#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l5y s SER 6 N 0.00 2.93 -0.16 2.55 0.15 -1.26 -0.38 113.70 117.53 1l5y s SER 6 Ca 0.00 -0.70 -0.18 0.00 0.70 0.00 0.00 55.95 55.77 1l5y s SER 6 Cb 0.00 -0.19 0.05 0.00 -1.71 0.00 0.00 66.02 64.17 1l5y s SER 6 CO 0.00 0.13 0.48 -0.69 1.20 0.00 0.00 173.24 174.36 1l5y s VAL 7 N -1.07 0.01 -0.22 4.45 1.01 -0.93 -1.90 120.40 121.74 1l5y s VAL 7 Ca 0.10 -0.05 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 1l5y s VAL 7 Cb -0.10 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.56 1l5y s VAL 7 CO 0.05 -0.03 0.04 -0.36 0.00 0.00 0.00 175.10 174.80 1l5y s PHE 8 N 0.00 3.09 -0.13 5.22 0.40 -0.57 -1.28 117.98 124.71 1l5y s PHE 8 Ca -0.02 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1l5y s PHE 8 Cb -0.03 -2.16 -0.01 0.00 0.51 0.00 0.00 43.02 41.33 1l5y s PHE 8 CO 0.02 -0.25 -0.16 -1.17 0.70 0.00 0.00 175.22 174.35 1l5y s LEU 9 N 1.23 2.50 -0.10 -0.37 2.96 -0.44 -0.81 118.68 123.65 1l5y s LEU 9 Ca 0.04 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.54 1l5y s LEU 9 Cb -0.15 -1.55 0.02 0.00 0.50 0.00 0.00 46.19 45.01 1l5y s LEU 9 CO 0.03 0.14 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.45 1l5y s ILE 10 N 0.51 1.21 -0.28 6.68 1.09 0.01 -0.47 121.20 129.95 1l5y s ILE 10 Ca -0.11 -0.45 -0.22 0.00 -1.10 0.00 0.00 60.65 58.78 1l5y s ILE 10 Cb -0.16 -1.15 0.08 0.00 -1.06 0.00 0.00 42.46 40.17 1l5y s ILE 10 CO 0.04 0.39 0.76 -0.62 -0.10 0.00 0.00 174.94 175.41 1l5y s ASP 11 N 1.21 -0.77 0.22 3.58 -1.08 -0.79 -0.57 116.67 118.48 1l5y s ASP 11 Ca -0.04 1.37 0.25 0.00 -0.52 0.00 0.00 52.55 53.62 1l5y s ASP 11 Cb -0.14 1.36 0.87 0.00 -1.46 0.00 0.00 42.92 43.55 1l5y s ASP 11 CO -0.03 -0.23 1.76 -0.90 0.52 0.00 0.00 175.17 176.29 1l5y n ASP 12 N 3.22 0.76 -4.54 -0.34 5.75 -1.26 -4.18 116.55 115.96 1l5y n ASP 12 Ca -0.16 0.60 -0.41 0.00 -0.01 0.00 0.00 54.79 54.80 1l5y n ASP 12 Cb 0.57 -0.79 -0.03 0.00 -1.03 0.00 0.00 41.12 39.83 1l5y n ASP 12 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1l5y s ASP 13 N -4.41 6.28 0.17 -1.12 -1.08 -1.26 -4.92 116.67 110.32 1l5y s ASP 13 Ca 0.09 -0.87 -0.16 0.00 -0.52 0.00 0.00 52.55 51.08 1l5y s ASP 13 Cb 0.12 -2.54 0.11 0.00 -1.46 0.00 0.00 42.92 39.15 1l5y s ASP 13 CO 0.54 -1.66 1.67 -0.09 0.52 0.00 0.00 175.17 176.15 1l5y h ARG 14 N 9.85 0.02 -0.74 4.34 2.43 -1.99 0.11 114.38 128.40 1l5y h ARG 14 Ca -0.12 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1l5y h ARG 14 Cb 1.04 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.55 1l5y h ARG 14 CO 1.30 0.01 0.43 -0.44 -1.51 0.00 0.00 179.97 179.77 1l5y h ASP 15 N 0.02 0.90 -0.52 -3.80 3.32 -1.97 -1.44 116.42 112.92 1l5y h ASP 15 Ca 0.21 -0.07 -0.10 0.00 0.02 0.00 0.00 57.03 57.09 1l5y h ASP 15 Cb 0.31 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1l5y h ASP 15 CO -0.42 0.71 -0.05 0.25 -1.72 0.00 0.00 179.24 178.01 1l5y h LEU 16 N 1.01 0.95 -0.79 1.55 5.85 -1.87 -1.59 115.31 120.42 1l5y h LEU 16 Ca 0.26 -0.33 0.01 0.00 0.84 0.00 0.00 57.88 58.66 1l5y h LEU 16 Cb -0.01 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 1l5y h LEU 16 CO -0.05 1.05 0.52 -0.09 -0.34 0.00 0.00 178.44 179.53 1l5y h ARG 17 N 0.82 1.03 -0.31 1.25 2.43 -0.30 0.14 114.38 119.45 1l5y h ARG 17 Ca 0.14 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 1l5y h ARG 17 Cb 0.59 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 1l5y h ARG 17 CO 0.04 0.68 0.08 0.87 -1.51 0.00 0.00 179.97 180.13 1l5y h LYS 18 N 1.06 0.49 -0.63 0.20 1.79 -1.11 -0.24 116.57 118.13 1l5y h LYS 18 Ca 0.29 -0.11 -0.06 0.00 -2.18 0.00 0.00 60.65 58.59 1l5y h LYS 18 Cb -0.11 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.45 1l5y h LYS 18 CO -0.07 0.55 0.17 0.00 -1.08 0.00 0.00 179.45 179.02 1l5y h ALA 19 N 0.92 0.83 -0.57 3.86 0.00 -0.95 -1.32 119.26 122.02 1l5y h ALA 19 Ca 0.10 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1l5y h ALA 19 Cb 0.28 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1l5y h ALA 19 CO -0.00 0.52 -0.01 0.52 0.00 0.00 0.00 179.25 180.28 1l5y h MET 20 N 0.92 1.02 -0.65 0.00 2.86 -0.61 -1.66 114.93 116.81 1l5y h MET 20 Ca 0.20 -0.33 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1l5y h MET 20 Cb 0.33 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 1l5y h MET 20 CO -0.00 1.02 0.37 0.37 1.06 0.00 0.00 176.91 179.72 1l5y h GLN 21 N 0.91 0.90 -0.50 1.72 4.15 -0.72 0.34 115.11 121.91 1l5y h GLN 21 Ca 0.16 -0.10 -0.04 0.00 0.77 0.00 0.00 58.65 59.44 1l5y h GLN 21 Cb 0.56 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 1l5y h GLN 21 CO 0.03 0.67 0.15 1.96 -1.93 0.00 0.00 178.83 179.71 1l5y h GLN 22 N 0.89 0.79 -0.52 1.69 4.20 -1.09 0.10 115.11 121.16 1l5y h GLN 22 Ca 0.23 -0.17 0.01 0.00 0.06 0.00 0.00 58.65 58.78 1l5y h GLN 22 Cb 0.02 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 1l5y h GLN 22 CO -0.04 0.74 0.33 1.15 -0.67 0.00 0.00 178.83 180.34 1l5y h THR 23 N 0.68 1.10 -0.13 -0.54 2.02 -1.05 0.13 112.91 115.13 1l5y h THR 23 Ca 0.16 -0.23 -0.12 0.00 0.77 0.00 0.00 66.41 66.99 1l5y h THR 23 Cb 0.28 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1l5y h THR 23 CO -0.00 0.12 -0.44 -0.07 0.37 0.00 0.00 175.52 175.50 1l5y h LEU 24 N 0.67 0.33 -0.63 2.58 3.38 -0.66 -2.20 115.31 118.79 1l5y h LEU 24 Ca 0.20 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 1l5y h LEU 24 Cb -0.04 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1l5y h LEU 24 CO -0.06 0.73 -0.27 -0.33 0.09 0.00 0.00 178.44 178.60 1l5y h GLU 25 N 0.25 0.79 -0.69 1.13 5.08 -0.49 -1.54 114.58 119.12 1l5y h GLU 25 Ca 0.02 -0.34 0.04 0.00 -1.00 0.00 0.00 59.36 58.08 1l5y h GLU 25 Cb 0.89 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.06 1l5y h GLU 25 CO 0.07 0.97 0.41 1.25 -1.00 0.00 0.00 179.01 180.71 1l5y h LEU 26 N 0.68 0.65 0.00 1.33 7.12 -0.43 0.49 115.31 125.15 1l5y h LEU 26 Ca 0.08 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.11 1l5y h LEU 26 Cb 0.80 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 40.80 1l5y h LEU 26 CO 0.07 0.44 0.00 0.00 -0.13 0.00 0.00 178.44 178.82 1l5y n ALA 27 N -2.33 2.12 -0.07 1.25 0.00 -0.86 -4.87 120.51 115.77 1l5y n ALA 27 Ca 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1l5y n ALA 27 Cb 0.12 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1l5y n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l5y n GLY 28 N 0.06 0.64 3.89 0.00 0.00 0.16 -5.08 105.19 104.86 1l5y n GLY 28 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1l5y n GLY 28 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1l5y s PHE 29 N -2.10 3.48 -0.27 1.61 0.40 -0.60 -4.70 117.98 115.80 1l5y s PHE 29 Ca 0.00 0.84 -0.12 0.00 -0.60 0.00 0.00 56.93 57.05 1l5y s PHE 29 Cb 0.00 -2.28 -0.05 0.00 0.51 0.00 0.00 43.02 41.21 1l5y s PHE 29 CO 0.00 -0.00 0.24 0.99 0.70 0.00 0.00 175.22 177.15 1l5y s THR 30 N -2.28 5.28 -0.12 0.64 2.01 0.49 -4.18 115.64 117.48 1l5y s THR 30 Ca 0.48 0.29 -0.01 0.00 0.31 0.00 0.00 61.69 62.75 1l5y s THR 30 Cb -0.10 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.81 1l5y s THR 30 CO 0.32 0.24 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.73 1l5y s VAL 31 N 1.75 3.68 -0.25 3.82 1.01 -1.26 -2.19 120.40 126.96 1l5y s VAL 31 Ca 0.09 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.59 1l5y s VAL 31 Cb -0.16 -2.56 0.01 0.00 0.00 0.00 0.00 36.38 33.68 1l5y s VAL 31 CO 0.10 0.54 -0.02 -0.44 0.00 0.00 0.00 175.10 175.28 1l5y s SER 32 N -0.12 4.50 0.08 3.32 0.01 -0.40 -5.01 113.70 116.07 1l5y s SER 32 Ca 0.01 -0.73 0.06 0.00 1.31 0.00 0.00 55.95 56.60 1l5y s SER 32 Cb -0.13 -1.73 -0.04 0.00 0.21 0.00 0.00 66.02 64.33 1l5y s SER 32 CO 0.03 -0.12 -0.08 -0.94 0.41 0.00 0.00 173.24 172.53 1l5y s SER 33 N 1.40 4.50 0.03 2.44 1.04 -1.26 -1.33 113.70 120.52 1l5y s SER 33 Ca 0.02 -0.31 -0.04 0.00 0.48 0.00 0.00 55.95 56.11 1l5y s SER 33 Cb -0.16 -0.93 -0.02 0.00 0.10 0.00 0.00 66.02 65.01 1l5y s SER 33 CO -0.03 0.20 0.05 -0.36 0.98 0.00 0.00 173.24 174.09 1l5y s PHE 34 N -1.16 0.25 -0.14 5.02 0.40 0.38 -4.95 117.98 117.78 1l5y s PHE 34 Ca 0.21 -0.57 0.20 0.00 -0.60 0.00 0.00 56.93 56.17 1l5y s PHE 34 Cb -0.11 -0.18 -0.17 0.00 0.51 0.00 0.00 43.02 43.06 1l5y s PHE 34 CO 0.12 -0.32 0.69 0.00 0.70 0.00 0.00 175.22 176.42 1l5y n ALA 35 N 0.93 2.31 -3.01 5.36 0.00 -1.26 -1.88 120.51 122.96 1l5y n ALA 35 Ca -0.20 -0.54 -0.32 0.00 0.00 0.00 0.00 53.44 52.37 1l5y n ALA 35 Cb 0.58 -0.84 -0.15 0.00 0.00 0.00 0.00 19.45 19.03 1l5y n ALA 35 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1l5y s SER 36 N -5.24 3.68 0.25 0.00 1.04 -1.26 -4.02 113.70 108.15 1l5y s SER 36 Ca -0.05 -0.39 -0.05 0.00 0.48 0.00 0.00 55.95 55.94 1l5y s SER 36 Cb 0.10 -1.40 0.28 0.00 0.10 0.00 0.00 66.02 65.10 1l5y s SER 36 CO 0.84 0.19 1.88 0.00 0.98 0.00 0.00 173.24 177.13 1l5y h ALA 37 N 6.49 1.23 -0.01 5.32 0.00 -1.89 -1.93 119.26 128.47 1l5y h ALA 37 Ca -0.27 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.36 1l5y h ALA 37 Cb 1.21 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1l5y h ALA 37 CO 0.52 0.63 -0.72 1.79 0.00 0.00 0.00 179.25 181.47 1l5y h THR 38 N 1.19 1.48 -0.44 0.00 1.35 -1.95 0.11 112.91 114.64 1l5y h THR 38 Ca 0.30 -2.37 -0.07 0.00 -0.55 0.00 0.00 66.41 63.72 1l5y h THR 38 Cb 0.02 2.28 -0.02 0.00 -1.73 0.00 0.00 68.15 68.70 1l5y h THR 38 CO -0.05 0.68 0.01 -0.33 -0.25 0.00 0.00 175.52 175.59 1l5y h GLU 39 N 0.06 0.78 -0.01 4.72 4.39 -1.93 -0.93 114.58 121.65 1l5y h GLU 39 Ca -0.01 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.44 1l5y h GLU 39 Cb 1.27 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.85 1l5y h GLU 39 CO 0.10 0.83 0.01 0.00 -1.16 0.00 0.00 179.01 178.79 1l5y h ALA 40 N 0.91 0.02 -1.00 3.43 0.00 -1.21 -2.80 119.26 118.61 1l5y h ALA 40 Ca 0.13 -0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.09 1l5y h ALA 40 Cb 0.47 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.18 