#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 5.15 0.17 1.61 0.15 -1.26 -4.96 113.70 114.57 2d9d s SER 2 Ca 0.00 -0.04 0.04 0.00 0.70 0.00 0.00 55.95 56.64 2d9d s SER 2 Cb 0.00 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.73 2d9d s SER 2 CO 0.00 -2.58 0.26 -0.55 1.20 0.00 0.00 173.24 171.57 2d9d s SER 3 N 8.31 6.13 0.00 5.45 0.15 -1.26 -4.97 113.70 127.51 2d9d s SER 3 Ca 0.70 0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.43 2d9d s SER 3 Cb -0.10 -1.78 0.00 0.00 -1.71 0.00 0.00 66.02 62.42 2d9d s SER 3 CO 0.12 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.20 2d9d n GLY 4 N -0.68 0.15 3.05 9.45 0.00 -1.26 -5.00 105.19 110.92 2d9d n GLY 4 Ca -0.08 -1.30 -0.15 0.00 0.00 0.00 0.00 46.02 44.49 2d9d n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2d9d n SER 5 N 1.49 -2.76 -4.02 1.61 2.88 -1.26 -5.03 113.62 106.52 2d9d n SER 5 Ca 0.00 -0.50 -0.16 0.00 -1.33 0.00 0.00 58.87 56.88 2d9d n SER 5 Cb 0.00 -4.31 -0.13 0.00 -0.75 0.00 0.00 64.21 59.02 2d9d n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2d9d s SER 6 N -3.95 0.87 0.00 -3.46 1.04 -1.26 -5.15 113.70 101.78 2d9d s SER 6 Ca 0.10 -0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2d9d s SER 6 Cb -0.04 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.03 2d9d s SER 6 CO 0.60 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 175.41 2d9d n GLY 7 N 2.30 5.43 0.10 7.32 0.00 -1.26 -5.06 105.19 114.02 2d9d n GLY 7 Ca -0.17 -1.75 -0.18 0.00 0.00 0.00 0.00 46.02 43.93 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 1.87 -0.28 1.61 7.64 -1.26 -3.48 113.62 119.72 2d9d n SER 8 Ca 0.00 0.45 -0.01 0.00 1.01 0.00 0.00 58.87 60.32 2d9d n SER 8 Cb 0.00 -0.89 0.05 0.00 -1.01 0.00 0.00 64.21 62.36 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 -1.00 0.13 0.40 0.44 2.04 -1.99 -0.33 117.51 117.20 2d9d h ILE 9 Ca -0.29 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 2d9d h ILE 9 Cb 1.13 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 2d9d h ILE 9 CO -0.18 0.00 -0.19 -0.07 0.00 0.00 0.00 178.15 177.71 2d9d h LEU 10 N -0.06 -0.45 -0.99 1.44 4.07 -1.98 -0.42 115.31 116.92 2d9d h LEU 10 Ca 0.32 -0.08 0.35 0.00 0.08 0.00 0.00 57.88 58.55 2d9d h LEU 10 Cb 0.58 0.12 -0.17 0.00 1.08 0.00 0.00 40.66 42.28 2d9d h LEU 10 CO -0.83 -0.18 0.47 0.50 -1.08 0.00 0.00 178.44 177.33 2d9d h LYS 11 N -0.72 0.14 0.02 1.13 3.64 -1.29 1.15 116.57 120.64 2d9d h LYS 11 Ca -0.05 -0.01 -0.22 0.00 -1.27 0.00 0.00 60.65 59.10 2d9d h LYS 11 Cb 0.51 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.27 2d9d h LYS 11 CO 0.09 0.09 -1.04 0.82 -2.27 0.00 0.00 179.45 177.14 2d9d h ILE 12 N 0.14 1.68 -0.11 2.00 2.04 -0.93 -3.11 117.51 119.22 2d9d h ILE 12 Ca 0.75 -3.35 -0.09 0.00 1.00 0.00 0.00 64.86 63.18 2d9d h ILE 12 Cb 1.82 2.86 -0.01 0.00 -0.74 0.00 0.00 36.82 40.75 2d9d h ILE 12 CO -0.71 0.96 -0.32 -0.33 0.00 0.00 0.00 178.15 177.75 2d9d h GLU 13 N 0.01 0.21 0.00 