#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 6.24 0.15 1.61 0.15 -1.26 -5.00 113.70 115.59 2d9d s SER 2 Ca 0.00 -1.06 0.09 0.00 0.70 0.00 0.00 55.95 55.68 2d9d s SER 2 Cb 0.00 -2.44 -0.04 0.00 -1.71 0.00 0.00 66.02 61.83 2d9d s SER 2 CO 0.00 -1.46 -0.20 -0.44 1.20 0.00 0.00 173.24 172.34 2d9d s SER 3 N 3.75 2.72 0.25 5.45 0.01 -1.26 -5.16 113.70 119.47 2d9d s SER 3 Ca 0.26 -0.81 0.09 0.00 1.31 0.00 0.00 55.95 56.81 2d9d s SER 3 Cb -0.13 -0.16 -0.05 0.00 0.21 0.00 0.00 66.02 65.88 2d9d s SER 3 CO 0.08 0.01 -0.15 -0.83 0.41 0.00 0.00 173.24 172.76 2d9d s GLY 4 N -2.42 1.68 0.00 3.44 0.00 -1.26 -5.15 107.32 103.61 2d9d s GLY 4 Ca 0.13 -1.79 0.05 0.00 0.00 0.00 0.00 44.72 43.11 2d9d s GLY 4 CO 0.06 -1.86 -0.17 -0.45 0.00 0.00 0.00 173.10 170.69 2d9d s SER 5 N -3.42 1.98 -0.24 1.64 0.15 -1.26 -5.14 113.70 107.42 2d9d s SER 5 Ca 0.27 -0.35 -0.17 0.00 0.70 0.00 0.00 55.95 56.39 2d9d s SER 5 Cb -0.01 -0.20 0.07 0.00 -1.71 0.00 0.00 66.02 64.16 2d9d s SER 5 CO 0.11 0.17 0.61 -0.94 1.20 0.00 0.00 173.24 174.39 2d9d s SER 6 N -0.61 -0.73 -0.12 5.45 1.04 -1.26 -5.15 113.70 112.31 2d9d s SER 6 Ca 0.06 1.28 -0.33 0.00 0.48 0.00 0.00 55.95 57.44 2d9d s SER 6 Cb -0.07 1.22 0.13 0.00 0.10 0.00 0.00 66.02 67.39 2d9d s SER 6 CO -0.00 -0.22 1.13 -0.83 0.98 0.00 0.00 173.24 174.30 2d9d s GLY 7 N 1.02 -0.34 -0.18 7.32 0.00 -1.26 -5.04 107.32 108.84 2d9d s GLY 7 Ca -0.06 1.32 -0.17 0.00 0.00 0.00 0.00 44.72 45.82 2d9d s GLY 7 CO -0.09 0.43 0.13 0.23 0.00 0.00 0.00 173.10 173.79 2d9d h SER 8 N 2.00 0.00 -0.14 1.64 0.87 -2.02 -3.14 113.55 112.76 2d9d h SER 8 Ca -0.15 -0.37 -0.02 0.00 -1.23 0.00 0.00 61.79 60.03 2d9d h SER 8 Cb 1.19 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.14 2d9d h SER 8 CO 0.25 1.17 0.03 0.40 -0.53 0.00 0.00 176.83 178.14 2d9d h ILE 9 N -1.00 1.21 -0.93 2.23 1.08 -1.98 -0.67 117.51 117.45 2d9d h ILE 9 Ca -0.19 -0.68 0.01 0.00 -0.39 0.00 0.00 64.86 63.61 2d9d h ILE 9 Cb 0.96 1.40 -0.05 0.00 -3.07 0.00 0.00 36.82 36.07 2d9d h ILE 9 CO -0.12 0.20 0.61 -0.07 -0.69 0.00 0.00 178.15 178.08 2d9d h LEU 10 N 0.01 1.08 -0.03 1.44 3.38 -1.97 0.19 115.31 119.41 2d9d h LEU 10 Ca 0.04 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2d9d h LEU 10 Cb 0.29 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2d9d h LEU 10 CO 0.00 0.80 0.00 0.50 0.09 0.00 0.00 178.44 179.83 2d9d h LYS 11 N 1.27 0.06 -0.70 1.13 3.64 -1.48 -3.11 116.57 117.39 2d9d h LYS 11 Ca 0.34 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.66 2d9d h LYS 11 Cb -0.13 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 2d9d h LYS 11 CO -0.07 0.34 0.26 0.82 -2.27 0.00 0.00 179.45 178.53 2d9d h ILE 12 N -0.23 1.24 -0.29 2.00 2.04 -0.89 -3.18 117.51 118.22 2d9d h ILE 12 Ca 0.01 -0.79 0.04 0.00 1.00 0.00 0.00 64.86 65.11 2d9d h ILE 12 Cb 0.31 0.43 -0.06 0.00 -0.74 0.00 0.00 36.82 36.76 2d9d h ILE 12 CO 0.00 0.32 -0.41 -0.33 0.00 0.00 0.00 178.15 177.73 