#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k83 s ILE 2 N 0.00 1.04 -0.41 2.02 1.01 -1.26 -1.92 121.20 121.67 1k83 s ILE 2 Ca 0.00 -1.94 -0.44 0.00 0.00 0.00 0.00 60.65 58.27 1k83 s ILE 2 Cb 0.00 -1.70 -0.18 0.00 0.01 0.00 0.00 42.46 40.59 1k83 s ILE 2 CO 0.00 -0.72 1.72 0.52 0.00 0.00 0.00 174.94 176.46 1k83 n VAL 3 N 0.01 0.12 -1.72 2.92 0.31 -1.26 -4.83 118.33 113.88 1k83 n VAL 3 Ca -0.12 -0.03 -0.38 0.00 -0.01 0.00 0.00 64.34 63.81 1k83 n VAL 3 Cb 0.60 -0.81 0.06 0.00 -0.91 0.00 0.00 33.84 32.78 1k83 n VAL 3 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1k83 n PRO 4 N 4.94 1.29 -0.15 5.55 -0.02 -1.26 -4.71 135.00 140.63 1k83 n PRO 4 Ca 0.32 0.49 -0.08 0.00 -2.02 0.00 0.00 63.50 62.20 1k83 n PRO 4 Cb 0.02 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 30.99 1k83 n PRO 4 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1k83 h VAL 5 N 0.82 1.17 -3.67 -1.45 2.07 -1.91 -2.61 116.25 110.67 1k83 h VAL 5 Ca -0.51 -0.46 -0.28 0.00 0.82 0.00 0.00 66.70 66.28 1k83 h VAL 5 Cb 1.33 0.66 -0.15 0.00 -1.52 0.00 0.00 31.29 31.61 1k83 h VAL 5 CO 0.54 0.18 -0.69 -0.13 0.02 0.00 0.00 177.57 177.50 1k83 s ARG 6 N -5.79 1.00 -0.06 1.57 0.52 -1.26 -0.76 118.95 114.17 1k83 s ARG 6 Ca -0.13 -1.44 -0.30 0.00 -0.52 0.00 0.00 55.73 53.34 1k83 s ARG 6 Cb 0.11 -0.35 -0.05 0.00 0.52 0.00 0.00 34.95 35.18 1k83 s ARG 6 CO 0.75 -0.04 1.54 0.00 0.02 0.00 0.00 175.30 177.58 1k83 h PHE 8 N 8.95 -0.78 -0.28 0.00 0.05 -1.92 -1.05 116.94 121.91 1k83 h PHE 8 Ca -0.37 0.07 -0.04 0.00 3.82 0.00 0.00 57.97 61.46 1k83 h PHE 8 Cb 1.17 0.44 -0.01 0.00 2.00 0.00 0.00 35.95 39.55 1k83 h PHE 8 CO 0.84 -0.37 0.03 0.77 -0.18 0.00 0.00 178.31 179.41 1k83 h SER 9 N -0.10 0.46 0.00 2.17 0.02 -1.91 -3.40 113.55 110.80 1k83 h SER 9 Ca 0.28 -0.27 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 1k83 h SER 9 Cb 0.55 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 1k83 h SER 9 CO -0.73 0.62 -1.21 0.00 -1.14 0.00 0.00 176.83 174.37 1k83 n GLY 11 N 2.48 2.53 2.83 0.00 0.00 -0.41 -5.00 105.19 107.62 1k83 n GLY 11 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 1k83 n GLY 11 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1k83 n LYS 12 N -0.84 0.00 -2.65 1.61 0.00 -1.26 -4.36 118.16 110.65 1k83 n LYS 12 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 58.31 57.89 1k83 n LYS 12 Cb 0.00 -0.97 -0.03 0.00 0.00 0.00 0.00 35.03 34.03 1k83 n LYS 12 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1k83 s VAL 13 N -0.53 4.71 0.00 3.15 1.01 -1.26 -1.62 120.40 125.85 1k83 s VAL 13 Ca 0.61 1.96 0.00 0.00 0.00 0.00 0.00 61.98 64.55 1k83 s VAL 13 Cb -0.86 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 31.26 1k83 s VAL 13 CO 0.46 0.09 