2.37 4.39 0.30 -2.67 114.58 119.19 2d9d h GLU 13 Ca -0.03 -0.08 -0.16 0.00 0.34 0.00 0.00 59.36 59.43 2d9d h GLU 13 Cb 1.80 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.41 2d9d h GLU 13 CO 0.14 0.51 -0.77 1.57 -1.16 0.00 0.00 179.01 179.30 2d9d h LYS 14 N 0.19 0.00 0.00 2.33 2.10 -0.76 -0.44 116.57 119.99 2d9d h LYS 14 Ca 0.03 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.66 2d9d h LYS 14 Cb 0.66 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.99 2d9d h LYS 14 CO 0.05 0.77 -0.08 0.28 -2.00 0.00 0.00 179.45 178.47 2d9d h VAL 15 N 0.00 0.20 0.00 0.07 2.07 -1.41 -3.23 116.25 113.95 2d9d h VAL 15 Ca -0.01 -0.76 -0.19 0.00 0.82 0.00 0.00 66.70 66.57 2d9d h VAL 15 Cb 1.47 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 32.84 2d9d h VAL 15 CO 0.10 0.08 -1.60 0.18 0.02 0.00 0.00 177.57 176.35 2d9d n LEU 16 N -3.20 1.90 -0.30 2.57 4.77 -1.11 -4.14 117.00 117.49 2d9d n LEU 16 Ca 0.01 0.32 -0.06 0.00 -0.03 0.00 0.00 56.01 56.25 2d9d n LEU 16 Cb 0.36 -0.75 -0.05 0.00 -2.33 0.00 0.00 43.42 40.66 2d9d n LEU 16 CO 0.30 0.06 0.37 1.17 -1.33 0.00 0.00 177.39 177.95 2d9d n LYS 17 N -4.33 -0.28 -0.17 3.23 0.00 -0.18 0.13 118.16 116.56 2d9d n LYS 17 Ca -0.30 1.09 -0.04 0.00 0.00 0.00 0.00 58.31 59.07 2d9d n LYS 17 Cb 0.65 -1.61 0.06 0.00 0.00 0.00 0.00 35.03 34.13 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 0.47 -0.51 1.64 9.65 -1.81 -2.83 114.38 120.99 2d9d h ARG 18 Ca 0.15 -0.03 0.07 0.00 -1.10 0.00 0.00 59.98 59.07 2d9d h ARG 18 Cb 0.33 -0.11 -0.09 0.00 -1.39 0.00 0.00 29.97 28.71 2d9d h ARG 18 CO -0.69 0.31 -0.51 1.98 2.80 0.00 0.00 179.97 183.86 2d9d h MET 19 N 0.48 -0.30 -0.36 0.20 4.05 0.90 0.80 114.93 120.71 2d9d h MET 19 Ca 0.23 0.02 0.05 0.00 -0.28 0.00 0.00 59.70 59.72 2d9d h MET 19 Cb 0.16 0.07 -0.08 0.00 -0.80 0.00 0.00 31.60 30.95 2d9d h MET 19 CO -0.17 -0.20 -0.55 -0.09 0.23 0.00 0.00 176.91 176.13 2d9d h ARG 20 N -0.31 -0.41 0.10 0.39 2.43 -1.12 0.18 114.38 115.65 2d9d h ARG 20 Ca 0.12 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.32 2d9d h ARG 20 Cb 0.57 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 2d9d h ARG 20 CO -0.65 -0.27 -0.34 0.93 -1.51 0.00 0.00 179.97 178.12 2d9d h GLU 21 N -0.43 -0.48 -0.97 0.20 4.39 -1.27 -1.51 114.58 114.51 2d9d h GLU 21 Ca 0.07 0.03 0.32 0.00 0.34 0.00 0.00 59.36 60.13 2d9d h GLU 21 Cb 0.61 0.11 -0.17 0.00 -0.10 0.00 0.00 28.75 29.20 2d9d h GLU 21 CO -0.57 -0.32 0.34 0.82 -1.16 0.00 0.00 179.01 178.12 2d9d h ILE 22 N -0.50 0.12 0.33 3.13 2.04 -0.52 0.19 117.51 122.30 2d9d h ILE 22 Ca -0.01 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 2d9d h ILE 22 Cb 0.49 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 2d9d h ILE 22 CO -0.17 0.02 -0.16 0.50 0.00 0.00 0.00 178.15 178.34 2d9d h LYS 23 N 0.10 -0.42 -0.83 2.37 3.64 -0.04 0.75 116.57 122.14 2d9d h LYS 23 Ca 0.70 0.03 0.19 0.00 -1.27 0.00 0.00 60.65 60.30 2d9d h LYS 23 Cb 1.63 0.10 -0.12 0.00 -0.41 