#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9d n SER 2 N 0.00 -1.18 -4.75 1.61 3.41 -1.26 -4.92 113.62 106.53 2d9d n SER 2 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 2d9d n SER 2 Cb 0.00 -1.32 -0.03 0.00 -0.26 0.00 0.00 64.21 62.61 2d9d n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2d9d s SER 3 N -2.45 6.81 -0.49 4.04 0.01 -1.26 -4.99 113.70 115.36 2d9d s SER 3 Ca 0.68 2.55 0.06 0.00 1.31 0.00 0.00 55.95 60.55 2d9d s SER 3 Cb -0.25 -2.62 0.19 0.00 0.21 0.00 0.00 66.02 63.55 2d9d s SER 3 CO 0.63 -0.57 0.65 0.61 0.41 0.00 0.00 173.24 174.98 2d9d n GLY 4 N 1.90 0.05 3.48 3.44 0.00 -1.26 -5.12 105.19 107.67 2d9d n GLY 4 Ca 0.05 0.06 -0.08 0.00 0.00 0.00 0.00 46.02 46.05 2d9d n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d9d s SER 5 N 0.59 -0.76 -0.25 1.61 1.04 -1.26 -5.13 113.70 109.53 2d9d s SER 5 Ca 0.31 1.26 -0.01 0.00 0.48 0.00 0.00 55.95 57.99 2d9d s SER 5 Cb 0.02 1.23 0.08 0.00 0.10 0.00 0.00 66.02 67.44 2d9d s SER 5 CO -0.09 -0.22 0.03 -0.94 0.98 0.00 0.00 173.24 173.00 2d9d s SER 6 N 1.71 3.69 0.20 7.02 1.04 -1.26 -4.91 113.70 121.19 2d9d s SER 6 Ca -0.09 -1.28 -0.22 0.00 0.48 0.00 0.00 55.95 54.84 2d9d s SER 6 Cb -0.07 -0.94 0.07 0.00 0.10 0.00 0.00 66.02 65.18 2d9d s SER 6 CO -0.17 -0.32 1.00 -0.83 0.98 0.00 0.00 173.24 173.90 2d9d s GLY 7 N 1.57 0.05 0.21 7.32 0.00 -1.26 -5.03 107.32 110.19 2d9d s GLY 7 Ca 0.02 -0.26 -0.07 0.00 0.00 0.00 0.00 44.72 44.40 2d9d s GLY 7 CO -0.13 1.54 1.22 -1.26 0.00 0.00 0.00 173.10 174.47 2d9d n SER 8 N -1.06 -0.31 -0.33 1.64 2.88 -1.26 0.48 113.62 115.66 2d9d n SER 8 Ca -0.04 1.35 0.02 0.00 -1.33 0.00 0.00 58.87 58.86 2d9d n SER 8 Cb 0.60 -0.39 0.07 0.00 -0.75 0.00 0.00 64.21 63.74 2d9d n SER 8 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2d9d n ILE 9 N -5.26 -0.43 0.05 2.46 2.08 -1.26 -0.44 119.36 116.56 2d9d n ILE 9 Ca 0.12 2.08 -0.12 0.00 0.56 0.00 0.00 62.75 65.39 2d9d n ILE 9 Cb 0.38 -2.80 -0.08 0.00 -0.75 0.00 0.00 39.64 36.39 2d9d n ILE 9 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2d9d h LEU 10 N 0.00 -0.17 -1.15 1.39 -0.00 -0.32 -1.79 115.31 113.27 2d9d h LEU 10 Ca 0.36 -0.37 0.13 0.00 -0.00 0.00 0.00 57.88 58.00 2d9d h LEU 10 Cb 0.58 0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 41.27 2d9d h LEU 10 CO -0.90 0.35 0.83 0.11 -0.00 0.00 0.00 178.44 178.84 2d9d h LYS 11 N -0.79 0.00 0.07 1.13 1.57 -0.42 0.46 116.57 118.59 2d9d h LYS 11 Ca -0.02 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.39 2d9d h LYS 11 Cb 0.53 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.80 2d9d h LYS 11 CO 0.03 0.00 -2.17 -0.89 -0.57 0.00 0.00 179.45 175.86 2d9d n ILE 12 N -3.08 1.66 0.14 1.86 5.41 0.41 -4.08 119.36 121.67 2d9d n ILE 12 Ca 0.09 -0.59 0.19 0.00 1.00 0.00 0.00 62.75 63.45 2d9d n ILE 12 Cb 0.98 -1.64 0.76 0.00 -0.71 0.00 0.00 39.64 39.04 2d9d n ILE 12 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2d9d h GLU 13 N -0.04 0.00 0.20 0.38 5.08 0.82 -2.14 114.58 118.89 2d9d h GLU 13 Ca -0.49 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 2d9d h GLU 13 Cb 1.