#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ouh s VAL 2 N 0.00 4.42 0.58 3.15 1.01 -1.26 -1.03 120.40 127.27 1ouh s VAL 2 Ca 0.00 -0.98 -0.17 0.00 0.00 0.00 0.00 61.98 60.83 1ouh s VAL 2 Cb 0.00 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 1ouh s VAL 2 CO 0.00 -0.27 1.08 -0.36 0.00 0.00 0.00 175.10 175.55 1ouh s PHE 3 N 1.52 2.84 0.32 5.22 0.08 -0.35 -5.00 117.98 122.60 1ouh s PHE 3 Ca 0.01 1.54 -0.07 0.00 0.12 0.00 0.00 56.93 58.53 1ouh s PHE 3 Cb -0.20 -3.11 -0.06 0.00 -0.57 0.00 0.00 43.02 39.08 1ouh s PHE 3 CO 0.06 -1.29 0.62 -1.21 -0.10 0.00 0.00 175.22 173.30 1ouh s GLU 4 N -3.78 3.70 0.08 0.44 2.02 -1.26 -4.86 118.70 115.04 1ouh s GLU 4 Ca 0.67 0.19 -0.22 0.00 0.02 0.00 0.00 54.97 55.63 1ouh s GLU 4 Cb -0.19 -2.56 -0.08 0.00 0.10 0.00 0.00 34.13 31.40 1ouh s GLU 4 CO 0.33 0.15 1.36 -0.09 0.02 0.00 0.00 175.26 177.03 1ouh h ARG 5 N 1.67 -0.31 0.00 1.61 2.43 -1.96 -1.40 114.38 116.41 1ouh h ARG 5 Ca -0.47 0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 58.66 1ouh h ARG 5 Cb 1.19 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 1ouh h ARG 5 CO 0.66 -0.21 -0.26 0.00 -1.51 0.00 0.00 179.97 178.65 1ouh h GLU 7 N 0.00 0.11 -0.60 0.00 4.81 -1.86 -1.51 114.58 115.54 1ouh h GLU 7 Ca -0.00 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1ouh h GLU 7 Cb 0.49 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 1ouh h GLU 7 CO 0.03 0.12 0.27 1.25 -0.73 0.00 0.00 179.01 179.96 1ouh h LEU 8 N 0.07 0.79 -0.55 1.64 5.85 -0.72 -2.13 115.31 120.27 1ouh h LEU 8 Ca 0.03 -0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.66 1ouh h LEU 8 Cb 0.04 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.81 1ouh h LEU 8 CO -0.01 0.72 0.27 0.00 -0.34 0.00 0.00 178.44 179.08 1ouh h ALA 9 N 1.11 0.71 -0.51 1.25 0.00 -1.00 0.24 119.26 121.07 1ouh h ALA 9 Ca 0.20 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 1ouh h ALA 9 Cb 0.14 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1ouh h ALA 9 CO -0.02 -0.09 -0.13 0.00 0.00 0.00 0.00 179.25 179.01 1ouh h ARG 10 N 0.51 0.97 -0.48 0.00 3.08 -1.12 -2.20 114.38 115.13 1ouh h ARG 10 Ca 0.25 -0.36 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 1ouh h ARG 10 Cb 0.20 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1ouh h ARG 10 CO -0.19 1.03 0.17 1.15 -1.07 0.00 0.00 179.97 181.05 1ouh h THR 11 N 0.86 1.22 -0.61 2.04 2.02 -0.78 -2.32 112.91 115.33 1ouh h THR 11 Ca 0.13 -0.71 -0.05 0.00 0.77 0.00 0.00 66.41 66.55 1ouh h THR 11 Cb 0.68 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.85 1ouh h THR 11 CO 0.05 0.26 0.20 -0.07 0.37 0.00 0.00 175.52 176.33 1ouh h LEU 12 N 0.64 0.88 -0.75 2.58 3.38 -0.86 -2.04 115.31 119.14 1ouh h LEU 12 Ca 0.16 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1ouh h LEU 12 Cb 0.24 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1ouh h LEU 12 CO -0.01 0.85 0.47 0.50 0.09 0.00 0.00 178.44 180.34 1ouh h LYS 13 N 0.87 1.00 0.00 1.13 3.64 -1.23 -1.87 116.57 120.11 1ouh h LYS 13 Ca 0.20 -0.08 -0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1ouh h LYS 13 Cb 0.27 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1ouh h LYS 13 CO -0.01 0.69 -0.26 -0.09 -2.27 0.00 0.00 179.45 177.51 1ouh h ARG 14 N 1.02 0.00 -0.08 1.90 2.43 -1.18 -1.36 114.38 117.11 1ouh h ARG 14 Ca 0.27 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1ouh h ARG 14 Cb -0.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 1ouh h ARG 14 CO -0.05 0.26 0.00 1.28 -1.51 0.00 0.00 179.97 179.95 1ouh n LEU 15 N -4.07 0.73 -0.68 3.80 4.77 -0.76 -4.92 117.00 115.88 1ouh n LEU 15 Ca -0.02 -0.31 -0.05 0.00 -0.03 0.00 0.00 56.01 55.60 1ouh n LEU 15 Cb 0.33 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1ouh n LEU 15 CO 0.36 0.16 -0.03 0.61 -1.33 0.00 0.00 177.39 177.16 1ouh n GLY 16 N 0.92 0.28 0.13 -0.72 0.00 -0.51 -4.97 105.19 100.32 1ouh n GLY 16 Ca 0.14 -0.64 0.08 0.00 0.00 0.00 0.00 46.02 45.60 1ouh n GLY 16 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1ouh h MET 17 N -0.14 0.00 -6.14 1.61 2.86 -1.58 -3.41 114.93 108.13 1ouh h MET 17 Ca -0.11 0.00 -0.58 0.00 -2.06 0.00 0.00 59.70 56.95 1ouh h MET 17 Cb 1.