0.00 0.52 0.00 0.00 0.00 175.10 176.17 1k83 n VAL 14 N 4.18 0.00 0.82 2.92 0.31 -0.01 -4.75 118.33 121.81 1k83 n VAL 14 Ca 0.08 -0.21 0.03 0.00 -0.01 0.00 0.00 64.34 64.22 1k83 n VAL 14 Cb 0.49 0.81 0.19 0.00 -0.91 0.00 0.00 33.84 34.43 1k83 n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1k83 n GLY 15 N 0.80 -0.41 0.20 2.92 0.00 0.06 -2.00 105.19 106.77 1k83 n GLY 15 Ca 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 46.02 46.00 1k83 n GLY 15 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1k83 n ASP 16 N -0.74 2.24 -0.11 1.61 5.75 -1.26 -4.68 116.55 119.37 1k83 n ASP 16 Ca 0.05 -1.95 0.01 0.00 -0.01 0.00 0.00 54.79 52.88 1k83 n ASP 16 Cb 0.02 -0.07 0.02 0.00 -1.03 0.00 0.00 41.12 40.06 1k83 n ASP 16 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1k83 n LYS 17 N -0.15 1.88 -0.06 0.11 5.02 -0.85 -4.75 118.16 119.36 1k83 n LYS 17 Ca 0.04 -1.31 -0.15 0.00 -2.02 0.00 0.00 58.31 54.87 1k83 n LYS 17 Cb 0.29 -1.05 -0.06 0.00 -0.02 0.00 0.00 35.03 34.20 1k83 n LYS 17 CO 0.00 0.00 0.00 2.35 -0.52 0.00 0.00 177.40 179.23 1k83 h TRP 18 N 0.38 0.85 -0.18 2.13 2.91 -1.84 -0.87 115.95 119.34 1k83 h TRP 18 Ca 0.00 -0.31 -0.09 0.00 1.13 0.00 0.00 58.89 59.63 1k83 h TRP 18 Cb 0.41 -0.16 -0.00 0.00 -0.51 0.00 0.00 29.16 28.90 1k83 h TRP 18 CO 0.03 1.08 -0.23 0.93 -1.03 0.00 0.00 178.44 179.22 1k83 h GLU 19 N 0.38 0.47 0.34 2.65 5.08 -1.95 -1.08 114.58 120.47 1k83 h GLU 19 Ca 0.01 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1k83 h GLU 19 Cb 1.03 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.27 1k83 h GLU 19 CO 0.10 0.85 -0.45 0.77 -1.00 0.00 0.00 179.01 179.27 1k83 h SER 20 N 0.12 -1.28 -0.88 1.42 0.02 -1.85 0.66 113.55 111.75 1k83 h SER 20 Ca 0.02 0.11 0.22 0.00 -0.84 0.00 0.00 61.79 61.30 1k83 h SER 20 Cb 0.79 0.44 -0.13 0.00 0.14 0.00 0.00 62.40 63.64 1k83 h SER 20 CO 0.05 -0.56 0.36 0.22 -1.14 0.00 0.00 176.83 175.77 1k83 h TYR 21 N -0.82 0.59 -0.58 3.45 3.20 -1.17 0.51 116.97 122.15 1k83 h TYR 21 Ca -0.04 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1k83 h TYR 21 Cb 0.74 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.86 1k83 h TYR 21 CO -0.30 -0.07 0.23 1.25 -1.64 0.00 0.00 178.16 177.63 1k83 h LEU 22 N 0.37 0.80 -0.22 2.82 5.85 -0.28 -2.90 115.31 121.75 1k83 h LEU 22 Ca 0.55 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 59.03 1k83 h LEU 22 Cb 1.05 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 1k83 h LEU 22 CO -0.54 0.76 -0.12 0.78 -0.34 0.00 0.00 178.44 178.98 1k83 h ASN 23 N 0.80 0.48 0.00 1.25 2.35 0.16 -2.49 115.58 118.13 1k83 h ASN 23 Ca 0.19 -0.42 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 1k83 h ASN 23 Cb 0.21 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1k83 