#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 5.31 -0.03 1.61 0.15 -1.26 -5.06 113.70 114.42 2d9d s SER 2 Ca 0.00 -0.57 -0.30 0.00 0.70 0.00 0.00 55.95 55.78 2d9d s SER 2 Cb 0.00 -0.76 -0.06 0.00 -1.71 0.00 0.00 66.02 63.49 2d9d s SER 2 CO 0.00 -0.57 1.62 -0.55 1.20 0.00 0.00 173.24 174.94 2d9d s SER 3 N -4.13 6.68 0.27 5.45 0.15 -1.26 -4.58 113.70 116.28 2d9d s SER 3 Ca 0.47 2.25 0.00 0.00 0.70 0.00 0.00 55.95 59.37 2d9d s SER 3 Cb -0.06 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2d9d s SER 3 CO 0.29 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 174.44 2d9d n GLY 4 N 4.04 -4.91 3.47 9.45 0.00 -1.26 -4.80 105.19 111.18 2d9d n GLY 4 Ca 0.16 -0.44 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 2d9d n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9d s SER 5 N -1.30 6.24 0.40 1.61 0.01 -1.26 -4.99 113.70 114.42 2d9d s SER 5 Ca 0.00 -1.06 0.03 0.00 1.31 0.00 0.00 55.95 56.23 2d9d s SER 5 Cb 0.00 -2.45 -0.03 0.00 0.21 0.00 0.00 66.02 63.75 2d9d s SER 5 CO 0.00 -1.46 0.10 -0.44 0.41 0.00 0.00 173.24 171.85 2d9d s SER 6 N 3.76 2.86 0.00 2.44 0.01 -1.26 -5.03 113.70 116.48 2d9d s SER 6 Ca 0.27 -1.61 0.00 0.00 1.31 0.00 0.00 55.95 55.92 2d9d s SER 6 Cb -0.13 0.38 0.00 0.00 0.21 0.00 0.00 66.02 66.48 2d9d s SER 6 CO 0.07 -0.85 0.00 0.61 0.41 0.00 0.00 173.24 173.48 2d9d n GLY 7 N -0.90 -1.75 0.33 3.44 0.00 -1.26 -4.60 105.19 100.44 2d9d n GLY 7 Ca -0.07 -0.50 0.16 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.06 -0.08 1.61 7.64 -1.26 0.03 113.62 121.51 2d9d n SER 8 Ca 0.00 1.61 -0.10 0.00 1.01 0.00 0.00 58.87 61.39 2d9d n SER 8 Cb 0.00 -0.61 -0.04 0.00 -1.01 0.00 0.00 64.21 62.55 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 0.00 0.17 -0.29 0.44 5.03 -1.99 -0.14 117.51 120.73 2d9d h ILE 9 Ca 0.61 0.00 -0.06 0.00 -0.12 0.00 0.00 64.86 65.29 2d9d h ILE 9 Cb 1.31 0.17 -0.02 0.00 -3.03 0.00 0.00 36.82 35.25 2d9d h ILE 9 CO -0.88 0.00 -0.06 -0.07 -0.68 0.00 0.00 178.15 176.46 2d9d h LEU 10 N -0.36 0.44 -0.15 1.44 3.38 -0.65 0.52 115.31 119.93 2d9d h LEU 10 Ca 0.13 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2d9d h LEU 10 Cb 0.58 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2d9d h LEU 10 CO -0.49 0.55 0.00 0.29 0.09 0.00 0.00 178.44 178.88 2d9d n LYS 11 N -4.25 0.02 0.00 1.13 5.02 -0.15 -1.87 118.16 118.06 2d9d n LYS 11 Ca 0.01 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 2d9d n LYS 11 Cb 0.27 -1.56 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 2d9d n LYS 11 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2d9d n ILE 12 N -1.60 0.00 -0.02 -0.18 5.41 -0.59 -4.54 119.36 117.84 2d9d n ILE 12 Ca 0.01 0.00 -0.06 0.00 1.00 0.00 0.00 62.75 63.70 2d9d n ILE 12 Cb 0.08 -0.78 0.13 0.00 -0.71 0.00 0.00 39.64 38.35 2d9d n ILE 12 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 176.55 177.60 2d9d h GLU 13 N 0.00 0.58 -0.27 0.38 -0.00 0.26 -3.04 114.58 112.49 2d9d h GLU 13 