1l5y h ALA 40 CO 0.02 -0.44 0.63 1.25 0.00 0.00 0.00 179.25 180.72 1l5y h LEU 41 N -0.07 0.96 -2.63 0.00 5.85 -0.63 -1.35 115.31 117.44 1l5y h LEU 41 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1l5y h LEU 41 Cb 0.09 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1l5y h LEU 41 CO -0.00 0.54 0.00 0.00 -0.34 0.00 0.00 178.44 178.64 1l5y h ALA 42 N 1.51 1.00 -0.08 1.25 0.00 -0.89 -1.37 119.26 120.68 1l5y h ALA 42 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1l5y h ALA 42 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1l5y h ALA 42 CO -0.24 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.42 1l5y n GLY 43 N -0.95 0.89 3.96 0.00 0.00 -0.52 -4.99 105.19 103.59 1l5y n GLY 43 Ca -0.02 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 45.13 1l5y n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l5y s LEU 44 N -1.72 3.00 0.04 0.99 1.43 -0.52 -5.07 118.68 116.84 1l5y s LEU 44 Ca 0.27 0.04 -0.28 0.00 -1.03 0.00 0.00 54.13 53.13 1l5y s LEU 44 Cb 0.18 -2.64 0.10 0.00 0.03 0.00 0.00 46.19 43.86 1l5y s LEU 44 CO 0.27 -1.61 1.10 -0.94 0.23 0.00 0.00 176.35 175.40 1l5y s SER 45 N -4.58 -0.15 0.00 2.29 1.04 -1.26 -5.00 113.70 106.05 1l5y s SER 45 Ca 0.62 -0.23 0.26 0.00 0.48 0.00 0.00 55.95 57.08 1l5y s SER 45 Cb -0.08 0.32 1.42 0.00 0.10 0.00 0.00 66.02 67.78 1l5y s SER 45 CO 0.43 -0.59 1.90 0.00 0.98 0.00 0.00 173.24 175.97 1l5y n ALA 46 N -0.42 2.38 1.03 5.32 0.00 -1.26 -2.45 120.51 125.10 1l5y n ALA 46 Ca -0.07 -0.14 0.11 0.00 0.00 0.00 0.00 53.44 53.34 1l5y n ALA 46 Cb 0.61 -1.43 0.10 0.00 0.00 0.00 0.00 19.45 18.74 1l5y n ALA 46 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1l5y n ASP 47 N -1.17 0.91 -4.68 0.00 8.00 -1.26 -4.94 116.55 113.41 1l5y n ASP 47 Ca 0.15 -0.74 -0.45 0.00 0.71 0.00 0.00 54.79 54.47 1l5y n ASP 47 Cb 0.16 0.53 -0.04 0.00 -0.02 0.00 0.00 41.12 41.76 1l5y n ASP 47 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1l5y n PHE 48 N -1.24 2.44 1.13 1.24 7.35 -1.03 -4.87 117.46 122.49 1l5y n PHE 48 Ca 0.06 0.05 0.13 0.00 -0.76 0.00 0.00 57.45 56.93 1l5y n PHE 48 Cb 0.35 -2.64 0.45 0.00 0.35 0.00 0.00 39.48 37.98 1l5y n PHE 48 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1l5y n ALA 49 N 4.91 2.99 -1.89 3.13 0.00 -1.26 -4.92 120.51 123.48 1l5y n ALA 49 Ca 0.18 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1l5y n ALA 49 Cb 0.32 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1l5y n ALA 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l5y n GLY 50 N 1.43 1.77 3.41 0.00 0.00 -1.26 -4.50 105.19 106.03 1l5y n GLY 50 Ca 0.09 -1.87 -0.20 0.00 0.00 0.00 0.00 46.02 44.04 1l5y n GLY 50 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1l5y s ILE 51 N 2.56 0.83 -0.07 -0.61 -4.36 -0.80 -4.67 121.20 114.09 1l5y s ILE 51 Ca 0.00 -2.00 0.05 0.00 -0.26 0.00 0.00 60.65 58.44 1l5y s ILE 51 Cb 0.00 -2.66 -0.00 0.00 1.25 0.00 0.00 42.46 41.04 1l5y s ILE 51 CO 0.00 0.00 -0.22 -0.69 0.24 0.00 0.00 174.94 174.27 1l5y s VAL 52 N -3.46 1.88 -0.18 8.37 1.01 -0.73 -1.51 120.40 125.78 1l5y s VAL 52 Ca 0.35 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.38 1l5y s VAL 52 Cb 0.07 -1.61 0.04 0.00 0.00 0.00 0.00 36.38 34.88 1l5y s VAL 52 CO 0.15 0.52 -0.09 -0.63 0.00 0.00 0.00 175.10 175.06 1l5y s ILE 53 N 0.07 1.43 0.01 2.22 1.01 0.01 -0.86 121.20 125.09 1l5y s ILE 53 Ca -0.09 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 59.76 1l5y s ILE 53 Cb -0.15 -1.53 -0.01 0.00 0.01 0.00 0.00 42.46 40.78 1l5y s ILE 53 CO 0.05 0.18 -0.09 -0.55 0.00 0.00 0.00 174.94 174.53 1l5y s SER 54 N 1.49 0.99 0.95 3.58 0.15 -0.36 -0.81 113.70 119.69 1l5y s SER 54 Ca -0.00 -0.26 -0.12 0.00 0.70 0.00 0.00 55.95 56.27 1l5y s SER 54 Cb -0.16 -0.07 0.16 0.00 -1.71 0.00 0.00 66.02 64.24 1l5y s SER 54 CO -0.08 0.03 1.10 -0.62 1.20 0.00 0.00 173.24 174.87 1l5y s ASP 55 N -0.59 3.06 -0.13 5.45 2.15 0.26 -0.88 116.67 126.00 1l5y s ASP 55 Ca 0.00 1.21 -0.13 0.00 0.43 0.00 0.00 52.55 54.06 1l5y s ASP 55 Cb -0.05 -1.86 -0.05 0.00 -0.30 0.00 0.00 42.92 40.65 1l5y s ASP 55 CO 0.00 -2.86 -0.26 -0.38 -0.17 0.00 0.00 175.17 171.50 1l5y n ILE 56 N -4.00 1.37 -2.69 4.11 5.41 -1.13 -3.54 119.36 118.88 1l5y n ILE 56 Ca 0.06 0.11 -0.43 0.00 1.00 0.00 0.00 62.75 63.49 1l5y n ILE 56 Cb 0.57 -2.07 -0.02 0.00 -0.71 0.00 0.00 39.64 37.41 1l5y n ILE 56 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1l5y s ARG 57 N -2.61 4.08 0.17 0.38 1.81 -1.26 -0.98 118.95 120.54 1l5y s ARG 57 Ca -0.23 1.05 -0.17 0.00 -1.72 0.00 0.00 55.73 54.66 1l5y s ARG 57 Cb 0.05 -3.72 0.03 0.00 -0.45 0.00 0.00 34.95 30.86 1l5y s ARG 57 CO 0.32 -0.82 0.48 -1.64 -0.68 0.00 0.00 175.30 172.96 1l5y s MET 58 N 3.47 1.26 0.62 3.54 -1.94 -1.26 -4.78 119.30 120.21 1l5y s MET 58 Ca 0.43 -0.80 -0.17 0.00 -1.71 0.00 0.00 55.69 53.45 1l5y s MET 58 Cb -0.13 0.50 -0.02 0.00 2.01 0.00 0.00 34.83 37.20 1l5y s MET 58 CO 0.13 -0.52 1.13 -2.14 -0.01 0.00 0.00 175.02 173.61 1l5y s