2d9d h GLU 13 N 1.02 -0.29 -0.58 2.37 5.08 -0.56 -1.99 114.58 119.64 2d9d h GLU 13 Ca 0.23 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.70 2d9d h GLU 13 Cb 0.23 0.07 -0.11 0.00 0.50 0.00 0.00 28.75 29.44 2d9d h GLU 13 CO -0.02 -0.19 -0.44 0.87 -1.00 0.00 0.00 179.01 178.24 2d9d h LYS 14 N -0.30 -0.22 -0.79 2.33 1.57 -1.53 0.24 116.57 117.87 2d9d h LYS 14 Ca 0.05 0.01 0.33 0.00 -1.87 0.00 0.00 60.65 59.17 2d9d h LYS 14 Cb 0.44 0.05 -0.14 0.00 0.08 0.00 0.00 32.23 32.66 2d9d h LYS 14 CO -0.43 -0.15 0.41 0.28 -0.57 0.00 0.00 179.45 178.99 2d9d n VAL 15 N -5.40 -0.33 -0.09 0.50 0.31 -0.76 -0.44 118.33 112.11 2d9d n VAL 15 Ca 0.02 1.60 -0.17 0.00 -0.01 0.00 0.00 64.34 65.78 2d9d n VAL 15 Cb 0.35 -2.59 -0.10 0.00 -0.91 0.00 0.00 33.84 30.59 2d9d n VAL 15 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2d9d h LEU 16 N 0.00 0.00 -0.91 7.52 3.38 -0.53 -3.19 115.31 121.57 2d9d h LEU 16 Ca 0.66 -0.49 0.15 0.00 0.09 0.00 0.00 57.88 58.29 2d9d h LEU 16 Cb 1.74 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 42.34 2d9d h LEU 16 CO -0.61 1.27 -0.34 1.17 0.09 0.00 0.00 178.44 180.01 2d9d n LYS 17 N -4.50 -0.20 -0.02 1.13 4.81 0.47 -0.16 118.16 119.69 2d9d n LYS 17 Ca -0.24 1.41 -0.12 0.00 -0.87 0.00 0.00 58.31 58.49 2d9d n LYS 17 Cb 0.56 -2.09 -0.08 0.00 0.02 0.00 0.00 35.03 33.44 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 0.13 -1.00 1.64 9.65 -1.32 -2.73 114.38 120.75 2d9d h ARG 18 Ca 0.33 -0.04 0.33 0.00 -1.10 0.00 0.00 59.98 59.50 2d9d h ARG 18 Cb 0.56 -0.01 -0.15 0.00 -1.39 0.00 0.00 29.97 28.98 2d9d h ARG 18 CO -0.91 0.40 0.56 1.98 2.80 0.00 0.00 179.97 184.80 2d9d h MET 19 N -0.16 0.29 0.25 0.20 4.05 -0.54 -0.08 114.93 118.94 2d9d h MET 19 Ca 0.02 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 2d9d h MET 19 Cb 0.35 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.08 2d9d h MET 19 CO 0.00 0.19 -0.12 0.00 0.23 0.00 0.00 176.91 177.22 2d9d h ARG 20 N 0.30 -0.32 -0.16 0.39 3.08 -0.95 -2.99 114.38 113.73 2d9d h ARG 20 Ca 0.74 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.84 2d9d h ARG 20 Cb 1.70 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 31.76 2d9d h ARG 20 CO -0.62 0.04 -0.45 0.93 -1.07 0.00 0.00 179.97 178.80 2d9d h GLU 21 N -0.86 -0.43 -0.85 0.04 5.08 -0.77 -1.05 114.58 115.73 2d9d h GLU 21 Ca -0.03 0.03 0.21 0.00 -1.00 0.00 0.00 59.36 58.57 2d9d h GLU 21 Cb 0.51 0.10 -0.15 0.00 0.50 0.00 0.00 28.75 29.71 2d9d h GLU 21 CO 0.06 -0.29 0.06 0.82 -1.00 0.00 0.00 179.01 178.66 2d9d h ILE 22 N -0.45 0.25 0.19 3.13 2.04 -1.25 -1.56 117.51 119.86 2d9d h ILE 22 Ca 0.03 -0.