#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ocp n GLU 2 N 0.00 -1.65 -0.06 2.12 2.13 -1.26 -4.85 120.64 117.08 1ocp n GLU 2 Ca 0.00 1.05 -0.08 0.00 0.66 0.00 0.00 57.16 58.79 1ocp n GLU 2 Cb 0.00 -5.67 -0.15 0.00 0.27 0.00 0.00 31.44 25.89 1ocp n GLU 2 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1ocp n THR 3 N -3.74 1.46 -2.92 6.31 -1.04 -1.26 -4.83 114.28 108.26 1ocp n THR 3 Ca -0.24 -0.82 -0.42 0.00 -2.04 0.00 0.00 64.05 60.53 1ocp n THR 3 Cb 0.69 -0.74 -0.05 0.00 -1.82 0.00 0.00 70.33 68.42 1ocp n THR 3 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1ocp s LEU 4 N -5.77 4.08 -0.21 -4.42 0.20 -1.26 -4.90 118.68 106.40 1ocp s LEU 4 Ca -0.07 0.73 0.02 0.00 0.69 0.00 0.00 54.13 55.49 1ocp s LEU 4 Cb 0.07 -3.12 -0.20 0.00 -0.43 0.00 0.00 46.19 42.51 1ocp s LEU 4 CO 0.83 -0.62 -0.00 0.52 -0.29 0.00 0.00 176.35 176.79 1ocp n VAL 5 N 5.52 1.57 -2.51 1.68 0.31 -1.26 -4.48 118.33 119.16 1ocp n VAL 5 Ca 0.04 -0.63 -0.41 0.00 -0.01 0.00 0.00 64.34 63.34 1ocp n VAL 5 Cb 0.48 -1.40 0.02 0.00 -0.91 0.00 0.00 33.84 32.03 1ocp n VAL 5 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ocp n GLN 6 N -3.26 5.19 -1.98 5.55 10.64 -1.26 -4.99 117.38 127.28 1ocp n GLN 6 Ca -0.40 -4.44 -0.43 0.00 -1.83 0.00 0.00 57.00 49.90 1ocp n GLN 6 Cb 1.02 -2.48 -0.03 0.00 -0.86 0.00 0.00 30.24 27.90 1ocp n GLN 6 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ocp s ALA 7 N -3.91 3.08 -0.09 2.61 0.00 -1.26 -4.86 121.76 117.32 1ocp s ALA 7 Ca 0.42 0.49 -0.23 0.00 0.00 0.00 0.00 51.96 52.64 1ocp s ALA 7 Cb 0.20 -3.94 -0.29 0.00 0.00 0.00 0.00 23.12 19.10 1ocp s ALA 7 CO -0.14 -2.28 0.79 0.00 0.00 0.00 0.00 175.76 174.13 1ocp h ARG 8 N 12.04 0.19 0.00 0.00 2.47 -1.99 -3.44 114.38 123.65 1ocp h ARG 8 Ca -0.36 -0.32 -0.22 0.00 -1.26 0.00 0.00 59.98 57.83 1ocp h ARG 8 Cb 1.18 0.12 -0.14 0.00 -1.65 0.00 0.00 29.97 29.47 1ocp h ARG 8 CO 1.00 1.15 -0.47 1.17 0.56 0.00 0.00 179.97 183.39 1ocp n LYS 9 N -4.27 0.78 -3.05 0.04 4.81 -1.26 -5.05 118.16 110.16 1ocp n LYS 9 Ca -0.15 -1.71 -0.17 0.00 -0.87 0.00 0.00 58.31 55.42 1ocp n LYS 9 Cb 0.72 -1.39 -0.03 0.00 0.02 0.00 0.00 35.03 34.35 1ocp n LYS 9 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1ocp n ARG 10 N 1.54 0.55 -4.50 1.64 1.74 -1.26 -5.12 116.66 111.24 1ocp n ARG 10 Ca 0.08 -2.60 -0.30 0.00 -0.77 0.00 0.00 57.85 54.26 1ocp n ARG 10 Cb 0.64 -1.45 -0.12 0.00 -1.02 0.00 0.00 32.46 30.51 1ocp n ARG 10 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1ocp s LYS 11 N 