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.19 2d9d h GLU 13 CO -0.01 0.00 -0.10 0.87 -1.00 0.00 0.00 179.01 178.78 2d9d h LYS 14 N 0.00 -0.26 -1.54 2.33 6.56 -1.59 0.26 116.57 122.34 2d9d h LYS 14 Ca 0.16 0.02 0.50 0.00 -1.06 0.00 0.00 60.65 60.27 2d9d h LYS 14 Cb 1.00 0.06 -0.12 0.00 -0.57 0.00 0.00 32.23 32.59 2d9d h LYS 14 CO -0.00 -0.11 1.03 0.28 -2.06 0.00 0.00 179.45 178.59 2d9d h VAL 15 N -1.05 0.01 0.07 0.50 2.07 -1.53 0.29 116.25 116.60 2d9d h VAL 15 Ca -0.03 -0.00 -0.35 0.00 0.82 0.00 0.00 66.70 67.14 2d9d h VAL 15 Cb 0.27 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.01 2d9d h VAL 15 CO 0.04 0.00 -2.01 0.18 0.02 0.00 0.00 177.57 175.81 2d9d n LEU 16 N -4.53 2.51 -0.33 2.57 4.77 -1.13 -3.66 117.00 117.20 2d9d n LEU 16 Ca 0.42 0.19 -0.04 0.00 -0.03 0.00 0.00 56.01 56.54 2d9d n LEU 16 Cb 1.69 -1.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.74 2d9d n LEU 16 CO 0.25 0.74 0.45 1.17 -1.33 0.00 0.00 177.39 178.68 2d9d n LYS 17 N -3.68 -0.26 0.03 3.23 3.00 0.98 -0.81 118.16 120.65 2d9d n LYS 17 Ca -0.37 1.27 -0.13 0.00 -0.00 0.00 0.00 58.31 59.09 2d9d n LYS 17 Cb 0.95 -1.88 -0.09 0.00 0.00 0.00 0.00 35.03 34.01 2d9d n LYS 17 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 2d9d h ARG 18 N 0.00 -0.12 -0.83 1.64 9.65 -1.68 -3.13 114.38 119.91 2d9d h ARG 18 Ca 0.23 0.01 0.24 0.00 -1.10 0.00 0.00 59.98 59.36 2d9d h ARG 18 Cb 0.44 0.03 -0.15 0.00 -1.39 0.00 0.00 29.97 28.89 2d9d h ARG 18 CO -0.81 0.32 0.06 -0.12 2.80 0.00 0.00 179.97 182.22 2d9d n MET 19 N -4.92 -0.06 0.38 0.20 1.56 0.01 -0.38 117.12 113.90 2d9d n MET 19 Ca -0.09 1.24 -0.15 0.00 -0.27 0.00 0.00 57.70 58.43 2d9d n MET 19 Cb 0.26 -1.99 -0.07 0.00 2.15 0.00 0.00 33.22 33.56 2d9d n MET 19 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2d9d h ARG 20 N 0.00 -0.95 -0.53 2.12 3.08 -1.13 -2.62 114.38 114.35 2d9d h ARG 20 Ca 0.53 0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.70 2d9d h ARG 20 Cb 1.13 0.22 -0.09 0.00 0.08 0.00 0.00 29.97 31.30 2d9d h ARG 20 CO -0.77 -0.63 -0.54 0.93 -1.07 0.00 0.00 179.97 177.89 2d9d h GLU 21 N -1.21 -0.30 -0.83 0.04 5.08 -0.65 0.83 114.58 117.54 2d9d h GLU 21 Ca -0.10 0.02 0.20 0.00 -1.00 0.00 0.00 59.36 58.48 2d9d h GLU 21 Cb 0.76 0.07 -0.13 0.00 0.50 0.00 0.00 28.75 29.94 2d9d h GLU 21 CO 0.17 -0.20 0.19 0.82 -1.00 0.00 0.00 179.01 178.99 2d9d h ILE 22 N -0.31 0.37 0.25 3.13 2.04 -1.10 -0.67 117.51 121.24 2d9d h ILE 22 Ca 0.11 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.89 2d9d h ILE 22 Cb 0.56 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 2d9d h ILE 22 CO -0.67 0.04 -0.37 0.50 0.00 0.00 0.00 178.15 177.65 2d9d h LYS 23 N 0.22 -0.63 -1.00 2.37 3.11 -0.45 0.16 116.57 120.34 2d9d h LYS 23 Ca 0.50 0.04 0.19 0.00 -2.81 0.00 0.00 60.65 58.57 2d9d h LYS 23 Cb 0.94 0.14 -0.11 0.00 -1.00 