#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r2d h SER 2 N 0.00 -0.93 0.48 3.17 0.02 -1.98 0.86 113.55 115.17 1r2d h SER 2 Ca 0.00 0.11 -0.21 0.00 -0.84 0.00 0.00 61.79 60.86 1r2d h SER 2 Cb 0.00 0.37 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 1r2d h SER 2 CO 0.00 -0.23 -0.89 -0.61 -1.14 0.00 0.00 176.83 173.95 1r2d h GLN 3 N -0.26 0.28 0.69 3.45 4.15 -2.01 -2.84 115.11 118.58 1r2d h GLN 3 Ca 0.03 -0.30 -0.03 0.00 0.77 0.00 0.00 58.65 59.12 1r2d h GLN 3 Cb 0.33 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1r2d h GLN 3 CO -0.26 1.01 -0.49 0.77 -1.93 0.00 0.00 178.83 177.93 1r2d h SER 4 N 0.16 -1.26 -0.88 -0.69 0.02 -1.93 -1.29 113.55 107.68 1r2d h SER 4 Ca -0.06 0.08 0.07 0.00 -0.84 0.00 0.00 61.79 61.05 1r2d h SER 4 Cb 1.52 0.38 -0.06 0.00 0.14 0.00 0.00 62.40 64.39 1r2d h SER 4 CO 0.14 -0.71 0.57 0.78 -1.14 0.00 0.00 176.83 176.47 1r2d h ASN 5 N -1.12 0.85 -0.48 3.07 -0.26 0.66 0.31 115.58 118.61 1r2d h ASN 5 Ca -0.09 0.01 0.03 0.00 -0.56 0.00 0.00 56.30 55.69 1r2d h ASN 5 Cb 0.92 -0.17 -0.03 0.00 -1.06 0.00 0.00 38.32 37.98 1r2d h ASN 5 CO 0.05 0.53 0.27 -0.09 -1.06 0.00 0.00 177.43 177.14 1r2d h ARG 6 N 0.96 0.52 -0.46 0.81 9.65 -1.23 0.50 114.38 125.14 1r2d h ARG 6 Ca 0.39 -0.03 -0.11 0.00 -1.10 0.00 0.00 59.98 59.13 1r2d h ARG 6 Cb 0.26 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.71 1r2d h ARG 6 CO -0.15 0.34 -0.15 1.49 2.80 0.00 0.00 179.97 184.31 1r2d h GLU 7 N 0.54 0.86 -0.31 0.20 4.81 -0.12 -1.67 114.58 118.88 1r2d h GLU 7 Ca 0.20 -0.32 -0.03 0.00 -0.13 0.00 0.00 59.36 59.08 1r2d h GLU 7 Cb 0.05 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1r2d h GLU 7 CO -0.11 0.95 0.08 1.25 -0.73 0.00 0.00 179.01 180.45 1r2d h LEU 8 N 0.77 0.47 -0.00 1.64 5.85 -0.45 -1.26 115.31 122.33 1r2d h LEU 8 Ca 0.12 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1r2d h LEU 8 Cb 0.66 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 1r2d h LEU 8 CO 0.05 0.58 0.00 0.58 -0.34 0.00 0.00 178.44 179.31 1r2d h VAL 9 N 0.34 1.01 -0.87 1.05 2.07 -0.78 -1.91 116.25 117.16 1r2d h VAL 9 Ca 0.10 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1r2d h VAL 9 Cb 0.29 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1r2d h VAL 9 CO 0.00 0.01 0.56 0.58 0.02 0.00 0.00 177.57 178.74 1r2d h VAL 10 N -0.01 1.23 0.01 2.57 2.07 -1.22 -1.26 116.25 119.64 1r2d h VAL 10 Ca 0.00 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 1r2d h VAL 10 Cb 0.01 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.75 1r2d h VAL 10 CO -0.00 0.23 -0.00 -0.78 0.02 0.00 0.00 177.57 177.03 1r2d h ASP 11 N 1.18 -0.01 -0.67 0.57 3.58 -1.02 0.72 116.42 120.77 1r2d h ASP 11 Ca 0.32 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.69 1r2d h ASP 11 Cb -0.11 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 1r2d h ASP 11 CO -0.07 0.05 0.36 0.15 -2.88 0.00 0.00 179.24 176.85 1r2d h PHE 12 N -0.07 0.94 -0.44 0.28 3.04 -1.11 0.18 116.94 119.77 1r2d h PHE 12 Ca -0.00 -0.03 -0.11 0.00 3.98 0.00 0.00 57.97 61.81 1r2d h PHE 12 Cb 0.07 -0.30 -0.02 0.00 2.56 0.00 0.00 35.95 38.26 1r2d h PHE 12 CO -0.06 0.68 -0.18 -0.07 -2.02 0.00 0.00 178.31 176.66 1r2d h LEU 13 N 0.93 0.86 -0.61 0.59 3.38 -1.09 -1.21 115.31 118.15 1r2d h LEU 13 Ca 0.24 -0.30 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 1r2d h LEU 13 Cb 0.06 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1r2d h LEU 13 CO -0.04 1.03 -0.07 0.28 0.09 0.00 0.00 178.44 179.73 1r2d h SER 14 N 0.75 1.01 0.01 -0.43 0.02 -0.57 -1.45 113.55 112.89 1r2d h SER 14 Ca 0.11 -0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1r2d h SER 14 Cb 0.71 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.97 1r2d h SER 14 CO 0.05 1.10 -0.00 0.22 -1.14 0.00 0.00 176.83 177.07 1r2d h TYR 15 N 0.92 -0.01 -0.29 3.45 3.20 -0.74 -0.85 116.97 122.65 1r2d h TYR 15 Ca 0.15 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 1r2d h TYR 15 Cb 0.63 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 1r2d h TYR 15 CO 0.04 0.00 0.17 -0.22 -1.64 0.00 0.00 178.16 176.52 1r2d h LYS 16 N -0.02 0.40 -0.36 1.82 1.63 -1.10 -0.30 116.57 118.64 1r2d h LYS 16 Ca -0.00 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.75 1r2d h LYS 16 Cb 0.01 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.55 1r2d h LYS 16 CO 0.00 0.32 0.20 -0.07 -3.45 0.00 0.00 179.45 176.45 1r2d h LEU 17 N 0.37 0.45 0.23 5.20 3.38 -1.15 -1.71 115.31 122.08 1r2d h LEU 17 Ca 0.10 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1r2d h LEU 17 Cb 0.03 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1r2d h LEU 17 CO -0.02 0.40 -0.19 -1.28 0.09 0.00 0.00 178.44 177.44 1r2d h SER 18 N 0.46 -0.50 -0.96 -0.43 0.87 -0.98 0.20 113.55 112.20 1r2d h SER 18 Ca 0.13 0.04 0.19 0.00 -1.23 0.00 0.00 61.79 60.92 1r2d h SER 18 Cb 0.05 0.17 -0.11 0.00 -0.44 0.00 0.00 62.40 62.07 1r2d h SER 18 CO -0.02 -0.29 0.55 -0.61 -0.53 0.00 0.00 176.83 175.92 1r2d h GLN 19 N -0.44 