 2k74 n PRO 98 Ca 0.12 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.46 2k74 n PRO 98 Cb 0.34 0.00 0.07 0.00 -0.02 0.00 0.00 33.50 33.89 2k74 n PRO 98 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2k74 n SER 99 N 0.00 -5.69 0.00 2.55 3.41 -1.26 -4.99 113.62 107.64 2k74 n SER 99 Ca 0.00 -0.66 0.00 0.00 -0.26 0.00 0.00 58.87 57.95 2k74 n SER 99 Cb 0.00 -5.00 0.00 0.00 -0.26 0.00 0.00 64.21 58.95 2k74 n SER 99 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2k74 n PRO 100 N -3.30 0.00 -1.88 4.33 -0.04 -1.26 -5.07 135.00 127.79 2k74 n PRO 100 Ca -0.10 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.34 2k74 n PRO 100 Cb 0.62 -0.22 -0.02 0.00 -0.04 0.00 0.00 33.50 33.85 2k74 n PRO 100 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2k74 n PHE 101 N -0.06 -1.54 -2.30 0.54 -0.00 -1.26 -4.90 117.46 107.93 2k74 n PHE 101 Ca 0.00 0.88 -0.43 0.00 -0.00 0.00 0.00 57.45 57.91 2k74 n PHE 101 Cb 0.00 -2.34 -0.02 0.00 -0.00 0.00 0.00 39.48 37.12 2k74 n PHE 101 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2k74 s ALA 102 N -0.25 3.32 -0.16 3.13 0.00 -1.26 -4.89 121.76 121.66 2k74 s ALA 102 Ca -0.09 0.24 -0.14 0.00 0.00 0.00 0.00 51.96 51.96 2k74 s ALA 102 Cb 0.01 -3.81 -0.05 0.00 0.00 0.00 0.00 23.12 19.27 2k74 s ALA 102 CO 0.27 -1.85 -0.27 2.41 0.00 0.00 0.00 175.76 176.32 2k74 n THR 103 N 6.30 1.38 0.02 0.00 -1.04 -1.26 -4.98 114.28 114.70 2k74 n THR 103 Ca 0.16 0.19 0.00 0.00 -2.04 0.00 0.00 64.05 62.36 2k74 n THR 103 Cb 0.46 -2.31 0.00 0.00 -1.82 0.00 0.00 70.33 66.66 2k74 n THR 103 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2k74 n SER 104 N -4.38 0.51 -1.05 8.00 2.88 -1.26 -5.13 113.62 113.19 2k74 n SER 104 Ca -0.11 0.06 0.04 0.00 -1.33 0.00 0.00 58.87 57.53 2k74 n SER 104 Cb 0.40 -0.15 -0.01 0.00 -0.75 0.00 0.00 64.21 63.70 2k74 n SER 104 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2k74 n ASP 105 N -2.96 -6.26 -3.10 -3.46 2.03 -1.26 -4.75 116.55 96.78 2k74 n ASP 105 Ca 0.00 0.30 -0.18 0.00 0.52 0.00 0.00 54.79 55.43 2k74 n ASP 105 Cb 0.00 -0.86 -0.05 0.00 -0.72 0.00 0.00 41.12 39.50 2k74 n ASP 105 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2k74 n PHE 106 N -2.37 -1.83 -3.00 -0.67 3.72 -1.26 -5.06 117.46 106.99 2k74 n PHE 106 Ca 0.00 -2.69 -0.40 0.00 -0.05 0.00 0.00 57.45 54.31 2k74 n PHE 106 Cb 0.13 0.59 -0.04 0.00 -0.94 0.00 0.00 39.48 39.22 2k74 n PHE 106 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 2k74 s MET 107 N 0.05 4.42 0.00 -1.08 -1.94 -1.26 -3.74 119.30 115.74 2k74 s MET 107 Ca 0.33 0.93 0.00 0.00 -1.71 0.00 0.00 55.69 55.23 2k74 s MET 107 Cb 0.09 -3.47 0.00 0.00 2.01 0.00 0.00 34.83 33.46 2k74 s MET 107 CO -0.15 -0.01 0.00 0.28 -0.01 0.00 0.00 175.02 175.13 2k74 n VAL 108 N 3.96 0.00 -3.22 -6.03 0.31 -1.26 -4.87 118.33 107.23 2k74 n VAL 108 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 63.88 2k74 n VAL 108 