#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j1e n LYS 36 N 0.00 0.38 -4.70 0.00 5.02 -1.26 -5.19 118.16 112.41 1j1e n LYS 36 Ca 0.00 -2.83 -0.31 0.00 -2.02 0.00 0.00 58.31 53.14 1j1e n LYS 36 Cb 0.00 2.36 -0.07 0.00 -0.02 0.00 0.00 35.03 37.30 1j1e n LYS 36 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1j1e n LYS 37 N -0.54 0.67 -2.43 1.97 5.02 -1.26 -5.17 118.16 116.41 1j1e n LYS 37 Ca 0.06 -3.77 -0.23 0.00 -2.02 0.00 0.00 58.31 52.34 1j1e n LYS 37 Cb 0.52 1.34 0.05 0.00 -0.02 0.00 0.00 35.03 36.92 1j1e n LYS 37 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1j1e s LYS 38 N -3.81 2.39 0.41 1.97 -0.14 -1.26 -5.13 119.74 114.17 1j1e s LYS 38 Ca 0.07 -0.52 0.08 0.00 -1.36 0.00 0.00 55.97 54.24 1j1e s LYS 38 Cb 0.00 -2.34 0.00 0.00 -1.68 0.00 0.00 37.83 33.82 1j1e s LYS 38 CO 0.05 -0.95 0.51 -1.54 -0.76 0.00 0.00 175.35 172.66 1j1e s SER 39 N -4.46 5.50 -0.07 2.83 1.04 -1.26 -5.10 113.70 112.19 1j1e s SER 39 Ca 0.58 -0.50 -0.26 0.00 0.48 0.00 0.00 55.95 56.25 1j1e s SER 39 Cb -0.11 -0.66 -0.23 0.00 0.10 0.00 0.00 66.02 65.12 1j1e s SER 39 CO 0.41 -0.71 1.04 0.11 0.98 0.00 0.00 173.24 175.07 1j1e h LYS 40 N 0.76 0.06 -5.62 4.02 1.79 -2.07 -3.48 116.57 112.03 1j1e h LYS 40 Ca -0.41 -0.06 -0.48 0.00 -2.18 0.00 0.00 60.65 57.52 1j1e h LYS 40 Cb 1.28 0.01 -0.14 0.00 -1.58 0.00 0.00 32.23 31.80 1j1e h LYS 40 CO 0.49 0.79 -0.72 -1.50 -1.08 0.00 0.00 179.45 177.43 1j1e s ILE 41 N -3.27 1.79 0.08 1.86 1.10 -1.26 -5.09 121.20 116.41 1j1e s ILE 41 Ca -0.17 -2.20 -0.36 0.00 -0.51 0.00 0.00 60.65 57.41 1j1e s ILE 41 Cb 0.00 -2.22 -0.16 0.00 0.15 0.00 0.00 42.46 40.23 1j1e s ILE 41 CO 0.70 -0.47 1.43 -1.54 -2.11 0.00 0.00 174.94 172.95 1j1e n SER 42 N -0.48 2.06 0.18 4.50 3.41 -1.26 -4.86 113.62 117.17 1j1e n SER 42 Ca -0.07 1.11 0.03 0.00 -0.26 0.00 0.00 58.87 59.68 1j1e n SER 42 Cb 0.61 -1.25 0.32 0.00 -0.26 0.00 0.00 64.21 63.64 1j1e n SER 42 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j1e h ALA 43 N 5.12 1.13 -0.08 7.33 0.00 -1.99 -2.81 119.26 127.97 1j1e h ALA 43 Ca -0.47 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 53.96 1j1e h ALA 43 Cb 1.31 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1j1e h ALA 43 CO 0.82 0.53 -0.39 0.77 0.00 0.00 0.00 179.25 180.97 1j1e h SER 44 N 0.00 0.17 0.39 0.00 0.02 -2.01 -3.04 113.55 109.08 1j1e h SER 44 Ca -0.00 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 1j1e h SER 44 Cb 0.84 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.33 1j1e h SER 44 CO 0.06 0.55 -0.19 -0.09 -1.14 0.00 0.00 176.83 176.02 1j1e h ARG 45 N 0.14 -0.51 -0.92 3.45 9.65 -1.88 -2.90 114.38 121.42 1j1e h ARG 45 Ca 0.01 0.03 0.36 0.00 -1.10 0.00 0.00 59.98 59.29 1j1e h ARG 45 Cb 0.76 0.12 -0.17 0.00 -1.39 0.00 0.00 29.97 29.29 1j1e h ARG 45 CO 0.06 -0.20 0.42 1.63 2.80 0.00 0.00 179.97 184.68 1j1e n LYS 46 N -5.16 -0.06 0.07 0.20 5.02 -1.09 0.17 118.16 117.31 1j1e n LYS 46 Ca -0.09 1.29 -0.13 0.00 -2.02 0.00 0.00 58.31 57.36 1j1e n LYS 46 Cb 0.28 -2.26 -0.08 0.00 -0.02 0.00 0.00 35.03 32.95 1j1e n LYS 46 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1j1e h LEU 47 N 0.00 -0.09 -1.93 -0.35 5.85 -1.42 -0.84 115.31 116.53 1j1e h LEU 47 Ca 0.75 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 59.44 1j1e h LEU 47 Cb 1.92 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.96 1j1e h LEU 47 CO -0.73 0.03 0.19 -0.61 -0.34 0.00 0.00 178.44 176.98 1j1e h GLN 48 N -0.20 0.08 0.00 1.25 4.15 0.20 1.41 115.11 121.99 1j1e h GLN 48 Ca -0.01 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.40 1j1e h GLN 48 Cb 0.17 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.84 1j1e h GLN 48 CO 0.02 0.05 -0.00 -0.07 -1.93 0.00 0.00 178.83 176.90 1j1e h LEU 49 N 0.09 -0.00 -0.64 -2.39 3.38 -1.02 -1.87 115.31 112.85 1j1e h LEU 49 Ca 0.13 -0.86 0.10 0.00 0.09 0.00 0.00 57.88 57.34 1j1e h LEU 49 Cb 0.39 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.07 1j1e h LEU 49 CO -0.01 0.86 0.25 0.11 0.09 0.00 0.00 178.44 179.74 1j1e h LYS 50 N -0.87 0.42 0.00 1.13 1.57 -0.32 1.90 116.57 120.40 1j1e h LYS 50 Ca -0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1j1e h LYS 50 Cb 0.86 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1j1e h LYS 50 CO 0.00 0.28 0.00 0.00 -0.57 0.00 0.00 179.45 179.16 1j1e h THR 51 N 0.43 0.00 0.00 -0.16 1.03 0.19 -2.74 112.91 111.66 1j1e h THR 51 Ca 0.32 -0.14 -0.37 0.00 -0.01 0.00 0.00 66.41 66.22 1j1e h THR 51 Cb 0.41 0.80 -0.07 0.00 -1.07 0.00 0.00 68.15 68.21 1j1e h THR 51 CO -0.32 0.00 -2.39 0.18 -0.01 0.00 0.00 175.52 172.99 1j1e n LEU 52 N -2.34 1.58 -0.22 0.00 4.77 0.52 -3.02 117.00 118.29 1j1e n LEU 52 Ca 0.00 -0.07 0.05 0.00 -0.03 0.00 0.00 56.01 55.96 1j1e n LEU 52 Cb 0.14 -0.24 0.31 0.00 -2.33 0.00 0.00 43.42 41.31 1j1e n LEU 52 CO 0.16 0.72 1.23 -0.07 -1.33 0.00 0.00 177.39 178.09 1j1e h LEU 53 N 0.00 0.75 0.20 2.23 3.38 0.23 -1.64 115.31 120.46 1j1e h LEU 53 Ca -0.55 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.42 1j1e h LEU 53 Cb 2.03 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.62 1j1e h LEU 53 CO -0.03 0.49 -0.09 -0.07 0.09 0.00 0.00 178.44 178.82 1j1e h LEU 54 N 0.86 -0.22 -1.23 1.67 3.38 -1.66 -2.14 115.31 115.95 1j1e h LEU 54 Ca 0.33 -0.30 0.44 0.00 0.09 0.00 0.00 57.88 58.45 1j1e h LEU 54 Cb 0.22 0.06 -0.15 0.00 0.09 0.00 0.00 40.66 40.87 1j1e h LEU 54 CO -0.11 0.31 0.74 -0.61 0.09 0.00 0.00 178.44 178.86 1j1e h GLN 55 N -0.89 0.03 0.23 1.13 4.15 -1.32 0.22 115.11 118.66 1j1e h GLN 55 Ca -0.03 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 1j1e h GLN 55 Cb 0.51 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.19 1j1e h GLN 55 CO 0.04 0.02 -0.11 0.82 -1.93 0.00 0.00 178.83 177.68 1j1e h ILE 56 N 0.03 0.35 -0.57 2.39 2.04 -1.30 -2.28 117.51 118.18 1j1e h ILE 56 Ca 0.86 -0.93 0.11 0.00 1.00 0.00 0.00 64.86 65.90 1j1e h ILE 56 Cb 2.53 0.60 -0.11 0.00 -0.74 0.00 0.00 36.82 39.10 1j1e h ILE 56 CO -0.58 0.10 -0.17 0.00 0.00 0.00 0.00 178.15 177.50 1j1e h ALA 57 N -0.80 0.31 -0.38 1.87 0.00 -0.09 3.58 119.26 123.75 1j1e h ALA 57 Ca -0.03 0.21 0.07 0.00 0.00 0.00 0.00 54.91 55.17 1j1e h ALA 57 Cb 0.39 0.48 -0.07 0.00 0.00 0.00 0.00 17.79 18.60 1j1e h ALA 57 CO 0.05 -0.47 -0.03 -0.22 0.00 0.00 0.00 179.25 178.58 1j1e h LYS 58 N -0.03 0.06 -0.67 0.00 3.11 -0.81 0.49 116.57 118.72 1j1e h LYS 58 Ca 0.27 -0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 58.05 1j1e h LYS 58 Cb 0.45 -0.01 -0.03 0.00 -1.00 0.00 0.00 32.23 31.63 1j1e h LYS 58 CO -0.60 0.04 0.20 0.37 -2.81 0.00 0.00 179.45 176.65 1j1e h GLN 59 N 0.06 1.05 0.00 1.90 4.15 0.72 -2.09 115.11 120.91 1j1e h GLN 59 Ca 0.19 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1j1e h GLN 59 Cb 0.27 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.81 1j1e h GLN 59 CO -0.34 0.92 0.00 1.49 -1.93 0.00 0.00 178.83 178.97 1j1e h GLU 60 N 0.98 0.00 0.01 1.69 4.81 0.80 -2.51 114.58 120.37 1j1e h GLU 60 Ca 0.22 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 1j1e h GLU 60 Cb 0.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1j1e h GLU 60 CO -0.01 0.00 -0.01 1.25 -0.73 0.00 0.00 179.01 179.52 1j1e h LEU 61 N 0.00 -0.01 -1.14 1.64 5.85 0.57 -2.63 115.31 119.58 1j1e h LEU 61 Ca 0.00 -0.78 0.28 0.00 0.84 0.00 0.00 57.88 58.22 1j1e h LEU 61 Cb 0.40 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 41.32 1j1e h LEU 61 CO 0.00 0.84 0.63 -0.33 -0.34 0.00 0.00 178.44 179.24 1j1e h GLU 62 N -0.93 0.44 -0.05 1.25 5.08 -1.01 0.18 114.58 119.54 1j1e h GLU 62 Ca -0.00 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1j1e h GLU 62 Cb 0.79 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 1j1e h GLU 62 CO 0.00 0.29 -0.04 -0.09 -1.00 0.00 0.00 179.01 178.17 1j1e h ARG 63 N 0.45 0.11 -0.27 2.33 2.43 -1.53 0.99 114.38 118.89 1j1e h ARG 63 Ca 0.66 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.85 1j1e h ARG 63 Cb 1.47 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.01 1j1e h ARG 63 CO -0.44 0.55 0.24 1.49 -1.51 0.00 0.00 179.97 180.30 1j1e h GLU 64 N -0.32 0.00 0.02 0.20 4.81 -0.39 1.00 114.58 119.89 1j1e h GLU 64 Ca 0.01 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1j1e h GLU 64 Cb 0.52 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1j1e