0.00 0.00 32.23 32.21 2d9d h LYS 23 CO -0.62 -0.42 0.61 -0.97 -2.81 0.00 0.00 179.45 175.25 2d9d h ASN 24 N -0.65 0.78 0.37 4.20 -1.24 -0.73 0.43 115.58 118.72 2d9d h ASN 24 Ca -0.03 0.10 -0.07 0.00 0.71 0.00 0.00 56.30 57.01 2d9d h ASN 24 Cb 0.59 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.60 2d9d h ASN 24 CO -0.11 0.26 -0.32 -0.08 -1.29 0.00 0.00 177.43 175.89 2d9d h GLU 25 N 0.75 0.00 0.15 6.67 4.81 -0.52 -0.92 114.58 125.51 2d9d h GLU 25 Ca 0.58 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 59.52 2d9d h GLU 25 Cb 0.93 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.33 2d9d h GLU 25 CO -0.39 0.32 -1.28 1.25 -0.73 0.00 0.00 179.01 178.18 2d9d h LEU 26 N 0.00 0.74 0.45 1.64 5.85 0.27 -2.79 115.31 121.47 2d9d h LEU 26 Ca -0.00 -0.73 -0.02 0.00 0.84 0.00 0.00 57.88 57.97 2d9d h LEU 26 Cb 0.59 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.39 2d9d h LEU 26 CO 0.04 1.55 -0.22 -0.07 -0.34 0.00 0.00 178.44 179.41 2d9d h LEU 27 N 0.20 -0.51 -1.15 2.25 3.38 -0.74 -3.24 115.31 115.49 2d9d h LEU 27 Ca -0.19 -0.05 0.15 0.00 0.09 0.00 0.00 57.88 57.89 2d9d h LEU 27 Cb 1.97 0.13 -0.08 0.00 0.09 0.00 0.00 40.66 42.77 2d9d h LEU 27 CO 0.24 -0.09 0.60 1.56 0.09 0.00 0.00 178.44 180.84 2d9d h GLN 28 N -1.10 0.77 -6.24 1.13 1.08 -1.33 -3.43 115.11 105.99 2d9d h GLN 28 Ca -0.06 -0.05 -0.57 0.00 -1.45 0.00 0.00 58.65 56.52 2d9d h GLN 28 Cb 0.53 -0.17 0.20 0.00 -0.05 0.00 0.00 27.48 27.99 2d9d h GLN 28 CO 0.10 0.51 -1.13 0.00 -0.95 0.00 0.00 178.83 177.36 2d9d n ALA 29 N -2.39 -3.39 -0.09 3.87 0.00 -1.05 -4.93 120.51 112.52 2d9d n ALA 29 Ca 0.19 -0.35 -0.10 0.00 0.00 0.00 0.00 53.44 53.19 2d9d n ALA 29 Cb 0.47 -1.47 -0.13 0.00 0.00 0.00 0.00 19.45 18.32 2d9d n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d9d n GLN 30 N 0.98 1.05 -3.35 0.00 10.64 -1.26 -4.69 117.38 120.74 2d9d n GLN 30 Ca 0.05 0.02 -0.28 0.00 -1.83 0.00 0.00 57.00 54.96 2d9d n GLN 30 Cb 0.51 -1.45 -0.07 0.00 -0.86 0.00 0.00 30.24 28.38 2d9d n GLN 30 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2d9d n ASN 31 N -2.74 4.01 0.00 2.61 4.13 -1.26 -4.87 115.26 117.15 2d9d n ASN 31 Ca -0.30 -3.47 0.07 0.00 1.68 0.00 0.00 54.58 52.56 2d9d n ASN 31 Cb 1.04 -0.70 0.34 0.00 -1.54 0.00 0.00 39.78 38.92 2d9d n ASN 31 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 2d9d n PRO 32 N 0.77 0.12 0.33 3.52 -0.04 -1.26 -3.05 135.00 135.39 2d9d n PRO 32 Ca 0.30 0.19 0.20 0.00 -0.04 0.00 0.00 63.50 64.15 2d9d n PRO 32 Cb 0.40 -1.50 1.07 0.00 -0.04 0.00 0.00 33.50 33.43 2d9d n PRO 32 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2d9d h SER 33 N 0.00 0.00 -0.00 3.54 4.64 -1.98 0.16 113.55 119.91 2d9d h SER 33 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2d9d h SER 33 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2d9d h SER 33 CO 0.00 0.00 -0.60 -0.62 -0.87 0.00 0.00 176.83 174.74 2d9d n GLU 34 N -3.13 2.16 0.04 4.77 -0.58 -1.17 -4.35 120.64 118.39 2d9d n GLU 34 