Cb 0.51 -0.21 -0.05 0.00 -0.91 0.00 0.00 33.84 33.18 2k74 n VAL 108 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2k74 s ARG 109 N -0.42 3.03 0.32 5.55 0.52 -1.25 -5.04 118.95 121.67 2k74 s ARG 109 Ca 0.00 -1.55 0.08 0.00 -0.52 0.00 0.00 55.73 53.74 2k74 s ARG 109 Cb 0.00 -4.29 -0.04 0.00 0.52 0.00 0.00 34.95 31.14 2k74 s ARG 109 CO 0.00 -1.43 0.16 -0.59 0.02 0.00 0.00 175.30 173.46 2k74 s PHE 110 N 2.08 2.78 0.60 -0.53 -0.12 -1.26 -4.85 117.98 116.68 2k74 s PHE 110 Ca 0.07 -0.32 -0.18 0.00 -0.05 0.00 0.00 56.93 56.45 2k74 s PHE 110 Cb -0.27 -1.60 -0.14 0.00 -0.63 0.00 0.00 43.02 40.38 2k74 s PHE 110 CO 0.04 0.35 -0.18 -2.30 -0.05 0.00 0.00 175.22 173.08 2k74 n PRO 111 N -1.17 0.04 0.00 1.99 -0.02 -1.26 -4.92 135.00 129.66 2k74 n PRO 111 Ca -0.04 0.02 0.05 0.00 -2.02 0.00 0.00 63.50 61.51 2k74 n PRO 111 Cb 0.60 -1.07 -0.06 0.00 -0.02 0.00 0.00 33.50 32.95 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 1.50 3.46 0.00 -0.52 1.02 -1.26 -4.43 120.64 120.40 2k74 n GLU 112 Ca 0.06 -0.03 0.06 0.00 -0.02 0.00 0.00 57.16 57.23 2k74 n GLU 112 Cb 0.49 -1.00 0.05 0.00 -0.02 0.00 0.00 31.44 30.95 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 -1.19 0.00 -3.64 -0.32 7.02 -1.26 -4.75 117.44 113.30 2k74 n TRP 113 Ca 0.02 0.00 -0.27 0.00 -1.02 0.00 0.00 57.50 56.23 2k74 n TRP 113 Cb 0.17 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 28.95 2k74 n TRP 113 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 2k74 n LEU 114 N 0.62 2.08 0.00 -0.99 7.94 -1.26 -4.94 117.00 120.45 2k74 n LEU 114 Ca 0.07 -5.01 0.00 0.00 -1.11 0.00 0.00 56.01 49.96 2k74 n LEU 114 Cb 0.29 -0.31 0.00 0.00 0.53 0.00 0.00 43.42 43.93 2k74 n LEU 114 CO 0.08 1.86 0.08 -2.65 -1.11 0.00 0.00 177.39 175.65 2k74 n PRO 115 N 1.93 0.00 0.03 1.96 -0.02 -1.26 -2.35 135.00 135.29 2k74 n PRO 115 Ca 0.24 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.75 2k74 n PRO 115 Cb 0.41 -1.26 0.41 0.00 -0.02 0.00 0.00 33.50 33.04 2k74 n PRO 115 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2k74 h LEU 116 N 0.00 0.41 0.02 2.45 5.85 -1.94 0.83 115.31 122.93 2k74 h LEU 116 Ca 0.00 -0.03 -0.39 0.00 0.84 0.00 0.00 57.88 58.29 2k74 h LEU 116 Cb 0.00 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 40.87 2k74 h LEU 116 CO 0.00 0.37 -2.30 0.47 -0.34 0.00 0.00 178.44 176.64 2k74 n ASP 117 N -4.41 1.99 -0.09 1.25 9.92 -0.99 -3.48 116.55 120.74 2k74 n ASP 117 Ca 0.02 0.11 -0.11 0.00 -0.53 0.00 0.00 54.79 54.28 2k74 n ASP 117 Cb 0.13 -0.66 -0.04 0.00 -0.64 0.00 0.00 41.12 39.90 2k74 n ASP 117 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 2k74 h LYS 118 N -0.38 0.48 0.00 -1.24 3.64 -1.69 -0.90 116.57 116.48 2k74 h LYS 118 Ca -0.57 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 58.64 2k74 h LYS 118 Cb 1.78 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.57 2k74 h LYS 118 CO -0.17 0.68 0.00 1.87 -2.27 