h GLU 64 CO 0.01 0.00 -0.01 0.00 -0.73 0.00 0.00 179.01 178.28 1j1e h ALA 65 N 1.78 -0.02 0.00 2.92 0.00 -0.41 -2.42 119.26 121.10 1j1e h ALA 65 Ca 0.13 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1j1e h ALA 65 Cb 0.60 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1j1e h ALA 65 CO -0.00 -0.09 -0.08 1.49 0.00 0.00 0.00 179.25 180.57 1j1e h GLU 66 N -0.86 0.00 -0.03 0.00 4.57 -0.30 0.00 114.58 117.97 1j1e h GLU 66 Ca -0.00 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 58.02 1j1e h GLU 66 Cb 0.77 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.35 1j1e h GLU 66 CO 0.00 0.08 -0.70 1.49 -1.18 0.00 0.00 179.01 178.71 1j1e h GLU 67 N 0.00 0.15 0.21 1.92 4.57 -0.80 -3.17 114.58 117.46 1j1e h GLU 67 Ca -0.00 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 1j1e h GLU 67 Cb 0.24 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 1j1e h GLU 67 CO 0.01 0.79 -0.10 -0.09 -1.18 0.00 0.00 179.01 178.44 1j1e h ARG 68 N 0.10 -0.27 -1.43 1.92 2.43 -0.49 -2.77 114.38 113.87 1j1e h ARG 68 Ca -0.02 0.02 0.42 0.00 -0.81 0.00 0.00 59.98 59.59 1j1e h ARG 68 Cb 1.24 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.79 1j1e h ARG 68 CO 0.10 0.11 1.02 0.00 -1.51 0.00 0.00 179.97 179.70 1j1e h ARG 69 N -0.83 0.02 0.11 0.20 3.08 -1.51 1.44 114.38 116.90 1j1e h ARG 69 Ca -0.03 -0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.75 1j1e h ARG 69 Cb 0.51 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1j1e h ARG 69 CO 0.05 0.01 -1.21 0.78 -1.07 0.00 0.00 179.97 178.53 1j1e h GLY 70 N 0.02 0.27 2.00 0.04 0.00 -1.51 -2.97 103.07 100.91 1j1e h GLY 70 Ca 0.69 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1j1e h GLY 70 CO -0.04 0.61 0.00 -2.21 0.00 0.00 0.00 176.54 174.90 1j1e n GLU 71 N -3.51 0.25 -0.03 4.80 2.13 0.47 -2.65 120.64 122.10 1j1e n GLU 71 Ca -0.07 0.30 -0.09 0.00 0.66 0.00 0.00 57.16 57.96 1j1e n GLU 71 Cb 1.01 -1.85 -0.08 0.00 0.27 0.00 0.00 31.44 30.80 1j1e n GLU 71 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1j1e h LYS 72 N 0.00 -0.06 -0.04 5.31 3.64 -0.80 -2.55 116.57 122.08 1j1e h LYS 72 Ca 0.00 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1j1e h LYS 72 Cb 0.60 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.39 1j1e h LYS 72 CO 0.00 0.51 -0.25 0.78 -2.27 0.00 0.00 179.45 178.23 1j1e h GLY 73 N -0.95 -0.34 2.00 5.01 0.00 -1.50 0.17 103.07 107.46 1j1e h GLY 73 Ca -0.01 0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.60 1j1e h GLY 73 CO 0.01 -0.20 -0.11 3.21 0.00 0.00 0.00 176.54 179.45 1j1e h ARG 74 N -0.36 0.00 0.00 4.80 3.08 -1.64 0.55 114.38 120.80 1j1e h ARG 74 Ca 0.07 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.95 1j1e h ARG 74 Cb 0.46 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 1j1e h ARG 74 CO -0.25 0.11 -0.99 0.00 -1.07 0.00 0.00 179.97 177.77 1j1e h ALA 75 N 1.89 0.58 0.00 0.04 0.00 -0.93 -3.12 119.26 117.72 1j1e h ALA 75 Ca -0.00 -0.80 -0.16 0.00 0.00 0.00 0.00 54.91 53.95 1j1e h ALA 75 Cb 0.23 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1j1e h ALA 75 CO 0.01 1.00 -0.77 -0.07 0.00 0.00 0.00 179.25 179.42 1j1e h LEU 76 N 0.00 0.00 -0.06 0.00 3.38 0.05 -2.80 115.31 115.89 1j1e h LEU 76 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1j1e h LEU 76 Cb 1.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.37 1j1e h LEU 76 CO 0.08 0.77 0.00 -0.24 0.09 0.00 0.00 178.44 179.14 1j1e n SER 77 N -3.35 0.09 -0.08 -0.43 2.88 0.11 0.23 113.62 113.08 1j1e n SER 77 Ca 0.01 0.52 -0.20 0.00 -1.33 0.00 0.00 58.87 57.86 1j1e n SER 77 Cb 0.82 -0.54 -0.13 0.00 -0.75 0.00 0.00 64.21 63.62 1j1e n SER 77 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1j1e n THR 78 N -1.59 1.61 -0.09 2.46 -1.04 -1.09 -4.01 114.28 110.53 1j1e n THR 78 Ca 0.04 -0.56 -0.17 0.00 -2.04 0.00 0.00 64.05 61.32 1j1e n THR 78 Cb 0.23 -1.61 -0.10 0.00 -1.82 0.00 0.00 70.33 67.03 1j1e n THR 78 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 1j1e h ARG 79 N -0.10 0.00 -2.20 -2.82 9.65 -1.44 -3.38 114.38 114.09 1j1e h ARG 79 Ca -0.52 0.00 -0.59 0.00 -1.10 0.00 0.00 