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 2d9d h ILE 22 Cb 0.55 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 2d9d h ILE 22 CO -0.39 0.02 -0.32 0.50 0.00 0.00 0.00 178.15 177.96 2d9d h LYS 23 N 0.10 -0.52 -0.61 2.37 3.64 -1.05 -0.02 116.57 120.48 2d9d h LYS 23 Ca 0.49 0.04 0.18 0.00 -1.27 0.00 0.00 60.65 60.09 2d9d h LYS 23 Cb 0.94 0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.86 2d9d h LYS 23 CO -0.74 -0.35 0.80 -0.97 -2.27 0.00 0.00 179.45 175.93 2d9d h ASN 24 N -0.54 0.00 0.58 4.20 -1.24 -0.61 1.11 115.58 119.08 2d9d h ASN 24 Ca -0.02 0.00 -0.28 0.00 0.71 0.00 0.00 56.30 56.71 2d9d h ASN 24 Cb 0.50 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.56 2d9d h ASN 24 CO -0.11 0.00 -1.28 -0.08 -1.29 0.00 0.00 177.43 174.67 2d9d h GLU 25 N 0.00 0.30 0.15 6.67 4.57 -0.47 -2.64 114.58 123.17 2d9d h GLU 25 Ca 0.29 -0.52 -0.29 0.00 -1.18 0.00 0.00 59.36 57.66 2d9d h GLU 25 Cb 1.89 0.19 0.02 0.00 -0.16 0.00 0.00 28.75 30.69 2d9d h GLU 25 CO -0.00 1.24 -1.29 1.25 -1.18 0.00 0.00 179.01 179.04 2d9d h LEU 26 N 0.08 0.67 -0.41 1.64 5.85 0.25 -2.03 115.31 121.37 2d9d h LEU 26 Ca -0.15 -0.67 -0.11 0.00 0.84 0.00 0.00 57.88 57.78 2d9d h LEU 26 Cb 2.00 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.80 2d9d h LEU 26 CO 0.21 1.51 -0.17 -0.07 -0.34 0.00 0.00 178.44 179.58 2d9d h LEU 27 N 0.16 0.86 -3.83 2.25 3.38 -0.86 -3.14 115.31 114.13 2d9d h LEU 27 Ca -0.18 -0.39 -0.55 0.00 0.09 0.00 0.00 57.88 56.85 2d9d h LEU 27 Cb 1.98 -0.24 -0.30 0.00 0.09 0.00 0.00 40.66 42.19 2d9d h LEU 27 CO 0.23 1.06 0.23 0.00 0.09 0.00 0.00 178.44 180.04 2d9d n GLN 28 N -4.25 2.78 -3.38 1.13 1.13 -1.00 -5.01 117.38 108.79 2d9d n GLN 28 Ca -0.01 -3.50 -0.28 0.00 -1.94 0.00 0.00 57.00 51.27 2d9d n GLN 28 Cb 0.41 -2.20 -0.03 0.00 0.11 0.00 0.00 30.24 28.53 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 -3.62 3.66 -0.14 -1.58 0.00 -0.76 -4.91 121.76 114.40 2d9d s ALA 29 Ca 0.57 -0.64 -0.28 0.00 0.00 0.00 0.00 51.96 51.62 2d9d s ALA 29 Cb 0.46 -2.24 -0.25 0.00 0.00 0.00 0.00 23.12 21.10 2d9d s ALA 29 CO 0.02 0.22 0.71 0.37 0.00 0.00 0.00 175.76 177.08 2d9d h GLN 30 N 1.58 0.00 -2.74 0.00 4.15 -1.91 -3.40 115.11 112.78 2d9d h GLN 30 Ca -0.48 0.00 -0.62 0.00 0.77 0.00 0.00 58.65 58.32 2d9d h GLN 30 Cb 1.19 0.00 -0.41 0.00 0.21 0.00 0.00 27.48 28.47 2d9d h GLN 30 CO 0.66 0.96 -0.50 0.27 -1.93 0.00 0.00 178.83 178.29 2d9d n ASN 31 N -4.61 3.53 0.00 -0.69 0.23 -1.26 -4.89 115.26 107.57 2d9d n ASN 31 Ca -0.11 -3.31 0.08 0.00 -0.53 0.00 0.00 54.58 50.71 2d9d n ASN 31 Cb 0.47 -0.76 0.46 0.00 -2.08 0.00 0.00 39.78 37.87 2d9d n ASN 31 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 2d9d n PRO 32 N 1.52 0.48 -0.03 -0.53 -0.04 -1.26 -3.20 135.00 131.93 2d9d n PRO 32 Ca 0.24 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.58 2d9d n PRO 32 Cb 0.37 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 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 0.17 0.37 3.54 4.64 -1.98 -2.80 113.55 117.50 2d9d h SER 33 Ca 0.00 -0.44 -0.32 0.00 -0.47 0.00 0.00 61.79 60.56 2d9d h SER 33 Cb 0.00 -0.05 0.01 0.00 -0.31 0.00 0.00 62.40 62.06 2d9d h SER 33 CO 0.00 0.57 -1.51 1.05 -0.87 0.00 0.00 176.83 176.07 2d9d h GLU 34 N -0.22 0.38 -1.00 4.77 