0.00 0.00 179.45 179.56 2k74 n TRP 119 N -4.57 0.33 -3.22 1.91 -0.00 0.29 -3.93 117.44 108.25 2k74 n TRP 119 Ca -0.03 0.11 -0.24 0.00 -0.00 0.00 0.00 57.50 57.33 2k74 n TRP 119 Cb 0.28 -0.68 -0.07 0.00 -0.00 0.00 0.00 31.31 30.84 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 -1.78 -0.48 0.39 5.87 0.31 -0.91 -4.93 118.33 116.80 2k74 n VAL 120 Ca 0.05 -4.08 0.13 0.00 -0.01 0.00 0.00 64.34 60.42 2k74 n VAL 120 Cb 0.29 -1.96 0.28 0.00 -0.91 0.00 0.00 33.84 31.54 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 4.09 0.00 -0.69 5.55 0.13 -1.30 -3.29 132.00 136.49 2k74 h PRO 121 Ca 0.09 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.29 2k74 h PRO 121 Cb 0.86 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.95 2k74 h PRO 121 CO 0.49 0.00 0.46 1.96 -0.23 0.00 0.00 178.00 180.67 2k74 h GLN 122 N 0.00 0.67 -1.48 0.86 4.20 -1.91 -1.64 115.11 115.81 2k74 h GLN 122 Ca 0.00 -0.04 -0.54 0.00 0.06 0.00 0.00 58.65 58.13 2k74 h GLN 122 Cb 0.88 -0.15 -0.42 0.00 0.30 0.00 0.00 27.48 28.09 2k74 h GLN 122 CO 0.00 0.44 -0.82 0.28 -0.67 0.00 0.00 178.83 178.06 2k74 n VAL 123 N -4.48 2.10 0.00 -0.54 0.31 -1.24 -4.70 118.33 109.78 2k74 n VAL 123 Ca 0.10 -4.61 0.00 0.00 -0.01 0.00 0.00 64.34 59.83 2k74 n VAL 123 Cb 0.24 -0.88 0.00 0.00 -0.91 0.00 0.00 33.84 32.29 2k74 n VAL 123 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2k74 n PHE 124 N -0.37 0.00 -1.67 3.52 3.72 -1.09 -5.07 117.46 116.51 2k74 n PHE 124 Ca 0.32 0.00 -0.47 0.00 -0.05 0.00 0.00 57.45 57.25 2k74 n PHE 124 Cb 0.67 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.17 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 -1.07 0.15 -3.63 -4.37 3.14 -0.64 -4.96 118.33 106.95 2k74 n VAL 125 Ca 0.00 -0.03 -0.32 0.00 -2.96 0.00 0.00 64.34 61.03 2k74 n VAL 125 Cb 0.00 -1.55 -0.05 0.00 -1.06 0.00 0.00 33.84 31.18 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 1.68 3.76 -0.30 1.55 0.00 -1.26 -4.99 121.76 122.20 2k74 s ALA 126 Ca 0.83 -0.50 -0.10 0.00 0.00 0.00 0.00 51.96 52.19 2k74 s ALA 126 Cb -0.71 -2.18 0.15 0.00 0.00 0.00 0.00 23.12 20.38 2k74 s ALA 126 CO 0.42 0.64 0.78 0.45 0.00 0.00 0.00 175.76 178.05 2k74 s SER 127 N -2.30 -0.95 0.00 0.00 0.15 -1.23 -4.79 113.70 104.57 2k74 s SER 127 Ca 0.40 1.12 0.00 0.00 0.70 0.00 0.00 55.95 58.17 2k74 s SER 127 Cb -0.12 2.01 0.00 0.00 -1.71 0.00 0.00 66.02 66.20 2k74 s SER 127 CO 0.23 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.10 2k74 n GLY 128 N 5.30 0.46 3.95 9.45 0.00 -1.25 -3.24 105.19 119.86 2k74 n GLY 128 Ca -0.09 -2.19 -0.23 0.00 0.00 0.00 0.00 46.02 43.51 2k74 n GLY 128 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k74 s ASP 129 N -4.00 5.97 -0.13 1.61 -1.08 -1.26 -4.92 116.67 112.85 2k74 s ASP 129 Ca 0.00 0.30 0.00 0.00 -0.52 0.00 0.00 52.55 52.34 2k74 s ASP 129 Cb 0.00 -1.65 -0.01 0.00 -1.46 0.00 0.00 42.92 39.80 2k74 s ASP 129 CO 0.00 -0.57 -0.14 0.00 0.52 0.00 0.00 175.17 174.97 2k74 n ALA 131 N 3.66 0.00 -2.09 0.00 0.00 -1.26 -5.03 120.51 115.80 2k74 n ALA 131 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 2k74 n ALA 131 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.95 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 4.27 -0.20 0.00 2.56 -1.26 -4.90 118.70 118.64 2k74 s GLU 132 Ca 0.00 2.16 -0.28 0.00 0.00 0.00 0.00 54.97 56.85 2k74 s GLU 132 Cb 0.00 -3.33 -0.05 0.00 2.00 0.00 0.00 34.13 32.75 2k74 s GLU 132 CO 0.00 -0.54 2.07 1.03 -0.56 0.00 0.00 175.26 177.25 2k74 s ARG 133 N 1.54 3.35 -0.09 4.30 3.00 -1.26 -4.78 118.95 125.02 2k74 s ARG 133 Ca 0.67 1.98 0.07 0.00 0.00 0.00 0.00 55.73 58.45 2k74 s ARG 133 Cb -0.38 -4.29 -0.10 0.00 0.00 0.00 0.00 34.95 30.18 2k74 s ARG 133 CO 0.30 -1.84 0.01 1.04 0.00 0.00 0.00 175.30 174.81 2k74 n GLN 134 N 8.45 2.29 -3.64 3.54 6.02 -1.26 -5.07 117.38 127.72 2k74 n GLN 134 Ca 0.26 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 57.19 2k74 n GLN 134 Cb 0.45 -1.22 -0.07 0.00 1.02 0.00 0.00 30.24 30.42 2k74 n GLN 134 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2k74 s TRP 135 N -2.21 -0.28 0.10 1.08 -0.00 -1.26 -5.17 118.94 111.21 2k74 s TRP 135 Ca -0.06 0.65 -0.09 0.00 -0.00 0.00 0.00 56.10 56.61 2k74 s TRP 135 Cb 0.03 0.42 -0.00 0.00 -0.00 0.00 0.00 33.47 33.92 2k74 s TRP 135 CO 0.34 -0.15 0.20 0.16 -0.00 0.00 0.00 176.95 177.50 2k74 s ASP 136 N -0.06 0.11 -0.02 5.86 1.47 -1.26 -3.54 116.67 119.23 2k74 s ASP 136 Ca 0.05 -0.70 0.07 0.00 1.18 0.00 0.00 52.55 53.14 2k74 s ASP 136 Cb -0.04 0.35 -0.02 0.00 -0.34 0.00 0.00 42.92 42.88 2k74 s ASP 136 CO -0.09 -0.76 -0.22 0.12 0.68 0.00 0.00 175.17 174.90 2k74 s PHE 137 N -3.88 2.01 -1.18 2.11 5.36 0.77 -4.62 117.98 118.54 2k74 s PHE 137 Ca 0.07 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 55.64 2k74 s PHE 137 Cb 0.05 -1.30 0.00 0.00 -0.34 0.00 0.00 43.02 41.43 2k74 s PHE 137 CO -0.09 -0.05 0.00 -0.11 -1.46 0.00 0.00 175.22 173.51 2k74 n LEU 138 N 2.58 -0.64 0.00 6.12 0.00 -1.26 0.79 117.00 124.60 2k74 n LEU 138 Ca -0.16 0.28 0.00 0.00 0.00 0.00 0.00 56.01 56.13 2k74 n LEU 138 Cb 0.52 -2.11 0.00 0.00 0.00 0.00 0.00 43.42 41.83 2k74 n LEU 138 CO 0.24 -0.76 0.00 0.61 0.00 0.00 0.00 177.39 177.48 2k74 n GLY 139 N -0.03 0.61 3.15 -3.96 0.00 -1.26 -5.06 105.19 98.64 2k74 n GLY 139 Ca -0.11 -0.77 -0.27 0.00 0.00 0.00 0.00 46.02 44.87 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 1.94 0.51 0.99 1.02 0.24 -5.07 118.68 118.31 2k74 s LEU 140 Ca 0.00 -0.37 -0.21 0.00 0.02 0.00 0.00 54.13 53.57 2k74 s LEU 140 Cb 0.00 -1.02 -0.06 0.00 0.02 0.00 0.00 46.19 45.13 2k74 s LEU 140 CO 0.00 0.17 1.15 -1.61 0.02 0.00 0.00 176.35 176.08 2k74 s GLU 141 N 0.00 3.49 0.13 1.70 2.02 -1.26 -0.17 118.70 124.61 2k74 s GLU 141 Ca -0.04 1.71 -0.32 0.00 0.02 0.00 0.00 54.97 56.34 2k74 s GLU 141 Cb -0.12 -2.17 -0.11 0.00 0.10 0.00 