#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 0.83 -0.80 3.17 3.38 -2.06 -2.43 115.31 117.39 2k74 h LEU 2 Ca 0.00 -0.11 0.11 0.00 0.09 0.00 0.00 57.88 57.97 2k74 h LEU 2 Cb 0.00 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 40.46 2k74 h LEU 2 CO 0.00 0.70 0.43 0.08 0.09 0.00 0.00 178.44 179.74 2k74 h ARG 3 N 0.90 0.67 -0.51 1.13 0.11 -2.03 -0.97 114.38 113.67 2k74 h ARG 3 Ca 0.23 -0.04 0.03 0.00 0.10 0.00 0.00 59.98 60.30 2k74 h ARG 3 Cb 0.06 -0.15 -0.04 0.00 1.11 0.00 0.00 29.97 30.95 2k74 h ARG 3 CO -0.03 0.44 0.29 0.74 0.10 0.00 0.00 179.97 181.51 2k74 h PHE 4 N 0.69 0.54 -0.89 4.08 0.04 -1.88 -1.77 116.94 117.75 2k74 h PHE 4 Ca 0.40 0.02 0.18 0.00 2.80 0.00 0.00 57.97 61.38 2k74 h PHE 4 Cb 0.45 -0.17 -0.11 0.00 2.20 0.00 0.00 35.95 38.32 2k74 h PHE 4 CO -0.08 0.29 0.45 1.25 -0.60 0.00 0.00 178.31 179.62 2k74 h LEU 5 N 0.58 0.49 -1.41 1.54 5.85 -0.95 0.79 115.31 122.21 2k74 h LEU 5 Ca 0.21 0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.99 2k74 h LEU 5 Cb 0.06 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 2k74 h LEU 5 CO -0.12 0.14 -0.30 0.78 -0.34 0.00 0.00 178.44 178.60 2k74 h ASN 6 N 0.55 0.00 0.01 1.25 2.35 -1.09 0.02 115.58 118.68 2k74 h ASN 6 Ca 0.52 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.25 2k74 h ASN 6 Cb 0.86 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.23 2k74 h ASN 6 CO -0.43 0.30 -0.08 -0.61 -1.65 0.00 0.00 177.43 174.96 2k74 h GLN 7 N 0.00 0.04 -0.29 0.81 4.15 0.75 -2.05 115.11 118.52 2k74 h GLN 7 Ca -0.00 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.34 2k74 h GLN 7 Cb 0.54 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.24 2k74 h GLN 7 CO 0.04 0.95 0.06 0.00 -1.93 0.00 0.00 178.83 177.95 2k74 h ALA 8 N 0.08 1.57 0.01 3.38 0.00 0.08 -2.24 119.26 122.15 2k74 h ALA 8 Ca -0.01 -0.13 -0.22 0.00 0.00 0.00 0.00 54.91 54.56 2k74 h ALA 8 Cb 0.99 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 2k74 h ALA 8 CO 0.01 0.32 -0.93 0.66 0.00 0.00 0.00 179.25 179.32 2k74 h SER 9 N 0.41 0.39 0.00 0.00 4.64 -1.07 -2.95 113.55 114.96 2k74 h SER 9 Ca 0.10 -0.32 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2k74 h SER 9 Cb 0.18 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2k74 h SER 9 CO -0.00 1.13 0.00 0.00 -0.87 0.00 0.00 176.83 177.09 2k74 n GLN 10 N -3.68 0.71 -4.34 4.77 6.02 -0.77 -4.52 117.38 115.57 2k74 n GLN 10 Ca -0.05 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.60 2k74 n GLN 10 Cb 0.84 -1.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.00 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 -1.28 1.86 0.54 1.08 0.00 -1.12 -4.96 107.32 103.44 2k74 s GLY 11 Ca 0.00 -0.87 0.36 0.00 0.00 0.00 0.00 44.72 44.21 2k74 s GLY 11 CO 0.00 -0.68 2.09 0.07 0.00 0.00 0.00 173.10 174.59 2k74 h ARG 12 N 4.80 0.00 -0.08 2.90 0.11 -1.86 -2.50 114.38 117.74 2k74 h ARG 12 Ca -0.50 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.56 2k74 h ARG 12 Cb 1.18 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.26 2k74 h ARG 12 CO 0.56 0.00 -0.04 0.78 0.10 0.00 0.00 179.97 181.36 2k74 h GLY 13 N 0.53 0.19 0.87 0.08 0.00 -1.93 -2.08 103.07 100.74 2k74 h GLY 13 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 2k74 h GLY 13 CO 0.00 0.15 -0.06 0.00 0.00 0.00 0.00 176.54 176.63 2k74 h ALA 14 N 0.62 -0.17 -1.00 3.60 0.00 -1.57 0.52 119.26 121.27 2k74 h ALA 14 Ca 0.02 -0.09 0.16 0.00 0.00 0.00 0.00 54.91 54.99 2k74 h ALA 14 Cb 0.50 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.26 2k74 h ALA 14 CO 0.01 -0.53 0.61 -1.49 0.00 0.00 0.00 179.25 177.85 2k74 h TRP 15 N -0.30 1.09 0.00 0.00 4.06 -1.59 0.25 115.95 119.46 2k74 h TRP 15 Ca -0.02 0.03 -0.17 0.00 2.06 0.00 0.00 58.89 60.79 2k74 h TRP 15 Cb 0.24 -0.34 -0.02 0.00 -1.00 0.00 0.00 29.16 28.04 2k74 h TRP 15 CO -0.03 0.33 -0.82 1.25 -3.56 0.00 0.00 178.44 175.61 2k74 h LEU 16 N 0.86 0.01 -0.80 -4.49 6.46 -1.01 -2.72 115.31 113.62 2k74 h LEU 16 Ca 0.54 -0.01 -0.12 0.00 -0.12 0.00 0.00 57.88 58.17 2k74 h LEU 16 Cb 0.70 -0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.62 2k74 h LEU 16 CO -0.33 0.82 -0.40 0.25 -0.62 0.00 0.00 178.44 178.16 2k74 h LEU 17 N 0.00 0.44 -0.37 2.25 5.85 0.31 -1.72 115.31 122.07 2k74 h LEU 17 Ca -0.01 -0.19 -0.19 0.00 0.84 0.00 0.00 57.88 58.34 2k74 h LEU 17 Cb 1.44 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 2k74 h LEU 17 CO 0.11 0.79 -0.80 0.24 -0.34 0.00 0.00 178.44 178.44 2k74 h MET 18 N 0.35 0.24 0.18 1.25 2.86 -0.69 -2.55 114.93 116.57 2k74 h MET 18 Ca 0.03 -0.23 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 2k74 h MET 18 Cb 0.85 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.57 2k74 h MET 18 CO 0.07 0.92 -0.08 0.00 1.06 0.00 0.00 176.91 178.88 2k74 h ALA 19 N 1.01 -0.24 -0.08 6.32 0.00 -1.24 -2.72 119.26 122.31 2k74 h ALA 19 Ca -0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2k74 h ALA 19 Cb 1.40 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 2k74 h ALA 19 CO 0.13 -0.44 -0.01 0.35 0.00 0.00 0.00 179.25 179.27 2k74 h PHE 20 N -0.62 0.12 0.75 0.00 3.57 -1.40 -2.23 116.94 117.13 2k74 h PHE 20 Ca -0.02 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 2k74 h PHE 20 Cb 0.46 -0.04 0.01 0.00 2.79 0.00 0.00 35.95 39.17 2k74 h PHE 20 CO 0.04 0.14 -0.36 1.15 -2.23 0.00 0.00 178.31 177.05 2k74 h THR 21 N 0.12 0.00 -0.14 4.41 2.02 -1.36 0.26 112.91 118.22 2k74 h THR 21 Ca 0.03 -0.06 0.04 0.00 0.77 0.00 0.00 66.41 67.19 2k74 h THR 21 Cb 0.11 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.51 2k74 h THR 21 CO 0.00 0.00 0.21 0.00 0.37 0.00 0.00 175.52 176.10 2k74 h ALA 22 N -1.47 1.62 0.14 6.16 0.00 -1.36 0.30 119.26 124.65 2k74 h ALA 22 Ca -0.10 -0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.50 2k74 h ALA 22 Cb 0.78 0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.61 2k74 h ALA 22 CO 0.17 -0.28 -1.28 1.25 0.00 0.00 0.00 179.25 179.11 2k74 h LEU 23 N 0.00 0.88 -1.90 0.00 6.46 -0.94 -3.03 115.31 116.78 2k74 h LEU 23 Ca 0.07 -0.83 0.04 0.00 -0.12 0.00 0.00 57.88 57.04 2k74 h LEU 23 Cb 0.48 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.12 2k74 h LEU 23 CO -0.00 1.63 0.16 0.00 -0.62 0.00 0.00 178.44 179.61 2k74 h ALA 24 N 0.27 2.05 0.00 1.25 