#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ntm h ALA 2 N 0.00 -0.22 -0.29 3.52 0.00 -2.07 -2.38 119.26 117.84 1ntm h ALA 2 Ca 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1ntm h ALA 2 Cb 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1ntm h ALA 2 CO 0.00 -0.40 0.06 -1.35 0.00 0.00 0.00 179.25 177.55 1ntm h PRO 3 N -0.65 0.47 0.00 0.00 0.11 -2.05 -2.44 132.00 127.44 1ntm h PRO 3 Ca -0.02 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1ntm h PRO 3 Cb 0.48 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.53 1ntm h PRO 3 CO 0.04 0.57 0.00 1.15 -0.21 0.00 0.00 178.00 179.54 1ntm h THR 4 N 0.29 0.00 0.35 -1.15 2.02 -1.98 -0.86 112.91 111.59 1ntm h THR 4 Ca 0.09 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.23 1ntm h THR 4 Cb 0.32 1.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1ntm h THR 4 CO 0.00 0.00 -0.17 0.25 0.37 0.00 0.00 175.52 175.97 1ntm h LEU 5 N 0.00 -0.40 -1.12 2.58 6.46 -0.91 0.93 115.31 122.85 1ntm h LEU 5 Ca 0.00 0.01 0.11 0.00 -0.12 0.00 0.00 57.88 57.89 1ntm h LEU 5 Cb 0.02 0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 39.98 1ntm h LEU 5 CO 0.00 -0.22 0.60 0.74 -0.62 0.00 0.00 178.44 178.95 1ntm h THR 6 N -0.62 0.94 0.57 1.05 2.02 -1.54 0.84 112.91 116.17 1ntm h THR 6 Ca -0.05 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.79 1ntm h THR 6 Cb 0.36 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.71 1ntm h THR 6 CO 0.08 0.17 -0.32 0.00 0.37 0.00 0.00 175.52 175.82 1ntm h ALA 7 N 1.55 -1.18 -1.00 6.16 0.00 -1.06 -0.61 119.26 123.13 1ntm h ALA 7 Ca 0.45 -0.17 0.16 0.00 0.00 0.00 0.00 54.91 55.35 1ntm h ALA 7 Cb 0.47 0.40 -0.10 0.00 0.00 0.00 0.00 17.79 18.57 1ntm h ALA 7 CO -0.22 -1.14 0.62 0.00 0.00 0.00 0.00 179.25 178.52 1ntm h ARG 8 N -0.82 0.83 -0.93 0.00 3.08 0.12 0.28 114.38 116.94 1ntm h ARG 8 Ca -0.08 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 59.95 1ntm h ARG 8 Cb 0.65 -0.19 -0.05 0.00 0.08 0.00 0.00 29.97 30.46 1ntm h ARG 8 CO 0.10 0.55 0.60 1.25 -1.07 0.00 0.00 179.97 181.40 1ntm h LEU 9 N 0.86 1.01 0.12 3.04 5.85 -0.69 -1.18 115.31 124.32 1ntm h LEU 9 Ca 0.54 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 59.24 1ntm h LEU 9 Cb 0.73 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1ntm h LEU 9 CO -0.32 0.70 -0.06 0.22 -0.34 0.00 0.00 178.44 178.64 1ntm h TYR 10 N 1.18 -0.15 -0.12 1.25 3.20 0.10 -2.75 116.97 119.68 1ntm h TYR 10 Ca 0.36 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.25 1ntm h TYR 10 Cb -0.02 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 1ntm h TYR 10 CO -0.01 0.24 -0.17 0.77 -1.64 0.00 0.00 178.16 177.36 1ntm h SER 11 N -0.59 -0.56 1.74 -2.11 0.02 -0.46 -0.29 113.55 111.31 1ntm h SER 11 Ca -0.02 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1ntm h SER 11 Cb 0.46 0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1ntm h SER 11 CO 0.03 -0.12 0.00 -0.07 -1.14 0.00 0.00 176.83 175.53 1ntm h LEU 12 N -0.12 0.00 0.00 5.07 3.38 -1.38 -3.41 115.31 118.85 1ntm h LEU 12 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1ntm h LEU 12 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1ntm h LEU 12 CO -0.18 0.00 -0.23 0.18 0.09 0.00 0.00 178.44 178.31 1ntm n LEU 13 N -3.09 0.00 -0.10 1.67 4.77 -1.05 -4.96 117.00 114.23 1ntm n LEU 13 Ca 0.03 -0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.83 1ntm n LEU 13 Cb 0.47 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.42 1ntm n LEU 13 CO 0.32 0.00 -1.18 0.49 -1.33 0.00 0.00 177.39 175.69 1ntm n PHE 14 N -0.44 0.09 0.00 -1.77 3.72 -0.13 -1.17 117.46 117.76 1ntm n PHE 14 Ca 0.00 0.03 -0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1ntm n PHE 14 Cb 0.00 -1.01 -0.00 0.00 -0.94 0.00 0.00 39.48 37.52 1ntm n PHE 14 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ntm h ARG 15 N 0.00 -0.01 -6.26 -1.08 3.08 -1.78 -3.41 114.38 104.93 1ntm h ARG 15 Ca -0.54 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 58.96 1ntm h ARG 15 Cb 2.11 0.00 0.01 0.00 0.08 0.00 0.00 29.97 32.17 1ntm h ARG 15 CO -0.01 -0.01 1.26 1.03 -1.07 0.00 0.00 179.97 181.18 1ntm s ARG 16 N -3.03 3.89 0.48 0.04 0.52 -1.26 -4.78 118.95 114.81 1ntm s ARG 16 Ca -0.00 2.33 0.23 0.00 -0.52 0.00 0.00 55.73 57.77 1ntm s ARG 16 Cb 0.00 -4.17 1.25 0.00 0.52 0.00 0.00 34.95 32.55 1ntm s ARG 16 CO 0.01 -1.23 1.66 1.15 0.02 0.00 0.00 175.30 176.91 1ntm h THR 17 N 6.01 0.00 0.00 0.02 2.02 -1.93 -0.10 112.91 118.93 1ntm h THR 17 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1ntm h THR 17 Cb 1.22 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 1ntm h THR 17 CO 0.95 0.00 0.00 -1.20 0.37 0.00 0.00 175.52 175.64 1ntm n SER 18 N -2.48 0.00 -0.23 4.18 7.64 -1.26 -0.88 113.62 120.59 1ntm n SER 18 Ca -0.02 0.71 0.04 0.00 1.01 0.00 0.00 58.87 60.61 1ntm n SER 18 Cb 0.29 -0.28 0.16 0.00 -1.01 0.00 0.00 64.21 63.36 1ntm n SER 18 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1ntm h THR 19 N 0.00 0.61 -0.87 0.44 1.35 -1.65 0.85 112.91 113.64 1ntm h THR 19 Ca 0.00 -0.11 0.20 0.00 -0.55 0.00 0.00 66.41 65.95 1ntm h THR 19 Cb 0.00 0.26 -0.12 0.00 -1.73 0.00 0.00 68.15 66.56 1ntm h THR 19 CO 0.00 0.06 0.37 0.15 -0.25 0.00 0.00 175.52 175.85 1ntm h PHE 20 N 0.32 0.61 0.04 4.73 3.57 0.49 0.85 116.94 127.55 1ntm h PHE 20 Ca 0.38 0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.81 1ntm h PHE 20 Cb 0.59 -0.14 0.01 0.00 2.79 0.00 0.00 35.95 39.21 1ntm h PHE 20 CO -0.23 -0.02 -0.45 0.00 -2.23 0.00 0.00 