59.98 57.77 1j1e h ARG 79 Cb 1.90 0.00 -0.17 0.00 -1.39 0.00 0.00 29.97 30.32 1j1e h ARG 79 CO -0.05 0.85 1.06 0.00 2.80 0.00 0.00 179.97 184.62 1j1e n ALA 80 N -3.25 6.56 -1.23 2.80 0.00 0.14 -5.01 120.51 120.51 1j1e n ALA 80 Ca -0.24 -3.45 -0.38 0.00 0.00 0.00 0.00 53.44 49.37 1j1e n ALA 80 Cb 0.57 -2.34 0.02 0.00 0.00 0.00 0.00 19.45 17.70 1j1e n ALA 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1j1e n GLN 81 N 1.06 0.04 -2.36 0.00 6.02 -1.25 -4.57 117.38 116.32 1j1e n GLN 81 Ca 0.53 0.02 -0.37 0.00 -0.01 0.00 0.00 57.00 57.17 1j1e n GLN 81 Cb 0.44 -1.07 -0.02 0.00 1.02 0.00 0.00 30.24 30.61 1j1e n GLN 81 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1j1e s PRO 82 N -1.26 3.90 -0.26 -1.09 0.04 -1.26 -5.00 135.00 130.07 1j1e s PRO 82 Ca 0.56 1.68 -0.11 0.00 0.04 0.00 0.00 61.00 63.16 1j1e s PRO 82 Cb -0.45 -2.45 -0.05 0.00 0.04 0.00 0.00 34.50 31.60 1j1e s PRO 82 CO 0.67 -0.41 0.17 -1.17 0.04 0.00 0.00 177.00 176.31 1j1e s LEU 83 N -2.90 4.07 -0.82 -3.56 2.96 -1.26 -5.03 118.68 112.14 1j1e s LEU 83 Ca 0.62 0.06 -0.02 0.00 -0.22 0.00 0.00 54.13 54.56 1j1e s LEU 83 Cb -0.26 -2.11 0.20 0.00 0.50 0.00 0.00 46.19 44.52 1j1e s LEU 83 CO 0.32 0.01 0.69 -1.61 -1.32 0.00 0.00 176.35 174.44 1j1e s GLU 84 N 1.38 3.10 0.15 1.98 2.02 -1.26 -4.88 118.70 121.19 1j1e s GLU 84 Ca 0.07 -3.06 -0.00 0.00 0.02 0.00 0.00 54.97 52.00 1j1e s GLU 84 Cb -0.15 -3.91 -0.04 0.00 0.10 0.00 0.00 34.13 30.13 1j1e s GLU 84 CO 0.07 -1.24 1.35 -0.07 0.02 0.00 0.00 175.26 175.39 1j1e h LEU 85 N 6.33 0.37 -0.24 1.80 4.07 -1.98 -3.36 115.31 122.30 1j1e h LEU 85 Ca 0.11 -0.30 0.08 0.00 0.08 0.00 0.00 57.88 57.85 1j1e h LEU 85 Cb 0.86 -0.11 -0.04 0.00 1.08 0.00 0.00 40.66 42.44 1j1e h LEU 85 CO 0.81 1.10 0.04 0.00 -1.08 0.00 0.00 178.44 179.31 1j1e n ALA 86 N -2.49 0.16 0.65 1.53 0.00 -1.26 0.80 120.51 119.89 1j1e n ALA 86 Ca -0.05 0.25 0.11 0.00 0.00 0.00 0.00 53.44 53.76 1j1e n ALA 86 Cb 0.82 -0.21 0.01 0.00 0.00 0.00 0.00 19.45 20.07 1j1e n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j1e n GLY 87 N -1.10 -1.16 3.77 0.00 0.00 -1.26 -4.99 105.19 100.44 1j1e n GLY 87 Ca 0.07 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 1j1e n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j1e s LEU 88 N -3.72 3.90 0.00 0.99 1.02 0.24 -5.06 118.68 116.05 1j1e s LEU 88 Ca 0.04 2.28 0.00 0.00 0.02 0.00 0.00 54.13 56.48 1j1e s LEU 88 Cb 0.15 -4.38 0.00 0.00 0.02 0.00 0.00 46.19 41.98 1j1e s LEU 88 CO 0.81 -1.08 0.00 0.61 0.02 0.00 0.00 176.35 176.71 1j1e n GLY 89 N 0.36 1.57 0.04 -3.19 0.00 -1.26 -4.74 105.19 97.97 1j1e n GLY 89 Ca 0.09 -1.78 -0.00 0.00 0.00 0.00 0.00 46.02 44.33 1j1e n GLY 89 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1j1e h PHE 90 N 0.00 0.00 -0.09 1.61 3.57 -1.97 0.09 116.94 120.15 1j1e h PHE 90 Ca 0.00 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.53 1j1e h PHE 90 Cb 0.00 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 1j1e h PHE 90 CO 0.00 0.00 0.13 0.00 -2.23 0.00 0.00 178.31 176.21 1j1e h ALA 91 N -1.23 1.56 0.25 2.41 0.00 -1.98 0.18 119.26 120.44 1j1e h ALA 91 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1j1e h ALA 91 Cb 0.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1j1e h ALA 91 CO 0.00 -0.18 -0.12 0.93 0.00 0.00 0.00 179.25 179.88 1j1e h GLU 92 N 0.00 -0.32 -0.58 0.00 4.39 -1.94 -2.59 114.58 113.55 1j1e h GLU 92 Ca 0.04 0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.81 1j1e h GLU 92 Cb 0.31 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 1j1e h GLU 92 CO -0.00 -0.02 0.38 -0.07 -1.16 0.00 0.00 179.01 178.14 1j1e h LEU 93 N -0.99 0.54 0.18 1.33 3.38 0.49 -1.98 115.31 118.26 1j1e h LEU 93 Ca -0.03 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1j1e h LEU 93 Cb 0.45 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1j1e h LEU 93 CO 0.06 0.37 -0.09 -0.61 0.09 0.00 0.00 178.44 178.25 1j1e h GLN 94 N 0.62 -0.23 -1.22 1.13 4.15 -0.81 -1.69 115.11 117.06 1j1e h GLN 94 Ca 0.24 0.02 0.35 0.00 0.77 0.00 0.00 58.65 60.02 1j1e h GLN 94 Cb 0.16 0.05 -0.06 0.00 0.21 0.00 0.00 27.48 27.84 1j1e h GLN 94 CO -0.07 -0.16 0.86 0.22 -1.93 0.00 0.00 178.83 177.76 1j1e h ASP 95 N -1.02 0.10 0.05 -0.69 -0.00 -1.45 0.90 116.42 114.32 1j1e h ASP 95 Ca -0.02 0.03 -0.17 0.00 -0.00 0.00 0.00 57.03 56.86 1j1e h ASP 95 Cb 0.19 0.01 0.02 0.00 -0.00 0.00 0.00 39.33 39.54 1j1e h ASP 95 CO 0.04 0.01 -0.70 0.25 -0.00 0.00 0.00 179.24 178.83 1j1e h LEU 96 N 0.08 0.54 -1.43 2.28 6.46 -1.39 0.90 115.31 122.75 1j1e h LEU 96 Ca 0.61 -0.82 0.06 0.00 -0.12 0.00 0.00 57.88 57.61 1j1e h LEU 96 Cb 2.24 -0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 41.96 1j1e h LEU 96 CO -0.09 1.30 0.45 0.00 -0.62 0.00 0.00 178.44 179.47 1j1e h ALA 97 N 0.25 1.74 -0.26 1.25 0.00 0.15 0.57 119.26 122.97 1j1e h ALA 97 Ca -0.10 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 1j1e h ALA 97 Cb 1.44 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1j1e h ALA 97 CO 0.14 0.16 -0.39 0.00 0.00 0.00 0.00 179.25 179.15 1j1e h ARG 98 N 0.70 0.72 0.14 0.00 3.08 -0.03 -1.14 114.38 117.84 1j1e h ARG 98 Ca 0.29 -0.43 0.01 0.00 0.07 0.00 0.00 59.98 59.93 1j1e h ARG 98 Cb 0.25 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 1j1e h ARG 98 CO -0.09 1.05 -0.26 0.37 -1.07 0.00 0.00 179.97 179.97 1j1e h GLN 99 N 0.45 -0.47 0.21 0.04 4.15 0.16 -1.13 115.11 118.51 1j1e h GLN 99 Ca 0.02 0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.48 1j1e h GLN 99 Cb 0.98 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.76 1j1e h GLN 99 CO 0.09 -0.31 -0.23 -0.07 -1.93 0.00 0.00 178.83 176.38 1j1e h LEU 100 N -0.49 -0.61 -1.19 -2.39 3.38 0.04 -1.02 115.31 113.04 1j1e h LEU 100 Ca 0.02 0.06 0.24 0.00 0.09 0.00 0.00 57.88 58.29 1j1e h LEU 100 Cb 0.50 0.21 -0.10 0.00 0.09 0.00 0.00 40.66 41.36 1j1e h LEU 100 CO -0.13 -0.33 0.63 -0.74 0.09 0.00 0.00 178.44 177.96 1j1e h HIS 101 N -0.47 0.85 -0.45 1.13 2.76 -1.02 0.34 115.15 118.29 1j1e h HIS 101 Ca 0.00 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.08 1j1e h HIS 101 Cb 0.45 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 1j1e h HIS 101 CO -0.17 0.11 -0.21 0.00 -1.30 0.00 0.00 177.93 176.36 1j1e h ALA 102 N 1.66 0.77 -0.08 5.26 0.00 -0.37 -3.24 119.26 123.26 1j1e h ALA 102 Ca 0.59 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1j1e h ALA 102 Cb 1.25 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1j1e h ALA 102 CO -0.36 0.66 -0.09 -0.09 0.00 0.00 0.00 179.25 179.37 1j1e h ARG 103 N 0.79 0.21 -0.82 0.00 2.43 0.87 -3.21 114.38 114.65 1j1e h ARG 103 Ca 0.11 -0.11 0.26 0.00 -0.81 0.00 0.00 59.98 59.42 1j1e h ARG 103 Cb 0.77 0.01 -0.15 0.00 -0.42 0.00 0.00 29.97 30.17 1j1e h ARG 103 CO 0.06 0.65 0.15 0.28 -1.51 0.00 0.00 179.97 179.60 1j1e n VAL 104 N -4.67 -0.34 -0.07 0.20 0.31 -0.18 0.75 118.33 114.33 1j1e n VAL 104 Ca -0.07 1.75 -0.14 0.00 -0.01 0.00 0.00 64.34 65.87 1j1e n VAL 104 Cb 0.33 -2.64 -0.06 0.00 -0.91 0.00 0.00 33.84 30.56 1j1e n VAL 104 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1j1e h ASP 105 N 0.00 0.70 -0.43 4.52 3.32 -1.65 -1.07 116.42 121.81 1j1e h ASP 105 Ca 0.55 -0.52 0.05 0.00 0.02 0.00 0.00 57.03 57.13 1j1e h ASP 105 Cb 1.27 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 40.57 1j1e h ASP 105 CO -0.72 1.09 0.16 0.50 -1.72 0.00 0.00 179.24 178.55 1j1e h LYS 106 N 0.34 0.33 -0.26 3.56 3.64 0.29 -2.41 116.57 122.07 1j1e h LYS 106 Ca 0.02 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 1j1e h LYS 106 Cb 0.94 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 1j1e h LYS 106 CO 0.08 0.22 -0.16 0.28 -2.27 0.00 0.00 179.45 177.60 1j1e h VAL 107 N 0.34 1.30 -0.12 2.00 2.07 -1.20 -2.21 116.25 118.43 1j1e h VAL 107 Ca 0.20 -1.26 0.04 0.00 0.82 0.00 0.00 66.70 66.49 1j1e h VAL 107 Cb 0.17 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1j1e h VAL 107 CO -0.19 0.40 0.16 -0.78 0.02 0.00 0.00 177.57 177.17 1j1e h ASP 108 N 0.28 0.00 0.10 0.57 -0.00 -0.93 -0.23 116.42 116.22 1j1e h ASP 108 Ca 0.05 0.00 -0.21 0.00 -0.00 0.00 0.00 57.03 56.88 1j1e h ASP 108 Cb 0.68 0.00 0.02 0.00 -0.00 0.00 0.00 39.33 40.03 1j1e h ASP 108 CO 0.04 0.00 -0.87 -0.08 -0.00 0.00 0.00 179.24 178.34 1j1e h GLU 109 N 0.00 0.40 -0.11 