Ca -0.02 -0.16 0.11 0.00 -0.42 0.00 0.00 57.16 56.67 2d9d n GLU 34 Cb 0.18 -1.19 0.02 0.00 -0.57 0.00 0.00 31.44 29.87 2d9d n GLU 34 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2d9d n LEU 35 N -1.09 0.61 -0.29 -4.62 4.77 0.45 -4.13 117.00 112.70 2d9d n LEU 35 Ca 0.03 0.07 0.12 0.00 -0.03 0.00 0.00 56.01 56.21 2d9d n LEU 35 Cb 0.24 -0.09 0.37 0.00 -2.33 0.00 0.00 43.42 41.61 2d9d n LEU 35 CO 0.27 -0.01 1.22 1.88 -1.33 0.00 0.00 177.39 179.42 2d9d h TYR 36 N 0.00 0.86 0.00 -1.77 0.05 -1.41 -1.07 116.97 113.64 2d9d h TYR 36 Ca 0.00 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.81 2d9d h TYR 36 Cb 0.80 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 38.27 2d9d h TYR 36 CO 0.00 0.30 -0.05 -0.07 -1.05 0.00 0.00 178.16 177.28 2d9d h LEU 37 N 0.71 0.00 -0.58 3.88 -0.00 -1.87 -3.19 115.31 114.26 2d9d h LEU 37 Ca 0.47 0.00 0.05 0.00 -0.00 0.00 0.00 57.88 58.40 2d9d h LEU 37 Cb 0.76 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 41.35 2d9d h LEU 37 CO -0.23 0.36 -0.34 -1.20 -0.00 0.00 0.00 178.44 177.03 2d9d n SER 38 N -3.85 -0.61 -0.05 -0.43 7.64 -1.18 -0.12 113.62 115.01 2d9d n SER 38 Ca -0.01 1.44 -0.07 0.00 1.01 0.00 0.00 58.87 61.24 2d9d n SER 38 Cb 0.03 -0.34 -0.05 0.00 -1.01 0.00 0.00 64.21 62.83 2d9d n SER 38 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2d9d h SER 39 N 0.00 -0.95 -1.06 6.43 0.02 -1.39 0.11 113.55 116.70 2d9d h SER 39 Ca 0.09 0.12 0.33 0.00 -0.84 0.00 0.00 61.79 61.49 2d9d h SER 39 Cb 0.24 0.39 -0.13 0.00 0.14 0.00 0.00 62.40 63.03 2d9d h SER 39 CO -0.54 -0.22 0.64 0.50 -1.14 0.00 0.00 176.83 176.06 2d9d h LYS 40 N -0.24 0.31 0.12 3.45 3.64 -1.33 -0.03 116.57 122.49 2d9d h LYS 40 Ca 0.03 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2d9d h LYS 40 Cb 0.32 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 2d9d h LYS 40 CO -0.29 0.20 -0.06 1.15 -2.27 0.00 0.00 179.45 178.19 2d9d h THR 41 N 0.31 0.00 -0.68 1.00 2.02 0.18 -2.92 112.91 112.82 2d9d h THR 41 Ca 0.72 -0.05 0.11 0.00 0.77 0.00 0.00 66.41 67.97 2d9d h THR 41 Cb 1.77 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 68.06 2d9d h THR 41 CO -0.51 0.00 -0.35 -0.08 0.37 0.00 0.00 175.52 174.95 2d9d h GLU 42 N -0.21 -0.13 -0.30 6.66 4.57 -0.32 -2.11 114.58 122.75 2d9d h GLU 42 Ca -0.02 0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.20 2d9d h GLU 42 Cb 0.13 0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.70 2d9d h GLU 42 CO 0.03 -0.08 -0.21 -0.07 -1.18 0.00 0.00 179.01 177.49 2d9d h LEU 43 N -0.13 -0.75 -0.99 1.64 3.38 -1.11 0.77 115.31 118.12 2d9d h LEU 43 Ca 0.25 0.11 0.21 0.00 0.09 0.00 0.00 57.88 58.55 2d9d h LEU 43 Cb 0.56 0.32 -0.19 0.00 0.09 0.00 0.00 40.66 41.45 2d9d h LEU 43 CO -0.75 -0.10 -0.19 0.00 0.09 0.00 0.00 178.44 177.49 2d9d n GLN 44 N -3.77 -0.09 -0.04 1.13 6.02 -0.82 -0.33 117.38 119.50 2d9d n GLN 44 Ca 0.00 1.53 -0.10 0.00 -0.01 0.00 0.00 57.00 58.43 2d9d n GLN 44 Cb 0.10 -2.32 -0.03 0.00 1.02 0.00 0.00 