#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k73 h LEU 2 N 0.00 -0.13 -0.95 4.03 7.12 -2.07 -2.51 115.31 120.81 2k73 h LEU 2 Ca 0.00 -0.05 0.27 0.00 0.13 0.00 0.00 57.88 58.23 2k73 h LEU 2 Cb 0.00 0.03 -0.14 0.00 -0.53 0.00 0.00 40.66 40.02 2k73 h LEU 2 CO 0.00 -0.03 0.42 -0.09 -0.13 0.00 0.00 178.44 178.61 2k73 h ARG 3 N -0.21 0.29 -0.74 1.25 2.43 -2.02 0.68 114.38 116.05 2k73 h ARG 3 Ca -0.02 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.10 2k73 h ARG 3 Cb 0.17 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 2k73 h ARG 3 CO 0.03 0.19 0.33 0.35 -1.51 0.00 0.00 179.97 179.36 2k73 h PHE 4 N 0.30 1.10 -0.95 2.20 3.57 -1.90 -2.32 116.94 118.95 2k73 h PHE 4 Ca 0.64 -0.07 0.21 0.00 3.53 0.00 0.00 57.97 62.28 2k73 h PHE 4 Cb 1.37 -0.34 -0.11 0.00 2.79 0.00 0.00 35.95 39.66 2k73 h PHE 4 CO -0.12 0.83 0.52 1.25 -2.23 0.00 0.00 178.31 178.55 2k73 h LEU 5 N 1.06 0.59 -1.28 0.59 6.46 0.67 1.00 115.31 124.40 2k73 h LEU 5 Ca 0.25 0.12 -0.08 0.00 -0.12 0.00 0.00 57.88 58.06 2k73 h LEU 5 Cb 0.16 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.12 2k73 h LEU 5 CO -0.03 0.14 -0.36 -1.13 -0.62 0.00 0.00 178.44 176.45 2k73 h ASN 6 N 0.59 0.00 0.02 1.25 -1.24 -1.16 0.37 115.58 115.41 2k73 h ASN 6 Ca 0.57 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.58 2k73 h ASN 6 Cb 1.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.05 2k73 h ASN 6 CO -0.45 0.36 -0.01 -0.61 -1.29 0.00 0.00 177.43 175.43 2k73 h GLN 7 N 0.00 -0.02 -0.24 6.67 -0.00 0.10 -0.46 115.11 121.15 2k73 h GLN 7 Ca -0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 58.59 2k73 h GLN 7 Cb 0.65 0.01 -0.01 0.00 0.00 0.00 0.00 27.48 28.12 2k73 h GLN 7 CO 0.05 0.68 -0.11 0.00 0.00 0.00 0.00 178.83 179.44 2k73 h ALA 8 N 0.16 1.36 0.03 3.38 0.00 -0.40 -2.77 119.26 121.02 2k73 h ALA 8 Ca -0.00 -0.24 -0.25 0.00 0.00 0.00 0.00 54.91 54.42 2k73 h ALA 8 Cb 0.71 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.39 2k73 h ALA 8 CO 0.00 0.44 -1.03 0.66 0.00 0.00 0.00 179.25 179.32 2k73 h SER 9 N 0.37 0.59 0.00 0.00 4.64 -0.98 -3.03 113.55 115.14 2k73 h SER 9 Ca 0.07 -0.50 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2k73 h SER 9 Cb 0.43 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 2k73 h SER 9 CO 0.02 1.31 0.00 0.00 -0.87 0.00 0.00 176.83 177.30 2k73 n GLN 10 N -3.73 0.53 -3.87 4.77 1.13 -0.18 -4.65 117.38 111.39 2k73 n GLN 10 Ca -0.08 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.66 2k73 n GLN 10 Cb 0.89 -1.37 -0.04 0.00 0.11 0.00 0.00 30.24 29.82 2k73 n GLN 10 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2k73 s GLY 11 N -1.86 2.20 -0.02 1.08 0.00 -1.14 -4.93 107.32 102.64 2k73 s GLY 11 Ca 0.19 -0.76 -0.25 0.00 0.00 0.00 0.00 44.72 43.90 2k73 s GLY 11 CO 0.15 -0.71 1.23 3.21 0.00 0.00 0.00 173.10 176.98 2k73 h ARG 12 N 3.22 0.07 -0.92 2.90 3.08 -1.86 -2.95 114.38 117.91 2k73 h ARG 12 Ca -0.46 -0.04 0.26 0.00 0.07 0.00 0.00 59.98 59.81 2k73 h ARG 12 Cb 1.17 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 31.06 2k73 h ARG 12 CO 0.74 0.59 0.19 0.78 -1.07 0.00 0.00 179.97 181.19 2k73 h GLY 13 N -0.44 1.39 0.88 0.04 0.00 -1.96 0.59 103.07 103.58 2k73 h GLY 13 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 2k73 h GLY 13 CO 0.01 -0.46 0.08 0.00 0.00 0.00 0.00 176.54 176.16 2k73 h ALA 14 N 1.87 0.27 -0.40 3.60 0.00 -1.75 -1.33 119.26 121.53 2k73 h ALA 14 Ca 0.59 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.40 2k73 h ALA 14 Cb 1.26 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 2k73 h ALA 14 CO -0.76 -0.12 0.22 -1.49 0.00 0.00 0.00 179.25 177.10 2k73 h TRP 15 N 0.18 0.40 0.00 0.00 4.06 0.16 -0.32 115.95 120.43 2k73 h TRP 15 Ca 0.07 0.01 -0.00 0.00 2.06 0.00 0.00 58.89 61.03 2k73 h TRP 15 Cb 0.20 -0.12 -0.00 0.00 -1.00 0.00 0.00 29.16 28.24 2k73 h TRP 15 CO -0.00 0.22 -0.01 -0.07 -3.56 0.00 0.00 178.44 175.02 2k73 h LEU 16 N 0.44 0.00 -0.81 -4.49 3.38 -0.26 -0.51 115.31 113.05 2k73 h LEU 16 Ca 0.16 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 2k73 h LEU 16 Cb 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2k73 h LEU 16 CO -0.09 0.01 -0.55 0.25 0.09 0.00 0.00 178.44 178.15 2k73 h LEU 17 N 0.00 0.14 -0.70 1.67 5.85 0.11 -2.53 115.31 119.86 2k73 h LEU 17 Ca -0.00 -0.08 -0.14 0.00 0.84 0.00 0.00 57.88 58.51 2k73 h LEU 17 Cb 0.02 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 2k73 h LEU 17 CO 0.00 0.66 -0.51 0.24 -0.34 0.00 0.00 178.44 178.49 2k73 h MET 18 N 0.10 0.36 0.09 1.25 2.86 -0.46 -2.68 114.93 116.45 2k73 h MET 18 Ca -0.00 -0.21 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2k73 h MET 18 Cb 1.00 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.67 2k73 h MET 18 CO 0.08 0.79 -0.04 0.00 1.06 0.00 0.00 176.91 178.79 2k73 h ALA 19 N 1.17 -0.12 -0.43 6.32 0.00 -1.31 -2.80 119.26 122.10 2k73 h ALA 19 Ca 0.01 -0.23 0.09 0.00 0.00 0.00 0.00 54.91 54.78 2k73 h ALA 19 Cb 1.00 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2k73 h ALA 19 CO 0.09 -0.32 0.30 0.35 0.00 0.00 0.00 179.25 179.66 2k73 h PHE 20 N -0.60 0.18 0.17 0.00 3.57 -1.48 0.80 116.94 119.57 2k73 h PHE 20 Ca -0.01 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 2k73 h PHE 20 Cb 0.50 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.18 2k73 h PHE 20 CO 0.08 0.09 -0.08 1.79 -2.23 0.00 0.00 178.31 177.96 2k73 h THR 21 N 0.17 0.96 0.00 4.41 1.35 -1.41 0.59 112.91 118.97 2k73 h THR 21 Ca 0.20 -0.72 -0.05 0.00 -0.55 0.00 0.00 66.41 65.28 2k73 h THR 21 Cb 0.57 1.39 -0.01 0.00 -1.73 0.00 0.00 68.15 68.37 2k73 h THR 21 CO -0.03 0.16 -0.25 0.00 -0.25 0.00 0.00 175.52 175.15 2k73 h ALA 22 N 0.16 1.49 0.10 6.62 0.00 -1.15 -2.71 119.26 123.77 2k73 h ALA 22 Ca -0.02 -0.23 -0.25 0.00 0.00 0.00 0.00 54.91 54.41 2k73 h ALA 22 Cb 0.44 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.21 2k73 h ALA 22 CO 0.04 0.32 -1.02 1.25 0.00 0.00 0.00 179.25 179.83 2k73 h LEU 23 N 0.00 0.73 -1.62 0.00 5.85 -0.74 -3.10 115.31 116.44 2k73 h LEU 23 Ca -0.00 -0.83 0.14 0.00 0.84 0.00 0.00 57.88 58.03 2k73 h LEU 23 Cb 0.47 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.23 2k73 h LEU 23 CO 0.03 1.49 0.48 0.00 -0.34 0.00 0.00 178.44 180.10 2k73 h ALA 24 N 0.26 2.12 -0.09 1.25 0.00 0.49 0.18 119.26 123.46 2k73 h ALA 24 Ca -0.16 