0.00 34.13 31.83 2k74 s GLU 141 CO 0.02 -0.76 1.53 0.52 0.02 0.00 0.00 175.26 176.60 2k74 h MET 142 N 1.54 -0.36 -0.99 1.61 2.86 -1.95 0.75 114.93 118.39 2k74 h MET 142 Ca -0.50 0.02 0.37 0.00 -2.06 0.00 0.00 59.70 57.53 2k74 h MET 142 Cb 1.26 0.08 -0.12 0.00 0.06 0.00 0.00 31.60 32.88 2k74 h MET 142 CO 0.58 -0.24 0.60 -2.30 1.06 0.00 0.00 176.91 176.61 2k74 n PRO 143 N -5.28 -0.04 -0.01 -0.22 -0.02 -1.26 0.11 135.00 128.28 2k74 n PRO 143 Ca -0.03 1.05 -0.13 0.00 -2.02 0.00 0.00 63.50 62.37 2k74 n PRO 143 Cb 0.33 -1.99 -0.10 0.00 -0.02 0.00 0.00 33.50 31.72 2k74 n PRO 143 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2k74 h GLN 144 N 0.00 -0.03 0.67 -0.52 4.20 -1.21 -2.69 115.11 115.53 2k74 h GLN 144 Ca 0.70 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.38 2k74 h GLN 144 Cb 2.10 0.01 0.01 0.00 0.30 0.00 0.00 27.48 29.89 2k74 h GLN 144 CO -0.47 0.50 -0.32 -1.49 -0.67 0.00 0.00 178.83 176.38 2k74 h TRP 145 N -0.58 -0.83 -1.29 2.96 4.06 0.11 -2.08 115.95 118.29 2k74 h TRP 145 Ca -0.00 -0.02 0.41 0.00 2.06 0.00 0.00 58.89 61.34 2k74 h TRP 145 Cb 0.54 0.28 -0.12 0.00 -1.00 0.00 0.00 29.16 28.86 2k74 h TRP 145 CO 0.11 -0.51 0.84 1.25 -3.56 0.00 0.00 178.44 176.58 2k74 h LEU 146 N -0.94 0.26 -1.15 -4.49 6.46 -0.73 3.15 115.31 117.87 2k74 h LEU 146 Ca -0.09 0.12 -0.07 0.00 -0.12 0.00 0.00 57.88 57.72 2k74 h LEU 146 Cb 0.70 0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.72 2k74 h LEU 146 CO 0.15 -0.13 -0.13 0.25 -0.62 0.00 0.00 178.44 177.96 2k74 h LEU 147 N 0.13 0.42 -0.32 2.25 5.85 -1.03 0.40 115.31 123.01 2k74 h LEU 147 Ca 0.78 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 59.39 2k74 h LEU 147 Cb 2.43 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 43.34 2k74 h LEU 147 CO -0.37 0.58 0.20 1.23 -0.34 0.00 0.00 178.44 179.74 2k74 h GLY 148 N 0.90 0.45 1.27 3.75 0.00 0.61 -1.53 103.07 108.53 2k74 h GLY 148 Ca 0.08 -0.18 -0.21 0.00 0.00 0.00 0.00 47.33 47.02 2k74 h GLY 148 CO 0.03 0.17 -0.74 -2.22 0.00 0.00 0.00 176.54 173.78 2k74 h ILE 149 N 0.42 1.30 -0.78 2.60 2.04 -1.06 -2.99 117.51 119.03 2k74 h ILE 149 Ca 0.11 -1.98 0.15 0.00 1.00 0.00 0.00 64.86 64.15 2k74 h ILE 149 Cb -0.02 1.97 -0.10 0.00 -0.74 0.00 0.00 36.82 37.93 2k74 h ILE 149 CO -0.02 0.62 0.32 0.15 0.00 0.00 0.00 178.15 179.22 2k74 h PHE 150 N 0.50 0.54 -0.40 1.37 3.57 0.12 -0.61 116.94 122.04 2k74 h PHE 150 Ca -0.04 0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.36 2k74 h PHE 150 Cb 1.36 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.97 2k74 h PHE 150 CO 0.08 0.05 -0.30 0.82 -2.23 0.00 0.00 178.31 176.72 2k74 h ILE 151 N 0.44 1.28 -0.39 1.41 2.04 -1.27 -2.65 117.51 118.37 2k74 h ILE 151 Ca 0.44 -1.47 0.05 0.00 1.00 0.00 0.00 64.86 64.88 2k74 h ILE 151 Cb 0.69 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 38.06 2k74 h ILE 151 CO -0.43 0.49 0.10 0.00 0.00 0.00 0.00 178.15 