0.03 1.83 -0.56 5.56 1.02 -1.26 -5.03 119.74 121.33 1ocp s LYS 11 Ca 0.33 -1.13 0.01 0.00 0.02 0.00 0.00 55.97 55.20 1ocp s LYS 11 Cb 0.11 -2.10 0.55 0.00 -0.52 0.00 0.00 37.83 35.88 1ocp s LYS 11 CO -0.15 0.50 1.97 2.89 -0.92 0.00 0.00 175.35 179.64 1ocp n ARG 12 N 1.18 2.48 0.13 1.68 1.85 -1.26 -4.43 116.66 118.29 1ocp n ARG 12 Ca -0.16 -3.16 0.04 0.00 -1.00 0.00 0.00 57.85 53.56 1ocp n ARG 12 Cb 0.52 -2.23 0.02 0.00 -1.05 0.00 0.00 32.46 29.73 1ocp n ARG 12 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ocp h THR 13 N 1.01 0.68 -2.07 8.89 1.03 -1.97 -3.48 112.91 117.01 1ocp h THR 13 Ca 0.62 -2.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.01 1ocp h THR 13 Cb 1.80 2.29 0.00 0.00 -1.07 0.00 0.00 68.15 71.17 1ocp h THR 13 CO 1.35 0.39 0.00 -1.54 -0.01 0.00 0.00 175.52 175.71 1ocp n SER 14 N -3.14 0.65 -4.56 0.00 3.41 -1.26 -5.01 113.62 103.71 1ocp n SER 14 Ca 0.01 -0.42 -0.41 0.00 -0.26 0.00 0.00 58.87 57.79 1ocp n SER 14 Cb 0.72 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.64 1ocp n SER 14 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1ocp s ILE 15 N -0.91 3.86 0.55 -1.33 -1.09 -1.26 -4.94 121.20 116.08 1ocp s ILE 15 Ca 0.00 -0.52 -0.08 0.00 -2.23 0.00 0.00 60.65 57.82 1ocp s ILE 15 Cb 0.00 -4.99 -0.03 0.00 -1.58 0.00 0.00 42.46 35.86 1ocp s ILE 15 CO 0.00 -1.88 0.90 -0.70 -1.23 0.00 0.00 174.94 172.02 1ocp s GLU 16 N 5.20 3.46 0.49 2.79 2.12 -1.26 -4.91 118.70 126.59 1ocp s GLU 16 Ca 0.45 0.38 0.16 0.00 0.36 0.00 0.00 54.97 56.32 1ocp s GLU 16 Cb -0.02 -2.25 1.18 0.00 0.26 0.00 0.00 34.13 33.30 1ocp s GLU 16 CO -0.05 -0.43 2.08 -0.97 -0.54 0.00 0.00 175.26 175.36 1ocp h ASN 17 N -0.05 0.00 1.17 -1.70 -0.73 -1.96 -0.74 115.58 111.58 1ocp h ASN 17 Ca -0.46 0.00 -0.12 0.00 1.87 0.00 0.00 56.30 57.59 1ocp h ASN 17 Cb 1.21 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 39.78 1ocp h ASN 17 CO 0.62 0.09 -0.58 0.08 -0.37 0.00 0.00 177.43 177.26 1ocp h ARG 18 N 0.00 0.00 -0.09 6.67 -0.00 -1.96 -2.76 114.38 116.23 1ocp h ARG 18 Ca -0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 59.98 59.92 1ocp h ARG 18 Cb 0.16 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 30.13 1ocp h ARG 18 CO 0.01 0.58 -0.16 -0.24 -0.00 0.00 0.00 179.97 180.16 1ocp h VAL 19 N 0.00 1.39 -0.37 0.08 3.04 -1.51 0.14 116.25 119.02 1ocp h VAL 19 Ca -0.01 -1.42 -0.02 0.00 -1.01 0.00 0.00 66.70 64.25 1ocp h VAL 19 Cb 1.32 2.09 -0.02 0.00 -2.01 0.00 0.00 31.29 32.68 1ocp h VAL 19 CO 0.08 0.40 0.16 0.03 -1.01 0.00 