#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9d s SER 2 N 0.00 3.43 0.00 1.61 0.15 -1.26 -5.04 113.70 112.59 2d9d s SER 2 Ca 0.00 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.23 2d9d s SER 2 Cb 0.00 -0.87 0.00 0.00 -1.71 0.00 0.00 66.02 63.44 2d9d s SER 2 CO 0.00 -2.56 0.00 -1.54 1.20 0.00 0.00 173.24 170.34 2d9d n SER 3 N -3.71 2.06 0.00 5.45 3.41 -1.26 -5.04 113.62 114.53 2d9d n SER 3 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 2d9d n SER 3 Cb 0.60 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 2d9d n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d9d n GLY 4 N 3.10 -1.65 3.63 5.00 0.00 -1.26 -5.13 105.19 108.89 2d9d n GLY 4 Ca 0.00 0.62 -0.43 0.00 0.00 0.00 0.00 46.02 46.21 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 0.00 6.82 0.48 1.61 1.04 -1.26 -5.02 113.70 117.37 2d9d s SER 5 Ca 0.00 0.97 -0.04 0.00 0.48 0.00 0.00 55.95 57.36 2d9d s SER 5 Cb 0.00 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.55 2d9d s SER 5 CO 0.00 -0.99 0.77 -0.55 0.98 0.00 0.00 173.24 173.44 2d9d s SER 6 N 2.05 6.16 0.00 7.02 0.15 -1.26 -5.07 113.70 122.75 2d9d s SER 6 Ca 0.48 0.81 0.00 0.00 0.70 0.00 0.00 55.95 57.94 2d9d s SER 6 Cb -0.12 -2.11 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 2d9d s SER 6 CO 0.20 -0.62 0.00 0.61 1.20 0.00 0.00 173.24 174.63 2d9d n GLY 7 N -2.24 3.93 0.48 9.45 0.00 -1.26 -5.04 105.19 110.51 2d9d n GLY 7 Ca 0.01 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 2d9d n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d9d n SER 8 N 0.00 1.47 -0.13 1.61 7.64 -1.26 -4.34 113.62 118.61 2d9d n SER 8 Ca 0.00 0.24 -0.10 0.00 1.01 0.00 0.00 58.87 60.02 2d9d n SER 8 Cb 0.00 -0.55 -0.05 0.00 -1.01 0.00 0.00 64.21 62.60 2d9d n SER 8 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2d9d h ILE 9 N -0.60 0.11 -0.15 0.44 2.04 -1.97 -1.33 117.51 116.05 2d9d h ILE 9 Ca -0.14 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.77 2d9d h ILE 9 Cb 0.86 0.11 -0.07 0.00 -0.74 0.00 0.00 36.82 36.98 2d9d h ILE 9 CO -0.09 0.00 -0.36 -0.07 0.00 0.00 0.00 178.15 177.64 2d9d h LEU 10 N -0.32 -1.12 -0.55 1.44 3.38 -1.97 0.14 115.31 116.31 2d9d h LEU 10 Ca 0.14 0.16 0.09 0.00 0.09 0.00 0.00 57.88 58.35 2d9d h LEU 10 Cb 0.58 0.47 -0.10 0.00 0.09 0.00 0.00 40.66 41.70 2d9d h LEU 10 CO -0.58 -0.38 -0.42 0.11 0.09 0.00 0.00 178.44 177.26 2d9d h LYS 11 N -0.42 -0.23 -0.88 1.13 1.57 -1.54 0.87 116.57 117.07 2d9d h LYS 11 Ca 0.09 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.91 2d9d h LYS 11 Cb 0.58 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.89 2d9d h LYS 11 CO -0.38 -0.15 0.58 0.82 -0.57 0.00 0.00 179.45 179.74 2d9d h ILE 12 N -0.24 1.18 -0.63 1.86 2.04 -0.71 -2.44 117.51 118.57 2d9d h ILE 12 Ca 0.18 -0.39 0.09 0.00 1.00 0.00 0.00 64.86 65.74 2d9d h ILE 12 Cb 0.56 -0.06 -0.07 0.00 -0.74 0.00 0.00 36.82 36.51 2d9d h ILE 12 CO -0.66 0.21 0.26 -0.33 0.00 0.00 0.00 178.15 177.63 2d9d h GLU 13 N 1.15 0.45 -0.53 2.37 4.39 0.16 -1.71 114.58 120.85 2d9d h GLU 13 Ca 0.34 -0.03 0.09 0.00 0.34 0.00 0.00 59.36 60.10 2d9d h GLU 13 Cb -0.06 -0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 28.42 2d9d h GLU 13 CO -0.10 0.30 0.14 0.87 -1.16 0.00 0.00 179.01 179.06 2d9d h LYS 14 N 0.46 0.28 0.46 2.33 1.57 -0.64 0.34 116.57 121.37 2d9d h LYS 14 Ca 0.32 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 59.07 2d9d h LYS 14 Cb 0.37 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2d9d h LYS 14 CO -0.29 0.18 -0.43 0.28 -0.57 0.00 0.00 179.45 178.62 2d9d h VAL 15 N 0.29 0.00 0.54 0.50 2.07 -1.26 -2.44 116.25 115.94 2d9d h VAL 15 Ca 0.27 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.77 2d9d h VAL 15 Cb 0.35 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2d9d h VAL 15 CO -0.32 0.00 -0.39 -0.07 0.02 0.00 0.00 177.57 176.81 2d9d h LEU 16 N -0.88 -1.00 -0.27 2.57 3.38 -1.23 -1.18 115.31 116.70 2d9d h LEU 16 Ca -0.06 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.00 2d9d h LEU 16 Cb 0.76 0.31 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 2d9d h LEU 16 CO -0.04 -0.58 -0.16 0.29 0.09 0.00 0.00 178.44 178.05 2d9d n LYS 17 N -5.51 -0.12 -0.20 1.13 5.02 0.12 0.45 118.16 119.05 2d9d n LYS 17 Ca -0.12 0.87 -0.03 0.00 -2.02 0.00 0.00 58.31 57.01 2d9d n LYS 17 Cb 0.40 -1.30 0.08 0.00 -0.02 0.00 0.00 35.03 34.19 2d9d n LYS 17 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2d9d h ARG 18 N 0.00 0.57 -0.69 1.97 9.65 -1.40 -2.19 114.38 122.29 2d9d h ARG 18 Ca 0.04 -0.03 0.14 0.00 -1.10 0.00 0.00 59.98 59.03 2d9d h ARG 18 Cb 0.11 -0.13 -0.10 0.00 -1.39 0.00 0.00 29.97 28.46 2d9d h ARG 18 CO -0.26 0.38 0.18 1.98 2.80 0.00 0.00 179.97 185.05 2d9d h MET 19 N 0.59 0.28 -0.42 0.20 4.05 0.13 -0.68 114.93 119.09 2d9d h MET 19 Ca 0.26 -0.02 0.07 0.00 -0.28 0.00 0.00 59.70 59.74 2d9d h MET 19 Cb 0.16 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 30.84 2d9d h MET 19 CO -0.17 0.19 0.06 0.00 0.23 0.00 0.00 176.91 177.21 2d9d h ARG 20 N 0.29 0.18 0.79 0.39 2.47 0.20 -1.37 114.38 117.32 2d9d h ARG 20 Ca 0.38 -0.01 -0.04 0.00 -1.26 0.00 0.00 59.98 59.05 2d9d h ARG 20 Cb 0.61 -0.04 0.01 0.00 -1.65 0.00 0.00 29.97 28.90 2d9d h ARG 20 CO -0.46 0.12 -0.38 0.93 0.56 0.00 0.00 179.97 180.74 2d9d h GLU 21 N 0.18 -1.02 0.00 0.04 3.07 -1.08 -1.73 114.58 114.04 2d9d h GLU 21 Ca 0.21 0.07 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 2d9d h GLU 21 Cb 0.27 0.23 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2d9d h GLU 21 CO -0.29 -0.67 0.30 0.82 -1.40 0.00 0.00 179.01 177.77 2d9d h ILE 22 N -1.10 0.00 0.00 3.13 2.04 -1.01 0.20 117.51 120.76 2d9d h ILE 22 Ca -0.11 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.68 2d9d h ILE 22 Cb 0.82 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 2d9d h ILE 22 CO 0.18 0.00 -0.46 0.50 0.00 0.00 0.00 178.15 178.37 2d9d h LYS 23 N 0.00 0.00 0.00 2.37 3.64 -0.48 -3.09 116.57 119.01 2d9d h LYS 23 Ca 