#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 0.63 -0.97 4.03 -0.00 -2.06 -1.51 115.31 115.42 2k74 h LEU 2 Ca 0.00 -0.01 0.10 0.00 -0.00 0.00 0.00 57.88 57.97 2k74 h LEU 2 Cb 0.00 -0.15 -0.08 0.00 -0.00 0.00 0.00 40.66 40.43 2k74 h LEU 2 CO 0.00 0.44 0.61 0.03 -0.00 0.00 0.00 178.44 179.52 2k74 h ARG 3 N 0.73 0.99 -0.42 0.17 3.08 -2.06 -1.34 114.38 115.54 2k74 h ARG 3 Ca 0.23 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 2k74 h ARG 3 Cb 0.01 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 2k74 h ARG 3 CO -0.06 0.65 0.11 0.35 -1.07 0.00 0.00 179.97 179.96 2k74 h PHE 4 N 1.02 0.69 -0.90 3.04 3.04 -1.72 -2.67 116.94 119.45 2k74 h PHE 4 Ca 0.46 -0.08 0.20 0.00 3.98 0.00 0.00 57.97 62.53 2k74 h PHE 4 Cb 0.36 -0.20 -0.11 0.00 2.56 0.00 0.00 35.95 38.56 2k74 h PHE 4 CO -0.01 0.65 0.44 1.25 -2.02 0.00 0.00 178.31 178.62 2k74 h LEU 5 N 0.54 0.46 -1.35 0.59 5.85 -1.05 0.96 115.31 121.30 2k74 h LEU 5 Ca 0.13 0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.92 2k74 h LEU 5 Cb 0.29 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2k74 h LEU 5 CO -0.00 0.10 -0.31 -1.13 -0.34 0.00 0.00 178.44 176.76 2k74 h ASN 6 N 0.52 0.00 0.01 1.25 -1.24 -1.16 0.01 115.58 114.97 2k74 h ASN 6 Ca 0.54 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.55 2k74 h ASN 6 Cb 0.93 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.98 2k74 h ASN 6 CO -0.46 0.31 -0.01 -0.61 -1.29 0.00 0.00 177.43 175.38 2k74 h GLN 7 N 0.00 -0.02 -0.14 6.67 5.75 0.11 -0.11 115.11 127.37 2k74 h GLN 7 Ca -0.00 0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.43 2k74 h GLN 7 Cb 0.62 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.16 2k74 h GLN 7 CO 0.04 0.62 -0.24 0.00 -2.65 0.00 0.00 178.83 176.60 2k74 h ALA 8 N 0.29 1.34 0.00 3.38 0.00 -0.65 -2.76 119.26 120.86 2k74 h ALA 8 Ca -0.00 -0.29 -0.22 0.00 0.00 0.00 0.00 54.91 54.40 2k74 h ALA 8 Cb 0.64 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2k74 h ALA 8 CO 0.00 0.45 -0.94 0.66 0.00 0.00 0.00 179.25 179.43 2k74 h SER 9 N 0.23 0.49 0.00 0.00 4.64 -1.02 -2.95 113.55 114.95 2k74 h SER 9 Ca 0.04 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2k74 h SER 9 Cb 0.55 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2k74 h SER 9 CO 0.04 1.20 0.00 0.00 -0.87 0.00 0.00 176.83 177.20 2k74 n GLN 10 N -3.73 0.72 -4.20 4.77 6.02 -0.06 -4.72 117.38 116.18 2k74 n GLN 10 Ca -0.06 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.62 2k74 n GLN 10 Cb 0.83 -1.08 -0.08 0.00 1.02 0.00 0.00 30.24 30.93 2k74 n GLN 10 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2k74 s GLY 11 N -1.05 1.90 -0.03 1.08 0.00 -1.12 -5.04 107.32 103.06 2k74 s GLY 11 Ca 0.00 -1.06 -0.26 0.00 0.00 0.00 0.00 44.72 43.40 2k74 s GLY 11 CO 0.00 -0.99 1.22 3.21 0.00 0.00 0.00 173.10 176.54 2k74 h ARG 12 N 3.79 0.01 -0.90 2.90 3.08 -1.86 -3.00 114.38 118.40 2k74 h ARG 12 Ca -0.48 -0.01 0.24 0.00 0.07 0.00 0.00 59.98 59.80 2k74 h ARG 12 Cb 1.17 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 31.06 2k74 h ARG 12 CO 0.59 0.54 0.09 0.78 -1.07 0.00 0.00 179.97 180.90 2k74 h GLY 13 N -0.52 1.20 0.97 0.04 0.00 -1.96 0.55 103.07 103.34 2k74 h GLY 13 Ca 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 2k74 h GLY 13 CO 0.00 -0.42 0.19 0.00 0.00 0.00 0.00 176.54 176.31 2k74 h ALA 14 N 1.86 0.42 -0.28 3.60 0.00 -1.76 -0.50 119.26 122.59 2k74 h ALA 14 Ca 0.54 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.42 2k74 h ALA 14 Cb 1.09 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2k74 h ALA 14 CO -0.78 -0.06 0.19 -1.49 0.00 0.00 0.00 179.25 177.11 2k74 h TRP 15 N 0.42 0.25 0.00 0.00 4.06 0.13 0.19 115.95 120.99 2k74 h TRP 15 Ca 0.12 0.01 -0.12 0.00 2.06 0.00 0.00 58.89 60.95 2k74 h TRP 15 Cb 0.04 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 28.10 2k74 h TRP 15 CO -0.03 0.15 -0.57 1.25 -3.56 0.00 0.00 178.44 175.68 2k74 h LEU 16 N 0.26 0.00 -0.55 -4.49 6.46 0.02 -2.85 115.31 114.17 2k74 h LEU 16 Ca 0.12 0.00 -0.15 0.00 -0.12 0.00 0.00 57.88 57.72 2k74 h LEU 16 Cb 0.14 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.07 2k74 h LEU 16 CO -0.02 0.57 -0.50 0.25 -0.62 0.00 0.00 178.44 178.11 2k74 h LEU 17 N 0.00 0.64 -0.68 2.25 6.46 0.91 -1.56 115.31 123.33 2k74 h LEU 17 Ca -0.01 -0.32 -0.14 0.00 -0.12 0.00 0.00 57.88 57.29 2k74 h LEU 17 Cb 1.15 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.88 2k74 h LEU 17 CO 0.07 1.03 -0.64 0.00 -0.62 0.00 0.00 178.44 178.29 2k74 h MET 18 N 0.46 0.10 0.13 1.25 -0.00 -1.24 -2.94 114.93 112.69 2k74 h MET 18 Ca 0.02 -0.08 -0.01 0.00 -0.00 0.00 0.00 59.70 59.64 2k74 h MET 18 Cb 1.04 0.01 0.00 0.00 -0.00 0.00 0.00 31.60 32.65 2k74 h MET 18 CO 0.10 0.70 -0.06 0.00 -0.00 0.00 0.00 176.91 177.65 2k74 h ALA 19 N 1.28 -0.18 -0.66 -3.00 0.00 -1.35 -2.99 119.26 112.36 2k74 h ALA 19 Ca -0.01 -0.24 0.14 0.00 0.00 0.00 0.00 54.91 54.80 2k74 h ALA 19 Cb 1.14 0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.89 2k74 h ALA 19 CO 0.09 -0.31 0.05 0.35 0.00 0.00 0.00 179.25 179.44 2k74 h PHE 20 N -0.77 0.05 0.37 0.00 3.04 -1.34 -0.63 116.94 117.67 2k74 h PHE 20 Ca -0.02 0.05 -0.01 0.00 3.98 0.00 0.00 57.97 61.97 2k74 h PHE 20 Cb 0.54 0.08 -0.02 0.00 2.56 0.00 0.00 35.95 39.11 2k74 h PHE 20 CO 0.09 -0.15 -0.41 1.79 -2.02 0.00 0.00 178.31 177.62 2k74 h THR 21 N 0.16 0.00 -1.01 4.41 1.35 -1.57 0.43 112.91 116.68 2k74 h THR 21 Ca 0.35 0.00 0.23 0.00 -0.55 0.00 0.00 66.41 66.45 2k74 h THR 21 Cb 0.58 0.00 -0.12 0.00 -1.73 0.00 0.00 68.15 66.89 2k74 h THR 21 CO -0.53 0.00 0.60 0.00 -0.25 0.00 0.00 175.52 175.34 2k74 h ALA 22 N -1.05 1.79 -0.34 6.62 0.00 -1.27 0.78 119.26 125.79 2k74 h ALA 22 Ca -0.05 0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 2k74 h ALA 22 Cb 0.69 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2k74 h ALA 22 CO -0.07 -0.24 -0.31 1.25 0.00 0.00 0.00 179.25 179.89 2k74 h LEU 23 N 0.62 0.87 -1.34 0.00 6.46 -0.50 -3.03 115.31 118.38 2k74 h LEU 23 Ca 0.63 -0.46 0.24 0.00 -0.12 0.00 0.00 57.88 58.17 2k74 h LEU 23 Cb 1.16 -0.24 -0.09 0.00 -0.73 0.00 0.00 40.66 40.76 2k74 h LEU 23 CO -0.44 1.15 0.64 0.00 -0.62 0.00 0.00 178.44 179.17 2k74 h ALA 24 N 0.75 2.13 -0.17 1.25 