0.00 177.57 177.23 1ocp h ARG 20 N -0.17 0.55 -0.00 4.17 3.08 -1.49 -1.36 114.38 119.16 1ocp h ARG 20 Ca 0.01 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1ocp h ARG 20 Cb 0.73 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.69 1ocp h ARG 20 CO 0.04 0.51 -0.01 0.91 -1.07 0.00 0.00 179.97 180.35 1ocp n TRP 21 N -4.69 0.00 0.13 3.04 5.03 -1.04 -2.11 117.44 117.80 1ocp n TRP 21 Ca -0.01 0.00 -0.24 0.00 3.03 0.00 0.00 57.50 60.28 1ocp n TRP 21 Cb 0.13 -0.05 -0.16 0.00 -1.03 0.00 0.00 31.31 30.20 1ocp n TRP 21 CO 0.00 0.00 0.00 0.77 -0.03 0.00 0.00 177.69 178.43 1ocp h SER 22 N 0.23 0.80 -0.64 -0.99 0.02 0.33 -2.97 113.55 110.33 1ocp h SER 22 Ca 0.00 -0.92 0.08 0.00 -0.84 0.00 0.00 61.79 60.11 1ocp h SER 22 Cb 0.10 -0.26 -0.07 0.00 0.14 0.00 0.00 62.40 62.32 1ocp h SER 22 CO 0.00 1.74 0.29 -0.07 -1.14 0.00 0.00 176.83 177.65 1ocp h LEU 23 N 0.14 0.36 -0.08 5.07 3.38 -0.75 -2.41 115.31 121.01 1ocp h LEU 23 Ca -0.28 0.06 0.04 0.00 0.09 0.00 0.00 57.88 57.79 1ocp h LEU 23 Cb 2.16 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 42.86 1ocp h LEU 23 CO 0.25 0.21 -0.28 -0.08 0.09 0.00 0.00 178.44 178.63 1ocp h GLU 24 N 0.51 -0.37 -0.13 1.13 4.81 -1.43 -0.37 114.58 118.73 1ocp h GLU 24 Ca 0.31 0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.61 1ocp h GLU 24 Cb 0.33 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1ocp h GLU 24 CO -0.26 -0.25 0.11 0.00 -0.73 0.00 0.00 179.01 177.88 1ocp h THR 25 N -0.39 0.73 0.00 0.32 1.03 -1.28 0.06 112.91 113.39 1ocp h THR 25 Ca 0.08 0.00 -0.19 0.00 -0.01 0.00 0.00 66.41 66.30 1ocp h THR 25 Cb 0.51 0.92 -0.02 0.00 -1.07 0.00 0.00 68.15 68.48 1ocp h THR 25 CO -0.30 0.00 -0.88 0.24 -0.01 0.00 0.00 175.52 174.58 1ocp h MET 26 N 0.00 0.03 -0.00 0.00 2.86 -0.81 -3.25 114.93 113.76 1ocp h MET 26 Ca 0.06 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1ocp h MET 26 Cb 0.29 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1ocp h MET 26 CO -0.00 0.89 -0.53 1.19 1.06 0.00 0.00 176.91 179.52 1ocp n PHE 27 N -3.53 0.00 0.24 -0.22 3.72 -0.20 -4.10 117.46 113.37 1ocp n PHE 27 Ca -0.01 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.44 1ocp n PHE 27 Cb 0.83 -0.19 0.21 0.00 -0.94 0.00 0.00 39.48 39.39 1ocp n PHE 27 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1ocp n LEU 28 N -1.32 3.07 -0.12 4.37 4.77 -0.16 -4.00 117.00 123.60 1ocp n LEU 28 Ca 0.06 -1.55 -0.19 0.00 -0.03 0.00 0.00 56.01 54.30 1ocp n LEU 28 Cb 0.34 -0.47 -0.11 0.00 -2.33 0.00 0.00 43.42 40.86 1ocp