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.73 1ouh h MET 17 CO 0.13 0.12 1.37 0.34 1.06 0.00 0.00 176.91 179.93 1ouh s ASP 18 N -5.76 5.67 0.00 1.22 2.15 -1.26 -1.78 116.67 116.91 1ouh s ASP 18 Ca 0.01 1.48 0.00 0.00 0.43 0.00 0.00 52.55 54.47 1ouh s ASP 18 Cb 0.08 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.18 1ouh s ASP 18 CO 0.77 -1.86 0.00 0.61 -0.17 0.00 0.00 175.17 174.52 1ouh n GLY 19 N 5.57 0.62 3.66 2.66 0.00 0.57 -4.89 105.19 113.39 1ouh n GLY 19 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 1ouh n GLY 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ouh s TYR 20 N -2.22 1.34 -1.39 1.61 5.04 -0.73 -1.03 117.35 119.97 1ouh s TYR 20 Ca 0.00 -0.43 -0.08 0.00 -2.44 0.00 0.00 57.07 54.12 1ouh s TYR 20 Cb 0.00 -4.24 0.05 0.00 0.35 0.00 0.00 41.96 38.13 1ouh s TYR 20 CO 0.00 -5.52 0.57 0.54 -1.34 0.00 0.00 175.55 169.81 1ouh n ARG 21 N 7.42 -4.05 -0.97 4.97 5.12 -1.26 -0.70 116.66 127.20 1ouh n ARG 21 Ca 0.20 0.61 0.00 0.00 -1.93 0.00 0.00 57.85 56.73 1ouh n ARG 21 Cb 0.41 -5.38 0.00 0.00 -1.16 0.00 0.00 32.46 26.32 1ouh n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ouh n GLY 22 N -1.33 0.57 3.53 -0.13 0.00 -0.20 -5.01 105.19 102.63 1ouh n GLY 22 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 1ouh n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ouh s ILE 23 N -2.21 5.23 0.67 -0.61 1.01 0.12 -4.89 121.20 120.51 1ouh s ILE 23 Ca 0.00 -0.17 -0.15 0.00 0.00 0.00 0.00 60.65 60.33 1ouh s ILE 23 Cb 0.00 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.83 1ouh s ILE 23 CO 0.00 0.04 1.14 -0.94 0.00 0.00 0.00 174.94 175.19 1ouh s SER 24 N 1.72 4.87 0.23 3.58 1.04 -1.26 -0.31 113.70 123.56 1ouh s SER 24 Ca 0.06 2.14 -0.07 0.00 0.48 0.00 0.00 55.95 58.56 1ouh s SER 24 Cb -0.17 -2.57 0.35 0.00 0.10 0.00 0.00 66.02 63.73 1ouh s SER 24 CO 0.10 -1.80 1.77 0.25 0.98 0.00 0.00 173.24 174.55 1ouh h LEU 25 N 0.05 0.43 -2.07 2.42 5.85 -1.90 -0.98 115.31 119.11 1ouh h LEU 25 Ca -0.47 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.37 1ouh h LEU 25 Cb 1.26 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 1ouh h LEU 25 CO 0.53 0.24 0.16 0.00 -0.34 0.00 0.00 178.44 179.03 1ouh h ALA 26 N 1.44 2.11 -0.14 1.25 0.00 -1.92 -0.26 119.26 121.74 1ouh h ALA 26 Ca 0.36 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 55.03 1ouh h ALA 26 Cb 0.40 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.22 1ouh h ALA 26 CO -0.29 -0.27 -0.80 -0.91 0.00 0.00 0.00 179.25 176.98 1ouh h ASN 27 N 0.00 0.95 -0.52 0.00 2.35 -1.51 -1.46 115.58 115.39 1ouh h ASN 27 Ca 0.10 -0.64 -0.08 0.00 -0.55 0.00 0.00 56.30 55.13 1ouh h ASN 27 Cb 0.43 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 1ouh h ASN 27 CO -0.00 1.44 0.03 -0.50 -1.65 0.00 0.00 177.43 176.75 1ouh h TRP 28 N 0.54 1.01 -0.35 1.19 4.06 -1.00 -1.31 115.95 120.09 1ouh h TRP 28 Ca -0.06 -0.15 -0.03 0.00 2.06 0.00 0.00 58.89 60.71 1ouh h TRP 28 Cb 1.44 -0.27 -0.01 0.00 -1.00 0.00 0.00 29.16 29.31 1ouh h TRP 28 CO 0.09 0.89 0.09 0.52 -3.56 0.00 0.00 178.44 176.48 1ouh h MET 29 N 0.88 0.55 -0.86 0.49 2.86 -1.03 -1.57 114.93 116.26 1ouh h MET 29 Ca 0.17 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1ouh h MET 29 Cb 0.47 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.02 1ouh h MET 29 CO 0.02 0.59 0.54 0.00 1.06 0.00 0.00 176.91 179.12 1ouh h LEU 31 N 1.17 -0.25 -1.02 0.00 5.85 -1.04 -2.34 115.31 117.68 1ouh h LEU 31 Ca 0.31 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 1ouh h LEU 31 Cb -0.08 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 1ouh h LEU 31 CO -0.06 -0.11 0.52 0.00 -0.34 0.00 0.00 178.44 178.45 1ouh h ALA 32 N 0.40 1.26 0.08 1.25 0.00 -1.12 0.69 119.26 121.82 1ouh h ALA 32 Ca -0.03 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ouh h ALA 32 Cb 0.28 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1ouh h ALA 32 CO 0.05 0.63 -0.04 -0.22 0.00 0.00 0.00 179.25 179.67 1ouh h LYS 33 N 1.22 -0.10 0.00 0.00 1.63 -1.10 -1.75 116.57 116.46 1ouh h LYS 33 Ca 0.31 0.01 -0.09 0.00 -0.85 0.00 0.00 60.65 60.04 1ouh h LYS 33 Cb -0.04 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.60 