0.00 0.23 0.24 119.26 123.69 2k74 h ALA 24 Ca 0.06 0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.85 2k74 h ALA 24 Cb 0.89 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 2k74 h ALA 24 CO 0.08 -0.50 -0.59 -0.07 0.00 0.00 0.00 179.25 178.16 2k74 h LEU 25 N 0.46 0.63 -0.38 0.00 4.07 -1.38 -1.03 115.31 117.68 2k74 h LEU 25 Ca 0.56 -0.35 0.00 0.00 0.08 0.00 0.00 57.88 58.17 2k74 h LEU 25 Cb 1.32 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.86 2k74 h LEU 25 CO -0.28 1.08 0.25 -0.08 -1.08 0.00 0.00 178.44 178.32 2k74 h GLU 26 N 0.42 0.49 -0.01 1.13 4.81 -0.49 -2.12 114.58 118.82 2k74 h GLU 26 Ca -0.00 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 2k74 h GLU 26 Cb 1.15 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2k74 h GLU 26 CO 0.11 0.33 -0.11 1.25 -0.73 0.00 0.00 179.01 179.86 2k74 h LEU 27 N 0.51 0.11 -0.91 1.64 5.85 -1.43 -2.34 115.31 118.74 2k74 h LEU 27 Ca 0.14 -0.75 0.25 0.00 0.84 0.00 0.00 57.88 58.35 2k74 h LEU 27 Cb -0.06 -0.03 -0.14 0.00 0.37 0.00 0.00 40.66 40.80 2k74 h LEU 27 CO -0.03 0.84 0.35 0.74 -0.34 0.00 0.00 178.44 180.00 2k74 h THR 28 N -0.62 0.37 0.00 1.05 2.02 -1.16 0.80 112.91 115.37 2k74 h THR 28 Ca -0.01 -0.10 -0.15 0.00 0.77 0.00 0.00 66.41 66.92 2k74 h THR 28 Cb 0.86 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 2k74 h THR 28 CO 0.02 0.05 -0.71 0.00 0.37 0.00 0.00 175.52 175.26 2k74 h ALA 29 N 1.77 0.65 0.00 6.16 0.00 -1.44 -3.06 119.26 123.34 2k74 h ALA 29 Ca 0.59 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2k74 h ALA 29 Cb 1.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2k74 h ALA 29 CO -0.60 0.88 0.00 1.25 0.00 0.00 0.00 179.25 180.78 2k74 h LEU 30 N 0.00 0.00 0.11 0.00 5.85 0.12 -2.63 115.31 118.76 2k74 h LEU 30 Ca -0.01 0.00 -0.36 0.00 0.84 0.00 0.00 57.88 58.35 2k74 h LEU 30 Cb 1.41 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 2k74 h LEU 30 CO 0.09 0.00 -1.99 1.87 -0.34 0.00 0.00 178.44 178.08 2k74 n TRP 31 N -2.86 1.14 -0.26 1.25 -0.00 -0.69 -3.50 117.44 112.52 2k74 n TRP 31 Ca -0.01 0.26 0.06 0.00 -0.00 0.00 0.00 57.50 57.81 2k74 n TRP 31 Cb 0.16 -1.15 0.20 0.00 -0.00 0.00 0.00 31.31 30.52 2k74 n TRP 31 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 177.69 178.43 2k74 h PHE 32 N -0.02 0.44 0.00 5.87 -1.00 -1.42 0.35 116.94 121.15 2k74 h PHE 32 Ca -0.43 0.04 -0.11 0.00 2.81 0.00 0.00 57.97 60.28 2k74 h PHE 32 Cb 1.97 -0.08 -0.02 0.00 3.61 0.00 0.00 35.95 41.43 2k74 h PHE 32 CO 0.07 -0.01 -0.50 -0.56 -1.61 0.00 0.00 178.31 175.70 2k74 h GLN 33 N 0.37 0.00 0.00 1.51 3.07 -1.70 0.68 115.11 119.04 2k74 h GLN 33 Ca 0.43 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 59.12 2k74 h GLN 33 Cb 0.72 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.27 2k74 h GLN 33 CO -0.46 0.50 -0.26 1.25 0.09 0.00 0.00 178.83 179.95 2k74 h HIS 34 N 0.00 0.00 0.00 0.06 2.76 -0.42 -0.37 115.15 117.18 2k74 h HIS 34 Ca -0.01 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 57.87 2k74 h HIS 34 Cb 1.01 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.93 2k74 h HIS 34 CO 0.00 0.26 -2.03 1.55 -1.30 0.00 0.00 177.93 176.42 2k74 n VAL 35 N -3.47 1.02 1.66 5.26 3.14 -0.23 -4.49 118.33 121.22 2k74 n VAL 35 Ca -0.00 -0.32 0.09 0.00 -2.96 0.00 0.00 64.34 61.14 2k74 n VAL 35 Cb 0.43 -1.44 0.42 0.00 -1.06 0.00 0.00 33.84 32.19 2k74 n VAL 35 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 2k74 n MET 36 N -3.43 1.30 -4.27 1.45 2.81 0.24 -4.89 117.12 110.32 2k74 n MET 36 Ca -0.34 -0.46 -0.36 0.00 -1.81 0.00 0.00 57.70 54.73 2k74 n MET 36 Cb 0.80 -1.30 -0.04 0.00 -0.71 0.00 0.00 33.22 31.96 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 -0.30 -1.51 -4.84 4.03 4.77 -0.16 -4.90 117.00 114.10 2k74 n LEU 37 Ca 0.13 -1.09 -0.32 0.00 -0.03 0.00 0.00 56.01 54.70 2k74 n LEU 37 Cb 0.17 -1.95 -0.04 0.00 -2.33 0.00 0.00 43.42 39.26 2k74 n LEU 37 CO 0.10 0.28 0.66 -0.76 -1.33 0.00 0.00 177.39 176.35 2k74 s LEU 38 N -7.24 3.69 -0.11 2.23 1.43 -1.15 -5.04 118.68 112.50 2k74 s LEU 38 Ca 0.61 1.56 0.03 0.00 -1.03 0.00 0.00 54.13 55.29 2k74 s LEU 38 Cb -0.34 -4.48 -0.01 0.00 0.03 0.00 0.00 46.19 41.40 2k74 s LEU 38 CO 0.95 -0.54 -0.20 -0.54 0.23 0.00 0.00 176.35 176.26 2k74 s LYS 39 N -3.91 3.14 1.09 1.70 1.02 -1.26 -4.79 119.74 116.74 2k74 s LYS 39 Ca 0.59 -0.81 -0.18 0.00 0.02 0.00 0.00 55.97 55.59 2k74 s LYS 39 Cb -0.10 -2.41 0.26 0.00 -0.52 0.00 0.00 37.83 35.06 2k74 s LYS 39 CO 0.28 0.21 1.25 -1.25 -0.92 0.00 0.00 175.35 174.92 2k74 s PRO 40 N 0.31 -0.39 0.23 -1.68 0.04 -1.24 -4.80 135.00 127.47 2k74 s PRO 40 Ca -0.15 -0.37 0.03 0.00 0.04 0.00 0.00 61.00 60.54 2k74 s PRO 40 Cb -0.17 -1.72 -0.01 0.00 0.04 0.00 0.00 34.50 32.64 2k74 s PRO 40 CO 0.08 -3.11 0.09 0.00 0.04 0.00 0.00 177.00 174.10 2k74 h VAL 42 N 1.42 1.24 0.01 0.00 2.07 -1.89 -2.53 116.25 116.56 2k74 h VAL 42 Ca -0.18 -0.82 -0.00 0.00 0.82 0.00 0.00 66.70 66.53 2k74 h VAL 42 Cb 0.70 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.82 2k74 h VAL 42 CO 0.28 0.25 -0.00 -0.07 0.02 0.00 0.00 177.57 178.05 2k74 h LEU 43 N 0.16 -0.01 -0.48 2.57 3.38 -1.95 -2.15 115.31 116.83 2k74 h LEU 43 Ca 0.06 -0.40 0.10 0.00 0.09 0.00 0.00 57.88 57.74 2k74 h LEU 43 Cb 0.36 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.01 2k74 h LEU 43 CO 0.01 0.39 -0.17 0.28 0.09 0.00 0.00 178.44 179.04 2k74 h SER 44 N -0.41 -0.61 -0.79 -0.43 0.02 -1.97 0.14 113.55 109.50 2k74 h SER 44 Ca -0.00 0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 2k74 h SER 44 Cb 0.41 0.36 -0.04 0.00 0.14 0.00 0.00 62.40 63.27 2k74 h SER 44 CO 0.00 -0.21 0.41 0.40 -1.14 0.00 0.00 176.83 176.29 2k74 h ILE 45 N -0.06 1.24 -0.58 3.27 2.04 -1.47 -2.44 117.51 119.51 2k74 h ILE 45 Ca 0.23 -0.64 0.08 0.00 1.00 0.00 0.00 64.86 65.54 2k74 h ILE 45 Cb 0.42 0.21 -0.07 0.00 -0.74 0.00 0.00 36.82 36.65 2k74 h ILE 45 CO -0.53 0.28 0.23 0.22 0.00 0.00 0.00 178.15 178.35 2k74 h TYR 46 N 1.10 0.41 -0.99 1.37 5.03 -0.33 -0.36 116.97 123.20 2k74 h TYR 46 Ca 0.27 0.03 0.02 0.00 2.58 0.00 0.00 58.73 61.63 2k74 h TYR 46 Cb 0.07 -0.10 -0.05 0.00 1.55 0.00 0.00 36.73 38.20 2k74 h TYR 46 CO 0.01 0.13 0.65 0.93 -1.32 0.00 0.00 178.16 178.56 2k74 h GLU 47 N 0.43 