0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2d9d h LYS 23 Cb 0.59 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 2d9d h LYS 23 CO 0.00 0.65 -0.20 -0.97 -2.27 0.00 0.00 179.45 176.66 2d9d h ASN 24 N -1.00 0.00 -0.28 4.20 -1.24 -0.37 -1.65 115.58 115.24 2d9d h ASN 24 Ca -0.11 0.00 -0.14 0.00 0.71 0.00 0.00 56.30 56.76 2d9d h ASN 24 Cb 0.83 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.87 2d9d h ASN 24 CO -0.06 0.20 -0.39 1.05 -1.29 0.00 0.00 177.43 176.94 2d9d h GLU 25 N 0.00 0.75 -0.39 6.67 4.11 -1.16 -1.80 114.58 122.77 2d9d h GLU 25 Ca -0.00 -0.44 -0.14 0.00 0.07 0.00 0.00 59.36 58.85 2d9d h GLU 25 Cb 0.36 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2d9d h GLU 25 CO 0.03 1.07 -0.31 1.25 0.07 0.00 0.00 179.01 181.12 2d9d h LEU 26 N 0.50 0.89 -0.21 3.06 5.85 -1.38 0.11 115.31 124.12 2d9d h LEU 26 Ca 0.03 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.35 2d9d h LEU 26 Cb 0.99 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.76 2d9d h LEU 26 CO 0.09 1.12 -0.00 -0.07 -0.34 0.00 0.00 178.44 179.24 2d9d h LEU 27 N 0.72 0.37 0.09 2.25 3.38 -1.30 -3.27 115.31 117.53 2d9d h LEU 27 Ca 0.08 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 2d9d h LEU 27 Cb 0.86 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.51 2d9d h LEU 27 CO 0.08 0.59 -0.04 1.56 0.09 0.00 0.00 178.44 180.71 2d9d h GLN 28 N 0.13 -0.11 -4.67 1.13 1.08 -1.31 -3.46 115.11 107.92 2d9d h GLN 28 Ca 0.06 0.01 -0.47 0.00 -1.45 0.00 0.00 58.65 56.80 2d9d h GLN 28 Cb 0.40 0.03 0.14 0.00 -0.05 0.00 0.00 27.48 28.00 2d9d h GLN 28 CO 0.01 0.32 -0.87 0.00 -0.95 0.00 0.00 178.83 177.34 2d9d n ALA 29 N -2.40 -2.70 -0.10 3.87 0.00 0.36 -4.93 120.51 114.61 2d9d n ALA 29 Ca -0.09 -0.02 -0.16 0.00 0.00 0.00 0.00 53.44 53.18 2d9d n ALA 29 Cb 0.25 -1.10 -0.06 0.00 0.00 0.00 0.00 19.45 18.53 2d9d n ALA 29 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2d9d n GLN 30 N 1.15 0.53 -3.40 0.00 7.27 -1.26 -4.70 117.38 116.97 2d9d n GLN 30 Ca 0.07 0.42 -0.34 0.00 0.07 0.00 0.00 57.00 57.21 2d9d n GLN 30 Cb 0.36 -1.61 -0.05 0.00 2.41 0.00 0.00 30.24 31.35 2d9d n GLN 30 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2d9d n ASN 31 N -4.45 4.57 0.00 1.69 3.02 -1.26 -4.86 115.26 113.97 2d9d n ASN 31 Ca -0.26 -3.33 0.07 0.00 -0.03 0.00 0.00 54.58 51.03 2d9d n ASN 31 Cb 0.57 -0.95 0.42 0.00 -0.61 0.00 0.00 39.78 39.21 2d9d n ASN 31 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2d9d n PRO 32 N 1.45 0.49 -0.30 3.52 -0.04 -1.26 -4.08 135.00 134.78 2d9d n PRO 32 Ca 0.26 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.68 2d9d n PRO 32 Cb 0.37 -1.45 -0.01 0.00 -0.04 0.00 0.00 33.50 32.37 2d9d n PRO 32 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2d9d n SER 33 N -0.95 -0.60 -0.05 3.54 7.64 -1.26 0.12 113.62 122.06 2d9d n SER 33 Ca 0.10 1.30 -0.13 0.00 1.01 0.00 0.00 58.87 61.16 2d9d n SER 33 Cb 0.05 -0.25 -0.00 0.00 -1.01 0.00 0.00 64.21 63.00 2d9d n SER 33 