1ouh h LYS 33 CO -0.06 -0.06 -0.41 -1.49 -3.45 0.00 0.00 179.45 173.98 1ouh h TRP 34 N -0.11 0.00 0.05 1.91 4.06 -1.21 -1.12 115.95 119.53 1ouh h TRP 34 Ca -0.01 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.83 1ouh h TRP 34 Cb 0.09 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.26 1ouh h TRP 34 CO -0.07 0.41 -0.45 0.93 -3.56 0.00 0.00 178.44 175.70 1ouh h GLU 35 N 0.00 0.21 0.00 0.49 4.39 -0.81 -3.43 114.58 115.44 1ouh h GLU 35 Ca -0.00 -0.30 0.00 0.00 0.34 0.00 0.00 59.36 59.40 1ouh h GLU 35 Cb 1.21 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 1ouh h GLU 35 CO 0.05 1.08 0.00 -1.13 -1.16 0.00 0.00 179.01 177.85 1ouh n SER 36 N -4.35 0.09 -1.26 1.42 3.41 -0.72 -4.86 113.62 107.35 1ouh n SER 36 Ca -0.11 -0.42 -0.09 0.00 -0.26 0.00 0.00 58.87 57.99 1ouh n SER 36 Cb 0.64 0.18 0.01 0.00 -0.26 0.00 0.00 64.21 64.78 1ouh n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ouh n GLY 37 N 0.18 0.10 2.48 5.00 0.00 -0.42 -3.02 105.19 109.51 1ouh n GLY 37 Ca 0.00 -0.44 -0.18 0.00 0.00 0.00 0.00 46.02 45.39 1ouh n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ouh n TYR 38 N -3.87 -1.10 -3.76 1.61 0.53 -1.13 -4.80 117.16 104.65 1ouh n TYR 38 Ca -0.07 0.13 -0.37 0.00 -1.02 0.00 0.00 57.90 56.57 1ouh n TYR 38 Cb 0.56 -3.69 -0.13 0.00 -1.03 0.00 0.00 39.34 35.06 1ouh n TYR 38 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 1ouh s ASN 39 N -2.36 5.09 0.47 7.72 2.47 -1.17 -1.21 114.94 125.95 1ouh s ASN 39 Ca 0.08 -0.47 0.30 0.00 0.42 0.00 0.00 52.86 53.19 1ouh s ASN 39 Cb -0.03 -1.90 1.05 0.00 -1.45 0.00 0.00 41.25 38.92 1ouh s ASN 39 CO 0.09 -0.12 1.85 0.71 -3.72 0.00 0.00 177.10 175.92 1ouh h THR 40 N 5.70 0.00 -0.40 -5.21 1.35 -1.41 -3.15 112.91 109.80 1ouh h THR 40 Ca -0.35 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 64.92 1ouh h THR 40 Cb 1.15 1.56 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 1ouh h THR 40 CO 0.60 0.00 0.00 -2.11 -0.25 0.00 0.00 175.52 173.76 1ouh n ARG 41 N -2.94 2.41 -1.89 4.72 1.85 -1.26 -4.15 116.66 115.40 1ouh n ARG 41 Ca 0.02 -2.14 -0.42 0.00 -1.00 0.00 0.00 57.85 54.31 1ouh n ARG 41 Cb 0.36 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.24 1ouh n ARG 41 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ouh s ALA 42 N -1.49 3.78 0.03 2.89 0.00 -1.20 -4.80 121.76 120.98 1ouh s ALA 42 Ca 0.39 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.81 1ouh s ALA 42 Cb 0.22 -3.63 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 1ouh s ALA 42 CO 0.31 -0.83 -0.09 0.95 0.00 0.00 0.00 175.76 176.10 1ouh s THR 43 N 0.82 0.71 -0.12 0.00 -4.23 -1.26 -0.62 115.64 110.94 1ouh s THR 43 Ca 0.68 -0.82 -0.04 0.00 -1.18 0.00 0.00 61.69 60.34 1ouh s THR 43 Cb -0.45 -0.68 0.05 0.00 1.34 0.00 0.00 72.50 72.76 1ouh s THR 43 CO 0.35 -0.11 0.08 0.21 -0.54 0.00 0.00 174.62 174.62 1ouh s ASN 44 N -1.02 1.79 -0.03 3.99 2.47 -0.48 -4.97 114.94 116.68 1ouh s ASN 44 Ca -0.03 -0.30 -0.25 0.00 0.42 0.00 0.00 52.86 52.71 1ouh s ASN 44 Cb -0.07 -0.17 -0.04 0.00 -1.45 0.00 0.00 41.25 39.52 1ouh s ASN 44 CO 0.01 -0.31 0.77 -0.47 -3.72 0.00 0.00 177.10 173.38 1ouh s TYR 45 N 2.16 3.63 -0.56 0.43 6.14 -1.26 -0.81 117.35 127.07 1ouh s TYR 45 Ca 0.03 1.39 -0.11 0.00 0.64 0.00 0.00 57.07 59.03 1ouh s TYR 45 Cb -0.14 -2.88 0.14 0.00 0.42 0.00 0.00 41.96 39.50 1ouh s TYR 45 CO -0.07 0.10 0.46 -0.80 0.64 0.00 0.00 175.55 175.89 1ouh s ASN 46 N 0.67 5.95 0.42 4.32 0.01 -0.13 -4.93 114.94 121.25 1ouh s ASN 46 Ca 0.41 -2.11 0.10 0.00 -0.71 0.00 0.00 52.86 50.55 1ouh s ASN 46 Cb -0.19 -2.08 0.93 0.00 0.41 0.00 0.00 41.25 40.33 1ouh s ASN 46 CO 0.21 -0.68 2.01 0.00 -1.51 0.00 0.00 177.10 177.13 1ouh h ALA 47 N 8.30 1.86 -0.66 0.60 0.00 -1.96 -0.53 119.26 126.87 1ouh h ALA 47 Ca -0.16 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 54.84 1ouh h ALA 47 Cb 1.06 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.65 1ouh h ALA 47 CO 0.87 0.05 0.27 0.78 0.00 0.00 0.00 179.25 181.22 1ouh h GLY 48 N 0.50 0.96 0.00 0.00 0.00 -1.95 -3.28 103.07 99.31 1ouh h GLY 48 Ca 0.23 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.42 1ouh h GLY 48 CO -0.06 -0.02 0.00 2.09 0.00 0.00 0.00 176.54 178.54 1ouh n ASP 49 N -4.97 1.42 -1.49 0.19 5.75 -1.12 -5.02 116.55 111.31 1ouh n ASP 49 Ca 0.10 -1.70 -0.15 0.00 -0.01 0.00 0.00 54.79 53.03 1ouh n ASP 49 Cb 0.31 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.37 1ouh n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1ouh n ARG 50 N -0.35 -1.13 -3.86 0.11 1.74 -0.22 -4.83 116.66 108.11 1ouh n ARG 50 Ca 0.00 0.83 -0.22 0.00 -0.77 0.00 0.00 57.85 57.69 1ouh n ARG 50 Cb 0.31 -5.08 -0.05 0.00 -1.02 0.00 0.00 32.46 26.63 1ouh n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1ouh s SER 51 N -2.51 4.94 0.01 0.55 1.04 -1.20 -4.46 113.70 112.06 1ouh s SER 51 Ca 0.00 -0.71 0.02 0.00 0.48 0.00 0.00 55.95 55.74 1ouh s SER 51 Cb 0.00 -0.73 -0.01 0.00 0.10 0.00 0.00 66.02 65.38 1ouh s SER 51 CO 0.00 -0.44 -0.07 -0.89 0.98 0.00 0.00 173.24 172.81 1ouh s THR 52 N -2.42 0.56 -0.18 2.02 2.01 -1.26 -0.95 115.64 115.41 1ouh s THR 52 Ca 0.42 -0.50 -0.13 0.00 0.31 0.00 0.00 61.69 61.79 1ouh s THR 52 Cb -0.03 -0.51 -0.05 0.00 0.01 0.00 0.00 72.50 71.92 1ouh s THR 52 CO 0.25 0.02 0.24 -1.81 -0.69 0.00 0.00 174.62 172.63 1ouh s ASP 53 N -0.53 6.34 -0.08 3.53 1.01 0.01 -1.15 116.67 125.79 1ouh s ASP 53 Ca -0.00 0.39 0.04 0.00 0.71 0.00 0.00 52.55 53.69 1ouh s ASP 53 Cb -0.04 -2.15 -0.01 0.00 1.01 0.00 0.00 42.92 41.72 1ouh s ASP 53 CO 0.00 0.11 -0.21 -0.31 0.21 0.00 0.00 175.17 174.97 1ouh s TYR 54 N 0.54 2.58 0.00 4.23 2.02 -0.03 -1.39 117.35 125.30 1ouh s TYR 54 Ca 0.13 -0.74 0.00 0.00 -0.37 0.00 0.00 57.07 56.09 1ouh s TYR 54 Cb -0.12 -1.68 0.00 0.00 -0.40 0.00 0.00 41.96 39.75 1ouh s TYR 54 CO 0.02 -0.23 0.00 0.41 -1.57 0.00 0.00 175.55 174.18 1ouh n GLY 55 N 3.16 -1.88 0.33 0.71 0.00 0.21 -1.44 105.19 106.28 1ouh n GLY 55 Ca -0.18 -1.38 0.07 0.00 0.00 0.00 0.00 46.02 44.53 1ouh n GLY 55 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ouh h ILE 56 N 0.00 1.03 -0.07 -0.61 2.10 -1.71 -1.60 117.51 116.65 1ouh h ILE 56 Ca 0.00 -0.18 0.00 0.00 1.08 0.00 0.00 64.86 65.76 1ouh h ILE 56 Cb 0.00 0.44 0.00 0.00 -1.09 0.00 0.00 36.82 36.17 1ouh h ILE 56 CO 0.00 0.10 0.00 0.49 -1.08 0.00 0.00 178.15 177.66 1ouh n PHE 57 N -4.47 0.06 -3.62 2.19 0.99 -1.26 -3.98 117.46 107.37 1ouh n PHE 57 Ca 0.06 -0.03 -0.28 0.00 -0.00 0.00 0.00 57.45 57.21 1ouh n PHE 57 Cb 0.18 -0.00 0.04 0.00 -1.00 0.00 0.00 39.48 38.70 1ouh n PHE 57 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1ouh n GLN 58 N 1.31 -1.28 -2.84 -1.08 1.13 -0.60 -4.92 117.38 109.10 1ouh n GLN 58 Ca 0.14 0.59 -0.41 0.00 -1.94 0.00 0.00 57.00 55.38 1ouh n GLN 58 Cb 0.58 -4.16 -0.04 0.00 0.11 0.00 0.00 30.24 26.74 1ouh n GLN 58 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1ouh s ILE 59 N -3.37 4.94 0.06 5.09 1.01 -0.52 -4.47 121.20 123.93 1ouh s ILE 59 Ca 0.39 1.81 -0.30 0.00 0.00 0.00 0.00 60.65 62.55 1ouh s ILE 59 Cb -0.14 -4.21 -0.05 0.00 0.01 0.00 0.00 42.46 38.08 1ouh s ILE 59 CO 0.85 0.19 1.00 0.21 0.00 0.00 0.00 174.94 177.20 1ouh s ASN 60 N 0.93 7.38 0.30 3.58 3.84 -1.26 -0.85 114.94 128.86 1ouh s ASN 60 Ca 0.46 1.78 0.24 0.00 0.21 0.00 0.00 52.86 55.54 1ouh s ASN 60 Cb -0.20 -2.58 1.08 0.00 -0.55 0.00 0.00 41.25 39.01 1ouh s ASN 60 CO 0.24 -0.20 1.72 0.77 -2.79 0.00 0.00 177.10 176.83 1ouh h SER 61 N 6.21 0.00 0.35 -4.21 4.64 -1.38 -2.32 113.55 116.85 1ouh h SER 61 Ca -0.42 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.81 1ouh h SER 61 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1ouh h SER 61 CO 0.74 0.00 -0.40 -0.09 -0.87 0.00 0.00 176.83 176.21 1ouh h ARG 62 N 0.00 0.06 0.00 4.77 2.43 -1.83 -3.39 114.38 116.42 1ouh h ARG 62 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1ouh h ARG 62 Cb 0.24 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1ouh h ARG 62 CO 0.00 0.46 -0.75 0.66 -1.51 0.00 0.00 179.97 178.83 1ouh n TYR 63 N -4.05 0.00 -0.07 2.20 4.02 -1.16 -0.38 117.16 117.71 1ouh n TYR 63 Ca -0.02 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.72 1ouh n TYR 63 Cb 0.44 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.62 1ouh n TYR 63 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 1ouh n TRP 64 N -1.89 0.49 -4.15 -0.72 7.02 -0.88 -1.00 117.44 116.32 1ouh n TRP 64 Ca 0.00 0.13 -0.11 0.00 -1.02 0.00 0.00 57.50 56.50 1ouh n TRP 64 Cb 0.37 -1.07 -0.10 0.00 -2.42 0.00 0.00 31.31 28.09 1ouh n TRP 64 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1ouh s ASN 66 N -2.78 6.21 0.00 0.00 2.47 -0.31 -4.55 114.94 115.98 1ouh s ASN 66 Ca 0.08 0.23 0.00 0.00 0.42 0.00 0.00 52.86 53.59 1ouh s ASN 66 Cb 0.03 -2.14 0.00 0.00 -1.45 0.00 0.00 41.25 37.69 1ouh s ASN 66 CO -0.04 0.02 0.62 -0.90 -3.72 0.00 0.00 177.10 173.08 1ouh n ASP 67 N 4.34 1.18 0.00 -4.21 5.68 -1.26 -1.45 116.55 120.83 1ouh n ASP 67 Ca -0.13 -1.31 0.00 0.00 -0.50 0.00 0.00 54.79 52.84 1ouh n ASP 67 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1ouh n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ouh n GLY 68 N -0.16 1.78 0.50 6.12 0.00 -1.26 -4.70 105.19 107.48 1ouh n GLY 68 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1ouh n GLY 68 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ouh n LYS 69 N 0.00 1.34 -3.10 1.61 2.85 -1.26 -4.87 118.16 114.73 1ouh n LYS 69 Ca 0.00 -1.01 -0.40 0.00 -1.05 0.00 0.00 58.31 55.84 1ouh n LYS 69 Cb 0.00 -1.48 -0.06 0.00 -0.65 0.00 0.00 35.03 32.84 1ouh n LYS 69 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1ouh s THR 70 N -2.36 5.00 0.32 0.58 2.01 -1.26 -4.98 115.64 114.95 1ouh s THR 70 Ca 0.23 1.20 -0.29 0.00 0.31 0.00 0.00 61.69 63.15 1ouh s THR 70 Cb 0.19 -3.95 -0.11 0.00 0.01 0.00 0.00 72.50 68.64 1ouh s THR 70 CO 0.49 0.08 1.50 -2.84 -0.69 0.00 0.00 174.62 173.16 1ouh s PRO 71 N 2.12 4.16 -1.43 4.92 0.02 -1.26 -3.76 135.00 139.78 1ouh s PRO 71 Ca 0.29 2.50 -0.07 0.00 0.02 0.00 0.00 61.00 63.73 1ouh s PRO 71 Cb -0.16 -3.02 0.01 0.00 0.02 0.00 0.00 34.50 31.35 1ouh s PRO 71 CO 0.10 -0.51 0.13 0.41 -0.33 0.00 0.00 177.00 176.79 1ouh n GLY 72 N 1.33 -0.25 3.89 0.52 0.00 -1.26 -4.93 105.19 104.49 1ouh n GLY 72 Ca 0.04 0.20 -0.20 0.00 0.00 0.00 0.00 46.02 46.06 1ouh n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ouh s ALA 73 N -4.19 4.01 0.47 4.61 0.00 -1.25 -5.03 121.76 120.39 1ouh s ALA 73 Ca 0.09 -1.66 0.04 0.00 0.00 0.00 0.00 51.96 50.43 1ouh s ALA 73 Cb -0.05 -1.27 -0.03 0.00 0.00 0.00 0.00 23.12 21.76 1ouh s ALA 73 CO 0.96 -0.07 0.04 0.00 0.00 0.00 0.00 175.76 176.69 1ouh s ALA 74 N -2.32 3.80 -0.40 0.00 0.00 0.49 -4.99 121.76 118.34 1ouh s ALA 74 Ca 0.44 -1.18 0.08 0.00 0.00 0.00 0.00 51.96 51.30 1ouh s ALA 74 Cb -0.06 -0.01 0.25 0.00 0.00 0.00 0.00 23.12 23.30 1ouh s ALA 74 CO 0.28 -0.09 0.56 -1.71 0.00 0.00 0.00 175.76 174.80 1ouh n ASN 75 N -1.20 -0.17 0.12 0.00 5.15 -1.19 -3.89 115.26 114.09 1ouh n ASN 75 Ca -0.12 -2.76 0.05 0.00 -0.60 0.00 0.00 54.58 51.15 1ouh n ASN 75 Cb 0.67 -0.36 0.51 0.00 -0.53 0.00 0.00 39.78 40.07 1ouh n ASN 75 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ouh h ALA 76 N 3.99 1.81 -0.00 5.20 0.00 -0.99 -1.20 119.26 128.07 1ouh h ALA 76 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ouh h ALA 76 Cb 0.90 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1ouh h ALA 76 CO 0.45 0.17 -0.04 0.00 0.00 0.00 0.00 179.25 179.82 1ouh n HIS 78 N -1.15 -1.88 -3.97 0.00 -0.00 -0.45 -4.97 115.22 102.79 1ouh n HIS 78 Ca 0.15 0.75 -0.09 0.00 -0.00 0.00 0.00 57.72 58.53 1ouh n HIS 78 Cb 0.24 -4.06 -0.10 0.00 -0.00 0.00 0.00 29.99 26.07 1ouh n HIS 78 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1ouh s LEU 79 N -6.62 2.12 0.38 2.41 1.43 -1.26 -5.08 118.68 112.06 1ouh s LEU 79 Ca 0.12 -0.54 -0.24 0.00 -1.03 0.00 0.00 54.13 52.44 1ouh s LEU 79 Cb -0.04 0.27 -0.09 0.00 0.03 0.00 0.00 46.19 46.36 1ouh s LEU 79 CO 0.83 -0.38 1.01 -0.55 0.23 0.00 0.00 176.35 177.49 1ouh s SER 80 N -1.76 6.92 0.60 2.29 0.15 -1.26 -1.16 113.70 119.47 1ouh s SER 80 Ca -0.11 1.95 0.37 0.00 0.70 0.00 0.00 55.95 58.85 1ouh s SER 80 Cb -0.06 -2.58 1.88 0.00 -1.71 0.00 0.00 66.02 63.56 1ouh s SER 80 CO -0.02 -0.38 2.19 0.00 1.20 0.00 0.00 173.24 176.23 1ouh h SER 82 N 0.00 0.43 0.05 0.00 0.87 -1.91 -1.41 113.55 111.59 1ouh h SER 82 Ca -0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1ouh h SER 82 Cb 0.22 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1ouh