0.00 0.00 32.23 33.43 2d9d h LYS 23 CO -0.76 -0.28 0.32 -0.97 -2.27 0.00 0.00 179.45 175.49 2d9d h ASN 24 N -0.44 0.24 -0.41 4.20 -1.24 -0.31 0.70 115.58 118.32 2d9d h ASN 24 Ca -0.04 0.14 0.00 0.00 0.71 0.00 0.00 56.30 57.11 2d9d h ASN 24 Cb 0.33 0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.50 2d9d h ASN 24 CO 0.07 0.02 0.27 -0.08 -1.29 0.00 0.00 177.43 176.42 2d9d h GLU 25 N 0.38 0.55 -0.39 6.67 4.57 -0.60 0.15 114.58 125.92 2d9d h GLU 25 Ca 0.50 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.58 2d9d h GLU 25 Cb 0.88 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.33 2d9d h GLU 25 CO -0.50 0.38 0.02 1.25 -1.18 0.00 0.00 179.01 178.98 2d9d h LEU 26 N 0.55 0.58 -0.35 1.64 5.85 0.13 -0.07 115.31 123.63 2d9d h LEU 26 Ca 0.15 -0.11 -0.19 0.00 0.84 0.00 0.00 57.88 58.57 2d9d h LEU 26 Cb -0.04 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 40.83 2d9d h LEU 26 CO -0.03 0.63 -0.75 -0.07 -0.34 0.00 0.00 178.44 177.88 2d9d h LEU 27 N 0.59 0.54 -3.84 2.25 3.38 -0.44 -3.14 115.31 114.64 2d9d h LEU 27 Ca 0.13 -0.36 -0.38 0.00 0.09 0.00 0.00 57.88 57.35 2d9d h LEU 27 Cb 0.34 -0.16 -0.23 0.00 0.09 0.00 0.00 40.66 40.70 2d9d h LEU 27 CO 0.01 1.11 0.45 0.00 0.09 0.00 0.00 178.44 180.11 2d9d n GLN 28 N -3.84 2.71 -2.89 1.13 1.13 0.48 -4.98 117.38 111.13 2d9d n GLN 28 Ca -0.05 -3.05 -0.29 0.00 -1.94 0.00 0.00 57.00 51.67 2d9d n GLN 28 Cb 0.72 -2.16 -0.02 0.00 0.11 0.00 0.00 30.24 28.90 2d9d n GLN 28 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2d9d s ALA 29 N -3.19 3.44 -0.14 -1.58 0.00 -0.07 -4.96 121.76 115.26 2d9d s ALA 29 Ca 0.55 -0.41 -0.09 0.00 0.00 0.00 0.00 51.96 52.01 2d9d s ALA 29 Cb 0.46 -2.56 -0.25 0.00 0.00 0.00 0.00 23.12 20.78 2d9d s ALA 29 CO 0.11 -0.09 0.31 0.94 0.00 0.00 0.00 175.76 177.03 2d9d n GLN 30 N -1.61 0.72 -3.65 0.00 0.00 -1.26 -4.68 117.38 106.90 2d9d n GLN 30 Ca 0.01 0.31 -0.27 0.00 -0.00 0.00 0.00 57.00 57.04 2d9d n GLN 30 Cb 0.54 -1.71 -0.11 0.00 0.00 0.00 0.00 30.24 28.97 2d9d n GLN 30 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2d9d n ASN 31 N -3.64 1.47 0.00 1.69 4.13 -1.26 -4.93 115.26 112.72 2d9d n ASN 31 Ca -0.33 -2.85 0.06 0.00 1.68 0.00 0.00 54.58 53.14 2d9d n ASN 31 Cb 0.98 -0.66 0.34 0.00 -1.54 0.00 0.00 39.78 38.90 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 2.28 0.49 -0.15 3.52 -0.04 -1.26 -3.46 135.00 136.38 2d9d n PRO 32 Ca 0.25 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.64 2d9d n PRO 32 Cb 0.41 -1.37 0.02 0.00 -0.04 0.00 0.00 33.50 32.53 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 0.43 0.38 3.54 4.64 -2.00 -0.57 113.55 119.97 2d9d h SER 33 Ca 0.00 0.01 -0.32 0.00 -0.47 0.00 0.00 61.79 61.01 2d9d h SER 33 Cb 0.00 -0.08 0.01 0.00 -0.31 0.00 0.00 62.40 62.02 2d9d h SER 33 CO 0.00 0.31 -1.51 -0.33 -0.87 0.00 0.00 176.83 174.42 2d9d h GLU 34 N 0.54 0.37 -0.49 4.77 4.39 -2.02 -3.34 114.58 118.79 2d9d h GLU 34 Ca 0.18 -0.64 0.06 0.00 0.34 