4.11 -2.00 -3.32 114.58 117.30 2d9d h GLU 34 Ca 0.02 -0.64 0.16 0.00 0.07 0.00 0.00 59.36 58.96 2d9d h GLU 34 Cb 0.51 0.24 -0.09 0.00 0.50 0.00 0.00 28.75 29.91 2d9d h GLU 34 CO 0.01 1.28 0.62 -0.07 0.07 0.00 0.00 179.01 180.92 2d9d h LEU 35 N 0.10 0.84 -0.79 3.06 3.38 -1.64 -1.91 115.31 118.35 2d9d h LEU 35 Ca -0.25 0.07 0.26 0.00 0.09 0.00 0.00 57.88 58.05 2d9d h LEU 35 Cb 2.08 -0.09 -0.15 0.00 0.09 0.00 0.00 40.66 42.59 2d9d h LEU 35 CO 0.21 0.38 0.17 -1.22 0.09 0.00 0.00 178.44 178.06 2d9d n TYR 36 N -4.68 0.66 -0.06 1.13 4.01 -1.06 -0.48 117.16 116.68 2d9d n TYR 36 Ca 0.21 0.95 -0.05 0.00 -0.16 0.00 0.00 57.90 58.84 2d9d n TYR 36 Cb 0.47 -1.19 -0.05 0.00 -0.31 0.00 0.00 39.34 38.26 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 -0.02 7.72 3.38 -1.59 -3.18 115.31 121.62 2d9d h LEU 37 Ca 0.55 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2d9d h LEU 37 Cb 1.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 2d9d h LEU 37 CO -0.69 0.70 -0.02 -1.28 0.09 0.00 0.00 178.44 177.23 2d9d h SER 38 N -1.00 -0.08 -0.11 -0.43 0.87 -0.81 0.75 113.55 112.74 2d9d h SER 38 Ca -0.01 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 2d9d h SER 38 Cb 0.39 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 2d9d h SER 38 CO -0.00 -0.02 -0.11 0.28 -0.53 0.00 0.00 176.83 176.45 2d9d h SER 39 N -0.01 -0.38 -0.88 6.23 0.02 -0.99 -0.89 113.55 116.65 2d9d h SER 39 Ca 0.00 0.05 0.13 0.00 -0.84 0.00 0.00 61.79 61.14 2d9d h SER 39 Cb 0.02 0.16 -0.14 0.00 0.14 0.00 0.00 62.40 62.58 2d9d h SER 39 CO -0.02 -0.07 -0.36 1.17 -1.14 0.00 0.00 176.83 176.41 2d9d n LYS 40 N -3.28 -0.22 -0.10 3.45 4.81 -1.13 0.38 118.16 122.08 2d9d n LYS 40 Ca -0.00 1.36 -0.06 0.00 -0.87 0.00 0.00 58.31 58.73 2d9d n LYS 40 Cb 0.06 -2.01 0.00 0.00 0.02 0.00 0.00 35.03 33.10 2d9d n LYS 40 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 2d9d h THR 41 N 0.00 0.50 0.14 3.15 2.02 0.22 -2.38 112.91 116.56 2d9d h THR 41 Ca 0.30 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.49 2d9d h THR 41 Cb 0.52 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 2d9d h THR 41 CO -0.87 0.00 -0.23 -0.08 0.37 0.00 0.00 175.52 174.71 2d9d h GLU 42 N -0.10 -0.43 -0.61 6.66 4.81 0.12 -3.04 114.58 121.99 2d9d h GLU 42 Ca 0.18 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.49 2d9d h GLU 42 Cb 0.37 0.10 -0.07 0.00 0.63 0.00 0.00 28.75 29.77 2d9d h GLU 42 CO -0.41 -0.28 -0.36 1.28 -0.73 0.00 0.00 179.01 178.50 2d9d n LEU 43 N -5.35 -0.65 -0.33 1.64 4.77 -0.12 0.78 117.00 117.74 2d9d n LEU 43 Ca -0.07 1.32 0.14 0.00 -0.03 0.00 0.00 56.01 57.37 2d9d n LEU 43 Cb 0.26 -0.25 0.28 0.00 -2.33 0.00 0.00 43.42 41.38 2d9d n LEU 43 CO 0.27 -1.00 0.76 0.00 -1.33 0.00 0.00 177.39 176.08 2d9d n GLN 44 N -4.46 -0.07 -0.16 3.23 6.02 -1.12 -0.05 117.38 120.77 2d9d n GLN 44 Ca 0.01 1.41 -0.06 0.00 -0.01 0.00 0.00 57.00 58.35 2d9d n GLN 44 Cb 0.16 -2.24 -0.00 0.00 1.02 0.00 0.00 30.24 