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 2k73 h ALA 24 Cb 1.73 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.46 2k73 h ALA 24 CO 0.20 -0.31 -0.71 1.25 0.00 0.00 0.00 179.25 179.67 2k73 h LEU 25 N 0.39 0.53 -0.19 0.00 6.46 -1.52 -1.28 115.31 119.70 2k73 h LEU 25 Ca 0.35 -0.34 -0.13 0.00 -0.12 0.00 0.00 57.88 57.64 2k73 h LEU 25 Cb 0.81 -0.15 0.00 0.00 -0.73 0.00 0.00 40.66 40.59 2k73 h LEU 25 CO -0.10 1.08 -0.38 -0.33 -0.62 0.00 0.00 178.44 178.09 2k73 h GLU 26 N 0.31 0.59 0.48 1.25 4.39 -0.77 -2.32 114.58 118.51 2k73 h GLU 26 Ca -0.03 -0.38 -0.02 0.00 0.34 0.00 0.00 59.36 59.27 2k73 h GLU 26 Cb 1.29 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.99 2k73 h GLU 26 CO 0.13 1.00 -0.23 1.25 -1.16 0.00 0.00 179.01 179.99 2k73 h LEU 27 N 0.26 -0.55 -1.98 1.33 6.46 -0.80 0.34 115.31 120.37 2k73 h LEU 27 Ca 0.01 -0.07 0.26 0.00 -0.12 0.00 0.00 57.88 57.96 2k73 h LEU 27 Cb 0.98 0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 41.01 2k73 h LEU 27 CO 0.08 -0.15 0.64 0.71 -0.62 0.00 0.00 178.44 179.11 2k73 h THR 28 N -1.05 0.56 0.16 1.05 1.35 -1.34 0.78 112.91 114.41 2k73 h THR 28 Ca -0.07 -0.01 -0.24 0.00 -0.55 0.00 0.00 66.41 65.55 2k73 h THR 28 Cb 0.58 0.54 0.02 0.00 -1.73 0.00 0.00 68.15 67.56 2k73 h THR 28 CO 0.11 0.00 -1.08 0.00 -0.25 0.00 0.00 175.52 174.30 2k73 h ALA 29 N 1.56 -0.05 0.00 6.62 0.00 -1.27 -3.16 119.26 122.96 2k73 h ALA 29 Ca 0.43 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2k73 h ALA 29 Cb 1.69 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.68 2k73 h ALA 29 CO -0.01 0.54 0.13 1.28 0.00 0.00 0.00 179.25 181.19 2k73 n LEU 30 N -4.00 0.44 -0.02 0.00 4.77 0.12 -0.54 117.00 117.77 2k73 n LEU 30 Ca -0.17 0.66 -0.17 0.00 -0.03 0.00 0.00 56.01 56.30 2k73 n LEU 30 Cb 0.90 -0.67 -0.14 0.00 -2.33 0.00 0.00 43.42 41.18 2k73 n LEU 30 CO 0.49 -0.81 -0.81 1.87 -1.33 0.00 0.00 177.39 176.80 2k73 n TRP 31 N -2.12 0.97 -0.36 -1.77 -0.00 -0.81 -3.09 117.44 110.25 2k73 n TRP 31 Ca -0.01 0.25 -0.00 0.00 -0.00 0.00 0.00 57.50 57.73 2k73 n TRP 31 Cb 0.16 -1.14 0.14 0.00 -0.00 0.00 0.00 31.31 30.46 2k73 n TRP 31 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 177.69 178.43 2k73 h PHE 32 N 0.04 1.20 -0.00 5.87 0.04 -0.78 -1.58 116.94 121.73 2k73 h PHE 32 Ca -0.41 0.03 -0.22 0.00 2.80 0.00 0.00 57.97 60.16 2k73 h PHE 32 Cb 2.03 -0.40 0.00 0.00 2.20 0.00 0.00 35.95 39.78 2k73 h PHE 32 CO 0.05 0.69 -0.93 -0.56 -0.60 0.00 0.00 178.31 176.96 2k73 h GLN 33 N 1.24 0.41 -0.08 1.51 3.07 -1.65 1.01 115.11 120.62 2k73 h GLN 33 Ca 0.39 -0.44 0.02 0.00 0.09 0.00 0.00 58.65 58.71 2k73 h GLN 33 Cb 0.00 0.12 -0.00 0.00 0.08 0.00 0.00 27.48 27.68 2k73 h GLN 33 CO -0.12 1.10 0.06 1.25 0.09 0.00 0.00 178.83 181.21 2k73 h HIS 34 N 0.24 0.00 0.00 0.06 2.76 -1.29 0.78 115.15 117.70 2k73 h HIS 34 Ca -0.08 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 57.81 2k73 h HIS 34 Cb 1.56 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.47 2k73 h HIS 34 CO 0.06 0.00 -2.08 1.33 -1.30 0.00 0.00 177.93 175.94 2k73 n VAL 35 N -4.35 1.09 1.97 5.26 0.24 -0.67 -4.39 118.33 117.48 2k73 n VAL 35 Ca -0.01 -0.46 0.16 0.00 -2.04 0.00 0.00 64.34 61.99 2k73 n VAL 35 Cb 0.17 -1.08 0.93 0.00 -1.47 0.00 0.00 33.84 32.39 2k73 n VAL 35 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 2k73 n MET 36 N -2.97 1.03 -3.99 7.34 0.00 0.35 -4.90 117.12 113.98 2k73 n MET 36 Ca -0.32 -0.05 -0.27 0.00 -0.00 0.00 0.00 57.70 57.06 2k73 n MET 36 Cb 0.88 -1.50 -0.02 0.00 0.00 0.00 0.00 33.22 32.59 2k73 n MET 36 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 2k73 n LEU 37 N -0.94 -2.19 -4.84 -0.89 7.94 0.27 -4.93 117.00 111.42 2k73 n LEU 37 Ca 0.24 -0.99 -0.32 0.00 -1.11 0.00 0.00 56.01 53.83 2k73 n LEU 37 Cb 0.12 -2.24 -0.06 0.00 0.53 0.00 0.00 43.42 41.78 2k73 n LEU 37 CO 0.18 0.41 0.51 -0.22 -1.11 0.00 0.00 177.39 177.16 2k73 s LEU 38 N -7.03 3.97 -0.05 -1.96 0.20 -1.01 -5.04 118.68 107.75 2k73 s LEU 38 Ca 0.18 1.41 0.06 0.00 0.69 0.00 0.00 54.13 56.47 2k73 s LEU 38 Cb -0.10 -4.25 -0.02 0.00 -0.43 0.00 0.00 46.19 41.40 2k73 s LEU 38 CO 0.89 -0.30 -0.21 -1.59 -0.29 0.00 0.00 176.35 174.85 2k73 s LYS 39 N -3.20 2.45 0.85 1.98 -2.85 -1.26 -4.90 119.74 112.81 2k73 s LYS 39 Ca 0.57 -0.84 -0.12 0.00 -1.00 0.00 0.00 55.97 54.58 2k73 s LYS 39 Cb -0.10 -2.22 0.10 0.00 -2.06 0.00 0.00 37.83 33.56 2k73 s LYS 39 CO 0.18 0.50 1.12 -1.25 0.10 0.00 0.00 175.35 176.00 2k73 s PRO 40 N -0.44 1.63 0.43 1.78 0.04 -1.24 -4.87 135.00 132.33 2k73 s PRO 40 Ca 0.05 0.43 0.03 0.00 0.04 0.00 0.00 61.00 61.55 2k73 s PRO 40 Cb -0.12 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 2k73 s PRO 40 CO 0.01 -1.89 0.05 0.00 0.04 0.00 0.00 177.00 175.21 2k73 h VAL 42 N 1.68 0.58 -0.12 0.00 2.07 -1.88 -1.57 116.25 117.01 2k73 h VAL 42 Ca -0.41 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 2k73 h VAL 42 Cb 1.28 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 2k73 h VAL 42 CO 0.69 0.00 0.02 0.25 0.02 0.00 0.00 177.57 178.55 2k73 h LEU 43 N -0.47 0.19 -0.66 2.57 5.85 -1.97 -2.47 115.31 118.35 2k73 h LEU 43 Ca -0.02 -0.26 0.14 0.00 0.84 0.00 0.00 57.88 58.58 2k73 h LEU 43 Cb 0.41 -0.05 -0.11 0.00 0.37 0.00 0.00 40.66 41.28 2k73 h LEU 43 CO -0.00 0.40 0.02 0.77 -0.34 0.00 0.00 178.44 179.28 2k73 h SER 44 N -0.03 -0.26 -0.52 1.25 4.64 -1.94 0.36 113.55 117.04 2k73 h SER 44 Ca 0.04 0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 61.51 2k73 h SER 44 Cb 0.29 0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 2k73 h SER 44 CO 0.00 -0.12 0.29 0.40 -0.87 0.00 0.00 176.83 176.53 2k73 h ILE 45 N 0.13 1.18 -0.34 0.95 1.08 -1.20 -0.76 117.51 118.55 2k73 h ILE 45 Ca 0.35 -0.44 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 2k73 h ILE 45 Cb 0.58 0.52 -0.02 0.00 -3.07 0.00 0.00 36.82 34.83 2k73 h ILE 45 CO -0.56 0.19 0.22 0.22 -0.69 0.00 0.00 178.15 177.53 2k73 h TYR 46 N 0.70 0.43 -0.81 1.37 5.03 -0.42 -2.12 116.97 121.15 2k73 h TYR 46 Ca 0.18 0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.51 2k73 h TYR 46 Cb 0.04 -0.14 -0.04 0.00 1.55 0.00 0.00 36.73 38.14 2k73 h TYR 46 CO -0.02 0.29 0.54 1.49 -1.32 0.00 0.00 178.16 179.14 2k73 h GLU 47 N 0.45 1.07 0.00 1.82 4.81 -0.10 -0.12 114.58 122.50 2k73 h GLU 47 Ca 0.12 