#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k83 n GLU 4 N 0.00 0.00 0.00 2.61 -0.58 -1.26 -2.77 120.64 118.64 1k83 n GLU 4 Ca 0.00 0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 1k83 n GLU 4 Cb 0.00 -0.69 0.00 0.00 -0.57 0.00 0.00 31.44 30.18 1k83 n GLU 4 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1k83 n ASN 5 N -0.36 0.00 -0.10 1.62 2.85 -1.26 0.11 115.26 118.12 1k83 n ASN 5 Ca 0.00 0.00 -0.13 0.00 -0.11 0.00 0.00 54.58 54.34 1k83 n ASN 5 Cb 0.00 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 40.93 1k83 n ASN 5 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 1k83 h GLU 6 N 0.00 -0.40 0.00 1.20 4.57 -1.87 1.16 114.58 119.24 1k83 h GLU 6 Ca 0.00 0.03 -0.13 0.00 -1.18 0.00 0.00 59.36 58.07 1k83 h GLU 6 Cb 0.00 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 1k83 h GLU 6 CO 0.00 -0.26 -0.64 0.07 -1.18 0.00 0.00 179.01 177.00 1k83 h ARG 7 N -0.41 0.00 0.00 1.92 0.11 0.69 -2.79 114.38 113.90 1k83 h ARG 7 Ca 0.06 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.12 1k83 h ARG 7 Cb 0.58 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.65 1k83 h ARG 7 CO -0.53 0.64 -0.11 -0.97 0.10 0.00 0.00 179.97 179.10 1k83 h ASN 8 N 0.00 0.00 -0.08 0.08 -0.73 -0.60 -2.16 115.58 112.09 1k83 h ASN 8 Ca -0.01 0.00 -0.10 0.00 1.87 0.00 0.00 56.30 58.06 1k83 h ASN 8 Cb 1.27 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.87 1k83 h ASN 8 CO 0.08 0.11 -0.34 0.40 -0.37 0.00 0.00 177.43 177.31 1k83 h ILE 9 N 0.00 1.41 -0.67 2.57 2.04 0.16 -3.25 117.51 119.77 1k83 h ILE 9 Ca -0.00 -1.71 0.12 0.00 1.00 0.00 0.00 64.86 64.27 1k83 h ILE 9 Cb 0.33 2.26 -0.09 0.00 -0.74 0.00 0.00 36.82 38.58 1k83 h ILE 9 CO 0.01 0.50 0.23 -1.28 0.00 0.00 0.00 178.15 177.61 1k83 h SER 10 N -0.08 0.19 -0.15 1.72 0.87 -1.39 -0.02 113.55 114.69 1k83 h SER 10 Ca -0.02 0.10 0.03 0.00 -1.23 0.00 0.00 61.79 60.67 1k83 h SER 10 Cb 0.98 0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 63.01 1k83 h SER 10 CO 0.07 0.09 -0.03 0.03 -0.53 0.00 0.00 176.83 176.46 1k83 h ARG 11 N 0.38 0.01 -0.33 2.24 3.08 -1.57 0.80 114.38 118.99 1k83 h ARG 11 Ca 0.35 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.39 1k83 h ARG 11 Cb 0.50 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 1k83 h ARG 11 CO -0.37 0.00 0.17 1.25 -1.07 0.00 0.00 179.97 179.95 1k83 h LEU 12 N 0.01 0.40 -0.09 3.04 5.85 -1.40 0.30 115.31 123.42 1k83 h LEU 12 Ca 0.07 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1k83 h LEU 12 Cb 0.11 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1k83 h LEU 12 CO -0.15 0.34 -0.13 -0.25 -0.34 0.00 0.00 178.44 177.91 1k83 h TRP 13 N 0.46 0.30 -0.32 1.25 7.01 0.56 -0.06 115.95 125.15 1k83 h TRP 13 Ca 0.12 -0.10 0.03 0.00 2.11 0.00 0.00 58.89 61.04 1k83 h TRP 13 Cb 0.04 -0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 27.01 1k83 h TRP 13 CO 0.00 0.72 0.15 0.00 -2.79 0.00 0.00 178.44 176.52 1k83 h ARG 14 N -0.20 0.30 -0.68 2.65 3.08 0.97 -0.52 114.38 119.98 1k83 h ARG 14 Ca 0.01 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.08 1k83 h ARG 14 Cb 0.68 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.62 1k83 h ARG 14 CO 0.03 0.20 0.41 0.00 -1.07 0.00 0.00 179.97 179.54 1k83 h ALA 15 N 1.17 0.89 -0.68 0.04 0.00 -0.95 -0.72 119.26 119.01 1k83 h ALA 15 Ca 0.14 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1k83 h ALA 15 Cb 0.06 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 1k83 h ALA 15 CO -0.11 0.16 0.37 0.35 0.00 0.00 0.00 179.25 180.03 1k83 h PHE 16 N 0.80 0.68 0.10 0.00 3.57 -0.02 -1.98 116.94 120.09 1k83 h PHE 16 Ca 0.28 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.82 1k83 h PHE 16 Cb 0.06 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.57 1k83 h PHE 16 CO -0.05 0.31 -0.18 -0.09 -2.23 0.00 0.00 178.31 176.07 1k83 h ARG 17 N 0.68 -0.34 -0.87 1.11 2.43 0.26 -2.30 114.38 115.35 1k83 h ARG 17 Ca 0.31 0.02 0.18 0.00 -0.81 0.00 0.00 59.98 59.69 1k83 h ARG 17 Cb 0.22 0.08 -0.11 0.00 -0.42 0.00 0.00 29.97 29.74 1k83 h ARG 17 CO -0.20 -0.23 0.42 1.15 -1.51 0.00 0.00 179.97 179.60 1k83 h THR 18 N -0.35 0.61 -0.73 0.20 2.02 -0.56 0.15 112.91 114.24 1k83 h THR 18 Ca 0.03 -0.18 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 1k83 h THR 18 Cb 0.37 0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 66.80 1k83 h THR 18 CO -0.10 0.09 0.22 0.58 0.37 0.00 0.00 175.52 176.68 1k83 h VAL 19 N 0.52 1.26 -0.25 3.16 2.07 -0.96 1.46 116.25 123.50 1k83 h VAL 19 Ca 0.51 -0.90 -0.03 0.00 0.82 0.00 0.00 66.70 67.10 1k83 h VAL 19 Cb 0.85 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1k83 h VAL 19 CO -0.44 0.35 0.05 0.11 0.02 0.00 0.00 177.57 177.66 1k83 h LYS 20 N 1.08 0.41 -0.65 1.57 1.79 -0.38 0.52 116.57 120.90 1k83 h LYS 20 Ca 0.23 -0.10 -0.02 0.00 -2.18 0.00 0.00 60.65 58.58 1k83 h LYS 20 Cb 0.30 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.88 1k83 h LYS 20 CO -0.01 0.52 0.31 0.93 -1.08 0.00 0.00 179.45 180.13 1k83 h GLU 21 N 0.22 0.93 0.32 3.15 5.08 -0.30 0.18 114.58 124.16 1k83 h GLU 21 Ca 0.08 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1k83 h GLU 21 Cb 0.31 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1k83 h GLU 21 CO 0.00 0.74 -0.15 1.98 -1.00 0.00 0.00 179.01 180.58 1k83 h MET 22 N 0.89 -0.41 -0.90 2.33 4.05 0.23 -0.05 114.93 121.07 1k83 h MET 22 Ca 0.22 0.03 0.07 0.00 -0.28 0.00 0.00 59.70 59.74 1k83 h MET 22 Cb 0.11 0.09 -0.06 0.00 -0.80 0.00 0.00 31.60 30.94 1k83 h MET 22 CO -0.03 -0.15 0.56 0.28 0.23 0.00 0.00 176.91 177.80 1k83 h VAL 23 N -0.63 1.04 -0.47 -5.77 2.07 0.20 -1.66 116.25 111.04 1k83 h VAL 23 Ca -0.04 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 1k83 h VAL 23 Cb 0.45 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 1k83 h VAL 23 CO 0.07 0.19 0.21 0.50 0.02 0.00 0.00 177.57 178.55 1k83 h LYS 24 N 1.02 0.69 0.00 1.57 3.64 -0.50 -1.94 116.57 121.05 1k83 h LYS 24 Ca 0.39 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1k83 h LYS 24 Cb 0.19 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1k83 h LYS 24 CO -0.18 0.60 0.00 -0.44 -2.27 0.00 0.00 179.45 177.16 1k83 h ASP 25 N 0.61 0.00 1.67 4.20 3.32 -0.12 -0.95 116.42 125.14 1k83 h ASP 25 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1k83 h ASP 25 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1k83 h ASP 25 CO -0.02 0.00 -0.06 0.03 -1.72 0.00 0.00 179.24 177.47 1k83 h ARG 26 N 0.00 0.00 0.00 3.56 3.08 -0.54 -3.47 114.38 117.01 1k83 h ARG 26 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1k83 h ARG 26 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1k83 h ARG 26 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1k83 n GLY 27 N 1.21 1.89 3.54 0.04 0.00 -0.36 -5.09 105.19 106.42 1k83 n GLY 27 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1k83 n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k83 s TYR 28 N -2.00 2.85 0.06 1.61 1.51 -1.19 -2.52 117.35 117.67 1k83 s TYR 28 Ca 0.00 -0.05 -0.30 0.00 -1.01 0.00 0.00 57.07 55.71 1k83 s TYR 28 Cb 0.00 -1.68 -0.09 0.00 -0.11 0.00 0.00 41.96 40.09 1k83 s TYR 28 CO 0.00 0.28 1.85 0.12 -1.11 0.00 0.00 175.55 176.69 1k83 s PHE 29 N -0.79 1.80 -0.20 2.71 5.36 0.66 -4.39 117.98 123.12 1k83 s PHE 29 Ca 0.12 -0.14 -0.10 0.00 -0.96 0.00 0.00 56.93 55.85 1k83 s PHE 29 Cb -0.11 -4.15 0.07 0.00 -0.34 0.00 0.00 43.02 