0.00 0.17 -0.58 119.26 122.42 2k74 h ALA 24 Ca -0.20 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.51 2k74 h ALA 24 Cb 1.95 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.69 2k74 h ALA 24 CO 0.24 -0.09 -0.91 -0.07 0.00 0.00 0.00 179.25 178.42 2k74 h LEU 25 N 0.13 0.00 -0.11 0.00 3.38 -1.51 -2.79 115.31 114.41 2k74 h LEU 25 Ca 0.10 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 2k74 h LEU 25 Cb 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2k74 h LEU 25 CO -0.01 0.91 -0.11 -0.08 0.09 0.00 0.00 178.44 179.24 2k74 h GLU 26 N 0.00 0.28 -0.27 1.13 4.81 -1.02 -2.90 114.58 116.61 2k74 h GLU 26 Ca -0.01 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.05 2k74 h GLU 26 Cb 1.64 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 31.02 2k74 h GLU 26 CO 0.12 0.68 0.09 1.25 -0.73 0.00 0.00 179.01 180.42 2k74 h LEU 27 N -0.12 0.40 -0.68 1.64 6.46 -1.41 -0.43 115.31 121.16 2k74 h LEU 27 Ca 0.02 -0.20 0.14 0.00 -0.12 0.00 0.00 57.88 57.72 2k74 h LEU 27 Cb 0.63 -0.10 -0.10 0.00 -0.73 0.00 0.00 40.66 40.36 2k74 h LEU 27 CO 0.03 0.49 0.14 0.71 -0.62 0.00 0.00 178.44 179.20 2k74 h THR 28 N 0.28 0.55 -0.14 1.05 1.35 -1.53 -0.81 112.91 113.66 2k74 h THR 28 Ca 0.09 -0.09 -0.21 0.00 -0.55 0.00 0.00 66.41 65.65 2k74 h THR 28 Cb 0.24 0.28 0.00 0.00 -1.73 0.00 0.00 68.15 66.94 2k74 h THR 28 CO -0.00 0.05 -0.74 0.00 -0.25 0.00 0.00 175.52 174.57 2k74 h ALA 29 N 1.56 0.42 0.00 6.62 0.00 -1.35 -3.00 119.26 123.52 2k74 h ALA 29 Ca 0.37 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2k74 h ALA 29 Cb 0.61 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2k74 h ALA 29 CO -0.48 0.71 0.10 1.25 0.00 0.00 0.00 179.25 180.83 2k74 h LEU 30 N 0.48 0.00 0.00 0.00 6.46 0.35 -0.28 115.31 122.32 2k74 h LEU 30 Ca -0.04 0.00 -0.20 0.00 -0.12 0.00 0.00 57.88 57.52 2k74 h LEU 30 Cb 1.35 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 41.24 2k74 h LEU 30 CO 0.15 0.00 -2.01 1.87 -0.62 0.00 0.00 178.44 177.83 2k74 n TRP 31 N -2.69 0.27 -0.06 1.25 -0.00 -0.79 -3.48 117.44 111.94 2k74 n TRP 31 Ca -0.02 0.09 -0.12 0.00 -0.00 0.00 0.00 57.50 57.45 2k74 n TRP 31 Cb 0.15 -0.88 -0.05 0.00 -0.00 0.00 0.00 31.31 30.53 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 0.00 0.40 0.00 5.87 0.04 -0.91 -2.89 116.94 119.45 2k74 h PHE 32 Ca -0.28 -0.08 -0.24 0.00 2.80 0.00 0.00 57.97 60.17 2k74 h PHE 32 Cb 1.70 -0.10 -0.04 0.00 2.20 0.00 0.00 35.95 39.71 2k74 h PHE 32 CO 0.00 0.59 -1.26 1.96 -0.60 0.00 0.00 178.31 179.00 2k74 h GLN 33 N 0.09 0.00 0.00 1.51 7.50 -1.73 -0.29 115.11 122.19 2k74 h GLN 33 Ca 0.05 -0.01 -0.00 0.00 0.50 0.00 0.00 58.65 59.19 2k74 h GLN 33 Cb 0.45 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.98 2k74 h GLN 33 CO 0.02 0.82 -0.01 1.25 -1.50 0.00 0.00 178.83 179.40 2k74 h HIS 34 N 0.00 0.00 0.00 2.96 2.76 -1.59 0.74 115.15 120.03 2k74 h HIS 34 Ca -0.11 0.00 -0.28 0.00 -2.20 0.00 0.00 60.37 57.78 2k74 h HIS 34 Cb 1.86 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.77 2k74 h HIS 34 CO 0.00 0.01 -2.05 1.33 -1.30 0.00 0.00 177.93 175.92 2k74 n VAL 35 N -3.97 1.05 1.50 5.26 0.24 -1.09 -4.36 118.33 116.95 2k74 n VAL 35 Ca -0.03 -0.45 0.10 0.00 -2.04 0.00 0.00 64.34 61.92 2k74 n VAL 35 Cb 0.10 -1.06 0.57 0.00 -1.47 0.00 0.00 33.84 31.98 2k74 n VAL 35 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 2k74 n MET 36 N -2.95 0.75 -3.61 7.34 2.00 -0.12 -4.88 117.12 115.65 2k74 n MET 36 Ca -0.31 0.00 -0.20 0.00 0.00 0.00 0.00 57.70 57.19 2k74 n MET 36 Cb 0.87 -1.40 0.05 0.00 0.00 0.00 0.00 33.22 32.74 2k74 n MET 36 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 2k74 n LEU 37 N -0.90 -3.45 -4.85 4.03 7.94 0.17 -4.98 117.00 114.95 2k74 n LEU 37 Ca 0.14 -0.76 -0.25 0.00 -1.11 0.00 0.00 56.01 54.03 2k74 n LEU 37 Cb 0.07 -2.81 -0.04 0.00 0.53 0.00 0.00 43.42 41.16 2k74 n LEU 37 CO 0.11 0.39 -0.17 -0.76 -1.11 0.00 0.00 177.39 175.85 2k74 s LEU 38 N -6.54 3.98 0.00 -1.96 2.01 -0.68 -5.05 118.68 110.44 2k74 s LEU 38 Ca 0.02 -0.06 0.07 0.00 0.01 0.00 0.00 54.13 54.17 2k74 s LEU 38 Cb -0.01 -2.56 -0.03 0.00 0.01 0.00 0.00 46.19 43.61 2k74 s LEU 38 CO 0.79 0.04 -0.20 -0.54 1.01 0.00 0.00 176.35 177.44 2k74 s LYS 39 N -3.33 2.17 1.00 1.70 1.02 -1.26 -4.76 119.74 116.29 2k74 s LYS 39 Ca 0.32 -0.90 -0.15 0.00 0.02 0.00 0.00 55.97 55.26 2k74 s LYS 39 Cb -0.10 -2.18 0.19 0.00 -0.52 0.00 0.00 37.83 35.22 2k74 s LYS 39 CO 0.25 0.57 1.17 -1.25 -0.92 0.00 0.00 175.35 175.17 2k74 s PRO 40 N -1.00 0.38 0.40 -1.68 0.04 -1.20 -4.70 135.00 127.23 2k74 s PRO 40 Ca 0.12 0.06 0.04 0.00 0.04 0.00 0.00 61.00 61.27 2k74 s PRO 40 Cb -0.10 -1.77 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 2k74 s PRO 40 CO 0.02 -2.67 0.16 0.00 0.04 0.00 0.00 177.00 174.55 2k74 h VAL 42 N 1.85 1.20 -0.05 0.00 2.07 -1.89 -2.10 116.25 117.33 2k74 h VAL 42 Ca -0.33 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 2k74 h VAL 42 Cb 1.27 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2k74 h VAL 42 CO 0.53 0.22 -0.03 0.25 0.02 0.00 0.00 177.57 178.55 2k74 h LEU 43 N 0.69 0.11 -0.37 2.57 5.85 -1.96 -2.10 115.31 120.10 2k74 h LEU 43 Ca 0.18 -0.46 0.08 0.00 0.84 0.00 0.00 57.88 58.52 2k74 h LEU 43 Cb 0.13 -0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.05 2k74 h LEU 43 CO -0.02 0.54 -0.13 -1.28 -0.34 0.00 0.00 178.44 177.21 2k74 h SER 44 N -0.32 -0.47 -0.71 1.25 0.87 -1.94 -0.22 113.55 112.01 2k74 h SER 44 Ca 0.01 0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.66 2k74 h SER 44 Cb 0.51 0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 62.71 2k74 h SER 44 CO 0.01 -0.17 0.32 0.40 -0.53 0.00 0.00 176.83 176.86 2k74 h ILE 45 N -0.06 1.24 -0.47 2.23 2.04 -1.42 -1.98 117.51 119.09 2k74 h ILE 45 Ca 0.18 -0.72 0.07 0.00 1.00 0.00 0.00 64.86 65.40 2k74 h ILE 45 Cb 0.33 0.34 -0.06 0.00 -0.74 0.00 0.00 36.82 36.70 2k74 h ILE 45 CO -0.41 0.30 0.12 0.22 0.00 0.00 0.00 178.15 178.38 2k74 h TYR 46 N 1.04 0.20 -0.57 1.37 5.03 -0.37 -1.11 116.97 122.57 2k74 h TYR 46 Ca 0.25 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.58 2k74 h TYR 46 Cb 0.16 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.39 2k74 h TYR 46 CO 0.01 0.03 0.32 0.93 -1.32 0.00 0.00 178.16 178.14 2k74 h GLU 47 N 0.27 