0.00 0.00 59.36 59.31 2d9d h GLU 34 Cb 0.02 0.24 -0.05 0.00 -0.10 0.00 0.00 28.75 28.85 2d9d h GLU 34 CO -0.09 1.28 0.19 -0.07 -1.16 0.00 0.00 179.01 179.16 2d9d h LEU 35 N 0.10 0.22 -0.93 1.33 3.38 -1.68 -1.87 115.31 115.87 2d9d h LEU 35 Ca -0.25 0.05 0.36 0.00 0.09 0.00 0.00 57.88 58.13 2d9d h LEU 35 Cb 2.07 0.02 -0.13 0.00 0.09 0.00 0.00 40.66 42.71 2d9d h LEU 35 CO 0.21 0.16 0.55 -1.22 0.09 0.00 0.00 178.44 178.22 2d9d n TYR 36 N -4.98 0.80 -0.08 1.13 4.01 -0.24 0.74 117.16 118.55 2d9d n TYR 36 Ca 0.05 0.81 -0.09 0.00 -0.16 0.00 0.00 57.90 58.50 2d9d n TYR 36 Cb 0.18 -1.22 -0.05 0.00 -0.31 0.00 0.00 39.34 37.94 2d9d n TYR 36 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2d9d h LEU 37 N 0.00 0.00 0.12 7.72 -0.00 -1.57 -3.29 115.31 118.28 2d9d h LEU 37 Ca 0.70 -0.21 0.01 0.00 -0.00 0.00 0.00 57.88 58.38 2d9d h LEU 37 Cb 2.00 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 42.62 2d9d h LEU 37 CO -0.53 0.93 -0.52 -1.28 -0.00 0.00 0.00 178.44 177.05 2d9d h SER 38 N -1.00 -1.55 -0.54 -0.43 0.87 -0.44 -0.24 113.55 110.22 2d9d h SER 38 Ca -0.10 0.16 0.09 0.00 -1.23 0.00 0.00 61.79 60.72 2d9d h SER 38 Cb 0.68 0.57 -0.11 0.00 -0.44 0.00 0.00 62.40 63.11 2d9d h SER 38 CO -0.06 -0.55 -0.38 0.28 -0.53 0.00 0.00 176.83 175.59 2d9d h SER 39 N -0.74 -1.31 0.17 6.23 0.02 0.10 0.13 113.55 118.14 2d9d h SER 39 Ca -0.00 0.23 0.01 0.00 -0.84 0.00 0.00 61.79 61.19 2d9d h SER 39 Cb 0.75 0.61 -0.04 0.00 0.14 0.00 0.00 62.40 63.86 2d9d h SER 39 CO -0.28 -0.33 -0.47 0.50 -1.14 0.00 0.00 176.83 175.10 2d9d h LYS 40 N -0.22 -0.72 -0.19 3.45 3.64 -1.53 0.27 116.57 121.27 2d9d h LYS 40 Ca 0.19 0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.67 2d9d h LYS 40 Cb 0.56 0.16 -0.07 0.00 -0.41 0.00 0.00 32.23 32.47 2d9d h LYS 40 CO -0.65 -0.48 -0.42 1.15 -2.27 0.00 0.00 179.45 176.78 2d9d h THR 41 N -0.74 0.14 -0.70 1.00 2.02 -0.24 -0.05 112.91 114.34 2d9d h THR 41 Ca 0.00 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.27 2d9d h THR 41 Cb 0.74 0.14 -0.07 0.00 -1.74 0.00 0.00 68.15 67.22 2d9d h THR 41 CO -0.24 0.00 0.34 -0.08 0.37 0.00 0.00 175.52 175.92 2d9d h GLU 42 N -0.46 0.57 0.11 6.66 4.57 -0.53 -1.75 114.58 123.75 2d9d h GLU 42 Ca 0.09 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.25 2d9d h GLU 42 Cb 0.62 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 29.05 2d9d h GLU 42 CO -0.43 0.38 -0.22 -0.07 -1.18 0.00 0.00 179.01 177.48 2d9d h LEU 43 N 0.58 -0.63 -0.66 1.64 3.38 0.70 -2.40 115.31 117.93 2d9d h LEU 43 Ca 0.34 0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.48 2d9d h LEU 43 Cb 0.36 0.24 -0.07 0.00 0.09 0.00 0.00 40.66 41.28 2d9d h LEU 43 CO -0.27 -0.31 0.28 1.56 0.09 0.00 0.00 178.44 179.80 2d9d h GLN 44 N -0.41 0.47 0.08 1.13 4.20 -0.55 -2.80 115.11 117.22 2d9d h GLN 44 Ca 0.03 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.73 2d9d h GLN 44 Cb 0.44 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 2d9d