38.49 1k83 s PHE 29 CO 0.01 -4.94 0.48 0.42 -1.46 0.00 0.00 175.22 169.73 1k83 s ILE 30 N 3.59 -0.21 -0.07 3.12 1.01 -1.26 -4.63 121.20 122.75 1k83 s ILE 30 Ca 0.82 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 61.27 1k83 s ILE 30 Cb -0.42 -0.71 -0.05 0.00 0.01 0.00 0.00 42.46 41.28 1k83 s ILE 30 CO 0.37 0.04 1.62 0.42 0.00 0.00 0.00 174.94 177.39 1k83 s THR 31 N 1.79 3.64 0.54 2.92 -4.23 -1.26 -4.82 115.64 114.22 1k83 s THR 31 Ca -0.08 0.77 0.19 0.00 -1.18 0.00 0.00 61.69 61.39 1k83 s THR 31 Cb -0.09 -3.50 0.19 0.00 1.34 0.00 0.00 72.50 70.44 1k83 s THR 31 CO -0.14 -0.07 1.55 -0.61 -0.54 0.00 0.00 174.62 174.80 1k83 h GLN 32 N 9.47 0.00 0.06 3.99 5.75 -2.00 0.52 115.11 132.91 1k83 h GLN 32 Ca -0.38 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.12 1k83 h GLN 32 Cb 1.17 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.72 1k83 h GLN 32 CO 0.96 0.00 -0.03 0.93 -2.65 0.00 0.00 178.83 178.04 1k83 h GLU 33 N 0.00 -0.08 -0.66 1.69 5.08 -1.95 -2.76 114.58 115.90 1k83 h GLU 33 Ca 0.00 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 1k83 h GLU 33 Cb 0.99 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.24 1k83 h GLU 33 CO 0.00 0.28 0.11 1.49 -1.00 0.00 0.00 179.01 179.89 1k83 h GLU 34 N -0.45 1.07 -0.62 2.33 4.81 -0.34 -2.59 114.58 118.80 1k83 h GLU 34 Ca -0.01 -0.28 0.12 0.00 -0.13 0.00 0.00 59.36 59.07 1k83 h GLU 34 Cb 0.40 -0.13 -0.12 0.00 0.63 0.00 0.00 28.75 29.53 1k83 h GLU 34 CO 0.01 0.98 -0.19 0.28 -0.73 0.00 0.00 179.01 179.36 1k83 h VAL 35 N 1.01 0.33 -0.19 0.32 2.07 -1.42 0.87 116.25 119.23 1k83 h VAL 35 Ca 0.20 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.59 1k83 h VAL 35 Cb 0.42 0.33 -0.06 0.00 -1.52 0.00 0.00 31.29 30.46 1k83 h VAL 35 CO 0.01 0.00 0.17 -0.62 0.02 0.00 0.00 177.57 177.15 1k83 n GLU 36 N -5.44 1.32 -2.06 1.57 1.02 -0.98 -4.79 120.64 111.28 1k83 n GLU 36 Ca 0.07 -0.63 -0.41 0.00 -0.02 0.00 0.00 57.16 56.17 1k83 n GLU 36 Cb 0.34 -1.25 -0.03 0.00 -0.02 0.00 0.00 31.44 30.48 1k83 n GLU 36 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1k83 s LEU 37 N -0.73 3.41 0.66 -4.62 2.96 0.30 -4.95 118.68 115.71 1k83 s LEU 37 Ca 0.12 0.77 -0.17 0.00 -0.22 0.00 0.00 54.13 54.63 1k83 s LEU 37 Cb 0.10 -3.03 -0.04 0.00 0.50 0.00 0.00 46.19 43.71 1k83 s LEU 37 CO -0.00 -2.01 0.68 -0.81 -1.32 0.00 0.00 176.35 172.89 1k83 n PRO 38 N 8.76 0.49 0.00 0.98 -0.04 -1.26 -4.71 135.00 139.22 1k83 n PRO 38 Ca 0.21 0.21 -0.04 0.00 -0.04 0.00 0.00 63.50 63.83 1k83 n PRO 38 Cb 0.50 -1.92 -0.03 0.00 -0.04 0.00 0.00 33.50 32.00 1k83 n PRO 38 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1k83 h LEU 39 N -0.05 -0.50 -1.65 1.53 5.85 -1.99 -1.91 115.31 116.59 1k83 h LEU 39 Ca -0.46 0.06 0.37 0.00 0.84 0.00 0.00 57.88 58.68 1k83 h LEU 39 Cb 1.36 0.19 -0.09 0.00 0.37 0.00 0.00 40.66 42.50 1k83 h LEU 39 CO 0.46 -0.14 0.86 -0.08 -0.34 0.00 0.00 178.44 179.20 1k83 h GLU 40 N -0.17 0.14 0.20 1.25 4.57 -1.99 0.20 114.58 118.77 1k83 h GLU 40 Ca 0.01 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1k83 h GLU 40 Cb 0.20 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 1k83 h GLU 40 CO -0.12 0.09 -0.10 -0.44 -1.18 0.00 0.00 179.01 177.26 1k83 h ASP 41 N 0.14 -0.23 -0.92 1.04 3.32 -1.83 -2.83 116.42 115.11 1k83 h ASP 41 Ca 0.68 -0.29 0.26 0.00 0.02 0.00 0.00 57.03 57.69 1k83 h ASP 41 Cb 2.28 0.06 -0.16 0.00 0.22 0.00 0.00 39.33 41.73 1k83 h ASP 41 CO -0.20 0.29 0.14 0.15 -1.72 0.00 0.00 179.24 177.90 1k83 h PHE 42 N -0.87 0.17 -0.48 4.55 3.57 0.09 0.60 116.94 124.57 1k83 h PHE 42 Ca -0.03 0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.60 1k83 h PHE 42 Cb 0.51 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.27 1k83 h PHE 42 CO 0.07 -0.33 0.17 0.87 -2.23 0.00 0.00 178.31 176.86 1k83 h LYS 43 N 0.09 0.34 0.11 1.11 1.57 -0.93 -1.65 116.57 117.21 1k83 h LYS 43 Ca 0.58 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.33 1k83 h LYS 43 Cb 1.20 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1k83 h LYS 43 CO -0.78 0.22 -0.05 0.00 -0.57 0.00 0.00 179.45 178.27 1k83 h ALA 44 N 1.32 -0.15 0.00 3.86 0.00 0.17 -0.11 119.26 124.35 1k83 h ALA 44 Ca 0.23 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1k83 h ALA 44 Cb 0.24 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1k83 h ALA 44 CO -0.23 -0.22 0.02 1.17 0.00 0.00 0.00 179.25 179.99 1k83 n LYS 45 N -4.86 0.00 0.00 0.00 4.81 0.16 -3.44 118.16 114.84 1k83 n LYS 45 Ca -0.07 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.72 1k83 n LYS 45 Cb 0.27 -1.52 0.00 0.00 0.02 0.00 0.00 35.03 33.80 1k83 n LYS 45 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1k83 n TYR 46 N -1.34 0.00 -3.26 5.64 4.02 -0.63 -5.02 117.16 116.57 1k83 n TYR 46 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.62 1k83 n TYR 46 Cb 0.02 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.32 1k83 n TYR 46 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1k83 s ASP 48 N -3.53 5.87 -1.14 0.00 -4.77 -1.12 -4.90 116.67 107.07 1k83 s ASP 48 Ca 0.43 0.07 -0.22 0.00 -3.30 0.00 0.00 52.55 49.53 1k83 s ASP 48 Cb -0.10 -1.38 -0.06 0.00 -1.09 0.00 0.00 42.92 40.29 1k83 s ASP 48 CO 0.34 -0.60 1.90 -0.94 0.70 0.00 0.00 175.17 176.56 1k83 s SER 49 N -4.21 5.31 0.00 2.11 1.04 -1.26 -2.89 113.70 113.81 1k83 s SER 49 Ca 0.47 -1.57 0.00 0.00 0.48 0.00 0.00 55.95 55.33 1k83 s SER 49 Cb -0.10 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.44 1k83 s SER 49 CO 0.35 -2.74 0.00 0.80 0.98 0.00 0.00 173.24 172.63 1k83 n MET 50 N 8.42 0.00 0.00 4.02 0.00 -1.26 -4.99 117.12 123.31 1k83 n MET 50 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 58.14 1k83 n MET 50 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.69 1k83 n MET 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1k83 n GLY 51 N 0.00 1.88 3.80 -5.12 0.00 -1.14 -5.08 105.19 99.53 1k83 n GLY 51 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1k83 n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k83 s ARG 52 N -0.73 4.39 -0.04 1.61 0.52 -1.26 -4.91 118.95 118.54 1k83 s ARG 52 Ca 0.00 1.14 -0.24 0.00 -0.52 0.00 0.00 55.73 56.11 1k83 s ARG 52 Cb 0.00 -2.65 -0.04 0.00 0.52 0.00 0.00 34.95 32.78 1k83 s ARG 52 CO 0.00 0.22 0.71 -1.25 0.02 0.00 0.00 175.30 175.01 1k83 s PRO 53 N -2.37 4.44 -0.76 3.54 0.04 -1.26 -2.79 135.00 135.85 1k83 s PRO 53 Ca 0.52 0.92 -0.14 0.00 0.04 0.00 0.00 61.00 62.34 1k83 s PRO 53 Cb -0.15 -3.42 0.20 0.00 0.04 0.00 0.00 34.50 31.16 1k83 s PRO 53 CO 0.20 0.13 0.70 -0.65 0.04 0.00 0.00 177.00 177.41 1k83 s GLN 54 N 0.57 3.43 0.25 4.56 -1.52 -1.20 -4.92 119.66 120.82 1k83 s GLN 54 Ca 0.38 -2.30 -0.03 0.00 -1.95 0.00 0.00 55.36 51.45 1k83 s GLN 54 Cb -0.18 -4.37 0.43 0.00 -0.22 0.00 0.00 33.01 28.67 1k83 s GLN 54 CO 0.19 -1.29 1.81 0.00 -0.25 0.00 0.00 175.29 175.75 1k83 h ARG 55 N 7.99 0.80 -0.99 2.91 3.08 -1.91 -1.92 114.38 124.33 1k83 h ARG 55 Ca 0.02 -0.05 0.33 0.00 0.07 0.00 0.00 59.98 60.35 1k83 h ARG 55 Cb 1.05 -0.18 -0.16 0.00 0.08 0.00 0.00 29.97 30.76 1k83 h ARG 55 CO 0.81 0.53 0.53 0.87 -1.07 0.00 0.00 179.97 181.63 1k83 h LYS 56 N 0.82 0.24 0.00 0.04 1.79 -1.91 0.30 116.57 117.84 1k83 h LYS 56 Ca 0.42 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.86 1k83 h LYS 56 Cb 0.40 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 30.99 1k83 h LYS 56 CO -0.26 0.16 -0.09 0.52 -1.08 0.00 0.00 179.45 178.70 1k83 h MET 57 N 0.24 0.00 -0.08 3.15 2.86 -1.68 -3.25 114.93 116.16 1k83 h MET 57 Ca 0.74 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 58.23 1k83 h MET 57 Cb 1.74 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.39 1k83 h MET 57 CO -0.65 0.09 -0.60 0.52 1.06 0.00 0.00 176.91 177.33 1k83 h MET 58 N 0.00 0.28 -5.54 1.72 2.86 -0.49 -3.46 114.93 110.29 1k83 h MET 58 Ca -0.00 -0.19 -0.46 0.00 -2.06 0.00 0.00 59.70 56.99 1k83 h MET 58 Cb 0.63 0.03 0.24 0.00 0.06 0.00 0.00 31.60 32.55 1k83 h MET 58 CO 0.01 0.79 -2.39 0.43 1.06 0.00 0.00 176.91 176.81 1k83 n SER 59 N -3.88 -3.28 0.00 1.22 7.64 -1.23 -4.94 113.62 109.14 1k83 n SER 59 Ca -0.02 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1k83 n SER 59 Cb 0.62 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 1k83 n SER 59 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 1k83 n PHE 60 N -3.07 0.00 -4.10 1.43 1.16 -1.17 -5.00 117.46 106.71 1k83 n PHE 60 Ca -0.02 0.00 -0.25 0.00 -1.87 0.00 0.00 57.45 55.31 1k83 n PHE 60 Cb 0.67 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.49 1k83 n PHE 60 CO 0.00 0.00 0.00 -1.14 -1.87 0.00 0.00 176.76 173.75 1k83 s GLN 61 N -2.00 2.89 -0.04 3.97 0.74 -1.26 -1.39 119.66 122.57 1k83 s GLN 61 Ca 0.00 -0.93 -0.02 0.00 0.05 0.00 0.00 55.36 54.46 1k83 s GLN 61 Cb 0.00 -2.61 0.02 0.00 1.10 0.00 0.00 33.01 31.52 1k83 s GLN 61 CO 0.00 0.46 0.08 0.00 -0.55 0.00 0.00 175.29 175.28 1k83 s ALA 62 N -1.86 -0.12 0.02 1.58 0.00 -0.96 -4.97 121.76 115.44 1k83 s ALA 62 Ca 0.31 0.37 0.04 0.00 0.00 0.00 0.00 51.96 52.69 1k83 s ALA 62 Cb -0.09 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 1k83 s ALA 62 CO 0.24 -0.09 -0.07 -0.80 0.00 0.00 0.00 175.76 175.03 1k83 s ASN 63 N 0.70 4.60 1.06 0.00 0.01 -1.26 -1.13 114.94 118.92 1k83 s ASN 63 Ca -0.05 -0.19 -0.13 0.00 -0.71 0.00 0.00 52.86 51.78 1k83 s ASN 63 Cb -0.08 -1.04 0.18 0.00 0.41 0.00 0.00 41.25 40.72 1k83 s ASN 63 CO -0.03 0.26 0.77 -2.65 -1.51 0.00 0.00 177.10 173.94 1k83 n PRO 64 N 1.38 -1.44 -4.08 -0.60 -0.02 -1.26 -0.25 135.00 128.73 1k83 n PRO 64 Ca -0.15 -0.38 -0.27 0.00 -2.02 0.00 0.00 63.50 60.68 1k83 n PRO 64 Cb 0.52 -2.09 -0.06 0.00 -0.02 0.00 0.00 33.50 31.86 1k83 n PRO 64 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1k83 s THR 65 N -2.44 4.44 0.24 3.45 -4.23 -1.05 -4.29 115.64 111.77 1k83 s THR 65 Ca 0.64 -1.02 -0.05 0.00 -1.18 0.00 0.00 61.69 60.08 1k83 s THR 65 Cb -0.22 -3.23 0.21 0.00 1.34 0.00 0.00 72.50 70.61 1k83 s THR 65 CO 0.64 -0.05 1.72 -0.33 -0.54 0.00 0.00 174.62 176.06 1k83 h GLU 66 N 2.66 0.38 -0.53 3.99 5.08 -1.95 0.61 114.58 124.82 1k83 h GLU 66 Ca -0.47 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 57.91 1k83 h GLU 66 Cb 1.19 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.33 1k83 h GLU 66 CO 0.63 0.25 0.35 1.49 -1.00 0.00 0.00 179.01 180.74 1k83 h GLU 67 N 0.39 0.54 0.19 2.33 4.81 -1.96 -2.77 114.58 118.11 1k83 h GLU 67 Ca 0.40 -0.03 -0.31 0.00 -0.13 0.00 0.00 59.36 59.29 1k83 h GLU 67 Cb 0.63 -0.12 0.03 0.00 0.63 0.00 0.00 28.75 29.91 1k83 h GLU 67 CO -0.42 0.36 -1.36 0.77 -0.73 0.00 0.00 179.01 177.63 1k83 h SER 68 N 0.56 0.77 0.46 1.04 0.02 -0.18 -3.30 113.55 112.92 1k83 h SER 68 Ca 0.22 -0.79 0.00 0.00 -0.84 0.00 0.00 61.79 60.38 1k83 h SER 68 Cb 0.18 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.47 1k83 h SER 68 CO -0.06 1.61 0.00 -0.38 -1.14 0.00 0.00 176.83 176.86 1k83 n ILE 69 N -3.71 0.19 0.35 3.27 5.41 0.15 -1.73 119.36 123.28 1k83 n ILE 69 Ca -0.14 0.05 0.13 0.00 1.00 0.00 0.00 62.75 63.78 1k83 n ILE 69 Cb 1.05 -0.63 0.31 0.00 -0.71 0.00 0.00 39.64 39.65 1k83 n ILE 69 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1k83 h SER 70 N 0.00 0.00 0.00 4.38 4.64 -1.58 -3.26 113.55 117.74 1k83 h SER 70 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1k83 h SER 70 Cb 0.23 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 1k83 h SER 70 CO 0.00 0.00 -1.34 1.17 -0.87 0.00 0.00 176.83 175.79 1k83 n LYS 71 N -2.83 0.15 -3.91 4.77 4.81 -1.08 -4.88 118.16 115.19 1k83 n LYS 71 Ca 0.04 0.04 -0.29 0.00 -0.87 0.00 0.00 58.31 57.22 1k83 n LYS 71 Cb 0.46 -1.07 -0.13 0.00 0.02 0.00 0.00 35.03 34.31 1k83 n LYS 71 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1k83 s PHE 72 N -2.12 3.20 0.31 5.64 0.40 -0.71 -4.91 117.98 119.81 1k83 s PHE 72 Ca -0.08 -3.17 0.02 0.00 -0.60 0.00 0.00 56.93 53.10 1k83 s PHE 72 Cb 0.02 -2.70 0.53 0.00 0.51 0.00 0.00 43.02 41.38 1k83 s PHE 72 CO 0.13 -0.68 1.85 -1.35 0.70 0.00 0.00 175.22 175.87 1k83 h PRO 73 N 6.14 0.62 0.00 0.24 0.11 -1.81 -3.03 132.00 134.27 1k83 h PRO 73 Ca 0.00 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 65.98 1k83 h PRO 73 Cb 0.85 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1k83 h PRO 73 CO 0.68 0.62 0.00 -0.25 -0.21 0.00 0.00 178.00 178.85 1k83 n ASP 74 N -4.27 0.00 -4.56 -2.05 8.00 -1.26 -4.74 116.55 107.68 1k83 n ASP 74 Ca 0.02 -1.23 -0.31 0.00 0.71 0.00 0.00 54.79 53.99 1k83 n ASP 74 Cb 0.25 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.31 1k83 n ASP 74 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1k83 s MET 75 N -2.00 2.47 0.00 -1.24 1.75 -1.14 -4.93 119.30 114.21 1k83 s MET 75 Ca 0.37 0.22 0.00 0.00 -1.25 0.00 0.00 55.69 55.03 1k83 s MET 75 Cb 0.17 -4.76 0.00 0.00 2.84 0.00 0.00 34.83 33.08 1k83 s MET 75 CO 0.29 -3.22 0.00 0.41 -0.65 0.00 0.00 175.02 171.85 1k83 n GLY 76 N 6.36 -3.23 3.58 2.11 0.00 -1.26 -4.69 105.19 108.05 1k83 n GLY 76 Ca 0.33 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 45.25 1k83 n GLY 76 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k83 s SER 77 N -1.91 3.49 0.38 1.61 1.04 -1.26 -4.24 113.70 112.80 1k83 s SER 77 Ca 0.00 -1.38 0.08 0.00 0.48 0.00 0.00 55.95 55.12 1k83 s SER 77 Cb 0.00 -0.28 -0.04 0.00 0.10 0.00 0.00 66.02 65.80 1k83 s SER 77 CO 0.00 -0.51 0.17 -0.76 0.98 0.00 0.00 173.24 173.12 1k83 s LEU 78 N -3.66 3.20 -0.26 2.42 1.43 -0.28 -2.70 118.68 118.83 1k83 s LEU 78 Ca 0.34 -0.90 -0.03 0.00 -1.03 0.00 0.00 54.13 52.51 1k83 s LEU 78 Cb 0.09 -1.63 0.10 0.00 0.03 0.00 0.00 46.19 44.78 1k83 s LEU 78 CO 0.17 -0.43 0.17 0.86 0.23 0.00 0.00 176.35 177.35 1k83 s TRP 79 N -2.50 0.08 0.51 0.29 -0.11 -0.53 -2.28 118.94 114.39 1k83 s TRP 79 Ca 0.40 -0.53 -0.09 0.00 1.22 0.00 0.00 56.10 57.10 1k83 s TRP 79 Cb 0.00 -0.72 -0.05 0.00 -1.50 0.00 0.00 33.47 31.20 1k83 s TRP 79 CO 0.23 -0.77 0.86 0.08 -4.62 0.00 0.00 176.95 172.73 1k83 s VAL 80 N 2.18 4.80 -0.25 5.86 1.01 -0.49 -1.23 120.40 132.29 1k83 s VAL 80 Ca 0.08 0.54 -0.16 0.00 0.00 0.00 0.00 61.98 62.45 1k83 s VAL 80 Cb -0.16 -3.83 0.07 0.00 0.00 0.00 0.00 36.38 32.47 1k83 s VAL 80 CO -0.29 -0.85 0.62 -0.70 0.00 0.00 0.00 175.10 173.88 1k83 s GLU 81 N -4.63 0.65 0.08 2.72 2.56 -0.74 -3.05 118.70 116.28 1k83 s GLU 81 Ca 0.51 1.08 0.08 0.00 0.00 0.00 0.00 54.97 56.64 1k83 s GLU 81 Cb -0.10 0.14 -0.04 0.00 2.00 0.00 0.00 34.13 36.13 1k83 s GLU 81 CO 0.44 -0.14 -0.17 -0.06 -0.56 0.00 0.00 175.26 174.77 1k83 s PHE 82 N 1.37 2.57 -0.03 5.30 0.40 -1.26 -0.89 117.98 125.44 1k83 s PHE 82 Ca -0.08 -0.24 0.04 0.00 -0.60 0.00 0.00 56.93 56.04 1k83 s PHE 82 Cb -0.06 -1.41 -0.00 0.00 0.51 0.00 0.00 43.02 42.06 1k83 s PHE 82 CO -0.15 0.34 -0.15 0.00 0.70 0.00 0.00 175.22 175.96 1k83 h ASP 84 N 6.12 0.00 -2.82 0.00 3.45 -1.95 -3.42 116.42 117.80 1k83 h ASP 84 Ca -0.34 0.00 -0.57 0.00 0.43 0.00 0.00 57.03 56.55 1k83 h ASP 84 Cb 1.17 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.90 1k83 h ASP 84 CO 0.48 0.23 1.22 -1.61 -1.57 0.00 0.00 179.24 177.99 1k83 s GLU 85 N -4.21 3.39 0.16 3.56 2.02 -1.26 -4.87 118.70 117.49 1k83 s GLU 85 Ca -0.03 1.27 -0.23 0.00 0.02 0.00 0.00 54.97 56.00 1k83 s GLU 85 Cb 0.14 -4.15 0.06 0.00 0.10 0.00 0.00 34.13 30.27 1k83 s GLU 85 CO 0.66 -1.80 1.60 -1.35 0.02 0.00 0.00 175.26 174.39 1k83 h PRO 86 N 12.31 -0.25 -5.19 0.39 0.11 -1.94 -3.37 132.00 134.06 1k83 h PRO 86 Ca -0.32 0.02 -0.62 0.00 0.11 0.00 0.00 66.00 65.19 1k83 h PRO 86 Cb 1.15 0.06 -0.17 0.00 0.11 0.00 0.00 31.00 32.14 1k83 h PRO 86 CO 1.05 -0.16 -0.57 0.45 -0.21 0.00 0.00 178.00 178.56 1k83 s SER 87 N -5.07 5.56 -0.20 -2.05 0.15 -1.26 -2.03 113.70 108.80 1k83 s SER 87 Ca -0.15 0.02 -0.13 0.00 0.70 0.00 0.00 55.95 56.39 1k83 s SER 87 Cb 0.13 -1.97 -0.05 0.00 -1.71 0.00 0.00 66.02 62.43 1k83 s SER 87 CO 0.68 0.12 0.28 -0.69 1.20 0.00 0.00 173.24 174.83 1k83 s VAL 88 N 0.69 5.29 0.30 4.45 1.01 -0.79 -4.97 120.40 126.39 1k83 s VAL 88 Ca 0.04 0.47 0.08 0.00 0.00 0.00 0.00 61.98 62.56 1k83 s VAL 88 Cb -0.13 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1k83 s VAL 88 CO 0.02 0.33 0.23 -0.83 0.00 0.00 0.00 175.10 174.84 1k83 s GLY 89 N 0.85 1.65 0.42 4.51 0.00 -1.26 0.50 107.32 114.00 1k83 s GLY 89 Ca 0.14 -1.58 0.25 0.00 0.00 0.00 0.00 44.72 43.52 1k83 s GLY 89 CO 0.05 -1.56 1.71 -0.24 0.00 0.00 0.00 173.10 173.06 1k83 h VAL 90 N 1.40 0.34 -0.36 1.40 3.04 -1.91 0.23 116.25 120.39 1k83 h VAL 90 Ca -0.46 -0.08 -0.04 0.00 -1.01 0.00 0.00 66.70 65.11 1k83 h VAL 90 Cb 1.25 0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 30.60 1k83 h VAL 90 CO 0.60 0.04 0.06 0.11 -1.01 0.00 0.00 177.57 177.37 1k83 h LYS 91 N 0.23 0.59 -0.45 4.17 1.57 -2.00 -1.21 116.57 119.47 1k83 h LYS 91 Ca 0.69 -0.16 -0.10 0.00 -1.87 0.00 0.00 60.65 59.22 1k83 h LYS 91 Cb 2.03 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 34.26 1k83 h LYS 91 CO -0.33 0.66 -0.10 1.15 -0.57 0.00 0.00 179.45 180.26 1k83 h THR 92 N 0.43 1.27 -0.21 -0.16 2.02 -0.98 -3.11 112.91 112.17 1k83 h THR 92 Ca 0.11 -1.21 -0.04 0.00 0.77 0.00 0.00 66.41 66.03 1k83 h THR 92 Cb 0.36 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 1k83 h THR 92 CO 0.01 0.41 -0.03 -0.03 0.37 0.00 0.00 175.52 176.25 1k83 h MET 93 N 0.70 0.39 -0.88 6.66 1.85 -1.23 -3.01 114.93 119.40 1k83 h MET 93 Ca 0.11 -0.14 0.18 0.00 -0.61 0.00 0.00 59.70 59.25 1k83 h MET 93 Cb 0.64 -0.03 -0.11 0.00 0.43 0.00 0.00 31.60 32.54 1k83 h MET 93 CO 0.04 0.62 0.43 0.87 -0.40 0.00 0.00 176.91 178.47 1k83 h LYS 94 N 0.12 0.51 -0.87 0.39 1.57 -1.24 0.67 116.57 117.72 1k83 h LYS 94 Ca 0.05 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.87 1k83 h LYS 94 Cb 0.47 -0.11 -0.06 0.00 0.08 0.00 0.00 32.23 32.60 1k83 h LYS 94 CO 0.02 0.34 0.54 1.15 -0.57 0.00 0.00 179.45 180.92 1k83 h THR 95 N 0.52 1.04 0.35 -0.16 2.02 -1.46 -0.26 112.91 114.97 1k83 h THR 95 Ca 0.51 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 67.34 1k83 h THR 95 Cb 0.86 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1k83 h THR 95 CO -0.44 0.18 -0.17 0.15 0.37 0.00 0.00 175.52 175.61 1k83 h PHE 96 N 0.98 -0.44 -0.40 3.16 3.57 -0.19 -1.52 116.94 122.10 1k83 h PHE 96 Ca 0.38 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.99 1k83 h PHE 96 Cb 0.18 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 1k83 h PHE 96 CO -0.03 -0.19 0.49 0.28 -2.23 0.00 0.00 178.31 176.63 1k83 h VAL 97 N -1.07 0.29 0.06 1.41 2.07 0.20 0.14 116.25 119.34 1k83 h VAL 97 Ca -0.05 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.33 1k83 h VAL 97 Cb 0.45 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1k83 h VAL 97 CO 0.08 0.00 -0.71 0.40 0.02 0.00 0.00 177.57 177.36 1k83 h ILE 98 N 0.00 1.41 -0.03 4.57 2.04 -1.05 -3.22 117.51 121.23 1k83 h ILE 98 Ca 0.19 -2.37 0.04 0.00 1.00 0.00 0.00 64.86 63.71 1k83 h ILE 98 Cb 1.18 2.99 -0.05 0.00 -0.74 0.00 0.00 36.82 40.20 1k83 h ILE 98 CO -0.00 0.60 -0.30 -0.74 0.00 0.00 0.00 178.15 177.71 1k83 h HIS 99 N -0.71 -0.81 -0.67 1.37 2.76 0.33 0.69 115.15 118.11 1k83 h HIS 99 Ca -0.16 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.10 1k83 h HIS 99 Cb 1.36 0.36 -0.06 0.00 1.55 0.00 0.00 27.41 30.63 1k83 h HIS 99 CO 0.20 -0.39 0.37 0.82 -1.30 0.00 0.00 177.93 177.63 1k83 h ILE 100 N -0.43 0.97 0.66 6.26 2.04 -1.50 -1.58 117.51 123.94 1k83 h ILE 100 Ca 0.07 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 1k83 h ILE 100 Cb 0.53 0.22 0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1k83 h ILE 100 CO -0.27 0.13 -0.32 -0.61 0.00 0.00 0.00 178.15 177.08 1k83 h GLN 101 N 0.69 -0.86 -0.05 2.37 4.15 -1.39 -0.79 115.11 119.23 1k83 h GLN 101 Ca 0.30 0.06 0.01 0.00 0.77 0.00 0.00 58.65 59.78 1k83 h GLN 101 Cb 0.19 0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 1k83 h GLN 101 CO -0.18 -0.54 -0.06 0.93 -1.93 0.00 0.00 178.83 177.05 1k83 h GLU 102 N -1.01 -0.04 -0.11 1.69 5.08 0.75 0.43 114.58 121.38 1k83 h GLU 102 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1k83 h GLU 102 Cb 0.71 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1k83 h GLU 102 CO 0.15 -0.03 0.00 1.63 -1.00 0.00 0.00 179.01 179.76 1k83 n LYS 103 N -3.00 0.29 -3.43 2.33 4.76 -0.63 -4.84 118.16 113.65 1k83 n LYS 103 Ca -0.00 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.21 1k83 n LYS 103 Cb 0.04 -1.06 0.01 0.00 -1.84 0.00 0.00 35.03 32.18 1k83 n LYS 103 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1k83 n ASN 104 N -0.18 -6.06 -4.49 4.39 4.05 0.14 -5.00 115.26 108.12 1k83 n ASN 104 Ca 0.00 -0.32 -0.33 0.00 0.45 0.00 0.00 54.58 54.38 1k83 n ASN 104 Cb 0.03 -2.88 -0.13 0.00 1.23 0.00 0.00 39.78 38.03 1k83 n ASN 104 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 1k83 s PHE 105 N -2.45 2.89 -0.32 1.20 2.99 -0.32 -4.91 117.98 117.06 1k83 s PHE 105 Ca 0.16 -0.26 0.26 0.00 0.00 0.00 0.00 56.93 57.09 1k83 s PHE 105 Cb -0.02 -1.80 0.63 0.00 0.00 0.00 0.00 43.02 41.83 1k83 s PHE 105 CO 0.85 0.07 1.71 0.37 -0.00 0.00 0.00 175.22 178.22 1k83 h GLN 106 N 6.02 0.00 -3.11 0.44 4.15 -1.86 -3.44 115.11 117.31 1k83 h GLN 106 Ca -0.38 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 58.88 1k83 h GLN 106 Cb 1.19 0.00 -0.26 0.00 0.21 0.00 0.00 27.48 28.62 1k83 h GLN 106 CO 0.56 0.00 -0.43 0.99 -1.93 0.00 0.00 178.83 178.02 1k83 s THR 107 N -3.32 -0.00 -0.07 2.39 2.01 -1.10 -2.48 115.64 113.07 1k83 s THR 107 Ca 0.06 0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.08 1k83 s THR 107 Cb 0.06 -0.36 0.02 0.00 0.01 0.00 0.00 72.50 72.23 1k83 s THR 107 CO 0.63 0.01 -0.07 -0.83 -0.69 0.00 0.00 174.62 173.67 1k83 s GLY 108 N 0.26 0.66 -0.20 4.40 0.00 -1.03 -1.45 107.32 109.96 1k83 s GLY 108 Ca -0.01 -0.30 -0.06 0.00 0.00 0.00 0.00 44.72 44.34 1k83 s GLY 108 CO -0.01 0.52 0.03 -0.42 0.00 0.00 0.00 173.10 173.22 1k83 s ILE 109 N 1.17 4.30 -0.33 0.90 1.01 -0.36 -0.31 121.20 127.58 1k83 s ILE 109 Ca -0.06 -0.20 -0.06 0.00 0.00 0.00 0.00 60.65 60.33 1k83 s ILE 109 Cb -0.14 -2.95 0.03 0.00 0.01 0.00 0.00 42.46 39.41 1k83 s ILE 109 CO -0.02 0.43 0.10 0.12 0.00 0.00 0.00 174.94 175.57 1k83 s PHE 110 N 0.82 3.22 -0.60 3.97 5.36 0.28 -1.80 117.98 129.23 1k83 s PHE 110 Ca 0.02 -1.30 -0.15 0.00 -0.96 0.00 0.00 56.93 54.53 1k83 s PHE 110 Cb -0.14 -2.27 0.15 0.00 -0.34 0.00 0.00 43.02 40.42 1k83 s PHE 110 CO 0.02 -0.69 0.56 0.08 -1.46 0.00 0.00 175.22 173.73 1k83 s VAL 111 N 1.43 5.28 0.57 3.12 1.01 -0.07 -0.99 120.40 130.75 1k83 s VAL 111 Ca -0.00 -1.72 -0.03 0.00 0.00 0.00 0.00 61.98 60.23 1k83 s VAL 111 Cb -0.19 -4.36 0.02 0.00 0.00 0.00 0.00 36.38 31.86 1k83 s VAL 111 CO 0.03 -0.90 0.85 -0.72 0.00 0.00 0.00 175.10 174.35 1k83 s TYR 112 N 1.28 3.10 -0.08 5.22 -0.85 -0.59 -3.75 117.35 121.68 1k83 s TYR 112 Ca 0.06 0.38 -0.05 0.00 -0.52 0.00 0.00 57.07 56.94 1k83 s TYR 112 Cb -0.26 -2.74 -0.02 0.00 0.38 0.00 0.00 41.96 39.33 1k83 s TYR 112 CO 0.00 -0.85 -0.10 1.04 -1.52 0.00 0.00 175.55 174.12 1k83 n GLN 113 N -2.49 0.26 -0.11 -3.49 6.02 -1.24 -2.02 117.38 114.31 1k83 n GLN 113 Ca 0.05 0.39 -0.13 0.00 -0.01 0.00 0.00 57.00 57.30 1k83 n GLN 113 Cb 0.59 -1.27 -0.12 0.00 1.02 0.00 0.00 30.24 30.45 1k83 n GLN 113 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1k83 n ASN 114 N -3.58 1.45 0.00 1.08 0.23 -0.86 -4.51 115.26 109.06 1k83 n ASN 114 Ca -0.04 -0.08 0.00 0.00 -0.53 0.00 0.00 54.58 53.93 1k83 n ASN 114 Cb 0.16 0.17 0.00 0.00 -2.08 0.00 0.00 39.78 38.03 1k83 n ASN 114 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1k83 n ASN 115 N -2.98 0.00 -4.44 0.53 6.94 -1.23 -5.05 115.26 109.03 1k83 n ASN 115 Ca -0.37 0.00 -0.22 0.00 -0.02 0.00 0.00 54.58 53.97 1k83 n ASN 115 Cb 1.01 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 38.33 1k83 n ASN 115 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1k83 s ILE 116 N -2.30 1.78 0.07 1.53 1.01 -1.26 -1.88 121.20 120.14 1k83 s ILE 116 Ca 0.00 -2.16 -0.31 0.00 0.00 0.00 0.00 60.65 58.19 1k83 s ILE 116 Cb 0.00 -2.44 -0.06 0.00 0.01 0.00 0.00 42.46 39.97 1k83 s ILE 116 CO 0.00 -0.31 1.22 -0.89 0.00 0.00 0.00 174.94 174.95 1k83 s THR 117 N -2.93 3.94 0.49 2.92 2.01 0.18 -4.85 115.64 117.41 1k83 s THR 117 Ca 0.29 1.41 0.25 0.00 0.31 0.00 0.00 61.69 63.95 1k83 s THR 117 Cb 0.03 -3.90 0.25 0.00 0.01 0.00 0.00 72.50 68.89 1k83 s THR 117 CO 0.12 0.12 1.74 -0.65 -0.69 0.00 0.00 174.62 175.26 1k83 h PRO 118 N 6.71 0.00 0.33 4.92 0.11 -1.99 0.14 132.00 142.21 1k83 h PRO 118 Ca -0.42 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 1k83 h PRO 118 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1k83 h PRO 118 CO 0.81 0.00 -0.16 0.77 -0.21 0.00 0.00 178.00 179.21 1k83 h SER 119 N 0.00 -0.37 -0.28 -2.05 0.02 -1.95 -3.18 113.55 105.74 1k83 h SER 119 Ca 0.00 -0.09 0.01 0.00 -0.84 0.00 0.00 61.79 60.87 1k83 h SER 119 Cb 0.67 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.30 1k83 h SER 119 CO 0.00 0.09 0.19 0.00 -1.14 0.00 0.00 176.83 175.97 1k83 h ALA 120 N -0.88 1.86 -0.81 3.77 0.00 -1.16 -2.07 119.26 119.97 1k83 h ALA 120 Ca -0.05 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 54.95 1k83 h ALA 120 Cb 0.44 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.06 1k83 h ALA 120 CO 0.07 0.12 0.44 0.52 0.00 0.00 0.00 179.25 180.40 1k83 h MET 121 N 0.33 0.69 0.00 0.00 2.86 -0.94 0.43 114.93 118.31 1k83 h MET 121 Ca 0.11 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1k83 h MET 121 Cb 0.03 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.54 1k83 h MET 121 CO -0.02 0.46 0.00 1.63 1.06 0.00 0.00 176.91 180.03 1k83 n LYS 122 N -4.80 0.15 0.15 1.72 5.02 -0.78 -2.05 118.16 117.57 1k83 n LYS 122 Ca 0.14 0.37 0.13 0.00 -2.02 0.00 0.00 58.31 56.93 1k83 n LYS 122 Cb 0.31 -1.78 0.49 0.00 -0.02 0.00 0.00 35.03 34.04 1k83 n LYS 122 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1k83 h LEU 123 N 0.00 0.00 0.00 -0.35 6.46 -0.09 -3.37 115.31 117.96 1k83 h LEU 123 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1k83 h LEU 123 Cb 0.35 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.28 1k83 h LEU 123 CO 0.00 0.00 0.00 0.52 -0.62 0.00 0.00 178.44 178.34 1k83 n VAL 124 N -2.39 0.00 -1.73 1.05 0.31 -0.87 -4.18 118.33 110.52 1k83 n VAL 124 Ca 0.03 1.05 -0.33 0.00 -0.01 0.00 0.00 64.34 65.08 1k83 n VAL 124 Cb 0.28 -2.01 -0.04 0.00 -0.91 0.00 0.00 33.84 31.17 1k83 n VAL 124 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1k83 s PRO 125 N -1.21 2.21 0.00 5.55 0.04 -1.26 -4.30 135.00 136.02 1k83 s PRO 125 Ca 0.00 0.92 0.00 0.00 0.04 0.00 0.00 61.00 61.96 1k83 s PRO 125 Cb 0.00 -4.60 0.00 0.00 0.04 0.00 0.00 34.50 29.94 1k83 s PRO 125 CO 0.00 -3.31 0.06 -1.13 0.04 0.00 0.00 177.00 172.66 1k83 n SER 126 N 15.29 0.00 -2.81 6.66 3.41 -1.26 -5.01 113.62 129.90 1k83 n SER 126 Ca 0.34 -0.80 -0.11 0.00 -0.26 0.00 0.00 58.87 58.04 1k83 n SER 126 Cb 0.52 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.51 1k83 n SER 126 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1k83 n ILE 127 N 0.00 0.34 -1.61 -1.33 -5.35 -1.26 -5.14 119.36 105.01 1k83 n ILE 127 Ca 0.00 -2.86 -0.38 0.00 -0.27 0.00 0.00 62.75 59.23 1k83 n ILE 127 Cb 0.40 0.63 0.05 0.00 -1.74 0.00 0.00 39.64 38.98 1k83 n ILE 127 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1k83 n PRO 128 N -0.03 0.97 0.13 6.28 -0.04 -1.26 -2.63 135.00 138.41 1k83 n PRO 128 Ca 0.10 0.37 0.12 0.00 -0.04 0.00 0.00 63.50 64.05 1k83 n PRO 128 Cb 0.77 -2.13 0.24 0.00 -0.04 0.00 0.00 33.50 32.34 1k83 n PRO 128 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1k83 h PRO 129 N 0.66 0.00 -6.11 0.54 0.13 -1.98 -3.50 132.00 121.74 1k83 h PRO 129 Ca -0.48 0.00 -0.78 0.00 -0.87 0.00 0.00 66.00 63.88 1k83 h PRO 129 Cb 1.36 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.51 1k83 h PRO 129 CO 0.52 0.00 0.74 0.00 -0.23 0.00 0.00 178.00 179.03 1k83 n ALA 130 N -1.93 -0.82 -2.86 -0.56 0.00 -1.08 -4.92 120.51 108.34 1k83 n ALA 130 Ca 0.04 0.45 -0.29 0.00 0.00 0.00 0.00 53.44 53.63 1k83 n ALA 130 Cb 0.47 -2.09 -0.05 0.00 0.00 0.00 0.00 19.45 17.78 1k83 n ALA 130 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1k83 s THR 131 N 2.86 4.99 0.03 0.00 -4.23 -1.03 -4.55 115.64 113.71 1k83 s THR 131 Ca 0.98 -0.64 0.07 0.00 -1.18 0.00 0.00 61.69 60.93 1k83 s THR 131 Cb -1.20 -3.46 -0.03 0.00 1.34 0.00 0.00 72.50 69.15 1k83 s THR 131 CO 0.68 0.07 -0.20 -0.63 -0.54 0.00 0.00 174.62 174.00 1k83 s ILE 132 N -1.54 2.60 0.05 2.99 1.01 -1.26 -2.46 121.20 122.60 1k83 s ILE 132 Ca 0.33 -1.21 0.05 0.00 0.00 0.00 0.00 60.65 59.82 1k83 s ILE 132 Cb -0.12 -2.06 -0.02 0.00 0.01 0.00 0.00 42.46 40.26 1k83 s ILE 132 CO 0.26 0.37 -0.15 -1.61 0.00 0.00 0.00 174.94 173.80 1k83 s GLU 133 N -1.31 0.97 0.14 2.79 2.02 0.57 -4.96 118.70 118.93 1k83 s GLU 133 Ca 0.13 -0.85 0.10 0.00 0.02 0.00 0.00 54.97 54.37 1k83 s GLU 133 Cb -0.10 -1.01 -0.04 0.00 0.10 0.00 0.00 34.13 33.08 1k83 s GLU 133 CO 0.04 0.24 -0.23 0.95 0.02 0.00 0.00 175.26 176.28 1k83 s THR 134 N -0.96 2.05 -0.05 3.63 -4.23 -1.26 1.00 115.64 115.82 1k83 s THR 134 Ca 0.02 -1.79 -0.07 0.00 -1.18 0.00 0.00 61.69 58.67 1k83 s THR 134 Cb -0.09 -1.88 0.01 0.00 1.34 0.00 0.00 72.50 71.89 1k83 s THR 134 CO 0.02 -0.07 0.18 -0.36 -0.54 0.00 0.00 174.62 173.85 1k83 s PHE 135 N -1.40 -0.13 -0.30 3.99 0.40 -0.16 -4.89 117.98 115.49 1k83 s PHE 135 Ca 0.14 0.30 -0.14 0.00 -0.60 0.00 0.00 56.93 56.63 1k83 s PHE 135 Cb -0.09 0.04 -0.03 0.00 0.51 0.00 0.00 43.02 43.45 1k83 s PHE 135 CO 0.06 -0.18 0.31 1.21 0.70 0.00 0.00 175.22 177.33 1k83 s ASN 136 N -0.44 6.15 0.19 1.36 3.84 -1.26 -1.54 114.94 