0.78 -0.99 1.82 4.39 -0.68 -2.07 114.58 118.10 2k74 h GLU 47 Ca 0.23 -0.09 0.17 0.00 0.34 0.00 0.00 59.36 60.02 2k74 h GLU 47 Cb 0.28 -0.16 -0.10 0.00 -0.10 0.00 0.00 28.75 28.68 2k74 h GLU 47 CO -0.28 0.59 0.62 -0.09 -1.16 0.00 0.00 179.01 178.69 2k74 h ARG 48 N 0.76 0.77 -0.34 2.33 1.12 -0.51 0.30 114.38 118.81 2k74 h ARG 48 Ca 0.20 -0.05 -0.08 0.00 -1.11 0.00 0.00 59.98 58.95 2k74 h ARG 48 Cb 0.03 -0.17 -0.02 0.00 -0.01 0.00 0.00 29.97 29.80 2k74 h ARG 48 CO -0.03 0.51 -0.12 0.00 -3.11 0.00 0.00 179.97 177.22 2k74 h ALA 49 N 1.61 1.17 -0.40 2.80 0.00 -0.62 0.38 119.26 124.21 2k74 h ALA 49 Ca 0.54 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2k74 h ALA 49 Cb 0.81 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2k74 h ALA 49 CO -0.32 0.53 0.25 0.00 0.00 0.00 0.00 179.25 179.71 2k74 h ALA 50 N 1.35 0.51 0.05 0.00 0.00 -0.08 0.53 119.26 121.62 2k74 h ALA 50 Ca 0.10 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2k74 h ALA 50 Cb 0.52 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2k74 h ALA 50 CO 0.03 -0.01 -0.03 -0.07 0.00 0.00 0.00 179.25 179.17 2k74 h LEU 51 N 0.54 -0.06 -0.99 0.00 3.38 -1.17 -2.52 115.31 114.49 2k74 h LEU 51 Ca 0.15 -0.56 0.29 0.00 0.09 0.00 0.00 57.88 57.85 2k74 h LEU 51 Cb -0.02 0.02 -0.14 0.00 0.09 0.00 0.00 40.66 40.60 2k74 h LEU 51 CO -0.03 0.65 0.53 0.15 0.09 0.00 0.00 178.44 179.84 2k74 h PHE 52 N -0.91 0.88 -0.28 1.13 3.57 -0.25 0.61 116.94 121.69 2k74 h PHE 52 Ca -0.01 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 2k74 h PHE 52 Cb 0.62 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2k74 h PHE 52 CO 0.15 -0.12 -0.01 0.78 -2.23 0.00 0.00 178.31 176.88 2k74 h GLY 53 N 0.37 0.54 0.97 2.40 0.00 -0.93 -2.81 103.07 103.62 2k74 h GLY 53 Ca 0.69 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.60 2k74 h GLY 53 CO -0.58 0.37 0.23 -2.08 0.00 0.00 0.00 176.54 174.48 2k74 h VAL 54 N 0.28 1.16 -0.86 4.60 2.07 0.37 -2.11 116.25 121.76 2k74 h VAL 54 Ca 0.08 -0.44 0.22 0.00 0.82 0.00 0.00 66.70 67.38 2k74 h VAL 54 Cb 0.45 0.66 -0.13 0.00 -1.52 0.00 0.00 31.29 30.75 2k74 h VAL 54 CO 0.02 0.17 0.29 0.25 0.02 0.00 0.00 177.57 178.32 2k74 h LEU 55 N 0.56 0.12 -1.49 2.57 7.12 0.06 1.62 115.31 125.87 2k74 h LEU 55 Ca 0.15 0.17 -0.05 0.00 0.13 0.00 0.00 57.88 58.28 2k74 h LEU 55 Cb 0.07 0.21 -0.01 0.00 -0.53 0.00 0.00 40.66 40.41 2k74 h LEU 55 CO -0.02 -0.09 -0.26 1.23 -0.13 0.00 0.00 178.44 179.17 2k74 h GLY 56 N 0.28 0.00 1.21 3.75 0.00 -1.14 -2.44 103.07 104.73 2k74 h GLY 56 Ca 0.54 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.80 2k74 h GLY 56 CO -0.59 0.00 0.14 0.00 0.00 0.00 0.00 176.54 176.09 2k74 h ALA 57 N 1.74 1.07 0.00 3.60 0.00 0.28 -2.03 119.26 123.93 2k74 h ALA 57 Ca -0.00 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 2k74 h ALA 57 Cb 0.51 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2k74 h ALA 57 CO 0.03 0.61 -0.54 0.00 0.00 0.00 0.00 179.25 179.36 2k74 h ALA 58 N 1.21 0.79 -0.33 0.00 0.00 -0.91 -1.74 119.26 118.28 2k74 h ALA 58 Ca 0.20 -0.49 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 2k74 h ALA 58 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2k74 h ALA 58 CO 0.00 0.67 -0.18 1.25 0.00 0.00 0.00 179.25 181.00 2k74 h LEU 59 N 0.00 0.73 -0.19 0.00 5.85 -1.03 -0.51 115.31 120.16 2k74 h LEU 59 Ca -0.01 -0.42 -0.19 0.00 0.84 0.00 0.00 57.88 58.11 2k74 h LEU 59 Cb 1.20 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 2k74 h LEU 59 CO 0.07 0.99 -0.90 0.16 -0.34 0.00 0.00 178.44 178.42 2k74 h ILE 60 N 0.48 1.64 0.00 4.05 3.07 -1.39 -3.13 117.51 122.23 2k74 h ILE 60 Ca 0.07 -3.10 0.00 0.00 1.55 0.00 0.00 64.86 63.38 2k74 h ILE 60 Cb 0.72 2.67 0.00 0.00 -0.27 0.00 0.00 36.82 39.94 2k74 h ILE 60 CO 0.05 0.88 0.00 0.61 -1.05 0.00 0.00 178.15 178.65 2k74 n GLY 61 N 1.08 -1.62 0.35 0.16 0.00 -0.66 -3.06 105.19 101.45 2k74 n GLY 61 Ca -0.00 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.09 2k74 n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k74 n ALA 62 N -1.66 2.58 0.03 4.61 0.00 -0.21 -2.89 120.51 122.98 2k74 n ALA 62 Ca 0.06 -0.38 -0.04 0.00 0.00 0.00 0.00 53.44 53.08 2k74 n ALA 62 Cb 0.39 -1.23 -0.09 0.00 0.00 0.00 0.00 19.45 18.52 2k74 n ALA 62 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2k74 h ILE 63 N 1.58 0.86 0.00 0.00 3.07 -1.67 -3.45 117.51 117.90 2k74 h ILE 63 Ca 0.00 -2.49 0.00 0.00 1.55 0.00 0.00 64.86 63.92 2k74 h ILE 63 Cb 0.34 2.34 0.00 0.00 -0.27 0.00 0.00 36.82 39.23 2k74 h ILE 63 CO 0.00 0.49 0.00 0.00 -1.05 0.00 0.00 178.15 177.59 2k74 n ALA 64 N -2.42 0.00 0.82 0.16 0.00 -1.24 -5.02 120.51 112.80 2k74 n ALA 64 Ca -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.34 2k74 n ALA 64 Cb 0.91 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.39 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 1.24 0.00 0.00 -0.04 -1.14 -3.34 135.00 131.71 2k74 n PRO 65 Ca 0.00 -0.28 0.08 0.00 -0.04 0.00 0.00 63.50 63.26 2k74 n PRO 65 Cb 0.00 -1.35 -0.07 0.00 -0.04 0.00 0.00 33.50 32.04 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 0.20 1.69 -4.04 0.54 5.02 -1.26 -4.73 118.16 115.58 2k74 n LYS 66 Ca 0.04 -0.21 -0.27 0.00 -2.02 0.00 0.00 58.31 55.86 2k74 n LYS 66 Cb 0.46 -1.27 -0.03 0.00 -0.02 0.00 0.00 35.03 34.18 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 -2.38 1.74 -0.61 -0.18 -4.23 -1.21 -4.95 115.64 103.82 2k74 s THR 67 Ca 0.08 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 2k74 s THR 67 Cb 0.12 -2.33 0.00 0.00 1.34 0.00 0.00 72.50 71.64 2k74 s THR 67 CO 0.60 0.00 0.42 -2.65 -0.54 0.00 0.00 174.62 172.45 2k74 n PRO 68 N -1.60 0.00 -0.13 3.99 -0.02 -1.26 -2.01 135.00 133.97 2k74 n PRO 68 Ca -0.04 0.09 0.23 0.00 -2.02 0.00 0.00 63.50 61.76 2k74 n PRO 68 Cb 0.65 -1.64 0.66 0.00 -0.02 0.00 0.00 33.50 33.15 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 0.10 -0.02 2.45 -0.00 -1.92 -2.89 115.31 113.04 2k74 h LEU 69 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 2k74 h LEU 69 Cb 0.27 -0.01 -0.00 0.00 -0.00 0.00 0.00 40.66 40.92 2k74 h LEU 69 CO 0.00 0.05 -0.01 0.03 -0.00 0.00 0.00 178.44 178.51 2k74 h ARG 70 N 0.11 -0.00 -0.91 1.13 3.08 -1.69 0.56 114.38 116.66 2k74 h ARG 70 Ca 0.37 0.00 0.19 0.00 0.07 0.00 0.00 