0.28 4.81 -1.09 -2.69 114.58 116.19 1j1e h GLU 109 Ca 0.06 -0.57 0.04 0.00 -0.13 0.00 0.00 59.36 58.75 1j1e h GLU 109 Cb 0.37 0.20 -0.05 0.00 0.63 0.00 0.00 28.75 29.90 1j1e h GLU 109 CO -0.00 1.24 -0.19 0.93 -0.73 0.00 0.00 179.01 180.26 1j1e h GLU 110 N -0.15 -0.24 -0.61 1.92 5.08 -0.50 -0.95 114.58 119.13 1j1e h GLU 110 Ca -0.14 0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.40 1j1e h GLU 110 Cb 1.63 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.90 1j1e h GLU 110 CO 0.17 -0.16 0.43 -0.09 -1.00 0.00 0.00 179.01 178.36 1j1e h ARG 111 N -0.25 0.11 -0.11 2.33 2.43 -1.21 -1.26 114.38 116.42 1j1e h ARG 111 Ca 0.09 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.15 1j1e h ARG 111 Cb 0.38 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1j1e h ARG 111 CO -0.25 0.07 -0.34 -0.92 -1.51 0.00 0.00 179.97 177.03 1j1e h TYR 112 N 0.12 0.56 -0.07 2.20 3.20 -0.85 -1.78 116.97 120.34 1j1e h TYR 112 Ca 0.29 -0.22 0.01 0.00 3.14 0.00 0.00 58.73 61.96 1j1e h TYR 112 Cb 1.01 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 1j1e h TYR 112 CO -0.00 0.95 -0.02 -0.44 -1.64 0.00 0.00 178.16 177.01 1j1e h ASP 113 N 0.01 -0.08 0.60 -2.11 3.32 -0.40 1.58 116.42 119.34 1j1e h ASP 113 Ca -0.01 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1j1e h ASP 113 Cb 0.96 0.05 0.01 0.00 0.22 0.00 0.00 39.33 40.56 1j1e h ASP 113 CO 0.07 -0.03 -0.29 -0.29 -1.72 0.00 0.00 179.24 176.98 1j1e h ILE 114 N -0.01 0.39 -0.97 0.35 2.10 -1.50 -1.35 117.51 116.53 1j1e h ILE 114 Ca 0.04 -0.11 0.31 0.00 1.08 0.00 0.00 64.86 66.17 1j1e h ILE 114 Cb 0.06 0.43 -0.15 0.00 -1.09 0.00 0.00 36.82 36.07 1j1e h ILE 114 CO -0.08 0.02 0.46 -0.08 -1.08 0.00 0.00 178.15 177.39 1j1e h GLU 115 N -0.88 0.25 -0.06 2.19 4.81 -0.93 0.59 114.58 120.55 1j1e h GLU 115 Ca -0.08 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1j1e h GLU 115 Cb 0.64 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.91 1j1e h GLU 115 CO 0.14 0.16 -0.40 0.00 -0.73 0.00 0.00 179.01 178.18 1j1e h ALA 116 N 1.85 -0.59 -0.28 2.92 0.00 0.33 -1.38 119.26 122.11 1j1e h ALA 116 Ca 0.69 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.55 1j1e h ALA 116 Cb 1.56 0.73 -0.01 0.00 0.00 0.00 0.00 17.79 20.06 1j1e h ALA 116 CO -0.65 -0.92 0.07 0.87 0.00 0.00 0.00 179.25 178.63 1j1e h LYS 117 N -0.52 0.45 -0.15 0.00 1.57 0.11 -1.88 116.57 116.16 1j1e h LYS 117 Ca 0.06 -0.11 0.04 0.00 -1.87 0.00 0.00 60.65 58.78 1j1e h LYS 117 Cb 0.62 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 1j1e h LYS 117 CO -0.35 0.53 0.19 0.28 -0.57 0.00 0.00 179.45 179.53 1j1e h VAL 118 N 0.29 0.40 0.01 0.50 2.07 -0.85 0.20 116.25 118.87 1j1e h VAL 118 Ca 0.09 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 1j1e h VAL 118 Cb 0.28 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1j1e h VAL 118 CO 0.00 0.00 -0.01 0.74 0.02 0.00 0.00 177.57 178.32 1j1e h THR 119 N 0.00 1.53 -0.75 2.57 2.02 -0.64 -2.75 112.91 114.89 1j1e h THR 119 Ca 0.07 -1.90 0.19 0.00 0.77 0.00 0.00 66.41 65.53 1j1e h THR 119 Cb 0.44 2.77 -0.04 0.00 -1.74 0.00 0.00 68.15 69.58 1j1e h THR 119 CO -0.00 0.47 0.52 0.11 0.37 0.00 0.00 175.52 176.99 1j1e h LYS 120 N -0.88 0.18 -0.13 6.66 1.79 -0.31 -0.86 116.57 123.02 1j1e h LYS 120 Ca -0.00 -0.01 -0.21 0.00 -2.18 0.00 0.00 60.65 58.25 1j1e h LYS 120 Cb 0.79 -0.04 0.01 0.00 -1.58 0.00 0.00 32.23 31.40 1j1e h LYS 120 CO 0.00 0.12 -0.76 -0.91 -1.08 0.00 0.00 179.45 176.82 1j1e h ASN 121 N 0.19 0.81 -0.86 0.86 2.35 -1.03 0.03 115.58 117.93 1j1e h ASN 121 Ca 0.37 -0.53 0.11 0.00 -0.55 0.00 0.00 56.30 55.70 1j1e h ASN 121 Cb 1.16 -0.24 -0.06 0.00 0.05 0.00 0.00 38.32 39.23 1j1e h ASN 121 CO -0.07 1.31 0.56 0.40 -1.65 0.00 0.00 177.43 177.98 1j1e h ILE 122 N 0.47 0.92 0.55 2.81 2.04 -0.84 0.91 117.51 124.36 1j1e h ILE 122 Ca -0.05 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.52 1j1e h ILE 122 Cb 1.37 0.07 0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1j1e h ILE 122 CO 0.15 0.14 -0.26 0.74 0.00 0.00 0.00 178.15 178.92 1j1e h THR 123 N 0.78 0.00 -0.56 -0.27 2.02 -1.32 -0.90 112.91 112.66 1j1e h THR 123 Ca 