Ca 0.00 -0.26 -0.16 0.00 -0.00 0.00 0.00 59.36 58.94 2d9d h GLU 13 Cb 0.84 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 29.58 2d9d h GLU 13 CO 0.00 0.84 -0.47 1.57 -0.00 0.00 0.00 179.01 180.94 2d9d h LYS 14 N 0.49 0.72 0.00 1.06 2.10 -1.61 0.11 116.57 119.44 2d9d h LYS 14 Ca 0.06 -0.41 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 2d9d h LYS 14 Cb 0.81 0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.17 2d9d h LYS 14 CO 0.07 1.03 0.05 0.28 -2.00 0.00 0.00 179.45 178.88 2d9d n VAL 15 N -4.01 1.53 -0.03 0.07 0.31 -1.15 -2.82 118.33 112.23 2d9d n VAL 15 Ca -0.03 0.58 -0.06 0.00 -0.01 0.00 0.00 64.34 64.82 2d9d n VAL 15 Cb 0.57 -1.58 -0.02 0.00 -0.91 0.00 0.00 33.84 31.90 2d9d n VAL 15 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2d9d n LEU 16 N -1.70 0.47 -0.32 7.52 4.77 -1.04 -4.33 117.00 122.37 2d9d n LEU 16 Ca -0.00 0.06 0.03 0.00 -0.03 0.00 0.00 56.01 56.07 2d9d n LEU 16 Cb 0.06 -0.16 0.08 0.00 -2.33 0.00 0.00 43.42 41.07 2d9d n LEU 16 CO 0.03 0.13 0.55 1.17 -1.33 0.00 0.00 177.39 177.94 2d9d n LYS 17 N -3.23 -0.13 -0.08 3.23 4.81 0.35 0.72 118.16 123.83 2d9d n LYS 17 Ca -0.11 1.35 -0.14 0.00 -0.87 0.00 0.00 58.31 58.55 2d9d n LYS 17 Cb 0.58 -2.02 -0.05 0.00 0.02 0.00 0.00 35.03 33.56 2d9d n LYS 17 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 2d9d h ARG 18 N 0.00 0.72 -0.96 1.64 9.65 -1.79 -3.08 114.38 120.55 2d9d h ARG 18 Ca 0.37 -0.42 0.20 0.00 -1.10 0.00 0.00 59.98 59.03 2d9d h ARG 18 Cb 0.59 0.03 -0.08 0.00 -1.39 0.00 0.00 29.97 29.12 2d9d h ARG 18 CO -0.88 1.04 0.61 1.98 2.80 0.00 0.00 179.97 185.52 2d9d h MET 19 N 0.46 0.53 0.12 0.20 4.05 0.10 -0.20 114.93 120.19 2d9d h MET 19 Ca 0.03 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 2d9d h MET 19 Cb 0.96 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.64 2d9d h MET 19 CO 0.09 0.35 -0.06 0.00 0.23 0.00 0.00 176.91 177.52 2d9d h ARG 20 N 0.55 -0.15 0.09 0.39 3.08 -0.82 -2.98 114.38 114.54 2d9d h ARG 20 Ca 0.52 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.60 2d9d h ARG 20 Cb 1.10 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 31.16 2d9d h ARG 20 CO -0.26 0.19 -0.19 0.93 -1.07 0.00 0.00 179.97 179.57 2d9d h GLU 21 N -0.51 -0.34 -1.07 0.04 4.39 -1.22 -1.92 114.58 113.94 2d9d h GLU 21 Ca -0.02 0.02 0.31 0.00 0.34 0.00 0.00 59.36 60.02 2d9d h GLU 21 Cb 0.41 0.08 -0.12 0.00 -0.10 0.00 0.00 28.75 29.02 2d9d h GLU 21 CO 0.03 -0.23 0.65 0.82 -1.16 0.00 0.00 179.01 179.12 2d9d h ILE 22 N -0.35 0.39 0.85 3.13 2.04 -1.13 -1.01 117.51 121.43 2d9d h ILE 22 Ca 0.03 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.72 2d9d h ILE 22 Cb 0.38 -0.00 0.01 0.00 -0.74 0.00 0.00 36.82 36.47 2d9d h ILE 22 CO -0.12 0.07 -0.41 0.50 0.00 0.00 0.00 178.15 178.19 2d9d h LYS 23 N 0.36 -1.10 -0.87 2.37 3.64 -1.19 -2.13 116.57 117.64 2d9d h LYS 23 Ca 0.69 0.08 0.20 0.00 -1.27 0.00 0.00 60.65 60.34 2d9d h LYS 23 Cb 1.68 0.25 -0.12 0.00 -0.41 0.00 