h GLN 44 CO -0.13 0.31 -0.48 0.78 -0.67 0.00 0.00 178.83 178.64 2d9d h GLY 45 N 0.49 -1.17 -0.58 3.46 0.00 -0.85 -2.76 103.07 101.66 2d9d h GLY 45 Ca 0.33 0.64 0.08 0.00 0.00 0.00 0.00 47.33 48.38 2d9d h GLY 45 CO -0.30 -0.28 -0.50 1.41 0.00 0.00 0.00 176.54 176.88 2d9d h LEU 46 N -0.66 -1.73 -0.70 3.11 3.38 -1.22 -0.64 115.31 116.85 2d9d h LEU 46 Ca -0.00 0.26 0.12 0.00 0.09 0.00 0.00 57.88 58.35 2d9d h LEU 46 Cb 0.68 0.76 -0.12 0.00 0.09 0.00 0.00 40.66 42.07 2d9d h LEU 46 CO -0.28 -0.34 -0.25 -0.38 0.09 0.00 0.00 178.44 177.29 2d9d n ILE 47 N -5.37 -0.35 -0.31 1.22 5.41 -1.05 -0.21 119.36 118.69 2d9d n ILE 47 Ca 0.01 1.63 -0.06 0.00 1.00 0.00 0.00 62.75 65.32 2d9d n ILE 47 Cb 0.33 -2.18 -0.04 0.00 -0.71 0.00 0.00 39.64 37.05 2d9d n ILE 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2d9d n GLY 48 N -1.36 -1.85 0.38 7.39 0.00 -0.25 -0.08 105.19 109.42 2d9d n GLY 48 Ca 0.08 0.89 -0.05 0.00 0.00 0.00 0.00 46.02 46.95 2d9d n GLY 48 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2d9d n GLN 49 N -5.01 -0.30 -0.35 1.61 6.02 0.70 0.38 117.38 120.44 2d9d n GLN 49 Ca 0.03 1.44 0.10 0.00 -0.01 0.00 0.00 57.00 58.57 2d9d n GLN 49 Cb 0.23 -2.13 0.21 0.00 1.02 0.00 0.00 30.24 29.57 2d9d n GLN 49 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2d9d n LEU 50 N -5.31 -0.24 -0.32 1.08 4.77 0.89 0.13 117.00 118.01 2d9d n LEU 50 Ca 0.07 1.68 0.16 0.00 -0.03 0.00 0.00 56.01 57.88 2d9d n LEU 50 Cb 0.33 -0.56 0.34 0.00 -2.33 0.00 0.00 43.42 41.20 2d9d n LEU 50 CO -0.14 -1.65 1.07 0.44 -1.33 0.00 0.00 177.39 175.78 2d9d h ASP 51 N 0.00 0.39 -0.54 -1.43 5.19 -0.08 0.13 116.42 120.09 2d9d h ASP 51 Ca 0.53 0.16 0.07 0.00 -0.62 0.00 0.00 57.03 57.18 2d9d h ASP 51 Cb 0.96 0.13 -0.06 0.00 0.18 0.00 0.00 39.33 40.54 2d9d h ASP 51 CO -0.97 -0.02 0.20 -0.33 -3.12 0.00 0.00 179.24 175.01 2d9d h GLU 52 N 0.41 0.37 -6.94 3.56 4.39 0.11 -3.42 114.58 113.06 2d9d h GLU 52 Ca 0.60 -0.02 -0.54 0.00 0.34 0.00 0.00 59.36 59.74 2d9d h GLU 52 Cb 1.19 -0.08 0.10 0.00 -0.10 0.00 0.00 28.75 29.86 2d9d h GLU 52 CO -0.54 0.25 0.75 0.08 -1.16 0.00 0.00 179.01 178.38 2d9d s VAL 53 N -6.12 2.16 0.11 3.13 1.01 0.46 -5.02 120.40 116.13 2d9d s VAL 53 Ca -0.13 0.16 0.09 0.00 0.00 0.00 0.00 61.98 62.10 2d9d s VAL 53 Cb 0.15 -3.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.40 2d9d s VAL 53 CO 0.74 0.04 -0.22 -0.44 0.00 0.00 0.00 175.10 175.21 2d9d s SER 54 N -0.25 2.73 0.14 3.32 0.01 -1.26 -5.00 113.70 113.39 2d9d s SER 54 Ca 0.53 -0.72 -0.31 0.00 1.31 0.00 0.00 55.95 56.76 2d9d s SER 54 Cb -0.45 -0.16 -0.09 0.00 0.21 0.00 0.00 66.02 65.53 2d9d s SER 54 CO 0.61 0.08 1.53 -0.76 0.41 0.00 0.00 173.24 175.11 2d9d s LEU 55 N -2.01 4.37 -0.74 2.44 1.43 -1.26 -4.96 118.68 117.95 2d9d s LEU 55 Ca 0.09 2.52 0.04 0.00 -1.03 0.00 0.00 54.13 55.75 2d9d s LEU 55 Cb -0.10 -3.59 0.26 0.00 0.03 0.00 0.00 46.19 42.79 2d9d s LEU 55 CO 0.05 -0.79 0.89 -0.62 0.23 0.00 0.00 176.35 176.11 