178.31 175.38 1ntm h ALA 21 N 1.67 -0.00 -0.87 2.41 0.00 0.11 -2.72 119.26 119.85 1ntm h ALA 21 Ca 0.52 -0.56 0.19 0.00 0.00 0.00 0.00 54.91 55.07 1ntm h ALA 21 Cb 0.95 0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.67 1ntm h ALA 21 CO -0.50 0.22 0.40 1.25 0.00 0.00 0.00 179.25 180.62 1ntm h LEU 22 N -0.45 0.39 -0.22 0.00 5.85 0.22 -1.00 115.31 120.09 1ntm h LEU 22 Ca -0.07 0.13 -0.10 0.00 0.84 0.00 0.00 57.88 58.68 1ntm h LEU 22 Cb 1.26 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.38 1ntm h LEU 22 CO 0.09 0.08 -0.26 0.00 -0.34 0.00 0.00 178.44 178.00 1ntm h THR 23 N 0.47 1.32 -0.22 1.05 1.03 0.58 -1.92 112.91 115.23 1ntm h THR 23 Ca 0.52 -1.44 -0.05 0.00 -0.01 0.00 0.00 66.41 65.43 1ntm h THR 23 Cb 0.91 1.74 -0.01 0.00 -1.07 0.00 0.00 68.15 69.71 1ntm h THR 23 CO -0.47 0.45 -0.08 0.16 -0.01 0.00 0.00 175.52 175.57 1ntm h ILE 24 N 0.26 1.18 -0.11 0.00 -0.00 -0.90 1.57 117.51 119.52 1ntm h ILE 24 Ca 0.03 -0.77 -0.06 0.00 -0.00 0.00 0.00 64.86 64.05 1ntm h ILE 24 Cb 0.83 1.11 -0.00 0.00 -0.00 0.00 0.00 36.82 38.75 1ntm h ILE 24 CO 0.06 0.25 -0.18 0.58 -0.00 0.00 0.00 178.15 178.86 1ntm h VAL 25 N 0.33 1.38 -0.58 0.16 2.07 -1.24 0.14 116.25 118.51 1ntm h VAL 25 Ca 0.07 -1.44 -0.06 0.00 0.82 0.00 0.00 66.70 66.09 1ntm h VAL 25 Cb 0.35 2.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.17 1ntm h VAL 25 CO 0.02 0.42 0.12 0.58 0.02 0.00 0.00 177.57 178.72 1ntm h VAL 26 N -0.12 1.24 0.00 2.57 2.07 -0.94 -1.87 116.25 119.20 1ntm h VAL 26 Ca 0.01 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 1ntm h VAL 26 Cb 0.76 0.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1ntm h VAL 26 CO 0.04 0.34 -0.12 1.23 0.02 0.00 0.00 177.57 179.08 1ntm h GLY 27 N 1.01 0.00 2.00 2.17 0.00 0.24 -2.59 103.07 105.89 1ntm h GLY 27 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.36 1ntm h GLY 27 CO 0.00 0.00 -0.75 0.00 0.00 0.00 0.00 176.54 175.80 1ntm h ALA 28 N 1.88 0.55 0.59 3.60 0.00 0.10 -2.84 119.26 123.14 1ntm h ALA 28 Ca -0.00 -0.68 -0.03 0.00 0.00 0.00 0.00 54.91 54.20 1ntm h ALA 28 Cb 0.59 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.26 1ntm h ALA 28 CO 0.02 0.93 -0.28 1.25 0.00 0.00 0.00 179.25 181.17 1ntm h LEU 29 N 0.00 -0.67 -0.47 0.00 5.85 -1.12 -0.95 115.31 117.95 1ntm h LEU 29 Ca -0.01 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.79 1ntm h LEU 29 Cb 1.53 0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.68 1ntm h LEU 29 CO 0.10 -0.37 0.20 -0.26 -0.34 0.00 0.00 178.44 177.77 1ntm h PHE 30 N -0.99 0.37 -0.30 1.25 -1.00 -1.68 -2.73 116.94 111.85 1ntm h PHE 30 Ca -0.08 0.02 0.02 0.00 2.81 0.00 0.00 57.97 60.74 1ntm h PHE 30 Cb 0.60 -0.09 -0.02 0.00 3.61 0.00 0.00 35.95 40.04 1ntm h PHE 30 CO 