123.25 1k83 s ASN 136 Ca -0.05 0.02 0.01 0.00 0.21 0.00 0.00 52.86 53.04 1k83 s ASN 136 Cb -0.04 -2.18 0.46 0.00 -0.55 0.00 0.00 41.25 38.95 1k83 s ASN 136 CO 0.01 -0.19 0.98 -0.62 -2.79 0.00 0.00 177.10 174.49 1k83 n GLU 137 N 5.26 -0.05 -0.29 0.43 1.02 -0.85 0.15 120.64 126.31 1k83 n GLU 137 Ca -0.10 0.95 0.10 0.00 -0.02 0.00 0.00 57.16 58.08 1k83 n GLU 137 Cb 0.51 -1.49 0.26 0.00 -0.02 0.00 0.00 31.44 30.69 1k83 n GLU 137 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1k83 h ALA 138 N 1.26 1.24 -0.30 0.62 0.00 -1.86 0.20 119.26 120.41 1k83 h ALA 138 Ca 0.37 0.17 -0.17 0.00 0.00 0.00 0.00 54.91 55.29 1k83 h ALA 138 Cb 0.75 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.65 1k83 h ALA 138 CO -0.60 -0.35 0.21 0.00 0.00 0.00 0.00 179.25 178.51 1k83 n ALA 139 N -2.59 3.73 -0.05 0.00 0.00 0.40 -2.99 120.51 119.01 1k83 n ALA 139 Ca 0.19 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.72 1k83 n ALA 139 Cb 0.59 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.88 1k83 n ALA 139 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1k83 n LEU 140 N 0.18 0.00 0.33 0.00 4.77 0.61 -4.82 117.00 118.08 1k83 n LEU 140 Ca 0.18 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.35 1k83 n LEU 140 Cb 0.78 0.00 1.02 0.00 -2.33 0.00 0.00 43.42 42.89 1k83 n LEU 140 CO 0.20 0.00 1.16 0.58 -1.33 0.00 0.00 177.39 177.99 1k83 h VAL 141 N 0.00 0.01 -3.48 4.08 2.07 -1.21 -3.35 116.25 114.37 1k83 h VAL 141 Ca 0.00 0.00 -0.40 0.00 0.82 0.00 0.00 66.70 67.12 1k83 h VAL 141 Cb 0.00 0.83 -0.34 0.00 -1.52 0.00 0.00 31.29 30.27 1k83 h VAL 141 CO 0.00 0.00 -0.77 -0.69 0.02 0.00 0.00 177.57 176.13 1k83 s VAL 142 N -4.14 0.53 -0.73 2.57 1.01 -1.26 -4.37 120.40 114.01 1k83 s VAL 142 Ca -0.04 -0.13 -0.25 0.00 0.00 0.00 0.00 61.98 61.56 1k83 s VAL 142 Cb 0.11 -0.55 0.05 0.00 0.00 0.00 0.00 36.38 35.98 1k83 s VAL 142 CO 0.35 0.22 1.19 0.21 0.00 0.00 0.00 175.10 177.06 1k83 s ASN 143 N 0.85 6.19 0.46 3.32 3.84 -1.26 -4.88 114.94 123.46 1k83 s ASN 143 Ca -0.11 -0.72 0.19 0.00 0.21 0.00 0.00 52.86 52.43 1k83 s ASN 143 Cb -0.14 -2.51 1.18 0.00 -0.55 0.00 0.00 41.25 39.23 1k83 s ASN 143 CO 0.00 -1.68 1.94 0.16 -2.79 0.00 0.00 177.10 174.73 1k83 h ILE 144 N 6.05 0.76 0.00 -5.21 3.07 -1.94 0.24 117.51 120.48 1k83 h ILE 144 Ca -0.25 -0.09 0.00 0.00 1.55 0.00 0.00 64.86 66.07 1k83 h ILE 144 Cb 1.05 0.46 0.00 0.00 -0.27 0.00 0.00 36.82 38.07 1k83 h ILE 144 CO 1.25 0.05 0.00 0.71 -1.05 0.00 0.00 178.15 179.11 1k83 h THR 145 N 0.27 0.00 0.00 0.16 1.35 -1.94 -0.39 112.91 112.35 1k83 h THR 145 Ca 0.34 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 66.06 1k83 h THR 145 Cb 0.96 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 1k83 h THR 145 CO -0.08 0.00 0.00 1.41 -0.25 0.00 0.00 175.52 176.60 1k83 n HIS 146 N -2.95 0.00 -3.04 4.73 8.25 0.07 -4.83 115.22 117.45 1k83 n HIS 146 Ca -0.02 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.05 1k83 n HIS 146 Cb 0.14 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.19 1k83 n HIS 146 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1k83 s HIS 147 N -2.00 3.79 0.08 4.41 5.04 -0.16 -4.99 115.29 121.47 1k83 s HIS 147 Ca 0.37 1.47 -0.16 0.00 -1.54 0.00 0.00 55.06 55.20 1k83 s HIS 147 Cb 0.17 -2.74 -0.04 0.00 0.04 0.00 0.00 32.58 30.01 1k83 s HIS 147 CO 0.29 0.40 0.82 -1.91 -2.34 0.00 0.00 174.74 172.00 1k83 n GLU 148 N 2.29 -0.23 0.00 2.88 2.13 -1.26 0.53 120.64 126.98 1k83 n GLU 148 Ca -0.05 0.81 0.09 0.00 0.66 0.00 0.00 57.16 58.67 1k83 n GLU 148 Cb 0.50 -1.19 0.54 0.00 0.27 0.00 0.00 31.44 31.56 1k83 n GLU 148 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1k83 n LEU 149 N -4.55 0.00 -4.35 4.31 7.99 -1.26 -4.66 117.00 114.47 1k83 n LEU 149 Ca 0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 56.01 55.59 1k83 n LEU 149 Cb 0.13 0.00 -0.10 0.00 -0.11 0.00 0.00 43.42 43.35 1k83 n LEU 149 CO -0.08 0.00 -0.08 -0.69 -1.51 0.00 0.00 177.39 175.03 1k83 s VAL 150 N -2.00 4.71 0.93 4.08 1.01 0.19 -5.08 120.40 124.24 1k83 s VAL 150 Ca 0.27 -1.10 -0.12 0.00 0.00 0.00 0.00 61.98 61.03 1k83 s VAL 150 Cb 0.12 -3.77 0.15 0.00 0.00 0.00 0.00 36.38 32.89 1k83 s VAL 150 CO 0.21 -0.44 1.12 -2.16 0.00 0.00 0.00 175.10 173.83 1k83 s PRO 151 N 1.54 0.95 -0.19 2.72 0.04 -1.26 -4.74 135.00 134.06 1k83 s PRO 151 Ca 0.03 0.37 -0.29 0.00 0.04 0.00 0.00 61.00 61.15 1k83 s PRO 151 Cb -0.22 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 1k83 s PRO 151 CO 0.05 -2.34 1.42 0.15 0.04 0.00 0.00 177.00 176.32 1k83 s LYS 152 N -5.18 4.05 -0.20 4.56 1.02 -1.23 -4.95 119.74 117.82 1k83 s LYS 152 Ca 0.64 1.66 -0.08 0.00 0.02 0.00 0.00 55.97 58.21 1k83 s LYS 152 Cb -0.16 -3.89 -0.04 0.00 -0.52 0.00 0.00 37.83 33.22 1k83 s LYS 152 CO 0.55 -0.96 0.08 -1.01 -0.92 0.00 0.00 175.35 173.09 1k83 s HIS 153 N 4.17 3.23 -0.13 3.18 3.76 -1.26 -2.17 115.29 126.07 1k83 s HIS 153 Ca 0.62 0.01 0.01 0.00 -0.15 0.00 0.00 55.06 55.55 1k83 s HIS 153 Cb -0.23 -2.13 0.02 0.00 1.11 0.00 0.00 32.58 31.35 1k83 s HIS 153 CO 0.22 0.05 -0.15 0.42 -0.85 0.00 0.00 174.74 174.44 1k83 s ILE 154 N 0.67 1.56 0.20 0.60 1.01 0.02 -4.93 121.20 120.32 1k83 s ILE 154 Ca 0.04 -0.65 -0.30 0.00 0.00 0.00 0.00 60.65 59.73 1k83 s ILE 154 Cb -0.13 -1.44 -0.09 0.00 0.01 0.00 0.00 42.46 40.81 1k83 s ILE 154 CO 0.02 0.45 1.33 -0.60 0.00 0.00 0.00 174.94 176.14 1k83 s ARG 155 N 1.19 4.37 -0.07 2.79 3.52 -1.26 -0.45 118.95 129.03 1k83 s ARG 155 Ca -0.02 2.09 -0.09 0.00 -0.13 0.00 0.00 55.73 57.59 1k83 s ARG 155 Cb -0.14 -3.19 -0.04 0.00 -1.56 0.00 0.00 34.95 30.02 1k83 s ARG 155 CO -0.05 -0.29 0.22 -0.51 -0.81 0.00 0.00 175.30 173.86 1k83 s LEU 156 N -0.07 4.41 0.66 -0.88 1.43 0.44 -4.90 118.68 119.78 1k83 s LEU 156 Ca 0.58 0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 54.14 1k83 s LEU 156 Cb -0.37 -2.27 -0.00 0.00 0.03 0.00 0.00 46.19 43.57 1k83 s LEU 156 CO 0.38 0.37 1.08 -0.94 0.23 0.00 0.00 176.35 177.48 1k83 s SER 157 N -1.13 5.24 0.64 2.29 1.04 -1.26 -4.47 113.70 116.05 1k83 s SER 157 Ca 0.19 1.87 0.35 0.00 0.48 0.00 0.00 55.95 58.84 1k83 s SER 157 Cb -0.13 -2.53 1.95 0.00 0.10 0.00 0.00 66.02 65.41 1k83 s SER 157 CO 0.08 -1.54 2.15 0.77 0.98 0.00 0.00 173.24 175.68 1k83 h SER 158 N -0.14 0.00 -0.01 7.02 4.64 -1.98 0.17 113.55 123.25 1k83 h SER 158 Ca -0.46 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.84 1k83 h SER 158 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1k83 h SER 158 CO 0.55 0.00 -0.08 -0.78 -0.87 0.00 0.00 176.83 175.65 1k83 h ASP 159 N 0.00 0.10 0.29 4.97 1.82 -1.93 -2.05 116.42 119.61 1k83 h ASP 159 Ca 0.02 -0.69 -0.06 0.00 -0.39 0.00 0.00 57.03 55.92 1k83 h ASP 159 Cb 0.35 -0.03 -0.01 0.00 0.68 0.00 0.00 39.33 40.33 1k83 h ASP 159 CO -0.00 0.77 -0.28 -0.33 -1.61 0.00 0.00 179.24 177.79 1k83 h GLU 160 N -0.57 0.00 -0.23 0.28 5.08 -1.41 -2.68 114.58 115.04 1k83 h GLU 160 Ca -0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1k83 h GLU 160 Cb 0.77 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1k83 h GLU 160 CO 0.02 0.28 0.01 -0.22 -1.00 0.00 0.00 179.01 178.10 1k83 h LYS 161 N 0.00 0.41 -0.77 2.33 3.64 -0.69 -1.19 116.57 120.30 1k83 h LYS 161 Ca -0.00 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 59.23 1k83 h LYS 161 Cb 0.50 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.24 1k83 h LYS 161 CO 0.04 0.58 0.40 0.00 -2.27 0.00 0.00 179.45 178.19 1k83 h ARG 162 N 0.19 1.09 -0.44 1.90 3.08 -1.05 -0.10 114.38 119.04 1k83 h ARG 162 Ca 0.07 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 1k83 h ARG 162 Cb 0.39 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1k83 h ARG 162 CO 0.01 0.83 0.19 1.49 -1.07 0.00 0.00 179.97 181.42 1k83 h GLU 163 N 1.08 0.65 0.48 0.04 4.57 -1.40 0.68 114.58 120.68 1k83 h GLU 163 Ca 0.27 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.32 1k83 h GLU 163 Cb 0.07 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 1k83 h GLU 163 CO -0.04 0.58 -0.44 1.25 -1.18 0.00 0.00 179.01 179.18 1k83 h LEU 164 N 0.57 -1.19 -1.98 1.64 5.85 -0.61 0.40 115.31 119.99 1k83 h LEU 164 Ca 0.15 0.09 0.14 0.00 0.84 0.00 0.00 57.88 59.10 1k83 h LEU 164 Cb 0.16 0.39 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1k83 h LEU 164 CO -0.02 -0.59 0.35 -0.07 -0.34 0.00 0.00 178.44 177.77 1k83 h LEU 165 N -0.91 0.02 0.00 2.25 3.38 -0.95 -2.77 115.31 116.34 1k83 h LEU 165 Ca -0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1k83 h LEU 165 Cb 0.78 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1k83 h LEU 165 CO -0.03 0.01 -0.03 0.50 0.09 0.00 0.00 178.44 178.97 1k83 h LYS 166 N 0.02 0.02 -0.27 1.13 3.64 0.03 -0.36 116.57 120.78 1k83 h LYS 166 Ca 0.24 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.50 1k83 h LYS 166 Cb 0.91 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.73 1k83 h LYS 166 CO -0.01 0.91 -0.21 0.00 -2.27 0.00 0.00 179.45 177.86 1k83 h ARG 167 N -0.86 0.50 -0.00 1.90 2.47 -0.82 -1.65 114.38 115.91 1k83 h ARG 167 Ca -0.01 -0.17 0.00 0.00 -1.26 0.00 0.00 59.98 58.54 1k83 h ARG 167 Cb 0.92 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.20 1k83 h ARG 167 CO 0.01 0.68 -0.33 0.66 0.56 0.00 0.00 179.97 181.55 1k83 n TYR 168 N -4.14 0.00 -3.38 3.04 4.02 -1.06 -4.98 117.16 110.67 1k83 n TYR 168 Ca -0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.77 1k83 n TYR 168 Cb 0.38 -0.18 0.01 0.00 -0.02 0.00 0.00 39.34 39.53 1k83 n TYR 168 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1k83 n ARG 169 N -0.99 -1.41 -4.36 -0.72 1.74 -0.62 -5.01 116.66 105.28 1k83 n ARG 169 Ca 0.10 1.12 -0.22 0.00 -0.77 0.00 0.00 57.85 58.08 1k83 n ARG 169 Cb 0.34 -4.42 -0.11 0.00 -1.02 0.00 0.00 32.46 27.26 1k83 n ARG 169 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1k83 s LEU 170 N -4.62 2.49 0.36 0.55 1.43 -0.23 -5.03 118.68 113.63 1k83 s LEU 170 Ca 0.06 -0.93 -0.05 0.00 -1.03 0.00 0.00 54.13 52.18 1k83 s LEU 170 Cb -0.02 -0.85 -0.05 0.00 0.03 0.00 0.00 46.19 45.30 1k83 s LEU 170 CO 0.81 -0.05 0.65 -0.54 0.23 0.00 0.00 176.35 177.45 1k83 s LYS 171 N -3.13 3.63 0.52 1.70 1.02 -1.26 -4.83 119.74 117.39 1k83 s LYS 171 Ca 0.20 0.10 0.21 0.00 0.02 0.00 0.00 55.97 56.50 1k83 s LYS 171 Cb -0.04 -2.54 1.32 0.00 -0.52 0.00 0.00 37.83 36.05 1k83 s LYS 171 CO 0.08 0.07 2.06 0.93 -0.92 0.00 0.00 175.35 177.57 1k83 h GLU 172 N 1.17 0.03 0.00 1.68 5.08 -1.99 -1.78 114.58 118.77 1k83 h GLU 172 Ca -0.48 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1k83 h GLU 172 Cb 1.20 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1k83 h GLU 172 CO 0.64 0.02 0.00 0.66 -1.00 0.00 0.00 179.01 179.33 1k83 h SER 173 N 0.03 0.00 -0.19 1.42 4.64 -2.01 -3.02 113.55 114.42 1k83 h SER 173 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1k83 h SER 173 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1k83 h SER 173 CO -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.95 1k83 n GLN 174 N -2.64 1.67 -3.46 4.77 6.02 -0.67 -4.88 117.38 118.19 1k83 n GLN 174 Ca 0.02 -1.02 -0.29 0.00 -0.01 0.00 0.00 57.00 55.71 1k83 n GLN 174 Cb 0.31 -1.35 -0.04 0.00 1.02 0.00 0.00 30.24 30.19 1k83 n GLN 174 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1k83 s LEU 175 N -1.42 4.13 0.56 1.08 1.43 -1.14 -4.97 118.68 118.35 1k83 s LEU 175 Ca 0.29 0.66 -0.20 0.00 -1.03 0.00 0.00 54.13 53.85 1k83 s LEU 175 Cb 0.15 -3.45 -0.04 0.00 0.03 0.00 0.00 46.19 42.88 1k83 s LEU 175 CO 0.23 -0.12 1.24 -2.84 0.23 0.00 0.00 176.35 175.08 1k83 s PRO 176 N -3.32 3.11 0.30 1.29 0.02 -1.24 -4.81 135.00 130.35 1k83 s PRO 176 Ca 0.43 1.92 0.08 0.00 0.02 0.00 0.00 61.00 63.44 1k83 s PRO 176 Cb -0.11 -2.07 -0.03 0.00 0.02 0.00 0.00 34.50 32.31 1k83 s PRO 176 CO 0.28 -1.12 0.22 1.03 -0.33 0.00 0.00 177.00 177.09 1k83 s ARG 177 N -3.14 2.74 -0.07 5.54 0.52 -1.26 -1.27 118.95 122.00 1k83 s ARG 177 Ca 0.74 -1.24 -0.03 0.00 -0.52 0.00 0.00 55.73 54.69 1k83 s ARG 177 Cb -0.33 -2.46 0.04 0.00 0.52 0.00 0.00 34.95 32.73 1k83 s ARG 177 CO 0.37 0.23 0.14 -1.50 0.02 0.00 0.00 175.30 174.55 1k83 s ILE 178 N -2.25 -0.18 0.69 1.52 2.07 -0.76 -4.75 121.20 117.53 1k83 s ILE 178 Ca 0.37 0.31 -0.17 0.00 -1.41 0.00 0.00 60.65 59.75 1k83 s ILE 178 Cb -0.06 -0.26 -0.00 0.00 0.13 0.00 0.00 42.46 42.26 1k83 s ILE 178 CO 0.25 0.13 1.02 0.00 -1.91 0.00 0.00 174.94 174.43 1k83 n GLN 179 N 4.97 0.67 0.07 3.50 1.13 -1.26 -1.02 117.38 125.44 1k83 n GLN 179 Ca -0.11 0.28 -0.02 0.00 -1.94 0.00 0.00 57.00 55.21 1k83 n GLN 179 Cb 0.50 -2.27 0.25 0.00 0.11 0.00 0.00 30.24 28.83 1k83 n GLN 179 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 1k83 h ARG 180 N -0.01 0.34 -0.55 -1.09 2.43 -1.92 -2.71 114.38 110.88 1k83 h ARG 180 Ca -0.48 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 58.56 1k83 h ARG 180 Cb 1.34 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 1k83 h ARG 180 CO 0.49 0.60 0.00 0.00 -1.51 0.00 0.00 179.97 179.55 1k83 n ALA 181 N -2.48 2.72 -2.00 2.80 0.00 -1.26 -4.12 120.51 116.18 1k83 n ALA 181 Ca -0.01 -0.91 -0.42 0.00 0.00 0.00 0.00 53.44 52.10 1k83 n ALA 181 Cb 0.41 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 1k83 n ALA 181 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1k83 s ASP 182 N -0.83 6.68 0.38 0.00 -1.08 -1.02 -4.77 116.67 116.02 1k83 s ASP 182 Ca 0.31 2.53 0.23 0.00 -0.52 0.00 0.00 52.55 55.10 1k83 s ASP 182 Cb 0.19 -2.60 1.36 0.00 -1.46 0.00 0.00 42.92 40.41 1k83 s ASP 182 CO 0.17 -0.75 1.59 -0.65 0.52 0.00 0.00 175.17 176.05 1k83 h PRO 183 N 6.51 0.03 0.09 4.34 0.11 -1.91 0.59 132.00 141.75 1k83 h PRO 183 Ca -0.43 -0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.41 1k83 h PRO 183 Cb 1.21 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.32 1k83 h PRO 183 CO 0.88 0.02 -1.15 0.28 -0.21 0.00 0.00 178.00 177.81 1k83 h VAL 184 N 0.03 1.39 -0.46 3.15 2.07 -1.96 -1.25 116.25 119.23 1k83 h VAL 184 Ca 0.85 -2.66 -0.01 0.00 0.82 0.00 0.00 66.70 65.70 1k83 h VAL 184 Cb 2.33 2.70 -0.02 0.00 -1.52 0.00 0.00 31.29 34.77 1k83 h VAL 184 CO -0.69 0.79 0.26 0.00 0.02 0.00 0.00 177.57 177.95 1k83 h ALA 185 N 0.54 0.58 -0.77 1.67 0.00 -0.25 0.50 119.26 121.53 1k83 h ALA 185 Ca -0.14 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.71 1k83 h ALA 185 Cb 1.83 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 19.40 1k83 h ALA 185 CO 0.20 0.10 0.51 -0.07 0.00 0.00 0.00 179.25 179.99 1k83 h LEU 186 N 0.60 0.87 -0.07 0.00 3.38 -0.77 0.39 115.31 119.72 1k83 h LEU 186 Ca 0.16 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1k83 h LEU 186 Cb 0.04 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 1k83 h LEU 186 CO -0.03 0.62 0.02 0.22 0.09 0.00 0.00 178.44 179.37 1k83 h TYR 187 N 1.02 0.10 -0.00 1.13 3.20 -0.09 -2.88 116.97 119.45 1k83 h TYR 187 