PRO 59 N -3.85 2.93 4.45 2.03 0.02 -1.26 -4.66 135.00 134.67 1l5y s PRO 59 Ca 0.07 1.51 0.00 0.00 0.02 0.00 0.00 61.00 62.60 1l5y s PRO 59 Cb 0.00 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.56 1l5y s PRO 59 CO -0.06 -1.17 0.00 0.41 -0.33 0.00 0.00 177.00 175.85 1l5y n GLY 60 N -0.19 1.04 3.75 0.52 0.00 -1.26 -4.78 105.19 104.27 1l5y n GLY 60 Ca 0.11 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 1l5y n GLY 60 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1l5y s MET 61 N 0.00 4.38 0.58 1.61 -2.45 -1.26 -5.04 119.30 117.12 1l5y s MET 61 Ca 0.00 2.13 -0.01 0.00 -1.25 0.00 0.00 55.69 56.56 1l5y s MET 61 Cb 0.00 -3.14 0.04 0.00 1.25 0.00 0.00 34.83 32.98 1l5y s MET 61 CO 0.00 -0.22 0.83 0.16 1.05 0.00 0.00 175.02 176.84 1l5y s ASP 62 N -0.02 5.22 0.46 1.11 -4.77 -1.26 -4.58 116.67 112.83 1l5y s ASP 62 Ca 0.54 0.17 0.17 0.00 -3.30 0.00 0.00 52.55 50.13 1l5y s ASP 62 Cb -0.38 -1.03 1.08 0.00 -1.09 0.00 0.00 42.92 41.50 1l5y s ASP 62 CO 0.44 -1.22 2.00 1.23 0.70 0.00 0.00 175.17 178.32 1l5y h GLY 63 N -0.09 0.00 1.48 2.12 0.00 -1.10 -1.64 103.07 103.84 1l5y h GLY 63 Ca -0.43 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 46.72 1l5y h GLY 63 CO 0.55 0.00 -0.66 1.41 0.00 0.00 0.00 176.54 177.84 1l5y h LEU 64 N 0.00 0.61 -0.35 3.11 3.38 -1.84 -1.03 115.31 119.19 1l5y h LEU 64 Ca -0.00 -0.37 -0.17 0.00 0.09 0.00 0.00 57.88 57.43 1l5y h LEU 64 Cb 0.36 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1l5y h LEU 64 CO 0.02 1.10 -0.43 0.00 0.09 0.00 0.00 178.44 179.23 1l5y h ALA 65 N 0.89 0.53 -0.54 1.53 0.00 -1.87 -1.97 119.26 117.83 1l5y h ALA 65 Ca -0.02 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 1l5y h ALA 65 Cb 1.23 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1l5y h ALA 65 CO 0.12 0.66 0.27 1.25 0.00 0.00 0.00 179.25 181.55 1l5y h LEU 66 N 0.72 0.71 -0.54 0.00 5.85 -1.26 -1.87 115.31 118.92 1l5y h LEU 66 Ca 0.05 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.66 1l5y h LEU 66 Cb 1.03 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.85 1l5y h LEU 66 CO 0.10 0.64 0.34 0.15 -0.34 0.00 0.00 178.44 179.33 1l5y h PHE 67 N 0.73 0.65 -0.67 1.25 3.57 -1.01 -0.52 116.94 120.94 1l5y h PHE 67 Ca 0.19 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 1l5y h PHE 67 Cb 0.11 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 1l5y h PHE 67 CO -0.00 0.39 0.38 0.00 -2.23 0.00 0.00 178.31 176.84 1l5y h ARG 68 N 0.69 0.92 -0.65 1.11 3.08 -1.14 -0.61 114.38 117.79 1l5y h ARG 68 Ca 0.21 -0.09 -0.09 0.00 0.07 0.00 0.00 59.98 60.08 1l5y h ARG 68 Cb -0.03 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 1l5y h ARG 68 CO -0.07 0.67 0.05 0.87 -1.07 0.00 0.00 179.97 180.42 1l5y h LYS 69 N 0.93 1.10 -0.48 0.04 1.79 -0.50 -2.66 116.57 116.80 1l5y h LYS 69 Ca 0.24 -0.33 -0.11 0.00 -2.18 0.00 0.00 60.65 58.28 1l5y h LYS 69 Cb 0.01 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.53 1l5y h LYS 69 CO -0.04 1.04 -0.12 0.82 -1.08 0.00 0.00 179.45 180.07 1l5y h ILE 70 N 1.02 1.27 -0.78 1.86 2.04 -0.46 -1.22 117.51 121.24 1l5y h ILE 70 Ca 0.19 -1.26 0.08 0.00 1.00 0.00 0.00 64.86 64.87 1l5y h ILE 70 Cb 0.51 1.09 -0.07 0.00 -0.74 0.00 0.00 36.82 37.62 1l5y h ILE 70 CO 0.02 0.43 0.44 -0.07 0.00 0.00 0.00 178.15 178.98 1l5y h LEU 71 N 0.77 0.65 -0.70 1.44 3.38 -1.01 0.51 115.31 120.35 1l5y h LEU 71 Ca 0.12 0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.99 1l5y h LEU 71 Cb 0.68 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1l5y h LEU 71 CO 0.05 0.39 -0.62 0.00 0.09 0.00 0.00 178.44 178.35 1l5y h ALA 72 N 1.42 0.91 -0.02 1.53 0.00 -1.27 -2.59 119.26 119.24 1l5y h ALA 72 Ca 0.36 -0.56 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1l5y h ALA 72 Cb 0.29 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1l5y h ALA 72 CO -0.22 0.75 -0.01 1.25 0.00 0.00 0.00 179.25 181.03 1l5y h LEU 73 N 0.08 0.04 -6.00 0.00 5.85 0.08 -3.44 115.31 111.93 1l5y h LEU 73 Ca -0.01 -0.40 0.07 0.00 0.84 0.00 0.00 57.88 58.39 1l5y h LEU 73 Cb 1.11 -0.01 -0.21 0.00 0.37 0.00 0.00 40.66 41.92 1l5y h LEU 73 CO 0.09 0.43 -0.29 -0.62 -0.34 0.00 0.00 178.44 177.71 1l5y s ASP 74 N -5.64 -1.41 0.00 1.25 -1.08 0.03 -4.70 116.67 105.12 1l5y s ASP 74 Ca -0.15 0.40 0.03 0.00 -0.52 0.00 0.00 52.55 52.30 1l5y s ASP 74 Cb 0.03 1.99 0.12 0.00 -1.46 0.00 0.00 42.92 43.60 1l5y s ASP 74 CO 0.68 -0.26 0.99 -0.81 0.52 0.00 0.00 175.17 176.29 1l5y n PRO 75 N 5.40 0.02 -0.54 4.34 -0.04 -0.98 -1.31 135.00 141.89 1l5y n PRO 75 Ca 0.03 0.36 0.10 0.00 -0.04 0.00 0.00 63.50 63.94 1l5y n PRO 75 Cb 0.53 -1.50 0.34 0.00 -0.04 0.00 0.00 33.50 32.84 1l5y n PRO 75 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1l5y n ASP 76 N -1.39 4.50 -4.43 3.54 8.00 -1.26 -4.82 116.55 120.69 1l5y n ASP 76 Ca 0.01 -2.33 -0.44 0.00 0.71 0.00 0.00 54.79 52.74 1l5y n ASP 76 Cb 0.03 -0.54 -0.07 0.00 -0.02 0.00 0.00 41.12 40.51 1l5y n ASP 76 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1l5y