#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 0.82 -0.95 4.03 3.38 -2.06 -2.53 115.31 118.00 2k74 h LEU 2 Ca 0.00 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.82 2k74 h LEU 2 Cb 0.00 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.48 2k74 h LEU 2 CO 0.00 0.85 0.62 0.08 0.09 0.00 0.00 178.44 180.08 2k74 h ARG 3 N 0.81 1.17 -0.26 1.13 0.11 -2.00 -2.18 114.38 113.16 2k74 h ARG 3 Ca 0.16 -0.07 0.01 0.00 0.10 0.00 0.00 59.98 60.18 2k74 h ARG 3 Cb 0.41 -0.26 -0.02 0.00 1.11 0.00 0.00 29.97 31.21 2k74 h ARG 3 CO 0.01 0.77 0.15 0.35 0.10 0.00 0.00 179.97 181.36 2k74 h PHE 4 N 1.20 0.28 -0.99 4.08 3.57 -1.90 -1.78 116.94 121.42 2k74 h PHE 4 Ca 0.38 0.01 0.20 0.00 3.53 0.00 0.00 57.97 62.09 2k74 h PHE 4 Cb -0.00 -0.09 -0.10 0.00 2.79 0.00 0.00 35.95 38.55 2k74 h PHE 4 CO -0.01 0.17 0.62 -0.07 -2.23 0.00 0.00 178.31 176.79 2k74 h LEU 5 N 0.31 0.69 -1.07 0.59 3.38 -1.21 0.62 115.31 118.62 2k74 h LEU 5 Ca 0.10 0.08 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 2k74 h LEU 5 Cb -0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2k74 h LEU 5 CO -0.05 0.24 -0.40 -1.13 0.09 0.00 0.00 178.44 177.19 2k74 h ASN 6 N 0.67 0.13 0.01 -0.43 -1.24 -1.06 -0.26 115.58 113.40 2k74 h ASN 6 Ca 0.56 -0.05 -0.00 0.00 0.71 0.00 0.00 56.30 57.52 2k74 h ASN 6 Cb 1.01 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 40.02 2k74 h ASN 6 CO -0.33 0.52 -0.01 -0.61 -1.29 0.00 0.00 177.43 175.71 2k74 h GLN 7 N 0.11 -0.02 -0.43 6.67 4.15 0.62 -0.78 115.11 125.43 2k74 h GLN 7 Ca 0.01 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.41 2k74 h GLN 7 Cb 0.75 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.43 2k74 h GLN 7 CO 0.06 0.76 0.17 0.00 -1.93 0.00 0.00 178.83 177.88 2k74 h ALA 8 N 0.03 1.49 0.05 3.38 0.00 -0.42 -2.55 119.26 121.25 2k74 h ALA 8 Ca -0.00 -0.12 -0.26 0.00 0.00 0.00 0.00 54.91 54.52 2k74 h ALA 8 Cb 0.79 -0.18 0.02 0.00 0.00 0.00 0.00 17.79 18.41 2k74 h ALA 8 CO 0.00 0.39 -1.10 0.66 0.00 0.00 0.00 179.25 179.21 2k74 h SER 9 N 0.61 0.72 0.00 0.00 4.64 -1.12 -3.06 113.55 115.34 2k74 h SER 9 Ca 0.15 -0.62 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2k74 h SER 9 Cb 0.13 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 2k74 h SER 9 CO -0.01 1.43 0.00 0.00 -0.87 0.00 0.00 176.83 177.38 2k74 n GLN 10 N -3.76 0.38 -3.82 4.77 1.13 -0.30 -4.64 117.38 111.13 2k74 n GLN 10 Ca -0.10 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.63 2k74 n GLN 10 Cb 0.92 -1.40 -0.05 0.00 0.11 0.00 0.00 30.24 29.82 2k74 n GLN 10 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2k74 s GLY 11 N -1.92 2.21 -0.04 1.08 0.00 -1.12 -4.97 107.32 102.56 2k74 s GLY 11 Ca 0.14 -0.69 -0.26 0.00 0.00 0.00 0.00 44.72 43.91 2k74 s GLY 11 CO 0.11 -0.59 1.18 -0.09 0.00 0.00 0.00 173.10 173.71 2k74 h ARG 12 N 3.47 0.03 -0.93 2.90 2.43 -1.87 -2.95 114.38 117.47 2k74 h ARG 12 Ca -0.48 -0.02 0.26 0.00 -0.81 0.00 0.00 59.98 58.94 2k74 h ARG 12 Cb 1.18 0.00 -0.16 0.00 -0.42 0.00 0.00 29.97 30.57 2k74 h ARG 12 CO 0.71 0.61 0.17 0.78 -1.51 0.00 0.00 179.97 180.73 2k74 h GLY 13 N -0.55 1.38 0.92 2.80 0.00 -1.95 0.75 103.07 106.41 2k74 h GLY 13 Ca -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 2k74 h GLY 13 CO 0.00 -0.47 0.11 0.00 0.00 0.00 0.00 176.54 176.18 2k74 h ALA 14 N 1.88 0.31 -0.88 3.60 0.00 -1.77 -0.91 119.26 121.49 2k74 h ALA 14 Ca 0.59 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.44 2k74 h ALA 14 Cb 1.25 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 2k74 h ALA 14 CO -0.78 -0.12 0.56 -1.49 0.00 0.00 0.00 179.25 177.43 2k74 h TRP 15 N 0.24 1.06 0.00 0.00 4.06 0.47 0.22 115.95 122.00 2k74 h TRP 15 Ca 0.08 0.03 -0.05 0.00 2.06 0.00 0.00 58.89 61.01 2k74 h TRP 15 Cb 0.14 -0.35 -0.01 0.00 -1.00 0.00 0.00 29.16 27.94 2k74 h TRP 15 CO -0.02 0.60 -0.22 1.25 -3.56 0.00 0.00 178.44 176.49 2k74 h LEU 16 N 1.08 0.00 -0.92 -4.49 6.46 -0.06 -1.84 115.31 115.54 2k74 h LEU 16 Ca 0.36 0.00 -0.11 0.00 -0.12 0.00 0.00 57.88 58.00 2k74 h LEU 16 Cb 0.04 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 39.95 2k74 h LEU 16 CO -0.13 0.22 -0.52 -0.07 -0.62 0.00 0.00 178.44 177.32 2k74 h LEU 17 N 0.00 0.05 -0.52 2.25 -0.00 0.44 -1.91 115.31 115.62 2k74 h LEU 17 Ca -0.00 -0.02 -0.16 0.00 -0.00 0.00 0.00 57.88 57.69 2k74 h LEU 17 Cb 0.42 -0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 41.05 2k74 h LEU 17 CO 0.03 0.56 -0.69 0.24 -0.00 0.00 0.00 178.44 178.58 2k74 h MET 18 N 0.03 0.25 0.28 1.13 2.86 -0.66 -2.87 114.93 115.95 2k74 h MET 18 Ca -0.00 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.42 2k74 h MET 18 Cb 0.94 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.64 2k74 h MET 18 CO 0.07 0.84 -0.13 0.00 1.06 0.00 0.00 176.91 178.75 2k74 h ALA 19 N 1.10 -0.37 -0.97 6.32 0.00 -1.23 -2.44 119.26 121.67 2k74 h ALA 19 Ca -0.02 -0.19 0.25 0.00 0.00 0.00 0.00 54.91 54.95 2k74 h ALA 19 Cb 1.23 0.14 -0.13 0.00 0.00 0.00 0.00 17.79 19.04 2k74 h ALA 19 CO 0.11 -0.44 0.53 0.35 0.00 0.00 0.00 179.25 179.80 2k74 h PHE 20 N -0.92 0.89 0.01 0.00 3.57 -1.43 0.10 116.94 119.18 2k74 h PHE 20 Ca -0.04 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 2k74 h PHE 20 Cb 0.50 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.00 2k74 h PHE 20 CO 0.05 0.01 -0.01 1.79 -2.23 0.00 0.00 178.31 177.92 2k74 h THR 21 N 0.50 1.13 -0.65 4.41 1.35 -1.51 0.54 112.91 118.68 2k74 h THR 21 Ca 0.63 -0.43 0.07 0.00 -0.55 0.00 0.00 66.41 66.13 2k74 h THR 21 Cb 1.22 1.42 -0.04 0.00 -1.73 0.00 0.00 68.15 69.02 2k74 h THR 21 CO -0.51 0.11 0.43 0.00 -0.25 0.00 0.00 175.52 175.31 2k74 h ALA 22 N 0.78 1.82 0.13 6.62 0.00 -0.39 -1.51 119.26 126.71 2k74 h ALA 22 Ca -0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.61 2k74 h ALA 22 Cb 0.20 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 17.86 2k74 h ALA 22 CO 0.00 0.06 -1.24 1.25 0.00 0.00 0.00 179.25 179.32 2k74 h LEU 23 N 0.61 0.64 -1.31 0.00 6.46 -0.59 -3.17 115.31 117.95 2k74 h LEU 23 Ca 0.29 -0.63 0.15 0.00 -0.12 0.00 0.00 57.88 57.57 2k74 h LEU 23 Cb 0.35 -0.20 -0.07 0.00 -0.73 0.00 0.00 40.66 40.01 2k74 h LEU 23 CO -0.09 1.47 0.57 0.00 -0.62 0.00 0.00 178.44 179.77 2k74 h ALA 24 N 0.45 1.86 -0.12 