0.00 32.23 33.63 2d9d h LYS 23 CO -0.45 -0.73 0.39 -0.97 -2.27 0.00 0.00 179.45 175.41 2d9d h ASN 24 N -1.25 0.36 -0.59 4.20 -0.73 -0.99 0.37 115.58 116.95 2d9d h ASN 24 Ca -0.12 0.14 0.00 0.00 1.87 0.00 0.00 56.30 58.19 2d9d h ASN 24 Cb 0.88 0.10 -0.03 0.00 0.27 0.00 0.00 38.32 39.54 2d9d h ASN 24 CO 0.19 0.06 0.39 -0.08 -0.37 0.00 0.00 177.43 177.61 2d9d h GLU 25 N 0.45 0.79 -0.01 6.67 4.81 -1.13 0.17 114.58 126.32 2d9d h GLU 25 Ca 0.52 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 59.55 2d9d h GLU 25 Cb 0.93 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 30.15 2d9d h GLU 25 CO -0.48 0.53 -0.59 1.25 -0.73 0.00 0.00 179.01 178.98 2d9d h LEU 26 N 0.81 0.54 -0.67 1.64 5.85 0.30 -0.43 115.31 123.35 2d9d h LEU 26 Ca 0.22 -0.75 -0.01 0.00 0.84 0.00 0.00 57.88 58.18 2d9d h LEU 26 Cb -0.08 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 2d9d h LEU 26 CO -0.05 1.22 0.39 -0.07 -0.34 0.00 0.00 178.44 179.59 2d9d h LEU 27 N -0.08 0.81 -0.03 2.25 3.38 -0.53 -3.09 115.31 118.02 2d9d h LEU 27 Ca -0.07 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 2d9d h LEU 27 Cb 1.30 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2d9d h LEU 27 CO 0.12 0.65 -0.18 1.56 0.09 0.00 0.00 178.44 180.68 2d9d h GLN 28 N 0.91 0.18 -5.39 1.13 4.20 -1.04 -3.45 115.11 111.64 2d9d h GLN 28 Ca 0.24 -0.15 -0.72 0.00 0.06 0.00 0.00 58.65 58.08 2d9d h GLN 28 Cb 0.00 0.03 0.04 0.00 0.30 0.00 0.00 27.48 27.86 2d9d h GLN 28 CO -0.04 0.81 0.10 0.00 -0.67 0.00 0.00 178.83 179.04 2d9d n ALA 29 N -2.48 -3.15 0.12 3.87 0.00 -0.17 -4.88 120.51 113.82 2d9d n ALA 29 Ca -0.09 0.53 -0.10 0.00 0.00 0.00 0.00 53.44 53.79 2d9d n ALA 29 Cb 0.43 -1.59 -0.06 0.00 0.00 0.00 0.00 19.45 18.23 2d9d n ALA 29 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2d9d h GLN 30 N 2.85 -0.37 -2.90 0.00 7.50 -1.88 -3.38 115.11 116.92 2d9d h GLN 30 Ca -0.45 0.03 -0.70 0.00 0.50 0.00 0.00 58.65 58.02 2d9d h GLN 30 Cb 1.28 0.09 -0.36 0.00 0.05 0.00 0.00 27.48 28.54 2d9d h GLN 30 CO 0.61 -0.07 -0.03 -1.71 -1.50 0.00 0.00 178.83 176.13 2d9d n ASN 31 N -5.04 4.61 0.00 1.46 5.15 -1.26 -4.86 115.26 115.31 2d9d n ASN 31 Ca -0.07 -3.29 0.07 0.00 -0.60 0.00 0.00 54.58 50.69 2d9d n ASN 31 Cb 0.24 -0.99 0.42 0.00 -0.53 0.00 0.00 39.78 38.92 2d9d n ASN 31 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2d9d n PRO 32 N 1.65 0.49 -0.28 1.20 -0.04 -1.26 -4.02 135.00 132.75 2d9d n PRO 32 Ca 0.25 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.78 2d9d n PRO 32 Cb 0.37 -1.45 0.15 0.00 -0.04 0.00 0.00 33.50 32.52 2d9d n PRO 32 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2d9d n SER 33 N -0.95 -0.22 0.10 3.54 3.41 -1.26 0.53 113.62 118.77 2d9d n SER 33 Ca 0.11 1.33 -0.23 0.00 -0.26 0.00 0.00 58.87 59.81 2d9d n SER 33 Cb 0.05 -0.43 -0.15 0.00 -0.26 0.00 0.00 64.21 63.42 2d9d n SER 33 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2d9d h GLU 34 N 0.00 0.44 -0.83 4.33 4.11 -2.03 -3.33 