30.24 29.01 2d9d n GLN 44 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2d9d h GLY 45 N 0.00 -0.37 -0.13 1.08 0.00 -0.60 -2.49 103.07 100.56 2d9d h GLY 45 Ca 0.50 0.39 0.06 0.00 0.00 0.00 0.00 47.33 48.29 2d9d h GLY 45 CO -1.00 -0.21 -0.40 1.41 0.00 0.00 0.00 176.54 176.34 2d9d h LEU 46 N -0.34 -1.29 -0.97 3.11 3.38 -0.15 -0.31 115.31 118.74 2d9d h LEU 46 Ca 0.12 0.19 0.35 0.00 0.09 0.00 0.00 57.88 58.63 2d9d h LEU 46 Cb 0.54 0.55 -0.18 0.00 0.09 0.00 0.00 40.66 41.66 2d9d h LEU 46 CO -0.41 -0.38 0.31 -0.38 0.09 0.00 0.00 178.44 177.67 2d9d n ILE 47 N -5.42 -0.41 -0.33 1.22 5.41 -0.95 0.11 119.36 118.98 2d9d n ILE 47 Ca -0.02 2.05 0.19 0.00 1.00 0.00 0.00 62.75 65.97 2d9d n ILE 47 Cb 0.35 -3.17 0.36 0.00 -0.71 0.00 0.00 39.64 36.47 2d9d n ILE 47 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2d9d h GLY 48 N 0.00 1.51 0.43 7.39 0.00 -0.90 0.50 103.07 112.01 2d9d h GLY 48 Ca 0.72 0.07 0.07 0.00 0.00 0.00 0.00 47.33 48.20 2d9d h GLY 48 CO -0.82 -0.58 0.11 1.46 0.00 0.00 0.00 176.54 176.71 2d9d h GLN 49 N 0.02 0.24 -0.79 4.80 4.20 -0.46 -2.35 115.11 120.77 2d9d h GLN 49 Ca 0.66 -0.01 0.16 0.00 0.06 0.00 0.00 58.65 59.52 2d9d h GLN 49 Cb 1.48 -0.05 -0.15 0.00 0.30 0.00 0.00 27.48 29.05 2d9d h GLN 49 CO -0.87 0.16 -0.19 1.28 -0.67 0.00 0.00 178.83 178.54 2d9d n LEU 50 N -5.09 -0.27 -0.31 1.46 4.77 0.18 0.12 117.00 117.85 2d9d n LEU 50 Ca 0.05 1.35 0.08 0.00 -0.03 0.00 0.00 56.01 57.46 2d9d n LEU 50 Cb 0.22 -0.41 0.18 0.00 -2.33 0.00 0.00 43.42 41.08 2d9d n LEU 50 CO 0.22 -1.30 0.76 -0.78 -1.33 0.00 0.00 177.39 174.95 2d9d h ASP 51 N 0.00 -0.59 0.53 -1.43 3.58 -1.49 -1.46 116.42 115.56 2d9d h ASP 51 Ca 0.38 0.25 -0.02 0.00 0.42 0.00 0.00 57.03 58.06 2d9d h ASP 51 Cb 0.59 0.48 -0.00 0.00 1.72 0.00 0.00 39.33 42.12 2d9d h ASP 51 CO -0.81 -0.28 -0.35 -0.33 -2.88 0.00 0.00 179.24 174.59 2d9d h GLU 52 N 0.03 -0.80 -4.89 0.28 4.39 0.79 -3.43 114.58 110.96 2d9d h GLU 52 Ca 0.48 0.05 -0.72 0.00 0.34 0.00 0.00 59.36 59.52 2d9d h GLU 52 Cb 0.86 0.18 0.01 0.00 -0.10 0.00 0.00 28.75 29.70 2d9d h GLU 52 CO -0.86 -0.53 0.56 0.28 -1.16 0.00 0.00 179.01 177.30 2d9d n VAL 53 N -4.53 0.00 -2.15 3.13 0.31 -0.55 -4.90 118.33 109.63 2d9d n VAL 53 Ca -0.10 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 63.96 2d9d n VAL 53 Cb 0.35 -0.40 0.09 0.00 -0.91 0.00 0.00 33.84 32.96 2d9d n VAL 53 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2d9d s SER 54 N 2.43 4.51 -0.14 4.52 1.04 -1.26 -4.99 113.70 119.80 2d9d s SER 54 Ca 0.85 0.41 -0.03 0.00 0.48 0.00 0.00 55.95 57.67 2d9d s SER 54 Cb -1.22 -0.93 0.05 0.00 0.10 0.00 0.00 66.02 64.01 2d9d s SER 54 CO 0.67 -1.82 0.04 -1.48 0.98 0.00 0.00 173.24 171.63 2d9d s LEU 55 N -5.37 0.69 0.68 2.42 2.34 -1.26 -4.80 118.68 113.38 2d9d s LEU 55 Ca 0.63 -0.46 0.04 0.00 0.06 0.00 0.00 54.13 54.41 2d9d s LEU 55 Cb -0.09 -0.42 0.12 0.00 -0.56 0.00 0.00 46.19 45.25 2d9d s LEU 55 CO 0.46 -0.28 0.94 -1.83 -1.06 0.00 0.00 176.35 174.58 