Ca 0.29 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.15 1k83 h TYR 187 Cb -0.08 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.16 1k83 h TYR 187 CO -0.00 0.26 -0.01 1.28 -1.64 0.00 0.00 178.16 178.04 1k83 n LEU 188 N -4.93 0.04 -1.06 2.82 4.77 0.06 -4.92 117.00 113.77 1k83 n LEU 188 Ca -0.06 0.30 -0.09 0.00 -0.03 0.00 0.00 56.01 56.12 1k83 n LEU 188 Cb 0.12 -0.31 -0.00 0.00 -2.33 0.00 0.00 43.42 40.90 1k83 n LEU 188 CO 0.34 0.01 -0.10 0.61 -1.33 0.00 0.00 177.39 176.92 1k83 n GLY 189 N 1.32 0.02 3.74 -0.72 0.00 0.12 -4.96 105.19 104.72 1k83 n GLY 189 Ca 0.13 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.26 1k83 n GLY 189 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k83 n LEU 190 N -1.35 5.44 -4.29 0.99 4.77 -0.32 -5.02 117.00 117.23 1k83 n LEU 190 Ca -0.10 0.98 -0.29 0.00 -0.03 0.00 0.00 56.01 56.57 1k83 n LEU 190 Cb 0.58 -1.57 -0.15 0.00 -2.33 0.00 0.00 43.42 39.95 1k83 n LEU 190 CO 0.13 -0.63 -0.55 -0.54 -1.33 0.00 0.00 177.39 174.48 1k83 s LYS 191 N -2.86 1.76 -0.37 3.23 1.02 -1.26 -4.89 119.74 116.36 1k83 s LYS 191 Ca 0.72 -0.94 -0.44 0.00 0.02 0.00 0.00 55.97 55.33 1k83 s LYS 191 Cb -0.42 -1.80 -0.19 0.00 -0.52 0.00 0.00 37.83 34.90 1k83 s LYS 191 CO 0.49 0.48 1.59 -2.13 -0.92 0.00 0.00 175.35 174.86 1k83 n ARG 192 N 2.15 0.38 0.00 1.68 0.63 -1.26 -1.25 116.66 118.98 1k83 n ARG 192 Ca -0.16 0.14 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 1k83 n ARG 192 Cb 0.52 -1.70 0.00 0.00 0.45 0.00 0.00 32.46 31.73 1k83 n ARG 192 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1k83 n GLY 193 N 3.80 1.46 3.76 5.14 0.00 -0.55 -5.00 105.19 113.80 1k83 n GLY 193 Ca 0.28 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.97 1k83 n GLY 193 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k83 s GLU 194 N -0.01 2.72 -0.02 1.61 2.02 -0.38 -4.69 118.70 119.96 1k83 s GLU 194 Ca 0.00 1.47 0.08 0.00 0.02 0.00 0.00 54.97 56.54 1k83 s GLU 194 Cb 0.00 -1.93 -0.02 0.00 0.10 0.00 0.00 34.13 32.28 1k83 s GLU 194 CO 0.00 -1.32 -0.26 0.08 0.02 0.00 0.00 175.26 173.78 1k83 s VAL 195 N -2.24 2.08 -0.02 2.63 1.01 -1.26 -0.89 120.40 121.72 1k83 s VAL 195 Ca 0.69 -1.10 0.04 0.00 0.00 0.00 0.00 61.98 61.61 1k83 s VAL 195 Cb -0.22 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 1k83 s VAL 195 CO 0.41 0.58 -0.11 0.68 0.00 0.00 0.00 175.10 176.66 1k83 s VAL 196 N -0.61 3.29 -0.20 2.92 -7.23 -0.07 -0.42 120.40 118.08 1k83 s VAL 196 Ca 0.10 -0.80 -0.10 0.00 -1.81 0.00 0.00 61.98 59.37 1k83 s VAL 196 Cb -0.10 -2.37 -0.05 0.00 0.56 0.00 0.00 36.38 34.42 1k83 s VAL 196 CO -0.01 0.47 0.15 -0.75 -0.31 0.00 0.00 175.10 174.66 1k83 s LYS 197 N -1.12 4.17 -0.23 4.82 2.20 0.40 -2.08 119.74 127.91 1k83 s LYS 197 Ca 0.14 -0.20 -0.03 0.00 -0.36 0.00 0.00 55.97 55.52 1k83 s LYS 197 Cb -0.11 -3.44 0.01 0.00 -1.51 0.00 0.00 37.83 32.78 1k83 s LYS 197 CO 0.04 0.25 -0.05 0.42 -0.36 0.00 0.00 175.35 175.65 1k83 s ILE 198 N 0.50 3.16 -0.35 5.43 1.01 0.31 -0.80 121.20 130.46 1k83 s ILE 198 Ca 0.09 -0.72 -0.09 0.00 0.00 0.00 0.00 60.65 59.93 1k83 s ILE 198 Cb -0.12 -2.50 0.02 0.00 0.01 0.00 0.00 42.46 39.88 1k83 s ILE 198 CO -0.00 0.33 0.17 -0.63 0.00 0.00 0.00 174.94 174.80 1k83 s ILE 199 N 1.42 4.34 0.17 2.92 1.01 -0.92 -1.08 121.20 129.05 1k83 s ILE 199 Ca 0.04 -0.86 0.10 0.00 0.00 0.00 0.00 60.65 59.93 1k83 s ILE 199 Cb -0.15 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 1k83 s ILE 199 CO -0.04 -0.16 -0.22 0.00 0.00 0.00 0.00 174.94 174.52 1k83 s ARG 200 N 1.52 1.37 0.60 2.79 1.70 -0.69 -3.53 118.95 122.70 1k83 s ARG 200 Ca 0.02 -1.42 -0.17 0.00 -0.47 0.00 0.00 55.73 53.68 1k83 s ARG 200 Cb -0.19 -1.60 -0.03 0.00 -0.57 0.00 0.00 34.95 32.56 1k83 s ARG 200 CO 0.05 0.35 1.12 0.15 -1.08 0.00 0.00 175.30 175.89 1k83 s LYS 201 N -2.57 3.10 -0.05 3.89 -0.14 -1.26 -1.56 119.74 121.16 1k83 s LYS 201 Ca 0.16 1.50 -0.02 0.00 -1.36 0.00 0.00 55.97 56.26 1k83 s LYS 201 Cb -0.08 -1.98 0.03 0.00 -1.68 0.00 0.00 37.83 34.13 1k83 s LYS 201 CO 0.08 -1.03 0.10 0.45 -0.76 0.00 0.00 175.35 174.19 1k83 s SER 202 N -2.16 -0.05 0.00 2.83 0.15 -0.63 -4.81 113.70 109.02 1k83 s SER 202 Ca 0.70 0.20 0.18 0.00 0.70 0.00 0.00 55.95 57.73 1k83 s SER 202 Cb -0.22 0.10 0.84 0.00 -1.71 0.00 0.00 66.02 65.02 1k83 s SER 202 CO 0.34 -0.14 1.54 -1.84 1.20 0.00 0.00 173.24 174.34 1k83 n GLU 203 N 4.15 0.16 -0.02 5.44 0.28 -1.26 -3.65 120.64 125.75 1k83 n GLU 203 Ca -0.26 0.15 -0.02 0.00 -0.16 0.00 0.00 57.16 56.87 1k83 n GLU 203 Cb 0.51 -1.50 -0.01 0.00 1.43 0.00 0.00 31.44 31.88 1k83 n GLU 203 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1k83 n THR 204 N -1.36 0.37 -3.24 3.84 -1.04 -1.26 -5.01 114.28 106.57 1k83 n THR 204 Ca 0.07 0.42 -0.10 0.00 -2.04 0.00 0.00 64.05 62.40 1k83 n THR 204 Cb 0.16 -1.72 0.02 0.00 -1.82 0.00 0.00 70.33 66.97 1k83 n THR 204 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1k83 n SER 205 N -2.90 1.27 0.06 8.00 3.41 -1.24 -5.06 113.62 117.15 1k83 n SER 205 Ca -0.02 -1.77 -0.03 0.00 -0.26 0.00 0.00 58.87 56.78 1k83 n SER 205 Cb 0.09 -0.14 -0.01 0.00 -0.26 0.00 0.00 64.21 63.89 1k83 n SER 205 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1k83 h GLY 206 N 0.13 -0.20 -2.43 5.00 0.00 -1.96 -3.35 103.07 100.27 1k83 h GLY 206 Ca -0.14 0.07 -0.54 0.00 0.00 0.00 0.00 47.33 46.72 1k83 h GLY 206 CO 0.21 -0.07 -0.75 0.50 0.00 0.00 0.00 176.54 176.42 1k83 s ARG 207 N -2.16 1.52 -0.13 4.80 0.52 -1.26 -1.61 118.95 120.63 1k83 s ARG 207 Ca -0.03 -1.67 -0.06 0.00 -0.52 0.00 0.00 55.73 53.45 1k83 s ARG 207 Cb 0.00 -1.49 0.05 0.00 0.52 0.00 0.00 34.95 34.03 1k83 s ARG 207 CO 0.08 0.27 0.29 -0.47 0.02 0.00 0.00 175.30 175.50 1k83 s TYR 208 N -2.65 -0.42 -0.16 -0.53 5.04 -0.60 -4.87 117.35 113.16 1k83 s TYR 208 Ca 0.26 0.95 -0.05 0.00 -2.44 0.00 0.00 57.07 55.79 1k83 s TYR 208 Cb -0.03 0.10 -0.03 0.00 0.35 0.00 0.00 41.96 42.34 1k83 s TYR 208 CO 0.11 -0.28 0.00 0.00 -1.34 0.00 0.00 175.55 174.04 1k83 s ALA 209 N 1.47 3.18 0.43 3.97 0.00 -1.26 -1.70 121.76 127.85 1k83 s ALA 209 Ca -0.08 -0.79 0.05 0.00 0.00 0.00 0.00 51.96 51.14 1k83 s ALA 209 Cb -0.10 -1.70 -0.05 0.00 0.00 0.00 0.00 23.12 21.26 1k83 s ALA 209 CO -0.10 0.22 0.02 0.45 0.00 0.00 0.00 175.76 176.36 1k83 s SER 210 N 0.30 3.68 0.02 0.00 0.15 -0.24 -4.94 113.70 112.66 1k83 s SER 210 Ca -0.01 -1.47 0.01 0.00 0.70 0.00 0.00 55.95 55.18 1k83 s SER 210 Cb -0.13 -0.03 -0.01 0.00 -1.71 0.00 0.00 66.02 64.13 1k83 s SER 210 CO 0.02 -0.62 -0.04 -0.31 1.20 0.00 0.00 173.24 173.49 1k83 s TYR 211 N -2.87 0.31 -0.02 3.44 1.51 -1.26 -0.53 117.35 117.93 1k83 s TYR 211 Ca 0.26 -0.36 0.00 0.00 -1.01 0.00 0.00 57.07 55.96 1k83 s TYR 211 Cb 0.07 -0.20 0.02 0.00 -0.11 0.00 0.00 41.96 41.74 1k83 s TYR 211 CO 0.13 -0.11 -0.00 1.03 -1.11 0.00 0.00 175.55 175.49 1k83 s ARG 212 N -1.03 0.23 -0.13 -0.62 0.52 -0.88 -3.67 118.95 113.37 1k83 s ARG 212 Ca -0.09 0.04 -0.07 0.00 -0.52 0.00 0.00 55.73 55.09 1k83 s ARG 212 Cb -0.07 -0.37 -0.04 0.00 0.52 0.00 0.00 34.95 34.99 1k83 s ARG 212 CO -0.00 -0.09 0.11 -1.50 0.02 0.00 0.00 175.30 173.84 1k83 s ILE 213 N 0.71 5.27 -0.01 1.52 2.07 -0.40 -0.90 121.20 129.47 1k83 s ILE 213 Ca -0.07 0.12 -0.30 0.00 -1.41 0.00 0.00 60.65 58.99 1k83 s ILE 213 Cb -0.10 -3.30 -0.06 0.00 0.13 0.00 0.00 42.46 39.13 1k83 s ILE 213 CO -0.01 0.58 1.44 0.00 -1.91 0.00 0.00 174.94 175.04