h ASN 23 CO -0.01 0.79 0.28 0.18 -1.65 0.00 0.00 177.43 177.02 1k83 n LEU 24 N -4.52 0.13 -0.09 1.61 4.77 0.15 -2.15 117.00 116.90 1k83 n LEU 24 Ca -0.05 0.38 -0.10 0.00 -0.03 0.00 0.00 56.01 56.21 1k83 n LEU 24 Cb 0.34 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 1k83 n LEU 24 CO 0.40 -0.42 -0.69 0.18 -1.33 0.00 0.00 177.39 175.53 1k83 n LEU 25 N -1.59 1.89 0.05 2.23 4.77 -0.97 -2.27 117.00 121.12 1k83 n LEU 25 Ca -0.00 0.32 -0.02 0.00 -0.03 0.00 0.00 56.01 56.27 1k83 n LEU 25 Cb 0.29 -0.72 -0.01 0.00 -2.33 0.00 0.00 43.42 40.65 1k83 n LEU 25 CO 0.02 -0.24 0.40 -0.61 -1.33 0.00 0.00 177.39 175.63 1k83 h GLN 26 N -0.94 -0.13 0.00 3.23 4.15 -1.09 0.17 115.11 120.49 1k83 h GLN 26 Ca -0.04 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1k83 h GLN 26 Cb 0.99 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.71 1k83 h GLN 26 CO -0.03 -0.09 0.00 0.93 -1.93 0.00 0.00 178.83 177.71 1k83 h GLU 27 N -0.17 0.00 -0.00 1.69 5.08 -1.70 -3.11 114.58 116.37 1k83 h GLU 27 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1k83 h GLU 27 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1k83 h GLU 27 CO 0.02 0.00 -0.12 -0.25 -1.00 0.00 0.00 179.01 177.66 1k83 n ASP 28 N -2.75 0.97 -4.21 1.42 9.92 -1.17 -5.01 116.55 115.71 1k83 n ASP 28 Ca 0.01 -0.98 -0.32 0.00 -0.53 0.00 0.00 54.79 52.97 1k83 n ASP 28 Cb 0.28 0.45 -0.05 0.00 -0.64 0.00 0.00 41.12 41.16 1k83 n ASP 28 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1k83 n GLU 29 N -0.31 -2.26 -2.62 -1.24 1.02 0.05 -4.94 120.64 110.34 1k83 n GLU 29 Ca 0.03 0.27 -0.23 0.00 -0.02 0.00 0.00 57.16 57.20 1k83 n GLU 29 Cb 0.13 -4.44 0.11 0.00 -0.02 0.00 0.00 31.44 27.21 1k83 n GLU 29 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1k83 s LEU 30 N -7.20 2.97 0.10 -4.62 1.43 -0.96 -5.02 118.68 105.37 1k83 s LEU 30 Ca 0.31 -0.43 0.04 0.00 -1.03 0.00 0.00 54.13 53.02 1k83 s LEU 30 Cb -0.17 -1.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1k83 s LEU 30 CO 0.95 -1.88 0.05 1.51 0.23 0.00 0.00 176.35 177.21 1k83 s ASP 31 N -4.75 5.29 0.38 2.29 -4.77 -1.26 -4.67 116.67 109.18 1k83 s ASP 31 Ca 0.67 -0.10 0.15 0.00 -3.30 0.00 0.00 52.55 49.96 1k83 s ASP 31 Cb -0.05 -1.34 1.01 0.00 -1.09 0.00 0.00 42.92 41.44 1k83 s ASP 31 CO 0.44 0.16 1.80 -0.33 0.70 0.00 0.00 175.17 177.94 1k83 h GLU 32 N 3.25 0.48 -0.10 2.11 3.07 -1.97 0.87 114.58 122.29 1k83 h GLU 32 Ca -0.47 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.34 1k83 h GLU 32 Cb 1.17 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.97 1k83 h GLU 32 CO 0.63 0.32 0.01 0.78 -1.40 0.00 0.00 179.01 179.34 1k83 h GLY 33 N 0.49 0.19 1.11 -3.84 0.00 -1.99 -0.26 103.07 98.78 1k83 h GLY 33 Ca 0.55 -0.14 -0.19 0.00 