2d9d s GLU 56 N 1.99 1.84 0.28 1.48 1.03 -1.26 -4.94 118.70 119.13 2d9d s GLU 56 Ca 0.02 -1.45 0.01 0.00 0.03 0.00 0.00 54.97 53.58 2d9d s GLU 56 Cb -0.15 -2.46 0.67 0.00 -0.80 0.00 0.00 34.13 31.39 2d9d s GLU 56 CO -0.07 -1.29 1.64 -0.22 -1.33 0.00 0.00 175.26 173.99 2d9d h LYS 57 N -0.28 0.18 -6.06 -4.83 1.63 -2.01 -3.40 116.57 101.79 2d9d h LYS 57 Ca -0.32 -0.01 -0.70 0.00 -0.85 0.00 0.00 60.65 58.78 2d9d h LYS 57 Cb 1.27 -0.04 0.09 0.00 -0.60 0.00 0.00 32.23 32.95 2d9d h LYS 57 CO 0.38 0.12 -0.25 -1.71 -3.45 0.00 0.00 179.45 174.54 2d9d n ASN 58 N -5.25 -0.50 -0.07 4.20 2.85 -1.26 -4.88 115.26 110.34 2d9d n ASN 58 Ca 0.20 1.14 -0.13 0.00 -0.11 0.00 0.00 54.58 55.68 2d9d n ASN 58 Cb 0.66 -0.99 -0.06 0.00 1.24 0.00 0.00 39.78 40.63 2d9d n ASN 58 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2d9d h PRO 59 N 1.84 0.47 0.00 1.20 0.13 -1.99 -2.98 132.00 130.67 2d9d h PRO 59 Ca -0.36 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2d9d h PRO 59 Cb 1.42 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.56 2d9d h PRO 59 CO 0.61 0.82 0.00 0.00 -0.23 0.00 0.00 178.00 179.19 2d9d h ILE 61 N 0.00 0.05 -0.23 0.00 5.03 -1.92 1.24 117.51 121.69 2d9d h ILE 61 Ca 0.00 -0.01 -0.13 0.00 -0.12 0.00 0.00 64.86 64.59 2d9d h ILE 61 Cb 0.00 0.01 -0.00 0.00 -3.03 0.00 0.00 36.82 33.80 2d9d h ILE 61 CO 0.00 0.01 -0.38 -0.09 -0.68 0.00 0.00 178.15 177.01 2d9d h ARG 62 N 0.04 0.66 0.22 2.37 2.43 -1.31 -3.26 114.38 115.53 2d9d h ARG 62 Ca 0.86 -0.41 -0.01 0.00 -0.81 0.00 0.00 59.98 59.61 2d9d h ARG 62 Cb 2.72 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 32.32 2d9d h ARG 62 CO -0.46 1.02 -0.11 0.93 -1.51 0.00 0.00 179.97 179.85 2d9d h GLU 63 N 0.36 -0.29 -0.84 0.20 4.39 0.60 -3.25 114.58 115.76 2d9d h GLU 63 Ca 0.02 0.02 0.31 0.00 0.34 0.00 0.00 59.36 60.05 2d9d h GLU 63 Cb 0.97 0.06 -0.11 0.00 -0.10 0.00 0.00 28.75 29.58 2d9d h GLU 63 CO 0.09 0.03 0.51 0.00 -1.16 0.00 0.00 179.01 178.48 2d9d n ALA 64 N -2.65 0.85 0.21 3.43 0.00 0.14 0.90 120.51 123.39 2d9d n ALA 64 Ca -0.07 0.64 -0.12 0.00 0.00 0.00 0.00 53.44 53.89 2d9d n ALA 64 Cb 0.23 -0.72 -0.06 0.00 0.00 0.00 0.00 19.45 18.89 2d9d n ALA 64 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2d9d h ARG 65 N 0.00 -0.56 0.75 0.00 2.43 -1.60 -2.79 114.38 112.61 2d9d h ARG 65 Ca 0.60 0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.77 2d9d h ARG 65 Cb 1.79 0.13 0.01 0.00 -0.42 0.00 0.00 29.97 31.47 2d9d h ARG 65 CO -0.40 -0.27 -0.36 -0.09 -1.51 0.00 0.00 179.97 177.34 2d9d h ARG 66 N -1.03 -0.97 -0.99 0.20 9.65 0.48 -2.83 114.38 118.90 2d9d h ARG 66 Ca -0.06 0.07 0.35 0.00 -1.10 0.00 0.00 59.98 59.24 2d9d h ARG 66 Cb 0.55 0.22 -0.18 0.00 -1.39 0.00 0.00 29.97 29.17 2d9d h ARG 66 CO 0.10 -0.65 0.31 -2.13 2.80 0.00 0.00 179.97 180.41 2d9d n ARG 67 N -4.82 -0.07 -0.31 0.20 0.63 0.37 0.17 116.66 112.83 2d9d n ARG 67 Ca -0.12 1.41 -0.03 0.00 -0.92 0.00 0.00 57.85 58.19 2d9d n ARG 67 Cb 0.40 -2.41 