n LEU 28 CO 0.34 0.50 -1.31 2.29 -1.33 0.00 0.00 177.39 177.89 1ocp n LYS 29 N 0.51 0.58 -3.87 3.23 2.85 -1.26 -4.99 118.16 115.23 1ocp n LYS 29 Ca 0.15 0.16 -0.12 0.00 -1.05 0.00 0.00 58.31 57.45 1ocp n LYS 29 Cb 0.60 -1.46 -0.13 0.00 -0.65 0.00 0.00 35.03 33.39 1ocp n LYS 29 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ocp n PRO 31 N 2.91 1.69 -3.47 0.00 -0.04 -1.26 -4.48 135.00 130.35 1ocp n PRO 31 Ca -0.13 -0.80 -0.28 0.00 -0.04 0.00 0.00 63.50 62.25 1ocp n PRO 31 Cb 0.59 -1.34 -0.08 0.00 -0.04 0.00 0.00 33.50 32.63 1ocp n PRO 31 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1ocp n LYS 32 N 0.13 2.52 -2.56 0.54 2.85 -1.26 -5.07 118.16 115.31 1ocp n LYS 32 Ca 0.07 -4.65 -0.41 0.00 -1.05 0.00 0.00 58.31 52.27 1ocp n LYS 32 Cb 0.29 -2.27 -0.04 0.00 -0.65 0.00 0.00 35.03 32.36 1ocp n LYS 32 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1ocp s PRO 33 N -2.37 4.58 0.46 -1.58 0.04 -1.26 -5.03 135.00 129.84 1ocp s PRO 33 Ca 0.38 1.64 -0.15 0.00 0.04 0.00 0.00 61.00 62.91 1ocp s PRO 33 Cb 0.12 -3.33 -0.08 0.00 0.04 0.00 0.00 34.50 31.25 1ocp s PRO 33 CO -0.03 0.03 0.90 -1.54 0.04 0.00 0.00 177.00 176.40 1ocp s SER 34 N 0.26 6.63 0.60 6.66 1.04 -1.26 -4.92 113.70 122.71 1ocp s SER 34 Ca 0.51 1.43 0.35 0.00 0.48 0.00 0.00 55.95 58.72 1ocp s SER 34 Cb -0.27 -2.45 1.93 0.00 0.10 0.00 0.00 66.02 65.33 1ocp s SER 34 CO 0.32 -0.48 2.23 -0.07 0.98 0.00 0.00 173.24 176.22 1ocp h LEU 35 N 1.20 0.00 -0.24 2.42 3.38 -1.99 0.16 115.31 120.25 1ocp h LEU 35 Ca -0.47 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.28 1ocp h LEU 35 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1ocp h LEU 35 CO 0.62 0.03 -0.82 -0.61 0.09 0.00 0.00 178.44 177.75 1ocp h GLN 36 N 0.00 0.56 0.00 1.13 4.15 -2.00 -2.33 115.11 116.62 1ocp h GLN 36 Ca -0.00 -0.50 -0.05 0.00 0.77 0.00 0.00 58.65 58.88 1ocp h GLN 36 Cb 0.13 0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 1ocp h GLN 36 CO 0.00 1.12 -0.22 0.37 -1.93 0.00 0.00 178.83 178.18 1ocp h GLN 37 N 0.36 0.00 0.00 1.69 4.15 -1.11 -2.21 115.11 117.99 1ocp h GLN 37 Ca -0.06 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.21 1ocp h GLN 37 Cb 1.44 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 29.11 1ocp h GLN 37 CO 0.15 0.22 -0.74 0.82 -1.93 0.00 0.00 178.83 177.35 1ocp h ILE 38 N 0.00 1.31 -0.17 2.39 1.08 -0.91 -0.08 117.51 121.13 1ocp h ILE 38 Ca -0.00 -2.77 -0.19 0.00 -0.39 0.00 0.00 64.86 61.51 1ocp h ILE 38 Cb 0.72 2.60 0.00 0.00 -3.07 0.00 0.00 36.82 37.07 