1.25 0.00 0.11 0.13 119.26 122.95 2k74 h ALA 24 Ca -0.16 0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.55 2k74 h ALA 24 Cb 1.93 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.61 2k74 h ALA 24 CO 0.22 -0.11 -0.77 -0.07 0.00 0.00 0.00 179.25 178.53 2k74 h LEU 25 N 0.66 0.76 -0.43 0.00 4.07 -1.50 -1.69 115.31 117.18 2k74 h LEU 25 Ca 0.45 -0.50 -0.06 0.00 0.08 0.00 0.00 57.88 57.85 2k74 h LEU 25 Cb 0.75 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.25 2k74 h LEU 25 CO -0.20 1.28 0.05 -0.08 -1.08 0.00 0.00 178.44 178.41 2k74 h GLU 26 N 0.43 0.73 -0.10 1.13 4.81 -1.03 -1.72 114.58 118.83 2k74 h GLU 26 Ca -0.05 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 58.96 2k74 h GLU 26 Cb 1.38 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.67 2k74 h GLU 26 CO 0.15 0.77 -0.01 1.25 -0.73 0.00 0.00 179.01 180.43 2k74 h LEU 27 N 0.58 0.18 -0.94 1.64 5.85 -0.85 -0.49 115.31 121.27 2k74 h LEU 27 Ca 0.13 -0.35 0.12 0.00 0.84 0.00 0.00 57.88 58.62 2k74 h LEU 27 Cb 0.41 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.31 2k74 h LEU 27 CO 0.01 0.48 0.57 0.71 -0.34 0.00 0.00 178.44 179.87 2k74 h THR 28 N -0.13 0.89 -0.13 1.05 1.35 -1.26 -1.00 112.91 113.68 2k74 h THR 28 Ca 0.03 -0.31 -0.19 0.00 -0.55 0.00 0.00 66.41 65.39 2k74 h THR 28 Cb 0.40 -0.08 -0.00 0.00 -1.73 0.00 0.00 68.15 66.74 2k74 h THR 28 CO 0.01 0.16 -0.69 0.00 -0.25 0.00 0.00 175.52 174.76 2k74 h ALA 29 N 1.52 0.55 0.00 6.62 0.00 -1.19 -2.73 119.26 124.02 2k74 h ALA 29 Ca 0.47 -0.58 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2k74 h ALA 29 Cb 0.48 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2k74 h ALA 29 CO -0.27 0.72 -0.00 1.25 0.00 0.00 0.00 179.25 180.94 2k74 h LEU 30 N 0.40 0.00 0.13 0.00 5.85 0.23 -2.15 115.31 119.77 2k74 h LEU 30 Ca -0.02 0.00 -0.36 0.00 0.84 0.00 0.00 57.88 58.34 2k74 h LEU 30 Cb 1.27 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2k74 h LEU 30 CO 0.13 0.00 -1.91 -0.25 -0.34 0.00 0.00 178.44 176.07 2k74 h TRP 31 N 0.00 0.52 -0.81 1.25 7.01 -1.18 -3.16 115.95 119.57 2k74 h TRP 31 Ca -0.00 -0.38 0.16 0.00 2.11 0.00 0.00 58.89 60.78 2k74 h TRP 31 Cb 0.08 -0.02 -0.10 0.00 -2.10 0.00 0.00 29.16 27.02 2k74 h TRP 31 CO 0.00 1.71 0.35 0.35 -2.79 0.00 0.00 178.44 178.06 2k74 h PHE 32 N 0.08 0.59 0.00 2.65 3.57 -1.09 0.41 116.94 123.15 2k74 h PHE 32 Ca -0.39 0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.01 2k74 h PHE 32 Cb 2.05 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 40.63 2k74 h PHE 32 CO 0.08 0.06 -0.65 0.37 -2.23 0.00 0.00 178.31 175.94 2k74 h GLN 33 N 0.47 0.00 0.00 1.11 -0.00 -1.67 1.08 115.11 116.10 2k74 h GLN 33 Ca 0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 59.06 2k74 h GLN 33 Cb 0.74 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.21 2k74 h GLN 33 CO -0.43 0.65 -0.22 1.25 0.00 0.00 0.00 178.83 180.08 2k74 h HIS 34 N 0.00 0.00 0.00 3.99 2.76 -0.23 -0.83 115.15 120.84 2k74 h HIS 34 Ca -0.01 0.00 -0.17 0.00 -2.20 0.00 0.00 60.37 58.00 2k74 h HIS 34 Cb 1.18 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.12 2k74 h HIS 34 CO 0.00 0.22 -1.40 0.28 -1.30 0.00 0.00 177.93 175.73 2k74 n VAL 35 N -3.74 1.01 1.27 5.26 0.31 -0.13 -4.55 118.33 117.75 2k74 n VAL 35 Ca -0.01 -0.05 0.09 0.00 -0.01 0.00 0.00 64.34 64.36 2k74 n VAL 35 Cb 0.33 -1.80 0.53 0.00 -0.91 0.00 0.00 33.84 31.99 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 -3.78 0.63 -4.12 5.55 2.81 0.37 -4.85 117.12 113.74 2k74 n MET 36 Ca -0.22 0.00 -0.34 0.00 -1.81 0.00 0.00 57.70 55.33 2k74 n MET 36 Cb 0.57 -1.44 -0.01 0.00 -0.71 0.00 0.00 33.22 31.62 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 -0.94 -1.98 -4.79 4.03 4.77 -0.32 -4.90 117.00 112.86 2k74 n LEU 37 Ca 0.13 -0.95 -0.35 0.00 -0.03 0.00 0.00 56.01 54.81 2k74 n LEU 37 Cb 0.06 -2.22 -0.04 0.00 -2.33 0.00 0.00 43.42 38.89 2k74 n LEU 37 CO 0.10 0.35 0.71 -0.22 -1.33 0.00 0.00 177.39 177.00 2k74 s LEU 38 N -7.24 4.03 -0.17 2.23 2.96 -1.18 -5.02 118.68 114.30 2k74 s LEU 38 Ca 0.63 1.94 -0.02 0.00 -0.22 0.00 0.00 54.13 56.45 2k74 s LEU 38 Cb -0.34 -4.34 -0.02 0.00 0.50 0.00 0.00 46.19 41.99 2k74 s LEU 38 CO 0.90 -0.53 -0.07 -0.54 -1.32 0.00 0.00 176.35 174.79 2k74 s LYS 39 N -2.79 3.49 0.56 1.98 1.02 -1.26 -4.75 119.74 117.98 2k74 s LYS 39 Ca 0.61 -0.61 -0.16 0.00 0.02 0.00 0.00 55.97 55.83 2k74 s LYS 39 Cb -0.18 -2.84 -0.06 0.00 -0.52 0.00 0.00 37.83 34.23 2k74 s LYS 39 CO 0.23 0.10 1.02 -1.25 -0.92 0.00 0.00 175.35 174.53 2k74 s PRO 40 N 0.69 3.62 0.11 -1.68 0.04 -1.25 -4.85 135.00 131.67 2k74 s PRO 40 Ca -0.04 1.08 0.00 0.00 0.04 0.00 0.00 61.00 62.08 2k74 s PRO 40 Cb -0.15 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2k74 s PRO 40 CO 0.02 -0.55 0.02 0.00 0.04 0.00 0.00 177.00 176.53 2k74 h VAL 42 N 0.95 1.19 0.01 0.00 2.07 -1.88 -1.99 116.25 116.60 2k74 h VAL 42 Ca -0.08 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 2k74 h VAL 42 Cb 0.26 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 2k74 h VAL 42 CO 0.14 0.18 -0.00 -0.07 0.02 0.00 0.00 177.57 177.83 2k74 h LEU 43 N 0.05 -0.01 -0.41 2.57 3.38 -1.97 -0.67 115.31 118.25 2k74 h LEU 43 Ca 0.05 -0.19 0.08 0.00 0.09 0.00 0.00 57.88 57.90 2k74 h LEU 43 Cb 0.24 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 2k74 h LEU 43 CO -0.00 0.18 -0.01 0.77 0.09 0.00 0.00 178.44 179.47 2k74 h SER 44 N -0.20 -0.20 -0.44 -0.43 4.64 -1.96 0.29 113.55 115.25 2k74 h SER 44 Ca -0.00 0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 2k74 h SER 44 Cb 0.20 0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 2k74 h SER 44 CO 0.00 -0.06 0.25 0.40 -0.87 0.00 0.00 176.83 176.55 2k74 h ILE 45 N 0.09 1.15 -0.44 0.95 1.08 -1.28 -0.83 117.51 118.24 2k74 h ILE 45 Ca 0.20 -0.38 0.03 0.00 -0.39 0.00 0.00 64.86 64.32 2k74 h ILE 45 Cb 0.30 0.60 -0.03 0.00 -3.07 0.00 0.00 36.82 34.62 2k74 h ILE 45 CO -0.35 0.16 0.24 0.22 -0.69 0.00 0.00 178.15 177.73 2k74 h TYR 46 N 0.58 0.45 -0.80 1.37 5.03 -0.08 -0.98 116.97 122.54 2k74 h TYR 46 Ca 0.16 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.48 2k74 h TYR 46 Cb 0.03 -0.14 -0.04 0.00 1.55 0.00 0.00 36.73 38.13 2k74 h TYR 46 CO -0.03 0.25 0.48 0.93 -1.32 0.00 