0.08 0.00 0.45 0.00 0.00 32.46 30.98 2d9d n ARG 67 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2d9d h ALA 68 N 1.98 1.08 -0.75 5.13 0.00 -1.30 0.48 119.26 125.86 2d9d h ALA 68 Ca 0.74 -0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.70 2d9d h ALA 68 Cb 1.80 -0.33 -0.08 0.00 0.00 0.00 0.00 17.79 19.18 2d9d h ALA 68 CO -0.83 0.46 0.38 0.28 0.00 0.00 0.00 179.25 179.54 2d9d h VAL 69 N 1.13 0.83 0.07 0.00 2.07 0.19 -0.07 116.25 120.47 2d9d h VAL 69 Ca 0.31 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.61 2d9d h VAL 69 Cb -0.11 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 29.80 2d9d h VAL 69 CO -0.07 0.12 -0.03 0.40 0.02 0.00 0.00 177.57 178.00 2d9d h ILE 70 N 0.63 1.09 -0.66 4.57 2.04 -1.23 -2.07 117.51 121.89 2d9d h ILE 70 Ca 0.38 -1.51 0.13 0.00 1.00 0.00 0.00 64.86 64.86 2d9d h ILE 70 Cb 0.42 1.94 -0.13 0.00 -0.74 0.00 0.00 36.82 38.32 2d9d h ILE 70 CO -0.28 0.32 -0.19 -0.33 0.00 0.00 0.00 178.15 177.67 2d9d h GLU 71 N -0.89 -0.03 0.67 2.37 5.08 -0.74 0.23 114.58 121.29 2d9d h GLU 71 Ca -0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2d9d h GLU 71 Cb 0.60 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.87 2d9d h GLU 71 CO 0.02 -0.02 -0.32 0.28 -1.00 0.00 0.00 179.01 177.97 2d9d h VAL 72 N -0.03 0.02 -1.06 3.13 2.07 -1.12 -3.14 116.25 116.12 2d9d h VAL 72 Ca 0.31 -0.34 0.34 0.00 0.82 0.00 0.00 66.70 67.83 2d9d h VAL 72 Cb 0.50 0.03 -0.14 0.00 -1.52 0.00 0.00 31.29 30.16 2d9d h VAL 72 CO -0.69 0.00 0.63 1.56 0.02 0.00 0.00 177.57 179.09 2d9d h GLN 73 N -1.23 0.27 -0.89 1.57 1.08 -0.94 -1.27 115.11 113.70 2d9d h GLN 73 Ca -0.09 -0.02 0.10 0.00 -1.45 0.00 0.00 58.65 57.19 2d9d h GLN 73 Cb 0.70 -0.06 -0.12 0.00 -0.05 0.00 0.00 27.48 27.95 2d9d h GLN 73 CO 0.15 0.18 -0.46 2.41 -0.95 0.00 0.00 178.83 180.16 2d9d n THR 74 N -4.95 -0.55 0.41 -0.54 -1.04 0.79 -0.88 114.28 107.51 2d9d n THR 74 Ca 0.32 2.12 -0.20 0.00 -2.04 0.00 0.00 64.05 64.26 2d9d n THR 74 Cb 1.07 -2.68 -0.10 0.00 -1.82 0.00 0.00 70.33 66.79 2d9d n THR 74 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2d9d h LEU 75 N 0.00 -1.30 -1.10 -4.42 3.38 -1.37 0.11 115.31 110.61 2d9d h LEU 75 Ca 0.20 0.08 0.42 0.00 0.09 0.00 0.00 57.88 58.67 2d9d h LEU 75 Cb 0.43 0.39 -0.16 0.00 0.09 0.00 0.00 40.66 41.40 2d9d h LEU 75 CO -0.85 -0.75 0.63 0.40 0.09 0.00 0.00 178.44 177.96 2d9d h ILE 76 N -1.19 0.05 0.00 1.22 2.04 -1.16 0.68 117.51 119.16 2d9d h ILE 76 Ca -0.10 -0.02 -0.19 0.00 1.00 0.00 0.00 64.86 65.55 2d9d h ILE 76 Cb 0.96 -0.00 0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2d9d h ILE 76 CO 0.07 0.01 -0.74 0.74 0.00 0.00 0.00 178.15 178.24 2d9d h THR 77 N 0.05 1.38 -0.86 -0.27 2.02 -0.47 -3.28 112.91 111.49 2d9d h THR 77 Ca 0.84 -2.13 0.22 0.00 0.77 0.00 0.00 66.41 66.11 2d9d h THR 77 Cb 2.30 2.54 -0.14 0.00 -1.74 0.00 0.00 68.15 71.11 2d9d h THR 77 CO -0.66 0.63 0.14 0.22 0.37 0.00 0.00 175.52 176.22 2d9d h TYR 78 N 0.04 0.18 0.84 3.16 3.20 0.24 -1.60 116.97 123.02 2d9d h TYR 78 Ca -0.09 0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.79 2d9d h TYR 78 Cb 1.43 0.06 0.01 0.00 1.54 0.00 0.00 36.73 39.77 2d9d h TYR 78 CO 0.13 -0.25 -0.43 0.82 -1.64 0.00 0.00 178.16 176.80 2d9d h ILE 79 N 0.15 0.00 -0.74 1.81 5.03 -1.53 -2.82 117.51 119.41 2d9d h ILE 79 Ca 0.52 0.00 0.14 0.00 -0.12 0.00 0.00 64.86 65.40 2d9d h ILE 79 Cb 1.02 0.00 -0.14 0.00 -3.03 0.00 0.00 36.82 34.67 2d9d h ILE 79 CO -0.70 0.00 -0.20 -0.67 -0.68 0.00 0.00 178.15 175.90 2d9d n ASP 80 N -5.17 -0.30 -0.04 1.72 -0.08 -0.63 0.14 116.55 112.18 2d9d n ASP 80 Ca -0.14 1.28 -0.08 0.00 -1.51 0.00 0.00 54.79 54.33 2d9d n ASP 80 Cb 0.46 -0.37 -0.02 0.00 2.34 0.00 0.00 41.12 43.52 2d9d n ASP 80 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2d9d h LEU 81 N 0.00 -0.11 0.56 -2.67 -0.00 -1.34 -2.17 115.31 109.58 2d9d h LEU 81 Ca 0.34 0.05 -0.03 0.00 -0.00 0.00 0.00 57.88 58.24 2d9d h LEU 81 Cb 0.53 0.09 0.01 0.00 -0.00 0.00 0.00 40.66 41.29 2d9d h LEU 81 CO -0.76 -0.03 -0.27 0.11 -0.00 0.00 0.00 178.44 177.49 2d9d h LYS 82 N 0.05 -0.73 -0.77 1.13 1.79 0.15 -3.00 116.57 115.19 2d9d h LYS 82 Ca 0.10 0.05 0.19 0.00 -2.18 0.00 0.00 60.65 58.80 2d9d h LYS 82 Cb 0.13 0.16 -0.15 0.00 -1.58 0.00 0.00 32.23 30.80 2d9d h LYS 82 CO -0.18 -0.48 -0.08 0.39 -1.08 0.00 0.00 179.45 178.02 2d9d n GLU 83 N -4.89 -0.07 -3.84 3.15 -0.58 0.15 -2.57 120.64 112.00 2d9d n GLU 83 Ca -0.09 1.18 -0.29 0.00 -0.42 0.00 0.00 57.16 57.54 2d9d n GLU 83 Cb 0.30 -1.82 -0.13 0.00 -0.57 0.00 0.00 31.44 29.21 2d9d n GLU 83 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2d9d s SER 84 N -5.10 4.09 0.00 1.62 0.01 -0.82 -5.05 113.70 108.45 2d9d s SER 84 Ca -0.11 -3.14 0.00 0.00 1.31 0.00 0.00 55.95 54.01 2d9d s SER 84 Cb 0.22 -1.40 0.00 0.00 0.21 0.00 0.00 66.02 65.05 2d9d s SER 84 CO 0.60 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.67 2d9d n GLY 85 N 2.90 0.71 3.58 3.44 0.00 -1.06 -4.70 105.19 110.06 2d9d n GLY 85 Ca 0.11 -1.84 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 2d9d n GLY 85 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d9d s PRO 86 N -1.86 -1.48 -0.40 1.61 0.04 -1.26 -4.73 135.00 126.91 2d9d s PRO 86 Ca 0.00 -0.16 0.03 0.00 0.04 0.00 0.00 61.00 60.92 2d9d s PRO 86 Cb 0.00 -1.57 0.11 0.00 0.04 0.00 0.00 34.50 33.08 2d9d s PRO 86 CO 0.00 -3.87 0.13 -1.54 0.04 0.00 0.00 177.00 171.77 2d9d s SER 87 N -3.97 4.49 0.18 6.66 1.04 -1.26 -4.30 113.70 116.54 2d9d s SER 87 Ca 0.72 -2.41 -0.12 0.00 0.48 0.00 0.00 55.95 54.62 2d9d s SER 87 Cb -0.08 -1.53 0.10 0.00 0.10 0.00 0.00 66.02 64.61 2d9d s SER 87 CO 0.56 -0.33 1.81 -1.28 0.98 0.00 0.00 173.24 174.98 2d9d h SER 88 N 7.25 0.78 0.00 7.02 0.87 -1.97 -3.53 113.55 123.97 2d9d h SER 88 Ca -0.06 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.42 2d9d h SER 88 Cb 0.97 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.74 2d9d h SER 88 CO 0.57 0.64 0.00 0.61 -0.53 0.00 0.00 176.83 178.11