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2d9d h GLU 34 N 0.00 0.77 -0.79 1.43 4.39 -2.03 -3.17 114.58 115.18 2d9d h GLU 34 Ca 0.20 -0.48 0.14 0.00 0.34 0.00 0.00 59.36 59.57 2d9d h GLU 34 Cb 0.39 0.05 -0.09 0.00 -0.10 0.00 0.00 28.75 29.00 2d9d h GLU 34 CO -0.72 1.10 0.37 -0.07 -1.16 0.00 0.00 179.01 178.53 2d9d h LEU 35 N 0.60 0.41 -0.88 1.33 3.38 0.64 -1.46 115.31 119.33 2d9d h LEU 35 Ca 0.02 0.10 0.30 0.00 0.09 0.00 0.00 57.88 58.38 2d9d h LEU 35 Cb 1.11 0.04 -0.16 0.00 0.09 0.00 0.00 40.66 41.74 2d9d h LEU 35 CO 0.11 0.17 0.23 -1.22 0.09 0.00 0.00 178.44 177.82 2d9d n TYR 36 N -4.93 0.78 0.13 1.13 4.01 0.54 0.36 117.16 119.18 2d9d n TYR 36 Ca 0.15 1.05 -0.11 0.00 -0.16 0.00 0.00 57.90 58.83 2d9d n TYR 36 Cb 0.41 -1.29 -0.07 0.00 -0.31 0.00 0.00 39.34 38.08 2d9d n TYR 36 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 2d9d h LEU 37 N 0.00 -0.33 0.24 7.72 5.85 -1.46 -2.97 115.31 124.36 2d9d h LEU 37 Ca 0.63 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 59.15 2d9d h LEU 37 Cb 1.51 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.62 2d9d h LEU 37 CO -0.76 0.13 -0.18 0.28 -0.34 0.00 0.00 178.44 177.58 2d9d h SER 38 N -0.93 -0.47 -0.85 1.25 0.02 -0.53 -0.65 113.55 111.38 2d9d h SER 38 Ca -0.04 0.03 0.13 0.00 -0.84 0.00 0.00 61.79 61.07 2d9d h SER 38 Cb 0.50 0.14 -0.14 0.00 0.14 0.00 0.00 62.40 63.05 2d9d h SER 38 CO 0.07 -0.26 -0.33 -1.54 -1.14 0.00 0.00 176.83 173.63 2d9d n SER 39 N -3.38 -0.54 0.35 3.07 3.41 0.16 -0.67 113.62 116.01 2d9d n SER 39 Ca -0.05 1.48 -0.18 0.00 -0.26 0.00 0.00 58.87 59.87 2d9d n SER 39 Cb 0.17 -0.34 -0.09 0.00 -0.26 0.00 0.00 64.21 63.69 2d9d n SER 39 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2d9d h LYS 40 N 0.00 -1.01 -0.49 4.33 3.64 -1.38 0.91 116.57 122.57 2d9d h LYS 40 Ca 0.30 0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.80 2d9d h LYS 40 Cb 0.51 0.23 -0.08 0.00 -0.41 0.00 0.00 32.23 32.48 2d9d h LYS 40 CO -0.85 -0.67 -0.50 1.15 -2.27 0.00 0.00 179.45 176.31 2d9d h THR 41 N -1.05 0.00 0.25 1.00 2.02 0.72 0.83 112.91 116.69 2d9d h THR 41 Ca -0.08 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.09 2d9d h THR 41 Cb 0.86 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 2d9d h THR 41 CO 0.04 0.00 -0.35 -0.08 0.37 0.00 0.00 175.52 175.51 2d9d h GLU 42 N -0.26 -0.60 -0.99 6.66 4.57 -0.93 -2.31 114.58 120.72 2d9d h GLU 42 Ca 0.08 0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.40 2d9d h GLU 42 Cb 0.48 0.14 -0.12 0.00 -0.16 0.00 0.00 28.75 29.09 2d9d h GLU 42 CO -0.61 -0.40 -0.58 1.28 -1.18 0.00 0.00 179.01 177.52 2d9d n LEU 43 N -4.47 -1.05 -0.13 1.64 4.77 0.31 -1.31 117.00 116.75 2d9d n LEU 43 Ca -0.07 1.77 -0.09 0.00 -0.03 0.00 0.00 56.01 57.58 2d9d n LEU 43 Cb 0.30 -0.23 -0.07 0.00 -2.33 0.00 0.00 43.42 41.09 2d9d n LEU 43 CO 0.15 -1.44 0.50 1.56 -1.33 0.00 0.00 177.39 176.83 2d9d h GLN 44 N 0.00 -0.21 -0.71 3.23 4.20 -0.68 -1.36 115.11 119.58 2d9d h GLN 44 Ca 0.16 0.01 0.12 0.00 0.06 0.00 0.00 