59.98 60.61 2k74 h ARG 70 Cb 1.29 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.27 2k74 h ARG 70 CO -0.04 -0.00 0.59 -0.92 -1.07 0.00 0.00 179.97 178.53 2k74 h TYR 71 N -0.00 0.63 -0.51 3.04 5.03 -1.82 0.28 116.97 123.61 2k74 h TYR 71 Ca 0.00 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.31 2k74 h TYR 71 Cb 0.01 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 38.07 2k74 h TYR 71 CO -0.89 0.17 0.25 0.28 -1.32 0.00 0.00 178.16 176.65 2k74 h VAL 72 N 0.48 1.19 0.02 1.81 2.07 -0.11 -2.52 116.25 119.20 2k74 h VAL 72 Ca 0.48 -0.54 -0.21 0.00 0.82 0.00 0.00 66.70 67.25 2k74 h VAL 72 Cb 1.07 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 2k74 h VAL 72 CO -0.20 0.21 -0.94 0.00 0.02 0.00 0.00 177.57 176.67 2k74 h ALA 73 N 1.09 0.44 0.00 1.67 0.00 0.84 -2.97 119.26 120.33 2k74 h ALA 73 Ca 0.18 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2k74 h ALA 73 Cb 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2k74 h ALA 73 CO -0.02 0.94 0.01 -0.12 0.00 0.00 0.00 179.25 180.05 2k74 n MET 74 N -3.63 0.05 -0.24 0.00 0.00 0.84 -1.85 117.12 112.30 2k74 n MET 74 Ca -0.04 0.55 -0.06 0.00 0.00 0.00 0.00 57.70 58.14 2k74 n MET 74 Cb 0.85 -1.69 0.04 0.00 0.00 0.00 0.00 33.22 32.42 2k74 n MET 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2k74 h VAL 75 N 0.00 1.20 0.00 1.12 2.07 -1.29 -1.68 116.25 117.67 2k74 h VAL 75 Ca 0.00 -0.49 -0.26 0.00 0.82 0.00 0.00 66.70 66.77 2k74 h VAL 75 Cb 0.02 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.07 2k74 h VAL 75 CO 0.00 0.22 -1.48 0.40 0.02 0.00 0.00 177.57 176.73 2k74 h ILE 76 N 0.90 1.10 0.09 4.57 2.04 -1.59 -2.96 117.51 121.65 2k74 h ILE 76 Ca 0.23 -2.90 -0.00 0.00 1.00 0.00 0.00 64.86 63.19 2k74 h ILE 76 Cb 0.02 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.64 2k74 h ILE 76 CO -0.04 0.63 -0.04 -0.25 0.00 0.00 0.00 178.15 178.45 2k74 h TRP 77 N 0.00 -0.11 -0.15 1.37 2.91 -1.38 -2.16 115.95 116.43 2k74 h TRP 77 Ca -0.20 -0.00 -0.07 0.00 1.13 0.00 0.00 58.89 59.75 2k74 h TRP 77 Cb 1.93 0.04 -0.00 0.00 -0.51 0.00 0.00 29.16 30.61 2k74 h TRP 77 CO 0.00 -0.03 -0.17 1.25 -1.03 0.00 0.00 178.44 178.46 2k74 h LEU 78 N -0.15 0.41 -0.72 0.65 5.85 -1.46 -1.79 115.31 118.09 2k74 h LEU 78 Ca -0.01 -0.49 0.14 0.00 0.84 0.00 0.00 57.88 58.36 2k74 h LEU 78 Cb 0.12 -0.12 -0.14 0.00 0.37 0.00 0.00 40.66 40.90 2k74 h LEU 78 CO 0.02 0.82 -0.20 0.22 -0.34 0.00 0.00 178.44 178.96 2k74 h TYR 79 N 0.01 -0.44 0.00 1.25 5.03 -1.46 0.68 116.97 122.03 2k74 h TYR 79 Ca 0.02 0.07 -0.11 0.00 2.58 0.00 0.00 58.73 61.29 2k74 h TYR 79 Cb 0.71 0.31 -0.02 0.00 1.55 0.00 0.00 36.73 39.28 2k74 h TYR 79 CO 0.09 -0.32 -0.52 0.66 -1.32 0.00 0.00 178.16 176.74 2k74 h SER 80 N -0.02 0.00 0.88 -2.11 4.64 -1.38 -2.21 113.55 113.35 2k74 h SER 80 Ca 0.34 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.62 2k74 h SER 80 Cb 0.54 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.63 2k74 h SER 80 CO -0.75 0.52 -0.42 0.00 -0.87 0.00 0.00 176.83 175.31 2k74 h ALA 81 N 1.48 -1.18 -0.01 5.18 0.00 0.12 0.57 119.26 125.42 2k74 h ALA 81 Ca -0.01 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2k74 h ALA 81 Cb 0.96 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 2k74 h ALA 81 CO 0.07 -1.15 -0.01 0.35 0.00 0.00 0.00 179.25 178.51 2k74 h PHE 82 N -1.21 0.02 0.05 0.00 3.57 -1.16 -2.85 116.94 115.36 2k74 h PHE 82 Ca -0.12 -0.01 -0.23 0.00 3.53 0.00 0.00 57.97 61.14 2k74 h PHE 82 Cb 0.91 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.64 2k74 h PHE 82 CO -0.01 0.56 -1.05 0.07 -2.23 0.00 0.00 178.31 175.65 2k74 h ARG 83 N -0.52 0.24 -0.21 1.11 -0.00 -1.50 -2.29 114.38 111.22 2k74 h ARG 83 Ca 0.00 -0.33 -0.03 0.00 -0.00 0.00 0.00 59.98 59.63 2k74 h ARG 83 Cb 0.55 0.11 -0.01 0.00 -0.00 0.00 0.00 29.97 30.62 2k74 h ARG 83 CO 0.00 1.09 0.03 0.78 -0.00 0.00 0.00 179.97 181.87 2k74 h GLY 84 N 1.78 0.37 0.86 0.08 0.00 0.03 -2.93 103.07 103.26 2k74 h GLY 84 Ca -0.08 -0.25 -0.07 0.00 0.00 0.00 0.00 47.33 46.92 2k74 h GLY 84 CO 0.17 0.23 -0.14 -0.39 0.00 0.00 0.00 176.54 176.41 2k74 h VAL 85 N 0.14 1.31 -0.44 4.60 -1.51 -1.53 -2.54 116.25 116.27 2k74 h VAL 85 Ca 0.06 -1.24 0.13 0.00 -1.23 0.00 0.00 66.70 64.42 2k74 h VAL 85 Cb 0.32 1.59 -0.02 0.00 -2.13 0.00 0.00 31.29 31.06 2k74 h VAL 85 CO 0.00 0.39 0.59 -0.61 -1.23 0.00 0.00 177.57 176.71 2k74 h GLN 86 N 0.24 0.00 0.18 5.19 5.75 -1.39 0.35 115.11 125.43 2k74 h GLN 86 Ca 0.05 0.00 -0.33 0.00 -0.15 0.00 0.00 58.65 58.23 2k74 h GLN 86 Cb 0.66 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.22 2k74 h GLN 86 CO 0.04 0.00 -1.60 1.25 -2.65 0.00 0.00 178.83 175.87 2k74 h LEU 87 N 0.00 0.59 -1.59 -2.39 5.85 -1.27 -3.32 115.31 113.17 2k74 h LEU 87 Ca 0.21 -0.92 0.28 0.00 0.84 0.00 0.00 57.88 58.29 2k74 h LEU 87 Cb 1.39 -0.19 -0.08 0.00 0.37 0.00 0.00 40.66 42.15 2k74 h LEU 87 CO -0.00 1.73 0.71 0.71 -0.34 0.00 0.00 178.44 181.25 2k74 h THR 88 N -0.01 0.50 0.18 1.05 1.35 0.05 0.97 112.91 117.00 2k74 h THR 88 Ca -0.32 -0.09 -0.01 0.00 -0.55 0.00 0.00 66.41 65.45 2k74 h THR 88 Cb 2.01 0.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 2k74 h THR 88 CO 0.16 0.05 -0.09 1.88 -0.25 0.00 0.00 175.52 177.27 2k74 h TYR 89 N 0.25 -0.22 -1.07 4.73 -1.99 -1.60 -1.40 116.97 115.67 2k74 h TYR 89 Ca 0.57 -0.01 0.30 0.00 2.00 0.00 0.00 58.73 61.59 2k74 h TYR 89 Cb 1.72 0.07 -0.06 0.00 2.00 0.00 0.00 36.73 40.46 2k74 h TYR 89 CO -0.00 -0.04 0.75 0.93 -0.00 0.00 0.00 178.16 179.80 2k74 h GLU 90 N -0.37 0.11 0.00 4.88 5.08 -0.94 0.78 114.58 124.13 2k74 h GLU 90 Ca -0.02 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2k74 h GLU 90 Cb 0.28 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2k74 h GLU 90 CO 0.04 0.08 -0.00 1.25 -1.00 0.00 0.00 179.01 179.37 2k74 h HIS 91 N 0.12 -0.01 0.23 4.33 2.76 -1.13 -2.76 115.15 118.71 2k74 h HIS 91 Ca 0.54 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.70 2k74 h HIS 91 Cb 1.91 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.87 2k74 h HIS 91 CO -0.00 0.76 -0.11 1.79 -1.30 0.00 0.00 177.93 179.06 2k74 h THR 92 N -0.78 0.79 -0.54 6.26 1.35 0.02 -0.06 112.91 119.96 2k74 h THR 92 Ca -0.00 -0.80 0.11 0.00 -0.55 0.00 0.00 66.41 65.17 2k74 h THR 92 Cb 0.76 1.21 -0.10 0.00 -1.73 0.00 0.00 68.15 68.30 2k74 h THR 92 CO 0.00 0.16 -0.06 -0.03 -0.25 0.00 0.00 175.52 175.34 2k74 h MET 93 N -0.76 0.06 -0.49 4.72 -1.53 0.33 0.33 114.93 117.58 2k74 h MET 93 Ca -0.03 -0.00 -0.12 0.00 -3.44 0.00 0.00 59.70 56.11 2k74 h MET 93 Cb 0.50 -0.01 -0.02 0.00 -0.55 0.00 0.00 31.60 31.52 2k74 h MET 93 CO 0.05 0.04 -0.16 1.25 0.14 0.00 0.00 176.91 178.23 2k74 h LEU 94 N 0.06 0.97 -1.02 3.39 5.85 -1.53 2.42 115.31 125.45 2k74 h LEU 94 Ca 0.27 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 2k74 h LEU 94 Cb 0.42 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 2k74 h LEU 94 CO -0.50 1.11 0.22 -0.61 -0.34 0.00 0.00 178.44 178.32 2k74 h GLN 95 N 0.84 0.93 0.00 1.25 5.75 0.56 -2.79 115.11 121.66 2k74 h GLN 95 Ca 0.12 -0.16 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 2k74 h GLN 95 Cb 0.71 -0.15 -0.00 0.00 1.07 0.00 0.00 27.48 29.11 2k74 h GLN 95 CO 0.05 0.78 -1.75 -0.11 -2.65 0.00 0.00 178.83 175.15 2k74 n LEU 96 N -4.30 0.22 -3.68 -2.39 7.94 0.10 -4.67 117.00 110.22 2k74 n LEU 96 Ca 0.05 0.08 -0.28 0.00 -1.11 0.00 0.00 56.01 54.76 2k74 n LEU 96 Cb 0.19 -0.01 -0.11 0.00 0.53 0.00 0.00 43.42 44.02 2k74 n LEU 96 CO 0.40 -0.04 -0.14 0.00 -1.11 0.00 0.00 177.39 176.49 2k74 n TYR 97 N -2.37 1.62 -2.27 1.96 4.19 0.81 -5.06 117.16 116.05 2k74 n TYR 97 Ca -0.03 -3.92 -0.32 0.00 3.31 0.00 0.00 57.90 56.94 2k74 n TYR 97 Cb 0.57 -0.28 -0.02 0.00 0.49 0.00 0.00 39.34 40.10 2k74 n TYR 97 CO 0.00 0.00 0.00 -1.25 0.91 0.00 0.00 176.86 176.52 2k74 s PRO 98 N -0.92 3.79 0.02 2.98 0.04 -1.07 -4.20 135.00 135.64 2k74 s PRO 98 Ca 0.29 0.98 -0.11 0.00 0.04 0.00 0.00 61.00 62.20 2k74 s PRO 98 Cb -0.00 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 32.44 2k74 s PRO 98 CO -0.18 -0.41 0.22 -1.12 0.04 0.00 0.00 177.00 175.56 2k74 s SER 99 N -3.15 -0.03 0.00 6.66 0.01 -1.26 -5.03 113.70 110.90 2k74 s SER 99 Ca 0.59 -0.23 0.16 0.00 1.31 0.00 0.00 55.95 57.78 2k74 s SER 99 Cb -0.11 0.29 0.93 0.00 0.21 0.00 0.00 66.02 67.34 2k74 s SER 99 CO 0.35 -0.51 1.41 -0.81 0.41 0.00 0.00 173.24 174.08 2k74 n PRO 100 N 0.90 0.44 -3.61 12.44 -0.04 -1.26 -4.71 135.00 139.16 2k74 n PRO 100 Ca -0.20 0.04 -0.14 0.00 -0.04 0.00 0.00 63.50 63.16 2k74 n PRO 100 Cb 0.58 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.47 2k74 n PRO 100 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2k74 s PHE 101 N -2.16 -0.67 0.00 0.54 -0.71 -1.26 -5.02 117.98 108.69 2k74 s PHE 101 Ca 0.22 1.53 0.00 0.00 -1.04 0.00 0.00 56.93 57.64 2k74 s PHE 101 Cb 0.11 0.33 0.00 0.00 -1.21 0.00 0.00 43.02 42.25 2k74 s PHE 101 CO 0.20 -0.40 0.00 0.00 -1.34 0.00 0.00 175.22 173.69 2k74 n ALA 102 N 2.10 0.00 -3.02 1.99 0.00 -1.26 -5.09 120.51 115.23 2k74 n ALA 102 Ca -0.14 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.29 2k74 n ALA 102 Cb 0.56 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.00 2k74 n ALA 102 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2k74 n THR 103 N 0.00 -5.08 0.00 0.00 -1.04 -1.26 -4.96 114.28 101.93 2k74 n THR 103 Ca 0.00 0.92 0.00 0.00 -2.04 0.00 0.00 64.05 62.93 2k74 n THR 103 Cb 0.09 -4.14 0.00 0.00 -1.82 0.00 0.00 70.33 64.46 2k74 n THR 103 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2k74 n SER 104 N 1.38 0.00 0.00 8.00 7.64 -1.26 -4.97 113.62 124.41 2k74 n SER 104 Ca -0.03 0.28 0.00 0.00 1.01 0.00 0.00 58.87 60.13 2k74 n SER 104 Cb 0.31 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 2k74 n SER 104 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2k74 n ASP 105 N -0.76 0.00 -3.38 6.43 2.03 -1.26 -5.07 116.55 114.55 2k74 n ASP 105 Ca 0.00 -0.26 -0.33 0.00 0.52 0.00 0.00 54.79 54.73 2k74 n ASP 105 Cb 0.00 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.43 2k74 n ASP 105 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2k74 n PHE 106 N 0.00 -2.79 -1.55 -0.67 3.01 -1.26 -4.62 117.46 109.57 2k74 n PHE 106 Ca 0.00 1.16 0.02 0.00 1.01 0.00 0.00 57.45 59.65 2k74 n PHE 106 Cb 0.06 -2.20 -0.01 0.00 -0.01 0.00 0.00 39.48 37.32 2k74 n PHE 106 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 2k74 n MET 107 N -0.16 -3.82 -1.71 -1.08 2.81 -1.26 -4.67 117.12 107.22 2k74 n MET 107 Ca -0.05 2.99 -0.42 0.00 -1.81 0.00 0.00 57.70 58.41 2k74 n MET 107 Cb 0.64 -3.84 -0.03 0.00 -0.71 0.00 0.00 33.22 29.28 2k74 n MET 107 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2k74 s VAL 108 N -5.23 2.70 -0.29 2.03 0.11 -1.26 -4.96 120.40 113.50 2k74 s VAL 108 Ca 0.00 0.06 0.01 0.00 -2.93 0.00 0.00 61.98 59.12 2k74 s VAL 108 Cb 0.00 -3.04 0.15 0.00 -1.53 0.00 0.00 36.38 31.96 2k74 s VAL 108 CO 0.00 -0.00 0.36 -0.60 -3.33 0.00 0.00 175.10 171.53 2k74 s ARG 109 N 3.26 0.37 0.06 1.54 3.52 -1.26 -5.00 118.95 121.44 2k74 s ARG 109 Ca 0.83 0.04 0.01 0.00 -0.13 0.00 0.00 55.73 56.49 2k74 s ARG 109 Cb -0.45 -0.46 -0.03 0.00 -1.56 0.00 0.00 34.95 32.46 2k74 s ARG 109 CO 0.38 -1.01 -0.06 -0.06 -0.81 0.00 0.00 175.30 173.73 2k74 s PHE 110 N 2.47 0.65 -0.32 5.12 0.40 -1.26 -5.10 117.98 119.95 2k74 s PHE 110 Ca 0.10 -0.69 -0.39 0.00 -0.60 0.00 0.00 56.93 55.35 2k74 s PHE 110 Cb -0.13 -0.40 -0.17 0.00 0.51 0.00 0.00 43.02 42.83 2k74 s PHE 110 CO -0.30 -0.15 1.27 -2.30 0.70 0.00 0.00 175.22 174.43 2k74 n PRO 111 N 0.91 0.00 0.00 0.24 -0.02 -1.26 -4.75 135.00 130.12 2k74 n PRO 111 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 2k74 n PRO 111 Cb 0.57 -1.30 0.00 0.00 -0.02 0.00 0.00 33.50 32.75 2k74 n PRO 111 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2k74 n GLU 112 N 2.89 0.80 -0.15 -0.52 0.28 -1.26 -3.41 120.64 119.28 2k74 n GLU 112 Ca 0.24 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 57.30 2k74 n GLU 112 Cb -0.02 -1.40 0.18 0.00 1.43 0.00 0.00 31.44 31.64 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 0.10 0.39 -3.82 -1.84 4.27 -1.26 -4.54 117.44 110.74 2k74 n TRP 113 Ca 0.00 -0.19 -0.32 0.00 -3.89 0.00 0.00 57.50 53.09 2k74 n TRP 113 Cb 0.20 0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 30.04 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 -1.09 4.88 0.00 5.67 2.96 -1.22 -4.94 118.68 124.93 2k74 s LEU 114 Ca 0.23 -3.27 0.00 0.00 -0.22 0.00 0.00 54.13 50.87 2k74 s LEU 114 Cb 0.12 -1.74 0.00 0.00 0.50 0.00 0.00 46.19 45.07 