1ocp h ILE 38 CO 0.03 0.73 -0.67 0.71 -0.69 0.00 0.00 178.15 178.26 1ocp h THR 39 N 0.00 1.31 0.00 -0.27 1.35 -1.00 -2.04 112.91 112.26 1ocp h THR 39 Ca -0.01 -1.93 -0.06 0.00 -0.55 0.00 0.00 66.41 63.86 1ocp h THR 39 Cb 1.54 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 69.84 1ocp h THR 39 CO 0.10 0.60 -0.30 -0.74 -0.25 0.00 0.00 175.52 174.93 1ocp h HIS 40 N 0.47 0.00 -0.25 4.73 -0.00 -1.35 -2.70 115.15 116.06 1ocp h HIS 40 Ca -0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.29 1ocp h HIS 40 Cb 1.26 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.66 1ocp h HIS 40 CO 0.06 0.30 -0.09 0.82 -0.00 0.00 0.00 177.93 179.03 1ocp h ILE 41 N 0.00 1.29 0.38 6.26 5.03 -0.66 0.15 117.51 129.96 1ocp h ILE 41 Ca -0.00 -1.14 -0.02 0.00 -0.12 0.00 0.00 64.86 63.58 1ocp h ILE 41 Cb 0.97 1.51 0.00 0.00 -3.03 0.00 0.00 36.82 36.27 1ocp h ILE 41 CO 0.04 0.35 -0.18 0.00 -0.68 0.00 0.00 178.15 177.68 1ocp h ALA 42 N 0.75 -0.51 0.00 1.87 0.00 -1.23 0.01 119.26 120.14 1ocp h ALA 42 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ocp h ALA 42 Cb 0.58 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1ocp h ALA 42 CO 0.03 -0.76 0.00 -0.91 0.00 0.00 0.00 179.25 177.61 1ocp h ASN 43 N -0.57 0.00 0.56 0.00 2.35 -1.48 0.38 115.58 116.82 1ocp h ASN 43 Ca -0.05 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.53 1ocp h ASN 43 Cb 0.42 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1ocp h ASN 43 CO 0.09 0.00 -0.75 1.56 -1.65 0.00 0.00 177.43 176.67 1ocp h GLN 44 N 0.00 0.15 0.00 0.81 1.08 0.12 -3.32 115.11 113.95 1ocp h GLN 44 Ca 0.00 -0.14 -0.00 0.00 -1.45 0.00 0.00 58.65 57.06 1ocp h GLN 44 Cb 0.18 0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.64 1ocp h GLN 44 CO 0.00 0.83 -0.18 1.47 -0.95 0.00 0.00 178.83 180.00 1ocp n LEU 45 N -3.73 1.57 -2.75 1.46 -0.00 -0.59 -5.00 117.00 107.95 1ocp n LEU 45 Ca -0.02 -2.40 -0.11 0.00 -0.00 0.00 0.00 56.01 53.47 1ocp n LEU 45 Cb 0.72 -0.29 -0.01 0.00 -0.00 0.00 0.00 43.42 43.85 1ocp n LEU 45 CO 0.46 0.57 -0.07 0.61 -0.00 0.00 0.00 177.39 178.95 1ocp n GLY 46 N -0.94 -0.49 3.68 1.47 0.00 0.13 -4.70 105.19 104.33 1ocp n GLY 46 Ca 0.11 0.02 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 1ocp n GLY 46 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1ocp n LEU 47 N -2.91 0.00 -4.85 0.99 -0.00 -1.18 -4.96 117.00 104.09 1ocp n LEU 47 Ca -0.05 -2.35 -0.35 0.00 -0.00 0.00 0.00 56.01 53.26 1ocp n LEU 47 Cb 0.54 -0.41 -0.06 0.00 -0.00 0.00 0.00 43.42 43.50 1ocp