114.58 117.27 2d9d h GLU 34 Ca 0.40 -0.75 0.20 0.00 0.07 0.00 0.00 59.36 59.29 2d9d h GLU 34 Cb 0.69 0.28 -0.13 0.00 0.50 0.00 0.00 28.75 30.09 2d9d h GLU 34 CO -0.78 1.36 0.21 -0.07 0.07 0.00 0.00 179.01 179.80 2d9d h LEU 35 N -0.05 0.00 -0.86 3.06 3.38 -0.17 -0.47 115.31 120.20 2d9d h LEU 35 Ca -0.23 0.18 0.21 0.00 0.09 0.00 0.00 57.88 58.12 2d9d h LEU 35 Cb 1.98 0.24 -0.16 0.00 0.09 0.00 0.00 40.66 42.80 2d9d h LEU 35 CO 0.22 -0.11 -0.10 -1.22 0.09 0.00 0.00 178.44 177.32 2d9d n TYR 36 N -5.20 0.43 0.20 1.13 4.01 0.23 0.56 117.16 118.51 2d9d n TYR 36 Ca 0.18 1.05 -0.08 0.00 -0.16 0.00 0.00 57.90 58.89 2d9d n TYR 36 Cb 0.59 -1.07 -0.04 0.00 -0.31 0.00 0.00 39.34 38.51 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 -0.44 -0.02 7.72 4.07 -1.30 -2.55 115.31 122.78 2d9d h LEU 37 Ca 0.47 0.02 0.01 0.00 0.08 0.00 0.00 57.88 58.46 2d9d h LEU 37 Cb 0.85 0.11 -0.03 0.00 1.08 0.00 0.00 40.66 42.68 2d9d h LEU 37 CO -0.85 -0.23 -0.26 -1.28 -1.08 0.00 0.00 178.44 174.74 2d9d h SER 38 N -0.69 -0.82 -0.95 -0.43 0.87 -1.10 0.78 113.55 111.21 2d9d h SER 38 Ca -0.05 0.09 0.10 0.00 -1.23 0.00 0.00 61.79 60.70 2d9d h SER 38 Cb 0.40 0.31 -0.13 0.00 -0.44 0.00 0.00 62.40 62.54 2d9d h SER 38 CO 0.09 -0.25 -0.51 -1.20 -0.53 0.00 0.00 176.83 174.43 2d9d n SER 39 N -3.94 -0.91 0.07 6.23 7.64 0.19 -0.59 113.62 122.32 2d9d n SER 39 Ca -0.03 1.69 -0.12 0.00 1.01 0.00 0.00 58.87 61.42 2d9d n SER 39 Cb 0.19 -0.26 -0.05 0.00 -1.01 0.00 0.00 64.21 63.08 2d9d n SER 39 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2d9d h LYS 40 N 0.00 -0.44 -0.00 1.43 3.64 -1.06 -1.66 116.57 118.48 2d9d h LYS 40 Ca 0.20 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 2d9d h LYS 40 Cb 0.44 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 2d9d h LYS 40 CO -0.91 -0.29 -0.06 1.15 -2.27 0.00 0.00 179.45 177.07 2d9d h THR 41 N -0.45 0.00 -0.99 1.00 2.02 0.16 -2.70 112.91 111.95 2d9d h THR 41 Ca 0.06 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.35 2d9d h THR 41 Cb 0.53 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.81 2d9d h THR 41 CO -0.24 0.00 -0.53 -0.08 0.37 0.00 0.00 175.52 175.04 2d9d h GLU 42 N -0.07 -0.00 -0.89 6.66 4.57 -0.86 0.32 114.58 124.30 2d9d h GLU 42 Ca 0.00 0.00 0.21 0.00 -1.18 0.00 0.00 59.36 58.40 2d9d h GLU 42 Cb 0.08 0.00 -0.17 0.00 -0.16 0.00 0.00 28.75 28.50 2d9d h GLU 42 CO -0.04 -0.00 -0.10 1.28 -1.18 0.00 0.00 179.01 178.97 2d9d n LEU 43 N -5.32 -0.21 -0.03 1.64 4.77 -0.63 0.59 117.00 117.81 2d9d n LEU 43 Ca 0.04 1.52 -0.08 0.00 -0.03 0.00 0.00 56.01 57.46 2d9d n LEU 43 Cb 0.30 -0.