2k74 s LEU 114 CO 0.16 -0.23 0.04 -2.65 -1.32 0.00 0.00 176.35 172.36 2k74 n PRO 115 N 2.84 0.00 0.14 0.98 -0.02 -1.26 -1.96 135.00 135.71 2k74 n PRO 115 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 2k74 n PRO 115 Cb 0.35 -1.07 0.15 0.00 -0.02 0.00 0.00 33.50 32.91 2k74 n PRO 115 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2k74 h LEU 116 N 0.00 0.00 0.05 2.45 5.85 -1.93 -0.75 115.31 120.98 2k74 h LEU 116 Ca 0.00 0.00 -0.38 0.00 0.84 0.00 0.00 57.88 58.34 2k74 h LEU 116 Cb 0.00 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 2k74 h LEU 116 CO 0.00 0.60 -2.26 0.47 -0.34 0.00 0.00 178.44 176.91 2k74 n ASP 117 N -3.55 2.04 0.04 1.25 8.00 -0.83 -2.53 116.55 120.96 2k74 n ASP 117 Ca -0.00 0.03 -0.02 0.00 0.71 0.00 0.00 54.79 55.50 2k74 n ASP 117 Cb 0.66 -0.62 0.24 0.00 -0.02 0.00 0.00 41.12 41.38 2k74 n ASP 117 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2k74 h LYS 118 N -0.01 0.43 0.00 -1.24 1.79 -1.71 0.20 116.57 116.02 2k74 h LYS 118 Ca -0.51 -0.15 0.00 0.00 -2.18 0.00 0.00 60.65 57.81 2k74 h LYS 118 Cb 1.94 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 32.56 2k74 h LYS 118 CO -0.03 0.63 -0.67 2.35 -1.08 0.00 0.00 179.45 180.66 2k74 h TRP 119 N 0.38 0.00 -1.84 -1.35 7.01 -1.31 -3.41 115.95 115.44 2k74 h TRP 119 Ca 0.06 0.00 -0.44 0.00 2.11 0.00 0.00 58.89 60.62 2k74 h TRP 119 Cb 0.60 0.00 -0.30 0.00 -2.10 0.00 0.00 29.16 27.36 2k74 h TRP 119 CO 0.02 0.00 -0.81 0.28 -2.79 0.00 0.00 178.44 175.13 2k74 n VAL 120 N -2.71 -0.78 0.52 2.65 0.31 -0.86 -4.97 118.33 112.49 2k74 n VAL 120 Ca 0.02 -2.61 0.13 0.00 -0.01 0.00 0.00 64.34 61.86 2k74 n VAL 120 Cb 0.53 -0.73 0.36 0.00 -0.91 0.00 0.00 33.84 33.09 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 5.31 0.00 0.00 5.55 0.13 -0.87 -3.13 132.00 138.99 2k74 h PRO 121 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2k74 h PRO 121 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2k74 h PRO 121 CO 0.26 0.00 0.00 0.94 -0.23 0.00 0.00 178.00 178.97 2k74 n GLN 122 N -2.47 0.51 -2.48 0.86 7.27 -1.26 -1.92 117.38 117.89 2k74 n GLN 122 Ca 0.05 0.00 -0.17 0.00 0.07 0.00 0.00 57.00 56.96 2k74 n GLN 122 Cb 0.45 -1.50 0.02 0.00 2.41 0.00 0.00 30.24 31.62 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 -1.24 1.86 0.00 1.69 0.31 -1.18 -4.77 118.33 114.99 2k74 n VAL 123 Ca 0.16 -3.90 0.00 0.00 -0.01 0.00 0.00 64.34 60.58 2k74 n VAL 123 Cb 0.22 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 32.89 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 -0.46 0.00 -1.67 3.52 7.35 -1.23 -4.99 117.46 119.97 2k74 n PHE 124 Ca 0.27 0.00 -0.48 0.00 -0.76 0.00 0.00 57.45 56.48 2k74 n PHE 124 Cb 0.80 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 40.59 2k74 n PHE 124 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2k74 n VAL 125 N -0.86 0.28 -3.78 -2.13 0.31 -0.81 -4.97 118.33 106.38 2k74 n VAL 125 Ca 0.00 -0.05 -0.24 0.00 -0.01 0.00 0.00 64.34 64.04 2k74 n VAL 125 Cb 0.00 -1.66 -0.02 0.00 -0.91 0.00 0.00 33.84 31.25 2k74 n VAL 125 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k74 s ALA 126 N 2.42 3.87 -0.30 3.52 0.00 -1.26 -4.99 121.76 125.01 2k74 s ALA 126 Ca 0.86 -1.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.68 2k74 s ALA 126 Cb -0.71 -1.88 0.18 0.00 0.00 0.00 0.00 23.12 20.71 2k74 s ALA 126 CO 0.45 0.29 1.02 0.45 0.00 0.00 0.00 175.76 177.97 2k74 s SER 127 N -3.65 -0.51 0.00 0.00 0.15 -1.15 -4.84 113.70 103.70 2k74 s SER 127 Ca 0.36 0.15 0.00 0.00 0.70 0.00 0.00 55.95 57.17 2k74 s SER 127 Cb -0.10 1.36 0.00 0.00 -1.71 0.00 0.00 66.02 65.57 2k74 s SER 127 CO 0.30 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.26 2k74 n GLY 128 N 5.27 0.52 3.85 9.45 0.00 -1.04 -3.22 105.19 120.02 2k74 n GLY 128 Ca 0.03 -1.81 -0.36 0.00 0.00 0.00 0.00 46.02 43.88 2k74 n GLY 128 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k74 s ASP 129 N -2.95 6.77 -0.08 1.61 1.11 -1.26 -4.75 116.67 117.11 2k74 s ASP 129 Ca 0.00 0.96 -0.15 0.00 0.18 0.00 0.00 52.55 53.54 2k74 s ASP 129 Cb 0.00 -2.24 -0.05 0.00 1.07 0.00 0.00 42.92 41.70 2k74 s ASP 129 CO 0.00 0.17 0.38 0.00 1.18 0.00 0.00 175.17 176.91 2k74 n ALA 131 N 2.83 0.00 -1.41 0.00 0.00 -1.26 -5.04 120.51 115.63 2k74 n ALA 131 Ca -0.12 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.99 2k74 n ALA 131 Cb 0.52 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.04 2k74 n ALA 131 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2k74 s GLU 132 N -0.34 2.50 0.06 0.00 -1.05 -1.25 -4.89 118.70 113.74 2k74 s GLU 132 Ca 0.00 1.45 -0.08 0.00 -0.15 0.00 0.00 54.97 56.19 2k74 s GLU 132 Cb 0.00 -1.91 -0.05 0.00 -0.44 0.00 0.00 34.13 31.73 2k74 s GLU 132 CO 0.00 -1.49 0.35 -0.98 0.95 0.00 0.00 175.26 174.09 2k74 s ARG 133 N -4.18 3.67 0.00 -4.83 1.70 -1.26 -4.97 118.95 109.09 2k74 s ARG 133 Ca 0.68 0.04 0.00 0.00 -0.47 0.00 0.00 55.73 55.98 2k74 s ARG 133 Cb -0.22 -3.01 0.00 0.00 -0.57 0.00 0.00 34.95 31.15 2k74 s ARG 133 CO 0.45 0.58 0.00 1.04 -1.08 0.00 0.00 175.30 176.29 2k74 n GLN 134 N 0.86 1.49 -3.63 3.89 6.02 -1.26 -5.12 117.38 119.63 2k74 n GLN 134 Ca -0.08 0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 56.85 2k74 n GLN 134 Cb 0.52 -0.66 -0.06 0.00 1.02 0.00 0.00 30.24 31.07 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 -1.26 -0.20 0.18 1.08 -0.00 -1.26 -5.06 118.94 112.41 2k74 s TRP 135 Ca 0.00 0.42 -0.01 0.00 -0.00 0.00 0.00 56.10 56.51 2k74 s TRP 135 Cb 0.00 0.46 -0.04 0.00 -0.00 0.00 0.00 33.47 33.89 2k74 s TRP 135 CO 0.00 -0.14 0.09 0.16 -0.00 0.00 0.00 176.95 177.05 2k74 s ASP 136 N -0.54 0.42 -0.10 5.86 1.47 -1.26 -3.31 116.67 119.22 2k74 s ASP 136 Ca 0.05 -1.30 -0.03 0.00 1.18 0.00 0.00 52.55 52.44 2k74 s ASP 136 Cb -0.03 0.30 0.05 0.00 -0.34 0.00 0.00 42.92 42.90 2k74 s ASP 136 CO -0.07 -0.76 0.17 0.12 0.68 0.00 0.00 175.17 175.30 2k74 s PHE 137 N -4.03 -0.18 -0.14 2.11 5.36 0.04 -4.77 117.98 116.37 2k74 s PHE 137 Ca 0.32 0.57 0.00 0.00 -0.96 0.00 0.00 56.93 56.85 2k74 s PHE 137 Cb 0.07 -0.28 0.00 0.00 -0.34 0.00 0.00 43.02 42.48 2k74 s PHE 137 CO 0.08 -0.30 0.00 -0.11 -1.46 0.00 0.00 175.22 173.42 2k74 n LEU 138 N 5.32 -0.07 0.00 6.12 0.00 -1.26 -2.56 117.00 124.55 2k74 n LEU 138 Ca -0.05 0.03 0.00 