0.04 0.16 0.15 0.35 -1.61 0.00 0.00 178.31 177.40 1ntm h PHE 31 N 0.40 0.28 -0.90 -0.55 3.57 -1.56 -1.11 116.94 117.08 1ntm h PHE 31 Ca 0.22 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.82 1ntm h PHE 31 Cb 0.17 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.76 1ntm h PHE 31 CO -0.13 0.16 0.55 1.49 -2.23 0.00 0.00 178.31 178.14 1ntm h GLU 32 N 0.32 0.89 0.49 1.11 4.81 -0.86 0.99 114.58 122.33 1ntm h GLU 32 Ca 0.12 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1ntm h GLU 32 Cb 0.04 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.22 1ntm h GLU 32 CO -0.08 0.59 -0.24 -0.09 -0.73 0.00 0.00 179.01 178.46 1ntm h ARG 33 N 0.92 -0.64 -0.37 1.92 2.43 -1.31 -2.40 114.38 114.94 1ntm h ARG 33 Ca 0.43 0.04 0.11 0.00 -0.81 0.00 0.00 59.98 59.75 1ntm h ARG 33 Cb 0.35 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1ntm h ARG 33 CO -0.23 -0.39 0.33 0.00 -1.51 0.00 0.00 179.97 178.16 1ntm h ALA 34 N -1.08 2.16 0.03 2.80 0.00 -1.02 0.11 119.26 122.27 1ntm h ALA 34 Ca -0.07 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.62 1ntm h ALA 34 Cb 0.54 0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.37 1ntm h ALA 34 CO 0.11 -0.52 -0.83 0.35 0.00 0.00 0.00 179.25 178.36 1ntm h PHE 35 N 0.00 0.79 0.00 0.00 3.57 -0.85 -3.03 116.94 117.41 1ntm h PHE 35 Ca 0.18 -0.45 -0.03 0.00 3.53 0.00 0.00 57.97 61.20 1ntm h PHE 35 Cb 0.83 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.48 1ntm h PHE 35 CO 0.00 1.28 -0.13 -0.44 -2.23 0.00 0.00 178.31 176.79 1ntm h ASP 36 N 0.07 0.00 0.04 0.41 3.45 -0.28 0.48 116.42 120.59 1ntm h ASP 36 Ca -0.11 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.35 1ntm h ASP 36 Cb 1.53 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.30 1ntm h ASP 36 CO 0.16 0.13 -0.02 1.56 -1.57 0.00 0.00 179.24 179.50 1ntm h GLN 37 N 0.00 -0.05 -0.68 3.56 1.08 -1.29 -2.41 115.11 115.32 1ntm h GLN 37 Ca -0.00 0.00 0.15 0.00 -1.45 0.00 0.00 58.65 57.35 1ntm h GLN 37 Cb 0.39 0.01 -0.12 0.00 -0.05 0.00 0.00 27.48 27.71 1ntm h GLN 37 CO 0.02 -0.03 -0.05 0.78 -0.95 0.00 0.00 178.83 178.59 1ntm h GLY 38 N -0.11 0.67 0.78 3.46 0.00 -1.54 0.39 103.07 106.71 1ntm h GLY 38 Ca -0.01 0.14 0.02 0.00 0.00 0.00 0.00 47.33 47.48 1ntm h GLY 38 CO 0.01 -0.25 -0.09 0.00 0.00 0.00 0.00 176.54 176.21 1ntm h ALA 39 N 1.65 -0.09 -0.25 3.60 0.00 -1.01 0.20 119.26 123.35 1ntm h ALA 39 Ca 0.35 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1ntm h ALA 39 Cb 0.59 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1ntm h ALA 39 CO -0.63 -0.58 0.07 -0.44 0.00 0.00 0.00 179.25 177.67 1ntm h ASP 40 N -0.15 0.36 -0.79 0.00 3.32 -0.88 -1.02 116.42 117.27 1ntm h ASP 40 Ca 0.03 -0.22 0.19 0.00 0.02 0.00 0.00 57.03 57.06 1ntm h