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.86 2d9d n LEU 43 CO -0.15 -1.51 0.71 1.56 -1.33 0.00 0.00 177.39 176.68 2d9d h GLN 44 N 0.00 -0.23 -0.72 3.23 4.20 -0.06 -2.79 115.11 118.75 2d9d h GLN 44 Ca 0.49 0.02 0.07 0.00 0.06 0.00 0.00 58.65 59.28 2d9d h GLN 44 Cb 0.89 0.05 -0.10 0.00 0.30 0.00 0.00 27.48 28.63 2d9d h GLN 44 CO -0.88 -0.15 -0.52 0.78 -0.67 0.00 0.00 178.83 177.40 2d9d h GLY 45 N -0.24 -1.07 -0.64 3.46 0.00 0.23 -1.44 103.07 103.38 2d9d h GLY 45 Ca 0.12 0.81 0.07 0.00 0.00 0.00 0.00 47.33 48.33 2d9d h GLY 45 CO -0.34 -0.11 -0.54 1.41 0.00 0.00 0.00 176.54 176.95 2d9d h LEU 46 N -0.12 -1.90 -1.87 3.11 3.38 -1.42 0.68 115.31 117.18 2d9d h LEU 46 Ca 0.12 0.28 0.52 0.00 0.09 0.00 0.00 57.88 58.88 2d9d h LEU 46 Cb 0.42 0.82 -0.07 0.00 0.09 0.00 0.00 40.66 41.91 2d9d h LEU 46 CO -0.74 -0.33 1.36 0.40 0.09 0.00 0.00 178.44 179.22 2d9d h ILE 47 N -0.23 0.03 -0.56 1.22 2.04 -1.15 0.84 117.51 119.70 2d9d h ILE 47 Ca 0.13 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 2d9d h ILE 47 Cb 0.53 0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 2d9d h ILE 47 CO -0.74 0.00 0.26 1.23 0.00 0.00 0.00 178.15 178.90 2d9d h GLY 48 N 0.00 0.88 1.84 5.37 0.00 0.59 -1.89 103.07 109.85 2d9d h GLY 48 Ca 0.85 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.74 2d9d h GLY 48 CO -0.01 0.42 0.07 1.46 0.00 0.00 0.00 176.54 178.49 2d9d h GLN 49 N 0.76 0.00 -1.13 4.80 4.20 0.67 -1.68 115.11 122.73 2d9d h GLN 49 Ca 0.19 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.73 2d9d h GLN 49 Cb 0.14 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.83 2d9d h GLN 49 CO -0.02 0.00 0.21 1.28 -0.67 0.00 0.00 178.83 179.63 2d9d n LEU 50 N -2.66 4.51 -0.07 1.46 4.77 -0.71 -3.85 117.00 120.44 2d9d n LEU 50 Ca -0.02 -2.30 -0.13 0.00 -0.03 0.00 0.00 56.01 53.53 2d9d n LEU 50 Cb 0.12 -0.69 -0.05 0.00 -2.33 0.00 0.00 43.42 40.46 2d9d n LEU 50 CO 0.14 0.76 -0.97 -0.67 -1.33 0.00 0.00 177.39 175.32 2d9d n ASP 51 N 0.14 1.59 0.19 -1.43 2.03 -0.63 -4.74 116.55 113.70 2d9d n ASP 51 Ca 0.18 0.10 -0.14 0.00 0.52 0.00 0.00 54.79 55.45 2d9d n ASP 51 Cb 0.80 -0.35 -0.08 0.00 -0.72 0.00 0.00 41.12 40.77 2d9d n ASP 51 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2d9d h GLU 52 N -0.35 -0.43 -5.77 -0.67 4.39 -1.79 -3.44 114.58 106.53 2d9d h GLU 52 Ca -0.34 0.03 -0.79 0.00 0.34 0.00 0.00 59.36 58.60 2d9d h GLU 52 Cb 1.35 0.10 0.03 0.00 -0.10 0.00 0.00 28.75 30.14 2d9d h GLU 52 CO -0.16 -0.19 0.30 0.28 -1.16 0.00 0.00 179.01 178.08 2d9d n VAL 53 N -5.22 0.00 -4.13 3.13 0.31 -1.26 -4.93 118.33 106.23 2d9d n VAL 53 Ca -0.10 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 63.94 2d9d n VAL 53 Cb 0.24 -0.20 -0.08 0.00 -0.91 0.00 0.00 33.84 32.90 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 1.18 5.06 -0.25 4.52 0.15 -1.26 -5.04 113.70 118.05 2d9d s SER 54 Ca 0.93 -0.21 -0.32 0.00 0.70 0.00 0.00 55.95 57.05 2d9d s SER 54 Cb -1.31 -1.20 -0.09 0.00 -1.71 0.00 0.00 66.02 61.70 2d9d s SER 54 CO 0.65 0.14 2.14 0.18 1.20 0.00 0.00 173.24 177.55 2d9d n LEU 55 N 0.32 2.80 -4.89 3.45 7.99 -1.26 -4.94 117.00 120.46 2d9d n LEU 55 Ca -0.10 0.45 -0.31 0.00 -0.01 0.00 0.00 56.01 56.04 2d9d n LEU 55 Cb 0.53 -1.39 -0.05 0.00 -0.11 0.00 0.00 43.42 42.40 2d9d n LEU 55 CO 0.40 -0.58 0.13 -1.61 -1.51 0.00 0.00 