0.66 -0.16 2.24 4.15 -0.93 -1.21 115.11 119.42 1r2d h GLN 19 Ca -0.01 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1r2d h GLN 19 Cb 0.40 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.94 1r2d h GLN 19 CO -0.02 0.43 0.00 1.63 -1.93 0.00 0.00 178.83 178.94 1r2d n LYS 20 N -4.83 1.56 -0.59 1.69 4.01 -0.65 -4.92 118.16 114.44 1r2d n LYS 20 Ca 0.22 -0.86 0.00 0.00 -0.51 0.00 0.00 58.31 57.17 1r2d n LYS 20 Cb 0.57 -1.33 0.00 0.00 -0.51 0.00 0.00 35.03 33.76 1r2d n LYS 20 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1r2d n GLY 21 N 1.02 0.70 3.94 0.72 0.00 -0.46 -5.06 105.19 106.05 1r2d n GLY 21 Ca 0.14 -0.09 -0.19 0.00 0.00 0.00 0.00 46.02 45.88 1r2d n GLY 21 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1r2d s TYR 22 N -2.00 2.93 0.39 1.61 2.02 0.66 -5.01 117.35 117.95 1r2d s TYR 22 Ca 0.00 -0.32 -0.15 0.00 -0.37 0.00 0.00 57.07 56.22 1r2d s TYR 22 Cb 0.00 -2.05 -0.09 0.00 -0.40 0.00 0.00 41.96 39.43 1r2d s TYR 22 CO 0.00 -0.06 0.82 0.45 -1.57 0.00 0.00 175.55 175.20 1r2d s SER 23 N -4.15 6.73 -0.08 2.29 0.15 -1.26 -3.77 113.70 113.61 1r2d s SER 23 Ca 0.46 1.37 0.11 0.00 0.70 0.00 0.00 55.95 58.60 1r2d s SER 23 Cb -0.08 -2.42 0.24 0.00 -1.71 0.00 0.00 66.02 62.06 1r2d s SER 23 CO 0.30 -0.34 1.16 -2.67 1.20 0.00 0.00 173.24 172.89 1r2d n TRP 24 N -0.80 0.20 0.48 3.44 2.14 -1.26 -4.72 117.44 116.92 1r2d n TRP 24 Ca 0.04 -0.76 0.09 0.00 2.07 0.00 0.00 57.50 58.95 1r2d n TRP 24 Cb 0.54 -0.13 0.40 0.00 -0.81 0.00 0.00 31.31 31.31 1r2d n TRP 24 CO 0.00 0.00 0.00 0.43 2.07 0.00 0.00 177.69 180.19 1r2d n SER 25 N -0.75 0.29 0.00 -0.67 7.64 -1.26 -3.10 113.62 115.77 1r2d n SER 25 Ca 0.11 0.57 0.07 0.00 1.01 0.00 0.00 58.87 60.63 1r2d n SER 25 Cb 0.53 -0.63 0.42 0.00 -1.01 0.00 0.00 64.21 63.52 1r2d n SER 25 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1r2d n GLN 26 N -1.82 0.51 0.00 1.43 3.00 -1.26 -5.16 117.38 114.08 1r2d n GLN 26 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 1r2d n GLN 26 Cb 0.21 -1.44 0.00 0.00 0.00 0.00 0.00 30.24 29.01 1r2d n GLN 26 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1r2d n PHE 27 N -0.94 0.00 -0.49 1.08 3.72 -1.18 -4.35 117.46 115.30 1r2d n PHE 27 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 1r2d n PHE 27 Cb 0.05 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 1r2d n PHE 27 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1r2d n PRO 82 N 0.00 0.00 -0.29 -1.08 -0.02 -1.26 -5.13 135.00 127.21 1r2d n PRO 82 Ca 0.00 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.51 1r2d n PRO 82 Cb 0.00 -0.49 0.09 0.00 -0.02 0.00 0.00 33.50 33.08 1r2d n PRO 82 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 1r2d n MET 83 N 1.84 -0.10 -0.35 -0.52 1.56 -1.26 0.76 117.12 119.05 1r2d n MET 83 Ca 0.00 1.25 0.05 0.00 -0.27 0.00 0.00 57.70 58.73 1r2d n MET 83 Cb 0.15 -1.86 0.23 0.00 2.15 0.00 0.00 33.22 33.89 1r2d n MET 83 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1r2d h ALA 84 N 1.47 1.50 -0.16 -5.12 0.00 -2.05 -0.40 119.26 114.51 1r2d h ALA 84 Ca 0.36 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.12 1r2d h ALA 84 Cb 0.56 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1r2d h ALA 84 CO -0.82 0.31 -0.51 0.00 0.00 0.00 0.00 179.25 178.23 1r2d h ALA 85 N 1.51 0.82 -0.05 0.00 0.00 -0.10 -2.29 119.26 119.15 1r2d h ALA 85 Ca 0.45 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1r2d h ALA 85 Cb 0.34 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1r2d h ALA 85 CO -0.21 0.67 -0.00 0.28 0.00 0.00 0.00 179.25 180.00 1r2d h VAL 86 N 0.34 1.25 -0.39 0.00 2.07 -0.50 -1.58 116.25 117.45 1r2d h VAL 86 Ca 0.01 -0.77 0.06 0.00 0.82 0.00 0.00 66.70 66.83 1r2d h VAL 86 Cb 1.02 1.67 -0.05 0.00 -1.52 0.00 0.00 31.29 32.40 1r2d h VAL 86 CO 0.09 0.21 0.07 0.11 0.02 0.00 0.00 177.57 178.07 1r2d h LYS 87 N -0.20 0.18 -0.42 1.57 1.57 -1.08 0.01 116.57 118.20 1r2d h LYS 87 Ca 0.01 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1r2d h LYS 87 Cb 0.33 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 1r2d h LYS 87 CO 0.00 0.12 0.16 0.37 -0.57 0.00 0.00 179.45 179.53 1r2d h GLN 88 N 0.19 0.63 -0.75 3.15 5.75 -1.38 -0.15 115.11 122.55 1r2d h GLN 88 Ca 0.19 -0.12 0.01 0.00 -0.15 0.00 0.00 58.65 58.57 1r2d h GLN 88 Cb 0.23 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.64 1r2d h GLN 88 CO -0.26 0.60 0.49 0.00 -2.65 0.00 0.00 178.83 177.02 1r2d h ALA 89 N 1.00 0.95 -0.45 3.38 0.00 -0.90 -1.95 119.26 121.30 1r2d h ALA 89 Ca 0.14 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1r2d h ALA 89 Cb 0.21 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1r2d h ALA 89 CO -0.01 0.38 -0.27 1.25 0.00 0.00 0.00 179.25 180.60 1r2d h LEU 90 N 1.02 1.00 -0.18 0.00 5.85 -0.71 0.25 115.31 122.54 1r2d h LEU 90 Ca 0.28 -0.40 0.02 0.00 0.84 0.00 0.00 57.88 58.61 1r2d h LEU 90 Cb -0.11 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.62 1r2d h LEU 90 CO -0.06 1.20 0.06 0.03 -0.34 0.00 0.00 178.44 179.34 1r2d h ARG 91 N 0.82 0.15 -0.57 1.25 3.08 -0.77 -0.56 114.38 117.77 1r2d h ARG 91 Ca 0.10 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.07 1r2d h ARG 91 Cb 0.85 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1r2d h ARG 91 CO 0.08 0.10 0.09 0.93 -1.07 0.00 0.00 179.97 180.09 1r2d h GLU 92 N 0.15 0.95 -0.39 0.04 5.08 -1.25 -2.17 114.58 116.99 1r2d h GLU 92 Ca 0.08 -0.26 0.04 0.00 -1.00 0.00 0.00 59.36 58.22 1r2d h GLU 92 Cb 0.05 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 1r2d h GLU 92 CO -0.08 0.91 0.16 0.00 -1.00 0.00 0.00 179.01 179.00 1r2d h ALA 93 N 1.00 0.46 -0.75 3.43 0.00 -0.69 -0.97 119.26 121.75 1r2d h ALA 93 Ca 0.17 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1r2d h ALA 93 Cb 0.42 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1r2d h ALA 93 CO 0.01 -0.22 0.44 0.78 0.00 0.00 0.00 179.25 180.27 1r2d h GLY 94 N 0.34 1.09 1.00 0.00 0.00 -0.91 -0.51 103.07 104.08 1r2d h GLY 94 Ca 0.17 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 1r2d h GLY 94 CO -0.15 0.45 0.35 -0.55 0.00 0.00 0.00 176.54 176.64 1r2d h ASP 95 N 1.03 0.82 -0.29 0.19 3.32 -0.84 -0.53 116.42 120.11 1r2d h ASP 95 Ca 0.27 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 1r2d h ASP 95 Cb -0.02 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 1r2d h ASP 95 CO -0.05 0.68 0.14 -0.08 -1.72 0.00 0.00 179.24 178.21 1r2d h GLU 96 N 0.89 0.42 -0.07 3.56 4.57 -0.83 -1.03 114.58 122.09 1r2d h GLU 96 Ca 0.23 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.36 1r2d h GLU 96 Cb 0.05 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1r2d h GLU 96 CO -0.04 0.39 -0.01 0.35 -1.18 0.00 0.00 179.01 178.52 1r2d h PHE 97 N 0.34 -0.02 0.00 0.92 3.57 -0.77 -2.20 116.94 118.78 1r2d h PHE 97 Ca 0.10 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1r2d h PHE 97 Cb 0.11 0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.87 1r2d h PHE 97 CO -0.02 -0.02 0.00 0.93 -2.23 0.00 0.00 178.31 176.97 1r2d h GLU 98 N 0.01 0.00 -0.45 1.11 5.08 -0.98 -0.64 114.58 118.71 1r2d h GLU 98 Ca 0.03 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 1r2d h GLU 98 Cb 0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1r2d h GLU 98 CO -0.07 0.00 -0.21 1.25 -1.00 0.00 0.00 179.01 178.98 1r2d h LEU 99 N 0.00 0.92 0.00 1.33 5.85 -0.54 -3.32 115.31 119.55 1r2d h LEU 99 Ca 0.00 -0.34 -0.05 0.00 0.84 0.00 0.00 57.88 58.34 1r2d h LEU 99 Cb 0.39 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 1r2d h LEU 99 CO 0.00 1.09 -0.37 0.03 -0.34 0.00 0.00 178.44 178.86 1r2d h ARG 100 N 0.78 0.00 -5.14 1.25 3.08 -1.29 -3.43 114.38 109.63 1r2d h ARG 100 Ca 0.11 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.49 1r2d h ARG 100 Cb 0.76 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 30.64 1r2d h ARG 100 CO 0.06 0.44 -0.05 -0.47 -1.07 0.00 0.00 179.97 178.88 1r2d s TYR 101 N -2.04 3.13 -0.40 3.04 5.04 -0.30 -4.91 117.35 120.91 1r2d s TYR 101 Ca -0.14 -0.15 0.12 0.00 -2.44 0.00 0.00 57.07 54.46 1r2d s TYR 101 Cb 0.01 -3.07 0.33 0.00 0.35 0.00 0.00 41.96 39.57 1r2d s TYR 101 CO 0.34 -0.74 1.25 2.89 -1.34 0.00 0.00 175.55 177.95 1r2d n ARG 102 N 5.88 2.68 0.24 4.97 1.85 -1.25 -4.20 116.66 126.83 1r2d n ARG 102 Ca -0.05 -2.30 0.13 0.00 -1.00 0.00 0.00 57.85 54.63 1r2d n ARG 102 Cb 0.48 -1.45 0.48 0.00 -1.05 0.00 0.00 32.46 30.92 1r2d n ARG 102 CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 1r2d h ARG 103 N 1.30 0.00 -2.51 2.89 2.43 -1.91 -3.47 114.38 113.11 1r2d h ARG 103 Ca 0.00 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 58.83 1r2d h ARG 103 Cb 0.97 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 1r2d h ARG 103 CO 0.07 0.10 -0.44 0.00 -1.51 0.00 0.00 179.97 178.19 1r2d n ALA 104 N -2.14 -0.52 -3.50 2.80 0.00 -1.26 -3.17 120.51 112.72 1r2d n ALA 104 Ca 0.01 0.14 -0.26 0.00 0.00 0.00 0.00 53.44 53.34 1r2d n ALA 104 Cb 0.41 -1.98 0.01 0.00 0.00 0.00 0.00 19.45 17.89 1r2d n ALA 104 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1r2d n PHE 105 N -4.04 -2.00 -0.32 0.00 3.01 -1.26 -4.84 117.46 108.02 1r2d n PHE 105 Ca -0.19 0.63 0.10 0.00 1.01 0.00 0.00 57.45 59.00 1r2d n PHE 105 Cb 0.65 -3.60 0.27 0.00 -0.01 0.00 0.00 39.48 36.79 1r2d n PHE 105 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1r2d h SER 106 N -1.44 0.60 -0.01 4.37 0.02 -1.97 0.45 113.55 115.56 1r2d h SER 106 Ca -0.50 0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1r2d h SER 106 Cb 1.34 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.88 1r2d h SER 106 CO 0.59 0.22 0.00 -0.78 -1.14 0.00 0.00 176.83 175.72 1r2d h ASP 107 N 0.65 0.02 -0.46 3.07 3.58 -1.89 0.79 116.42 122.18 1r2d h ASP 107 Ca 0.52 -0.22 -0.03 0.00 0.42 0.00 0.00 57.03 57.71 1r2d h ASP 107 Cb 0.79 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.81 1r2d h ASP 107 CO -0.39 0.24 0.17 -0.07 -2.88 0.00 0.00 179.24 176.30 1r2d h LEU 108 N -0.20 0.65 -1.08 2.28 3.38 -1.60 0.93 