0.41 -0.23 0.05 0.00 0.77 0.00 0.00 66.41 67.41 1j1e h THR 123 Cb 0.51 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.85 1j1e h THR 123 CO -0.17 0.00 -0.38 -0.08 0.37 0.00 0.00 175.52 175.26 1j1e h GLU 124 N -0.96 -0.06 -0.70 6.66 4.57 0.26 0.81 114.58 125.16 1j1e h GLU 124 Ca -0.07 0.00 0.11 0.00 -1.18 0.00 0.00 59.36 58.22 1j1e h GLU 124 Cb 0.56 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 29.08 1j1e h GLU 124 CO 0.12 -0.04 0.29 0.82 -1.18 0.00 0.00 179.01 179.02 1j1e h ILE 125 N -0.06 0.74 0.00 2.32 2.04 0.73 0.19 117.51 123.47 1j1e h ILE 125 Ca 0.09 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1j1e h ILE 125 Cb 0.29 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1j1e h ILE 125 CO -0.56 0.09 0.00 0.00 0.00 0.00 0.00 178.15 177.68 1j1e h ALA 126 N 1.48 1.00 0.00 1.87 0.00 0.39 -0.17 119.26 123.82 1j1e h ALA 126 Ca 0.36 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 1j1e h ALA 126 Cb 0.48 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1j1e h ALA 126 CO -0.34 0.00 -0.00 0.22 0.00 0.00 0.00 179.25 179.13 1j1e h ASP 127 N 0.00 0.00 -0.73 0.00 -0.00 0.35 -3.08 116.42 112.95 1j1e h ASP 127 Ca 0.00 -0.00 0.06 0.00 -0.00 0.00 0.00 57.03 57.09 1j1e h ASP 127 Cb 0.56 0.00 -0.06 0.00 -0.00 0.00 0.00 39.33 39.83 1j1e h ASP 127 CO 0.00 0.50 0.42 -0.07 -0.00 0.00 0.00 179.24 180.10 1j1e h LEU 128 N -1.00 0.64 -1.82 2.28 3.38 -1.03 0.34 115.31 118.09 1j1e h LEU 128 Ca -0.00 0.03 0.32 0.00 0.09 0.00 0.00 57.88 58.32 1j1e h LEU 128 Cb 0.00 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.60 1j1e h LEU 128 CO -0.00 0.40 0.80 0.74 0.09 0.00 0.00 178.44 180.47 1j1e h THR 129 N 0.77 0.44 0.21 0.22 2.02 -1.13 0.82 112.91 116.26 1j1e h THR 129 Ca 0.33 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.47 1j1e h THR 129 Cb 0.21 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1j1e h THR 129 CO -0.19 0.02 -0.10 -0.61 0.37 0.00 0.00 175.52 175.01 1j1e h GLN 130 N 0.10 -0.27 -0.77 6.66 5.75 -0.24 -2.99 115.11 123.34 1j1e h GLN 130 Ca 0.57 0.02 0.17 0.00 -0.15 0.00 0.00 58.65 59.26 1j1e h GLN 130 Cb 2.05 0.06 -0.14 0.00 1.07 0.00 0.00 27.48 30.52 1j1e h GLN 130 CO -0.09 0.10 -0.11 0.87 -2.65 0.00 0.00 178.83 176.95 1j1e h LYS 131 N -0.91 0.03 0.12 1.69 1.57 -0.43 0.88 116.57 119.53 1j1e h LYS 131 Ca -0.03 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1j1e h LYS 131 Cb 0.50 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1j1e h LYS 131 CO 0.05 0.02 -0.21 0.82 -0.57 0.00 0.00 179.45 179.56 1j1e h ILE 132 N 0.04 0.53 -1.05 1.86 2.04 -1.51 -1.40 117.51 118.03 1j1e h ILE 132 Ca 0.40 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.55 1j1e h ILE 132 Cb 0.66 0.53 -0.12 0.00 -0.74 0.00 0.00 36.82 37.15 1j1e h ILE 132 CO -0.75 0.00 0.64 0.15 0.00 0.00 0.00 178.15 178.18 1j1e h PHE 133 N -0.40 0.84 -0.30 1.37 3.57 -0.73 0.58 116.94 121.87 1j1e h PHE 133 Ca 0.02 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.45 1j1e h PHE 133 Cb 0.41 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1j1e h PHE 133 CO -0.19 -0.04 -0.25 -0.44 -2.23 0.00 0.00 178.31 175.15 1j1e h ASP 134 N 0.39 0.60 -0.35 0.41 3.45 -0.11 -3.06 116.42 117.76 1j1e h ASP 134 Ca 0.68 -0.21 -0.17 0.00 0.43 0.00 0.00 57.03 57.76 1j1e h ASP 134 Cb 1.60 -0.17 -0.00 0.00 -0.56 0.00 0.00 39.33 40.20 1j1e h ASP 134 CO -0.46 0.84 -0.44 -0.07 -1.57 0.00 0.00 179.24 177.54 1j1e h LEU 135 N 0.52 0.99 0.00 1.55 3.38 0.67 -3.52 115.31 118.90 1j1e h LEU 135 Ca 0.07 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1j1e h LEU 135 Cb 0.71 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1j1e h LEU 135 CO 0.05 1.28 0.00 0.54 0.09 0.00 0.00 178.44 180.40 1j1e n ARG 136 N -4.05 0.91 0.00 1.13 5.12 -0.66 -5.13 116.66 113.98 1j1e n ARG 136 Ca -0.03 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.89 1j1e n ARG 136 Cb 0.57 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.87 1j1e n ARG 136 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1j1e n VAL 147 N -0.73 0.00 -3.58 1.55 0.31 -1.26 -5.11 118.33 109.52 1j1e n VAL 147 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1j1e