h SER 82 CO 0.00 0.27 -0.02 0.00 -0.53 0.00 0.00 176.83 176.56 1ouh h ALA 83 N 1.70 1.52 -0.29 6.23 0.00 -1.69 -1.43 119.26 125.29 1ouh h ALA 83 Ca 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1ouh h ALA 83 Cb 0.35 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1ouh h ALA 83 CO -0.07 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.49 1ouh n LEU 84 N -3.86 1.68 -0.21 0.00 4.77 -0.53 -3.52 117.00 115.32 1ouh n LEU 84 Ca -0.03 -0.84 0.02 0.00 -0.03 0.00 0.00 56.01 55.13 1ouh n LEU 84 Cb 0.11 -0.22 0.05 0.00 -2.33 0.00 0.00 43.42 41.02 1ouh n LEU 84 CO 0.28 0.40 0.51 0.18 -1.33 0.00 0.00 177.39 177.43 1ouh n LEU 85 N 0.36 2.15 -4.84 2.23 4.77 -0.54 -3.35 117.00 117.79 1ouh n LEU 85 Ca 0.10 -1.83 -0.30 0.00 -0.03 0.00 0.00 56.01 53.95 1ouh n LEU 85 Cb 0.28 -0.07 0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1ouh n LEU 85 CO 0.07 0.53 0.72 -1.10 -1.33 0.00 0.00 177.39 176.29 1ouh s GLN 86 N -0.88 2.78 0.15 3.23 -0.21 -1.23 -4.52 119.66 118.98 1ouh s GLN 86 Ca 0.08 0.71 0.01 0.00 0.02 0.00 0.00 55.36 56.17 1ouh s GLN 86 Cb 0.04 -1.99 -0.05 0.00 1.00 0.00 0.00 33.01 32.01 1ouh s GLN 86 CO 0.05 -1.14 1.34 -0.44 -2.12 0.00 0.00 175.29 172.98 1ouh h ASP 87 N -0.74 0.32 -3.18 5.90 5.19 -1.93 -3.42 116.42 118.56 1ouh h ASP 87 Ca -0.45 -0.26 -0.58 0.00 -0.62 0.00 0.00 57.03 55.12 1ouh h ASP 87 Cb 1.23 -0.10 -0.06 0.00 0.18 0.00 0.00 39.33 40.59 1ouh h ASP 87 CO 0.60 1.08 0.84 0.21 -3.12 0.00 0.00 179.24 178.84 1ouh s ASN 88 N -6.97 6.99 -0.02 6.45 3.84 -1.26 -4.93 114.94 119.05 1ouh s ASN 88 Ca -0.03 1.24 0.10 0.00 0.21 0.00 0.00 52.86 54.37 1ouh s ASN 88 Cb 0.10 -2.54 0.31 0.00 -0.55 0.00 0.00 41.25 38.57 1ouh s ASN 88 CO 0.84 -0.79 1.21 2.30 -2.79 0.00 0.00 177.10 177.87 1ouh n ILE 89 N 5.62 0.62 -0.17 -5.21 -5.35 -1.26 -4.45 119.36 109.15 1ouh n ILE 89 Ca 0.12 -0.49 -0.03 0.00 -0.27 0.00 0.00 62.75 62.08 1ouh n ILE 89 Cb 0.46 0.10 0.07 0.00 -1.74 0.00 0.00 39.64 38.53 1ouh n ILE 89 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ouh h ALA 90 N 3.48 0.67 -0.43 -1.28 0.00 -1.95 -0.13 119.26 119.62 1ouh h ALA 90 Ca 0.00 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1ouh h ALA 90 Cb 0.60 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1ouh h ALA 90 CO 0.05 -0.14 -0.19 -0.44 0.00 0.00 0.00 179.25 178.53 1ouh h ASP 91 N 0.45 0.90 -0.95 0.00 3.45 -1.87 -1.64 116.42 116.76 1ouh h ASP 91 Ca 0.25 -0.40 -0.01 0.00 0.43 0.00 0.00 57.03 57.30 1ouh h ASP 91 Cb 0.21 -0.25 -0.05 0.00 -0.56 0.00 0.00 39.33 38.69 1ouh h ASP 91 CO -0.21 1.10 0.58 0.00 -1.57 0.00 0.00 179.24 179.13 1ouh h ALA 92 N 0.83 1.22 -0.42 3.45 0.00 -1.68 -1.22 119.26 121.45 1ouh h ALA 92 Ca 0.10 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1ouh h ALA 92 Cb 0.75 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1ouh h ALA 92 CO 0.06 0.67 -0.05 0.28 0.00 0.00 0.00 179.25 180.21 1ouh h VAL 93 N 1.32 1.27 -0.75 0.00 2.07 -0.89 0.19 116.25 119.45 1ouh h VAL 93 Ca 0.34 -1.11 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 1ouh h VAL 93 Cb -0.06 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 1ouh h VAL 93 CO -0.06 0.38 0.41 0.00 0.02 0.00 0.00 177.57 178.32 1ouh h ALA 94 N 0.87 1.32 -0.20 1.67 0.00 -0.87 -0.78 119.26 121.27 1ouh h ALA 94 Ca 0.11 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 1ouh h ALA 94 Cb 0.55 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 18.05 1ouh h ALA 94 CO 0.03 0.56 -0.63 0.00 0.00 0.00 0.00 179.25 179.21 1ouh h ALA 96 N 0.59 1.44 -0.74 0.00 0.00 -0.61 -0.23 119.26 119.71 1ouh h ALA 96 Ca -0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1ouh h ALA 96 Cb 1.25 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 1ouh h ALA 96 CO 0.13 0.48 0.25 0.87 0.00 0.00 0.00 179.25 180.98 1ouh h LYS 97 N 0.91 1.13 -0.39 0.00 1.57 -1.03 -2.65 116.57 116.11 1ouh h LYS 97 Ca 0.24 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1ouh h LYS 97 Cb -0.02 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.10 1ouh h LYS 97 CO -0.04 0.95 0.11 -0.09 -0.57 0.00 0.00 179.45 179.81 1ouh h ARG 98 N 1.09 0.62 -0.48 3.15 9.65 -0.70 -2.94 114.38 124.78 1ouh