58.65 59.01 2d9d h GLN 44 Cb 0.41 0.05 -0.13 0.00 0.30 0.00 0.00 27.48 28.11 2d9d h GLN 44 CO -0.93 -0.14 -0.32 0.78 -0.67 0.00 0.00 178.83 177.55 2d9d h GLY 45 N -0.21 0.04 -0.08 3.46 0.00 -0.62 -1.37 103.07 104.29 2d9d h GLY 45 Ca 0.06 0.42 0.04 0.00 0.00 0.00 0.00 47.33 47.86 2d9d h GLY 45 CO -0.46 -0.22 -0.47 1.41 0.00 0.00 0.00 176.54 176.81 2d9d h LEU 46 N -0.10 -1.48 -0.88 3.11 3.38 -0.23 -1.18 115.31 117.94 2d9d h LEU 46 Ca 0.28 0.19 0.23 0.00 0.09 0.00 0.00 57.88 58.67 2d9d h LEU 46 Cb 0.56 0.60 -0.15 0.00 0.09 0.00 0.00 40.66 41.76 2d9d h LEU 46 CO -0.77 -0.44 0.08 0.40 0.09 0.00 0.00 178.44 177.80 2d9d h ILE 47 N -0.51 0.22 -1.55 1.22 2.04 -0.31 0.23 117.51 118.86 2d9d h ILE 47 Ca 0.07 -0.03 0.47 0.00 1.00 0.00 0.00 64.86 66.37 2d9d h ILE 47 Cb 0.64 0.11 -0.09 0.00 -0.74 0.00 0.00 36.82 36.74 2d9d h ILE 47 CO -0.43 0.02 1.08 0.61 0.00 0.00 0.00 178.15 179.42 2d9d n GLY 48 N -1.44 -0.82 0.21 5.37 0.00 -0.45 0.20 105.19 108.27 2d9d n GLY 48 Ca 0.19 0.63 -0.11 0.00 0.00 0.00 0.00 46.02 46.73 2d9d n GLY 48 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2d9d h GLN 49 N 0.00 0.69 -0.63 1.61 4.20 -0.64 -3.25 115.11 117.09 2d9d h GLN 49 Ca 0.81 -0.26 0.07 0.00 0.06 0.00 0.00 58.65 59.32 2d9d h GLN 49 Cb 3.02 -0.04 -0.10 0.00 0.30 0.00 0.00 27.48 30.66 2d9d h GLN 49 CO -0.16 0.84 -0.56 -0.07 -0.67 0.00 0.00 178.83 178.21 2d9d h LEU 50 N 0.48 -1.95 -1.24 1.46 3.38 0.22 0.48 115.31 118.14 2d9d h LEU 50 Ca 0.09 0.28 0.27 0.00 0.09 0.00 0.00 57.88 58.61 2d9d h LEU 50 Cb 0.58 0.83 -0.11 0.00 0.09 0.00 0.00 40.66 42.05 2d9d h LEU 50 CO 0.03 -0.34 0.66 -0.78 0.09 0.00 0.00 178.44 178.10 2d9d h ASP 51 N -0.25 0.50 -0.12 -0.43 3.58 -1.61 0.49 116.42 118.59 2d9d h ASP 51 Ca 0.11 0.11 -0.11 0.00 0.42 0.00 0.00 57.03 57.56 2d9d h ASP 51 Cb 0.53 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.60 2d9d h ASP 51 CO -0.73 0.06 -0.29 -0.08 -2.88 0.00 0.00 179.24 175.32 2d9d h GLU 52 N 0.42 0.59 -5.14 0.28 4.57 -0.17 -3.40 114.58 111.73 2d9d h GLU 52 Ca 0.63 -0.25 -0.05 0.00 -1.18 0.00 0.00 59.36 58.52 2d9d h GLU 52 Cb 1.51 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 30.06 2d9d h GLU 52 CO -0.37 0.81 0.42 0.28 -1.18 0.00 0.00 179.01 178.97 2d9d n VAL 53 N -4.09 0.00 -1.65 0.32 0.31 0.17 -4.83 118.33 108.56 2d9d n VAL 53 Ca -0.01 -0.31 -0.43 0.00 -0.01 0.00 0.00 64.34 63.59 2d9d n VAL 53 Cb 0.45 -1.44 -0.03 0.00 -0.91 0.00 0.00 33.84 31.91 2d9d n VAL 53 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2d9d s SER 54 N 6.94 5.61 0.83 4.52 0.15 -1.26 -4.92 113.70 125.57 2d9d s SER 54 Ca 0.80 1.94 -0.15 0.00 0.70 0.00 0.00 55.95 59.23 2d9d s SER 54 Cb -0.17 -2.51 -0.01 0.00 -1.71 0.00 0.00 66.02 61.61 2d9d s SER 54 CO 0.17 -1.83 0.44 0.00 1.20 0.00 0.00 173.24 173.22 2d9d n LEU 55 N 11.06 0.18 0.00 3.45 -0.00 -1.26 -4.94 117.00 125.48 2d9d n LEU 55 Ca 0.28 0.46 -0.18 0.00 -0.00 0.00 0.00 56.01 56.57 2d9d n LEU 55 Cb 0.45 -1.20 -0.04 0.00 -0.00 0.00 0.00 43.42 