0.00 178.16 178.48 2k74 h GLU 47 N 0.49 1.08 -0.46 1.82 4.39 -0.12 -1.59 114.58 120.19 2k74 h GLU 47 Ca 0.18 -0.09 -0.06 0.00 0.34 0.00 0.00 59.36 59.72 2k74 h GLU 47 Cb 0.05 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 2k74 h GLU 47 CO -0.10 0.76 0.03 -0.09 -1.16 0.00 0.00 179.01 178.44 2k74 h ARG 48 N 1.10 0.73 -0.49 2.33 2.43 -0.31 -2.64 114.38 117.54 2k74 h ARG 48 Ca 0.29 -0.18 -0.12 0.00 -0.81 0.00 0.00 59.98 59.16 2k74 h ARG 48 Cb -0.05 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 2k74 h ARG 48 CO -0.05 0.73 -0.18 0.00 -1.51 0.00 0.00 179.97 178.96 2k74 h ALA 49 N 1.34 0.76 -0.40 2.80 0.00 -0.32 0.37 119.26 123.81 2k74 h ALA 49 Ca 0.14 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.74 2k74 h ALA 49 Cb 0.39 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 2k74 h ALA 49 CO 0.01 0.67 0.08 0.00 0.00 0.00 0.00 179.25 180.01 2k74 h ALA 50 N 0.94 0.43 0.00 0.00 0.00 -0.96 0.14 119.26 119.81 2k74 h ALA 50 Ca 0.12 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2k74 h ALA 50 Cb 0.74 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2k74 h ALA 50 CO 0.06 -0.32 -0.05 1.25 0.00 0.00 0.00 179.25 180.19 2k74 h LEU 51 N 0.21 0.04 -1.20 0.00 6.46 -1.41 -2.80 115.31 116.60 2k74 h LEU 51 Ca 0.19 -0.84 0.31 0.00 -0.12 0.00 0.00 57.88 57.43 2k74 h LEU 51 Cb 0.22 -0.01 -0.12 0.00 -0.73 0.00 0.00 40.66 40.02 2k74 h LEU 51 CO -0.25 0.87 0.66 0.15 -0.62 0.00 0.00 178.44 179.25 2k74 h PHE 52 N -0.79 0.78 -0.30 1.25 3.57 -0.11 0.73 116.94 122.07 2k74 h PHE 52 Ca -0.01 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 2k74 h PHE 52 Cb 0.88 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 2k74 h PHE 52 CO 0.22 -0.06 -0.10 0.78 -2.23 0.00 0.00 178.31 176.92 2k74 h GLY 53 N 0.35 0.64 0.86 2.40 0.00 -0.73 -2.93 103.07 103.67 2k74 h GLY 53 Ca 0.69 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 47.46 2k74 h GLY 53 CO -0.44 0.50 0.06 -2.08 0.00 0.00 0.00 176.54 174.57 2k74 h VAL 54 N 0.35 1.18 -0.83 4.60 2.07 0.48 -2.18 116.25 121.92 2k74 h VAL 54 Ca 0.07 -0.56 0.19 0.00 0.82 0.00 0.00 66.70 67.22 2k74 h VAL 54 Cb 0.59 1.22 -0.15 0.00 -1.52 0.00 0.00 31.29 31.43 2k74 h VAL 54 CO 0.03 0.18 -0.10 0.25 0.02 0.00 0.00 177.57 177.95 2k74 h LEU 55 N 0.12 -0.58 -0.19 2.57 6.46 -0.14 0.66 115.31 124.20 2k74 h LEU 55 Ca 0.06 0.24 0.01 0.00 -0.12 0.00 0.00 57.88 58.06 2k74 h LEU 55 Cb 0.22 0.45 -0.01 0.00 -0.73 0.00 0.00 40.66 40.59 2k74 h LEU 55 CO -0.00 -0.26 0.11 1.23 -0.62 0.00 0.00 178.44 178.91 2k74 h GLY 56 N 0.04 0.26 0.20 3.75 0.00 -1.30 -1.24 103.07 104.79 2k74 h GLY 56 Ca 0.44 -0.09 0.24 0.00 0.00 0.00 0.00 47.33 47.92 2k74 h GLY 56 CO -0.80 0.08 0.63 0.00 0.00 0.00 0.00 176.54 176.45 2k74 h ALA 57 N 1.08 2.48 -0.25 3.60 0.00 0.84 0.49 119.26 127.51 2k74 h ALA 57 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 2k74 h ALA 57 Cb -0.01 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2k74 h ALA 57 CO -0.03 -0.77 -0.35 0.00 0.00 0.00 0.00 179.25 178.09 2k74 h ALA 58 N 1.59 0.93 -0.37 0.00 0.00 0.30 0.37 119.26 122.07 2k74 h ALA 58 Ca 0.47 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 2k74 h ALA 58 Cb 1.45 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2k74 h ALA 58 CO -0.12 0.62 -0.24 -0.07 0.00 0.00 0.00 179.25 179.44 2k74 h LEU 59 N 0.46 0.76 -0.04 0.00 4.07 0.27 -0.25 115.31 120.58 2k74 h LEU 59 Ca 0.05 -0.28 -0.25 0.00 0.08 0.00 0.00 57.88 57.48 2k74 h LEU 59 Cb 0.83 -0.21 0.02 0.00 1.08 0.00 0.00 40.66 42.38 2k74 h LEU 59 CO 0.07 0.97 -0.94 0.40 -1.08 0.00 0.00 178.44 177.85 2k74 h ILE 60 N 0.65 1.29 0.00 1.22 5.03 -1.16 -3.19 117.51 121.35 2k74 h ILE 60 Ca 0.09 -2.16 -0.07 0.00 -0.12 0.00 0.00 64.86 62.60 2k74 h ILE 60 Cb 0.74 2.29 -0.01 0.00 -3.03 0.00 0.00 36.82 36.81 2k74 h ILE 60 CO 0.06 0.67 -0.35 1.23 -0.68 0.00 0.00 178.15 179.08 2k74 h GLY 61 N 0.40 0.00 0.22 5.37 0.00 -0.83 -2.05 103.07 106.18 2k74 h GLY 61 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.22 2k74 h GLY 61 CO 0.19 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.73 2k74 n ALA 62 N -2.41 2.34 0.06 3.60 0.00 -0.11 -2.91 120.51 121.07 2k74 n ALA 62 Ca -0.02 -0.04 -0.11 0.00 0.00 0.00 0.00 53.44 53.27 2k74 n ALA 62 Cb 0.41 -1.09 -0.13 0.00 0.00 0.00 0.00 19.45 18.63 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 1.40 0.00 0.00 2.04 -1.45 -3.45 117.51 116.05 2k74 h ILE 63 Ca 0.00 -3.09 0.00 0.00 1.00 0.00 0.00 64.86 62.77 2k74 h ILE 63 Cb 0.00 2.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.86 2k74 h ILE 63 CO 0.00 0.85 0.00 0.00 0.00 0.00 0.00 178.15 179.00 2k74 n ALA 64 N -2.50 0.00 0.69 1.87 0.00 -1.16 -5.01 120.51 114.40 2k74 n ALA 64 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2k74 n ALA 64 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.45 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 0.69 0.00 0.00 -0.04 -1.15 -2.46 135.00 132.04 2k74 n PRO 65 Ca 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.50 2k74 n PRO 65 Cb 0.00 -1.26 -0.03 0.00 -0.04 0.00 0.00 33.50 32.18 2k74 n PRO 65 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k74 n LYS 66 N 0.39 3.23 -4.24 0.54 5.02 -1.26 -4.86 118.16 116.97 2k74 n LYS 66 Ca 0.00 -0.26 -0.23 0.00 -2.02 0.00 0.00 58.31 55.79 2k74 n LYS 66 Cb 0.25 -0.98 -0.07 0.00 -0.02 0.00 0.00 35.03 34.21 2k74 n LYS 66 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2k74 s THR 67 N -1.57 3.17 0.33 -0.18 -4.23 -1.03 -4.96 115.64 107.17 2k74 s THR 67 Ca 0.05 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 58.71 2k74 s THR 67 Cb 0.07 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 71.03 2k74 s THR 67 CO 0.30 -0.28 0.72 -2.65 -0.54 0.00 0.00 174.62 172.17 2k74 n PRO 68 N -0.98 0.02 -0.54 3.99 -0.02 -1.26 -1.82 135.00 134.38 2k74 n PRO 68 Ca -0.05 0.48 0.43 0.00 -2.02 0.00 0.00 63.50 62.34 2k74 n PRO 68 Cb 0.60 -2.18 0.73 0.00 -0.02 0.00 0.00 33.50 32.63 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 0.13 -0.10 2.45 4.07 -1.93 -1.93 115.31 118.00 2k74 h LEU 69 Ca 0.00 0.08 0.01 0.00 0.08 0.00 0.00 57.88 58.05 2k74 h LEU 69 Cb 1.45 0.07 -0.01 0.00 1.08 0.00 0.00 40.66 43.25 2k74 h LEU 69 CO 0.00 -0.11 -0.06 0.54 -1.08 0.00 0.00 