29.17 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 -0.15 0.13 1.08 0.00 0.32 -2.27 103.07 102.18 2d9d h GLY 45 Ca 0.58 0.41 0.02 0.00 0.00 0.00 0.00 47.33 48.34 2d9d h GLY 45 CO -0.88 -0.21 -0.51 1.41 0.00 0.00 0.00 176.54 176.35 2d9d h LEU 46 N -0.20 -1.55 -0.75 3.11 3.38 -0.43 -2.02 115.31 116.86 2d9d h LEU 46 Ca 0.21 0.17 0.17 0.00 0.09 0.00 0.00 57.88 58.51 2d9d h LEU 46 Cb 0.54 0.58 -0.14 0.00 0.09 0.00 0.00 40.66 41.72 2d9d h LEU 46 CO -0.61 -0.54 -0.13 -0.38 0.09 0.00 0.00 178.44 176.86 2d9d n ILE 47 N -5.48 -0.31 -0.31 1.22 5.41 -0.87 0.10 119.36 119.12 2d9d n ILE 47 Ca -0.08 1.70 0.01 0.00 1.00 0.00 0.00 62.75 65.38 2d9d n ILE 47 Cb 0.41 -2.39 0.06 0.00 -0.71 0.00 0.00 39.64 37.01 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 -1.45 -1.56 0.31 7.39 0.00 -0.76 0.12 105.19 109.24 2d9d n GLY 48 Ca 0.14 0.90 0.13 0.00 0.00 0.00 0.00 46.02 47.18 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 0.19 -0.33 1.61 4.20 -0.47 0.13 115.11 120.45 2d9d h GLN 49 Ca 0.32 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 59.08 2d9d h GLN 49 Cb 0.52 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.20 2d9d h GLN 49 CO -0.82 0.13 -0.05 -0.07 -0.67 0.00 0.00 178.83 177.35 2d9d h LEU 50 N 0.20 -0.25 -0.97 1.46 3.38 0.84 -1.51 115.31 118.47 2d9d h LEU 50 Ca 0.56 0.09 0.37 0.00 0.09 0.00 0.00 57.88 58.99 2d9d h LEU 50 Cb 1.12 0.18 -0.18 0.00 0.09 0.00 0.00 40.66 41.88 2d9d h LEU 50 CO -0.66 -0.08 0.39 0.47 0.09 0.00 0.00 178.44 178.64 2d9d n ASP 51 N -5.24 0.22 0.07 -0.43 9.92 0.46 0.52 116.55 122.06 2d9d n ASP 51 Ca 0.01 1.62 -0.13 0.00 -0.53 0.00 0.00 54.79 55.76 2d9d n ASP 51 Cb 0.18 -0.74 -0.08 0.00 -0.64 0.00 0.00 41.12 39.84 2d9d n ASP 51 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2d9d h GLU 52 N 0.00 -0.14 -5.87 -1.24 3.07 -1.30 -3.41 114.58 105.70 2d9d h GLU 52 Ca 0.76 0.01 -0.54 0.00 -0.50 0.00 0.00 59.36 59.10 2d9d h GLU 52 Cb 1.93 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 29.87 2d9d h GLU 52 CO -0.79 0.12 1.53 0.08 -1.40 0.00 0.00 179.01 178.54 2d9d s VAL 53 N -5.19 3.05 0.15 3.13 1.01 0.18 -4.95 120.40 117.79 2d9d s VAL 53 Ca -0.15 0.05 -0.17 0.00 0.00 0.00 0.00 61.98 61.71 2d9d s VAL 53 Cb 0.04 -3.09 -0.07 0.00 0.00 0.00 0.00 36.38 33.25 2d9d s VAL 53 CO 0.64 -0.07 0.60 -0.44 0.00 0.00 0.00 175.10 175.83 2d9d s SER 54 N 9.63 6.94 0.15 3.32 0.01 -1.26 -4.95 113.70 127.55 2d9d s SER 54 Ca 0.97 1.21 -0.34 0.00 1.31 0.00 0.00 55.95 59.10 2d9d s SER 54 Cb -0.25 -2.34 -0.14 0.00 0.21 0.00 0.00 66.02 63.50 2d9d s SER 54 CO 0.31 0.12 1.57 0.18 0.41 0.00 0.00 173.24 175.83 2d9d n LEU 55 N 0.97 3.00 0.00 2.44 4.32 -1.26 -4.98 117.00 121.49 2d9d n LEU 55 Ca -0.05 1.08 -0.17 0.00 -0.02 0.00 0.00 56.01 56.85 2d9d n LEU 55 Cb 0.51 -1.41 0.00 0.00 -1.62 0.00 0.00 43.42 40.91 2d9d n LEU 55 CO 0.42 -0.34 0.06 -0.62 -1.22 0.00 0.00 177.39 175.70 2d9d n GLU 56 N 3.43 0.95 -0.11 3.23 -0.58 -1.26 -5.01 120.64 121.28 2d9d n GLU 56 Ca 0.17 -2.21 -0.12 0.00 -0.42 0.00 0.00 57.16 54.58 2d9d n GLU 56 Cb 0.28 0.21 -0.03 0.00 -0.57 0.00 0.00 31.44 31.33 2d9d n GLU 56 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2d9d h LYS 57 N 0.00 0.75 -6.78 3.49 3.64 -2.00 -3.41 116.57 112.27 2d9d h LYS 57 Ca -0.22 -0.36 -0.57 0.00 -1.27 0.00 0.00 60.65 58.23 2d9d h LYS 57 Cb 0.82 -0.01 0.12 0.00 -0.41 0.00 0.00 32.23 32.76 2d9d h LYS 57 CO 0.35 0.98 0.47 0.09 -2.27 0.00 0.00 179.45 179.06 2d9d n ASN 58 N -4.26 2.52 -0.12 4.20 3.02 -1.26 -4.91 115.26 114.44 2d9d n ASN 58 Ca -0.03 1.14 -0.13 0.00 -0.03 0.00 0.00 54.58 55.53 2d9d n ASN 58 Cb 0.44 -1.48 -0.02 0.00 -0.61 0.00 0.00 39.78 38.11 2d9d n ASN 58 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2d9d h PRO 59 N 2.23 0.94 -0.60 3.52 0.13 -1.99 -2.56 132.00 133.67 2d9d h PRO 59 Ca -0.47 -0.50 0.05 0.00 -0.87 0.00 0.00 66.00 64.22 2d9d h PRO 59 Cb 1.29 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.39 2d9d h PRO 59 CO 0.61 1.16 0.32 0.00 -0.23 0.00 0.00 178.00 179.85 2d9d h ILE 61 N 0.61 1.30 -0.64 0.00 2.04 -1.92 0.48 117.51 119.38 2d9d h ILE 61 Ca 0.27 -1.09 -0.04 0.00 1.00 0.00 0.00 64.86 64.99 2d9d h ILE 61 Cb 0.16 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.80 2d9d h ILE 61 CO -0.17 0.33 0.23 -0.09 0.00 0.00 0.00 178.15 178.45 2d9d h ARG 62 N 0.13 0.94 0.06 2.37 2.43 -1.08 -2.71 114.38 116.52 2d9d h ARG 62 Ca 0.05 -0.17 -0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2d9d h ARG 62 Cb 0.54 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2d9d h ARG 62 CO 0.03 0.79 -0.03 1.49 -1.51 0.00 0.00 179.97 180.74 2d9d h GLU 63 N 0.92 -0.07 -0.38 0.20 4.81 -0.22 -3.26 114.58 116.58 2d9d h GLU 63 Ca 0.21 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.48 2d9d h GLU 63 Cb 0.21 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.57 2d9d h GLU 63 CO -0.01 -0.05 -0.23 0.00 -0.73 0.00 0.00 179.01 177.99 2d9d n ALA 64 N -2.67 -0.24 -0.13 2.92 0.00 0.17 -0.57 120.51 119.98 2d9d n ALA 64 Ca -0.01 0.32 -0.05 0.00 0.00 0.00 0.00 53.44 53.70 2d9d n ALA 64 Cb 0.03 0.19 -0.04 0.00 0.00 0.00 0.00 19.45 19.62 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 -0.15 0.00 2.43 -1.67 0.17 114.38 115.09 2d9d h ARG 65 Ca 0.06 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.25 2d9d h ARG 65 Cb 0.16 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 2d9d h ARG 65 CO -0.36 -0.05 -0.22 -0.09 -1.51 0.00 0.00 179.97 177.75 2d9d h ARG 66 N -0.07 -0.15 -0.93 0.20 2.43 -1.30 -0.70 114.38 113.85 2d9d h ARG 66 Ca 0.05 0.01 0.23 0.00 -0.81 0.00 0.00 59.98 59.46 2d9d h ARG 66 Cb 0.21 0.03 -0.17 0.00 -0.42 0.00 0.00 29.97 29.62 2d9d h ARG 66 CO -0.34 -0.10 -0.04 -0.09 -1.51 0.00 0.00 179.97 177.88 2d9d h ARG 67 N -0.16 0.03 -0.09 0.20 2.43 -0.38 0.21 114.38 116.62 2d9d h ARG 67 Ca 0.03 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.23 2d9d h ARG 67 Cb 0.23 