115.31 119.66 1r2d h LEU 108 Ca 0.00 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1r2d h LEU 108 Cb 0.22 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1r2d h LEU 108 CO -0.00 0.66 0.07 0.71 0.09 0.00 0.00 178.44 179.96 1r2d h THR 109 N 0.60 1.22 -0.55 0.22 1.35 -0.11 -0.99 112.91 114.64 1r2d h THR 109 Ca 0.15 -0.83 -0.06 0.00 -0.55 0.00 0.00 66.41 65.12 1r2d h THR 109 Cb 0.22 0.79 -0.02 0.00 -1.73 0.00 0.00 68.15 67.42 1r2d h THR 109 CO -0.01 0.30 0.12 0.28 -0.25 0.00 0.00 175.52 175.96 1r2d h SER 110 N 0.69 0.85 0.02 5.36 0.02 -0.42 1.37 113.55 121.44 1r2d h SER 110 Ca 0.15 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1r2d h SER 110 Cb 0.33 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.64 1r2d h SER 110 CO 0.01 0.87 -0.02 1.56 -1.14 0.00 0.00 176.83 178.11 1r2d h GLN 111 N 0.79 0.00 0.05 3.45 4.20 0.03 -3.05 115.11 120.57 1r2d h GLN 111 Ca 0.17 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.51 1r2d h GLN 111 Cb 0.37 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.10 1r2d h GLN 111 CO 0.00 0.02 -2.19 -0.11 -0.67 0.00 0.00 178.83 175.88 1r2d n LEU 112 N -4.33 2.21 -3.14 1.46 7.94 -0.46 -5.02 117.00 115.66 1r2d n LEU 112 Ca -0.03 0.08 -0.24 0.00 -1.11 0.00 0.00 56.01 54.71 1r2d n LEU 112 Cb 0.10 -0.68 0.02 0.00 0.53 0.00 0.00 43.42 43.39 1r2d n LEU 112 CO 0.32 0.78 -0.20 0.00 -1.11 0.00 0.00 177.39 177.19 1r2d n HIS 113 N -3.25 -1.74 -2.33 1.96 1.44 0.46 -4.79 115.22 106.98 1r2d n HIS 113 Ca -0.35 0.72 -0.41 0.00 -2.01 0.00 0.00 57.72 55.67 1r2d n HIS 113 Cb 1.04 -1.62 -0.03 0.00 0.12 0.00 0.00 29.99 29.50 1r2d n HIS 113 CO 0.00 0.00 0.00 -1.50 -2.81 0.00 0.00 176.34 172.03 1r2d s ILE 114 N -1.85 3.53 0.13 0.61 2.07 -1.26 -4.96 121.20 119.46 1r2d s ILE 114 Ca 0.15 1.23 -0.00 0.00 -1.41 0.00 0.00 60.65 60.62 1r2d s ILE 114 Cb -0.02 -3.79 -0.04 0.00 0.13 0.00 0.00 42.46 38.75 1r2d s ILE 114 CO 0.65 0.17 0.04 0.42 -1.91 0.00 0.00 174.94 174.31 1r2d s THR 115 N 0.24 0.22 -0.19 4.00 -4.23 -1.26 -5.01 115.64 109.41 1r2d s THR 115 Ca 0.56 -1.91 0.16 0.00 -1.18 0.00 0.00 61.69 59.31 1r2d s THR 115 Cb -0.33 -2.00 0.16 0.00 1.34 0.00 0.00 72.50 71.66 1r2d s THR 115 CO 0.35 -0.52 1.44 -2.65 -0.54 0.00 0.00 174.62 172.70 1r2d n PRO 116 N -0.10 0.10 0.03 3.99 -0.02 -1.26 -0.49 135.00 137.25 1r2d n PRO 116 Ca -0.07 0.59 0.12 0.00 -2.02 0.00 0.00 63.50 62.12 1r2d n PRO 116 Cb 0.63 -1.97 0.15 0.00 -0.02 0.00 0.00 33.50 32.29 1r2d n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r2d n GLY 117 N -1.30 -1.29 3.76 -1.23 0.00 -1.26 -4.93 105.19 98.94 1r2d n GLY 117 Ca -0.01 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 1r2d n GLY 117 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1r2d s THR 118 N -3.11 2.18 0.19 2.61 2.01 0.35 -5.01 115.64 114.85 1r2d s THR 118 Ca 0.07 0.16 0.04 0.00 0.31 0.00 0.00 61.69 62.27 1r2d s THR 118 Cb 0.15 -3.10 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 1r2d s THR 118 CO 0.74 0.03 0.26 0.00 -0.69 0.00 0.00 174.62 174.96 1r2d s ALA 119 N -0.36 3.82 0.22 7.40 0.00 -1.26 -4.95 121.76 126.63 1r2d s ALA 119 Ca 0.59 -1.17 -0.09 0.00 0.00 0.00 0.00 51.96 51.29 1r2d s ALA 119 Cb -0.46 -1.61 0.33 0.00 0.00 0.00 0.00 23.12 21.37 1r2d s ALA 119 CO 0.52 0.43 1.68 -0.92 0.00 0.00 0.00 175.76 177.46 1r2d h TYR 120 N 1.90 0.07 -1.01 0.00 3.20 -2.00 -1.30 116.97 117.84 1r2d h TYR 120 Ca -0.49 0.04 0.23 0.00 3.14 0.00 0.00 58.73 61.66 1r2d h TYR 120 Cb 1.21 0.07 -0.11 0.00 1.54 0.00 0.00 36.73 39.44 1r2d h TYR 120 CO 0.53 -0.12 0.62 -0.56 -1.64 0.00 0.00 178.16 176.99 1r2d h GLN 121 N 0.17 0.55 -0.31 1.82 -0.00 -1.98 0.55 115.11 115.91 1r2d h GLN 121 Ca 0.34 -0.03 -0.09 0.00 -0.00 0.00 0.00 58.65 58.87 1r2d h GLN 121 Cb 0.55 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.48 27.90 1r2d h GLN 121 CO -0.50 0.36 -0.16 0.77 -0.00 0.00 0.00 178.83 179.31 1r2d h SER 122 N 0.57 0.67 0.14 0.06 0.02 -1.65 -0.12 113.55 113.24 1r2d h SER 122 Ca 0.60 -0.41 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1r2d h SER 122 Cb 1.22 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.57 1r2d h SER 122 CO -0.38 0.94 -0.08 0.15 -1.14 0.00 0.00 176.83 176.31 1r2d h PHE 123 N 0.41 -0.21 -0.74 3.45 3.57 -0.50 -2.27 116.94 120.66 1r2d h PHE 123 Ca 0.07 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.65 1r2d h PHE 123 Cb 0.68 0.07 -0.07 0.00 2.79 0.00 0.00 35.95 39.43 1r2d h PHE 123 CO 0.06 -0.13 0.39 1.49 -2.23 0.00 0.00 178.31 177.90 1r2d h GLU 124 N -0.21 0.66 -0.80 1.11 4.81 0.05 -0.32 114.58 119.88 1r2d h GLU 124 Ca -0.01 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 1r2d h GLU 124 Cb 0.17 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 1r2d h GLU 124 CO 0.02 0.43 0.36 0.37 -0.73 0.00 0.00 179.01 179.46 1r2d h GLN 125 N 0.68 1.16 -0.13 1.92 5.75 -0.76 -0.85 115.11 122.87 1r2d h GLN 125 Ca 0.36 -0.19 -0.12 0.00 -0.15 0.00 0.00 58.65 58.54 1r2d h GLN 125 Cb 0.33 