178.44 177.73 2k74 n ARG 70 N -4.38 -0.04 -0.17 1.13 1.74 -0.75 0.12 116.66 114.31 2k74 n ARG 70 Ca 0.39 1.01 0.24 0.00 -0.77 0.00 0.00 57.85 58.73 2k74 n ARG 70 Cb 1.66 -1.51 0.66 0.00 -1.02 0.00 0.00 32.46 32.24 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 0.16 -0.19 -1.55 3.20 -1.66 0.54 116.97 117.47 2k74 h TYR 71 Ca 0.02 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.83 2k74 h TYR 71 Cb 0.04 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 2k74 h TYR 71 CO -0.91 0.04 -0.11 0.28 -1.64 0.00 0.00 178.16 175.82 2k74 h VAL 72 N 0.12 1.31 0.11 1.81 2.07 0.91 -2.22 116.25 120.36 2k74 h VAL 72 Ca 0.41 -1.18 -0.27 0.00 0.82 0.00 0.00 66.70 66.48 2k74 h VAL 72 Cb 1.43 1.69 -0.00 0.00 -1.52 0.00 0.00 31.29 32.89 2k74 h VAL 72 CO -0.06 0.36 -1.24 0.00 0.02 0.00 0.00 177.57 176.65 2k74 h ALA 73 N 0.68 0.15 0.00 1.67 0.00 0.61 -3.20 119.26 119.17 2k74 h ALA 73 Ca 0.04 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 54.04 2k74 h ALA 73 Cb 0.60 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2k74 h ALA 73 CO 0.03 1.03 0.00 0.52 0.00 0.00 0.00 179.25 180.83 2k74 h MET 74 N 0.06 0.00 -0.78 0.00 2.07 -0.00 -2.23 114.93 114.05 2k74 h MET 74 Ca -0.13 0.00 0.15 0.00 -2.07 0.00 0.00 59.70 57.66 2k74 h MET 74 Cb 1.95 0.00 -0.05 0.00 -1.87 0.00 0.00 31.60 31.63 2k74 h MET 74 CO 0.19 0.00 0.52 0.28 1.07 0.00 0.00 176.91 178.97 2k74 h VAL 75 N 0.00 0.79 0.04 -2.22 2.07 -1.39 0.56 116.25 116.10 2k74 h VAL 75 Ca 0.00 -0.15 -0.31 0.00 0.82 0.00 0.00 66.70 67.06 2k74 h VAL 75 Cb 0.23 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.28 2k74 h VAL 75 CO 0.00 0.08 -1.73 0.40 0.02 0.00 0.00 177.57 176.34 2k74 h ILE 76 N 0.43 0.86 -0.01 4.57 2.04 -1.62 -2.91 117.51 120.87 2k74 h ILE 76 Ca 0.38 -2.65 -0.00 0.00 1.00 0.00 0.00 64.86 63.59 2k74 h ILE 76 Cb 0.87 2.50 -0.00 0.00 -0.74 0.00 0.00 36.82 39.45 2k74 h ILE 76 CO -0.13 0.65 0.00 -0.25 0.00 0.00 0.00 178.15 178.42 2k74 h TRP 77 N 0.03 0.02 -0.03 1.37 2.91 -1.03 -2.86 115.95 116.36 2k74 h TRP 77 Ca -0.30 -0.00 -0.00 0.00 1.13 0.00 0.00 58.89 59.71 2k74 h TRP 77 Cb 2.01 -0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 30.65 2k74 h TRP 77 CO 0.03 0.30 0.00 1.25 -1.03 0.00 0.00 178.44 178.99 2k74 h LEU 78 N -0.28 0.05 -0.96 0.65 5.85 -0.11 -2.05 115.31 118.45 2k74 h LEU 78 Ca 0.00 -0.30 0.31 0.00 0.84 0.00 0.00 57.88 58.73 2k74 h LEU 78 Cb 0.30 -0.01 -0.16 0.00 0.37 0.00 0.00 40.66 41.15 2k74 h LEU 78 CO 0.00 0.34 0.36 1.88 -0.34 0.00 0.00 178.44 180.67 2k74 h TYR 79 N -0.25 0.54 0.00 1.25 -1.99 -1.54 2.16 116.97 117.14 2k74 h TYR 79 Ca 0.01 0.05 -0.04 0.00 2.00 0.00 0.00 58.73 60.74 2k74 h TYR 79 Cb 0.31 -0.08 -0.01 0.00 2.00 0.00 0.00 36.73 38.96 2k74 h TYR 79 CO 0.03 -0.31 -0.20 0.66 -0.00 0.00 0.00 178.16 178.34 2k74 h SER 80 N 0.15 0.00 0.99 3.88 4.64 -1.33 -2.77 113.55 119.11 2k74 h SER 80 Ca 0.68 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.96 2k74 h SER 80 Cb 1.56 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.66 2k74 h SER 80 CO -0.72 0.20 -0.48 0.00 -0.87 0.00 0.00 176.83 174.95 2k74 h ALA 81 N 1.80 -1.34 0.03 5.18 0.00 0.43 0.59 119.26 125.94 2k74 h ALA 81 Ca -0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2k74 h ALA 81 Cb 1.06 0.53 0.00 0.00 0.00 0.00 0.00 17.79 19.38 2k74 h ALA 81 CO 0.03 -1.26 -0.01 0.74 0.00 0.00 0.00 179.25 178.75 2k74 h PHE 82 N -1.34 -0.03 -0.42 0.00 0.04 -1.61 -2.90 116.94 110.68 2k74 h PHE 82 Ca -0.14 -0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.49 2k74 h PHE 82 Cb 1.03 0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.18 2k74 h PHE 82 CO -0.01 0.66 -0.28 0.00 -0.60 0.00 0.00 178.31 178.07 2k74 h ARG 83 N -0.80 0.93 -0.23 1.51 2.47 -1.60 0.23 114.38 116.89 2k74 h ARG 83 Ca -0.00 -0.44 -0.01 0.00 -1.26 0.00 0.00 59.98 58.26 2k74 h ARG 83 Cb 0.71 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.01 2k74 h ARG 83 CO 0.01 1.10 0.10 0.78 0.56 0.00 0.00 179.97 182.51 2k74 h GLY 84 N 0.76 0.37 1.79 0.04 0.00 0.05 0.35 103.07 106.43 2k74 h GLY 84 Ca 0.08 -0.20 -0.21 0.00 0.00 0.00 0.00 47.33 47.00 2k74 h GLY 84 CO 0.08 0.19 -0.97 -0.39 0.00 0.00 0.00 176.54 175.44 2k74 h VAL 85 N 0.23 1.53 -0.08 4.60 -1.51 -1.49 -1.79 116.25 117.74 2k74 h VAL 85 Ca 0.08 -2.85 -0.17 0.00 -1.23 0.00 0.00 66.70 62.53 2k74 h VAL 85 Cb 0.17 2.63 0.01 0.00 -2.13 0.00 0.00 31.29 31.96 2k74 h VAL 85 CO -0.01 0.83 -0.60 -0.61 -1.23 0.00 0.00 177.57 175.95 2k74 h GLN 86 N 0.08 0.56 -0.12 5.19 4.15 -0.46 -2.91 115.11 121.60 2k74 h GLN 86 Ca -0.06 -0.49 -0.22 0.00 0.77 0.00 0.00 58.65 58.66 2k74 h GLN 86 Cb 1.64 0.11 0.01 0.00 0.21 0.00 0.00 27.48 29.45 2k74 h GLN 86 CO 0.15 1.11 -0.79 1.25 -1.93 0.00 0.00 178.83 178.62 2k74 h LEU 87 N 0.16 0.81 -0.57 -2.39 5.85 -0.38 -3.26 115.31 115.53 2k74 h LEU 87 Ca -0.05 -0.54 0.01 0.00 0.84 0.00 0.00 57.88 58.14 2k74 h LEU 87 Cb 1.26 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 2k74 h LEU 87 CO 0.12 1.33 0.37 0.71 -0.34 0.00 0.00 178.44 180.63 2k74 h THR 88 N 0.45 1.12 -0.25 1.05 1.35 -1.40 -2.77 112.91 112.46 2k74 h THR 88 Ca -0.05 -0.26 0.06 0.00 -0.55 0.00 0.00 66.41 65.61 2k74 h THR 88 Cb 1.41 0.31 -0.07 0.00 -1.73 0.00 0.00 68.15 68.07 2k74 h THR 88 CO 0.16 0.14 -0.19 1.88 -0.25 0.00 0.00 175.52 177.25 2k74 h TYR 89 N 0.74 -0.48 -0.66 4.73 -1.99 -1.55 0.82 116.97 118.58 2k74 h TYR 89 Ca 0.22 0.03 0.13 0.00 2.00 0.00 0.00 58.73 61.11 2k74 h TYR 89 Cb -0.05 0.25 -0.10 0.00 2.00 0.00 0.00 36.73 38.83 2k74 h TYR 89 CO -0.04 -0.26 0.15 1.49 -0.00 0.00 0.00 178.16 179.49 2k74 h GLU 90 N -0.18 0.26 -0.23 4.88 4.57 -1.54 0.31 114.58 122.65 2k74 h GLU 90 Ca 0.14 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.25 2k74 h GLU 90 Cb 0.39 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 2k74 h GLU 90 CO -0.36 0.17 -0.10 0.45 -1.18 0.00 0.00 179.01 178.00 2k74 h HIS 91 N 0.27 0.38 -0.22 0.92 3.86 -1.00 -2.42 115.15 116.93 2k74 h HIS 91 Ca 0.36 -0.05 -0.16 0.00 -1.16 0.00 0.00 60.37 59.36 2k74 h HIS 91 Cb 0.56 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 2k74 h HIS 91 CO -0.25 0.46 -0.52 1.15 0.86 0.00 0.00 177.93 179.63 2k74 h THR 92 N 0.34 1.31 -0.26 2.45 2.02 0.18 -2.87 112.91 