42.63 2d9d n LEU 55 CO 0.66 -3.43 -0.13 -0.62 -0.00 0.00 0.00 177.39 173.88 2d9d n GLU 56 N -1.05 1.17 -1.17 1.47 -0.58 -1.26 -4.98 120.64 114.24 2d9d n GLU 56 Ca 0.08 -2.13 -0.38 0.00 -0.42 0.00 0.00 57.16 54.31 2d9d n GLU 56 Cb 0.52 0.68 -0.03 0.00 -0.57 0.00 0.00 31.44 32.03 2d9d n GLU 56 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2d9d n LYS 57 N -0.70 2.06 -3.63 3.49 3.00 -1.26 -4.61 118.16 116.51 2d9d n LYS 57 Ca -0.11 -1.92 -0.05 0.00 -0.00 0.00 0.00 58.31 56.23 2d9d n LYS 57 Cb 0.37 -2.87 -0.06 0.00 0.00 0.00 0.00 35.03 32.48 2d9d n LYS 57 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 2d9d s ASN 58 N 4.06 -0.19 0.11 3.14 0.01 -1.26 -5.06 114.94 115.77 2d9d s ASN 58 Ca 0.52 0.30 -0.13 0.00 -0.71 0.00 0.00 52.86 52.84 2d9d s ASN 58 Cb 0.14 0.29 -0.07 0.00 0.41 0.00 0.00 41.25 42.01 2d9d s ASN 58 CO 0.03 -0.10 1.44 1.55 -1.51 0.00 0.00 177.10 178.51 2d9d h PRO 59 N 3.02 0.79 -0.84 -0.60 0.13 -1.99 -2.61 132.00 129.90 2d9d h PRO 59 Ca -0.21 -0.41 0.19 0.00 -0.87 0.00 0.00 66.00 64.69 2d9d h PRO 59 Cb 1.18 0.01 -0.12 0.00 0.13 0.00 0.00 31.00 32.21 2d9d h PRO 59 CO 0.19 1.04 0.32 0.00 -0.23 0.00 0.00 178.00 179.33 2d9d h ILE 61 N 0.38 0.00 -0.97 0.00 5.03 -1.91 -2.37 117.51 117.67 2d9d h ILE 61 Ca 0.50 -0.28 0.28 0.00 -0.12 0.00 0.00 64.86 65.24 2d9d h ILE 61 Cb 0.89 0.00 -0.18 0.00 -3.03 0.00 0.00 36.82 34.50 2d9d h ILE 61 CO -0.50 0.00 0.10 -0.09 -0.68 0.00 0.00 178.15 176.98 2d9d h ARG 62 N -0.40 0.03 0.48 2.37 2.43 -1.33 -1.15 114.38 116.80 2d9d h ARG 62 Ca -0.01 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 2d9d h ARG 62 Cb 0.09 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2d9d h ARG 62 CO 0.02 0.02 -0.23 1.49 -1.51 0.00 0.00 179.97 179.76 2d9d h GLU 63 N 0.03 -0.62 -0.75 0.20 4.57 -0.57 -3.03 114.58 114.41 2d9d h GLU 63 Ca 0.62 0.04 0.30 0.00 -1.18 0.00 0.00 59.36 59.14 2d9d h GLU 63 Cb 1.32 0.14 -0.12 0.00 -0.16 0.00 0.00 28.75 29.93 2d9d h GLU 63 CO -0.87 -0.41 0.42 0.00 -1.18 0.00 0.00 179.01 176.96 2d9d n ALA 64 N -2.41 0.76 0.03 2.92 0.00 -0.49 0.20 120.51 121.52 2d9d n ALA 64 Ca -0.08 0.70 -0.12 0.00 0.00 0.00 0.00 53.44 53.94 2d9d n ALA 64 Cb 0.25 -0.72 -0.07 0.00 0.00 0.00 0.00 19.45 18.91 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 0.02 0.39 0.00 2.43 -1.28 -1.66 114.38 114.28 2d9d h ARG 65 Ca 0.60 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.75 2d9d h ARG 65 Cb 1.65 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.20 2d9d h ARG 65 CO -0.51 0.05 -0.19 -0.09 -1.51 0.00 0.00 179.97 177.72 2d9d h ARG 66 N -0.01 -0.51 -0.88 0.20 9.65 0.22 -2.94 114.38 120.11 2d9d h ARG 66 Ca 0.01 0.03 0.10 0.00 -1.10 0.00 0.00 59.98 59.02 2d9d h ARG 66 Cb 0.03 0.12 -0.12 0.00 -1.39 0.00 0.00 29.97 28.61 2d9d h ARG 66 CO -0.00 -0.27 -0.52 -0.09 2.80 0.00 0.00 179.97 181.89 2d9d h ARG 67 N -1.09 -0.07 0.01 0.20 2.43 -1.10 -1.43 114.38 113.33 2d9d h ARG 67 Ca -0.05 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2d9d