178.32 2k74 h ALA 152 N 0.79 0.44 -0.31 1.87 0.00 -0.99 0.17 119.26 121.23 2k74 h ALA 152 Ca 0.07 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2k74 h ALA 152 Cb 0.89 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2k74 h ALA 152 CO 0.08 -0.30 0.12 1.88 0.00 0.00 0.00 179.25 181.03 2k74 h TYR 153 N 0.24 0.47 -0.88 0.00 -1.99 -1.29 -0.58 116.97 112.94 2k74 h TYR 153 Ca 0.19 -0.04 -0.02 0.00 2.00 0.00 0.00 58.73 60.86 2k74 h TYR 153 Cb 0.20 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 38.75 2k74 h TYR 153 CO -0.18 0.45 0.47 -0.07 -0.00 0.00 0.00 178.16 178.84 2k74 h LEU 154 N 0.34 1.11 -0.45 3.88 3.38 -1.08 -2.67 115.31 119.82 2k74 h LEU 154 Ca 0.10 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2k74 h LEU 154 Cb 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2k74 h LEU 154 CO -0.01 0.89 -0.24 0.40 0.09 0.00 0.00 178.44 179.58 2k74 h ILE 155 N 1.23 1.27 -0.80 1.22 5.03 -0.49 -2.83 117.51 122.15 2k74 h ILE 155 Ca 0.31 -1.40 0.14 0.00 -0.12 0.00 0.00 64.86 63.78 2k74 h ILE 155 Cb 0.04 1.20 -0.09 0.00 -3.03 0.00 0.00 36.82 34.94 2k74 h ILE 155 CO -0.05 0.48 0.39 0.58 -0.68 0.00 0.00 178.15 178.87 2k74 h VAL 156 N 0.80 0.73 -0.30 1.67 2.07 -0.76 -1.29 116.25 119.17 2k74 h VAL 156 Ca 0.10 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.38 2k74 h VAL 156 Cb 0.82 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 2k74 h VAL 156 CO 0.07 0.10 0.02 0.00 0.02 0.00 0.00 177.57 177.78 2k74 h ALA 157 N 1.53 0.40 -1.04 1.67 0.00 -1.39 -2.06 119.26 118.37 2k74 h ALA 157 Ca 0.43 -0.22 0.27 0.00 0.00 0.00 0.00 54.91 55.39 2k74 h ALA 157 Cb 0.59 -0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.17 2k74 h ALA 157 CO -0.36 0.12 0.66 0.28 0.00 0.00 0.00 179.25 179.96 2k74 h VAL 158 N 0.32 0.52 0.08 0.00 2.07 -1.00 0.76 116.25 118.99 2k74 h VAL 158 Ca 0.09 -0.14 -0.26 0.00 0.82 0.00 0.00 66.70 67.21 2k74 h VAL 158 Cb 0.40 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 2k74 h VAL 158 CO 0.01 0.07 -1.22 -0.07 0.02 0.00 0.00 177.57 176.38 2k74 h LEU 159 N 0.41 0.25 -0.44 2.57 3.38 -1.23 -2.97 115.31 117.28 2k74 h LEU 159 Ca 0.60 -0.29 -0.10 0.00 0.09 0.00 0.00 57.88 58.18 2k74 h LEU 159 Cb 1.49 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.15 2k74 h LEU 159 CO -0.32 1.23 -0.50 0.58 0.09 0.00 0.00 178.44 179.53 2k74 h VAL 160 N 0.04 0.96 0.01 1.22 2.07 0.15 -2.31 116.25 118.40 2k74 h VAL 160 Ca -0.11 -2.02 -0.00 0.00 0.82 0.00 0.00 66.70 65.39 2k74 h VAL 160 Cb 1.91 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 33.92 2k74 h VAL 160 CO 0.17 0.49 -0.01 0.58 0.02 0.00 0.00 177.57 178.82 2k74 h VAL 161 N 0.00 1.54 0.00 2.57 2.07 0.28 -3.22 116.25 119.48 2k74 h VAL 161 Ca -0.00 -1.78 -0.02 0.00 0.82 0.00 0.00 66.70 65.72 2k74 h VAL 161 Cb 1.20 2.72 -0.00 0.00 -1.52 0.00 0.00 31.29 33.68 2k74 h VAL 161 CO 0.06 0.45 -0.07 0.16 0.02 0.00 0.00 177.57 178.19 