116.08 2k74 h THR 92 Ca 0.07 -1.75 -0.02 0.00 0.77 0.00 0.00 66.41 65.48 2k74 h THR 92 Cb 0.39 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 2k74 h THR 92 CO 0.02 0.55 0.05 -0.03 0.37 0.00 0.00 175.52 176.49 2k74 h MET 93 N 0.50 0.37 -0.14 6.66 -1.53 -0.12 -2.45 114.93 118.23 2k74 h MET 93 Ca 0.02 -0.05 -0.03 0.00 -3.44 0.00 0.00 59.70 56.19 2k74 h MET 93 Cb 1.08 -0.07 -0.00 0.00 -0.55 0.00 0.00 31.60 32.06 2k74 h MET 93 CO 0.10 0.36 -0.03 1.25 0.14 0.00 0.00 176.91 178.74 2k74 h LEU 94 N 0.37 0.27 -0.87 3.39 5.85 -1.29 1.18 115.31 124.21 2k74 h LEU 94 Ca 0.09 -0.36 0.16 0.00 0.84 0.00 0.00 57.88 58.61 2k74 h LEU 94 Cb 0.17 -0.07 -0.10 0.00 0.37 0.00 0.00 40.66 41.03 2k74 h LEU 94 CO -0.00 0.56 0.45 1.56 -0.34 0.00 0.00 178.44 180.67 2k74 h GLN 95 N -0.03 0.59 -0.00 1.25 4.20 -1.24 0.37 115.11 120.26 2k74 h GLN 95 Ca 0.04 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2k74 h GLN 95 Cb 0.44 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2k74 h GLN 95 CO 0.01 0.39 -0.59 1.28 -0.67 0.00 0.00 178.83 179.26 2k74 n LEU 96 N -4.88 0.67 -3.17 1.46 4.32 -1.02 -4.47 117.00 109.90 2k74 n LEU 96 Ca 0.18 -0.14 -0.23 0.00 -0.02 0.00 0.00 56.01 55.81 2k74 n LEU 96 Cb 0.47 -0.18 -0.06 0.00 -1.62 0.00 0.00 43.42 42.02 2k74 n LEU 96 CO 0.20 0.16 -0.27 0.00 -1.22 0.00 0.00 177.39 176.26 2k74 n TYR 97 N -1.42 -0.46 -0.71 -1.77 4.19 0.40 -5.07 117.16 112.32 2k74 n TYR 97 Ca 0.06 -3.50 -0.31 0.00 3.31 0.00 0.00 57.90 57.46 2k74 n TYR 97 Cb 0.34 -0.27 0.14 0.00 0.49 0.00 0.00 39.34 40.04 2k74 n TYR 97 CO 0.00 0.00 0.00 -2.30 0.91 0.00 0.00 176.86 175.47 2k74 n PRO 98 N 1.35 -1.42 -2.69 2.98 -0.02 0.96 -4.29 135.00 131.87 2k74 n PRO 98 Ca 0.21 -0.41 -0.29 0.00 -2.02 0.00 0.00 63.50 60.99 2k74 n PRO 98 Cb 0.54 -1.51 -0.02 0.00 -0.02 0.00 0.00 33.50 32.49 2k74 n PRO 98 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2k74 s SER 99 N -1.69 6.40 0.00 2.55 0.01 -1.26 -5.02 113.70 114.69 2k74 s SER 99 Ca 0.48 1.08 0.00 0.00 1.31 0.00 0.00 55.95 58.82 2k74 s SER 99 Cb -0.06 -2.31 0.00 0.00 0.21 0.00 0.00 66.02 63.86 2k74 s SER 99 CO 0.60 -0.51 0.00 -0.81 0.41 0.00 0.00 173.24 172.93 2k74 n PRO 100 N -1.79 0.00 0.00 12.44 -0.04 -1.26 -4.96 135.00 139.39 2k74 n PRO 100 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 2k74 n PRO 100 Cb 0.54 -0.16 0.00 0.00 -0.04 0.00 0.00 33.50 33.84 2k74 n PRO 100 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2k74 n PHE 101 N 0.00 0.00 -0.30 0.54 3.01 -1.26 -5.09 117.46 114.36 2k74 n PHE 101 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2k74 n PHE 101 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 2k74 n PHE 101 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2k74 n ALA 102 N -1.64 0.00 -2.85 4.37 0.00 -1.26 -4.80 120.51 114.32 2k74 n ALA 102 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2k74 n ALA 102 Cb 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.65 2k74 n ALA 102 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2k74 n THR 103 N -1.50 -6.77 0.00 0.00 -2.24 -1.26 -4.97 114.28 97.53 2k74 n THR 103 Ca 0.00 1.35 0.00 0.00 -2.27 0.00 0.00 64.05 63.13 2k74 n THR 103 Cb 0.00 -4.47 0.00 0.00 -2.10 0.00 0.00 70.33 63.76 2k74 n THR 103 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2k74 n SER 104 N 2.13 0.00 -2.68 3.42 2.88 -1.26 -5.01 113.62 113.10 2k74 n SER 104 Ca -0.21 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.29 2k74 n SER 104 Cb 0.32 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 63.87 2k74 n SER 104 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2k74 n ASP 105 N 0.00 -1.50 -2.97 -3.46 5.75 -1.26 -5.15 116.55 107.97 2k74 n ASP 105 Ca 0.00 -2.13 -0.09 0.00 -0.01 0.00 0.00 54.79 52.56 2k74 n ASP 105 Cb 0.00 1.12 0.05 0.00 -1.03 0.00 0.00 41.12 41.26 2k74 n ASP 105 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2k74 n PHE 106 N 0.97 -3.30 -2.75 2.11 3.01 -1.26 -5.10 117.46 111.14 2k74 n PHE 106 Ca -0.01 -0.66 0.00 0.00 1.01 0.00 0.00 57.45 57.79 2k74 n PHE 106 Cb 0.72 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.89 2k74 n PHE 106 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2k74 n MET 107 N -1.77 0.00 -0.85 -1.08 0.00 -1.26 -4.94 117.12 107.22 2k74 n MET 107 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.76 2k74 n MET 107 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.45 2k74 n MET 107 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2k74 n VAL 108 N 0.00 0.00 -3.59 3.17 0.31 -1.26 -4.92 118.33 112.04 2k74 n VAL 108 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.93 2k74 n VAL 108 Cb 0.00 -0.64 -0.10 0.00 -0.91 0.00 0.00 33.84 32.20 2k74 n VAL 108 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k74 s ARG 109 N -1.28 2.57 0.15 5.55 1.70 -1.26 -5.07 118.95 121.32 2k74 s ARG 109 Ca 0.00 -1.54 0.07 0.00 -0.47 0.00 0.00 55.73 53.80 2k74 s ARG 109 Cb 0.00 -3.82 -0.04 0.00 -0.57 0.00 0.00 34.95 30.52 2k74 s ARG 109 CO 0.00 -1.02 -0.16 -0.59 -1.08 0.00 0.00 175.30 172.45 2k74 s PHE 110 N 1.41 1.62 0.21 5.89 -0.12 -1.26 -5.11 117.98 120.62 2k74 s PHE 110 Ca 0.04 -0.51 -0.32 0.00 -0.05 0.00 0.00 56.93 56.08 2k74 s PHE 110 Cb -0.24 -0.83 -0.13 0.00 -0.63 0.00 0.00 43.02 41.19 2k74 s PHE 110 CO 0.01 0.24 1.54 -0.35 -0.05 0.00 0.00 175.22 176.61 2k74 n PRO 111 N 0.39 2.25 -0.01 1.99 -0.04 -1.26 -4.86 135.00 133.47 2k74 n PRO 111 Ca -0.14 0.81 0.09 0.00 -0.04 0.00 0.00 63.50 64.22 2k74 n PRO 111 Cb 0.57 -2.55 0.54 0.00 -0.04 0.00 0.00 33.50 32.02 2k74 n PRO 111 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2k74 n GLU 112 N 2.84 1.05 0.00 0.54 -0.58 -1.26 -2.88 120.64 120.34 2k74 n GLU 112 Ca 0.14 -0.07 0.11 0.00 -0.42 0.00 0.00 57.16 56.92 2k74 n GLU 112 Cb 0.31 -1.30 0.01 0.00 -0.57 0.00 0.00 31.44 29.90 2k74 n GLU 112 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 2k74 n TRP 113 N -0.71 0.00 -3.71 -0.32 7.02 -1.26 -4.65 117.44 113.80 2k74 n TRP 113 Ca 0.14 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.28 2k74 n TRP 113 Cb 0.08 -0.01 -0.08 0.00 -2.42 0.00 0.00 31.31 28.88 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 -2.54 5.31 0.00 -0.99 1.02 -1.14 -4.91 118.68 115.43 2k74 