177.39 174.22 2d9d s GLU 56 N 5.83 3.68 0.17 3.23 2.02 -1.26 -5.00 118.70 127.37 2d9d s GLU 56 Ca 1.03 0.04 -0.25 0.00 0.02 0.00 0.00 54.97 55.80 2d9d s GLU 56 Cb -0.64 -2.74 0.02 0.00 0.10 0.00 0.00 34.13 30.87 2d9d s GLU 56 CO 0.45 0.36 1.44 1.63 0.02 0.00 0.00 175.26 179.16 2d9d n LYS 57 N -0.23 -0.36 -1.70 1.61 5.02 -1.26 -4.43 118.16 116.81 2d9d n LYS 57 Ca -0.01 1.42 -0.40 0.00 -2.02 0.00 0.00 58.31 57.30 2d9d n LYS 57 Cb 0.52 -2.09 0.02 0.00 -0.02 0.00 0.00 35.03 33.47 2d9d n LYS 57 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2d9d n ASN 58 N -5.23 2.36 -0.11 4.39 4.13 -1.26 -4.93 115.26 114.62 2d9d n ASN 58 Ca 0.04 1.04 -0.13 0.00 1.68 0.00 0.00 54.58 57.21 2d9d n ASN 58 Cb 0.28 -1.51 -0.03 0.00 -1.54 0.00 0.00 39.78 36.98 2d9d n ASN 58 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2d9d h PRO 59 N 1.72 0.86 -1.48 3.52 0.13 -2.01 -3.14 132.00 131.60 2d9d h PRO 59 Ca -0.49 -0.45 0.43 0.00 -0.87 0.00 0.00 66.00 64.62 2d9d h PRO 59 Cb 1.31 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 32.39 2d9d h PRO 59 CO 0.58 1.09 1.25 0.00 -0.23 0.00 0.00 178.00 180.69 2d9d h ILE 61 N 0.00 0.84 -0.31 0.00 5.03 -1.85 -2.76 117.51 118.46 2d9d h ILE 61 Ca 0.70 -2.39 0.03 0.00 -0.12 0.00 0.00 64.86 63.09 2d9d h ILE 61 Cb 3.19 2.61 -0.03 0.00 -3.03 0.00 0.00 36.82 39.55 2d9d h ILE 61 CO -0.01 0.79 0.11 -0.09 -0.68 0.00 0.00 178.15 178.27 2d9d h ARG 62 N -0.11 0.25 0.14 2.37 2.43 0.20 -1.92 114.38 117.74 2d9d h ARG 62 Ca -0.36 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.78 2d9d h ARG 62 Cb 1.92 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 31.41 2d9d h ARG 62 CO 0.08 0.16 -0.07 1.49 -1.51 0.00 0.00 179.97 180.12 2d9d h GLU 63 N 0.25 -0.19 -0.74 0.20 4.81 -1.36 -3.29 114.58 114.27 2d9d h GLU 63 Ca 0.14 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.45 2d9d h GLU 63 Cb 0.10 0.04 -0.09 0.00 0.63 0.00 0.00 28.75 29.43 2d9d h GLU 63 CO -0.14 -0.12 -0.43 0.00 -0.73 0.00 0.00 179.01 177.59 2d9d n ALA 64 N -2.43 -0.46 -0.24 2.92 0.00 -1.04 -0.09 120.51 119.17 2d9d n ALA 64 Ca -0.02 0.63 -0.08 0.00 0.00 0.00 0.00 53.44 53.96 2d9d n ALA 64 Cb 0.08 -0.11 -0.07 0.00 0.00 0.00 0.00 19.45 19.34 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 -0.07 0.60 0.00 2.43 -1.50 0.15 114.38 115.99 2d9d h ARG 65 Ca 0.12 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.27 2d9d h ARG 65 Cb 0.31 0.02 0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2d9d h ARG 65 CO -0.70 -0.05 -0.29 -0.09 -1.51 0.00 0.00 179.97 177.34 2d9d h ARG 66 N -0.08 -0.77 -0.73 0.20 2.43 -0.87 -2.77 114.38 111.79 2d9d h ARG 66 Ca 0.10 0.05 0.18 0.00 -0.81 0.00 0.00 59.98 59.50 2d9d h ARG 66 Cb 0.33 0.18 -0.14 0.00 -0.42 0.00 0.00 29.97 29.92 2d9d h ARG 66 CO -0.60 -0.51 -0.07 -2.13 -1.51 0.00 0.00 179.97 175.14 2d9d n ARG 67 N -4.18 -0.06 0.04 0.20 0.63 0.87 0.14 116.66 114.30 2d9d n ARG 67 Ca -0.10 1.11 -0.11 0.00 -0.92 0.00 0.00 57.85 57.83 