1.27 -0.69 1.82 5.08 -0.73 -1.10 114.58 120.67 2k74 h GLU 47 Ca 0.29 -0.08 0.06 0.00 -1.00 0.00 0.00 59.36 58.63 2k74 h GLU 47 Cb 0.32 -0.29 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 2k74 h GLU 47 CO -0.27 0.84 0.45 -0.09 -1.00 0.00 0.00 179.01 178.94 2k74 h ARG 48 N 1.31 0.71 -0.35 2.33 2.43 -0.66 -1.13 114.38 119.01 2k74 h ARG 48 Ca 0.37 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.36 2k74 h ARG 48 Cb -0.10 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.28 2k74 h ARG 48 CO -0.10 0.47 -0.36 0.00 -1.51 0.00 0.00 179.97 178.48 2k74 h ALA 49 N 1.62 0.71 -0.07 2.80 0.00 -0.52 0.44 119.26 124.25 2k74 h ALA 49 Ca 0.29 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2k74 h ALA 49 Cb 0.22 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2k74 h ALA 49 CO -0.09 0.66 -0.02 0.00 0.00 0.00 0.00 179.25 179.80 2k74 h ALA 50 N 0.93 0.05 0.02 0.00 0.00 -0.63 0.88 119.26 120.50 2k74 h ALA 50 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2k74 h ALA 50 Cb 0.91 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2k74 h ALA 50 CO 0.08 -0.49 -0.01 1.25 0.00 0.00 0.00 179.25 180.08 2k74 h LEU 51 N 0.00 -0.02 -1.06 0.00 5.85 -1.40 -2.82 115.31 115.85 2k74 h LEU 51 Ca 0.04 -0.73 0.28 0.00 0.84 0.00 0.00 57.88 58.31 2k74 h LEU 51 Cb 0.05 0.01 -0.13 0.00 0.37 0.00 0.00 40.66 40.96 2k74 h LEU 51 CO -0.07 0.76 0.61 0.15 -0.34 0.00 0.00 178.44 179.54 2k74 h PHE 52 N -0.85 0.92 -0.37 1.25 3.57 -0.11 0.46 116.94 121.83 2k74 h PHE 52 Ca -0.00 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 2k74 h PHE 52 Cb 0.75 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 2k74 h PHE 52 CO 0.19 -0.03 -0.03 0.78 -2.23 0.00 0.00 178.31 177.00 2k74 h GLY 53 N 0.45 0.72 1.02 2.40 0.00 -0.85 -2.67 103.07 104.14 2k74 h GLY 53 Ca 0.68 -0.55 -0.07 0.00 0.00 0.00 0.00 47.33 47.39 2k74 h GLY 53 CO -0.50 0.50 0.08 -2.08 0.00 0.00 0.00 176.54 174.54 2k74 h VAL 54 N 0.47 1.26 -0.44 4.60 2.07 -0.03 -1.52 116.25 122.65 2k74 h VAL 54 Ca 0.10 -0.99 0.09 0.00 0.82 0.00 0.00 66.70 66.71 2k74 h VAL 54 Cb 0.50 0.80 -0.09 0.00 -1.52 0.00 0.00 31.29 30.99 2k74 h VAL 54 CO 0.02 0.36 -0.13 0.25 0.02 0.00 0.00 177.57 178.09 2k74 h LEU 55 N 0.84 -0.48 -0.26 2.57 5.85 -0.27 0.57 115.31 124.12 2k74 h LEU 55 Ca 0.17 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 2k74 h LEU 55 Cb 0.43 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2k74 h LEU 55 CO 0.01 -0.17 0.12 1.23 -0.34 0.00 0.00 178.44 179.30 2k74 h GLY 56 N -0.03 0.40 0.03 3.75 0.00 -1.27 -2.17 103.07 103.78 2k74 h GLY 56 Ca 0.21 -0.20 0.23 0.00 0.00 0.00 0.00 47.33 47.57 2k74 h GLY 56 CO -0.47 0.19 0.63 0.00 0.00 0.00 0.00 176.54 176.90 2k74 h ALA 57 N 0.98 2.04 0.00 3.60 0.00 -0.14 0.98 119.26 126.73 2k74 h ALA 57 Ca 0.09 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 2k74 h ALA 57 Cb 0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2k74 h ALA 57 CO -0.01 -0.42 -0.37 0.00 0.00 0.00 0.00 179.25 178.45 2k74 h ALA 58 N 1.63 0.94 -0.15 0.00 0.00 -0.34 -1.84 119.26 119.50 2k74 h ALA 58 Ca 0.57 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 2k74 h ALA 58 Cb 1.25 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2k74 h ALA 58 CO -0.31 0.46 -0.43 1.25 0.00 0.00 0.00 179.25 180.23 2k74 h LEU 59 N 0.00 0.64 -0.61 0.00 6.46 0.15 0.16 115.31 122.12 2k74 h LEU 59 Ca -0.00 -0.59 -0.15 0.00 -0.12 0.00 0.00 57.88 57.02 2k74 h LEU 59 Cb 0.96 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.68 2k74 h LEU 59 CO 0.05 1.12 -0.69 0.40 -0.62 0.00 0.00 178.44 178.69 2k74 h ILE 60 N 0.20 1.48 0.00 4.05 1.08 -1.18 -3.11 117.51 120.03 2k74 h ILE 60 Ca -0.01 -2.32 -0.15 0.00 -0.39 0.00 0.00 64.86 62.00 2k74 h ILE 60 Cb 1.05 2.25 -0.02 0.00 -3.07 0.00 0.00 36.82 37.02 2k74 h ILE 60 CO 0.09 0.67 -0.81 1.23 -0.69 0.00 0.00 178.15 178.64 2k74 h GLY 61 N 1.95 0.00 1.30 5.37 0.00 -1.32 -3.19 103.07 107.17 2k74 h GLY 61 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2k74 h GLY 61 CO 0.09 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.63 2k74 n ALA 62 N -2.29 2.13 0.15 3.60 0.00 0.57 -1.51 120.51 123.16 2k74 n ALA 62 Ca -0.01 -0.11 0.10 0.00 0.00 0.00 0.00 53.44 53.42 2k74 n ALA 62 Cb 0.81 -1.32 0.07 0.00 0.00 0.00 0.00 19.45 19.02 2k74 n ALA 62 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2k74 h ILE 63 N 0.00 0.10 0.00 0.00 1.08 -1.60 -3.44 117.51 113.66 2k74 h ILE 63 Ca 0.00 -1.17 0.00 0.00 -0.39 0.00 0.00 64.86 63.30 2k74 h ILE 63 Cb 0.09 1.84 0.00 0.00 -3.07 0.00 0.00 36.82 35.68 2k74 h ILE 63 CO 0.00 0.06 0.00 0.00 -0.69 0.00 0.00 178.15 177.52 2k74 n ALA 64 N -2.16 0.00 0.92 1.87 0.00 -0.97 -5.02 120.51 115.15 2k74 n ALA 64 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.45 2k74 n ALA 64 Cb 0.58 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.04 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 1.09 0.00 0.00 -0.04 -0.57 -3.25 135.00 132.24 2k74 n PRO 65 Ca 0.00 -0.12 0.05 0.00 -0.04 0.00 0.00 63.50 63.40 2k74 n PRO 65 Cb 0.00 -1.25 -0.02 0.00 -0.04 0.00 0.00 33.50 32.19 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 0.26 2.50 -3.95 0.54 5.02 -1.26 -4.77 118.16 116.51 2k74 n LYS 66 Ca 0.02 -0.44 -0.25 0.00 -2.02 0.00 0.00 58.31 55.62 2k74 n LYS 66 Cb 0.44 -1.07 -0.04 0.00 -0.02 0.00 0.00 35.03 34.34 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 -1.61 2.00 -0.31 -0.18 -4.23 -1.20 -4.95 115.64 105.17 2k74 s THR 67 Ca 0.07 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 2k74 s THR 67 Cb 0.08 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.37 2k74 s THR 67 CO 0.32 0.00 0.62 -2.65 -0.54 0.00 0.00 174.62 172.37 2k74 n PRO 68 N -1.54 0.00 -0.17 3.99 -0.02 -1.26 -1.62 135.00 134.39 2k74 n PRO 68 Ca -0.02 0.14 0.28 0.00 -2.02 0.00 0.00 63.50 61.88 2k74 n PRO 68 Cb 0.64 -1.83 0.72 0.00 -0.02 0.00 0.00 33.50 33.01 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 0.00 -0.02 2.45 3.38 -1.93 -2.79 115.31 116.42 2k74 h LEU 69 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k74 h LEU 69 Cb 0.67 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 2k74 h LEU 69 CO 0.00 0.00 -0.01 0.03 0.09 0.00 0.00 178.44 178.55 2k74 h ARG 70 N 0.00 -0.00 -0.98 1.13 3.08 -1.60 0.57 114.38 116.58 2k74 h ARG 70 Ca 0.41 0.00 0.19 0.00 0.07 0.00 0.00 59.98 60.66 2k74 h ARG 70 Cb 1.66 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.61 2k74 h ARG 70 CO -0.01 -0.00 0.61 -0.92 -1.07 0.00 0.00 179.97 178.59 2k74 h TYR 71 N -0.00 0.93 0.37 3.04 5.03 -1.80 0.34 116.97 124.89 2k74 h TYR 71 Ca 0.00 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.33 2k74 h TYR 71 Cb 0.01 -0.28 -0.00 0.00 1.55 0.00 0.00 36.73 38.01 2k74 h TYR 71 CO -0.84 0.22 -0.20 0.28 -1.32 0.00 0.00 178.16 176.29 2k74 h VAL 72 N 0.68 0.58 -0.10 1.81 2.07 -0.29 -1.04 116.25 119.96 2k74 h VAL 72 Ca 0.55 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.95 2k74 h VAL 72 Cb 0.97 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 2k74 h VAL 72 CO -0.32 0.00 -0.46 0.00 0.02 0.00 0.00 177.57 176.80 2k74 h ALA 73 N 0.08 1.04 0.00 1.67 0.00 0.59 -2.57 119.26 120.07 2k74 h ALA 73 Ca -0.05 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2k74 h ALA 73 Cb 0.43 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2k74 h ALA 73 CO 0.06 0.63 -0.03 1.98 0.00 0.00 0.00 179.25 181.89 2k74 h MET 74 N 0.19 0.00 -0.96 0.00 -1.53 -0.03 -2.24 114.93 110.36 2k74 h MET 74 Ca 0.01 0.00 0.20 0.00 -3.44 0.00 0.00 59.70 56.47 2k74 h MET 74 Cb 0.90 0.00 -0.09 0.00 -0.55 0.00 0.00 31.60 31.86 2k74 h MET 74 CO 0.07 0.03 0.61 0.28 0.14 0.00 0.00 176.91 178.05 2k74 h VAL 75 N 0.00 0.69 0.14 -5.77 2.07 -0.76 -0.47 116.25 112.14 2k74 h VAL 75 Ca -0.00 -0.20 -0.33 0.00 0.82 0.00 0.00 66.70 66.99 2k74 h VAL 75 Cb 0.08 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 29.91 2k74 h VAL 75 CO 0.00 0.11 -1.66 0.40 0.02 0.00 0.00 177.57 176.44 2k74 h ILE 76 N 0.58 1.02 -0.16 4.57 2.04 -1.59 -2.85 117.51 121.12 2k74 h ILE 76 Ca 0.53 -2.65 0.03 0.00 1.00 0.00 0.00 64.86 63.76 2k74 h ILE 76 Cb 1.06 2.73 -0.02 0.00 -0.74 0.00 0.00 36.82 39.85 2k74 h ILE 76 CO -0.27 0.82 0.01 -0.25 0.00 0.00 0.00 178.15 178.46 2k74 h TRP 77 N 0.08 0.01 -0.20 1.37 7.01 -1.22 -1.46 115.95 121.53 2k74 h TRP 77 Ca -0.30 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 60.69 2k74 h TRP 77 Cb 2.05 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 29.12 2k74 h TRP 77 CO 0.08 -0.01 0.02 1.25 -2.79 0.00 0.00 178.44 176.98 2k74 h LEU 78 N 0.06 0.33 -0.74 0.65 6.46 -1.27 0.62 115.31 121.43 2k74 h LEU 78 Ca 0.08 -0.28 0.17 0.00 -0.12 0.00 0.00 57.88 57.72 2k74 h LEU 78 Cb 0.09 -0.09 -0.13 0.00 -0.73 0.00 0.00 40.66 39.80 2k74 h LEU 78 CO -0.12 0.54 0.02 0.22 -0.62 0.00 0.00 178.44 178.47 2k74 h TYR 79 N 0.12 -0.02 0.00 1.25 3.20 -1.23 0.37 116.97 120.67 2k74 h TYR 79 Ca 0.06 0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.87 2k74 h TYR 79 Cb 0.35 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 2k74 h TYR 79 CO 0.03 -0.22 -0.54 0.66 -1.64 0.00 0.00 178.16 176.45 2k74 h SER 80 N 0.12 0.00 0.93 -2.11 4.64 -1.17 -2.55 113.55 113.40 2k74 h SER 80 Ca 0.40 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.68 2k74 h SER 80 Cb 0.70 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.80 2k74 h SER 80 CO -0.64 0.54 -0.48 0.00 -0.87 0.00 0.00 176.83 175.39 2k74 h ALA 81 N 1.46 -1.33 0.08 5.18 0.00 0.21 0.72 119.26 125.58 2k74 h ALA 81 Ca -0.01 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2k74 h ALA 81 Cb 1.38 0.54 0.00 0.00 0.00 0.00 0.00 17.79 19.71 2k74 h ALA 81 CO 0.07 -1.25 -0.04 0.74 0.00 0.00 0.00 179.25 178.77 2k74 h PHE 82 N -1.28 -0.10 -0.49 0.00 -1.00 -1.39 -2.51 116.94 110.16 2k74 h PHE 82 Ca -0.13 -0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.59 2k74 h PHE 82 Cb 1.00 0.03 -0.02 0.00 3.61 0.00 0.00 35.95 40.57 2k74 h PHE 82 CO -0.02 0.45 0.05 -0.09 -1.61 0.00 0.00 178.31 177.09 2k74 h ARG 83 N -0.83 0.84 -0.31 1.51 9.65 -1.57 0.32 114.38 123.99 2k74 h ARG 83 Ca -0.01 -0.24 -0.02 0.00 -1.10 0.00 0.00 59.98 58.61 2k74 h ARG 83 Cb 0.60 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.08 2k74 h ARG 83 CO 0.02 0.85 0.11 0.78 2.80 0.00 0.00 179.97 184.53 2k74 h GLY 84 N 0.71 0.51 0.51 2.80 0.00 0.35 -2.50 103.07 105.44 2k74 h GLY 84 Ca 0.15 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 2k74 h GLY 84 CO 0.02 0.27 -0.11 -2.08 0.00 0.00 0.00 176.54 174.64 2k74 h VAL 85 N 0.35 0.80 -1.12 4.60 2.07 -1.37 -1.27 116.25 120.31 2k74 h VAL 85 Ca 0.10 -0.88 0.33 0.00 0.82 0.00 0.00 66.70 67.07 2k74 h VAL 85 Cb 0.22 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 2k74 h VAL 85 CO -0.01 0.17 0.86 -0.61 0.02 0.00 0.00 177.57 178.01 2k74 h GLN 86 N -0.79 0.00 0.18 1.57 5.75 -0.39 0.30 115.11 121.73 2k74 h GLN 86 Ca -0.03 0.00 -0.35 0.00 -0.15 0.00 0.00 58.65 58.12 2k74 h GLN 86 Cb 0.51 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.07 2k74 h GLN 86 CO 0.05 0.00 -1.73 1.25 -2.65 0.00 0.00 178.83 175.75 2k74 h LEU 87 N 0.00 0.60 -1.98 -2.39 5.85 -1.34 -3.30 115.31 112.75 2k74 h LEU 87 Ca 0.53 -0.89 0.06 0.00 0.84 0.00 0.00 57.88 58.42 2k74 h LEU 87 Cb 2.25 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 43.08 2k74 h LEU 87 CO -0.01 1.75 0.39 0.71 -0.34 0.00 0.00 178.44 180.94 2k74 h THR 88 N 0.11 0.21 0.01 1.05 1.35 0.83 0.23 112.91 116.69 2k74 h THR 88 Ca -0.33 0.00 -0.26 0.00 -0.55 0.00 0.00 66.41 65.27 2k74 h THR 88 Cb 2.10 0.66 0.02 0.00 -1.73 0.00 0.00 68.15 69.20 2k74 h THR 88 CO 0.18 0.00 -1.02 0.22 -0.25 0.00 0.00 175.52 174.65 2k74 h TYR 89 N 0.00 1.00 -1.00 4.73 3.20 -1.53 -2.79 116.97 120.58 2k74 h TYR 89 Ca 0.10 -0.56 0.08 0.00 3.14 0.00 0.00 58.73 61.50 2k74 h TYR 89 Cb 0.88 -0.11 -0.07 0.00 1.54 0.00 0.00 36.73 38.96 2k74 h TYR 89 CO 0.00 1.39 0.64 0.93 -1.64 0.00 0.00 178.16 179.49 2k74 h GLU 90 N 0.33 1.08 -0.02 1.82 4.39 -0.67 0.44 114.58 121.95 2k74 h GLU 90 Ca -0.13 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.50 2k74 h GLU 90 Cb 1.68 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 30.09 2k74 h GLU 90 CO 0.20 0.71 -0.02 0.45 -1.16 0.00 0.00 179.01 179.20 2k74 h HIS 91 N 1.11 0.05 -0.01 4.33 3.86 -1.54 -2.92 115.15 120.04 2k74 h HIS 91 Ca 0.46 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.65 2k74 h HIS 91 Cb 0.28 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.74 2k74 h HIS 91 CO -0.00 0.49 