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2k73 h GLU 47 Cb -0.03 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.11 2k73 h GLU 47 CO -0.03 0.70 -0.03 -0.09 -0.73 0.00 0.00 179.01 178.84 2k73 h ARG 48 N 1.10 0.00 -0.22 1.92 2.43 -0.50 -1.21 114.38 117.90 2k73 h ARG 48 Ca 0.30 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.31 2k73 h ARG 48 Cb -0.12 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 2k73 h ARG 48 CO -0.07 0.03 -0.53 0.00 -1.51 0.00 0.00 179.97 177.90 2k73 h ALA 49 N 1.97 0.66 -0.01 2.80 0.00 -0.52 0.31 119.26 124.47 2k73 h ALA 49 Ca -0.00 -0.50 0.01 0.00 0.00 0.00 0.00 54.91 54.42 2k73 h ALA 49 Cb 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2k73 h ALA 49 CO 0.00 0.68 -0.04 0.00 0.00 0.00 0.00 179.25 179.90 2k73 h ALA 50 N 0.92 -0.03 0.07 0.00 0.00 -0.92 0.48 119.26 119.79 2k73 h ALA 50 Ca 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2k73 h ALA 50 Cb 1.08 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2k73 h ALA 50 CO 0.10 -0.53 -0.04 1.25 0.00 0.00 0.00 179.25 180.03 2k73 h LEU 51 N -0.07 -0.08 -1.12 0.00 5.85 -1.52 -2.72 115.31 115.66 2k73 h LEU 51 Ca 0.02 -0.49 0.35 0.00 0.84 0.00 0.00 57.88 58.61 2k73 h LEU 51 Cb 0.10 0.02 -0.14 0.00 0.37 0.00 0.00 40.66 41.01 2k73 h LEU 51 CO -0.05 0.59 0.63 0.15 -0.34 0.00 0.00 178.44 179.42 2k73 h PHE 52 N -0.92 0.81 -0.45 1.25 3.57 -0.41 1.26 116.94 122.06 2k73 h PHE 52 Ca -0.01 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.42 2k73 h PHE 52 Cb 0.57 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 2k73 h PHE 52 CO 0.13 -0.20 -0.11 0.78 -2.23 0.00 0.00 178.31 176.68 2k73 h GLY 53 N 0.24 0.94 0.91 2.40 0.00 -0.92 -2.91 103.07 103.73 2k73 h GLY 53 Ca 0.75 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 2k73 h GLY 53 CO -0.56 0.71 0.08 -2.08 0.00 0.00 0.00 176.54 174.70 2k73 h VAL 54 N 0.71 1.14 -0.80 4.60 2.07 0.18 -2.38 116.25 121.76 2k73 h VAL 54 Ca 0.11 -0.41 0.17 0.00 0.82 0.00 0.00 66.70 67.40 2k73 h VAL 54 Cb 0.66 1.07 -0.15 0.00 -1.52 0.00 0.00 31.29 31.35 2k73 h VAL 54 CO 0.05 0.13 -0.14 0.25 0.02 0.00 0.00 177.57 177.88 2k73 h LEU 55 N 0.16 -0.64 -2.01 2.57 7.12 -0.60 2.26 115.31 124.18 2k73 h LEU 55 Ca 0.06 0.23 -0.01 0.00 0.13 0.00 0.00 57.88 58.30 2k73 h LEU 55 Cb 0.13 0.46 -0.00 0.00 -0.53 0.00 0.00 40.66 40.72 2k73 h LEU 55 CO -0.01 -0.25 -0.03 1.23 -0.13 0.00 0.00 178.44 179.26 2k73 h GLY 56 N 0.02 0.00 1.73 3.75 0.00 -1.26 -0.90 103.07 106.41 2k73 h GLY 56 Ca 0.41 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.62 2k73 h GLY 56 CO -0.79 0.00 -0.44 0.00 0.00 0.00 0.00 176.54 175.31 2k73 h ALA 57 N 1.97 1.02 0.00 3.60 0.00 0.42 -2.73 119.26 123.55 2k73 h ALA 57 Ca -0.00 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 2k73 h ALA 57 Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2k73 h ALA 57 CO 0.00 0.62 -0.34 0.00 0.00 0.00 0.00 179.25 179.53 2k73 h ALA 58 N 1.30 0.87 -0.12 0.00 0.00 0.28 -0.70 119.26 120.89 2k73 h ALA 58 Ca 0.02 -0.31 -0.23 0.00 0.00 0.00 0.00 54.91 54.39 2k73 h ALA 58 Cb 0.87 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.62 2k73 h ALA 58 CO 0.07 0.43 -0.82 -0.07 0.00 0.00 0.00 179.25 178.85 2k73 h LEU 59 N 0.00 0.88 0.12 0.00 -0.00 -1.16 -2.26 115.31 112.90 2k73 h LEU 59 Ca -0.00 -0.60 -0.29 0.00 -0.00 0.00 0.00 57.88 56.98 2k73 h LEU 59 Cb 1.06 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 41.45 2k73 h LEU 59 CO 0.04 1.40 -1.39 0.16 -0.00 0.00 0.00 178.44 178.65 2k73 h ILE 60 N 0.48 1.33 -0.56 1.22 3.07 -1.49 -3.33 117.51 118.23 2k73 h ILE 60 Ca -0.06 -2.93 -0.08 0.00 1.55 0.00 0.00 64.86 63.33 2k73 h ILE 60 Cb 1.45 2.85 -0.02 0.00 -0.27 0.00 0.00 36.82 40.83 2k73 h ILE 60 CO 0.16 0.85 0.02 1.23 -1.05 0.00 0.00 178.15 179.37 2k73 h GLY 61 N 1.65 1.02 -0.11 0.16 0.00 -1.19 -2.19 103.07 102.41 2k73 h GLY 61 Ca -0.19 -0.70 0.00 0.00 0.00 0.00 0.00 47.33 46.44 2k73 h GLY 61 CO 0.18 0.65 0.00 0.00 0.00 0.00 0.00 176.54 177.37 2k73 n ALA 62 N -2.48 1.92 0.04 3.60 0.00 -0.85 -2.46 120.51 120.29 2k73 n ALA 62 Ca 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.41 2k73 n ALA 62 Cb 0.31 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.66 2k73 n ALA 62 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2k73 h ILE 63 N 0.00 1.26 0.00 0.00 2.04 -1.56 -3.45 117.51 115.80 2k73 h ILE 63 Ca 0.00 -2.95 0.00 0.00 1.00 0.00 0.00 64.86 62.91 2k73 h ILE 63 Cb 0.02 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 38.71 2k73 h ILE 63 CO 0.00 0.72 0.00 0.00 0.00 0.00 0.00 178.15 178.87 2k73 n ALA 64 N -2.39 0.00 0.86 1.87 0.00 -1.03 -5.02 120.51 114.80 2k73 n ALA 64 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2k73 n ALA 64 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.39 2k73 n ALA 64 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2k73 n PRO 65 N 0.00 0.86 0.00 0.00 -0.04 -1.22 -2.68 135.00 131.93 2k73 n PRO 65 Ca 0.00 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.51 2k73 n PRO 65 Cb 0.00 -1.33 -0.02 0.00 -0.04 0.00 0.00 33.50 32.11 2k73 n PRO 65 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2k73 n LYS 66 N 0.21 2.61 -4.29 0.54 4.81 -1.26 -4.86 118.16 115.93 2k73 n LYS 66 Ca 0.00 -0.42 -0.24 0.00 -0.87 0.00 0.00 58.31 56.78 2k73 n LYS 66 Cb 0.28 -1.04 -0.08 0.00 0.02 0.00 0.00 35.03 34.21 2k73 n LYS 66 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2k73 s THR 67 N -1.52 2.93 0.21 3.15 -4.23 -1.09 -4.96 115.64 110.13 2k73 s THR 67 Ca 0.07 -1.93 0.01 0.00 -1.18 0.00 0.00 61.69 58.66 2k73 s THR 67 Cb 0.08 -2.81 0.01 0.00 1.34 0.00 0.00 72.50 71.11 2k73 s THR 67 CO 0.29 -0.26 0.72 -2.65 -0.54 0.00 0.00 174.62 172.18 2k73 n PRO 68 N -0.95 0.02 -0.46 3.99 -0.02 -1.26 -1.99 135.00 134.32 2k73 n PRO 68 Ca -0.05 0.36 0.38 0.00 -2.02 0.00 0.00 63.50 62.17 2k73 n PRO 68 Cb 0.61 -2.19 0.67 0.00 -0.02 0.00 0.00 33.50 32.57 2k73 n PRO 68 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2k73 h LEU 69 N 0.00 0.21 -0.28 2.45 3.38 -1.93 -1.73 115.31 117.41 2k73 h LEU 69 Ca 0.00 0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.11 2k73 h LEU 69 Cb 1.30 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 42.12 2k73 h LEU 69 CO 0.00 -0.14 -0.16 0.54 0.09 0.00 0.00 178.44 178.76 2k73 n ARG 70 N -4.58 -0.12 -0.31 1.13 1.74 -0.84 0.16 116.66 113.84 