0.00 0.00 0.00 0.00 56.01 56.00 2k74 n LEU 138 Cb 0.50 -0.70 0.00 0.00 0.00 0.00 0.00 43.42 43.22 2k74 n LEU 138 CO 0.05 -0.09 0.00 0.61 0.00 0.00 0.00 177.39 177.95 2k74 n GLY 139 N -2.74 0.46 3.24 -3.96 0.00 -1.26 -5.03 105.19 95.90 2k74 n GLY 139 Ca -0.01 -0.62 -0.32 0.00 0.00 0.00 0.00 46.02 45.07 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 2.14 0.59 0.99 1.02 -1.06 -5.08 118.68 117.27 2k74 s LEU 140 Ca 0.00 -0.53 -0.18 0.00 0.02 0.00 0.00 54.13 53.45 2k74 s LEU 140 Cb 0.00 -1.42 -0.04 0.00 0.02 0.00 0.00 46.19 44.76 2k74 s LEU 140 CO 0.00 0.18 1.11 -1.61 0.02 0.00 0.00 176.35 176.05 2k74 s GLU 141 N 0.22 3.17 0.16 1.70 2.02 -1.26 -0.78 118.70 123.93 2k74 s GLU 141 Ca -0.15 1.49 -0.20 0.00 0.02 0.00 0.00 54.97 56.13 2k74 s GLU 141 Cb -0.17 -1.99 0.07 0.00 0.10 0.00 0.00 34.13 32.14 2k74 s GLU 141 CO 0.08 -0.97 1.63 0.52 0.02 0.00 0.00 175.26 176.53 2k74 h MET 142 N 0.73 -0.17 -1.06 1.61 2.86 -1.94 -0.99 114.93 115.97 2k74 h MET 142 Ca -0.49 0.01 0.35 0.00 -2.06 0.00 0.00 59.70 57.51 2k74 h MET 142 Cb 1.25 0.04 -0.14 0.00 0.06 0.00 0.00 31.60 32.81 2k74 h MET 142 CO 0.56 -0.11 0.63 -1.35 1.06 0.00 0.00 176.91 177.70 2k74 h PRO 143 N -0.17 0.25 -0.02 -0.22 0.11 -1.92 0.43 132.00 130.46 2k74 h PRO 143 Ca 0.17 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 2k74 h PRO 143 Cb 0.44 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.49 2k74 h PRO 143 CO -0.44 0.17 -0.06 1.96 -0.21 0.00 0.00 178.00 179.42 2k74 h GLN 144 N 0.26 0.07 0.46 1.05 4.20 -1.57 -2.81 115.11 116.77 2k74 h GLN 144 Ca 0.75 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 59.39 2k74 h GLN 144 Cb 1.87 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.64 2k74 h GLN 144 CO -0.56 0.70 -0.38 -1.49 -0.67 0.00 0.00 178.83 176.43 2k74 h TRP 145 N -0.54 -1.03 -0.97 2.96 4.06 -0.11 -1.38 115.95 118.94 2k74 h TRP 145 Ca -0.00 0.00 0.32 0.00 2.06 0.00 0.00 58.89 61.27 2k74 h TRP 145 Cb 0.70 0.39 -0.16 0.00 -1.00 0.00 0.00 29.16 29.09 2k74 h TRP 145 CO 0.15 -0.55 0.39 1.25 -3.56 0.00 0.00 178.44 176.12 2k74 h LEU 146 N -0.84 0.17 -1.43 -4.49 5.85 -0.39 3.63 115.31 117.81 2k74 h LEU 146 Ca -0.05 0.23 0.13 0.00 0.84 0.00 0.00 57.88 59.04 2k74 h LEU 146 Cb 0.72 0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.96 2k74 h LEU 146 CO -0.02 -0.26 0.53 0.25 -0.34 0.00 0.00 178.44 178.60 2k74 h LEU 147 N 0.15 0.54 -0.95 2.25 6.46 -0.98 0.66 115.31 123.43 2k74 h LEU 147 Ca 0.70 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 58.48 2k74 h LEU 147 Cb 1.63 -0.08 -0.05 0.00 -0.73 0.00 0.00 40.66 41.44 2k74 h LEU 147 CO -0.72 0.29 0.57 1.23 -0.62 0.00 0.00 178.44 179.19 2k74 h GLY 148 N 0.58 1.38 1.81 3.75 0.00 0.72 -1.72 103.07 109.59 2k74 h GLY 148 Ca 0.39 -0.58 -0.23 0.00 0.00 0.00 0.00 47.33 46.92 2k74 h GLY 148 CO -0.15 0.56 -1.13 -2.22 0.00 0.00 0.00 176.54 173.60 2k74 h ILE 149 N 1.31 1.57 -0.23 2.60 2.04 -0.23 -3.03 117.51 121.54 2k74 h ILE 149 Ca 0.34 -3.28 0.00 0.00 1.00 0.00 0.00 64.86 62.92 2k74 h ILE 149 Cb -0.05 2.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.82 2k74 h ILE 149 CO -0.06 0.90 0.15 0.15 0.00 0.00 0.00 178.15 179.29 2k74 h PHE 150 N 0.01 0.29 -0.43 1.37 3.04 0.61 -0.51 116.94 121.32 2k74 h PHE 150 Ca -0.06 0.01 -0.12 0.00 3.98 0.00 0.00 57.97 61.77 2k74 h PHE 150 Cb 1.83 -0.10 -0.01 0.00 2.56 0.00 0.00 35.95 40.23 2k74 h PHE 150 CO 0.01 0.18 -0.20 -0.84 -2.02 0.00 0.00 178.31 175.44 2k74 h ILE 151 N 0.31 1.28 -0.19 1.41 -0.00 -1.43 -2.90 117.51 115.99 2k74 h ILE 151 Ca 0.08 -1.35 0.03 0.00 -0.00 0.00 0.00 64.86 63.63 2k74 h ILE 151 Cb -0.04 1.23 -0.03 0.00 -0.00 0.00 0.00 36.82 37.98 2k74 h ILE 151 CO -0.02 0.46 -0.01 0.00 -0.00 0.00 0.00 178.15 178.58 2k74 h ALA 152 N 0.83 0.16 -0.61 0.16 0.00 -1.37 -2.17 119.26 116.26 2k74 h ALA 152 Ca 0.10 0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.18 2k74 h ALA 152 Cb 0.77 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.57 2k74 h ALA 152 CO 0.06 -0.44 0.13 1.88 0.00 0.00 0.00 179.25 180.88 2k74 h TYR 153 N 0.05 0.20 -0.92 0.00 -1.99 -1.03 0.12 116.97 113.41 2k74 h TYR 153 Ca 0.09 0.04 0.17 0.00 2.00 0.00 0.00 58.73 61.03 2k74 h TYR 153 Cb 0.12 0.01 -0.08 0.00 2.00 0.00 0.00 36.73 38.78 2k74 h TYR 153 CO -0.18 -0.04 0.59 1.25 -0.00 0.00 0.00 178.16 179.78 2k74 h LEU 154 N 0.25 0.60 -0.37 3.88 5.85 -1.19 -0.24 115.31 124.09 2k74 h LEU 154 Ca 0.33 0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.98 2k74 h LEU 154 Cb 0.49 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2k74 h LEU 154 CO -0.42 0.26 -0.23 0.40 -0.34 0.00 0.00 178.44 178.12 2k74 h ILE 155 N 0.61 1.28 -0.85 4.05 1.08 -0.50 -2.43 117.51 120.75 2k74 h ILE 155 Ca 0.48 -1.38 0.09 0.00 -0.39 0.00 0.00 64.86 63.66 2k74 h ILE 155 Cb 0.91 1.35 -0.06 0.00 -3.07 0.00 0.00 36.82 35.95 2k74 h ILE 155 CO -0.23 0.46 0.55 0.58 -0.69 0.00 0.00 178.15 178.82 2k74 h VAL 156 N 0.62 0.99 -0.00 1.67 2.07 -0.40 -0.46 116.25 120.73 2k74 h VAL 156 Ca 0.08 -0.30 -0.17 0.00 0.82 0.00 0.00 66.70 67.13 2k74 h VAL 156 Cb 0.79 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 2k74 h VAL 156 CO 0.06 0.16 -0.80 0.00 0.02 0.00 0.00 177.57 177.01 2k74 h ALA 157 N 1.56 0.66 0.00 1.67 0.00 -1.31 -2.35 119.26 119.48 2k74 h ALA 157 Ca 0.39 -0.70 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 2k74 h ALA 157 Cb 0.36 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2k74 h ALA 157 CO -0.15 0.93 -0.55 0.28 0.00 0.00 0.00 179.25 179.76 2k74 h VAL 158 N 0.05 1.15 0.16 0.00 2.07 -0.71 -1.51 116.25 117.46 2k74 h VAL 158 Ca -0.02 -2.05 -0.30 0.00 0.82 0.00 0.00 66.70 65.15 2k74 h VAL 158 Cb 1.40 2.19 0.01 0.00 -1.52 0.00 0.00 31.29 33.37 2k74 h VAL 158 CO 0.11 0.54 -1.45 -0.07 0.02 0.00 0.00 177.57 176.72 2k74 h LEU 159 N 0.00 0.54 -0.59 2.57 3.38 -1.12 -2.90 115.31 117.19 2k74 h LEU 159 Ca -0.01 -0.91 -0.15 0.00 0.09 0.00 0.00 57.88 56.91 2k74 h LEU 159 Cb 1.14 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 2k74 h LEU 159 CO 0.07 1.66 -0.67 1.62 0.09 0.00 0.00 178.44 181.21 2k74 h VAL 160 N -0.12 1.43 0.01 1.22 3.04 -1.49 -2.23 116.25 118.12 2k74 h VAL 160 Ca -0.29 -2.19 -0.00 0.00 -1.01 0.00 0.00 66.70 63.21 2k74 h VAL 160 Cb 1.91 2.16 0.00 0.00 -2.01 0.00 0.00 