0.00 1.79 0.86 0.00 0.00 177.93 181.07 2k74 h THR 92 N -0.40 1.08 -0.75 2.45 1.35 -1.16 -0.80 112.91 114.69 2k74 h THR 92 Ca 0.00 -0.23 0.17 0.00 -0.55 0.00 0.00 66.41 65.80 2k74 h THR 92 Cb 0.48 1.23 -0.12 0.00 -1.73 0.00 0.00 68.15 68.00 2k74 h THR 92 CO 0.00 0.06 0.09 -0.03 -0.25 0.00 0.00 175.52 175.39 2k74 h MET 93 N -0.09 0.16 -0.27 4.72 -1.53 -0.19 0.54 114.93 118.28 2k74 h MET 93 Ca 0.00 -0.01 -0.08 0.00 -3.44 0.00 0.00 59.70 56.17 2k74 h MET 93 Cb 0.10 -0.04 -0.01 0.00 -0.55 0.00 0.00 31.60 31.10 2k74 h MET 93 CO -0.00 0.11 -0.14 -0.07 0.14 0.00 0.00 176.91 176.95 2k74 h LEU 94 N 0.17 0.59 -0.32 3.39 3.38 -1.30 1.31 115.31 122.53 2k74 h LEU 94 Ca 0.42 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2k74 h LEU 94 Cb 0.75 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 2k74 h LEU 94 CO -0.60 0.88 0.18 -0.61 0.09 0.00 0.00 178.44 178.38 2k74 h GLN 95 N 0.30 0.36 0.00 1.13 -0.00 0.50 2.16 115.11 119.57 2k74 h GLN 95 Ca 0.06 -0.02 -0.13 0.00 -0.00 0.00 0.00 58.65 58.56 2k74 h GLN 95 Cb 0.66 -0.08 -0.02 0.00 0.00 0.00 0.00 27.48 28.04 2k74 h GLN 95 CO 0.04 0.24 -0.65 -0.07 0.00 0.00 0.00 178.83 178.39 2k74 h LEU 96 N 0.37 0.00 -5.81 -2.39 3.38 0.00 -3.39 115.31 107.48 2k74 h LEU 96 Ca 0.13 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.61 2k74 h LEU 96 Cb 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 40.41 2k74 h LEU 96 CO -0.06 0.58 -1.00 0.00 0.09 0.00 0.00 178.44 178.05 2k74 n TYR 97 N -3.21 -0.86 -1.22 1.13 9.36 0.45 -5.06 117.16 117.74 2k74 n TYR 97 Ca 0.01 -3.25 -0.36 0.00 3.32 0.00 0.00 57.90 57.61 2k74 n TYR 97 Cb 0.77 0.01 0.07 0.00 -0.63 0.00 0.00 39.34 39.57 2k74 n TYR 97 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 2k74 n PRO 98 N 1.30 0.25 -2.87 2.98 -0.02 0.73 -4.16 135.00 133.20 2k74 n PRO 98 Ca 0.19 0.12 -0.12 0.00 -2.02 0.00 0.00 63.50 61.68 2k74 n PRO 98 Cb 0.57 -1.81 0.05 0.00 -0.02 0.00 0.00 33.50 32.29 2k74 n PRO 98 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2k74 n SER 99 N -0.27 -1.24 -4.80 2.55 7.64 -1.26 -5.00 113.62 111.23 2k74 n SER 99 Ca 0.10 -3.40 -0.31 0.00 1.01 0.00 0.00 58.87 56.26 2k74 n SER 99 Cb 0.50 1.03 0.05 0.00 -1.01 0.00 0.00 64.21 64.79 2k74 n SER 99 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2k74 s PRO 100 N -0.66 2.82 0.09 1.43 0.04 -1.26 -5.08 135.00 132.38 2k74 s PRO 100 Ca 0.28 1.06 0.01 0.00 0.04 0.00 0.00 61.00 62.38 2k74 s PRO 100 Cb 0.32 -1.97 -0.00 0.00 0.04 0.00 0.00 34.50 32.88 2k74 s PRO 100 CO -0.06 -1.20 0.04 1.19 0.04 0.00 0.00 177.00 177.01 2k74 n PHE 101 N -3.06 0.01 0.84 0.56 3.01 -1.26 -5.00 117.46 112.57 2k74 n PHE 101 Ca 0.08 -0.63 0.00 0.00 1.01 0.00 0.00 57.45 57.91 2k74 n PHE 101 Cb 0.53 0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.01 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 -2.53 2.19 -3.38 4.37 0.00 -1.26 -4.75 120.51 115.16 2k74 n ALA 102 Ca -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.40 2k74 n ALA 102 Cb 0.15 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 0.06 0.00 -2.70 0.00 -2.24 -1.26 -5.12 114.28 103.03 2k74 n THR 103 Ca 0.00 -0.05 -0.06 0.00 -2.27 0.00 0.00 64.05 61.67 2k74 n THR 103 Cb 0.18 0.02 0.08 0.00 -2.10 0.00 0.00 70.33 68.52 2k74 n THR 103 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2k74 n SER 104 N -2.28 -1.85 -2.27 3.42 3.41 -1.26 -5.09 113.62 107.70 2k74 n SER 104 Ca -0.00 -2.52 0.00 0.00 -0.26 0.00 0.00 58.87 56.09 2k74 n SER 104 Cb 0.01 1.32 0.00 0.00 -0.26 0.00 0.00 64.21 65.29 2k74 n SER 104 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2k74 n ASP 105 N 1.04 0.00 -3.39 4.04 8.00 -1.26 -4.69 116.55 120.30 2k74 n ASP 105 Ca 0.02 -0.72 -0.12 0.00 0.71 0.00 0.00 54.79 54.68 2k74 n ASP 105 Cb 0.70 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.81 2k74 n ASP 105 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2k74 n PHE 106 N -1.44 -2.54 -3.67 1.24 3.72 -1.26 -5.02 117.46 108.49 2k74 n PHE 106 Ca 0.00 0.97 -0.09 0.00 -0.05 0.00 0.00 57.45 58.28 2k74 n PHE 106 Cb 0.00 -3.56 -0.09 0.00 -0.94 0.00 0.00 39.48 34.89 2k74 n PHE 106 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2k74 s MET 107 N -3.98 0.47 -1.01 -1.08 0.23 -1.26 -4.91 119.30 107.76 2k74 s MET 107 Ca 0.04 0.98 -0.16 0.00 -1.03 0.00 0.00 55.69 55.53 2k74 s MET 107 Cb -0.01 0.13 0.01 0.00 -1.53 0.00 0.00 34.83 33.42 2k74 s MET 107 CO 0.81 -0.17 0.69 0.28 -2.03 0.00 0.00 175.02 174.61 2k74 n VAL 108 N 4.52 -4.75 -3.57 5.16 0.31 -1.26 -4.98 118.33 113.76 2k74 n VAL 108 Ca -0.20 -0.49 -0.19 0.00 -0.01 0.00 0.00 64.34 63.46 2k74 n VAL 108 Cb 0.55 -3.67 -0.14 0.00 -0.91 0.00 0.00 33.84 29.67 2k74 n VAL 108 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 2k74 s ARG 109 N -5.69 0.12 0.21 5.55 3.52 -1.26 -5.03 118.95 116.37 2k74 s ARG 109 Ca 0.28 0.30 0.11 0.00 -0.13 0.00 0.00 55.73 56.28 2k74 s ARG 109 Cb -0.12 -0.96 -0.04 0.00 -1.56 0.00 0.00 34.95 32.26 2k74 s ARG 109 CO 0.89 -0.53 -0.21 -0.59 -0.81 0.00 0.00 175.30 174.05 2k74 s PHE 110 N 2.29 2.13 0.60 5.12 -0.12 -1.26 -5.06 117.98 121.68 2k74 s PHE 110 Ca 0.05 -0.39 -0.19 0.00 -0.05 0.00 0.00 56.93 56.35 2k74 s PHE 110 Cb -0.14 -1.02 -0.03 0.00 -0.63 0.00 0.00 43.02 41.19 2k74 s PHE 110 CO -0.09 0.50 1.20 -1.25 -0.05 0.00 0.00 175.22 175.52 2k74 s PRO 111 N -2.95 2.95 -0.07 1.99 0.04 -1.26 -4.94 135.00 130.76 2k74 s PRO 111 Ca 0.22 1.81 0.19 0.00 0.04 0.00 0.00 61.00 63.26 2k74 s PRO 111 Cb -0.06 -1.93 0.67 0.00 0.04 0.00 0.00 34.50 33.22 2k74 s PRO 111 CO 0.10 -1.22 1.57 -0.85 0.04 0.00 0.00 177.00 176.64 2k74 n GLU 112 N -1.65 3.30 0.00 4.56 0.28 -1.26 -4.11 120.64 121.77 2k74 n GLU 112 Ca 0.13 -2.76 0.00 0.00 -0.16 0.00 0.00 57.16 54.38 2k74 n GLU 112 Cb 0.50 -1.74 0.00 0.00 1.43 0.00 0.00 31.44 31.63 2k74 n GLU 112 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 177.13 174.30 2k74 n TRP 113 N 1.24 0.00 -3.84 -1.84 4.27 -1.26 -4.90 117.44 111.11 2k74 n TRP 113 Ca 0.24 0.00 -0.32 0.00 -3.89 0.00 0.00 57.50 53.53 2k74 n TRP 113 Cb 0.77 0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 30.60 2k74 n TRP 113 CO 0.00 0.00 0.00 -1.17 -2.29 0.00 0.00 177.69 174.23 2k74 s LEU 114 N -0.44 4.84 0.00 5.67 2.96 -1.26 -4.94 118.68 125.51 2k74 s LEU 114 Ca 0.00 -3.29 0.00 0.00 -0.22 0.00 0.00 54.13 50.62 2k74 s LEU 114 Cb 0.00 -1.73 0.00 0.00 0.50 0.00 0.00 46.19 44.96 2k74 s LEU 114 CO 0.00 -0.22 0.07 -2.65 -1.32 0.00 0.00 176.35 172.23 2k74 n PRO 115 N 2.80 0.00 0.16 0.98 -0.02 -1.26 -1.91 135.00 135.75 2k74 n PRO 115 Ca 0.12 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.62 2k74 n PRO 115 Cb 0.35 -1.10 0.21 0.00 -0.02 0.00 0.00 33.50 32.95 2k74 n PRO 115 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2k74 h LEU 116 N 0.00 0.00 0.04 2.45 -0.00 -1.94 0.73 115.31 116.59 2k74 h LEU 116 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 57.88 57.50 2k74 h LEU 116 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.61 2k74 h LEU 116 CO 0.00 0.52 -2.28 -0.90 -0.00 0.00 0.00 178.44 175.78 2k74 n ASP 117 N -3.58 2.02 -0.06 -0.43 5.75 -0.80 -3.28 116.55 116.18 2k74 n ASP 117 Ca -0.00 0.03 -0.14 0.00 -0.01 0.00 0.00 54.79 54.67 2k74 n ASP 117 Cb 0.60 -0.61 -0.07 0.00 -1.03 0.00 0.00 41.12 40.01 2k74 n ASP 117 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 2k74 h LYS 118 N -0.08 0.44 0.00 0.11 1.79 -1.70 0.21 116.57 117.34 2k74 h LYS 118 Ca -0.53 -0.26 0.00 0.00 -2.18 0.00 0.00 60.65 57.68 2k74 h LYS 118 Cb 1.91 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.58 2k74 h LYS 118 CO -0.06 0.85 0.00 2.35 -1.08 0.00 0.00 179.45 181.51 2k74 h TRP 119 N 0.08 0.00 -1.91 -1.35 7.01 -1.07 -3.35 115.95 115.36 2k74 h TRP 119 Ca 0.02 0.00 -0.52 0.00 2.11 0.00 0.00 58.89 60.49 2k74 h TRP 119 Cb 0.80 0.00 -0.36 0.00 -2.10 0.00 0.00 29.16 27.50 2k74 h TRP 119 CO 0.09 0.00 -0.99 0.28 -2.79 0.00 0.00 178.44 175.03 2k74 n VAL 120 N -2.79 -0.78 0.36 2.65 0.31 -1.10 -4.95 118.33 112.03 2k74 n VAL 120 Ca 0.02 -3.48 0.13 0.00 -0.01 0.00 0.00 64.34 61.00 2k74 n VAL 120 Cb 0.35 -1.44 0.33 0.00 -0.91 0.00 0.00 33.84 32.16 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 4.57 0.00 0.00 5.55 0.13 -1.10 -3.13 132.00 138.02 2k74 h PRO 121 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2k74 h PRO 121 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 2k74 h PRO 121 CO 0.40 0.00 0.00 0.94 -0.23 0.00 0.00 178.00 179.11 2k74 n GLN 122 N -2.79 0.05 -2.66 0.86 7.27 -1.26 -1.80 117.38 117.05 2k74 n GLN 122 Ca 0.04 0.28 -0.09 0.00 0.07 0.00 0.00 57.00 57.30 2k74 n GLN 122 Cb 0.45 -1.60 0.03 0.00 2.41 0.00 0.00 30.24 31.54 2k74 n GLN 122 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2k74 n VAL 123 N -1.69 1.35 0.00 1.69 0.31 -1.18 -4.83 118.33 113.97 2k74 n VAL 123 Ca 0.03 -3.29 0.00 0.00 -0.01 0.00 0.00 64.34 61.07 2k74 n VAL 123 Cb 0.20 0.55 0.00 0.00 -0.91 0.00 0.00 33.84 33.68 2k74 n VAL 123 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 2k74 n PHE 124 N -0.34 0.00 -1.70 3.52 -0.00 -1.17 -5.01 117.46 112.76 2k74 n PHE 124 Ca 0.14 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 57.16 2k74 n PHE 124 Cb 0.81 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 40.25 2k74 n PHE 124 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.76 178.31 2k74 n VAL 125 N -1.18 0.02 -3.62 -2.13 3.14 -0.75 -4.98 118.33 108.83 2k74 n VAL 125 Ca 0.00 -0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.09 2k74 n VAL 125 Cb 0.00 -1.84 -0.04 0.00 -1.06 0.00 0.00 33.84 30.91 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 1.16 3.78 -0.29 1.55 0.00 -1.26 -4.99 121.76 121.71 2k74 s ALA 126 Ca 0.77 -0.68 -0.01 0.00 0.00 0.00 0.00 51.96 52.04 2k74 s ALA 126 Cb -0.56 -2.10 0.19 0.00 0.00 0.00 0.00 23.12 20.65 2k74 s ALA 126 CO 0.34 0.48 0.77 0.45 0.00 0.00 0.00 175.76 177.81 2k74 s SER 127 N -2.90 -1.14 0.00 0.00 0.15 -1.22 -4.56 113.70 104.02 2k74 s SER 127 Ca 0.40 0.15 0.00 0.00 0.70 0.00 0.00 55.95 57.20 2k74 s SER 127 Cb -0.11 1.73 0.00 0.00 -1.71 0.00 0.00 66.02 65.93 2k74 s SER 127 CO 0.28 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.12 2k74 n GLY 128 N 5.30 1.01 3.84 9.45 0.00 -1.19 -3.64 105.19 119.96 2k74 n GLY 128 Ca 0.06 -1.94 -0.34 0.00 0.00 0.00 0.00 46.02 43.81 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 -1.54 6.83 -0.20 1.61 2.15 -1.26 -4.75 116.67 119.51 2k74 s ASP 129 Ca 0.00 1.23 -0.10 0.00 0.43 0.00 0.00 52.55 54.11 2k74 s ASP 129 Cb 0.00 -2.35 -0.05 0.00 -0.30 0.00 0.00 42.92 40.22 2k74 s ASP 129 CO 0.00 -0.08 0.15 0.00 -0.17 0.00 0.00 175.17 175.06 2k74 n ALA 131 N 3.51 0.00 -2.11 0.00 0.00 -1.26 -5.03 120.51 115.62 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 -0.50 4.29 0.12 0.00 2.12 -1.26 -4.84 118.70 118.63 2k74 s GLU 132 Ca 0.00 2.14 -0.31 0.00 0.36 0.00 0.00 54.97 57.16 2k74 s GLU 132 Cb 0.00 -3.25 -0.09 0.00 0.26 0.00 0.00 34.13 31.05 2k74 s GLU 132 CO 0.00 -0.49 1.51 1.03 -0.54 0.00 0.00 175.26 176.78 2k74 s ARG 133 N 1.21 4.25 0.00 4.30 0.52 -1.26 -4.86 118.95 123.11 2k74 s ARG 133 Ca 0.66 2.23 0.00 0.00 -0.52 0.00 0.00 55.73 58.10 2k74 s ARG 133 Cb -0.38 -3.30 0.00 0.00 0.52 0.00 0.00 34.95 31.79 2k74 s ARG 133 CO 0.30 -0.57 0.00 1.04 0.02 0.00 0.00 175.30 176.09 2k74 n GLN 134 N 4.37 2.33 -3.65 3.54 1.13 -1.26 -5.09 117.38 118.76 2k74 n GLN 134 Ca 0.13 0.00 -0.03 0.00 -1.94 0.00 0.00 57.00 55.16 2k74 n GLN 134 Cb 0.40 -0.85 -0.07 0.00 0.11 0.00 0.00 30.24 29.84 2k74 n GLN 134 CO 0.00 0.00 0.00 -0.46 -1.44 0.00 0.00 177.06 175.16 2k74 s TRP 135 N -1.56 -0.23 0.07 1.08 -0.11 -1.26 -5.15 118.94 111.79 2k74 s TRP 135 Ca 0.00 0.51 -0.01 0.00 1.22 0.00 0.00 56.10 57.82 2k74 s TRP 135 Cb 0.00 0.36 -0.04 0.00 -1.50 0.00 0.00 33.47 32.29 2k74 s TRP 135 CO 0.00 -0.11 -0.01 0.16 -4.62 0.00 0.00 176.95 172.37 2k74 s ASP 136 N 0.43 0.46 -0.06 5.86 1.47 -1.26 -3.11 116.67 120.45 2k74 s ASP 136 Ca 0.01 -1.04 -0.02 0.00 1.18 0.00 0.00 52.55 52.68 2k74 s ASP 136 Cb -0.04 0.22 0.03 0.00 -0.34 0.00 0.00 42.92 42.79 2k74 s ASP 136 CO -0.12 -0.63 0.02 -0.36 0.68 0.00 0.00 175.17 174.76 2k74 s PHE 137 N -3.94 0.46 -0.10 2.11 0.08 0.68 -4.72 117.98 112.54 2k74 s PHE 137 Ca 0.11 -0.03 0.00 0.00 0.12 0.00 0.00 56.93 57.13 2k74 s PHE 137 Cb 0.08 -0.70 0.00 0.00 -0.57 0.00 0.00 43.02 41.83 2k74 s PHE 137 CO -0.07 -0.29 0.00 -0.11 -0.10 0.00 0.00 175.22 174.65 2k74 n LEU 138 N 5.20 -0.05 0.00 -0.37 7.94 -1.26 -2.60 117.00 