n VAL 147 Cb 0.00 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 32.89 1j1e n VAL 147 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1j1e s ARG 148 N 0.00 0.49 -0.14 5.55 1.70 -1.26 -5.17 118.95 120.13 1j1e s ARG 148 Ca 0.00 1.24 -0.09 0.00 -0.47 0.00 0.00 55.73 56.41 1j1e s ARG 148 Cb 0.00 0.75 0.05 0.00 -0.57 0.00 0.00 34.95 35.17 1j1e s ARG 148 CO 0.00 -0.17 0.34 0.96 -1.08 0.00 0.00 175.30 175.35 1j1e s ILE 149 N 2.76 -0.02 0.40 4.99 -4.36 -1.26 -5.16 121.20 118.55 1j1e s ILE 149 Ca -0.05 0.07 -0.01 0.00 -0.26 0.00 0.00 60.65 60.40 1j1e s ILE 149 Cb -0.10 -0.50 -0.03 0.00 1.25 0.00 0.00 42.46 43.08 1j1e s ILE 149 CO -0.19 0.03 0.63 -0.94 0.24 0.00 0.00 174.94 174.71 1j1e s SER 150 N 0.87 6.19 -0.02 4.36 1.04 -1.26 -5.03 113.70 119.85 1j1e s SER 150 Ca -0.06 0.53 -0.20 0.00 0.48 0.00 0.00 55.95 56.70 1j1e s SER 150 Cb -0.06 -1.98 -0.11 0.00 0.10 0.00 0.00 66.02 63.96 1j1e s SER 150 CO -0.06 -0.44 0.84 0.00 0.98 0.00 0.00 173.24 174.55 1j1e h ALA 151 N 0.56 -0.72 -0.09 5.32 0.00 -2.01 -3.09 119.26 119.21 1j1e h ALA 151 Ca -0.48 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.29 1j1e h ALA 151 Cb 1.22 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 1j1e h ALA 151 CO 0.61 -0.67 0.15 -0.44 0.00 0.00 0.00 179.25 178.89 1j1e h ASP 152 N -1.19 0.00 -0.12 0.00 3.32 -1.98 0.42 116.42 116.87 1j1e h ASP 152 Ca -0.07 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.77 1j1e h ASP 152 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1j1e h ASP 152 CO 0.12 0.00 -0.68 0.00 -1.72 0.00 0.00 179.24 176.96 1j1e h ALA 153 N 1.80 0.43 0.11 3.45 0.00 -1.97 -0.75 119.26 122.33 1j1e h ALA 153 Ca 0.04 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1j1e h ALA 153 Cb 0.34 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1j1e h ALA 153 CO -0.00 0.69 -0.05 1.98 0.00 0.00 0.00 179.25 181.87 1j1e h MET 154 N 0.53 -0.14 -0.67 0.00 1.85 -0.90 -1.52 114.93 114.10 1j1e h MET 154 Ca -0.02 0.01 0.09 0.00 -0.61 0.00 0.00 59.70 59.17 1j1e h MET 154 Cb 1.29 0.03 -0.07 0.00 0.43 0.00 0.00 31.60 33.28 1j1e h MET 154 CO 0.14 0.30 0.30 0.52 -0.40 0.00 0.00 176.91 177.77 1j1e h MET 155 N -0.65 0.50 -0.38 0.39 2.07 -1.21 0.80 114.93 116.44 1j1e h MET 155 Ca -0.01 -0.03 0.07 0.00 -2.07 0.00 0.00 59.70 57.65 1j1e h MET 155 Cb 0.51 -0.11 -0.06 0.00 -1.87 0.00 0.00 31.60 30.06 1j1e h MET 155 CO 0.02 0.33 0.00 0.37 1.07 0.00 0.00 176.91 178.71 1j1e h GLN 156 N 0.51 0.10 -0.93 1.72 4.15 -1.05 -0.58 115.11 119.05 1j1e h GLN 156 Ca 0.33 -0.01 0.05 0.00 0.77 0.00 0.00 58.65 59.80 1j1e h GLN 156 Cb 0.38 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 27.99 1j1e h GLN 156 CO -0.29 0.07 0.60 0.00 -1.93 0.00 0.00 178.83 177.28 1j1e h ALA 157 N 1.33 1.46 0.00 3.38 0.00 0.15 -2.49 119.26 123.09 1j1e h ALA 157 Ca 0.19 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1j1e h ALA 157 Cb 0.26 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1j1e h ALA 157 CO -0.31 0.42 -0.25 -0.07 0.00 0.00 0.00 179.25 179.04 1j1e h LEU 158 N 1.10 0.00 0.00 0.00 3.38 -0.07 -3.41 115.31 116.31 1j1e h LEU 158 Ca 0.39 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 1j1e h LEU 158 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1j1e h LEU 158 CO -0.14 0.72 -0.45 -0.07 0.09 0.00 0.00 178.44 178.59 1j1e h LEU 159 N -1.00 0.00 0.00 1.67 3.38 -1.26 -3.50 115.31 114.60 1j1e h LEU 159 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1j1e h LEU 159 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1j1e h LEU 159 CO -0.02 0.38 0.00 0.61 0.09 0.00 0.00 178.44 179.50 1j1e n GLY 160 N 1.20 0.88 3.07 0.83 0.00 -0.94 -4.73 105.19 105.50 1j1e n GLY 160 Ca 0.02 -1.07 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 1j1e n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1e n ALA 161 N 1.56 5.00 -1.27 4.61 0.00 -1.26 -4.70 120.51 124.45 1j1e n ALA 161 Ca 0.00 -4.75 0.00 0.00 0.00 0.00 0.00 53.44 48.69 1j1e n ALA 161 Cb 0.00 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.03 1j1e n ALA 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04