2k74 h ILE 162 N -0.80 0.32 0.00 4.57 -0.00 -1.59 -2.67 117.51 117.34 2k74 h ILE 162 Ca -0.00 -0.47 0.00 0.00 -0.00 0.00 0.00 64.86 64.39 2k74 h ILE 162 Cb 0.75 1.35 0.00 0.00 -0.00 0.00 0.00 36.82 38.92 2k74 h ILE 162 CO 0.00 0.07 0.07 -1.54 -0.00 0.00 0.00 178.15 176.76 2k74 n SER 163 N -3.38 0.00 -4.44 2.16 3.41 -0.87 -4.43 113.62 106.07 2k74 n SER 163 Ca -0.01 0.17 -0.30 0.00 -0.26 0.00 0.00 58.87 58.47 2k74 n SER 163 Cb 0.24 -0.17 -0.12 0.00 -0.26 0.00 0.00 64.21 63.89 2k74 n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k74 s GLN 164 N -2.19 1.76 -0.22 4.33 1.03 -1.01 -5.02 119.66 118.35 2k74 s GLN 164 Ca 0.00 -1.17 -0.04 0.00 0.04 0.00 0.00 55.36 54.20 2k74 s GLN 164 Cb 0.00 -2.06 -0.12 0.00 0.03 0.00 0.00 33.01 30.86 2k74 s GLN 164 CO 0.00 0.49 2.14 -0.35 -2.54 0.00 0.00 175.29 175.03 2k74 n PRO 165 N 1.11 1.29 0.00 9.60 -0.04 -1.26 -4.88 135.00 140.82 2k74 n PRO 165 Ca -0.16 -0.75 0.00 0.00 -0.04 0.00 0.00 63.50 62.54 2k74 n PRO 165 Cb 0.53 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 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 3.11 0.00 -3.11 0.54 7.35 -1.26 -4.15 117.46 119.94 2k74 n PHE 166 Ca 0.28 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 57.01 2k74 n PHE 166 Cb 0.40 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 40.23 2k74 n PHE 166 CO 0.00 0.00 0.00 0.21 -0.76 0.00 0.00 176.76 176.21 2k74 s LYS 167 N 0.00 0.31 -0.03 -4.13 2.20 -1.26 -5.06 119.74 111.78 2k74 s LYS 167 Ca 0.00 0.21 -0.21 0.00 -0.36 0.00 0.00 55.97 55.61 2k74 s LYS 167 Cb 0.00 0.11 -0.14 0.00 -1.51 0.00 0.00 37.83 36.30 2k74 s LYS 167 CO 0.00 -0.55 0.91 0.00 -0.36 0.00 0.00 175.35 175.35 2k74 h ALA 168 N 7.25 -0.44 0.00 3.13 0.00 -2.03 -3.45 119.26 123.72 2k74 h ALA 168 Ca -0.05 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2k74 h ALA 168 Cb 1.19 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 2k74 h ALA 168 CO -0.01 -0.48 -0.00 0.36 0.00 0.00 0.00 179.25 179.11 2k74 n LYS 169 N -5.09 0.00 -2.65 0.00 2.85 -1.26 -5.08 118.16 106.94 2k74 n LYS 169 Ca -0.08 -0.02 -0.42 0.00 -1.05 0.00 0.00 58.31 56.74 2k74 n LYS 169 Cb 0.26 0.19 -0.02 0.00 -0.65 0.00 0.00 35.03 34.81 2k74 n LYS 169 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 2k74 s LYS 170 N 0.00 3.70 -0.16 -1.58 2.47 -1.26 -4.97 119.74 117.93 2k74 s LYS 170 Ca 0.00 -1.48 -0.16 0.00 -1.56 0.00 0.00 55.97 52.77 2k74 s LYS 170 Cb 0.00 -5.30 -0.04 0.00 -1.46 0.00 0.00 37.83 31.02 2k74 s LYS 170 CO 0.00 -2.12 0.40 1.03 0.16 0.00 0.00 175.35 174.82 2k74 s ARG 171 N 4.26 4.26 0.77 4.03 0.52 -1.26 -5.06 118.95 126.46 2k74 s ARG 171 Ca 0.45 0.26 -0.12 0.00 -0.52 0.00 0.00 55.73 55.80 2k74 s ARG 171 Cb -0.00 -3.47 0.06 0.00 0.52 0.00 0.00 34.95 32.06 2k74 s ARG 171 CO -0.06 0.11 1.14 -0.51 0.02 0.00 0.00 175.30 176.00 2k74 s ASP 172 N 0.73 4.16 0.84 0.23 1.01 -1.26 -5.02 116.67 117.36 2k74 s ASP 172 Ca 