s LEU 77 N -1.63 5.24 0.27 0.64 0.20 -0.43 -4.81 118.68 118.16 1l5y s LEU 77 Ca 0.50 -1.06 -0.31 0.00 0.69 0.00 0.00 54.13 53.95 1l5y s LEU 77 Cb 0.30 -2.32 -0.12 0.00 -0.43 0.00 0.00 46.19 43.62 1l5y s LEU 77 CO 0.26 -0.74 1.52 -2.65 -0.29 0.00 0.00 176.35 174.45 1l5y n PRO 78 N 5.68 2.43 -4.40 0.98 -0.02 -1.26 -4.88 135.00 133.53 1l5y n PRO 78 Ca -0.09 0.87 -0.30 0.00 -2.02 0.00 0.00 63.50 61.95 1l5y n PRO 78 Cb 0.45 -2.60 -0.17 0.00 -0.02 0.00 0.00 33.50 31.16 1l5y n PRO 78 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1l5y s MET 79 N -0.41 2.47 -0.21 -0.52 1.75 -1.26 -1.77 119.30 119.35 1l5y s MET 79 Ca 0.66 -0.65 -0.04 0.00 -1.25 0.00 0.00 55.69 54.41 1l5y s MET 79 Cb -0.56 -2.11 -0.01 0.00 2.84 0.00 0.00 34.83 34.99 1l5y s MET 79 CO 0.48 -0.10 -0.03 0.42 -0.65 0.00 0.00 175.02 175.14 1l5y s ILE 80 N 1.07 3.56 -0.09 10.11 1.01 -0.04 -0.31 121.20 136.51 1l5y s ILE 80 Ca -0.04 -0.44 -0.10 0.00 0.00 0.00 0.00 60.65 60.08 1l5y s ILE 80 Cb -0.14 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.67 1l5y s ILE 80 CO -0.04 0.43 0.22 -0.76 0.00 0.00 0.00 174.94 174.79 1l5y s LEU 81 N 1.21 4.40 -0.05 2.97 1.43 -0.63 -1.23 118.68 126.78 1l5y s LEU 81 Ca 0.03 0.60 0.03 0.00 -1.03 0.00 0.00 54.13 53.76 1l5y s LEU 81 Cb -0.14 -2.23 0.00 0.00 0.03 0.00 0.00 46.19 43.85 1l5y s LEU 81 CO -0.00 0.36 -0.13 -0.69 0.23 0.00 0.00 176.35 176.12 1l5y s VAL 82 N -0.93 1.12 -0.06 -1.59 1.01 -0.06 -0.40 120.40 119.49 1l5y s VAL 82 Ca 0.17 -0.52 -0.26 0.00 0.00 0.00 0.00 61.98 61.38 1l5y s VAL 82 Cb -0.13 -0.99 0.06 0.00 0.00 0.00 0.00 36.38 35.32 1l5y s VAL 82 CO 0.06 0.34 0.59 0.28 0.00 0.00 0.00 175.10 176.37 1l5y s THR 83 N 0.31 0.01 -1.22 3.92 -1.32 0.30 -2.86 115.64 114.79 1l5y s THR 83 Ca -0.07 -0.11 0.12 0.00 -1.21 0.00 0.00 61.69 60.42 1l5y s THR 83 Cb -0.12 -0.90 0.27 0.00 -1.51 0.00 0.00 72.50 70.24 1l5y s THR 83 CO 0.02 -0.06 1.16 0.61 -2.21 0.00 0.00 174.62 174.14 1l5y n GLY 84 N 1.19 1.78 1.99 6.08 0.00 -1.26 0.09 105.19 115.06 1l5y n GLY 84 Ca -0.19 -0.40 -0.07 0.00 0.00 0.00 0.00 46.02 45.36 1l5y n GLY 84 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1l5y n HIS 85 N 0.67 1.36 -3.09 1.61 8.25 -1.26 -4.92 115.22 117.83 1l5y n HIS 85 Ca 0.11 -1.80 -0.20 0.00 -0.26 0.00 0.00 57.72 55.57 1l5y n HIS 85 Cb 0.41 -0.26 0.06 0.00 1.12 0.00 0.00 29.99 31.32 1l5y n HIS 85 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1l5y s GLY 86 N -3.36 1.77 0.33 -1.41 0.00 -1.26 -5.01 107.32 98.38 1l5y s GLY 86 Ca 0.38 -2.10 -0.04 0.00 0.00 0.00 0.00 44.72 42.96 1l5y s GLY 86 CO -0.04 -1.71 0.47 0.51 0.00 0.00 0.00 173.10 172.33 1l5y s ASP 87 N -4.65 0.74 0.10 1.64 1.47 -1.26 -5.07 116.67 109.65 1l5y s ASP 87 Ca 0.60 -1.41 -0.20 0.00 1.18 0.00 0.00 52.55 52.72 1l5y s ASP 87 Cb -0.05 0.65 -0.09 0.00 -0.34 0.00 0.00 42.92 43.09 1l5y s ASP 87 CO 0.38 -1.27 1.69 0.40 0.68 0.00 0.00 175.17 177.04 1l5y h ILE 88 N 2.14 1.12 -0.50 2.11 2.04 -2.00 -2.46 117.51 119.96 1l5y h ILE 88 Ca -0.28 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.23 1l5y h ILE 88 Cb 1.24 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 38.29 1l5y h ILE 88 CO 0.39 0.11 0.22 1.55 0.00 0.00 0.00 178.15 180.42 1l5y h PRO 89 N 0.18 0.71 -0.26 2.37 0.13 -1.99 -0.99 132.00 132.15 1l5y h PRO 89 Ca 0.06 -0.09 -0.07 0.00 -0.87 0.00 0.00 66.00 65.03 1l5y h PRO 89 Cb 0.09 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.08 1l5y h PRO 89 CO -0.01 0.58 -0.11 1.98 -0.23 0.00 0.00 178.00 180.20 1l5y h MET 90 N 0.71 0.55 -0.47 0.86 -1.53 -1.96 -2.01 114.93 111.08 1l5y h MET 90 Ca 0.17 -0.23 -0.05 0.00 -3.44 0.00 0.00 59.70 56.15 1l5y h MET 90 Cb 0.12 -0.02 -0.02 0.00 -0.55 0.00 0.00 31.60 31.13 1l5y h MET 90 CO -0.02 0.79 0.08 0.00 0.14 0.00 0.00 176.91 177.90 1l5y h ALA 91 N 0.74 0.62 -0.24 0.39 0.00 -1.15 -1.56 119.26 118.07 1l5y h ALA 91 Ca 0.06 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1l5y h ALA 91 Cb 0.62 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1l5y h ALA 91 CO 0.04 0.34 0.09 0.28 0.00 0.00 0.00 179.25 180.00 1l5y h VAL 92 N 0.64 0.96 -0.53 0.00 2.07 -1.22 -1.88 116.25 116.28 1l5y h VAL 92 Ca 0.14 -0.07 -0.09 0.00 0.82 0.00 0.00 66.70 67.50 1l5y h VAL 92 Cb 0.37 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 1l5y h VAL 92 CO 0.01 0.04 -0.04 -0.61 0.02 0.00 0.00 177.57 176.99 1l5y h GLN 93 N 0.21 0.94 -0.32 1.57 5.75 -1.17 -0.69 115.11 121.40 1l5y h GLN 93 Ca 0.10 -0.29 0.00 0.00 -0.15 0.00 0.00 58.65 58.31 1l5y h GLN 93 Cb 0.05 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.50 1l5y h GLN 93 CO -0.09 0.95 0.21 0.00 -2.65 0.00 0.00 178.83 177.25 1l5y h ALA 94 N 1.10 0.41 -0.39 3.38 0.00 -1.06 0.21 119.26 122.90 1l5y h ALA 94 Ca 0.15 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1l5y h ALA 94 Cb 0.55 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1l5y h ALA 94 CO 0.03 -0.13 0.01 0.82 0.00 0.00 0.00 179.25 179.98 1l5y h ILE 