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.73 2d9d h ARG 67 CO -0.23 0.02 -0.19 0.00 -1.51 0.00 0.00 179.97 178.06 2d9d h ALA 68 N 1.92 -0.17 -0.35 2.80 0.00 0.74 0.11 119.26 124.31 2d9d h ALA 68 Ca 0.52 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.54 2d9d h ALA 68 Cb 0.99 0.36 -0.09 0.00 0.00 0.00 0.00 17.79 19.06 2d9d h ALA 68 CO -0.88 -0.66 -0.38 0.28 0.00 0.00 0.00 179.25 177.61 2d9d h VAL 69 N -0.26 0.17 0.74 0.00 2.07 0.56 0.44 116.25 119.98 2d9d h VAL 69 Ca 0.08 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.57 2d9d h VAL 69 Cb 0.38 0.17 0.01 0.00 -1.52 0.00 0.00 31.29 30.34 2d9d h VAL 69 CO -0.24 0.00 -0.36 0.40 0.02 0.00 0.00 177.57 177.39 2d9d h ILE 70 N -0.32 0.27 -0.83 4.57 2.04 -1.14 0.19 117.51 122.29 2d9d h ILE 70 Ca 0.14 -0.01 0.17 0.00 1.00 0.00 0.00 64.86 66.17 2d9d h ILE 70 Cb 0.57 0.27 -0.16 0.00 -0.74 0.00 0.00 36.82 36.77 2d9d h ILE 70 CO -0.52 0.00 -0.17 -0.33 0.00 0.00 0.00 178.15 177.12 2d9d h GLU 71 N -1.00 0.01 -0.08 2.37 4.39 -0.41 0.47 114.58 120.33 2d9d h GLU 71 Ca -0.10 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.58 2d9d h GLU 71 Cb 0.77 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.41 2d9d h GLU 71 CO 0.17 0.01 -0.03 0.28 -1.16 0.00 0.00 179.01 178.27 2d9d h VAL 72 N 0.01 1.31 -0.03 3.13 2.07 -0.76 -2.85 116.25 119.13 2d9d h VAL 72 Ca 0.41 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.93 2d9d h VAL 72 Cb 0.65 1.82 -0.00 0.00 -1.52 0.00 0.00 31.29 32.24 2d9d h VAL 72 CO -0.84 0.28 0.08 1.56 0.02 0.00 0.00 177.57 178.67 2d9d h GLN 73 N -0.19 0.00 -0.75 1.57 1.08 0.13 -1.38 115.11 115.57 2d9d h GLN 73 Ca 0.02 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.19 2d9d h GLN 73 Cb 0.46 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.86 2d9d h GLN 73 CO 0.01 0.00 0.37 1.15 -0.95 0.00 0.00 178.83 179.41 2d9d h THR 74 N 0.00 1.23 0.35 -0.54 2.02 0.10 -2.87 112.91 113.20 2d9d h THR 74 Ca 0.02 -0.65 -0.02 0.00 0.77 0.00 0.00 66.41 66.53 2d9d h THR 74 Cb 0.17 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 2d9d h THR 74 CO -0.00 0.28 -0.17 -0.07 0.37 0.00 0.00 175.52 175.93 2d9d h LEU 75 N 1.06 -0.40 -1.92 2.58 3.38 -1.34 -2.84 115.31 115.82 2d9d h LEU 75 Ca 0.26 -0.13 0.49 0.00 0.09 0.00 0.00 57.88 58.59 2d9d h LEU 75 Cb 0.09 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.87 2d9d h LEU 75 CO -0.03 0.05 1.19 0.40 0.09 0.00 0.00 178.44 180.14 2d9d h ILE 76 N -0.99 0.14 0.04 1.22 2.04 -1.54 0.79 117.51 119.20 2d9d h ILE 76 Ca -0.05 -0.00 -0.19 0.00 1.00 0.00 0.00 64.86 65.62 2d9d h ILE 76 Cb 0.51 0.12 0.02 0.00 -0.74 0.00 0.00 36.82 36.73 2d9d h ILE 76 CO 0.08 0.00 -0.75 0.74 0.00 0.00 0.00 178.15 178.22 2d9d h THR 77 N 0.01 1.42 -0.61 -0.27 2.02 -1.46 -3.23 112.91 110.79 2d9d h THR 77 Ca 0.82 -2.23 0.09 0.00 0.77 0.00 0.00 66.41 65.86 2d9d h THR 77 Cb 3.20 2.72 -0.11 0.00 -1.74 0.00 0.00 68.15 72.22 2d9d h THR 77 CO -0.06 0.65 -0.43 