n LEU 47 CO 0.21 -0.71 0.19 -0.70 -0.00 0.00 0.00 177.39 176.38 1ocp s GLU 48 N -4.49 3.91 0.65 1.47 2.56 -1.26 -4.81 118.70 116.73 1ocp s GLU 48 Ca 0.58 0.39 0.35 0.00 0.00 0.00 0.00 54.97 56.29 1ocp s GLU 48 Cb -0.05 -2.94 1.91 0.00 2.00 0.00 0.00 34.13 35.05 1ocp s GLU 48 CO 0.37 0.49 2.11 -0.22 -0.56 0.00 0.00 175.26 177.45 1ocp h LYS 49 N 3.55 0.00 -0.08 4.30 3.64 -1.97 -1.13 116.57 124.88 1ocp h LYS 49 Ca -0.49 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 58.68 1ocp h LYS 49 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1ocp h LYS 49 CO 0.66 0.00 -0.80 0.38 -2.27 0.00 0.00 179.45 177.42 1ocp h ASP 50 N 0.00 0.67 1.60 4.20 3.04 -2.00 -2.27 116.42 121.67 1ocp h ASP 50 Ca 0.02 -0.46 -0.05 0.00 -3.24 0.00 0.00 57.03 53.31 1ocp h ASP 50 Cb 0.43 -0.20 -0.01 0.00 -1.04 0.00 0.00 39.33 38.51 1ocp h ASP 50 CO -0.00 1.23 -0.40 1.62 -2.04 0.00 0.00 179.24 179.65 1ocp h VAL 51 N 0.36 0.32 0.00 4.15 3.04 -1.62 -2.81 116.25 119.69 1ocp h VAL 51 Ca -0.05 -1.47 -0.17 0.00 -1.01 0.00 0.00 66.70 64.00 1ocp h VAL 51 Cb 1.41 2.07 -0.02 0.00 -2.01 0.00 0.00 31.29 32.74 1ocp h VAL 51 CO 0.15 0.18 -0.79 1.62 -1.01 0.00 0.00 177.57 177.72 1ocp h VAL 52 N 0.00 1.49 0.11 1.51 3.04 -1.36 -1.89 116.25 119.16 1ocp h VAL 52 Ca -0.01 -2.77 -0.20 0.00 -1.01 0.00 0.00 66.70 62.71 1ocp h VAL 52 Cb 1.17 2.53 0.01 0.00 -2.01 0.00 0.00 31.29 32.98 1ocp h VAL 52 CO 0.02 0.77 -0.94 -0.09 -1.01 0.00 0.00 177.57 176.33 1ocp h ARG 53 N 0.00 0.24 -0.04 4.17 9.65 -1.43 -2.15 114.38 124.83 1ocp h ARG 53 Ca -0.01 -0.41 -0.06 0.00 -1.10 0.00 0.00 59.98 58.40 1ocp h ARG 53 Cb 1.46 0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 30.19 1ocp h ARG 53 CO 0.10 1.20 -0.27 0.28 2.80 0.00 0.00 179.97 184.08 1ocp h VAL 54 N -0.44 1.21 -0.07 0.20 2.07 -1.58 0.56 116.25 118.20 1ocp h VAL 54 Ca -0.19 -1.01 -0.23 0.00 0.82 0.00 0.00 66.70 66.09 1ocp h VAL 54 Cb 1.60 1.49 0.02 0.00 -1.52 0.00 0.00 31.29 32.88 1ocp h VAL 54 CO 0.09 0.29 -0.87 -0.25 0.02 0.00 0.00 177.57 176.86 1ocp h TRP 55 N 0.06 1.01 -0.16 1.57 7.01 -1.41 -3.09 115.95 120.93 1ocp h TRP 55 Ca 0.01 -0.50 0.00 0.00 2.11 0.00 0.00 58.89 60.51 1ocp h TRP 55 Cb 0.52 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 27.44 1ocp h TRP 55 CO 0.00 1.33 0.00 0.34 -2.79 0.00 0.00 178.44 177.32 1ocp n PHE 56 N -3.94 0.21 0.09 2.65 7.35 -0.81 -3.19 117.46 119.82 1ocp n PHE 56 Ca -0.09 -0.10 -0.18 0.00 -0.76 0.00 0.00 57.45 56.32 1ocp n PHE 56 Cb 0.79 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 