2d9d n ARG 67 Cb 0.32 -1.71 -0.05 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 1.45 -0.07 -0.58 5.13 0.00 -0.57 0.13 119.26 124.75 2d9d h ALA 68 Ca 0.40 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.44 2d9d h ALA 68 Cb 0.75 0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.57 2d9d h ALA 68 CO -0.71 -0.57 -0.17 0.28 0.00 0.00 0.00 179.25 178.08 2d9d h VAL 69 N -0.13 0.37 0.20 0.00 2.07 0.15 -0.01 116.25 118.91 2d9d h VAL 69 Ca 0.04 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 2d9d h VAL 69 Cb 0.18 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 2d9d h VAL 69 CO -0.09 0.00 -0.10 0.40 0.02 0.00 0.00 177.57 177.80 2d9d h ILE 70 N -0.03 0.88 -0.68 4.57 5.03 -1.15 -1.63 117.51 124.50 2d9d h ILE 70 Ca 0.28 -0.71 0.11 0.00 -0.12 0.00 0.00 64.86 64.42 2d9d h ILE 70 Cb 0.45 1.28 -0.12 0.00 -3.03 0.00 0.00 36.82 35.41 2d9d h ILE 70 CO -0.61 0.15 -0.37 -0.33 -0.68 0.00 0.00 178.15 176.31 2d9d h GLU 71 N -0.64 -0.13 0.50 2.37 4.39 -0.16 0.14 114.58 121.04 2d9d h GLU 71 Ca -0.03 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 2d9d h GLU 71 Cb 0.46 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 2d9d h GLU 71 CO 0.05 -0.09 -0.24 0.28 -1.16 0.00 0.00 179.01 177.85 2d9d h VAL 72 N -0.14 0.00 -0.92 3.13 2.07 -1.05 -3.17 116.25 116.17 2d9d h VAL 72 Ca 0.24 -0.07 0.18 0.00 0.82 0.00 0.00 66.70 67.88 2d9d h VAL 72 Cb 0.56 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.16 2d9d h VAL 72 CO -0.75 0.00 -0.23 0.00 0.02 0.00 0.00 177.57 176.61 2d9d n GLN 73 N -3.99 -0.08 -0.30 1.57 1.13 -0.62 0.28 117.38 115.38 2d9d n GLN 73 Ca -0.08 1.43 0.10 0.00 -1.94 0.00 0.00 57.00 56.51 2d9d n GLN 73 Cb 0.26 -2.14 0.21 0.00 0.11 0.00 0.00 30.24 28.68 2d9d n GLN 73 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 2d9d n THR 74 N -5.49 -0.36 0.01 5.09 -1.04 0.46 0.62 114.28 113.58 2d9d n THR 74 Ca 0.15 1.89 -0.13 0.00 -2.04 0.00 0.00 64.05 63.92 2d9d n THR 74 Cb 0.46 -2.71 -0.09 0.00 -1.82 0.00 0.00 70.33 66.17 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 -0.01 -0.83 -4.42 3.38 -0.27 -1.77 115.31 111.40 2d9d h LEU 75 Ca 0.48 -0.28 0.15 0.00 0.09 0.00 0.00 57.88 58.32 2d9d h LEU 75 Cb 0.91 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.57 2d9d h LEU 75 CO -0.82 0.28 0.40 0.40 0.09 0.00 0.00 178.44 178.78 2d9d h ILE 76 N -0.30 0.68 -0.37 1.22 2.04 0.28 -0.81 117.51 120.26 2d9d h ILE 76 Ca -0.00 -0.19 -0.08 0.00 1.00 0.00 0.00 64.86 65.59 2d9d h ILE 76 Cb 0.29 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 2d9d h ILE 76 CO 0.00 0.10 -0.08 0.74 0.00 0.00 0.00 178.15 178.91 2d9d h THR 77 N 0.55 1.28 -0.55 -0.27 2.02 -0.80 -2.42 112.91 112.71 2d9d h THR 77 Ca 0.46 -1.15 0.05 0.00 0.77 0.00 0.00 66.41 66.54 2d9d h THR 77 Cb 0.69 1.26 -0.05 0.00 -1.74 0.00 0.00 68.15 68.31 2d9d h THR 77 CO -0.39 0.38 0.29 0.22 0.37 0.00 0.00 175.52 176.39 2d9d h TYR 78 N 0.51 0.53 -0.78 3.16 3.20 -0.28 -2.01 116.97 121.29 