2k73 n ARG 70 Ca 0.37 1.09 0.26 0.00 -0.77 0.00 0.00 57.85 58.81 2k73 n ARG 70 Cb 1.47 -1.63 0.59 0.00 -1.02 0.00 0.00 32.46 31.87 2k73 n ARG 70 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 2k73 h TYR 71 N 0.00 0.44 -0.19 -1.55 0.05 -1.62 0.35 116.97 114.45 2k73 h TYR 71 Ca 0.04 0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.79 2k73 h TYR 71 Cb 0.11 -0.13 -0.00 0.00 1.01 0.00 0.00 36.73 37.72 2k73 h TYR 71 CO -0.92 0.04 -0.09 0.28 -1.05 0.00 0.00 178.16 176.42 2k73 h VAL 72 N 0.26 1.31 0.15 -2.88 2.07 0.15 -2.60 116.25 114.71 2k73 h VAL 72 Ca 0.57 -1.15 -0.21 0.00 0.82 0.00 0.00 66.70 66.74 2k73 h VAL 72 Cb 1.71 1.66 0.02 0.00 -1.52 0.00 0.00 31.29 33.16 2k73 h VAL 72 CO -0.20 0.35 -0.89 0.00 0.02 0.00 0.00 177.57 176.84 2k73 h ALA 73 N 0.69 -0.09 0.00 1.67 0.00 0.65 -3.24 119.26 118.95 2k73 h ALA 73 Ca 0.04 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2k73 h ALA 73 Cb 0.58 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2k73 h ALA 73 CO 0.03 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.70 2k73 h MET 74 N -0.28 0.00 -0.42 0.00 3.00 -0.47 -1.00 114.93 115.76 2k73 h MET 74 Ca -0.15 0.00 0.06 0.00 0.00 0.00 0.00 59.70 59.61 2k73 h MET 74 Cb 1.70 0.00 -0.02 0.00 0.00 0.00 0.00 31.60 33.27 2k73 h MET 74 CO 0.17 0.00 0.28 0.28 0.00 0.00 0.00 176.91 177.64 2k73 h VAL 75 N 0.00 0.95 0.06 -0.10 2.07 -1.48 0.50 116.25 118.24 2k73 h VAL 75 Ca 0.00 -0.10 -0.31 0.00 0.82 0.00 0.00 66.70 67.10 2k73 h VAL 75 Cb 0.00 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2k73 h VAL 75 CO 0.00 0.06 -1.73 0.40 0.02 0.00 0.00 177.57 176.31 2k73 h ILE 76 N 0.31 0.87 -0.36 4.57 1.08 -1.39 -2.93 117.51 119.66 2k73 h ILE 76 Ca 0.18 -2.64 -0.03 0.00 -0.39 0.00 0.00 64.86 61.98 2k73 h ILE 76 Cb 0.34 2.53 -0.01 0.00 -3.07 0.00 0.00 36.82 36.61 2k73 h ILE 76 CO -0.04 0.69 0.10 -0.25 -0.69 0.00 0.00 178.15 177.96 2k73 h TRP 77 N 0.03 0.58 -0.17 1.37 2.91 -1.14 -2.69 115.95 116.85 2k73 h TRP 77 Ca -0.31 -0.06 -0.05 0.00 1.13 0.00 0.00 58.89 59.60 2k73 h TRP 77 Cb 2.01 -0.17 -0.00 0.00 -0.51 0.00 0.00 29.16 30.49 2k73 h TRP 77 CO 0.04 0.58 -0.10 1.25 -1.03 0.00 0.00 178.44 179.18 2k73 h LEU 78 N 0.42 0.38 -0.95 0.65 5.85 -0.20 -1.47 115.31 119.99 2k73 h LEU 78 Ca 0.11 -0.42 0.27 0.00 0.84 0.00 0.00 57.88 58.68 2k73 h LEU 78 Cb 0.28 -0.10 -0.14 0.00 0.37 0.00 0.00 40.66 41.06 2k73 h LEU 78 CO -0.00 0.72 0.43 1.88 -0.34 0.00 0.00 178.44 181.13 2k73 h TYR 79 N 0.04 0.70 0.00 1.25 -1.99 -1.43 1.18 116.97 116.71 2k73 h TYR 79 Ca 0.04 0.04 -0.08 0.00 2.00 0.00 0.00 58.73 60.73 2k73 h TYR 79 Cb 0.58 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 39.15 2k73 h TYR 79 CO 0.07 -0.15 -0.44 0.66 -0.00 0.00 0.00 178.16 178.30 2k73 h SER 80 N 0.31 0.00 0.97 3.88 4.64 -1.35 -2.63 113.55 119.37 2k73 h SER 80 Ca 0.64 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.91 2k73 h SER 80 Cb 1.36 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.46 2k73 h SER 80 CO -0.60 0.37 -0.46 0.00 -0.87 0.00 0.00 176.83 175.26 2k73 h ALA 81 N 1.63 -1.30 0.10 5.18 0.00 0.25 0.60 119.26 125.72 2k73 h ALA 81 Ca -0.01 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2k73 h ALA 81 Cb 1.29 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.59 2k73 h ALA 81 CO 0.05 -1.22 -0.05 0.35 0.00 0.00 0.00 179.25 178.38 2k73 h PHE 82 N -1.31 -0.12 -0.19 0.00 3.04 -1.52 -2.81 116.94 114.03 2k73 h PHE 82 Ca -0.13 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.78 2k73 h PHE 82 Cb 1.00 0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.54 2k73 h PHE 82 CO -0.00 0.40 -0.00 0.00 -2.02 0.00 0.00 178.31 176.69 2k73 h ARG 83 N -0.87 0.34 -0.39 1.11 2.47 -1.58 0.11 114.38 115.57 2k73 h ARG 83 Ca -0.01 -0.11 0.04 0.00 -1.26 0.00 0.00 59.98 58.64 2k73 h ARG 83 Cb 0.57 -0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.82 2k73 h ARG 83 CO 0.02 0.54 0.15 0.78 0.56 0.00 0.00 179.97 182.02 2k73 h GLY 84 N 0.09 0.51 0.79 0.04 0.00 0.10 0.29 103.07 104.88 2k73 h GLY 84 Ca 0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.27 2k73 h GLY 84 CO 0.01 0.04 -0.01 -2.08 0.00 0.00 0.00 176.54 174.50 2k73 h VAL 85 N 0.31 1.26 -0.60 4.60 2.07 -1.42 0.51 116.25 122.98 2k73 h VAL 85 Ca 0.18 -0.86 0.05 0.00 0.82 0.00 0.00 66.70 66.89 2k73 h VAL 85 Cb 0.15 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.39 2k73 h VAL 85 CO -0.17 0.26 0.32 -0.61 0.02 0.00 0.00 177.57 177.39 2k73 h GLN 86 N 0.02 0.59 0.11 1.57 -0.00 -0.43 -2.24 115.11 114.73 2k73 h GLN 86 Ca 0.04 -0.04 -0.01 0.00 -0.00 0.00 0.00 58.65 58.65 2k73 h GLN 86 Cb 0.39 -0.13 0.00 0.00 0.00 0.00 0.00 27.48 27.74 2k73 h GLN 86 CO 0.01 0.39 -0.05 1.25 0.00 0.00 0.00 178.83 180.43 2k73 h LEU 87 N 0.61 -0.12 -1.48 -2.39 6.46 -0.33 -2.24 115.31 115.81 2k73 h LEU 87 Ca 0.27 -0.20 0.12 0.00 -0.12 0.00 0.00 57.88 57.94 2k73 h LEU 87 Cb 0.17 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.12 2k73 h LEU 87 CO -0.18 0.14 0.68 0.71 -0.62 0.00 0.00 178.44 179.17 2k73 h THR 88 N -0.39 0.14 -0.07 1.05 1.35 -0.50 0.61 112.91 115.11 2k73 h THR 88 Ca -0.01 0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 65.73 2k73 h THR 88 Cb 0.32 0.41 0.01 0.00 -1.73 0.00 0.00 68.15 67.15 2k73 h THR 88 CO 0.02 0.00 -0.39 0.22 -0.25 0.00 0.00 175.52 175.12 2k73 h TYR 89 N 0.00 0.53 -0.96 4.73 3.20 -0.82 -2.82 116.97 120.83 2k73 h TYR 89 Ca 0.19 -0.24 0.17 0.00 3.14 0.00 0.00 58.73 62.00 2k73 h TYR 89 Cb 1.55 -0.08 -0.09 0.00 1.54 0.00 0.00 36.73 39.65 2k73 h TYR 89 CO 0.00 0.99 0.61 1.49 -1.64 0.00 0.00 178.16 179.61 2k73 h GLU 90 N -0.09 0.67 -0.40 1.82 4.81 0.31 0.30 114.58 122.01 2k73 h GLU 90 Ca -0.03 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 2k73 h GLU 90 Cb 1.05 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 2k73 h GLU 90 CO 0.08 0.45 -0.15 1.25 -0.73 0.00 0.00 179.01 179.91 2k73 h HIS 91 N 0.69 0.92 0.11 0.92 2.76 -1.48 -1.21 115.15 117.86 2k73 h HIS 91 Ca 0.51 -0.21 -0.01 0.00 -2.20 0.00 0.00 60.37 58.46 2k73 h HIS 91 Cb 0.87 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 29.62 2k73 h HIS 91 CO -0.00 0.96 -0.05 1.79 -1.30 0.00 0.00 177.93 179.32 2k73 h THR 92 N 0.61 1.07 -0.06 6.26 1.35 -0.66 0.21 112.91 121.70 2k73 h THR 92 Ca 0.09 -0.71 0.03 0.00 -0.55 0.00 0.00 66.41 65.27 2k73 h