s LEU 114 Ca 0.18 -3.54 0.00 0.00 0.02 0.00 0.00 54.13 50.78 2k74 s LEU 114 Cb 0.18 -1.84 0.00 0.00 0.02 0.00 0.00 46.19 44.55 2k74 s LEU 114 CO 0.60 -0.20 0.24 -0.81 0.02 0.00 0.00 176.35 176.19 2k74 n PRO 115 N 2.53 0.27 0.08 1.29 -0.04 -1.26 -2.33 135.00 135.54 2k74 n PRO 115 Ca 0.18 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.60 2k74 n PRO 115 Cb 0.37 -1.03 -0.07 0.00 -0.04 0.00 0.00 33.50 32.72 2k74 n PRO 115 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2k74 h LEU 116 N 0.16 0.00 0.03 1.53 3.38 -1.94 -1.40 115.31 117.07 2k74 h LEU 116 Ca 0.00 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.58 2k74 h LEU 116 Cb 0.03 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 2k74 h LEU 116 CO 0.00 0.84 -2.34 -0.90 0.09 0.00 0.00 178.44 176.14 2k74 n ASP 117 N -3.31 2.01 -0.07 -0.43 5.68 -0.98 -3.41 116.55 116.04 2k74 n ASP 117 Ca 0.00 -0.01 -0.13 0.00 -0.50 0.00 0.00 54.79 54.16 2k74 n ASP 117 Cb 0.88 -0.56 -0.06 0.00 -1.14 0.00 0.00 41.12 40.24 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 -0.06 0.47 0.00 0.11 3.64 -1.69 -1.28 116.57 117.75 2k74 h LYS 118 Ca -0.54 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 58.61 2k74 h LYS 118 Cb 1.90 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.73 2k74 h LYS 118 CO -0.07 0.79 0.00 1.87 -2.27 0.00 0.00 179.45 179.78 2k74 n TRP 119 N -4.48 0.38 -3.16 1.91 -0.00 -0.53 -4.09 117.44 107.47 2k74 n TRP 119 Ca -0.05 0.12 -0.23 0.00 -0.00 0.00 0.00 57.50 57.35 2k74 n TRP 119 Cb 0.37 -0.70 -0.06 0.00 -0.00 0.00 0.00 31.31 30.92 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 -1.82 -0.68 0.49 5.87 0.31 -1.07 -4.94 118.33 116.49 2k74 n VAL 120 Ca 0.05 -3.67 0.13 0.00 -0.01 0.00 0.00 64.34 60.84 2k74 n VAL 120 Cb 0.32 -1.56 0.39 0.00 -0.91 0.00 0.00 33.84 32.08 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 4.18 0.00 -0.83 5.55 0.13 -1.39 -3.27 132.00 136.37 2k74 h PRO 121 Ca 0.07 0.00 0.21 0.00 -0.87 0.00 0.00 66.00 65.41 2k74 h PRO 121 Cb 0.90 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.98 2k74 h PRO 121 CO 0.43 0.00 0.57 1.96 -0.23 0.00 0.00 178.00 180.74 2k74 h GLN 122 N 0.00 0.21 -1.08 0.86 4.20 -1.92 -1.99 115.11 115.40 2k74 h GLN 122 Ca 0.00 -0.01 -0.42 0.00 0.06 0.00 0.00 58.65 58.27 2k74 h GLN 122 Cb 0.71 -0.05 -0.41 0.00 0.30 0.00 0.00 27.48 28.04 2k74 h GLN 122 CO 0.00 0.14 -1.04 1.33 -0.67 0.00 0.00 178.83 178.59 2k74 n VAL 123 N -4.41 1.48 0.00 -0.54 0.24 -1.23 -4.80 118.33 109.07 2k74 n VAL 123 Ca 0.17 -3.63 0.00 0.00 -2.04 0.00 0.00 64.34 58.84 2k74 n VAL 123 Cb 0.75 0.09 0.00 0.00 -1.47 0.00 0.00 33.84 33.22 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 -0.26 -0.08 -2.00 6.34 3.72 -0.92 -4.97 117.46 119.30 2k74 n PHE 124 Ca 0.19 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.17 2k74 n PHE 124 Cb 0.78 0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 39.32 2k74 n PHE 124 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2k74 s VAL 125 N -1.05 2.90 0.27 -4.37 1.01 -0.79 -4.96 120.40 113.40 2k74 s VAL 125 Ca 0.00 0.59 -0.03 0.00 0.00 0.00 0.00 61.98 62.54 2k74 s VAL 125 Cb 0.00 -3.38 -0.05 0.00 0.00 0.00 0.00 36.38 32.96 2k74 s VAL 125 CO 0.00 0.03 0.50 0.00 0.00 0.00 0.00 175.10 175.64 2k74 s ALA 126 N 1.49 3.70 -0.29 5.51 0.00 -1.26 -5.00 121.76 125.91 2k74 s ALA 126 Ca 0.69 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.99 2k74 s ALA 126 Cb -0.41 -2.18 0.19 0.00 0.00 0.00 0.00 23.12 20.72 2k74 s ALA 126 CO 0.31 0.26 0.55 -1.54 0.00 0.00 0.00 175.76 175.34 2k74 s SER 127 N -3.30 -1.13 0.00 0.00 1.04 -0.82 -4.82 113.70 104.66 2k74 s SER 127 Ca 0.42 0.25 0.00 0.00 0.48 0.00 0.00 55.95 57.09 2k74 s SER 127 Cb -0.11 1.86 0.00 0.00 0.10 0.00 0.00 66.02 67.87 2k74 s SER 127 CO 0.31 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.84 2k74 n GLY 128 N 5.41 0.95 3.85 7.32 0.00 -1.24 -3.75 105.19 117.73 2k74 n GLY 128 Ca 0.02 -2.02 -0.32 0.00 0.00 0.00 0.00 46.02 43.70 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 -1.09 6.76 -0.21 1.61 2.15 -1.26 -4.73 116.67 119.89 2k74 s ASP 129 Ca 0.00 1.26 -0.09 0.00 0.43 0.00 0.00 52.55 54.15 2k74 s ASP 129 Cb 0.00 -2.36 -0.05 0.00 -0.30 0.00 0.00 42.92 40.21 2k74 s ASP 129 CO 0.00 -0.20 0.11 0.00 -0.17 0.00 0.00 175.17 174.91 2k74 n ALA 131 N 3.94 0.00 -2.10 0.00 0.00 -1.26 -5.05 120.51 116.03 2k74 n ALA 131 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.86 2k74 n ALA 131 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 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 -0.94 4.28 0.24 0.00 2.56 -1.26 -4.96 118.70 118.62 2k74 s GLU 132 Ca 0.00 2.15 -0.30 0.00 0.00 0.00 0.00 54.97 56.82 2k74 s GLU 132 Cb 0.00 -3.31 -0.09 0.00 2.00 0.00 0.00 34.13 32.73 2k74 s GLU 132 CO 0.00 -0.52 1.30 0.50 -0.56 0.00 0.00 175.26 175.97 2k74 s ARG 133 N 1.45 4.40 0.00 4.30 3.52 -1.26 -4.89 118.95 126.46 2k74 s ARG 133 Ca 0.67 2.08 0.00 0.00 -0.13 0.00 0.00 55.73 58.35 2k74 s ARG 133 Cb -0.38 -3.16 0.00 0.00 -1.56 0.00 0.00 34.95 29.85 2k74 s ARG 133 CO 0.30 -0.20 0.00 1.04 -0.81 0.00 0.00 175.30 175.63 2k74 n GLN 134 N 2.06 2.04 -3.63 5.12 6.02 -1.26 -5.11 117.38 122.62 2k74 n GLN 134 Ca 0.04 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 56.98 2k74 n GLN 134 Cb 0.43 -0.75 -0.06 0.00 1.02 0.00 0.00 30.24 30.88 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 -1.46 -0.20 0.07 1.08 -0.00 -1.26 -5.16 118.94 112.02 2k74 s TRP 135 Ca 0.00 0.41 -0.06 0.00 -0.00 0.00 0.00 56.10 56.44 2k74 s TRP 135 Cb 0.00 0.46 -0.01 0.00 -0.00 0.00 0.00 33.47 33.91 2k74 s TRP 135 CO 0.00 -0.14 0.12 0.16 -0.00 0.00 0.00 176.95 177.09 2k74 s ASP 136 N -0.52 0.23 -0.06 5.86 -4.77 -1.26 -3.46 116.67 112.69 2k74 s ASP 136 Ca 0.05 -0.74 0.04 0.00 -3.30 0.00 0.00 52.55 48.59 2k74 s ASP 136 Cb -0.03 0.29 -0.02 0.00 -1.09 0.00 0.00 42.92 42.07 2k74 s ASP 136 CO -0.08 -0.68 -0.16 -0.36 0.70 0.00 0.00 175.17 174.60 2k74 s PHE 137 N -3.79 2.67 -0.78 2.11 0.08 0.16 -4.53 117.98 113.89 2k74 s PHE 137 Ca 0.05 -0.30 0.00 0.00 0.12 0.00 0.00 56.93 56.80 2k74 s PHE 137 Cb 0.05 -1.65 0.00 0.00 -0.57 0.00 0.00 43.02 40.86 2k74 s PHE 137 CO -0.10 0.08 0.00 -0.11 -0.10 0.00 0.00 175.22 174.98 2k74 n