h ARG 98 Ca 0.24 -0.14 0.06 0.00 -1.10 0.00 0.00 59.98 59.04 1ouh h ARG 98 Cb 0.28 -0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 28.72 1ouh h ARG 98 CO -0.01 0.64 0.17 0.28 2.80 0.00 0.00 179.97 183.85 1ouh h VAL 99 N 0.49 0.84 0.00 0.20 2.07 -0.82 -2.03 116.25 117.00 1ouh h VAL 99 Ca 0.13 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.53 1ouh h VAL 99 Cb 0.28 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1ouh h VAL 99 CO -0.00 0.06 0.00 1.33 0.02 0.00 0.00 177.57 178.98 1ouh n VAL 100 N -5.00 0.21 0.92 2.57 0.24 -1.02 -2.44 118.33 113.81 1ouh n VAL 100 Ca 0.05 0.05 0.12 0.00 -2.04 0.00 0.00 64.34 62.52 1ouh n VAL 100 Cb 0.19 -0.64 0.55 0.00 -1.47 0.00 0.00 33.84 32.47 1ouh n VAL 100 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1ouh n ARG 101 N -1.29 0.06 -2.19 7.34 1.74 -0.76 -4.13 116.66 117.43 1ouh n ARG 101 Ca 0.11 0.07 -0.30 0.00 -0.77 0.00 0.00 57.85 56.96 1ouh n ARG 101 Cb 0.20 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 30.14 1ouh n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ouh s ASP 102 N -2.93 6.30 0.44 0.55 -0.00 -1.02 -4.98 116.67 115.04 1ouh s ASP 102 Ca 0.14 1.29 0.22 0.00 -0.00 0.00 0.00 52.55 54.20 1ouh s ASP 102 Cb 0.16 -2.41 1.20 0.00 -0.00 0.00 0.00 42.92 41.88 1ouh s ASP 102 CO 0.44 -0.73 1.83 1.55 -0.00 0.00 0.00 175.17 178.26 1ouh h PRO 103 N 0.06 0.29 0.00 8.23 0.13 -1.89 -1.61 132.00 137.21 1ouh h PRO 103 Ca -0.45 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 64.59 1ouh h PRO 103 Cb 1.19 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1ouh h PRO 103 CO 0.62 0.19 -0.32 1.96 -0.23 0.00 0.00 178.00 180.23 1ouh h GLN 104 N 0.30 0.00 0.00 0.86 4.20 -1.90 -3.48 115.11 115.08 1ouh h GLN 104 Ca 0.51 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.22 1ouh h GLN 104 Cb 1.47 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.25 1ouh h GLN 104 CO -0.17 0.32 0.00 0.41 -0.67 0.00 0.00 178.83 178.71 1ouh n GLY 105 N -0.50 1.96 0.30 3.46 0.00 -0.61 -2.14 105.19 107.65 1ouh n GLY 105 Ca -0.02 -0.56 0.19 0.00 0.00 0.00 0.00 46.02 45.64 1ouh n GLY 105 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ouh h ILE 106 N 0.00 0.00 0.00 -0.61 6.09 -1.91 -2.79 117.51 118.29 1ouh h ILE 106 Ca 0.00 -0.28 0.00 0.00 -1.37 0.00 0.00 64.86 63.21 1ouh h ILE 106 Cb 0.00 1.26 0.00 0.00 0.47 0.00 0.00 36.82 38.55 1ouh h ILE 106 CO 0.00 0.00 0.00 0.54 -3.07 0.00 0.00 178.15 175.62 1ouh n ARG 107 N -3.04 0.15 0.02 2.19 1.74 -0.91 -2.78 116.66 114.04 1ouh n ARG 107 Ca -0.01 0.52 0.20 0.00 -0.77 0.00 0.00 57.85 57.79 1ouh n ARG 107 Cb 0.20 -1.88 0.70 0.00 -1.02 0.00 0.00 32.46 30.46 1ouh n ARG 107 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ouh h ALA 108 N 2.14 2.44 -2.48 7.54 0.00 -1.65 -3.36 119.26 123.89 1ouh h ALA 108 Ca 0.00 -0.02 -0.67 0.00 0.00 0.00 0.00 54.91 54.23 1ouh h ALA 108 Cb 0.17 0.04 -0.17 0.00 0.00 0.00 0.00 17.79 17.83 1ouh h ALA 108 CO 0.00 -0.62 -0.19 -1.58 0.00 0.00 0.00 179.25 176.86 1ouh s TRP 109 N -4.98 3.18 0.50 0.00 0.51 -1.12 -4.94 118.94 112.10 1ouh s TRP 109 Ca -0.05 -0.08 0.25 0.00 -2.12 0.00 0.00 56.10 54.10 1ouh s TRP 109 Cb 0.19 -2.83 1.49 0.00 -0.81 0.00 0.00 33.47 31.52 1ouh s TRP 109 CO 0.71 -0.56 2.13 0.28 -0.51 0.00 0.00 176.95 179.01 1ouh h VAL 110 N 5.63 0.69 -0.34 4.03 2.07 -1.89 -1.18 116.25 125.25 1ouh h VAL 110 Ca -0.28 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 66.90 1ouh h VAL 110 Cb 1.13 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1ouh h VAL 110 CO 0.75 0.08 0.07 0.00 0.02 0.00 0.00 177.57 178.48 1ouh h ALA 111 N 1.92 1.49 -0.56 1.67 0.00 -1.92 -1.72 119.26 120.14 1ouh h ALA 111 Ca -0.00 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1ouh h ALA 111 Cb 0.18 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1ouh h ALA 111 CO 0.01 0.38 0.18 2.35 0.00 0.00 0.00 179.25 182.17 1ouh h TRP 112 N 0.49 0.89 -0.59 0.00 7.01 -1.53 -0.38 115.95 121.84 1ouh h TRP 112 Ca 0.11 -0.09 0.00 0.00 2.11 0.00 0.00 58.89 61.03 1ouh h TRP 112 Cb 0.21 -0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 26.99 1ouh h TRP 112 CO 0.01 0.75 0.38 0.00 -2.79 0.00 0.00 178.44 