95 N 0.43 1.26 -0.32 0.00 1.08 -1.14 -0.14 117.51 118.67 1l5y h ILE 95 Ca 0.12 -0.99 -0.04 0.00 -0.39 0.00 0.00 64.86 63.56 1l5y h ILE 95 Cb -0.05 1.13 -0.02 0.00 -3.07 0.00 0.00 36.82 34.81 1l5y h ILE 95 CO -0.03 0.33 0.02 1.56 -0.69 0.00 0.00 178.15 179.35 1l5y h GLN 96 N 0.51 0.49 0.00 2.37 4.20 -0.86 -1.05 115.11 120.77 1l5y h GLN 96 Ca 0.11 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1l5y h GLN 96 Cb 0.46 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1l5y h GLN 96 CO 0.02 0.50 0.00 -0.25 -0.67 0.00 0.00 178.83 178.43 1l5y n ASP 97 N -4.31 0.00 0.00 1.46 8.00 0.70 -4.88 116.55 117.52 1l5y n ASP 97 Ca 0.01 -0.59 0.00 0.00 0.71 0.00 0.00 54.79 54.92 1l5y n ASP 97 Cb 0.22 -0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 1l5y n ASP 97 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l5y n GLY 98 N 0.81 0.97 3.77 0.44 0.00 -0.40 -5.06 105.19 105.72 1l5y n GLY 98 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1l5y n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l5y s ALA 99 N -2.00 3.57 0.19 4.61 0.00 -0.10 -4.81 121.76 123.22 1l5y s ALA 99 Ca 0.00 1.50 -0.09 0.00 0.00 0.00 0.00 51.96 53.37 1l5y s ALA 99 Cb 0.00 -3.58 0.11 0.00 0.00 0.00 0.00 23.12 19.65 1l5y s ALA 99 CO 0.00 -0.96 1.72 -0.92 0.00 0.00 0.00 175.76 175.61 1l5y h TYR 100 N 3.23 1.15 -3.40 0.00 3.20 -1.00 -3.42 116.97 116.72 1l5y h TYR 100 Ca -0.50 -0.13 -0.03 0.00 3.14 0.00 0.00 58.73 61.22 1l5y h TYR 100 Cb 1.23 -0.33 -0.10 0.00 1.54 0.00 0.00 36.73 39.08 1l5y h TYR 100 CO 0.54 0.92 -0.01 0.34 -1.64 0.00 0.00 178.16 178.31 1l5y s ASP 101 N -6.38 -0.20 -0.17 -2.11 -1.08 -1.21 -5.01 116.67 100.50 1l5y s ASP 101 Ca -0.12 -0.63 -0.04 0.00 -0.52 0.00 0.00 52.55 51.24 1l5y s ASP 101 Cb 0.14 0.58 0.08 0.00 -1.46 0.00 0.00 42.92 42.27 1l5y s ASP 101 CO 0.84 -1.09 0.21 0.12 0.52 0.00 0.00 175.17 175.77 1l5y s PHE 102 N -3.92 -0.26 -0.14 -5.34 2.19 -1.26 -1.61 117.98 107.65 1l5y s PHE 102 Ca 0.13 0.34 0.01 0.00 0.33 0.00 0.00 56.93 57.74 1l5y s PHE 102 Cb -0.01 -0.32 -0.00 0.00 -1.31 0.00 0.00 43.02 41.37 1l5y s PHE 102 CO 0.01 -0.52 -0.18 0.42 1.83 0.00 0.00 175.22 176.79 1l5y s ILE 103 N 2.32 2.52 0.23 3.12 1.01 0.47 -4.99 121.20 125.88 1l5y s ILE 103 Ca 0.05 -0.83 -0.22 0.00 0.00 0.00 0.00 60.65 59.65 1l5y s ILE 103 Cb -0.15 -2.04 -0.09 0.00 0.01 0.00 0.00 42.46 40.20 1l5y s ILE 103 CO -0.11 0.53 0.79 0.00 0.00 0.00 0.00 174.94 176.15 1l5y s ALA 104 N 0.65 3.37 0.04 9.38 0.00 -1.26 -0.54 121.76 133.41 1l5y s ALA 104 Ca -0.09 0.29 -0.15 0.00 0.00 0.00 0.00 51.96 52.01 1l5y s ALA 104 Cb -0.16 -2.94 -0.06 0.00 0.00 0.00 0.00 23.12 19.96 1l5y s ALA 104 CO 0.02 0.28 0.46 0.15 0.00 0.00 0.00 175.76 176.68 1l5y s LYS 105 N -1.82 3.98 0.40 0.00 1.02 0.11 -3.40 119.74 120.04 1l5y s LYS 105 Ca 0.43 0.48 -0.22 0.00 0.02 0.00 0.00 55.97 56.68 1l5y s LYS 105 Cb -0.18 -3.17 -0.10 0.00 -0.52 0.00 0.00 37.83 33.85 1l5y s LYS 105 CO 0.23 0.64 0.96 -1.25 -0.92 0.00 0.00 175.35 175.01 1l5y s PRO 106 N -1.26 4.29 0.18 -1.68 0.04 -1.26 -4.62 135.00 130.68 1l5y s PRO 106 Ca 0.27 1.21 0.08 0.00 0.04 0.00 0.00 61.00 62.60 1l5y s PRO 106 Cb -0.17 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.97 1l5y s PRO 106 CO 0.16 0.02 -0.16 -0.59 0.04 0.00 0.00 177.00 176.46 1l5y s PHE 107 N -1.99 1.74 0.36 0.56 -0.12 -1.22 -5.13 117.98 112.18 1l5y s PHE 107 Ca 0.59 -0.52 -0.24 0.00 -0.05 0.00 0.00 56.93 56.71 1l5y s PHE 107 Cb -0.13 -0.84 -0.10 0.00 -0.63 0.00 0.00 43.02 41.32 1l5y s PHE 107 CO 0.17 0.33 0.95 0.00 -0.05 0.00 0.00 175.22 176.62 1l5y s ALA 108 N -2.44 3.15 0.21 1.99 0.00 -1.26 -4.95 121.76 118.45 1l5y s ALA 108 Ca 0.18 0.49 -0.09 0.00 0.00 0.00 0.00 51.96 52.54 1l5y s ALA 108 Cb -0.04 -3.18 0.27 0.00 0.00 0.00 0.00 23.12 20.18 1l5y s ALA 108 CO 0.06 0.14 1.80 0.00 0.00 0.00 0.00 175.76 177.76 1l5y h ALA 109 N 2.71 0.92 0.00 0.00 0.00 -2.00 -1.28 119.26 119.61 1l5y h ALA 109 Ca -0.48 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1l5y h ALA 109 Cb 1.19 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1l5y h ALA 109 CO 0.63 0.01 -0.11 0.38 0.00 0.00 0.00 179.25 180.17 1l5y h ASP 110 N 0.65 0.00 -0.18 0.00 3.04 -1.99 -0.65 116.42 117.30 1l5y h ASP 110 Ca 0.31 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 54.04 1l5y h ASP 110 Cb 0.25 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.53 1l5y h ASP 110 CO -0.21 0.11 -0.13 -0.09 -2.04 0.00 0.00 179.24 176.87 1l5y h ARG 111 N 0.00 0.41 -0.29 4.15 9.65 -1.62 -1.66 114.38 125.03 1l5y h ARG 111 Ca -0.00 -0.20 -0.04 0.00 -1.10 0.00 0.00 59.98 58.64 1l5y h ARG 111 Cb 0.26 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.83 1l5y h ARG 111 CO 0.01 0.75 0.03 1.25 2.80 0.00 0.00 179.97 184.81 1l5y h LEU 112 N 0.08 0.47 -0.28 3.80 5.85 -1.29 -2.87 115.31 121.07 1l5y h LEU 112 Ca 0.03 -0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 1l5y h LEU 112 Cb 0.65 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1l5y