LEU 138 N 2.55 -0.38 0.00 -0.37 7.94 -1.26 0.13 117.00 125.62 2k74 n LEU 138 Ca -0.17 0.18 0.00 0.00 -1.11 0.00 0.00 56.01 54.91 2k74 n LEU 138 Cb 0.52 -1.66 0.00 0.00 0.53 0.00 0.00 43.42 42.81 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 0.02 0.85 3.18 -3.96 0.00 -1.26 -5.08 105.19 98.95 2k74 n GLY 139 Ca -0.07 -0.48 -0.27 0.00 0.00 0.00 0.00 46.02 45.19 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 1.97 0.47 0.99 2.01 0.35 -5.05 118.68 119.43 2k74 s LEU 140 Ca 0.00 -0.39 -0.23 0.00 0.01 0.00 0.00 54.13 53.52 2k74 s LEU 140 Cb 0.00 -1.07 -0.07 0.00 0.01 0.00 0.00 46.19 45.06 2k74 s LEU 140 CO 0.00 0.19 1.17 -1.61 1.01 0.00 0.00 176.35 177.11 2k74 s GLU 141 N -0.11 3.69 0.10 1.70 0.41 -1.26 0.38 118.70 123.61 2k74 s GLU 141 Ca -0.01 1.78 -0.24 0.00 -0.41 0.00 0.00 54.97 56.09 2k74 s GLU 141 Cb -0.11 -2.36 -0.08 0.00 -1.78 0.00 0.00 34.13 29.80 2k74 s GLU 141 CO 0.02 -0.61 1.40 0.52 -0.49 0.00 0.00 175.26 176.10 2k74 h MET 142 N 1.94 -0.24 -0.85 1.61 2.86 -1.95 0.87 114.93 119.17 2k74 h MET 142 Ca -0.49 0.02 0.32 0.00 -2.06 0.00 0.00 59.70 57.48 2k74 h MET 142 Cb 1.25 0.05 -0.11 0.00 0.06 0.00 0.00 31.60 32.86 2k74 h MET 142 CO 0.60 -0.16 0.52 -2.30 1.06 0.00 0.00 176.91 176.63 2k74 n PRO 143 N -4.65 -0.03 0.01 -0.22 -0.02 -1.26 0.13 135.00 128.96 2k74 n PRO 143 Ca -0.02 0.90 -0.12 0.00 -2.02 0.00 0.00 63.50 62.24 2k74 n PRO 143 Cb 0.24 -1.72 -0.09 0.00 -0.02 0.00 0.00 33.50 31.91 2k74 n PRO 143 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2k74 h GLN 144 N 0.00 -0.10 0.70 -0.52 7.50 -1.19 -2.62 115.11 118.87 2k74 h GLN 144 Ca 0.60 0.01 -0.03 0.00 0.50 0.00 0.00 58.65 59.73 2k74 h GLN 144 Cb 1.81 0.02 0.00 0.00 0.05 0.00 0.00 27.48 29.36 2k74 h GLN 144 CO -0.41 0.43 -0.36 -1.49 -1.50 0.00 0.00 178.83 175.50 2k74 h TRP 145 N -0.72 -0.94 -1.24 2.96 4.06 0.14 -1.67 115.95 118.54 2k74 h TRP 145 Ca -0.01 -0.02 0.38 0.00 2.06 0.00 0.00 58.89 61.30 2k74 h TRP 145 Cb 0.57 0.32 -0.11 0.00 -1.00 0.00 0.00 29.16 28.94 2k74 h TRP 145 CO 0.11 -0.57 0.81 1.25 -3.56 0.00 0.00 178.44 176.48 2k74 h LEU 146 N -0.97 0.28 -1.36 -4.49 5.85 -0.73 3.29 115.31 117.19 2k74 h LEU 146 Ca -0.09 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 2k74 h LEU 146 Cb 0.76 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 2k74 h LEU 146 CO 0.14 -0.08 0.05 0.25 -0.34 0.00 0.00 178.44 178.46 2k74 h LEU 147 N 0.17 0.44 -0.35 2.25 5.85 -0.91 0.33 115.31 123.10 2k74 h LEU 147 Ca 0.74 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 59.39 2k74 h LEU 147 Cb 2.26 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 43.15 2k74 h LEU 147 CO -0.34 0.47 0.19 1.23 -0.34 0.00 0.00 178.44 179.65 2k74 h GLY 148 N 0.73 0.52 2.00 3.75 0.00 0.65 -1.29 103.07 109.43 2k74 h GLY 148 Ca 0.11 -0.23 -0.09 0.00 0.00 0.00 0.00 47.33 47.11 2k74 h GLY 148 CO 0.00 0.22 -0.44 -2.22 0.00 0.00 0.00 176.54 174.10 2k74 h ILE 149 N 0.44 0.91 -0.41 2.60 5.03 -0.99 -2.99 117.51 122.10 2k74 h ILE 149 Ca 0.12 -1.84 -0.04 0.00 -0.12 0.00 0.00 64.86 62.99 2k74 h ILE 149 Cb 0.05 2.14 -0.02 0.00 -3.03 0.00 0.00 36.82 35.96 2k74 h ILE 149 CO -0.02 0.44 0.10 0.15 -0.68 0.00 0.00 178.15 178.14 2k74 h PHE 150 N 0.00 0.68 -0.31 1.37 3.57 0.28 -2.77 116.94 119.76 2k74 h PHE 150 Ca -0.00 -0.08 -0.14 0.00 3.53 0.00 0.00 57.97 61.28 2k74 h PHE 150 Cb 1.10 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 2k74 h PHE 150 CO 0.00 0.65 -0.36 0.97 -2.23 0.00 0.00 178.31 177.33 2k74 h ILE 151 N 0.52 1.29 -0.52 1.41 2.10 -1.25 -2.93 117.51 118.12 2k74 h ILE 151 Ca 0.13 -1.52 0.08 0.00 1.08 0.00 0.00 64.86 64.63 2k74 h ILE 151 Cb 0.31 1.43 -0.07 0.00 -1.09 0.00 0.00 36.82 37.40 2k74 h ILE 151 CO 0.00 0.49 0.13 0.00 -1.08 0.00 0.00 178.15 177.70 2k74 h ALA 152 N 1.00 0.61 -0.53 0.18 0.00 -1.37 0.19 119.26 119.33 2k74 h ALA 152 Ca 0.06 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2k74 h ALA 152 Cb 0.89 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 2k74 h ALA 152 CO 0.08 -0.27 0.32 1.88 0.00 0.00 0.00 179.25 181.26 2k74 h TYR 153 N 0.28 0.70 -0.06 0.00 -1.99 -1.39 0.79 116.97 115.30 2k74 h TYR 153 Ca 0.26 -0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.93 2k74 h TYR 153 Cb 0.34 -0.23 -0.01 0.00 2.00 0.00 0.00 36.73 38.83 2k74 h TYR 153 CO -0.21 0.48 -0.22 -0.07 -0.00 0.00 0.00 178.16 178.14 2k74 h LEU 154 N 0.71 0.10 -0.01 3.88 3.38 -1.11 -2.59 115.31 119.68 2k74 h LEU 154 Ca 0.19 -0.02 -0.24 0.00 0.09 0.00 0.00 57.88 57.90 2k74 h LEU 154 Cb -0.02 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2k74 h LEU 154 CO -0.04 0.34 -1.09 0.40 0.09 0.00 0.00 178.44 178.14 2k74 h ILE 155 N 0.10 1.55 -0.12 1.22 5.03 -0.05 -2.83 117.51 122.41 2k74 h ILE 155 Ca 0.02 -3.02 -0.06 0.00 -0.12 0.00 0.00 64.86 61.68 2k74 h ILE 155 Cb 0.46 2.79 -0.01 0.00 -3.03 0.00 0.00 36.82 37.03 2k74 h ILE 155 CO 0.03 0.88 -0.18 0.58 -0.68 0.00 0.00 178.15 178.77 2k74 h VAL 156 N 0.07 1.19 0.03 1.67 2.07 -0.49 -2.25 116.25 118.54 2k74 h VAL 156 Ca -0.08 -0.88 -0.07 0.00 0.82 0.00 0.00 66.70 66.49 2k74 h VAL 156 Cb 1.80 1.31 0.01 0.00 -1.52 0.00 0.00 31.29 32.89 2k74 h VAL 156 CO 0.17 0.27 -0.31 0.00 0.02 0.00 0.00 177.57 177.72 2k74 h ALA 157 N 1.64 0.00 -0.84 1.67 0.00 -1.49 -2.33 119.26 117.91 2k74 h ALA 157 Ca 0.03 -0.52 0.09 0.00 0.00 0.00 0.00 54.91 54.52 2k74 h ALA 157 Cb 0.44 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 2k74 h ALA 157 CO 0.03 0.13 0.49 0.28 0.00 0.00 0.00 179.25 180.17 2k74 h VAL 158 N -0.58 0.93 0.00 0.00 2.07 -1.39 0.15 116.25 117.42 2k74 h VAL 158 Ca -0.05 -0.28 -0.15 0.00 0.82 0.00 0.00 66.70 67.04 2k74 h VAL 158 Cb 1.13 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 2k74 h VAL 158 CO 0.06 0.15 -0.70 0.25 0.02 0.00 0.00 177.57 177.35 2k74 h LEU 159 N 0.82 0.00 -0.26 2.57 7.12 -1.51 -2.78 115.31 121.28 2k74 h LEU 159 Ca 0.40 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.40 2k74 h LEU 159 Cb 0.34 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.47 2k74 h LEU 159 CO -0.24 0.70 -0.03 0.58 -0.13 0.00 0.00 178.44 179.32 2k74 h VAL 160 N 0.00 0.05 0.00 1.05 2.07 -0.65 -2.17 116.25 116.60 2k74 h VAL 160 Ca -0.01 -0.99 -0.07 0.00 0.82 0.00 0.00 66.70 66.46 