31.29 33.35 2k74 h VAL 160 CO 0.14 0.64 -0.01 0.58 -1.01 0.00 0.00 177.57 177.91 2k74 h VAL 161 N 0.11 1.47 0.00 1.51 2.07 -1.41 -3.11 116.25 116.89 2k74 h VAL 161 Ca -0.01 -1.52 -0.01 0.00 0.82 0.00 0.00 66.70 65.97 2k74 h VAL 161 Cb 1.20 2.50 -0.00 0.00 -1.52 0.00 0.00 31.29 33.47 2k74 h VAL 161 CO 0.10 0.39 -0.04 0.40 0.02 0.00 0.00 177.57 178.43 2k74 h ILE 162 N -0.68 0.33 0.00 4.57 5.03 -1.57 -1.95 117.51 123.24 2k74 h ILE 162 Ca -0.00 -0.25 0.00 0.00 -0.12 0.00 0.00 64.86 64.48 2k74 h ILE 162 Cb 0.65 1.18 0.00 0.00 -3.03 0.00 0.00 36.82 35.63 2k74 h ILE 162 CO 0.00 0.04 0.00 -1.54 -0.68 0.00 0.00 178.15 175.98 2k74 n SER 163 N -3.46 0.00 -3.67 1.72 3.41 -0.84 -4.69 113.62 106.09 2k74 n SER 163 Ca -0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.26 2k74 n SER 163 Cb 0.16 -0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.14 2k74 n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k74 n GLN 164 N -0.93 0.00 0.11 4.33 6.02 -0.74 -4.48 117.38 121.68 2k74 n GLN 164 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2k74 n GLN 164 Cb 0.00 -0.92 0.02 0.00 1.02 0.00 0.00 30.24 30.36 2k74 n GLN 164 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2k74 n PRO 165 N 2.29 0.01 -2.34 -1.09 -0.02 -1.26 -4.81 135.00 127.79 2k74 n PRO 165 Ca -0.02 0.33 -0.00 0.00 -2.02 0.00 0.00 63.50 61.79 2k74 n PRO 165 Cb 0.52 -2.18 -0.00 0.00 -0.02 0.00 0.00 33.50 31.82 2k74 n PRO 165 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2k74 n PHE 166 N -1.52 -4.48 -0.11 6.00 7.35 -1.26 -4.98 117.46 118.46 2k74 n PHE 166 Ca -0.00 2.66 -0.14 0.00 -0.76 0.00 0.00 57.45 59.22 2k74 n PHE 166 Cb 0.64 -3.63 -0.13 0.00 0.35 0.00 0.00 39.48 36.71 2k74 n PHE 166 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 2k74 n LYS 167 N 1.87 0.73 -3.64 -4.13 4.81 -1.26 -5.05 118.16 111.50 2k74 n LYS 167 Ca -0.01 0.07 -0.04 0.00 -0.87 0.00 0.00 58.31 57.47 2k74 n LYS 167 Cb 0.01 -1.49 -0.06 0.00 0.02 0.00 0.00 35.03 33.51 2k74 n LYS 167 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k74 s ALA 168 N -2.48 -2.13 0.00 3.14 0.00 -1.26 -4.75 121.76 114.28 2k74 s ALA 168 Ca -0.22 1.77 0.00 0.00 0.00 0.00 0.00 51.96 53.51 2k74 s ALA 168 Cb 0.07 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.66 2k74 s ALA 168 CO 0.67 -0.19 0.00 1.17 0.00 0.00 0.00 175.76 177.41 2k74 n LYS 169 N 1.11 0.00 -0.11 0.00 3.00 -1.26 -4.98 118.16 115.93 2k74 n LYS 169 Ca -0.06 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.02 2k74 n LYS 169 Cb 0.58 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 35.49 2k74 n LYS 169 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2k74 n LYS 170 N -1.57 0.64 -3.23 1.64 4.81 -1.26 -4.91 118.16 114.29 2k74 n LYS 170 Ca 0.00 0.24 -0.02 0.00 -0.87 0.00 0.00 58.31 57.66 2k74 n LYS 170 Cb 0.00 -1.57 -0.02 0.00 0.02 0.00 0.00 35.03 33.46 2k74 n LYS 170 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 2k74 s ARG 171 N -2.51 0.73 0.99 1.64 1.70 -1.26 -5.16 118.95 115.09 2k74 s ARG 171 Ca -0.33 -0.21 -0.14 0.00 -0.47 0.00 0.00 55.73 54.57 2k74 s ARG 171 Cb 0.10 -0.04 0.23 0.00 -0.57 0.00 0.00 34.95 34.67 2k74 s ARG 171 CO 0.60 -1.16 0.51 -0.40 -1.08 0.00 0.00 175.30 173.76 2k74 n ASP 172 N 4.60 -3.20 0.00 -2.89 5.75 -1.26 -4.99 116.55 114.56 2k74 n ASP 172 Ca 0.10 -0.51 0.00 0.00 -0.01 0.00 0.00 54.79 54.36 2k74 n ASP 172 Cb 0.54 -0.71 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 2k74 n ASP 172 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k74 n LEU 173 N 0.00 0.00 -3.02 -2.12 -0.00 -1.26 -5.07 117.00 105.53 2k74 n LEU 173 Ca 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 56.08 2k74 n LEU 173 Cb 0.35 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.77 2k74 n LEU 173 CO 0.23 0.00 -0.38 0.33 -0.00 0.00 0.00 177.39 177.57 2k74 n PHE 174 N 0.00 -1.15 -2.68 1.47 7.35 -1.26 -4.88 117.46 116.31 2k74 n PHE 174 Ca 0.00 0.58 -0.39 0.00 -0.76 0.00 0.00 57.45 56.88 2k74 n PHE 174 Cb 0.00 -1.82 -0.06 0.00 0.35 0.00 0.00 39.48 37.96 2k74 n PHE 174 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2k74 s GLY 175 N -0.78 3.04 -1.52 7.13 0.00 -1.26 -4.94 107.32 108.99 2k74 s GLY 175 Ca -0.03 0.68 -0.11 0.00 0.00 0.00 0.00 44.72 45.25 2k74 s GLY 175 CO 0.22 1.23 2.65 0.54 0.00 0.00 0.00 173.10 177.74 2k74 n ARG 176 N 1.20 3.30 -3.94 2.90 1.74 -1.26 -4.48 116.66 116.12 2k74 n ARG 176 Ca -0.01 -2.30 -0.30 0.00 -0.77 0.00 0.00 57.85 54.46 2k74 n ARG 176 Cb 0.47 -2.96 0.02 0.00 -1.02 0.00 0.00 32.46 28.97 2k74 n ARG 176 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k74 n GLY 177 N 3.79 -0.48 7.00 -0.13 0.00 -1.26 -4.45 105.19 109.67 2k74 n GLY 177 Ca 0.68 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.88 2k74 n GLY 177 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2k74 n HIS 178 N -4.63 0.00 0.00 1.61 8.25 -1.26 -4.77 115.22 114.42 2k74 n HIS 178 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2k74 n HIS 178 Cb 0.53 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.64 2k74 n HIS 178 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2k74 n HIS 179 N 0.00 0.00 -3.79 4.41 1.44 -1.26 -5.14 115.22 110.87 2k74 n HIS 179 Ca 0.00 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.60 2k74 n HIS 179 Cb 0.00 0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.03 2k74 n HIS 179 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2k74 s HIS 180 N -2.00 -0.03 0.09 -1.40 3.76 -1.26 -5.05 115.29 109.40 2k74 s HIS 180 Ca 0.00 -0.15 0.00 0.00 -0.15 0.00 0.00 55.06 54.76 2k74 s HIS 180 Cb 0.00 0.04 0.00 0.00 1.11 0.00 0.00 32.58 33.73 2k74 s HIS 180 CO 0.00 -0.48 0.00 -2.39 -0.85 0.00 0.00 174.74 171.02 2k74 n HIS 181 N 0.59 -2.61 0.00 1.40 1.44 -1.26 -5.08 115.22 109.70 2k74 n HIS 181 Ca -0.19 0.32 0.00 0.00 -2.01 0.00 0.00 57.72 55.84 2k74 n HIS 181 Cb 0.59 1.13 0.00 0.00 0.12 0.00 0.00 29.99 31.83 2k74 n HIS 181 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2k74 n HIS 182 N -2.88 0.00 -0.13 -1.40 -0.00 -1.26 -5.41 115.22 104.15 2k74 n HIS 182 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2k74 n HIS 182 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2k74 n HIS 182 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06