2d9d h TYR 78 Ca 0.09 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 2d9d h TYR 78 Cb 0.59 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 2d9d h TYR 78 CO 0.05 0.26 0.28 0.82 -1.64 0.00 0.00 178.16 177.93 2d9d h ILE 79 N 0.55 1.26 -0.21 1.81 2.04 -1.14 -2.61 117.51 119.21 2d9d h ILE 79 Ca 0.24 -0.87 0.03 0.00 1.00 0.00 0.00 64.86 65.27 2d9d h ILE 79 Cb 0.14 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 2d9d h ILE 79 CO -0.16 0.35 -0.00 -0.78 0.00 0.00 0.00 178.15 177.55 2d9d h ASP 80 N 1.15 -0.08 0.47 1.72 1.82 -0.87 -0.16 116.42 120.47 2d9d h ASP 80 Ca 0.26 0.05 -0.02 0.00 -0.39 0.00 0.00 57.03 56.92 2d9d h ASP 80 Cb 0.26 0.08 -0.00 0.00 0.68 0.00 0.00 39.33 40.35 2d9d h ASP 80 CO -0.02 -0.02 -0.28 -0.07 -1.61 0.00 0.00 179.24 177.24 2d9d h LEU 81 N 0.06 -0.71 -0.66 2.28 4.07 -1.24 -2.08 115.31 117.03 2d9d h LEU 81 Ca 0.10 0.04 0.12 0.00 0.08 0.00 0.00 57.88 58.22 2d9d h LEU 81 Cb 0.12 0.21 -0.13 0.00 1.08 0.00 0.00 40.66 41.94 2d9d h LEU 81 CO -0.17 -0.44 -0.26 0.11 -1.08 0.00 0.00 178.44 176.61 2d9d h LYS 82 N -0.71 -0.08 -0.14 1.13 1.79 -1.43 -2.09 116.57 115.05 2d9d h LYS 82 Ca -0.06 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.43 2d9d h LYS 82 Cb 0.56 0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 31.19 2d9d h LYS 82 CO 0.07 -0.05 -0.35 0.93 -1.08 0.00 0.00 179.45 178.96 2d9d h GLU 83 N -0.08 -0.33 -6.89 3.15 5.08 -0.93 -3.41 114.58 111.18 2d9d h GLU 83 Ca 0.29 0.02 -0.54 0.00 -1.00 0.00 0.00 59.36 58.14 2d9d h GLU 83 Cb 0.54 0.07 0.10 0.00 0.50 0.00 0.00 28.75 29.96 2d9d h GLU 83 CO -0.71 -0.22 0.83 0.45 -1.00 0.00 0.00 179.01 178.37 2d9d s SER 84 N -4.09 6.33 1.01 1.42 0.15 -0.79 -4.93 113.70 112.80 2d9d s SER 84 Ca -0.10 3.04 -0.19 0.00 0.70 0.00 0.00 55.95 59.40 2d9d s SER 84 Cb 0.05 -2.66 -0.08 0.00 -1.71 0.00 0.00 66.02 61.62 2d9d s SER 84 CO 0.39 -0.91 -0.60 0.61 1.20 0.00 0.00 173.24 173.93 2d9d n GLY 85 N 1.15 -3.35 0.07 9.45 0.00 -1.26 -4.81 105.19 106.43 2d9d n GLY 85 Ca 0.04 -0.62 0.10 0.00 0.00 0.00 0.00 46.02 45.54 2d9d n GLY 85 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d9d n PRO 86 N 0.88 0.10 -1.30 1.61 -0.04 -1.26 -4.87 135.00 130.12 2d9d n PRO 86 Ca 0.00 0.35 -0.47 0.00 -0.04 0.00 0.00 63.50 63.34 2d9d n PRO 86 Cb 0.61 -1.70 -0.04 0.00 -0.04 0.00 0.00 33.50 32.33 2d9d n PRO 86 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d9d n SER 87 N -1.90 -0.75 -4.85 3.54 2.88 -1.26 -4.90 113.62 106.39 2d9d n SER 87 Ca 0.03 1.04 -0.32 0.00 -1.33 0.00 0.00 58.87 58.28 2d9d n SER 87 Cb 0.20 -0.85 -0.02 0.00 -0.75 0.00 0.00 64.21 62.78 2d9d n SER 87 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2d9d s SER 88 N -0.60 6.45 0.00 -3.46 0.01 -1.26 -5.17 113.70 109.67 2d9d s SER 88 Ca 0.67 1.55 0.00 0.00 1.31 0.00 0.00 55.95 59.48 2d9d s SER 88 Cb -0.95 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 62.78 2d9d s SER 88 CO 0.51 -0.71 0.00 0.61 0.41 0.00 0.00 173.24 174.06