ASP 40 Cb 0.19 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 39.60 1ntm h ASP 40 CO -0.09 0.48 0.54 0.00 -1.72 0.00 0.00 179.24 178.46 1ntm h ALA 41 N 0.89 2.35 -0.09 3.45 0.00 0.06 0.31 119.26 126.23 1ntm h ALA 41 Ca 0.08 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1ntm h ALA 41 Cb 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ntm h ALA 41 CO -0.00 -0.59 -0.38 0.82 0.00 0.00 0.00 179.25 179.10 1ntm h ILE 42 N 0.26 1.40 -0.55 0.00 1.08 -0.13 -2.29 117.51 117.28 1ntm h ILE 42 Ca 0.39 -1.75 0.02 0.00 -0.39 0.00 0.00 64.86 63.14 1ntm h ILE 42 Cb 1.15 2.25 -0.03 0.00 -3.07 0.00 0.00 36.82 37.12 1ntm h ILE 42 CO -0.10 0.51 0.36 0.22 -0.69 0.00 0.00 178.15 178.46 1ntm h TYR 43 N -0.03 0.65 0.49 1.37 5.03 0.80 -2.53 116.97 122.76 1ntm h TYR 43 Ca -0.02 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.28 1ntm h TYR 43 Cb 1.03 -0.22 0.00 0.00 1.55 0.00 0.00 36.73 39.09 1ntm h TYR 43 CO 0.12 0.39 -0.24 0.93 -1.32 0.00 0.00 178.16 178.05 1ntm h GLU 44 N 0.69 -0.64 -1.02 1.82 5.08 -0.82 -3.15 114.58 116.54 1ntm h GLU 44 Ca 0.21 0.04 0.25 0.00 -1.00 0.00 0.00 59.36 58.86 1ntm h GLU 44 Cb 0.01 0.14 -0.11 0.00 0.50 0.00 0.00 28.75 29.29 1ntm h GLU 44 CO -0.05 -0.37 0.63 1.25 -1.00 0.00 0.00 179.01 179.47 1ntm h HIS 45 N -1.12 0.84 -0.00 4.33 2.76 -1.18 0.80 115.15 121.58 1ntm h HIS 45 Ca -0.07 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 1ntm h HIS 45 Cb 0.56 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 29.28 1ntm h HIS 45 CO 0.01 0.08 -0.02 1.51 -1.30 0.00 0.00 177.93 178.21 1ntm n ILE 46 N -4.74 0.00 0.00 6.26 3.06 -0.97 -4.76 119.36 118.21 1ntm n ILE 46 Ca 0.26 -0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.50 1ntm n ILE 46 Cb 0.80 -0.47 0.00 0.00 0.54 0.00 0.00 39.64 40.51 1ntm n ILE 46 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 1ntm n ASN 47 N -1.37 0.00 -0.56 9.51 3.02 0.27 -5.03 115.26 121.11 1ntm n ASN 47 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 1ntm n ASN 47 Cb 0.29 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.46 1ntm n ASN 47 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ntm n GLU 48 N 0.00 0.00 -0.00 3.52 1.02 -0.89 -5.00 120.64 119.29 1ntm n GLU 48 Ca 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.22 1ntm n GLU 48 Cb 0.00 -2.37 -0.11 0.00 -0.02 0.00 0.00 31.44 28.94 1ntm n GLU 48 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ntm n GLY 49 N -0.56 -0.70 3.29 0.62 0.00 -1.26 -4.92 105.19 101.66 1ntm n GLY 49 Ca 0.00 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.44 1ntm n GLY 49 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ntm s LYS 50 N -2.78 1.05 0.00 1.61 2.47 -1.26 -4.93 119.74 115.90 1ntm s LYS 50 Ca 0.04 -1.13 