176.79 1ouh h ARG 113 N 0.78 0.79 -0.05 2.65 3.08 -1.35 0.16 114.38 120.45 1ouh h ARG 113 Ca 0.18 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 1ouh h ARG 113 Cb 0.27 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 1ouh h ARG 113 CO -0.01 0.54 -0.07 -0.91 -1.07 0.00 0.00 179.97 178.45 1ouh h ASN 114 N 0.80 0.15 0.00 7.04 2.35 -1.13 -3.36 115.58 121.44 1ouh h ASN 114 Ca 0.22 -0.52 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 1ouh h ASN 114 Cb -0.07 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.26 1ouh h ASN 114 CO -0.04 0.64 -0.98 0.54 -1.65 0.00 0.00 177.43 175.94 1ouh n ARG 115 N -4.72 1.32 0.00 0.81 5.12 -0.17 -4.82 116.66 114.20 1ouh n ARG 115 Ca -0.08 -0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.81 1ouh n ARG 115 Cb 0.32 -1.31 0.00 0.00 -1.16 0.00 0.00 32.46 30.31 1ouh n ARG 115 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ouh n GLN 117 N -2.43 1.82 -1.75 0.00 7.27 -0.13 -2.17 117.38 119.99 1ouh n GLN 117 Ca 0.00 0.65 -0.21 0.00 0.07 0.00 0.00 57.00 57.51 1ouh n GLN 117 Cb 0.45 -2.32 -0.08 0.00 2.41 0.00 0.00 30.24 30.70 1ouh n GLN 117 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1ouh n ASN 118 N 2.63 -5.60 -4.67 1.69 5.03 -1.26 -4.97 115.26 108.11 1ouh n ASN 118 Ca 0.15 0.42 -0.24 0.00 0.87 0.00 0.00 54.58 55.78 1ouh n ASN 118 Cb 0.28 -4.89 -0.08 0.00 -1.02 0.00 0.00 39.78 34.07 1ouh n ASN 118 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1ouh s ARG 119 N -4.00 2.17 -0.80 3.52 0.52 -0.92 -5.06 118.95 114.38 1ouh s ARG 119 Ca 0.00 -1.72 -0.25 0.00 -0.52 0.00 0.00 55.73 53.24 1ouh s ARG 119 Cb 0.00 -1.99 0.04 0.00 0.52 0.00 0.00 34.95 33.52 1ouh s ARG 119 CO 0.00 0.09 1.28 0.34 0.02 0.00 0.00 175.30 177.03 1ouh s ASP 120 N -3.78 6.26 0.00 0.23 -1.08 -1.26 -4.84 116.67 112.20 1ouh s ASP 120 Ca 0.36 -0.80 0.20 0.00 -0.52 0.00 0.00 52.55 51.79 1ouh s ASP 120 Cb 0.00 -2.54 0.58 0.00 -1.46 0.00 0.00 42.92 39.51 1ouh s ASP 120 CO 0.21 -1.69 1.46 1.33 0.52 0.00 0.00 175.17 176.99 1ouh n VAL 121 N 6.42 0.37 -0.20 1.11 0.24 -1.26 -4.35 118.33 120.65 1ouh n VAL 121 Ca 0.10 -0.50 0.11 0.00 -2.04 0.00 0.00 64.34 62.01 1ouh n VAL 121 Cb 0.49 0.51 0.42 0.00 -1.47 0.00 0.00 33.84 33.78 1ouh n VAL 121 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1ouh h ARG 122 N 2.86 0.59 -0.78 7.34 3.08 -1.92 -2.32 114.38 123.24 1ouh h ARG 122 Ca 0.00 -0.04 0.22 0.00 0.07 0.00 0.00 59.98 60.23 1ouh h ARG 122 Cb 0.63 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.52 1ouh h ARG 122 CO 0.00 0.39 0.55 -0.56 -1.07 0.00 0.00 179.97 179.28 1ouh h GLN 123 N 0.61 0.06 0.00 0.04 3.07 -1.98 -1.67 115.11 115.24 1ouh h GLN 123 Ca 0.38 -0.00 -0.05 0.00 0.09 0.00 0.00 58.65 59.07 1ouh h GLN 123 Cb 0.62 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 28.16 1ouh h GLN 123 CO -0.14 0.04 -0.21 1.88 0.09 0.00 0.00 178.83 180.48 1ouh h TYR 124 N 0.06 0.00 -0.01 0.06 0.05 -1.75 -3.23 116.97 112.15 1ouh h TYR 124 Ca 0.37 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.15 1ouh h TYR 124 Cb 1.40 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.14 1ouh h TYR 124 CO -0.00 0.21 0.00 1.33 -1.05 0.00 0.00 178.16 178.65 1ouh n VAL 125 N -3.52 0.03 -2.03 -2.88 0.24 -0.68 -4.84 118.33 104.65 1ouh n VAL 125 Ca -0.01 -0.52 -0.42 0.00 -2.04 0.00 0.00 64.34 61.36 1ouh n VAL 125 Cb 0.37 1.09 -0.03 0.00 -1.47 0.00 0.00 33.84 33.81 1ouh n VAL 125 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1ouh s GLN 126 N -0.47 4.27 0.00 7.34 -1.52 -0.92 -2.69 119.66 125.67 1ouh s GLN 126 Ca 0.06 2.27 0.00 0.00 -1.95 0.00 0.00 55.36 55.74 1ouh s GLN 126 Cb 0.05 -3.15 0.00 0.00 -0.22 0.00 0.00 33.01 29.68 1ouh s GLN 126 CO 0.07 -0.48 0.00 0.41 -0.25 0.00 0.00 175.29 175.04 1ouh n GLY 127 N 2.96 0.69 0.12 3.09 0.00 -1.26 -4.91 105.19 105.89 1ouh n GLY 127 Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.25 1ouh n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ouh n GLY 129 N 1.41 0.06 0.00 0.00 0.00 -1.26 -4.82 105.19 100.58 1ouh n GLY 129 Ca 0.09 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1ouh n GLY 129 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65