0.00 0.00 0.00 47.33 47.55 1k83 h GLY 33 CO -0.28 0.13 -0.61 -0.84 0.00 0.00 0.00 176.54 174.94 1k83 h THR 34 N -0.08 1.29 -0.61 4.70 2.02 -1.76 -2.80 112.91 115.66 1k83 h THR 34 Ca 0.03 -1.81 0.08 0.00 0.77 0.00 0.00 66.41 65.48 1k83 h THR 34 Cb 0.33 1.82 -0.06 0.00 -1.74 0.00 0.00 68.15 68.50 1k83 h THR 34 CO 0.00 0.58 0.28 0.00 0.37 0.00 0.00 175.52 176.76 1k83 h ALA 35 N 0.61 0.81 -0.40 6.16 0.00 0.79 -1.59 119.26 125.63 1k83 h ALA 35 Ca -0.01 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1k83 h ALA 35 Cb 1.23 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1k83 h ALA 35 CO 0.13 -0.10 -0.01 -0.07 0.00 0.00 0.00 179.25 179.20 1k83 h LEU 36 N 0.51 0.70 -1.24 0.00 3.38 -0.99 -2.83 115.31 114.85 1k83 h LEU 36 Ca 0.29 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1k83 h LEU 36 Cb 0.29 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1k83 h LEU 36 CO -0.24 0.85 -0.12 0.28 0.09 0.00 0.00 178.44 179.29 1k83 h SER 37 N 0.54 0.36 0.65 -0.43 0.02 -1.22 -1.37 113.55 112.09 1k83 h SER 37 Ca 0.11 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1k83 h SER 37 Cb 0.50 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1k83 h SER 37 CO 0.02 0.51 0.00 0.54 -1.14 0.00 0.00 176.83 176.77 1k83 n ARG 38 N -4.23 0.04 -0.04 3.45 1.74 -0.62 -1.36 116.66 115.63 1k83 n ARG 38 Ca 0.00 0.15 0.12 0.00 -0.77 0.00 0.00 57.85 57.35 1k83 n ARG 38 Cb 0.30 -1.50 0.21 0.00 -1.02 0.00 0.00 32.46 30.44 1k83 n ARG 38 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1k83 n LEU 39 N -1.47 2.75 0.00 0.55 4.77 -0.58 -4.94 117.00 118.08 1k83 n LEU 39 Ca 0.05 -0.98 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 1k83 n LEU 39 Cb 0.22 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1k83 n LEU 39 CO 0.18 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 1k83 n GLY 40 N 1.34 0.74 3.54 -0.72 0.00 -0.47 -4.99 105.19 104.63 1k83 n GLY 40 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1k83 n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k83 s LEU 41 N 0.00 4.13 -0.06 0.99 1.43 -0.82 -4.79 118.68 119.57 1k83 s LEU 41 Ca 0.00 -2.33 -0.14 0.00 -1.03 0.00 0.00 54.13 50.62 1k83 s LEU 41 Cb 0.00 -2.52 -0.30 0.00 0.03 0.00 0.00 46.19 43.39 1k83 s LEU 41 CO 0.00 -1.14 0.69 0.07 0.23 0.00 0.00 176.35 176.20 1k83 h LYS 42 N 8.04 0.35 -6.15 1.70 2.10 -1.88 -3.38 116.57 117.35 1k83 h LYS 42 Ca 0.35 -0.60 -0.56 0.00 -2.00 0.00 0.00 60.65 57.83 1k83 h LYS 42 Cb 0.91 0.22 -0.05 0.00 -0.90 0.00 0.00 32.23 32.42 1k83 h LYS 42 CO 1.38 1.29 0.03 -0.98 -2.00 0.00 0.00 179.45 179.17 1k83 s ARG 43 N -2.53 4.36 0.47 0.07 1.70 -1.26 -4.96 118.95 116.81 1k83 s ARG 43 Ca -0.16 0.83 0.19 0.00 -0.47 0.00 0.00 55.73 56.11 1k83 s ARG 43 Cb 0.04 -3.34 1.03 0.00 -0.57 0.00 0.00 34.95 32.11 1k83 s ARG 43 CO 0.83 0.36 1.52 0.10 -1.08 0.00 0.00 175.30 177.03 1k83 h TYR 44 N 5.57 0.00 -0.22 5.89 -0.00 -1.99 -1.41 116.97 124.80 1k83 h TYR 44 Ca -0.45 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 58.19 1k83 h TYR 44 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.93 1k83 h TYR 44 CO 0.66 0.00 -0.22 0.00 -0.00 0.00 0.00 178.16 178.60 1k83 h ARG 47 N 0.00 -0.97 -0.81 0.00 3.08 -1.40 -2.67 114.38 111.61 1k83 h ARG 47 Ca -0.01 0.07 0.22 0.00 0.07 0.00 0.00 59.98 60.33 1k83 h ARG 47 Cb 1.16 0.22 -0.04 0.00 0.08 0.00 0.00 29.97 31.39 1k83 h ARG 47 CO 0.08 -0.64 0.57 0.07 -1.07 0.00 0.00 179.97 178.99 1k83 h ARG 48 N -1.06 0.08 -0.64 0.04 -0.00 -1.47 -0.68 114.38 110.65 1k83 h ARG 48 Ca -0.10 -0.00 0.08 0.00 -0.00 0.00 0.00 59.98 59.95 1k83 h ARG 48 Cb 0.78 -0.02 -0.07 0.00 -0.00 0.00 0.00 29.97 30.67 1k83 h ARG 48 CO 0.17 0.05 0.30 1.98 -0.00 0.00 0.00 179.97 182.47 1k83 h MET 49 N 0.08 0.52 0.00 0.08 4.05 -1.41 -1.41 114.93 116.84 1k83 h MET 49 Ca 0.39 -0.03 -0.21 0.00 -0.28 0.00 0.00 59.70 59.57 1k83 h MET 49 Cb 1.44 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 32.09 1k83 h MET 49 CO -0.04 0.34 -1.26 -0.89 0.23 0.00 0.00 176.91 175.29 1k83 n ILE 50 N -4.90 1.52 -0.11 1.77 2.08 -0.44 -3.04 119.36 116.25 1k83 n ILE 50 Ca 0.09 -0.02 0.26 0.00 0.56 0.00 0.00 62.75 63.64 1k83 n ILE 50 Cb 0.24 -2.09 0.72 0.00 -0.75 0.00 0.00 39.64 37.76 1k83 n ILE 50 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 1k83 h LEU 51 N -1.00 0.00 0.00 1.39 5.85 -1.24 -2.19 115.31 118.12 1k83 h LEU 51 Ca -0.32 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1k83 h LEU 51 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1k83 h LEU 51 CO -0.20 0.00 -1.68 0.41 -0.34 0.00 0.00 178.44 176.64 1k83 n THR 52 N -4.06 0.00 -1.30 1.05 -1.04 -0.53 -5.01 114.28 103.38 1k83 n THR 52 Ca 0.16 -0.36 -0.36 0.00 -2.04 0.00 0.00 64.05 61.44 1k83 n THR 52 Cb 0.90 0.26 0.08 0.00 -1.82 0.00 0.00 70.33 69.74 1k83 n THR 52 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 1k83 n HIS 53 N -2.02 -0.19 -3.75 -1.42 -0.00 -0.83 -5.00 115.22 102.01 1k83 n HIS 53 Ca -0.02 0.37 -0.28 0.00 -0.00 0.00 0.00 57.72 57.79 1k83 n HIS 53 Cb 0.46 -1.99 -0.16 0.00 -0.00 0.00 0.00 29.99 28.31 1k83 n HIS 53 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1k83 s VAL 54 N -1.87 0.68 -1.14 3.57 1.01 -1.26 -5.04 120.40 116.34 1k83 s VAL 54 Ca 0.69 -0.76 -0.16 0.00 0.00 0.00 0.00 61.98 61.74 1k83 s VAL 54 Cb -0.35 -1.21 -0.06 0.00 0.00 0.00 0.00 36.38 34.76 1k83 s VAL 54 CO 0.55 -0.28 2.15 -0.67 0.00 0.00 0.00 175.10 176.85 1k83 n ASP 55 N 4.98 3.78 0.08 3.32 2.03 -1.26 -4.29 116.55 125.19 1k83 n ASP 55 Ca -0.08 -2.71 0.10 0.00 0.52 0.00 0.00 54.79 52.62 1k83 n ASP 55 Cb 0.46 -1.38 0.43 0.00 -0.72 0.00 0.00 41.12 39.91 1k83 n ASP 55 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1k83 n LEU 56 N 6.31 0.43 -0.20 -2.67 4.77 -1.05 -2.87 117.00 121.72 1k83 n LEU 56 Ca 0.52 0.60 -0.03 0.00 -0.03 0.00 0.00 56.01 57.08 1k83 n LEU 56 Cb 0.36 -0.54 0.17 0.00 -2.33 0.00 0.00 43.42 41.08 1k83 n LEU 56 CO 0.94 -0.43 1.08 -0.29 -1.33 0.00 0.00 177.39 177.36 1k83 h ILE 57 N 0.00 1.23 -0.41 -0.08 2.10 -1.67 -1.39 117.51 117.28 1k83 h ILE 57 Ca 0.00 -0.68 0.12 0.00 1.08 0.00 0.00 64.86 65.38 1k83 h ILE 57 Cb 0.34 0.39 -0.02 0.00 -1.09 0.00 0.00 36.82 36.45 1k83 h ILE 57 CO 0.00 0.28 0.43 -0.33 -1.08 0.00 0.00 178.15 177.45 1k83 h GLU 58 N 0.97 0.00 0.01 2.19 4.39 -1.81 0.32 114.58 120.65 1k83 h GLU 58 Ca 0.23 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.65 1k83 h GLU 58 Cb 0.15 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.75 1k83 h GLU 58 CO -0.02 0.00 -1.60 0.87 -1.16 0.00 0.00 179.01 177.10 1k83 h LYS 59 N 0.00 0.02 -0.43 2.33 1.57 -1.47 -3.34 116.57 115.25 1k83 h LYS 59 Ca 0.20 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.80 1k83 h LYS 59 Cb 1.05 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.36 1k83 h LYS 59 CO -0.00 0.62 -0.30 0.74 -0.57 0.00 0.00 179.45 179.93 1k83 h PHE 60 N 0.00 1.12 0.00 -1.35 0.04 -0.08 -2.83 116.94 113.85 1k83 h PHE 60 Ca -0.24 -0.31 0.00 0.00 2.80 0.00 0.00 57.97 60.22 1k83 h PHE 60 Cb 1.98 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 39.88 1k83 h PHE 60 CO 0.00 1.13 0.07 -0.07 -0.60 0.00 0.00 178.31 178.85 1k83 h LEU 61 N 0.79 0.00 -0.03 1.54 3.38 -1.09 -0.56 115.31 119.34 1k83 h LEU 61 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1k83 h LEU 61 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1k83 h LEU 61 CO 0.08 0.00 -0.00 0.54 0.09 0.00 0.00 178.44 179.15 1k83 n ARG 62 N -2.86 1.01 -3.42 1.13 1.74 -1.07 -4.73 116.66 108.45 1k83 n ARG 62 Ca -0.02 -0.03 -0.37 0.00 -0.77 0.00 0.00 57.85 56.66 1k83 n ARG 62 Cb 0.13 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.00 1k83 n ARG 62 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1k83 s TYR 63 N -2.01 3.50 0.08 -1.55 1.51 -0.22 -5.01 117.35 113.65 1k83 s TYR 63 Ca 0.47 0.77 -0.30 0.00 -1.01 0.00 0.00 57.07 57.01 1k83 s TYR 63 Cb 0.22 -2.44 -0.14 0.00 -0.11 0.00 0.00 41.96 39.49 1k83 s TYR 63 CO 0.37 0.23 1.47 -0.97 -1.11 0.00 0.00 175.55 175.54 1k83 h ASN 64 N 6.56 -1.24 -0.02 2.29 -1.24 -1.88 -3.51 115.58 116.55 1k83 h ASN 64 Ca -0.42 0.11 0.00 0.00 0.71 0.00 0.00 56.30 56.70 1k83 h ASN 64 Cb 1.18 0.43 0.00 0.00 0.73 0.00 0.00 38.32 40.65 1k83 h ASN 64 CO 0.75 -0.53 0.00 -0.81 -1.29 0.00 0.00 177.43 175.55