h ARG 67 Cb 0.47 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.99 2d9d h ARG 67 CO 0.09 -0.05 -0.42 0.00 -1.51 0.00 0.00 179.97 178.08 2d9d h ALA 68 N 0.68 -0.86 -0.73 2.80 0.00 -1.41 -1.05 119.26 118.70 2d9d h ALA 68 Ca 0.20 -0.07 0.22 0.00 0.00 0.00 0.00 54.91 55.26 2d9d h ALA 68 Cb 0.50 0.85 -0.14 0.00 0.00 0.00 0.00 17.79 19.00 2d9d h ALA 68 CO -0.88 -0.98 0.08 0.28 0.00 0.00 0.00 179.25 177.74 2d9d n VAL 69 N -4.81 -0.31 0.20 0.00 0.31 -0.58 -0.00 118.33 113.14 2d9d n VAL 69 Ca -0.06 1.59 -0.11 0.00 -0.01 0.00 0.00 64.34 65.75 2d9d n VAL 69 Cb 0.31 -2.37 -0.06 0.00 -0.91 0.00 0.00 33.84 30.81 2d9d n VAL 69 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2d9d h ILE 70 N 0.00 0.27 -0.82 2.52 2.04 -0.86 -0.27 117.51 120.40 2d9d h ILE 70 Ca 0.48 -0.62 0.17 0.00 1.00 0.00 0.00 64.86 65.89 2d9d h ILE 70 Cb 1.05 0.43 -0.15 0.00 -0.74 0.00 0.00 36.82 37.40 2d9d h ILE 70 CO -0.67 0.06 -0.17 -0.33 0.00 0.00 0.00 178.15 177.04 2d9d h GLU 71 N -1.05 0.01 0.44 2.37 4.39 0.80 0.15 114.58 121.69 2d9d h GLU 71 Ca -0.06 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 2d9d h GLU 71 Cb 0.53 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2d9d h GLU 71 CO 0.09 0.01 -0.21 0.28 -1.16 0.00 0.00 179.01 178.02 2d9d h VAL 72 N 0.01 0.00 -1.16 3.13 2.07 -1.00 -3.20 116.25 116.11 2d9d h VAL 72 Ca 0.40 -0.33 0.44 0.00 0.82 0.00 0.00 66.70 68.03 2d9d h VAL 72 Cb 0.64 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.25 2d9d h VAL 72 CO -0.82 0.00 0.69 1.56 0.02 0.00 0.00 177.57 179.01 2d9d h GLN 73 N -0.92 0.03 -0.85 1.57 4.20 -0.53 0.69 115.11 119.30 2d9d h GLN 73 Ca -0.06 -0.00 0.19 0.00 0.06 0.00 0.00 58.65 58.84 2d9d h GLN 73 Cb 0.45 -0.01 -0.12 0.00 0.30 0.00 0.00 27.48 28.11 2d9d h GLN 73 CO 0.10 0.02 0.34 1.15 -0.67 0.00 0.00 178.83 179.77 2d9d h THR 74 N 0.03 0.51 0.39 -0.54 2.02 -0.71 -1.34 112.91 113.28 2d9d h THR 74 Ca 0.85 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.88 2d9d h THR 74 Cb 2.44 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 2d9d h THR 74 CO -0.63 0.07 -0.19 -0.07 0.37 0.00 0.00 175.52 175.08 2d9d h LEU 75 N 0.39 -0.45 -0.42 2.58 3.38 0.29 -2.55 115.31 118.53 2d9d h LEU 75 Ca 0.51 -0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.51 2d9d h LEU 75 Cb 0.92 0.12 -0.09 0.00 0.09 0.00 0.00 40.66 41.69 2d9d h LEU 75 CO -0.51 -0.24 -0.37 0.40 0.09 0.00 0.00 178.44 177.82 2d9d h ILE 76 N -0.63 0.18 -0.66 1.22 5.03 -1.29 -0.47 117.51 120.88 2d9d h ILE 76 Ca -0.05 0.00 0.13 0.00 -0.12 0.00 0.00 64.86 64.82 2d9d h ILE 76 Cb 0.46 0.18 -0.10 0.00 -3.03 0.00 0.00 36.82 34.33 2d9d h ILE 76 CO 0.09 0.00 0.13 0.74 -0.68 0.00 0.00 178.15 178.43 2d9d h THR 77 N -0.27 0.57 -0.49 -0.27 2.02 -1.29 -0.78 112.91 112.39 2d9d h THR 77 Ca 0.17 -0.09 0.08 0.00 0.77 0.00 0.00 66.41 67.34 2d9d h THR 77 Cb 0.56 0.30 -0.07 0.00 -1.74 0.00 0.00 68.15 67.20 2d9d h THR 77 CO -0.57 0.05 0.10 0.22 0.37 0.00 0.00 175.52 175.69 2d9d h TYR 78 N 