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 28.68 1r2d h GLN 125 CO -0.25 0.92 -0.40 0.28 -2.65 0.00 0.00 178.83 176.73 1r2d h VAL 126 N 1.14 1.36 -0.32 2.39 2.07 -0.84 -3.15 116.25 118.90 1r2d h VAL 126 Ca 0.27 -1.69 -0.02 0.00 0.82 0.00 0.00 66.70 66.08 1r2d h VAL 126 Cb 0.16 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 1r2d h VAL 126 CO -0.03 0.51 0.13 0.58 0.02 0.00 0.00 177.57 178.78 1r2d h VAL 127 N 0.12 1.13 -0.53 2.57 2.07 -0.95 -1.04 116.25 119.61 1r2d h VAL 127 Ca -0.01 -0.39 0.15 0.00 0.82 0.00 0.00 66.70 67.27 1r2d h VAL 127 Cb 1.02 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1r2d h VAL 127 CO 0.09 0.15 0.42 0.78 0.02 0.00 0.00 177.57 179.03 1r2d h ASN 128 N 0.44 0.00 -0.39 0.57 -0.26 -1.11 -0.56 115.58 114.28 1r2d h ASN 128 Ca 0.11 0.00 0.06 0.00 -0.56 0.00 0.00 56.30 55.91 1r2d h ASN 128 Cb 0.09 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.33 1r2d h ASN 128 CO -0.01 0.00 0.26 -0.33 -1.06 0.00 0.00 177.43 176.29 1r2d h GLU 129 N 0.00 0.27 0.00 0.81 4.39 -1.28 -0.17 114.58 118.60 1r2d h GLU 129 Ca 0.25 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.92 1r2d h GLU 129 Cb 1.09 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.68 1r2d h GLU 129 CO -0.00 0.18 -0.06 -0.07 -1.16 0.00 0.00 179.01 177.90 1r2d h LEU 130 N 0.28 0.00 -3.27 1.33 3.38 -1.26 -3.21 115.31 112.56 1r2d h LEU 130 Ca 0.17 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.98 1r2d h LEU 130 Cb 0.32 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.96 1r2d h LEU 130 CO -0.03 0.06 -0.29 0.49 0.09 0.00 0.00 178.44 178.75 1r2d n PHE 131 N -3.20 0.89 0.28 1.13 3.72 -0.09 -4.71 117.46 115.48 1r2d n PHE 131 Ca 0.00 -1.67 0.14 0.00 -0.05 0.00 0.00 57.45 55.87 1r2d n PHE 131 Cb 0.32 -0.41 0.79 0.00 -0.94 0.00 0.00 39.48 39.24 1r2d n PHE 131 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 1r2d h ARG 132 N 1.14 0.00 -0.36 -1.08 0.11 -1.53 -0.70 114.38 111.97 1r2d h ARG 132 Ca 0.16 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.21 1r2d h ARG 132 Cb 1.38 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.44 1r2d h ARG 132 CO 0.31 0.09 0.02 -0.25 0.10 0.00 0.00 179.97 180.23 1r2d n ASP 133 N -3.57 4.14 0.00 0.08 8.00 -1.26 -5.08 116.55 118.86 1r2d n ASP 133 Ca -0.02 -3.09 0.00 0.00 0.71 0.00 0.00 54.79 52.39 1r2d n ASP 133 Cb 0.21 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.72 1r2d n ASP 133 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r2d n GLY 134 N -0.36 -3.27 3.88 0.44 0.00 -0.27 -4.98 105.19 100.63 1r2d n GLY 134 Ca 0.25 -1.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.11 1r2d n GLY 134 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r2d s VAL 135 N -0.92 5.01 0.22 1.61 1.01 -1.26 -4.59 120.40 121.47 1r2d s VAL 135 Ca 0.00 0.39 -0.20 0.00 0.00 0.00 0.00 61.98 62.17 1r2d s VAL 135 Cb 0.00 -3.63 0.03 0.00 0.00 0.00 0.00 36.38 32.78 1r2d s VAL 135 CO 0.00 0.03 0.60 0.54 0.00 0.00 0.00 175.10 176.27 1r2d s ASN 136 N -2.25 -0.32 0.24 3.32 2.20 -1.26 -5.03 114.94 111.83 1r2d s ASN 136 Ca 0.43 -0.44 -0.06 0.00 -0.94 0.00 0.00 52.86 51.85 1r2d s ASN 136 Cb -0.12 0.63 0.34 0.00 -2.00 0.00 0.00 41.25 40.10 1r2d s ASN 136 CO 0.22 -1.13 1.82 -0.50 -2.94 0.00 0.00 177.10 174.56 1r2d h TRP 137 N 2.09 0.86 -0.69 1.54 4.06 -1.99 -1.81 115.95 120.00 1r2d h TRP 137 Ca -0.27 0.03 -0.03 0.00 2.06 0.00 0.00 58.89 60.68 1r2d h TRP 137 Cb 1.27 -0.27 -0.03 0.00 -1.00 0.00 0.00 29.16 29.13 1r2d h TRP 137 CO 0.35 0.39 0.32 0.78 -3.56 0.00 0.00 178.44 176.72 1r2d h GLY 138 N 0.82 1.07 2.00 1.49 0.00 -1.99 -1.23 103.07 105.23 1r2d h GLY 138 Ca 0.37 -0.52 -0.12 0.00 0.00 0.00 0.00 47.33 47.05 1r2d h GLY 138 CO -0.21 0.50 -0.59 3.21 0.00 0.00 0.00 176.54 179.44 1r2d h ARG 139 N 0.99 0.00 -0.36 4.80 -0.00 -1.80 -0.37 114.38 117.64 1r2d h ARG 139 Ca 0.24 -0.00 -0.13 0.00 -0.50 0.00 0.00 59.98 59.59 1r2d h ARG 139 Cb 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.08 1r2d h ARG 139 CO -0.03 0.59 -0.29 0.82 0.00 0.00 0.00 179.97 181.06 1r2d h ILE 140 N 0.00 1.28 -0.50 2.04 2.04 -0.81 -0.81 117.51 120.76 1r2d h ILE 140 Ca -0.01 -1.45 -0.03 0.00 1.00 0.00 0.00 64.86 64.37 1r2d h ILE 140 Cb 1.05 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 38.52 1r2d h ILE 140 CO 0.08 0.48 0.20 0.58 0.00 0.00 0.00 178.15 179.49 1r2d h VAL 141 N 0.63 1.21 -0.90 1.67 2.07 -1.00 -1.77 116.25 118.16 1r2d h VAL 141 Ca 0.07 -0.65 0.03 0.00 0.82 0.00 0.00 66.70 66.97 1r2d h VAL 141 Cb 0.87 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.29 1r2d h VAL 141 CO 0.08 0.25 0.59 0.00 0.02 0.00 0.00 177.57 178.50 1r2d h ALA 142 N 1.05 1.42 -0.39 1.67 0.00 -0.88 -0.39 119.26 121.74 1r2d h ALA 142 Ca 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1r2d h ALA 142 Cb 0.19 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1r2d h ALA 142 CO -0.01 0.50 0.26 0.35 0.00 0.00 0.00 179.25 180.34 1r2d h PHE 143 N 1.14 0.49 -0.30 0.00 3.57 -0.58 0.27 116.94 121.53 1r2d h