0.21 2.08 0.00 0.00 0.71 0.00 0.00 52.55 55.55 2k74 s ASP 172 Cb -0.14 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.23 2k74 s ASP 172 CO 0.07 -2.27 0.00 0.18 0.21 0.00 0.00 175.17 173.36 2k74 n LEU 173 N -3.28 0.00 -4.26 1.23 4.77 -1.26 -5.05 117.00 109.15 2k74 n LEU 173 Ca 0.11 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.82 2k74 n LEU 173 Cb 0.52 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.46 2k74 n LEU 173 CO 0.50 -1.24 -0.53 -0.36 -1.33 0.00 0.00 177.39 174.42 2k74 s PHE 174 N -0.84 1.93 0.00 -1.77 0.08 -1.26 -5.13 117.98 110.99 2k74 s PHE 174 Ca 0.00 -0.38 0.00 0.00 0.12 0.00 0.00 56.93 56.67 2k74 s PHE 174 Cb 0.00 -1.17 0.00 0.00 -0.57 0.00 0.00 43.02 41.28 2k74 s PHE 174 CO 0.00 0.07 0.00 0.41 -0.10 0.00 0.00 175.22 175.60 2k74 n GLY 175 N 1.98 0.76 1.20 4.36 0.00 -1.26 -5.04 105.19 107.19 2k74 n GLY 175 Ca -0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.99 2k74 n GLY 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k74 n ARG 176 N 0.00 -2.29 -0.97 1.61 1.74 -1.26 -4.79 116.66 110.70 2k74 n ARG 176 Ca 0.00 1.71 0.00 0.00 -0.77 0.00 0.00 57.85 58.79 2k74 n ARG 176 Cb 0.00 -2.87 0.00 0.00 -1.02 0.00 0.00 32.46 28.57 2k74 n ARG 176 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k74 n GLY 177 N -3.68 0.43 3.61 -0.13 0.00 -1.26 -3.28 105.19 100.88 2k74 n GLY 177 Ca -0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 2k74 n GLY 177 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2k74 n HIS 178 N -2.55 -2.64 -1.73 1.61 8.25 -1.26 -4.89 115.22 112.00 2k74 n HIS 178 Ca 0.00 0.98 -0.42 0.00 -0.26 0.00 0.00 57.72 58.02 2k74 n HIS 178 Cb 0.11 -4.90 -0.02 0.00 1.12 0.00 0.00 29.99 26.30 2k74 n HIS 178 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k74 n HIS 179 N -4.77 2.76 -0.06 4.41 -0.00 -1.20 -4.93 115.22 111.42 2k74 n HIS 179 Ca -0.06 0.15 -0.07 0.00 -0.00 0.00 0.00 57.72 57.75 2k74 n HIS 179 Cb 0.58 -2.63 -0.05 0.00 -0.00 0.00 0.00 29.99 27.89 2k74 n HIS 179 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2k74 h HIS 180 N 5.79 0.00 -3.39 1.57 2.76 -1.95 -3.50 115.15 116.44 2k74 h HIS 180 Ca -0.45 0.00 0.02 0.00 -2.20 0.00 0.00 60.37 57.74 2k74 h HIS 180 Cb 1.22 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.16 2k74 h HIS 180 CO 0.61 0.44 -0.90 1.58 -1.30 0.00 0.00 177.93 178.36 2k74 n HIS 181 N -4.67 -3.89 -3.48 5.26 -0.00 -1.26 -4.87 115.22 102.31 2k74 n HIS 181 Ca -0.07 2.11 -0.18 0.00 -0.00 0.00 0.00 57.72 59.58 2k74 n HIS 181 Cb 0.25 -3.33 0.02 0.00 -0.00 0.00 0.00 29.99 26.93 2k74 n HIS 181 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2k74 n HIS 182 N -2.63 -2.34 1.38 1.57 -0.00 -1.26 -5.32 115.22 106.63 2k74 n HIS 182 Ca -0.01 0.81 0.11 0.00 -0.00 0.00 0.00 57.72 58.63 2k74 n HIS 182 Cb 0.46 -3.52 0.66 0.00 -0.00 0.00 0.00 29.99 27.58 2k74 n HIS 182 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95