2d9d n GLU 56 N 4.19 2.91 -3.53 1.70 -0.58 -1.26 -4.88 120.64 119.19 2d9d n GLU 56 Ca 0.14 -4.64 -0.19 0.00 -0.42 0.00 0.00 57.16 52.04 2d9d n GLU 56 Cb 0.40 -2.32 -0.06 0.00 -0.57 0.00 0.00 31.44 28.89 2d9d n GLU 56 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 2d9d n LYS 57 N 1.04 -0.94 -3.81 3.49 0.00 -1.26 -4.87 118.16 111.80 2d9d n LYS 57 Ca 0.28 0.06 -0.13 0.00 -0.00 0.00 0.00 58.31 58.53 2d9d n LYS 57 Cb 0.39 -2.22 -0.12 0.00 -0.00 0.00 0.00 35.03 33.08 2d9d n LYS 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2d9d s ASN 58 N -3.59 -0.19 0.15 -5.58 2.20 -1.26 -5.05 114.94 101.62 2d9d s ASN 58 Ca 0.08 0.37 -0.09 0.00 -0.94 0.00 0.00 52.86 52.27 2d9d s ASN 58 Cb -0.04 0.37 -0.00 0.00 -2.00 0.00 0.00 41.25 39.57 2d9d s ASN 58 CO 0.59 -0.06 1.49 1.55 -2.94 0.00 0.00 177.10 177.73 2d9d h PRO 59 N 5.87 0.89 0.00 3.55 0.13 -1.98 -2.50 132.00 137.95 2d9d h PRO 59 Ca -0.25 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.41 2d9d h PRO 59 Cb 1.20 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2d9d h PRO 59 CO 0.39 1.11 0.00 0.00 -0.23 0.00 0.00 178.00 179.28 2d9d h ILE 61 N 0.00 0.45 0.13 0.00 5.03 -1.96 0.37 117.51 121.52 2d9d h ILE 61 Ca 0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.73 2d9d h ILE 61 Cb 0.00 0.68 0.00 0.00 -3.03 0.00 0.00 36.82 34.47 2d9d h ILE 61 CO 0.00 0.00 -0.06 -0.09 -0.68 0.00 0.00 178.15 177.32 2d9d h ARG 62 N 0.00 -0.16 0.11 2.37 2.43 -1.07 -2.77 114.38 115.29 2d9d h ARG 62 Ca 0.20 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 2d9d h ARG 62 Cb 1.02 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 2d9d h ARG 62 CO -0.00 0.27 -0.05 1.49 -1.51 0.00 0.00 179.97 180.17 2d9d h GLU 63 N -0.68 -0.14 -0.91 0.20 4.57 0.50 -2.80 114.58 115.33 2d9d h GLU 63 Ca -0.02 0.01 0.26 0.00 -1.18 0.00 0.00 59.36 58.43 2d9d h GLU 63 Cb 0.51 0.03 -0.15 0.00 -0.16 0.00 0.00 28.75 28.98 2d9d h GLU 63 CO 0.03 0.36 0.25 0.00 -1.18 0.00 0.00 179.01 178.46 2d9d h ALA 64 N -0.14 1.35 -0.11 2.92 0.00 -0.45 0.81 119.26 123.65 2d9d h ALA 64 Ca -0.02 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2d9d h ALA 64 Cb 0.56 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2d9d h ALA 64 CO 0.02 -0.52 -0.00 -0.09 0.00 0.00 0.00 179.25 178.67 2d9d h ARG 65 N 0.18 0.19 0.24 0.00 2.43 -1.55 -2.82 114.38 113.06 2d9d h ARG 65 Ca 0.59 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.68 2d9d h ARG 65 Cb 1.23 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 2d9d h ARG 65 CO -0.69 0.45 -0.12 -0.09 -1.51 0.00 0.00 179.97 178.01 2d9d h ARG 66 N -0.08 -0.32 -0.74 0.20 9.65 -0.49 -3.19 114.38 119.41 2d9d h ARG 66 Ca 0.03 0.02 0.10 0.00 -1.10 0.00 0.00 59.98 59.03 2d9d h ARG 66 Cb 0.37 0.07 -0.11 0.00 -1.39 0.00 0.00 29.97 28.91 2d9d h ARG 66 CO 0.01 -0.21 -0.33 -2.13 2.80 0.00 0.00 179.97 180.11 2d9d n ARG 67 N -3.26 -0.21 -0.27 0.20 0.63 0.25 0.11 116.66 114.12 2d9d n ARG 67 Ca -0.04 1.13 0.01 0.00 -0.92 