40.48 1ocp n PHE 56 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ocp h ASN 58 N 0.08 0.53 0.06 0.00 4.21 -1.65 -2.90 115.58 115.90 1ocp h ASN 58 Ca -0.20 -0.64 -0.01 0.00 1.21 0.00 0.00 56.30 56.66 1ocp h ASN 58 Cb 2.02 -0.17 -0.00 0.00 -1.12 0.00 0.00 38.32 39.05 1ocp h ASN 58 CO 0.20 1.52 -0.03 0.03 -1.29 0.00 0.00 177.43 177.85 1ocp h ARG 59 N 0.09 0.00 0.00 0.81 -0.00 -1.62 0.25 114.38 113.92 1ocp h ARG 59 Ca -0.23 0.00 -0.26 0.00 -0.50 0.00 0.00 59.98 58.99 1ocp h ARG 59 Cb 2.05 0.00 -0.04 0.00 0.00 0.00 0.00 29.97 31.98 1ocp h ARG 59 CO 0.20 0.03 -1.48 0.07 0.00 0.00 0.00 179.97 178.79 1ocp h ARG 60 N 0.00 0.00 -1.92 0.04 0.11 -1.46 -3.39 114.38 107.76 1ocp h ARG 60 Ca -0.00 0.00 -0.52 0.00 0.10 0.00 0.00 59.98 59.56 1ocp h ARG 60 Cb 0.07 0.00 -0.41 0.00 1.11 0.00 0.00 29.97 30.74 1ocp h ARG 60 CO 0.00 0.61 -0.94 0.00 0.10 0.00 0.00 179.97 179.75 1ocp n GLN 61 N -3.12 2.13 0.08 0.08 10.64 -0.85 -4.84 117.38 121.51 1ocp n GLN 61 Ca -0.12 -4.05 -0.11 0.00 -1.83 0.00 0.00 57.00 50.90 1ocp n GLN 61 Cb 1.00 -1.91 -0.11 0.00 -0.86 0.00 0.00 30.24 28.36 1ocp n GLN 61 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.06 176.80 1ocp h LYS 62 N 2.94 0.13 0.00 2.61 2.10 -1.17 -3.46 116.57 119.72 1ocp h LYS 62 Ca 0.11 -0.20 0.00 0.00 -2.00 0.00 0.00 60.65 58.56 1ocp h LYS 62 Cb 0.82 0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.22 1ocp h LYS 62 CO 0.66 1.08 0.00 0.41 -2.00 0.00 0.00 179.45 179.60 1ocp n GLY 63 N 1.35 -1.42 0.20 0.07 0.00 -1.26 -5.02 105.19 99.12 1ocp n GLY 63 Ca -0.04 0.95 0.09 0.00 0.00 0.00 0.00 46.02 47.02 1ocp n GLY 63 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ocp h LYS 64 N 0.00 0.00 0.01 1.61 1.57 -1.92 -3.35 116.57 114.50 1ocp h LYS 64 Ca 0.00 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.38 1ocp h LYS 64 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.25 1ocp h LYS 64 CO 0.00 0.15 -2.35 0.54 -0.57 0.00 0.00 179.45 177.22 1ocp n ARG 65 N -3.14 0.63 -3.09 3.15 1.74 -1.26 -4.78 116.66 109.90 1ocp n ARG 65 Ca 0.03 0.25 -0.44 0.00 -0.77 0.00 0.00 57.85 56.92 1ocp n ARG 65 Cb 0.58 -1.55 -0.05 0.00 -1.02 0.00 0.00 32.46 30.43 1ocp n ARG 65 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1ocp s SER 66 N -7.00 6.19 0.00 0.55 0.01 -1.26 -5.29 113.70 106.91 1ocp s SER 66 Ca -0.35 -1.25 0.29 0.00 1.31 0.00 0.00 55.95 55.96 1ocp s SER 66 Cb 0.11 -2.31 1.24 0.00 0.21 0.00 0.00 66.02 65.26 1ocp s SER 66 CO 0.57 -1.10 1.85 -1.20 0.41 0.00 0.00 173.24 173.78