THR 92 Cb 0.69 1.51 -0.03 0.00 -1.73 0.00 0.00 68.15 68.59 2k73 h THR 92 CO 0.05 0.17 -0.11 -0.03 -0.25 0.00 0.00 175.52 175.35 2k73 h MET 93 N -0.47 -0.16 -0.69 4.72 -1.53 -0.55 -0.34 114.93 115.90 2k73 h MET 93 Ca -0.01 0.01 -0.03 0.00 -3.44 0.00 0.00 59.70 56.22 2k73 h MET 93 Cb 0.39 0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.44 2k73 h MET 93 CO 0.02 -0.11 0.29 1.25 0.14 0.00 0.00 176.91 178.51 2k73 h LEU 94 N -0.17 0.94 -0.66 3.39 5.85 -1.24 2.67 115.31 126.09 2k73 h LEU 94 Ca 0.06 -0.16 0.07 0.00 0.84 0.00 0.00 57.88 58.69 2k73 h LEU 94 Cb 0.25 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.98 2k73 h LEU 94 CO -0.16 0.84 0.35 -0.61 -0.34 0.00 0.00 178.44 178.52 2k73 h GLN 95 N 0.98 0.61 -0.01 1.25 4.15 -0.04 0.13 115.11 122.17 2k73 h GLN 95 Ca 0.23 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.62 2k73 h GLN 95 Cb 0.18 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.73 2k73 h GLN 95 CO -0.02 0.40 -0.51 -0.11 -1.93 0.00 0.00 178.83 176.66 2k73 n LEU 96 N -4.83 1.31 -3.19 -2.39 0.00 -0.19 -4.49 117.00 103.22 2k73 n LEU 96 Ca 0.09 -0.45 -0.22 0.00 0.00 0.00 0.00 56.01 55.42 2k73 n LEU 96 Cb 0.21 -0.07 -0.06 0.00 0.00 0.00 0.00 43.42 43.49 2k73 n LEU 96 CO 0.27 0.26 -0.26 0.00 0.00 0.00 0.00 177.39 177.66 2k73 n TYR 97 N -0.70 -0.03 -2.01 1.96 9.36 0.89 -5.05 117.16 121.58 2k73 n TYR 97 Ca 0.09 -3.66 -0.43 0.00 3.32 0.00 0.00 57.90 57.22 2k73 n TYR 97 Cb 0.39 -0.38 -0.03 0.00 -0.63 0.00 0.00 39.34 38.69 2k73 n TYR 97 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2k73 s PRO 98 N -1.60 3.86 -0.37 2.98 0.04 0.34 -4.19 135.00 136.05 2k73 s PRO 98 Ca 0.37 1.89 0.05 0.00 0.04 0.00 0.00 61.00 63.35 2k73 s PRO 98 Cb 0.22 -4.06 0.31 0.00 0.04 0.00 0.00 34.50 31.01 2k73 s PRO 98 CO -0.10 -1.23 1.28 -1.13 0.04 0.00 0.00 177.00 175.86 2k73 n SER 99 N 8.35 -1.64 -3.98 6.66 3.41 -1.26 -5.12 113.62 120.04 2k73 n SER 99 Ca 0.19 -2.51 -0.30 0.00 -0.26 0.00 0.00 58.87 56.00 2k73 n SER 99 Cb 0.44 1.40 0.22 0.00 -0.26 0.00 0.00 64.21 66.02 2k73 n SER 99 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2k73 s PRO 100 N 0.13 -0.67 0.00 4.33 0.04 -1.26 -5.08 135.00 132.49 2k73 s PRO 100 Ca 0.20 -0.06 0.00 0.00 0.04 0.00 0.00 61.00 61.17 2k73 s PRO 100 Cb 0.28 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 33.16 2k73 s PRO 100 CO -0.13 -3.35 0.00 1.19 0.04 0.00 0.00 177.00 174.75 2k73 n PHE 101 N -4.50 0.00 0.00 0.56 3.72 -1.26 -5.01 117.46 110.97 2k73 n PHE 101 Ca 0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 2k73 n PHE 101 Cb 0.59 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.13 2k73 n PHE 101 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2k73 n ALA 102 N -3.00 -0.01 -2.75 4.37 0.00 -1.26 -4.78 120.51 113.07 2k73 n ALA 102 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 2k73 n ALA 102 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 2k73 n ALA 102 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2k73 n THR 103 N -0.62 1.11 -0.00 0.00 5.66 -1.26 -4.90 114.28 114.26 2k73 n THR 103 Ca 0.00 -2.93 0.23 0.00 -3.05 0.00 0.00 64.05 58.30 2k73 n THR 103 Cb 0.00 1.01 0.68 0.00 -1.55 0.00 0.00 70.33 70.47 2k73 n THR 103 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 2k73 h SER 104 N 2.75 0.00 -0.15 1.09 4.64 -1.98 -3.30 113.55 116.60 2k73 h SER 104 Ca -0.13 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.76 2k73 h SER 104 Cb 1.23 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 63.36 2k73 h SER 104 CO 0.31 0.00 1.34 -0.90 -0.87 0.00 0.00 176.83 176.72 2k73 n ASP 105 N -3.62 2.13 -3.71 4.97 5.75 -1.26 -4.73 116.55 116.08 2k73 n ASP 105 Ca 0.12 -2.61 -0.28 0.00 -0.01 0.00 0.00 54.79 52.01 2k73 n ASP 105 Cb 0.87 -1.26 -0.11 0.00 -1.03 0.00 0.00 41.12 39.59 2k73 n ASP 105 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2k73 n PHE 106 N 12.00 2.83 -1.24 2.11 7.35 -1.25 -5.09 117.46 134.17 2k73 n PHE 106 Ca 0.46 -4.16 0.00 0.00 -0.76 0.00 0.00 57.45 53.00 2k73 n PHE 106 Cb 0.44 -0.52 0.00 0.00 0.35 0.00 0.00 39.48 39.75 2k73 n PHE 106 CO 0.00 0.00 0.00 -1.33 -0.76 0.00 0.00 176.76 174.67 2k73 n MET 107 N 1.75 0.00 -3.42 -4.13 2.81 -1.26 -4.43 117.12 108.44 2k73 n MET 107 Ca 0.23 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.74 2k73 n MET 107 Cb 0.38 0.00 -0.09 0.00 -0.71 0.00 0.00 33.22 32.80 2k73 n MET 107 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2k73 s VAL 108 N 0.00 5.20 -0.46 2.03 -7.23 -1.26 -5.01 120.40 113.67 2k73 s VAL 108 Ca 0.00 0.55 -0.19 0.00 -1.81 0.00 0.00 61.98 60.52 2k73 s VAL 108 Cb 0.00 -3.68 0.03 0.00 0.56 0.00 0.00 36.38 33.29 2k73 s VAL 108 CO 0.00 0.20 0.59 -0.60 -0.31 0.00 0.00 175.10 174.98 2k73 s ARG 109 N 1.80 3.19 0.03 4.82 3.52 -1.26 -5.03 118.95 126.01 2k73 s ARG 109 Ca 0.15 -0.62 0.02 0.00 -0.13 0.00 0.00 55.73 55.15 2k73 s ARG 109 Cb -0.15 -4.00 -0.02 0.00 -1.56 0.00 0.00 34.95 29.22 2k73 s ARG 109 CO 0.09 -1.05 -0.07 -0.59 -0.81 0.00 0.00 175.30 172.88 2k73 s PHE 110 N 2.62 0.58 0.23 5.12 -0.12 -1.26 -5.14 117.98 120.02 2k73 s PHE 110 Ca 0.18 -0.39 -0.30 0.00 -0.05 0.00 0.00 56.93 56.37 2k73 s PHE 110 Cb -0.16 -0.35 -0.09 0.00 -0.63 0.00 0.00 43.02 41.78 2k73 s PHE 110 CO 0.16 -0.07 1.37 -1.25 -0.05 0.00 0.00 175.22 175.37 2k73 s PRO 111 N -1.19 4.33 0.00 1.99 0.04 -1.26 -4.86 135.00 134.05 2k73 s PRO 111 Ca -0.07 2.18 0.03 0.00 0.04 0.00 0.00 61.00 63.18 2k73 s PRO 111 Cb -0.08 -3.15 0.19 0.00 0.04 0.00 0.00 34.50 31.50 2k73 s PRO 111 CO 0.00 -0.32 0.59 0.39 0.04 0.00 0.00 177.00 177.70 2k73 n GLU 112 N 2.35 0.40 0.00 4.56 4.71 -1.26 -1.91 120.64 129.49 2k73 n GLU 112 Ca 0.06 0.00 0.14 0.00 -0.01 0.00 0.00 57.16 57.35 2k73 n GLU 112 Cb 0.41 -1.12 0.50 0.00 -1.01 0.00 0.00 31.44 30.22 2k73 n GLU 112 CO 0.00 0.00 0.00 1.87 0.09 0.00 0.00 177.13 179.09 2k73 n TRP 113 N -0.62 0.00 -3.74 -0.32 -0.00 -1.26 -4.44 117.44 107.06 2k73 n TRP 113 Ca 0.02 0.00 -0.28 0.00 -0.00 0.00 0.00 57.50 57.25 2k73 n TRP 113 Cb 0.01 -0.08 -0.11 0.00 -0.00 0.00 0.00 31.31 31.13 2k73 n TRP 113 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 2k73 s LEU 114 N -2.28 3.74 0.00 5.87 1.43 -0.81 -4.94 118.68 121.70 2k73 s LEU 114 Ca 0.31 -3.61 0.00 0.00 -1.03 0.00 0.00 54.13 49.81 2k73 s LEU 114 Cb 0.20 -1.26 0.00 0.00 0.03 0.00 