PHE 143 Ca 0.35 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.85 1r2d h PHE 143 Cb -0.00 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.56 1r2d h PHE 143 CO -0.00 0.31 0.13 0.74 -2.23 0.00 0.00 178.31 177.26 1r2d h PHE 144 N 0.53 0.46 -0.85 0.41 0.04 -0.65 -1.81 116.94 115.06 1r2d h PHE 144 Ca 0.14 -0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.89 1r2d h PHE 144 Cb -0.06 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 37.91 1r2d h PHE 144 CO -0.05 0.44 0.56 1.03 -0.60 0.00 0.00 178.31 179.69 1r2d h SER 145 N 0.34 0.96 -0.37 2.17 0.87 -0.73 -1.11 113.55 115.70 1r2d h SER 145 Ca 0.10 -0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.66 1r2d h SER 145 Cb 0.17 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.86 1r2d h SER 145 CO -0.01 0.69 0.19 0.15 -0.53 0.00 0.00 176.83 177.32 1r2d h PHE 146 N 1.14 0.36 -0.92 2.24 3.57 -0.26 0.32 116.94 123.39 1r2d h PHE 146 Ca 0.32 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.83 1r2d h PHE 146 Cb -0.11 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.48 1r2d h PHE 146 CO -0.01 0.20 0.58 0.78 -2.23 0.00 0.00 178.31 177.63 1r2d h GLY 147 N 0.40 1.31 1.00 2.40 0.00 -0.68 0.49 103.07 107.99 1r2d h GLY 147 Ca 0.15 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1r2d h GLY 147 CO -0.09 0.50 0.33 -1.33 0.00 0.00 0.00 176.54 175.95 1r2d h GLY 148 N 1.25 0.73 1.02 4.60 0.00 -0.65 -0.96 103.07 109.06 1r2d h GLY 148 Ca 0.33 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.38 1r2d h GLY 148 CO -0.07 0.28 0.57 0.00 0.00 0.00 0.00 176.54 177.32 1r2d h ALA 149 N 1.18 1.19 -0.64 3.60 0.00 -0.07 -0.88 119.26 123.64 1r2d h ALA 149 Ca 0.19 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1r2d h ALA 149 Cb -0.06 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.33 1r2d h ALA 149 CO -0.04 0.64 0.13 -0.07 0.00 0.00 0.00 179.25 179.92 1r2d h LEU 150 N 1.29 0.96 -0.33 0.00 3.38 -0.48 -1.12 115.31 119.02 1r2d h LEU 150 Ca 0.34 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1r2d h LEU 150 Cb -0.06 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.42 1r2d h LEU 150 CO -0.06 0.94 -0.02 0.00 0.09 0.00 0.00 178.44 179.39 1r2d h VAL 152 N 0.38 1.11 -0.66 0.00 2.07 -1.00 -0.85 116.25 117.30 1r2d h VAL 152 Ca 0.09 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1r2d h VAL 152 Cb 0.48 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1r2d h VAL 152 CO 0.02 0.13 0.42 -0.08 0.02 0.00 0.00 177.57 178.08 1r2d h GLU 153 N 0.70 0.89 -0.76 1.57 4.81 -1.10 -0.49 114.58 120.20 1r2d h GLU 153 Ca 0.20 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1r2d h GLU 153 Cb -0.05 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.10 1r2d h GLU 153 CO -0.06 0.61 0.41 0.77 -0.73 0.00 0.00 179.01 180.01 1r2d h SER 154 N 0.90 0.95 -0.48 1.04 0.02 -0.49 -1.66 113.55 113.83 1r2d h SER 154 Ca 0.24 -0.10 -0.11 0.00 -0.84 0.00 0.00 61.79 60.98 1r2d h SER 154 Cb -0.07 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.21 1r2d h SER 154 CO -0.05 0.78 -0.12 0.58 -1.14 0.00 0.00 176.83 176.88 1r2d h VAL 155 N 1.05 1.27 0.00 2.27 2.07 -0.72 0.30 116.25 122.50 1r2d h VAL 155 Ca 0.27 -1.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 1r2d h VAL 155 Cb 0.04 1.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1r2d h VAL 155 CO -0.04 0.43 -0.05 0.44 0.02 0.00 0.00 177.57 178.37 1r2d h ASP 156 N 0.78 0.00 -0.62 0.57 3.32 -0.71 -0.34 116.42 119.42 1r2d h ASP 156 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1r2d h ASP 156 Cb 0.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1r2d h ASP 156 CO 0.05 0.05 0.00 0.29 -1.72 0.00 0.00 179.24 177.91 1r2d n LYS 157 N -3.74 2.55 -3.56 3.56 5.02 -0.66 -4.93 118.16 116.40 1r2d n LYS 157 Ca -0.02 -2.26 -0.22 0.00 -2.02 0.00 0.00 58.31 53.78 1r2d n LYS 157 Cb 0.15 -1.52 0.08 0.00 -0.02 0.00 0.00 35.03 33.72 1r2d n LYS 157 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1r2d n GLU 158 N 1.28 -7.64 -2.40 1.97 -0.58 -0.14 -4.91 120.64 108.22 1r2d n GLU 158 Ca 0.21 0.83 -0.18 0.00 -0.42 0.00 0.00 57.16 57.60 1r2d n GLU 158 Cb 0.56 -5.88 0.02 0.00 -0.57 0.00 0.00 31.44 25.56 1r2d n GLU 158 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1r2d n MET 159 N -4.79 2.84 0.24 3.49 2.81 0.10 -4.84 117.12 116.96 1r2d n MET 159 Ca -0.07 -4.00 0.13 0.00 -1.81 0.00 0.00 57.70 51.96 1r2d n MET 159 Cb 0.59 -1.99 0.72 0.00 -0.71 0.00 0.00 33.22 31.83 1r2d n MET 159 CO 0.00 0.00 0.00 -0.56 1.51 0.00 0.00 175.97 176.92 1r2d h GLN 160 N 2.49 0.00 0.00 0.03 -0.00 -1.85 0.17 115.11 115.95 1r2d h GLN 160 Ca 0.18 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.81 1r2d h GLN 160 Cb 1.26 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.74 1r2d h GLN 160 CO 0.63 0.00 -0.09 -0.24 -0.00 0.00 0.00 178.83 179.14 1r2d h VAL 161 N 0.00 0.58 0.00 1.86 3.04 -1.91 -2.46 116.25 117.36 1r2d h VAL 161 Ca 0.00 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.31 