0.00 0.00 -1.56 0.00 0.00 55.97 53.32 1ntm s LYS 50 Cb 0.13 0.36 0.00 0.00 -1.46 0.00 0.00 37.83 36.86 1ntm s LYS 50 CO 0.73 -0.37 0.00 1.28 0.16 0.00 0.00 175.35 177.16 1ntm n LEU 51 N -0.16 0.00 0.00 5.43 4.77 -1.26 -4.59 117.00 121.19 1ntm n LEU 51 Ca -0.09 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.03 1ntm n LEU 51 Cb 0.63 0.00 0.85 0.00 -2.33 0.00 0.00 43.42 42.57 1ntm n LEU 51 CO 0.24 0.00 1.04 1.87 -1.33 0.00 0.00 177.39 179.21 1ntm n TRP 52 N 0.00 0.00 0.02 -1.77 -0.00 -1.26 -1.96 117.44 112.47 1ntm n TRP 52 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.50 57.42 1ntm n TRP 52 Cb 0.00 -0.07 0.09 0.00 -0.00 0.00 0.00 31.31 31.33 1ntm n TRP 52 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 177.69 178.56 1ntm h LYS 53 N 0.00 0.49 -0.36 5.87 1.79 -1.92 -3.27 116.57 119.17 1ntm h LYS 53 Ca 0.00 -0.29 0.04 0.00 -2.18 0.00 0.00 60.65 58.22 1ntm h LYS 53 Cb 0.06 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 30.70 1ntm h LYS 53 CO 0.00 0.89 0.13 1.12 -1.08 0.00 0.00 179.45 180.51 1ntm h HIS 54 N 0.38 0.23 -0.47 -1.35 -0.00 -1.78 -1.82 115.15 110.34 1ntm h HIS 54 Ca 0.01 0.02 0.14 0.00 -0.00 0.00 0.00 60.37 60.54 1ntm h HIS 54 Cb 1.04 -0.05 -0.02 0.00 -0.00 0.00 0.00 27.41 28.38 1ntm h HIS 54 CO 0.04 0.10 0.57 -0.84 -0.00 0.00 0.00 177.93 177.80 1ntm h ILE 55 N 0.28 0.26 0.00 6.12 -0.00 -1.71 -2.89 117.51 119.58 1ntm h ILE 55 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 65.02 1ntm h ILE 55 Cb 0.14 0.53 0.00 0.00 -0.00 0.00 0.00 36.82 37.49 1ntm h ILE 55 CO -0.17 0.00 -0.08 0.11 -0.00 0.00 0.00 178.15 178.02 1ntm h LYS 56 N 0.00 0.00 0.00 0.16 1.57 -1.48 -3.43 116.57 113.39 1ntm h LYS 56 Ca 0.22 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1ntm h LYS 56 Cb 1.37 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.68 1ntm h LYS 56 CO -0.00 0.00 -0.01 0.45 -0.57 0.00 0.00 179.45 179.31 1ntm h HIS 57 N -0.22 0.00 0.00 -1.35 3.86 -1.38 -3.44 115.15 112.63 1ntm h HIS 57 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1ntm h HIS 57 Cb 0.08 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.55 1ntm h HIS 57 CO -0.03 0.01 0.00 1.63 0.86 0.00 0.00 177.93 180.40 1ntm n LYS 58 N -4.05 0.00 -2.03 2.45 4.01 -1.10 -5.03 118.16 112.41 1ntm n LYS 58 Ca -0.03 0.00 -0.04 0.00 -0.51 0.00 0.00 58.31 57.73 1ntm n LYS 58 Cb 0.10 0.00 0.02 0.00 -0.51 0.00 0.00 35.03 34.64 1ntm n LYS 58 CO 0.00 0.00 0.00 0.98 -1.11 0.00 0.00 177.40 177.27 1ntm n TYR 59 N 0.00 -0.66 -1.22 2.13 9.36 -1.26 -5.01 117.16 120.50 1ntm n TYR 59 Ca 0.00 0.24 0.00 0.00 3.32 0.00 0.00 57.90 61.46 1ntm n TYR 59 Cb 0.00 -2.93 0.00 0.00 -0.63 0.00 0.00 39.34 35.78 1ntm n TYR 59 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47