0.00 46.19 45.17 2k73 s LEU 114 CO 0.43 -0.11 0.13 -2.65 0.23 0.00 0.00 176.35 174.38 2k73 n PRO 115 N 2.25 0.00 0.05 1.29 -0.02 -1.26 -2.37 135.00 134.94 2k73 n PRO 115 Ca 0.23 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.74 2k73 n PRO 115 Cb 0.39 -1.20 0.41 0.00 -0.02 0.00 0.00 33.50 33.08 2k73 n PRO 115 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2k73 h LEU 116 N 0.00 0.38 0.03 2.45 5.85 -1.94 1.09 115.31 123.17 2k73 h LEU 116 Ca 0.00 -0.03 -0.39 0.00 0.84 0.00 0.00 57.88 58.30 2k73 h LEU 116 Cb 0.00 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 2k73 h LEU 116 CO 0.00 0.36 -2.28 0.47 -0.34 0.00 0.00 178.44 176.65 2k73 n ASP 117 N -4.40 2.00 -0.10 1.25 9.92 -1.00 -3.35 116.55 120.87 2k73 n ASP 117 Ca 0.01 0.09 -0.11 0.00 -0.53 0.00 0.00 54.79 54.25 2k73 n ASP 117 Cb 0.14 -0.65 -0.04 0.00 -0.64 0.00 0.00 41.12 39.94 2k73 n ASP 117 CO 0.00 0.00 0.00 0.50 0.13 0.00 0.00 177.20 177.83 2k73 h LYS 118 N -0.29 0.52 0.00 -1.24 1.63 -1.70 0.51 116.57 115.99 2k73 h LYS 118 Ca -0.55 -0.17 0.00 0.00 -0.85 0.00 0.00 60.65 59.08 2k73 h LYS 118 Cb 1.82 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 33.40 2k73 h LYS 118 CO -0.13 0.67 0.00 1.87 -3.45 0.00 0.00 179.45 178.41 2k73 n TRP 119 N -4.57 0.54 -3.18 1.91 -0.00 0.37 -4.01 117.44 108.50 2k73 n TRP 119 Ca -0.03 0.18 -0.22 0.00 -0.00 0.00 0.00 57.50 57.43 2k73 n TRP 119 Cb 0.26 -0.80 -0.06 0.00 -0.00 0.00 0.00 31.31 30.71 2k73 n TRP 119 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 2k73 n VAL 120 N -1.96 -0.73 0.42 5.87 0.31 -0.84 -4.94 118.33 116.45 2k73 n VAL 120 Ca 0.04 -3.53 0.13 0.00 -0.01 0.00 0.00 64.34 60.98 2k73 n VAL 120 Cb 0.29 -1.45 0.37 0.00 -0.91 0.00 0.00 33.84 32.14 2k73 n VAL 120 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2k73 h PRO 121 N 4.41 0.00 0.04 5.55 0.13 -1.05 -3.32 132.00 137.75 2k73 h PRO 121 Ca 0.09 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.25 2k73 h PRO 121 Cb 0.91 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.00 2k73 h PRO 121 CO 0.41 0.00 -0.23 1.96 -0.23 0.00 0.00 178.00 179.91 2k73 h GLN 122 N 0.00 -0.37 -2.19 0.86 7.50 -1.92 -1.19 115.11 117.79 2k73 h GLN 122 Ca 0.00 0.03 -0.74 0.00 0.50 0.00 0.00 58.65 58.44 2k73 h GLN 122 Cb 0.75 0.08 -0.31 0.00 0.05 0.00 0.00 27.48 28.05 2k73 h GLN 122 CO 0.00 -0.25 0.54 0.28 -1.50 0.00 0.00 178.83 177.90 2k73 n VAL 123 N -5.36 4.86 0.00 -0.54 0.31 -1.25 -4.41 118.33 111.95 2k73 n VAL 123 Ca -0.05 -5.62 0.00 0.00 -0.01 0.00 0.00 64.34 58.66 2k73 n VAL 123 Cb 0.27 -1.46 0.00 0.00 -0.91 0.00 0.00 33.84 31.74 2k73 n VAL 123 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2k73 n PHE 124 N -0.19 -0.63 -1.91 3.52 3.72 -1.14 -5.06 117.46 115.78 2k73 n PHE 124 Ca 0.44 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.42 2k73 n PHE 124 Cb 0.31 0.13 -0.03 0.00 -0.94 0.00 0.00 39.48 38.95 2k73 n PHE 124 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2k73 s VAL 125 N -1.29 2.52 0.26 -4.37 1.01 -0.46 -4.82 120.40 113.25 2k73 s VAL 125 Ca 0.00 0.38 -0.01 0.00 0.00 0.00 0.00 61.98 62.35 2k73 s VAL 125 Cb 0.00 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 2k73 s VAL 125 CO 0.00 0.03 0.46 0.00 0.00 0.00 0.00 175.10 175.60 2k73 s ALA 126 N 1.06 3.76 -0.29 5.51 0.00 -1.26 -5.00 121.76 125.54 2k73 s ALA 126 Ca 0.70 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.89 2k73 s ALA 126 Cb -0.45 -2.07 0.20 0.00 0.00 0.00 0.00 23.12 20.80 2k73 s ALA 126 CO 0.32 0.26 0.62 -1.12 0.00 0.00 0.00 175.76 175.85 2k73 s SER 127 N -3.44 -1.56 0.00 0.00 0.01 -1.14 -4.95 113.70 102.62 2k73 s SER 127 Ca 0.40 0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.83 2k73 s SER 127 Cb -0.10 1.99 0.00 0.00 0.21 0.00 0.00 66.02 68.11 2k73 s SER 127 CO 0.31 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 174.29 2k73 n GLY 128 N 5.39 1.04 3.86 3.44 0.00 -1.19 -3.60 105.19 114.13 2k73 n GLY 128 Ca 0.05 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 43.76 2k73 n GLY 128 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k73 s ASP 129 N 0.00 6.69 -0.20 1.61 1.01 -1.26 -4.56 116.67 119.95 2k73 s ASP 129 Ca 0.00 1.09 -0.09 0.00 0.71 0.00 0.00 52.55 54.26 2k73 s ASP 129 Cb 0.00 -2.30 -0.05 0.00 1.01 0.00 0.00 42.92 41.59 2k73 s ASP 129 CO 0.00 -0.15 0.11 0.00 0.21 0.00 0.00 175.17 175.34 2k73 n ALA 131 N 3.66 0.00 -1.77 0.00 0.00 -1.26 -5.07 120.51 116.07 2k73 n ALA 131 Ca -0.16 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.91 2k73 n ALA 131 Cb 0.52 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.96 2k73 n ALA 131 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2k73 s GLU 132 N -0.97 3.75 -0.17 0.00 4.04 -1.26 -5.01 118.70 119.07 2k73 s GLU 132 Ca 0.00 1.75 -0.09 0.00 0.04 0.00 0.00 54.97 56.67 2k73 s GLU 132 Cb 0.00 -2.38 -0.05 0.00 0.02 0.00 0.00 34.13 31.72 2k73 s GLU 132 CO 0.00 -0.56 0.12 1.03 -1.84 0.00 0.00 175.26 174.02 2k73 s ARG 133 N -2.74 3.94 0.00 -4.83 3.00 -1.26 -4.94 118.95 112.13 2k73 s ARG 133 Ca 0.64 -0.21 0.00 0.00 0.00 0.00 0.00 55.73 56.16 2k73 s ARG 133 Cb -0.28 -3.32 0.00 0.00 0.00 0.00 0.00 34.95 31.35 2k73 s ARG 133 CO 0.34 0.43 0.04 1.04 0.00 0.00 0.00 175.30 177.15 2k73 n GLN 134 N 3.09 2.72 -3.65 3.54 6.02 -1.26 -5.07 117.38 122.77 2k73 n GLN 134 Ca -0.17 -0.04 -0.01 0.00 -0.01 0.00 0.00 57.00 56.76 2k73 n GLN 134 Cb 0.53 -0.33 -0.06 0.00 1.02 0.00 0.00 30.24 31.39 2k73 n GLN 134 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2k73 s TRP 135 N -0.40 -0.31 0.08 1.08 -0.11 -1.26 -5.14 118.94 112.88 2k73 s TRP 135 Ca 0.00 0.64 0.00 0.00 1.22 0.00 0.00 56.10 57.96 2k73 s TRP 135 Cb 0.00 0.25 -0.04 0.00 -1.50 0.00 0.00 33.47 32.18 2k73 s TRP 135 CO 0.00 -0.15 -0.04 0.16 -4.62 0.00 0.00 176.95 172.30 2k73 s ASP 136 N 0.94 0.81 -0.04 5.86 -4.77 -1.26 -3.46 116.67 114.75 2k73 s ASP 136 Ca -0.05 -1.02 0.06 0.00 -3.30 0.00 0.00 52.55 48.24 2k73 s ASP 136 Cb -0.03 0.15 -0.02 0.00 -1.09 0.00 0.00 42.92 41.93 2k73 s ASP 136 CO -0.12 -0.54 -0.22 0.12 0.70 0.00 0.00 175.17 175.11 2k73 s PHE 137 N -3.78 2.48 -0.76 2.11 2.19 0.18 -4.60 117.98 115.81 2k73 s PHE 137 Ca 0.10 -0.39 0.00 0.00 0.33 0.00 0.00 56.93 56.97 2k73 s PHE 137 Cb 0.07 -1.57 0.00 0.00 -1.31 0.00 0.00 43.02 40.21 2k73 s PHE 137 CO -0.07 0.01 0.00 1.28 1.83 0.00 0.00 175.22 178.27 2k73 n LEU 138 N 2.50 -0.38 0.00 6.12 4.77 -1.26 0.14 117.00 128.89 2k73 n LEU 138 Ca -0.17 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2k73 n LEU 138 Cb 0.52 -1.