125.86 2k74 n LEU 138 Ca -0.06 0.02 0.00 0.00 -1.11 0.00 0.00 56.01 54.87 2k74 n LEU 138 Cb 0.50 -0.65 0.00 0.00 0.53 0.00 0.00 43.42 43.80 2k74 n LEU 138 CO 0.09 -0.07 0.00 0.61 -1.11 0.00 0.00 177.39 176.91 2k74 n GLY 139 N -2.79 0.53 3.25 -3.96 0.00 -1.26 -5.04 105.19 95.92 2k74 n GLY 139 Ca -0.01 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 2k74 n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k74 s LEU 140 N 0.00 2.10 0.62 0.99 1.02 -1.07 -5.07 118.68 117.27 2k74 s LEU 140 Ca 0.00 -0.52 -0.14 0.00 0.02 0.00 0.00 54.13 53.49 2k74 s LEU 140 Cb 0.00 -1.39 -0.02 0.00 0.02 0.00 0.00 46.19 44.79 2k74 s LEU 140 CO 0.00 0.21 1.05 -1.61 0.02 0.00 0.00 176.35 176.03 2k74 s GLU 141 N 0.04 3.22 0.10 1.70 8.01 -1.26 -0.23 118.70 130.27 2k74 s GLU 141 Ca -0.10 1.10 -0.29 0.00 0.01 0.00 0.00 54.97 55.69 2k74 s GLU 141 Cb -0.15 -2.02 -0.11 0.00 -4.31 0.00 0.00 34.13 27.53 2k74 s GLU 141 CO 0.06 -0.88 1.48 0.52 0.01 0.00 0.00 175.26 176.44 2k74 h MET 142 N 0.06 -0.48 -0.78 1.61 2.86 -1.94 -1.01 114.93 115.25 2k74 h MET 142 Ca -0.46 0.03 0.31 0.00 -2.06 0.00 0.00 59.70 57.52 2k74 h MET 142 Cb 1.21 0.11 -0.14 0.00 0.06 0.00 0.00 31.60 32.84 2k74 h MET 142 CO 0.57 -0.32 0.36 -2.30 1.06 0.00 0.00 176.91 176.28 2k74 n PRO 143 N -5.03 -0.05 -0.03 -0.22 -0.02 -1.26 0.14 135.00 128.53 2k74 n PRO 143 Ca -0.05 1.09 -0.16 0.00 -2.02 0.00 0.00 63.50 62.36 2k74 n PRO 143 Cb 0.32 -1.92 -0.09 0.00 -0.02 0.00 0.00 33.50 31.80 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 0.47 0.56 -0.52 4.20 -1.58 -2.76 115.11 115.48 2k74 h GLN 144 Ca 0.63 -0.37 -0.03 0.00 0.06 0.00 0.00 58.65 58.94 2k74 h GLN 144 Cb 1.63 0.07 0.01 0.00 0.30 0.00 0.00 27.48 29.48 2k74 h GLN 144 CO -0.62 1.00 -0.27 -1.49 -0.67 0.00 0.00 178.83 176.79 2k74 h TRP 145 N 0.05 -0.69 -1.09 2.96 4.06 0.20 -2.60 115.95 118.82 2k74 h TRP 145 Ca -0.03 -0.02 0.36 0.00 2.06 0.00 0.00 58.89 61.27 2k74 h TRP 145 Cb 1.08 0.23 -0.14 0.00 -1.00 0.00 0.00 29.16 29.32 2k74 h TRP 145 CO 0.12 -0.37 0.65 1.25 -3.56 0.00 0.00 178.44 176.53 2k74 h LEU 146 N -1.06 0.41 -1.38 -4.49 6.46 -0.37 3.60 115.31 118.48 2k74 h LEU 146 Ca -0.08 0.18 -0.03 0.00 -0.12 0.00 0.00 57.88 57.83 2k74 h LEU 146 Cb 0.64 0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.69 2k74 h LEU 146 CO 0.13 -0.18 0.11 0.25 -0.62 0.00 0.00 178.44 178.13 2k74 h LEU 147 N 0.21 0.48 -0.07 2.25 5.85 -1.27 0.41 115.31 123.19 2k74 h LEU 147 Ca 0.76 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 59.42 2k74 h LEU 147 Cb 2.00 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.90 2k74 h LEU 147 CO -0.55 0.47 0.02 1.23 -0.34 0.00 0.00 178.44 179.27 2k74 h GLY 148 N 0.73 0.11 2.00 3.75 0.00 0.71 -2.26 103.07 108.12 2k74 h GLY 148 Ca 0.13 -0.07 -0.05 0.00 0.00 0.00 0.00 47.33 47.34 2k74 h GLY 148 CO -0.01 0.06 -0.23 -2.22 0.00 0.00 0.00 176.54 174.15 2k74 h ILE 149 N -0.08 0.87 -0.58 2.60 5.03 -0.80 -2.52 117.51 122.04 2k74 h ILE 149 Ca 0.02 -0.87 -0.09 0.00 -0.12 0.00 0.00 64.86 63.81 2k74 h ILE 149 Cb 0.21 1.51 -0.02 0.00 -3.03 0.00 0.00 36.82 35.49 2k74 h ILE 149 CO -0.00 0.22 0.00 0.15 -0.68 0.00 0.00 178.15 177.84 2k74 h PHE 150 N 0.00 1.09 -0.39 1.37 3.04 -0.51 -2.67 116.94 118.87 2k74 h PHE 150 Ca -0.00 -0.18 -0.09 0.00 3.98 0.00 0.00 57.97 61.68 2k74 h PHE 150 Cb 0.49 -0.29 -0.02 0.00 2.56 0.00 0.00 35.95 38.70 2k74 h PHE 150 CO 0.00 0.96 -0.14 0.97 -2.02 0.00 0.00 178.31 178.08 2k74 h ILE 151 N 0.92 1.26 -0.36 1.41 2.10 -0.98 -2.78 117.51 119.08 2k74 h ILE 151 Ca 0.17 -1.18 0.06 0.00 1.08 0.00 0.00 64.86 64.99 2k74 h ILE 151 Cb 0.53 1.11 -0.06 0.00 -1.09 0.00 0.00 36.82 37.32 2k74 h ILE 151 CO 0.03 0.40 0.01 0.00 -1.08 0.00 0.00 178.15 177.50 2k74 h ALA 152 N 1.21 0.33 -0.88 0.18 0.00 -1.31 -0.99 119.26 117.80 2k74 h ALA 152 Ca 0.11 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.17 2k74 h ALA 152 Cb 0.60 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 2k74 h ALA 152 CO 0.04 -0.39 0.56 1.88 0.00 0.00 0.00 179.25 181.34 2k74 h TYR 153 N 0.11 1.04 -0.64 0.00 -1.99 -1.32 0.07 116.97 114.23 2k74 h TYR 153 Ca 0.18 0.03 0.17 0.00 2.00 0.00 0.00 58.73 61.11 2k74 h TYR 153 Cb 0.24 -0.34 -0.03 0.00 2.00 0.00 0.00 36.73 38.60 2k74 h TYR 153 CO -0.24 0.55 0.45 1.25 -0.00 0.00 0.00 178.16 180.17 2k74 h LEU 154 N 1.04 0.08 0.03 3.88 5.85 -0.93 0.15 115.31 125.41 2k74 h LEU 154 Ca 0.37 0.01 -0.24 0.00 0.84 0.00 0.00 57.88 58.86 2k74 h LEU 154 Cb 0.11 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2k74 h LEU 154 CO -0.15 0.04 -1.09 0.40 -0.34 0.00 0.00 178.44 177.30 2k74 h ILE 155 N 0.09 1.61 -0.27 4.05 1.08 -0.58 -2.70 117.51 120.79 2k74 h ILE 155 Ca 0.31 -3.20 -0.04 0.00 -0.39 0.00 0.00 64.86 61.54 2k74 h ILE 155 Cb 1.10 2.86 -0.01 0.00 -3.07 0.00 0.00 36.82 37.70 2k74 h ILE 155 CO -0.03 0.92 0.03 0.58 -0.69 0.00 0.00 178.15 178.96 2k74 h VAL 156 N 0.04 1.24 0.07 1.67 2.07 -0.18 -2.87 116.25 118.29 2k74 h VAL 156 Ca -0.06 -0.84 -0.11 0.00 0.82 0.00 0.00 66.70 66.51 2k74 h VAL 156 Cb 1.83 1.27 0.01 0.00 -1.52 0.00 0.00 31.29 32.88 2k74 h VAL 156 CO 0.16 0.27 -0.45 0.00 0.02 0.00 0.00 177.57 177.57 2k74 h ALA 157 N 0.85 -0.04 -0.97 1.67 0.00 -1.54 -2.66 119.26 116.58 2k74 h ALA 157 Ca 0.08 -0.59 0.17 0.00 0.00 0.00 0.00 54.91 54.57 2k74 h ALA 157 Cb 0.37 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.11 2k74 h ALA 157 CO 0.01 0.21 0.57 -0.24 0.00 0.00 0.00 179.25 179.80 2k74 h VAL 158 N -0.58 0.73 0.08 0.00 3.04 -1.58 0.34 116.25 118.28 2k74 h VAL 158 Ca -0.08 -0.26 -0.25 0.00 -1.01 0.00 0.00 66.70 65.10 2k74 h VAL 158 Cb 1.32 -0.09 -0.01 0.00 -2.01 0.00 0.00 31.29 30.50 2k74 h VAL 158 CO 0.09 0.14 -1.16 -0.07 -1.01 0.00 0.00 177.57 175.55 2k74 h LEU 159 N 0.76 0.27 -0.87 3.16 3.38 -1.62 -2.88 115.31 117.50 2k74 h LEU 159 Ca 0.54 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 58.17 2k74 h LEU 159 Cb 0.80 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2k74 h LEU 159 CO -0.37 1.23 -0.27 0.58 0.09 0.00 0.00 178.44 179.70 2k74 h VAL 160 N 0.05 0.60 0.00 1.22 2.07 -0.82 -1.36 116.25 118.01 2k74 h VAL 160 Ca -0.09 -1.32 -0.02 0.00 0.82 0.00 0.00 66.70 66.10 2k74 h VAL 160 Cb 1.90 1.89 -0.00 0.00 -1.52 0.00 0.00 31.29 