0.00 0.00 57.85 58.03 2d9d n ARG 67 Cb 0.13 -1.67 0.09 0.00 0.45 0.00 0.00 32.46 31.46 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 0.85 0.47 -0.81 5.13 0.00 -1.57 0.12 119.26 123.45 2d9d h ALA 68 Ca 0.22 0.29 0.17 0.00 0.00 0.00 0.00 54.91 55.59 2d9d h ALA 68 Cb 0.40 0.60 -0.15 0.00 0.00 0.00 0.00 17.79 18.64 2d9d h ALA 68 CO -0.72 -0.43 -0.18 0.28 0.00 0.00 0.00 179.25 178.20 2d9d h VAL 69 N -0.01 0.19 -0.16 0.00 2.07 0.85 0.53 116.25 119.73 2d9d h VAL 69 Ca 0.36 -0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.76 2d9d h VAL 69 Cb 0.56 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2d9d h VAL 69 CO -0.79 0.00 -0.35 0.40 0.02 0.00 0.00 177.57 176.85 2d9d h ILE 70 N 0.01 1.35 -0.01 4.57 5.03 -0.81 0.48 117.51 128.12 2d9d h ILE 70 Ca 0.40 -1.60 0.00 0.00 -0.12 0.00 0.00 64.86 63.54 2d9d h ILE 70 Cb 0.62 1.96 -0.00 0.00 -3.03 0.00 0.00 36.82 36.37 2d9d h ILE 70 CO -0.83 0.49 0.01 -0.33 -0.68 0.00 0.00 178.15 176.81 2d9d h GLU 71 N 0.16 0.00 0.01 2.37 3.07 0.10 0.67 114.58 120.96 2d9d h GLU 71 Ca 0.00 0.00 -0.38 0.00 -0.50 0.00 0.00 59.36 58.48 2d9d h GLU 71 Cb 0.95 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.79 2d9d h GLU 71 CO 0.08 0.00 -2.40 0.28 -1.40 0.00 0.00 179.01 175.57 2d9d n VAL 72 N -3.62 1.47 -0.16 3.13 0.31 0.17 -4.46 118.33 115.17 2d9d n VAL 72 Ca -0.03 -0.69 -0.10 0.00 -0.01 0.00 0.00 64.34 63.51 2d9d n VAL 72 Cb 0.09 -1.07 -0.00 0.00 -0.91 0.00 0.00 33.84 31.95 2d9d n VAL 72 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 2d9d h GLN 73 N 0.00 0.83 -1.05 5.55 1.08 0.41 -2.97 115.11 118.95 2d9d h GLN 73 Ca -0.55 -0.27 0.35 0.00 -1.45 0.00 0.00 58.65 56.72 2d9d h GLN 73 Cb 2.04 -0.07 -0.15 0.00 -0.05 0.00 0.00 27.48 29.25 2d9d h GLN 73 CO -0.03 0.89 0.62 0.00 -0.95 0.00 0.00 178.83 179.36 2d9d h THR 74 N 0.67 0.24 0.20 -0.54 1.03 -1.09 0.13 112.91 113.55 2d9d h THR 74 Ca 0.13 -0.08 -0.01 0.00 -0.01 0.00 0.00 66.41 66.43 2d9d h THR 74 Cb 0.53 -0.02 0.00 0.00 -1.07 0.00 0.00 68.15 67.59 2d9d h THR 74 CO 0.03 0.04 -0.09 -0.07 -0.01 0.00 0.00 175.52 175.42 2d9d h LEU 75 N 0.24 -0.22 -0.83 0.00 3.38 -1.76 -2.52 115.31 113.60 2d9d h LEU 75 Ca 0.76 -0.22 0.20 0.00 0.09 0.00 0.00 57.88 58.71 2d9d h LEU 75 Cb 1.89 0.06 -0.15 0.00 0.09 0.00 0.00 40.66 42.55 2d9d h LEU 75 CO -0.58 0.11 0.01 0.40 0.09 0.00 0.00 178.44 178.47 2d9d h ILE 76 N -0.58 0.25 -0.48 1.22 2.04 -0.80 0.21 117.51 119.36 2d9d h ILE 76 Ca -0.03 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 2d9d h ILE 76 Cb 0.43 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.64 2d9d h ILE 76 CO 0.04 0.02 0.17 0.74 0.00 0.00 0.00 178.15 179.12 2d9d h THR 77 N 0.08 1.22 -0.33 -0.27 2.02 -1.41 -0.71 112.91 113.52 2d9d h THR 77 Ca 0.47 -0.71 0.07 0.00 0.77 0.00 0.00 66.41 67.01 2d9d h THR 77 Cb 0.87 0.78 -0.08 0.00 -1.74 0.00 0.00 68.15 67.98 2d9d h THR 77 CO -0.74 0.26 -0.22 0.22 0.37 0.00 0.00 175.52 175.41 2d9d h TYR 78 N 0.64 -0.57 0.04 