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.01 2k73 n LEU 138 CO 0.24 -0.52 0.00 0.61 -1.33 0.00 0.00 177.39 176.40 2k73 n GLY 139 N 0.01 0.74 3.21 -0.72 0.00 -1.26 -5.08 105.19 102.10 2k73 n GLY 139 Ca -0.07 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.16 2k73 n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k73 s LEU 140 N 0.00 2.03 0.45 0.99 1.02 0.37 -5.07 118.68 118.48 2k73 s LEU 140 Ca 0.00 -0.38 -0.23 0.00 0.02 0.00 0.00 54.13 53.54 2k73 s LEU 140 Cb 0.00 -1.08 -0.08 0.00 0.02 0.00 0.00 46.19 45.06 2k73 s LEU 140 CO 0.00 0.24 1.15 -1.61 0.02 0.00 0.00 176.35 176.16 2k73 s GLU 141 N -0.41 3.79 0.14 1.70 0.41 -1.26 0.48 118.70 123.55 2k73 s GLU 141 Ca 0.06 1.75 -0.31 0.00 -0.41 0.00 0.00 54.97 56.06 2k73 s GLU 141 Cb -0.09 -2.41 -0.07 0.00 -1.78 0.00 0.00 34.13 29.78 2k73 s GLU 141 CO -0.00 -0.52 1.56 0.52 -0.49 0.00 0.00 175.26 176.33 2k73 h MET 142 N 2.08 -0.37 -1.05 1.61 2.86 -1.94 0.61 114.93 118.73 2k73 h MET 142 Ca -0.49 0.03 0.39 0.00 -2.06 0.00 0.00 59.70 57.56 2k73 h MET 142 Cb 1.24 0.08 -0.14 0.00 0.06 0.00 0.00 31.60 32.85 2k73 h MET 142 CO 0.60 -0.25 0.63 -2.30 1.06 0.00 0.00 176.91 176.66 2k73 n PRO 143 N -5.39 -0.04 -0.06 -0.22 -0.02 -1.26 0.15 135.00 128.15 2k73 n PRO 143 Ca -0.03 1.13 -0.14 0.00 -2.02 0.00 0.00 63.50 62.45 2k73 n PRO 143 Cb 0.35 -2.14 -0.07 0.00 -0.02 0.00 0.00 33.50 31.62 2k73 n PRO 143 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2k73 h GLN 144 N 0.00 0.44 0.49 -0.52 4.20 -1.24 -2.64 115.11 115.84 2k73 h GLN 144 Ca 0.75 -0.26 -0.02 0.00 0.06 0.00 0.00 58.65 59.18 2k73 h GLN 144 Cb 2.23 0.02 0.00 0.00 0.30 0.00 0.00 27.48 30.03 2k73 h GLN 144 CO -0.52 0.84 -0.24 -1.49 -0.67 0.00 0.00 178.83 176.75 2k73 h TRP 145 N 0.08 -0.61 -1.19 2.96 4.06 0.16 -2.74 115.95 118.65 2k73 h TRP 145 Ca 0.02 -0.01 0.39 0.00 2.06 0.00 0.00 58.89 61.34 2k73 h TRP 145 Cb 0.79 0.20 -0.13 0.00 -1.00 0.00 0.00 29.16 29.02 2k73 h TRP 145 CO 0.09 -0.29 0.75 -0.07 -3.56 0.00 0.00 178.44 175.36 2k73 h LEU 146 N -1.01 0.33 -1.10 -4.49 3.38 -0.85 3.15 115.31 114.73 2k73 h LEU 146 Ca -0.07 0.15 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2k73 h LEU 146 Cb 0.60 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 2k73 h LEU 146 CO 0.11 -0.15 0.11 0.25 0.09 0.00 0.00 178.44 178.85 2k73 h LEU 147 N 0.17 0.70 -1.04 1.67 5.85 -1.27 -1.71 115.31 119.69 2k73 h LEU 147 Ca 0.77 -0.12 0.10 0.00 0.84 0.00 0.00 57.88 59.47 2k73 h LEU 147 Cb 2.22 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 42.99 2k73 h LEU 147 CO -0.46 0.70 0.63 1.23 -0.34 0.00 0.00 178.44 180.20 2k73 h GLY 148 N 0.93 1.56 0.85 3.75 0.00 0.61 -1.61 103.07 109.15 2k73 h GLY 148 Ca 0.16 -0.43 -0.10 0.00 0.00 0.00 0.00 47.33 46.96 2k73 h GLY 148 CO -0.00 0.22 -0.30 -2.22 0.00 0.00 0.00 176.54 174.24 2k73 h ILE 149 N 1.03 1.34 -0.90 2.60 2.04 -0.99 -2.95 117.51 119.68 2k73 h ILE 149 Ca 0.47 -1.53 0.23 0.00 1.00 0.00 0.00 64.86 65.03 2k73 h ILE 149 Cb 0.39 1.90 -0.13 0.00 -0.74 0.00 0.00 36.82 38.24 2k73 h ILE 149 CO -0.22 0.46 0.40 -0.26 0.00 0.00 0.00 178.15 178.53 2k73 h PHE 150 N 0.16 0.66 -0.30 1.37 -1.00 -0.54 0.38 116.94 117.68 2k73 h PHE 150 Ca 0.01 0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.82 2k73 h PHE 150 Cb 0.88 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 40.28 2k73 h PHE 150 CO 0.09 -0.06 0.12 0.82 -1.61 0.00 0.00 178.31 177.67 2k73 h ILE 151 N 0.39 1.18 0.19 -0.55 2.04 -1.34 -0.20 117.51 119.22 2k73 h ILE 151 Ca 0.57 -0.55 0.01 0.00 1.00 0.00 0.00 64.86 65.89 2k73 h ILE 151 Cb 1.10 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 2k73 h ILE 151 CO -0.54 0.19 -0.24 0.00 0.00 0.00 0.00 178.15 177.56 2k73 h ALA 152 N 0.96 -0.46 -0.78 1.87 0.00 -0.22 -1.65 119.26 118.98 2k73 h ALA 152 Ca 0.10 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.02 2k73 h ALA 152 Cb 0.18 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 2k73 h ALA 152 CO -0.01 -0.79 0.51 1.88 0.00 0.00 0.00 179.25 180.84 2k73 h TYR 153 N -0.48 0.83 0.00 0.00 -1.99 -0.63 -0.01 116.97 114.69 2k73 h TYR 153 Ca 0.01 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.72 2k73 h TYR 153 Cb 0.47 -0.27 -0.01 0.00 2.00 0.00 0.00 36.73 38.92 2k73 h TYR 153 CO -0.19 0.43 -0.17 1.25 -0.00 0.00 0.00 178.16 179.48 2k73 h LEU 154 N 0.81 0.00 0.23 3.88 6.46 -0.30 -2.94 115.31 123.45 2k73 h LEU 154 Ca 0.34 0.00 -0.33 0.00 -0.12 0.00 0.00 57.88 57.77 2k73 h LEU 154 Cb 0.29 0.00 0.03 0.00 -0.73 0.00 0.00 40.66 40.25 2k73 h LEU 154 CO -0.12 0.17 -1.49 0.40 -0.62 0.00 0.00 178.44 176.78 2k73 h ILE 155 N 0.00 1.26 -0.78 4.05 2.04 -0.12 -2.91 117.51 121.06 2k73 h ILE 155 Ca -0.00 -2.73 -0.02 0.00 1.00 0.00 0.00 64.86 63.10 2k73 h ILE 155 Cb 0.31 2.99 -0.04 0.00 -0.74 0.00 0.00 36.82 39.34 2k73 h ILE 155 CO 0.02 0.83 0.39 -0.37 0.00 0.00 0.00 178.15 179.02 2k73 h VAL 156 N 0.13 1.24 -0.04 1.67 -1.51 -1.22 0.12 116.25 116.64 2k73 h VAL 156 Ca -0.25 -0.65 -0.03 0.00 -1.23 0.00 0.00 66.70 64.53 2k73 h VAL 156 Cb 2.13 0.23 0.00 0.00 -2.13 0.00 0.00 31.29 31.52 2k73 h VAL 156 CO 0.25 0.28 -0.10 0.00 -1.23 0.00 0.00 177.57 176.77 2k73 h ALA 157 N 1.32 0.06 -0.68 5.19 0.00 -1.64 0.21 119.26 123.73 2k73 h ALA 157 Ca 0.27 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2k73 h ALA 157 Cb 0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2k73 h ALA 157 CO -0.04 -0.05 0.41 0.28 0.00 0.00 0.00 179.25 179.85 2k73 h VAL 158 N -0.42 1.19 0.20 0.00 2.07 -1.36 0.38 116.25 118.31 2k73 h VAL 158 Ca -0.00 -0.42 -0.27 0.00 0.82 0.00 0.00 66.70 66.82 2k73 h VAL 158 Cb 0.72 0.23 0.03 0.00 -1.52 0.00 0.00 31.29 30.75 2k73 h VAL 158 CO 0.02 0.20 -1.18 0.25 0.02 0.00 0.00 177.57 176.89 2k73 h LEU 159 N 0.94 0.70 -1.07 2.57 5.85 -0.77 -2.91 115.31 120.62 2k73 h LEU 159 Ca 0.25 -0.92 -0.04 0.00 0.84 0.00 0.00 57.88 58.00 2k73 h LEU 159 Cb -0.04 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 2k73 h LEU 159 CO -0.05 1.57 -0.20 0.58 -0.34 0.00 0.00 178.44 180.00 2k73 h VAL 160 N -0.06 0.48 0.00 1.05 2.07 -0.37 -1.51 116.25 117.92 2k73 h VAL 160 Ca -0.20 -1.09 -0.12 0.00 0.82 0.00 0.00 66.70 66.12 2k73 h VAL 160 Cb 1.92 1.77 0.01 0.00 -1.52 0.00 0.00 31.29 33.47 2k73 h VAL 160 CO 0.22 0.20 -0.45 0.58 0.02 0.00 0.00 177.57 178.14 2k73 h VAL 161 N 0.00 1.49 0.00 2.57 2.07 -0.31 -3.21 116.25 118.86 2k73 h VAL 161 Ca -0.00 -2.04 -0.02 0.00 0.82 0.00 0.00 66.70 65.46 2k73 h VAL 161 Cb 0.75 2.70 -0.00 0.00 -1.52 0.00 0.00 31.29 33.22 2k73 h VAL 161 CO 0.03 0.58 -0.09 0.40 0.02 0.00 0.00 177.57 178.51 2k73 h ILE 162 N -0.29 0.21 0.00 4.57 2.04 -1.45 -2.70 117.51 119.90 2k73 h ILE 162 Ca -0.06 -0.78 0.00 0.00 1.00 0.00 0.00 64.86 65.02 2k73 h ILE 162 Cb 1.19 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 2k73 h ILE 162 CO 0.09 0.08 0.00 -1.20 0.00 0.00 0.00 178.15 177.12 2k73 n SER 163 N -3.21 0.41 -4.56 1.72 7.64 -0.57 -4.74 113.62 110.31 2k73 n SER 163 Ca 0.01 0.67 -0.39 0.00 1.01 0.00 0.00 58.87 60.17 2k73 n SER 163 Cb 0.37 -0.73 0.04 0.00 -1.01 0.00 0.00 64.21 62.88 2k73 n SER 163 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k73 n GLN 164 N -2.03 0.85 -0.65 1.43 10.64 -1.02 -4.74 117.38 121.85 2k73 n GLN 164 Ca -0.00 0.32 0.49 0.00 -1.83 0.00 0.00 57.00 55.98 2k73 n GLN 164 Cb 0.06 -1.97 0.75 0.00 -0.86 0.00 0.00 30.24 28.23 2k73 n GLN 164 CO 0.00 0.00 0.00 -2.30 -1.83 0.00 0.00 177.06 172.93 2k73 n PRO 165 N -0.42 -0.00 0.00 2.61 -0.02 -1.26 -4.74 135.00 131.17 2k73 n PRO 165 Ca 0.12 1.00 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 2k73 n PRO 165 Cb 0.45 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 2k73 n PRO 165 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2k73 n PHE 166 N -3.77 0.00 -0.88 6.00 7.35 -1.26 -4.80 117.46 120.09 2k73 n PHE 166 Ca 0.41 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.10 2k73 n PHE 166 Cb 1.85 0.00 0.00 0.00 0.35 0.00 0.00 39.48 41.68 2k73 n PHE 166 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 2k73 n LYS 167 N 14.00 0.00 -1.57 -4.13 4.81 -1.26 -4.99 118.16 125.02 2k73 n LYS 167 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2k73 n LYS 167 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2k73 n LYS 167 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k73 n ALA 168 N 11.45 -2.27 -0.03 3.14 0.00 -1.26 -4.94 120.51 126.59 2k73 n ALA 168 Ca 0.00 0.36 -0.00 0.00 0.00 0.00 0.00 53.44 53.80 2k73 n ALA 168 Cb 0.00 -1.23 -0.14 0.00 0.00 0.00 0.00 19.45 18.08 2k73 n ALA 168 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2k73 n LYS 169 N 0.93 0.66 0.00 0.00 5.02 -1.26 -4.77 118.16 118.74 2k73 n LYS 169 Ca 0.00 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 2k73 n LYS 169 Cb 0.00 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 2k73 n LYS 169 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2k73 n LYS 170 N -2.61 0.00 -3.41 1.97 5.02 -1.26 -4.87 118.16 113.00 2k73 n LYS 170 Ca -0.17 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 55.95 2k73 n LYS 170 Cb 0.87 -0.03 0.01 0.00 -0.02 0.00 0.00 35.03 35.86 2k73 n LYS 170 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2k73 n ARG 171 N 0.00 -1.64 -2.41 1.97 1.74 -1.26 -4.86 116.66 110.20 2k73 n ARG 171 Ca 0.00 1.26 -0.43 0.00 -0.77 0.00 0.00 57.85 57.91 2k73 n ARG 171 Cb 0.00 -3.73 -0.02 0.00 -1.02 0.00 0.00 32.46 27.68 2k73 n ARG 171 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2k73 s ASP 172 N -2.71 6.98 0.51 0.55 1.47 -1.26 -4.73 116.67 117.49 2k73 s ASP 172 Ca 0.09 1.80 0.00 0.00 1.18 0.00 0.00 52.55 55.62 2k73 s ASP 172 Cb -0.01 -2.55 0.00 0.00 -0.34 0.00 0.00 42.92 40.02 2k73 s ASP 172 CO 0.83 -0.68 0.00 0.18 0.68 0.00 0.00 175.17 176.18 2k73 n LEU 173 N 5.89 -1.97 -3.15 2.11 4.77 -1.26 -5.05 117.00 118.34 2k73 n LEU 173 Ca 0.13 2.88 0.05 0.00 -0.03 0.00 0.00 56.01 59.04 2k73 n LEU 173 Cb 0.45 -3.14 -0.01 0.00 -2.33 0.00 0.00 43.42 38.40 2k73 n LEU 173 CO 0.56 0.19 0.49 0.12 -1.33 0.00 0.00 177.39 177.42 2k73 s PHE 174 N -3.86 -0.66 0.00 -1.77 5.36 -1.26 -5.14 117.98 110.64 2k73 s PHE 174 Ca 0.00 0.48 0.00 0.00 -0.96 0.00 0.00 56.93 56.45 2k73 s PHE 174 Cb 0.00 0.15 0.00 0.00 -0.34 0.00 0.00 43.02 42.83 2k73 s PHE 174 CO 0.00 -0.38 0.00 0.41 -1.46 0.00 0.00 175.22 173.79 2k73 n GLY 175 N 5.26 0.68 3.88 13.12 0.00 -1.26 -5.05 105.19 121.82 2k73 n GLY 175 Ca 0.04 -1.40 -0.30 0.00 0.00 0.00 0.00 46.02 44.36 2k73 n GLY 175 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k73 s ARG 176 N -5.06 3.52 0.00 1.61 0.52 -1.26 -5.07 118.95 113.22 2k73 s ARG 176 Ca 0.00 0.66 0.00 0.00 -0.52 0.00 0.00 55.73 55.87 2k73 s ARG 176 Cb 0.00 -2.11 0.00 0.00 0.52 0.00 0.00 34.95 33.36 2k73 s ARG 176 CO 0.00 -0.57 0.00 0.41 0.02 0.00 0.00 175.30 175.16 2k73 n GLY 177 N -2.72 -0.07 2.99 -3.53 0.00 -1.26 -5.05 105.19 95.55 2k73 n GLY 177 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 2k73 n GLY 177 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2k73 n HIS 178 N 0.00 -3.24 -1.98 1.61 -0.00 -1.26 -4.96 115.22 105.38 2k73 n HIS 178 Ca 0.00 1.34 0.00 0.00 -0.00 0.00 0.00 57.72 59.06 2k73 n HIS 178 Cb 0.00 -3.45 0.00 0.00 -0.00 0.00 0.00 29.99 26.54 2k73 n HIS 178 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2k73 n HIS 179 N -0.08 0.00 0.54 1.57 1.44 -1.26 -4.91 115.22 112.53 2k73 n HIS 179 Ca 0.05 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.89 2k73 n HIS 179 Cb 0.45 0.20 0.39 0.00 0.12 0.00 0.00 29.99 31.16 2k73 n HIS 179 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2k73 h HIS 180 N 0.00 0.00 -0.63 -1.40 6.17 -2.06 -3.49 115.15 113.75 2k73 h HIS 180 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 2k73 h HIS 180 Cb 0.99 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.92 2k73 h HIS 180 CO -0.16 0.00 0.00 1.58 0.71 0.00 0.00 177.93 180.06 2k73 n HIS 181 N -2.39 -0.63 -3.69 5.26 -0.00 -1.26 -4.93 115.22 107.59 2k73 n HIS 181 Ca 0.05 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.09 2k73 n HIS 181 Cb 0.42 0.13 -0.07 0.00 -0.12 0.00 0.00 29.99 30.35 2k73 n HIS 181 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2k73 s HIS 182 N 0.00 -0.27 -1.59 1.57 2.46 -1.26 -5.21 115.29 110.99 2k73 s HIS 182 Ca 0.00 0.32 0.00 0.00 0.47 0.00 0.00 55.06 55.85 2k73 s HIS 182 Cb 0.00 0.19 0.00 0.00 -0.13 0.00 0.00 32.58 32.64 2k73 s HIS 182 CO 0.00 -0.51 0.40 1.58 -2.47 0.00 0.00 174.74 173.73