0.22 0.37 0.00 0.00 175.52 176.27 2d9d h TYR 78 N -0.08 -1.26 0.38 3.16 3.20 0.85 -1.31 116.97 121.91 2d9d h TYR 78 Ca -0.11 0.08 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 2d9d h TYR 78 Cb 1.48 0.64 -0.02 0.00 1.54 0.00 0.00 36.73 40.37 2d9d h TYR 78 CO 0.15 -0.42 -0.40 0.82 -1.64 0.00 0.00 178.16 176.67 2d9d h ILE 79 N -0.20 0.00 -0.89 1.81 5.03 -1.65 -2.59 117.51 119.02 2d9d h ILE 79 Ca 0.19 0.00 0.17 0.00 -0.12 0.00 0.00 64.86 65.10 2d9d h ILE 79 Cb 0.56 0.00 -0.17 0.00 -3.03 0.00 0.00 36.82 34.18 2d9d h ILE 79 CO -0.71 0.00 -0.23 -0.67 -0.68 0.00 0.00 178.15 175.86 2d9d n ASP 80 N -4.81 -0.34 0.06 1.72 -0.08 -0.88 0.41 116.55 112.62 2d9d n ASP 80 Ca -0.09 1.53 -0.12 0.00 -1.51 0.00 0.00 54.79 54.60 2d9d n ASP 80 Cb 0.36 -0.45 -0.05 0.00 2.34 0.00 0.00 41.12 43.32 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 -0.90 0.00 -2.67 3.38 -0.90 0.21 115.31 114.43 2d9d h LEU 81 Ca 0.42 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.51 2d9d h LEU 81 Cb 0.64 0.37 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2d9d h LEU 81 CO -0.91 -0.37 0.00 0.29 0.09 0.00 0.00 178.44 177.54 2d9d n LYS 82 N -5.40 0.00 -0.32 1.13 4.01 0.13 -3.89 118.16 113.81 2d9d n LYS 82 Ca -0.05 0.39 0.02 0.00 -0.51 0.00 0.00 58.31 58.17 2d9d n LYS 82 Cb 0.32 -1.13 0.08 0.00 -0.51 0.00 0.00 35.03 33.79 2d9d n LYS 82 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 2d9d n GLU 83 N -1.68 -0.13 -3.36 1.97 0.00 0.16 -4.81 120.64 112.80 2d9d n GLU 83 Ca 0.00 1.32 -0.17 0.00 0.00 0.00 0.00 57.16 58.30 2d9d n GLU 83 Cb 0.00 -1.96 0.08 0.00 0.00 0.00 0.00 31.44 29.56 2d9d n GLU 83 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2d9d n SER 84 N -5.33 -3.37 0.00 4.31 2.88 0.75 -4.98 113.62 107.88 2d9d n SER 84 Ca 0.11 -0.53 0.00 0.00 -1.33 0.00 0.00 58.87 57.12 2d9d n SER 84 Cb 0.39 -4.64 0.00 0.00 -0.75 0.00 0.00 64.21 59.21 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 -1.37 0.66 2.93 0.46 0.00 -1.26 -5.11 105.19 101.50 2d9d n GLY 85 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 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 0.00 -2.82 -3.30 1.61 -0.04 -1.26 -5.10 135.00 124.09 2d9d n PRO 86 Ca 0.00 -1.46 0.03 0.00 -0.04 0.00 0.00 63.50 62.03 2d9d n PRO 86 Cb 0.00 -1.37 -0.04 0.00 -0.04 0.00 0.00 33.50 32.05 2d9d n PRO 86 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d9d s SER 87 N -3.96 -0.44 -0.05 3.54 0.15 -1.26 -4.97 113.70 106.71 2d9d s SER 87 Ca 0.59 0.54 -0.30 0.00 0.70 0.00 0.00 55.95 57.48 2d9d s SER 87 Cb -0.06 1.48 -0.03 0.00 -1.71 0.00 0.00 66.02 65.70 2d9d s SER 87 CO 0.46 -0.08 1.10 -0.55 1.20 0.00 0.00 173.24 175.36 2d9d s SER 88 N 2.44 7.17 0.00 5.45 0.15 -1.26 -5.28 113.70 122.36 2d9d s SER 88 Ca -0.01 1.72 0.00 0.00 0.70 0.00 0.00 55.95 58.35 2d9d s SER 88 Cb -0.06 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2d9d s SER 88 CO -0.16 -0.48 0.13 0.61 1.20 0.00 0.00 173.24 174.54