33.56 2k74 h VAL 160 CO 0.18 0.26 -0.08 0.58 0.02 0.00 0.00 177.57 178.53 2k74 h VAL 161 N 0.00 1.71 0.00 2.57 2.07 -0.44 -3.27 116.25 118.89 2k74 h VAL 161 Ca -0.00 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.21 2k74 h VAL 161 Cb 0.87 3.26 0.00 0.00 -1.52 0.00 0.00 31.29 33.90 2k74 h VAL 161 CO 0.03 0.58 0.00 -0.38 0.02 0.00 0.00 177.57 177.82 2k74 n ILE 162 N -4.60 0.86 0.32 4.57 2.08 -1.09 -2.91 119.36 118.59 2k74 n ILE 162 Ca -0.11 0.21 0.14 0.00 0.56 0.00 0.00 62.75 63.54 2k74 n ILE 162 Cb 0.48 -0.96 0.73 0.00 -0.75 0.00 0.00 39.64 39.14 2k74 n ILE 162 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 2k74 h SER 163 N 0.00 0.00 -6.58 4.38 0.02 -1.30 -3.45 113.55 106.62 2k74 h SER 163 Ca 0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 2k74 h SER 163 Cb 0.30 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 2k74 h SER 163 CO 0.00 0.00 -0.95 0.00 -1.14 0.00 0.00 176.83 174.74 2k74 n GLN 164 N -2.78 -1.43 0.00 3.45 6.02 -1.15 -4.75 117.38 116.75 2k74 n GLN 164 Ca -0.02 0.30 0.00 0.00 -0.01 0.00 0.00 57.00 57.27 2k74 n GLN 164 Cb 0.40 -3.71 0.00 0.00 1.02 0.00 0.00 30.24 27.95 2k74 n GLN 164 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2k74 n PRO 165 N -4.53 0.44 -3.75 -1.09 -0.04 -1.26 -4.57 135.00 120.20 2k74 n PRO 165 Ca -0.18 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.16 2k74 n PRO 165 Cb 0.62 -1.10 -0.13 0.00 -0.04 0.00 0.00 33.50 32.85 2k74 n PRO 165 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2k74 s PHE 166 N -1.55 -0.28 -0.03 0.54 5.36 -1.26 -5.06 117.98 115.71 2k74 s PHE 166 Ca 0.00 0.68 -0.24 0.00 -0.96 0.00 0.00 56.93 56.40 2k74 s PHE 166 Cb 0.00 0.04 -0.21 0.00 -0.34 0.00 0.00 43.02 42.51 2k74 s PHE 166 CO 0.00 -0.19 1.14 -0.22 -1.46 0.00 0.00 175.22 174.50 2k74 h LYS 167 N 6.75 0.15 0.00 10.12 3.64 -2.01 -3.44 116.57 131.77 2k74 h LYS 167 Ca -0.36 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2k74 h LYS 167 Cb 1.17 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2k74 h LYS 167 CO 0.38 0.76 0.00 0.00 -2.27 0.00 0.00 179.45 178.33 2k74 n ALA 168 N -2.46 0.00 -0.61 5.00 0.00 -1.26 -4.55 120.51 116.63 2k74 n ALA 168 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2k74 n ALA 168 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 2k74 n ALA 168 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2k74 n LYS 169 N 0.00 0.00 -0.04 0.00 4.81 -1.26 -4.74 118.16 116.93 2k74 n LYS 169 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.32 2k74 n LYS 169 Cb 0.00 -3.56 -0.14 0.00 0.02 0.00 0.00 35.03 31.35 2k74 n LYS 169 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2k74 n LYS 170 N -2.00 0.67 -0.63 1.64 4.81 -1.26 -5.05 118.16 116.35 2k74 n LYS 170 Ca 0.00 0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.65 2k74 n LYS 170 Cb 0.00 -1.69 0.00 0.00 0.02 0.00 0.00 35.03 33.36 2k74 n LYS 170 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 2k74 n ARG 171 N -3.08 0.00 -3.98 1.64 1.85 -1.26 -5.20 116.66 106.63 2k74 n ARG 171 Ca -0.26 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.48 2k74 n ARG 171 Cb 1.07 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 32.45 2k74 n ARG 171 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 2k74 s ASP 172 N 0.30 0.34 0.42 2.89 2.15 -1.26 -5.05 116.67 116.46 2k74 s ASP 172 Ca 0.00 -1.20 -0.24 0.00 0.43 0.00 0.00 52.55 51.54 2k74 s ASP 172 Cb 0.00 0.70 -0.11 0.00 -0.30 0.00 0.00 42.92 43.21 2k74 s ASP 172 CO 0.00 -1.36 0.94 0.00 -0.17 0.00 0.00 175.17 174.58 2k74 n LEU 173 N -0.50 2.23 -0.00 -1.34 -0.00 -1.26 -4.96 117.00 111.17 2k74 n LEU 173 Ca -0.02 1.02 -0.00 0.00 -0.00 0.00 0.00 56.01 57.00 2k74 n LEU 173 Cb 0.61 -1.32 -0.00 0.00 -0.00 0.00 0.00 43.42 42.71 2k74 n LEU 173 CO 0.26 -1.69 -0.00 -0.26 -0.00 0.00 0.00 177.39 175.69 2k74 h PHE 174 N 1.41 0.00 0.00 1.47 0.04 -2.08 -3.48 116.94 114.30 2k74 h PHE 174 Ca -0.44 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.33 2k74 h PHE 174 Cb 1.35 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.50 2k74 h PHE 174 CO 0.42 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.54 2k74 n GLY 175 N 1.94 2.74 2.68 -1.45 0.00 -1.26 -4.48 105.19 105.37 2k74 n GLY 175 Ca -0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 2k74 n GLY 175 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2k74 n ARG 176 N 14.00 0.45 -0.26 1.61 1.85 -1.26 -5.02 116.66 128.02 2k74 n ARG 176 Ca 0.00 -1.12 0.03 0.00 -1.00 0.00 0.00 57.85 55.76 2k74 n ARG 176 Cb 0.00 -0.43 0.12 0.00 -1.05 0.00 0.00 32.46 31.10 2k74 n ARG 176 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 2k74 h GLY 177 N 2.39 0.67 0.00 2.89 0.00 -1.98 -3.44 103.07 103.61 2k74 h GLY 177 Ca -0.26 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2k74 h GLY 177 CO 0.03 -0.30 0.00 1.42 0.00 0.00 0.00 176.54 177.69 2k74 n HIS 178 N -5.45 0.00 0.00 5.60 8.25 -1.26 -4.40 115.22 117.96 2k74 n HIS 178 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 2k74 n HIS 178 Cb 0.43 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.54 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 7.47 0.00 -3.17 4.41 -0.00 -1.26 -5.04 115.22 117.63 2k74 n HIS 179 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.72 57.51 2k74 n HIS 179 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 29.93 2k74 n HIS 179 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2k74 n HIS 180 N 0.00 -1.27 0.00 1.57 -0.00 -1.26 -5.11 115.22 109.15 2k74 n HIS 180 Ca 0.00 -3.04 0.00 0.00 -0.00 0.00 0.00 57.72 54.68 2k74 n HIS 180 Cb 0.00 0.28 0.00 0.00 -0.00 0.00 0.00 29.99 30.27 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 2.09 0.00 0.00 4.41 -0.00 -1.26 -4.65 115.22 115.80 2k74 n HIS 181 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.94 2k74 n HIS 181 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.52 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 14.00 0.00 0.78 4.41 -0.00 -1.26 -5.21 115.22 127.94 2k74 n HIS 182 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.72 57.78 2k74 n HIS 182 Cb 0.00 0.00 0.37 0.00 -0.00 0.00 0.00 29.99 30.36 2k74 n HIS 182 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06