h LEU 112 CO 0.04 0.64 0.10 0.58 -0.34 0.00 0.00 178.44 179.45 1l5y h VAL 113 N 0.29 1.19 -0.69 1.05 2.07 -1.15 -1.12 116.25 117.89 1l5y h VAL 113 Ca 0.08 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 1l5y h VAL 113 Cb 0.38 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1l5y h VAL 113 CO 0.01 0.20 0.30 -0.61 0.02 0.00 0.00 177.57 177.49 1l5y h GLN 114 N 0.30 0.99 -0.32 1.57 4.15 -1.35 0.54 115.11 120.99 1l5y h GLN 114 Ca 0.09 -0.15 -0.11 0.00 0.77 0.00 0.00 58.65 59.25 1l5y h GLN 114 Cb 0.22 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 1l5y h GLN 114 CO -0.00 0.79 -0.23 1.03 -1.93 0.00 0.00 178.83 178.49 1l5y h SER 115 N 0.98 0.76 -0.52 -0.69 0.87 -1.39 -2.27 113.55 111.29 1l5y h SER 115 Ca 0.24 -0.44 -0.01 0.00 -1.23 0.00 0.00 61.79 60.35 1l5y h SER 115 Cb 0.14 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 1l5y h SER 115 CO -0.03 1.03 0.30 0.00 -0.53 0.00 0.00 176.83 177.61 1l5y h ALA 116 N 0.75 0.67 -0.21 6.23 0.00 -0.75 -1.43 119.26 124.51 1l5y h ALA 116 Ca 0.06 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1l5y h ALA 116 Cb 0.78 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1l5y h ALA 116 CO 0.06 0.18 0.03 -0.09 0.00 0.00 0.00 179.25 179.43 1l5y h ARG 117 N 0.70 0.10 -0.49 0.00 2.43 -0.79 -0.46 114.38 115.88 1l5y h ARG 117 Ca 0.19 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.23 1l5y h ARG 117 Cb 0.03 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1l5y h ARG 117 CO -0.03 0.07 -0.15 0.00 -1.51 0.00 0.00 179.97 178.35 1l5y h ARG 118 N 0.11 0.94 -0.53 0.20 3.08 -1.33 -1.71 114.38 115.14 1l5y h ARG 118 Ca 0.10 -0.36 -0.06 0.00 0.07 0.00 0.00 59.98 59.73 1l5y h ARG 118 Cb 0.10 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1l5y h ARG 118 CO -0.14 1.02 0.08 0.00 -1.07 0.00 0.00 179.97 179.86 1l5y h ALA 119 N 0.99 0.71 -0.73 0.04 0.00 -0.90 -0.98 119.26 118.38 1l5y h ALA 119 Ca 0.12 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1l5y h ALA 119 Cb 0.69 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1l5y h ALA 119 CO 0.05 0.45 0.29 1.49 0.00 0.00 0.00 179.25 181.54 1l5y h GLU 120 N 0.77 1.10 -0.54 0.00 4.22 -0.95 0.37 114.58 119.55 1l5y h GLU 120 Ca 0.16 -0.20 -0.09 0.00 0.08 0.00 0.00 59.36 59.31 1l5y h GLU 120 Cb 0.42 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1l5y h GLU 120 CO 0.01 0.90 -0.04 -0.22 -2.18 0.00 0.00 179.01 177.49 1l5y h LYS 121 N 1.06 0.95 -0.65 1.92 3.64 -0.86 0.17 116.57 122.79 1l5y h LYS 121 Ca 0.24 -0.30 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1l5y h LYS 121 Cb 0.21 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1l5y h LYS 121 CO -0.02 0.96 0.39 -0.22 -2.27 0.00 0.00 179.45 178.29 1l5y h LYS 122 N 0.86 0.88 -0.45 1.90 3.64 -0.49 -0.94 116.57 121.98 1l5y h LYS 122 Ca 0.15 -0.08 -0.14 0.00 -1.27 0.00 0.00 60.65 59.31 1l5y h LYS 122 Cb 0.56 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1l5y h LYS 122 CO 0.03 0.63 -0.28 -0.09 -2.27 0.00 0.00 179.45 177.47 1l5y h ARG 123 N 0.88 0.98 -0.64 1.90 9.65 -0.49 -2.54 114.38 124.12 1l5y h ARG 123 Ca 0.23 -0.45 0.05 0.00 -1.10 0.00 0.00 59.98 58.71 1l5y h ARG 123 Cb -0.03 -0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 28.49 1l5y h ARG 123 CO -0.04 1.13 0.37 -0.09 2.80 0.00 0.00 179.97 184.13 1l5y h ARG 124 N 0.82 0.68 -0.82 0.20 2.43 -0.21 -0.99 114.38 116.50 1l5y h ARG 124 Ca 0.09 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 1l5y h ARG 124 Cb 0.87 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.23 1l5y h ARG 124 CO 0.08 0.45 0.36 -0.07 -1.51 0.00 0.00 179.97 179.28 1l5y h LEU 125 N 0.70 1.10 -0.28 3.80 3.38 -1.05 -1.35 115.31 121.61 1l5y h LEU 125 Ca 0.28 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1l5y h LEU 125 Cb 0.13 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1l5y h LEU 125 CO -0.15 0.95 0.18 0.58 0.09 0.00 0.00 178.44 180.08 1l5y h VAL 126 N 1.17 1.07 -0.05 1.22 2.07 -0.96 -2.46 116.25 118.30 1l5y h VAL 126 Ca 0.28 -0.13 -0.09 0.00 0.82 0.00 0.00 66.70 67.58 1l5y h VAL 126 Cb 0.16 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1l5y h VAL 126 CO -0.03 0.07 -0.37 0.24 0.02 0.00 0.00 177.57 177.50 1l5y h MET 127 N 0.37 0.11 -0.06 1.57 2.86 -0.83 -2.12 114.93 116.83 1l5y h MET 127 Ca 0.10 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 1l5y h MET 127 Cb -0.04 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 1l5y h MET 127 CO -0.02 0.47 -0.00 1.49 1.06 0.00 0.00 176.91 179.90 1l5y h GLU 128 N 0.10 0.10 -0.86 1.72 4.81 -1.11 0.17 114.58 119.50 1l5y h GLU 128 Ca 0.01 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1l5y h GLU 128 Cb 0.70 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.02 1l5y h GLU 128 CO 0.05 0.40 0.55 -0.97 -0.73 0.00 0.00 179.01 178.31 1l5y h ASN 129 N -0.20 0.92 -0.61 1.04 -1.24 -1.34 0.38 115.58 114.53 1l5y h ASN 129 Ca 0.02 -0.00 -0.09 0.00 0.71 0.00 0.00 56.30 56.93 1l5y h ASN 129 Cb 0.35 