1r2d h VAL 161 Cb 0.27 1.24 0.00 0.00 -2.01 0.00 0.00 31.29 30.79 1r2d h VAL 161 CO 0.00 0.09 0.00 -0.07 -1.01 0.00 0.00 177.57 176.58 1r2d h LEU 162 N 0.00 0.00 -0.17 3.16 3.38 -1.33 -3.36 115.31 116.99 1r2d h LEU 162 Ca -0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1r2d h LEU 162 Cb 0.23 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1r2d h LEU 162 CO 0.01 0.00 -0.06 0.58 0.09 0.00 0.00 178.44 179.06 1r2d h VAL 163 N 0.00 0.79 0.00 1.22 2.07 -1.61 0.10 116.25 118.82 1r2d h VAL 163 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1r2d h VAL 163 Cb 0.77 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1r2d h VAL 163 CO 0.00 0.00 -0.29 0.77 0.02 0.00 0.00 177.57 178.07 1r2d h SER 164 N -0.03 0.00 -0.27 0.57 4.64 -1.76 -1.63 113.55 115.07 1r2d h SER 164 Ca 0.09 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.31 1r2d h SER 164 Cb 0.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1r2d h SER 164 CO -0.19 0.29 -0.18 -0.09 -0.87 0.00 0.00 176.83 175.78 1r2d h ARG 165 N 0.00 0.61 -0.84 4.77 2.43 -1.44 -1.98 114.38 117.93 1r2d h ARG 165 Ca -0.00 -0.29 -0.03 0.00 -0.81 0.00 0.00 59.98 58.85 1r2d h ARG 165 Cb 0.53 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.04 1r2d h ARG 165 CO 0.04 0.87 0.42 0.82 -1.51 0.00 0.00 179.97 180.61 1r2d h ILE 166 N 0.34 1.25 -0.75 1.20 2.04 -0.55 -0.13 117.51 120.92 1r2d h ILE 166 Ca 0.05 -0.69 0.01 0.00 1.00 0.00 0.00 64.86 65.24 1r2d h ILE 166 Cb 0.72 0.17 -0.04 0.00 -0.74 0.00 0.00 36.82 36.93 1r2d h ILE 166 CO 0.05 0.30 0.49 0.00 0.00 0.00 0.00 178.15 178.99 1r2d h ALA 167 N 1.22 0.96 -0.38 1.87 0.00 -1.16 0.47 119.26 122.25 1r2d h ALA 167 Ca 0.29 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 1r2d h ALA 167 Cb 0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1r2d h ALA 167 CO -0.04 0.35 -0.05 0.00 0.00 0.00 0.00 179.25 179.51 1r2d h ALA 168 N 1.28 0.51 -0.65 0.00 0.00 -0.72 -1.97 119.26 117.72 1r2d h ALA 168 Ca 0.28 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1r2d h ALA 168 Cb -0.09 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1r2d h ALA 168 CO -0.07 0.34 0.40 -1.49 0.00 0.00 0.00 179.25 178.43 1r2d h TRP 169 N 0.51 0.84 -0.54 0.00 6.55 -0.70 -1.32 115.95 121.30 1r2d h TRP 169 Ca 0.10 0.01 -0.03 0.00 0.95 0.00 0.00 58.89 59.91 1r2d h TRP 169 Cb 0.55 -0.28 -0.02 0.00 -0.86 0.00 0.00 29.16 28.55 1r2d h TRP 169 CO 0.05 0.56 0.21 0.52 -1.05 0.00 0.00 178.44 178.72 1r2d h MET 170 N 0.88 0.80 -0.83 0.49 2.86 -0.77 -0.44 114.93 117.93 1r2d h MET 170 Ca 0.23 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.70 1r2d h MET 170 Cb -0.05 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 31.44 1r2d h MET 170 CO -0.05 0.71 0.41 0.00 1.06 0.00 0.00 176.91 179.04 1r2d h ALA 171 N 1.06 1.06 -0.12 6.32 0.00 -1.02 0.16 119.26 126.72 1r2d h ALA 171 Ca 0.18 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1r2d h ALA 171 Cb 0.21 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1r2d h ALA 171 CO -0.01 0.62 0.05 1.15 0.00 0.00 0.00 179.25 181.05 1r2d h THR 172 N 1.17 1.15 -0.65 0.00 2.02 -0.98 -1.22 112.91 114.40 1r2d h THR 172 Ca 0.29 -0.45 -0.04 0.00 0.77 0.00 0.00 66.41 66.98 1r2d h THR 172 Cb 0.10 1.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 1r2d h THR 172 CO -0.04 0.14 0.26 0.22 0.37 0.00 0.00 175.52 176.47 1r2d h TYR 173 N 0.04 0.98 0.21 3.16 5.03 -0.78 -0.82 116.97 124.80 1r2d h TYR 173 Ca 0.04 -0.07 -0.01 0.00 2.58 0.00 0.00 58.73 61.27 1r2d h TYR 173 Cb 0.17 -0.29 0.00 0.00 1.55 0.00 0.00 36.73 38.16 1r2d h TYR 173 CO -0.02 0.77 -0.10 1.25 -1.32 0.00 0.00 178.16 178.74 1r2d h LEU 174 N 0.91 -0.24 -1.01 2.82 6.46 -0.57 0.57 115.31 124.24 1r2d h LEU 174 Ca 0.22 -0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 57.92 1r2d h LEU 174 Cb 0.20 0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.17 1r2d h LEU 174 CO -0.02 -0.15 0.18 0.78 -0.62 0.00 0.00 178.44 178.62 1r2d h ASN 175 N -0.31 0.83 0.00 1.25 2.35 -1.12 0.14 115.58 118.73 1r2d h ASN 175 Ca -0.03 -0.14 -0.00 0.00 -0.55 0.00 0.00 56.30 55.59 1r2d h ASN 175 Cb 0.24 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1r2d h ASN 175 CO 0.05 0.78 -0.00 -0.78 -1.65 0.00 0.00 177.43 175.83 1r2d h ASP 176 N 0.87 -0.00 0.17 5.81 3.58 -1.03 -3.39 116.42 122.44 1r2d h ASP 176 Ca 0.20 -0.52 -0.28 0.00 0.42 0.00 0.00 57.03 56.85 1r2d h ASP 176 Cb 0.25 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.25 1r2d h ASP 176 CO -0.01 0.75 -2.10 1.41 -2.88 0.00 0.00 179.24 176.42 1r2d n HIS 177 N -4.70 0.30 -0.11 0.28 8.25 0.18 -4.68 115.22 114.75 1r2d n HIS 177 Ca -0.05 0.10 -0.15 0.00 -0.26 0.00 0.00 57.72 57.37 1r2d n HIS 177 Cb 0.25 -0.98 -0.14 0.00 1.12 0.00 0.00 29.99 30.24 1r2d n HIS 177 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1r2d n LEU 178 N -2.75 1.68 -0.24 2.41 4.77 -0.73 -4.48 117.00 117.66 1r2d n LEU 178 Ca -0.23 -0.04 0.09 0.00 -0.03 0.00 0.00 56.01 55.79 1r2d n LEU 178 Cb 1.02 -0.31 0.35 0.00 -2.33 0.00 0.00 43.42 42.15 1r2d n LEU 178 CO 0.44 0.74 1.22 -0.33 -1.33 0.00 0.00 177.39 178.13 1r2d h GLU 179 N 0.00 0.74 -0.36 3.23 4.39 -0.94 -1.19 114.58 120.46 1r2d h GLU 179 Ca -0.55 -0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.17 1r2d h GLU 179 Cb 2.05 -0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 30.48 1r2d h GLU 179 CO -0.03 0.49 0.05 -1.35 -1.16 0.00 0.00 179.01 177.01 1r2d h PRO 180 N 0.77 0.16 -0.26 2.33 0.11 -1.82 0.20 132.00 133.49 1r2d h PRO 180 Ca 0.38 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.41 1r2d h PRO 180 Cb 0.46 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1r2d h PRO 180 CO -0.15 0.10 -0.13 2.35 -0.21 0.00 0.00 178.00 179.96 1r2d h TRP 181 N 0.16 0.62 -0.02 0.65 7.01 -1.68 -2.51 115.95 120.18 1r2d h TRP 181 Ca 0.18 -0.16 0.03 0.00 2.11 0.00 0.00 58.89 61.05 1r2d h TRP 181 Cb 0.22 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 27.10 1r2d h TRP 181 CO -0.21 0.80 -0.18 0.82 -2.79 0.00 0.00 178.44 176.87 1r2d h ILE 182 N 0.27 0.55 0.00 2.65 2.04 -0.83 -0.96 117.51 121.23 1r2d h ILE 182 Ca 0.06 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.89 1r2d h ILE 182 Cb 0.64 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1r2d h ILE 182 CO 0.04 0.00 -0.11 1.56 0.00 0.00 0.00 178.15 179.63 1r2d h GLN 183 N -0.29 0.00 0.00 2.37 1.08 -0.64 0.12 115.11 117.74 1r2d h GLN 183 Ca 0.06 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1r2d h GLN 183 Cb 0.37 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 1r2d h GLN 183 CO -0.19 0.11 -0.08 1.49 -0.95 0.00 0.00 178.83 179.22 1r2d h GLU 184 N 0.00 0.00 -0.41 1.46 4.57 -0.89 -3.34 114.58 115.96 1r2d h GLU 184 Ca -0.00 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 57.91 1r2d h GLU 184 Cb 0.25 0.00 -0.18 0.00 -0.16 0.00 0.00 28.75 28.65 1r2d h GLU 184 CO 0.01 0.00 -0.34 0.09 -1.18 0.00 0.00 179.01 177.60 1r2d n ASN 185 N -2.69 3.31 0.00 1.04 4.13 -0.44 -4.93 115.26 115.68 1r2d n ASN 185 Ca 0.04 -3.82 0.00 0.00 1.68 0.00 0.00 54.58 52.49 1r2d n ASN 185 Cb 0.49 -0.55 0.00 0.00 -1.54 0.00 0.00 39.78 38.18 1r2d n ASN 185 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1r2d n GLY 186 N -0.99 2.65 1.95 7.41 0.00 -1.17 -4.81 105.19 110.23 1r2d n GLY 186 Ca 0.35 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.38 1r2d n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r2d n GLY 187 N -1.08 -2.16 0.26 -0.02 0.00 0.30 -3.62 105.19 98.87 1r2d n GLY 187 Ca 0.00 -1.46 0.18 0.00 0.00 0.00 0.00 46.02 44.74 1r2d n GLY 187 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1r2d h TRP 188 N -0.12 0.00 -0.62 1.61 4.06 -1.95 -1.70 115.95 117.23 1r2d h TRP 188 Ca 0.00 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.93 1r2d h TRP 188 Cb 0.12 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.25 1r2d h TRP 188 CO 0.00 0.00 0.28 -0.44 -3.56 0.00 0.00 178.44 174.72 1r2d h ASP 189 N 0.00 0.82 -0.02 -3.49 3.32 -1.98 -0.99 116.42 114.08 1r2d h ASP 189 Ca 0.00 -0.14 -0.10 0.00 0.02 0.00 0.00 57.03 56.81 1r2d h ASP 189 Cb 0.06 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1r2d h ASP 189 CO 0.00 0.74 -0.27 0.74 -1.72 0.00 0.00 179.24 178.73 1r2d h THR 190 N 0.85 1.27 0.15 0.35 2.02 -1.37 -0.92 112.91 115.26 1r2d h THR 190 Ca 0.21 -1.29 -0.01 0.00 0.77 0.00 0.00 66.41 66.09 1r2d h THR 190 Cb 0.15 1.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.95 1r2d h THR 190 CO -0.02 0.41 -0.07 0.15 0.37 0.00 0.00 175.52 176.35 1r2d h PHE 191 N 0.40 -0.19 -0.37 3.16 3.57 -1.35 0.46 116.94 122.62 1r2d h PHE 191 Ca 0.06 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.57 1r2d h PHE 191 Cb 0.69 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 1r2d h PHE 191 CO 0.02 -0.09 0.21 0.28 -2.23 0.00 0.00 178.31 176.50 1r2d h VAL 192 N -0.23 1.02 -0.44 1.41 2.07 -1.00 0.41 116.25 119.49 1r2d h VAL 192 Ca -0.02 -0.14 0.07 0.00 0.82 0.00 0.00 66.70 67.42 1r2d h VAL 192 Cb 0.18 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1r2d h VAL 192 CO 0.03 0.08 0.30 -0.08 0.02 0.00 0.00 177.57 177.92 1r2d h GLU 193 N 0.42 0.31 0.07 1.57 4.81 -0.94 2.04 114.58 122.86 1r2d h GLU 193 Ca 0.15 -0.02 -0.31 0.00 -0.13 0.00 0.00 59.36 59.05 1r2d h GLU 193 Cb 0.02 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1r2d h GLU 193 CO -0.08 0.21 -1.68 1.25 -0.73 0.00 0.00 179.01 177.97 1r2d h LEU 194 N 0.32 0.22 0.00 1.64 5.85 0.07 -3.41 115.31 120.01 1r2d h LEU 194 Ca 0.19 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.51 1r2d h LEU 194 Cb 0.36 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1r2d h LEU 194 CO -0.04 1.35 -0.64 -1.22 -0.34 0.00 0.00 178.44 177.55 1r2d n TYR 195 N -3.30 0.00 0.00 1.25 4.02 0.14 -5.08 117.16 114.19 1r2d n TYR 195 Ca -0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.70 1r2d n TYR 195 Cb 1.04 -0.04 0.00 0.00 -0.02 0.00 0.00 39.34 40.32 1r2d n TYR 195 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26