0.25 0.17 0.86 3.16 3.20 -0.67 -2.55 116.97 121.38 2d9d h TYR 78 Ca 0.36 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.22 2d9d h TYR 78 Cb 0.57 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.84 2d9d h TYR 78 CO -0.27 0.00 -0.46 0.82 -1.64 0.00 0.00 178.16 176.62 2d9d h ILE 79 N 0.24 0.08 -0.80 1.81 2.04 -0.47 -2.80 117.51 117.61 2d9d h ILE 79 Ca 0.24 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.17 2d9d h ILE 79 Cb 0.32 0.08 -0.10 0.00 -0.74 0.00 0.00 36.82 36.38 2d9d h ILE 79 CO -0.31 0.00 -0.47 -0.67 0.00 0.00 0.00 178.15 176.70 2d9d n ASP 80 N -5.62 -0.84 -0.25 1.72 -0.08 -0.71 0.04 116.55 110.82 2d9d n ASP 80 Ca -0.15 1.56 0.01 0.00 -1.51 0.00 0.00 54.79 54.70 2d9d n ASP 80 Cb 0.49 -0.25 0.08 0.00 2.34 0.00 0.00 41.12 43.78 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 -0.66 0.78 -2.67 3.38 -1.44 -1.22 115.31 113.48 2d9d h LEU 81 Ca 0.13 0.21 -0.04 0.00 0.09 0.00 0.00 57.88 58.27 2d9d h LEU 81 Cb 0.33 0.44 0.01 0.00 0.09 0.00 0.00 40.66 41.53 2d9d h LEU 81 CO -0.75 -0.24 -0.37 0.11 0.09 0.00 0.00 178.44 177.28 2d9d h LYS 82 N 0.00 -1.00 -0.94 1.13 1.79 -0.11 -2.93 116.57 114.51 2d9d h LYS 82 Ca 0.35 0.07 0.32 0.00 -2.18 0.00 0.00 60.65 59.20 2d9d h LYS 82 Cb 0.53 0.23 -0.17 0.00 -1.58 0.00 0.00 32.23 31.24 2d9d h LYS 82 CO -0.74 -0.67 0.23 0.39 -1.08 0.00 0.00 179.45 177.59 2d9d n GLU 83 N -4.87 -0.07 -3.17 3.15 -0.58 0.62 -3.93 120.64 111.80 2d9d n GLU 83 Ca -0.13 1.36 -0.40 0.00 -0.42 0.00 0.00 57.16 57.57 2d9d n GLU 83 Cb 0.41 -2.28 -0.07 0.00 -0.57 0.00 0.00 31.44 28.93 2d9d n GLU 83 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2d9d s SER 84 N -4.81 6.54 0.00 1.62 1.04 -0.52 -4.99 113.70 112.58 2d9d s SER 84 Ca -0.11 0.66 0.00 0.00 0.48 0.00 0.00 55.95 56.98 2d9d s SER 84 Cb 0.30 -2.32 0.00 0.00 0.10 0.00 0.00 66.02 64.10 2d9d s SER 84 CO 0.73 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 175.25 2d9d n GLY 85 N 4.16 2.67 3.56 7.32 0.00 -1.25 -4.81 105.19 116.84 2d9d n GLY 85 Ca -0.02 -0.68 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 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 1.17 2.78 -0.00 1.61 0.04 -1.26 -4.96 135.00 134.39 2d9d s PRO 86 Ca 0.00 0.75 0.00 0.00 0.04 0.00 0.00 61.00 61.79 2d9d s PRO 86 Cb 0.00 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 30.20 2d9d s PRO 86 CO 0.00 -2.54 0.00 -1.12 0.04 0.00 0.00 177.00 173.38 2d9d s SER 87 N 7.57 0.02 0.08 6.66 0.01 -1.26 -5.07 113.70 121.71 2d9d s SER 87 Ca 0.69 0.00 -0.37 0.00 1.31 0.00 0.00 55.95 57.58 2d9d s SER 87 Cb -0.14 -0.01 -0.19 0.00 0.21 0.00 0.00 66.02 65.89 2d9d s SER 87 CO 0.23 -0.01 1.57 -1.28 0.41 0.00 0.00 173.24 174.16 2d9d h SER 88 N 6.28 -1.31 -0.00 2.44 0.87 -2.07 -3.56 113.55 116.21 2d9d h SER 88 Ca -0.27 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.38 2d9d h SER 88 Cb 1.20 0.40 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 2d9d h SER 88 CO 0.51 -0.72 0.00 0.61 -0.53 0.00 0.00 176.83 176.69