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.18 1l5y h ASN 129 CO 0.00 0.63 0.02 -0.09 -1.29 0.00 0.00 177.43 176.70 1l5y h ARG 130 N 1.07 1.06 0.23 6.67 2.43 -1.18 -1.80 114.38 122.86 1l5y h ARG 130 Ca 0.35 -0.33 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1l5y h ARG 130 Cb 0.02 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1l5y h ARG 130 CO -0.12 1.02 -0.11 1.03 -1.51 0.00 0.00 179.97 180.28 1l5y h SER 131 N 0.96 -0.26 -0.86 -3.80 0.87 0.12 -2.75 113.55 107.83 1l5y h SER 131 Ca 0.18 -0.24 0.15 0.00 -1.23 0.00 0.00 61.79 60.65 1l5y h SER 131 Cb 0.53 0.07 -0.10 0.00 -0.44 0.00 0.00 62.40 62.46 1l5y h SER 131 CO 0.03 0.13 0.44 -0.07 -0.53 0.00 0.00 176.83 176.82 1l5y h LEU 132 N -0.69 0.52 -0.47 2.23 3.38 -0.25 -1.24 115.31 118.79 1l5y h LEU 132 Ca -0.03 0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 1l5y h LEU 132 Cb 0.48 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1l5y h LEU 132 CO 0.05 0.21 -0.36 0.03 0.09 0.00 0.00 178.44 178.47 1l5y h ARG 133 N 0.61 0.88 -0.01 1.13 3.08 -1.32 -2.82 114.38 115.93 1l5y h ARG 133 Ca 0.47 -0.44 -0.08 0.00 0.07 0.00 0.00 59.98 60.00 1l5y h ARG 133 Cb 0.68 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 1l5y h ARG 133 CO -0.37 1.09 -0.37 0.00 -1.07 0.00 0.00 179.97 179.25 1l5y h ARG 134 N 0.73 0.02 0.00 0.04 3.08 -1.11 -2.49 114.38 114.65 1l5y h ARG 134 Ca 0.07 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 1l5y h ARG 134 Cb 0.93 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 1l5y h ARG 134 CO 0.09 0.39 -0.30 0.00 -1.07 0.00 0.00 179.97 179.07 1l5y h ALA 135 N 1.61 1.07 -2.59 0.04 0.00 -1.08 -3.40 119.26 114.91 1l5y h ALA 135 Ca -0.00 -0.28 -0.76 0.00 0.00 0.00 0.00 54.91 53.87 1l5y h ALA 135 Cb 0.66 -0.05 -0.27 0.00 0.00 0.00 0.00 17.79 18.14 1l5y h ALA 135 CO 0.05 0.38 -0.11 0.00 0.00 0.00 0.00 179.25 179.57 1l5y s ALA 136 N -3.74 3.82 0.28 0.00 0.00 -0.94 -4.91 121.76 116.26 1l5y s ALA 136 Ca -0.00 -2.96 0.01 0.00 0.00 0.00 0.00 51.96 49.00 1l5y s ALA 136 Cb 0.11 -3.28 0.65 0.00 0.00 0.00 0.00 23.12 20.61 1l5y s ALA 136 CO 0.66 -2.13 1.68 0.93 0.00 0.00 0.00 175.76 176.90 1l5y h GLU 137 N 8.16 0.30 0.00 0.00 5.08 -1.79 0.63 114.58 126.96 1l5y h GLU 137 Ca -0.08 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1l5y h GLU 137 Cb 1.06 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1l5y h GLU 137 CO 0.86 0.20 0.00 0.00 -1.00 0.00 0.00 179.01 179.07 1l5y n ALA 138 N -2.61 1.45 0.72 3.43 0.00 -1.26 -2.27 120.51 119.97 1l5y n ALA 138 Ca 0.20 0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.77 1l5y n ALA 138 Cb 0.61 -1.21 0.47 0.00 0.00 0.00 0.00 19.45 19.32 1l5y n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l5y n ALA 139 N -1.57 2.26 -2.36 0.00 0.00 0.21 -4.82 120.51 114.24 1l5y n ALA 139 Ca 0.02 -0.04 -0.40 0.00 0.00 0.00 0.00 53.44 53.02 1l5y n ALA 139 Cb 0.13 -1.46 -0.05 0.00 0.00 0.00 0.00 19.45 18.07 1l5y n ALA 139 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1l5y s SER 140 N -4.05 7.30 0.28 0.00 0.01 -0.96 -5.07 113.70 111.22 1l5y s SER 140 Ca 0.11 1.56 0.00 0.00 1.31 0.00 0.00 55.95 58.93 1l5y s SER 140 Cb 0.14 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.86 1l5y s SER 140 CO 0.56 -0.01 0.00 -0.62 0.41 0.00 0.00 173.24 173.58 1l5y n GLU 141 N 2.81 1.33 0.00 12.44 1.02 -1.26 -5.09 120.64 131.89 1l5y n GLU 141 Ca -0.01 -2.01 0.00 0.00 -0.02 0.00 0.00 57.16 55.12 1l5y n GLU 141 Cb 0.50 0.54 0.00 0.00 -0.02 0.00 0.00 31.44 32.45 1l5y n GLU 141 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1l5y n GLY 142 N 1.70 -0.31 3.67 0.62 0.00 -1.26 -4.87 105.19 104.74 1l5y n GLY 142 Ca -0.11 -1.06 -0.47 0.00 0.00 0.00 0.00 46.02 44.38 1l5y n GLY 142 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1l5y n LEU 143 N 0.00 3.03 -4.39 0.99 7.94 -1.26 -5.02 117.00 118.29 1l5y n LEU 143 Ca 0.00 1.06 -0.28 0.00 -1.11 0.00 0.00 56.01 55.68 1l5y n LEU 143 Cb 0.00 -1.39 -0.13 0.00 0.53 0.00 0.00 43.42 42.43 1l5y n LEU 143 CO 0.00 -0.31 -0.56 -0.54 -1.11 0.00 0.00 177.39 174.87 1l5y s LYS 144 N 1.55 1.41 -0.02 1.96 -0.14 -1.26 -5.14 119.74 118.10 1l5y s LYS 144 Ca 0.82 -1.38 0.07 0.00 -1.36 0.00 0.00 55.97 54.13 1l5y s LYS 144 Cb -0.71 -1.86 -0.02 0.00 -1.68 0.00 0.00 37.83 33.56 1l5y s LYS 144 CO 0.42 0.43 -0.24 -0.51 -0.76 0.00 0.00 175.35 174.69 1l5y s LEU 145 N -2.18 2.05 0.07 3.17 1.43 -1.26 -5.13 118.68 116.82 1l5y s LEU 145 Ca 0.15 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.82 1l5y s LEU 145 Cb -0.10 -1.24 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 1l5y s LEU 145 CO 0.07 0.30 -0.05 0.00 0.23 0.00 0.00 176.35 176.89 1l5y s ALA 146 N -0.57 0.68 -1.67 4.21 0.00 -1.26 -5.34 121.76 117.80 1l5y s ALA 146 Ca 0.09 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 50.86 1l5y s ALA 146 Cb -0.09 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1l5y s ALA 146 CO -0.01 -0.28 0.42 0.00 0.00 0.00 0.00 175.76 175.89