3.16 3.20 -0.15 -2.51 116.97 120.78 2d9d h TYR 78 Ca 0.16 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 2d9d h TYR 78 Cb 0.24 0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.81 2d9d h TYR 78 CO 0.01 -0.30 -0.02 0.82 -1.64 0.00 0.00 178.16 177.04 2d9d h ILE 79 N -0.18 1.22 -0.80 1.81 2.04 -1.27 -3.03 117.51 117.30 2d9d h ILE 79 Ca 0.17 -0.83 0.21 0.00 1.00 0.00 0.00 64.86 65.40 2d9d h ILE 79 Cb 0.44 1.77 -0.15 0.00 -0.74 0.00 0.00 36.82 38.14 2d9d h ILE 79 CO -0.44 0.21 -0.04 -0.67 0.00 0.00 0.00 178.15 177.22 2d9d n ASP 80 N -4.94 -0.14 0.28 1.72 2.03 -0.28 0.33 116.55 115.55 2d9d n ASP 80 Ca -0.08 1.37 -0.11 0.00 0.52 0.00 0.00 54.79 56.48 2d9d n ASP 80 Cb 0.20 -0.48 -0.05 0.00 -0.72 0.00 0.00 41.12 40.07 2d9d n ASP 80 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2d9d h LEU 81 N 0.00 -0.63 -0.14 -2.67 3.38 -1.43 -3.12 115.31 110.71 2d9d h LEU 81 Ca 0.46 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.48 2d9d h LEU 81 Cb 0.90 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.75 2d9d h LEU 81 CO -0.77 -0.30 -0.53 0.11 0.09 0.00 0.00 178.44 177.04 2d9d h LYS 82 N -1.03 -0.54 -0.80 1.13 6.56 -0.76 -1.64 116.57 119.49 2d9d h LYS 82 Ca -0.08 0.04 0.15 0.00 -1.06 0.00 0.00 60.65 59.70 2d9d h LYS 82 Cb 0.57 0.12 -0.15 0.00 -0.57 0.00 0.00 32.23 32.20 2d9d h LYS 82 CO 0.12 -0.36 -0.23 -1.91 -2.06 0.00 0.00 179.45 175.01 2d9d n GLU 83 N -5.34 -0.10 -1.71 3.15 2.13 0.15 -4.39 120.64 114.53 2d9d n GLU 83 Ca -0.06 1.25 -0.38 0.00 0.66 0.00 0.00 57.16 58.63 2d9d n GLU 83 Cb 0.37 -1.86 0.05 0.00 0.27 0.00 0.00 31.44 30.27 2d9d n GLU 83 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2d9d n SER 84 N -5.27 2.04 0.00 4.31 2.88 -0.62 -4.89 113.62 112.07 2d9d n SER 84 Ca 0.12 0.89 0.00 0.00 -1.33 0.00 0.00 58.87 58.55 2d9d n SER 84 Cb 0.38 -1.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.32 2d9d n SER 84 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9d n GLY 85 N 0.94 -0.96 3.62 0.46 0.00 -1.26 -4.99 105.19 102.99 2d9d n GLY 85 Ca 0.13 0.59 -0.43 0.00 0.00 0.00 0.00 46.02 46.31 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 0.61 3.71 -0.18 1.61 0.04 -1.26 -4.98 135.00 134.55 2d9d s PRO 86 Ca 0.00 1.57 -0.01 0.00 0.04 0.00 0.00 61.00 62.59 2d9d s PRO 86 Cb 0.00 -4.06 0.05 0.00 0.04 0.00 0.00 34.50 30.53 2d9d s PRO 86 CO 0.00 -1.40 -0.01 -1.12 0.04 0.00 0.00 177.00 174.51 2d9d s SER 87 N 4.48 2.88 -1.55 6.66 0.01 -1.26 -4.82 113.70 120.10 2d9d s SER 87 Ca 0.72 -0.75 -0.12 0.00 1.31 0.00 0.00 55.95 57.11 2d9d s SER 87 Cb -0.24 -0.76 0.09 0.00 0.21 0.00 0.00 66.02 65.32 2d9d s SER 87 CO 0.30 -0.25 0.80 -1.20 0.41 0.00 0.00 173.24 173.30 2d9d n SER 88 N 4.95 -3.21 0.00 2.44 7.64 -1.26 -5.33 113.62 118.85 2d9d n SER 88 Ca -0.10 -0.90 0.00 0.00 1.01 0.00 0.00 58.87 58.88 2d9d n SER 88 Cb 0.47 -3.37 0.00 0.00 -1.01 0.00 0.00 64.21 60.30 2d9d n SER 88 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64