2k74 h VAL 160 Cb 1.36 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 2k74 h VAL 160 CO 0.09 0.03 -0.36 0.58 0.02 0.00 0.00 177.57 177.93 2k74 h VAL 161 N 0.00 1.54 0.00 2.57 2.07 -0.68 -3.34 116.25 118.41 2k74 h VAL 161 Ca -0.00 -2.30 -0.05 0.00 0.82 0.00 0.00 66.70 65.17 2k74 h VAL 161 Cb 0.94 3.05 -0.01 0.00 -1.52 0.00 0.00 31.29 33.75 2k74 h VAL 161 CO 0.00 0.52 -0.23 0.40 0.02 0.00 0.00 177.57 178.28 2k74 h ILE 162 N -1.00 0.76 0.00 4.57 2.04 -1.58 -1.99 117.51 120.31 2k74 h ILE 162 Ca -0.10 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 64.80 2k74 h ILE 162 Cb 1.08 1.59 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2k74 h ILE 162 CO -0.06 0.23 0.00 -1.54 0.00 0.00 0.00 178.15 176.78 2k74 n SER 163 N -3.68 0.00 -2.88 1.72 3.41 -0.82 -3.85 113.62 107.53 2k74 n SER 163 Ca -0.01 -0.59 -0.11 0.00 -0.26 0.00 0.00 58.87 57.90 2k74 n SER 163 Cb 0.35 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.31 2k74 n SER 163 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2k74 n GLN 164 N -1.00 0.63 -0.98 4.33 0.00 -0.75 -5.03 117.38 114.59 2k74 n GLN 164 Ca 0.14 -2.19 -0.26 0.00 -0.00 0.00 0.00 57.00 54.70 2k74 n GLN 164 Cb 0.06 -1.45 -0.05 0.00 0.00 0.00 0.00 30.24 28.80 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 2.14 2.63 -0.58 3.69 -0.04 -1.24 -4.91 135.00 136.69 2k74 n PRO 165 Ca 0.16 -1.61 0.08 0.00 -0.04 0.00 0.00 63.50 62.09 2k74 n PRO 165 Cb 0.58 -2.47 -0.02 0.00 -0.04 0.00 0.00 33.50 31.55 2k74 n PRO 165 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2k74 n PHE 166 N 3.59 -2.60 0.00 0.54 3.72 -1.26 -4.88 117.46 116.56 2k74 n PHE 166 Ca 0.56 0.73 0.00 0.00 -0.05 0.00 0.00 57.45 58.69 2k74 n PHE 166 Cb 0.30 -1.20 0.00 0.00 -0.94 0.00 0.00 39.48 37.65 2k74 n PHE 166 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2k74 n LYS 167 N -2.74 2.20 -3.17 -1.08 5.02 -1.26 -5.05 118.16 112.08 2k74 n LYS 167 Ca 0.00 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.32 2k74 n LYS 167 Cb 0.27 -0.43 -0.01 0.00 -0.02 0.00 0.00 35.03 34.84 2k74 n LYS 167 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2k74 s ALA 168 N -0.57 -2.29 0.00 7.82 0.00 -1.26 -5.00 121.76 120.46 2k74 s ALA 168 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 51.96 52.82 2k74 s ALA 168 Cb 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 23.12 20.59 2k74 s ALA 168 CO 0.00 -1.88 0.00 1.63 0.00 0.00 0.00 175.76 175.51 2k74 n LYS 169 N 5.27 0.00 0.00 0.00 5.02 -1.26 -5.05 118.16 122.13 2k74 n LYS 169 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 2k74 n LYS 169 Cb 0.54 -0.16 0.00 0.00 -0.02 0.00 0.00 35.03 35.39 2k74 n LYS 169 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2k74 n LYS 170 N -1.76 0.00 -1.16 1.97 5.02 -1.26 -4.83 118.16 116.14 2k74 n LYS 170 Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.21 2k74 n LYS 170 Cb 0.00 -0.02 -0.03 0.00 -0.02 0.00 0.00 35.03 34.96 2k74 n LYS 170 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2k74 n ARG 171 N -0.04 -1.28 0.00 1.97 1.74 -1.26 -4.83 116.66 112.96 2k74 n ARG 171 Ca 0.00 0.48 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 2k74 n ARG 171 Cb 0.00 -4.55 0.00 0.00 -1.02 0.00 0.00 32.46 26.89 2k74 n ARG 171 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2k74 n ASP 172 N 0.16 0.00 0.00 0.55 8.00 -1.26 -4.73 116.55 119.27 2k74 n ASP 172 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.42 2k74 n ASP 172 Cb 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 2k74 n ASP 172 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2k74 n LEU 173 N 0.00 0.14 -4.46 0.64 7.94 -1.26 -4.67 117.00 115.33 2k74 n LEU 173 Ca 0.00 0.45 -0.43 0.00 -1.11 0.00 0.00 56.01 54.92 2k74 n LEU 173 Cb 0.00 -0.48 -0.03 0.00 0.53 0.00 0.00 43.42 43.44 2k74 n LEU 173 CO 0.00 -0.48 0.84 -0.36 -1.11 0.00 0.00 177.39 176.29 2k74 s PHE 174 N -0.95 2.79 0.55 1.96 0.40 -1.26 -5.01 117.98 116.45 2k74 s PHE 174 Ca 0.00 -0.79 0.07 0.00 -0.60 0.00 0.00 56.93 55.61 2k74 s PHE 174 Cb 0.00 -4.31 0.05 0.00 0.51 0.00 0.00 43.02 39.27 2k74 s PHE 174 CO 0.00 -1.62 0.52 0.20 0.70 0.00 0.00 175.22 175.03 2k74 s GLY 175 N 3.73 2.16 -1.17 4.36 0.00 -1.26 -4.58 107.32 110.55 2k74 s GLY 175 Ca 0.26 -1.57 -0.23 0.00 0.00 0.00 0.00 44.72 43.18 2k74 s GLY 175 CO 0.04 -1.85 1.94 0.50 0.00 0.00 0.00 173.10 173.74 2k74 s ARG 176 N -4.39 2.43 0.00 2.90 0.52 -1.26 -4.73 118.95 114.42 2k74 s ARG 176 Ca 0.43 -1.11 0.00 0.00 -0.52 0.00 0.00 55.73 54.54 2k74 s ARG 176 Cb -0.03 -5.23 0.00 0.00 0.52 0.00 0.00 34.95 30.21 2k74 s ARG 176 CO 0.27 -4.04 0.00 0.41 0.02 0.00 0.00 175.30 171.96 2k74 n GLY 177 N 5.85 2.12 3.15 -3.53 0.00 -1.26 -5.15 105.19 106.38 2k74 n GLY 177 Ca 0.44 -0.61 0.04 0.00 0.00 0.00 0.00 46.02 45.90 2k74 n GLY 177 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k74 s HIS 178 N -2.00 -1.33 -0.25 1.61 -3.43 -1.26 -5.08 115.29 103.55 2k74 s HIS 178 Ca 0.00 1.15 -0.20 0.00 -0.80 0.00 0.00 55.06 55.20 2k74 s HIS 178 Cb 0.00 0.37 -0.02 0.00 -1.43 0.00 0.00 32.58 31.50 2k74 s HIS 178 CO 0.00 -0.75 0.64 -1.01 -2.00 0.00 0.00 174.74 171.62 2k74 s HIS 179 N 2.88 3.29 0.00 0.38 3.76 -1.26 -4.95 115.29 119.39 2k74 s HIS 179 Ca 0.14 0.84 0.00 0.00 -0.15 0.00 0.00 55.06 55.89 2k74 s HIS 179 Cb -0.11 -2.84 0.00 0.00 1.11 0.00 0.00 32.58 30.73 2k74 s HIS 179 CO -0.21 -0.32 0.00 1.58 -0.85 0.00 0.00 174.74 174.95 2k74 n HIS 180 N 5.67 0.00 -1.48 1.40 -0.00 -1.26 -5.16 115.22 114.39 2k74 n HIS 180 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2k74 n HIS 180 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.48 2k74 n HIS 180 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2k74 n HIS 181 N 0.00 -4.00 -1.55 1.57 8.25 -1.26 -4.99 115.22 113.24 2k74 n HIS 181 Ca 0.00 2.12 -0.16 0.00 -0.26 0.00 0.00 57.72 59.42 2k74 n HIS 181 Cb 0.00 -3.30 0.11 0.00 1.12 0.00 0.00 29.99 27.92 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 -0.51 -3.95 -1.75 4.41 -0.00 -1.26 -5.31 115.22 106.84 2k74 n HIS 182 Ca 0.00 -0.65 0.00 0.00 0.46 0.00 0.00 57.72 57.53 2k74 n HIS 182 Cb 0.00 -0.54 0.00 0.00 -0.12 0.00 0.00 29.99 29.33 2k74 n HIS 182 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38