#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 0.96 -3.39 3.17 2.13 -1.26 -5.03 120.64 117.22 1ocp n GLU 2 Ca 0.00 -1.34 -0.39 0.00 0.66 0.00 0.00 57.16 56.10 1ocp n GLU 2 Cb 0.00 0.29 -0.03 0.00 0.27 0.00 0.00 31.44 31.97 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 -0.98 3.85 -3.71 6.31 -1.04 -1.26 -4.99 114.28 112.45 1ocp n THR 3 Ca -0.18 -5.39 -0.08 0.00 -2.04 0.00 0.00 64.05 56.36 1ocp n THR 3 Cb 0.83 -2.32 -0.00 0.00 -1.82 0.00 0.00 70.33 67.03 1ocp n THR 3 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ocp n LEU 4 N 1.95 0.00 -3.30 -4.42 -0.00 -1.26 -5.10 117.00 104.87 1ocp n LEU 4 Ca 0.24 -1.84 -0.18 0.00 -0.00 0.00 0.00 56.01 54.24 1ocp n LEU 4 Cb 0.37 2.15 -0.07 0.00 -0.00 0.00 0.00 43.42 45.87 1ocp n LEU 4 CO 0.48 -0.51 -0.16 -0.69 -0.00 0.00 0.00 177.39 176.51 1ocp s VAL 5 N -2.55 -0.26 -1.00 1.47 1.01 -1.26 -5.06 120.40 112.76 1ocp s VAL 5 Ca 0.15 -1.36 -0.05 0.00 0.00 0.00 0.00 61.98 60.72 1ocp s VAL 5 Cb -0.02 -0.72 0.25 0.00 0.00 0.00 0.00 36.38 35.89 1ocp s VAL 5 CO 0.11 -0.67 0.93 -1.58 0.00 0.00 0.00 175.10 173.90 1ocp s GLN 6 N 1.06 3.69 -0.05 2.72 0.74 -1.26 -4.88 119.66 121.69 1ocp s GLN 6 Ca 0.22 -3.28 -0.08 0.00 0.05 0.00 0.00 55.36 52.27 1ocp s GLN 6 Cb -0.10 -4.22 -0.04 0.00 1.10 0.00 0.00 33.01 29.74 1ocp s GLN 6 CO -0.06 -1.25 0.38 0.00 -0.55 0.00 0.00 175.29 173.81 1ocp h ALA 7 N 6.26 -0.34 -3.57 1.58 0.00 -1.97 -3.46 119.26 117.77 1ocp h ALA 7 Ca 0.17 -0.06 -0.27 0.00 0.00 0.00 0.00 54.91 54.74 1ocp h ALA 7 Cb 0.83 0.11 -0.32 0.00 0.00 0.00 0.00 17.79 18.42 1ocp h ALA 7 CO 0.93 -0.32 -0.72 1.03 0.00 0.00 0.00 179.25 180.18 1ocp s ARG 8 N -2.48 -0.02 -0.37 0.00 0.52 -1.26 -5.04 118.95 110.30 1ocp s ARG 8 Ca -0.04 0.14 -0.04 0.00 -0.52 0.00 0.00 55.73 55.27 1ocp s ARG 8 Cb 0.00 -0.17 0.04 0.00 0.52 0.00 0.00 34.95 35.35 1ocp s ARG 8 CO 0.13 -0.12 2.76 1.17 0.02 0.00 0.00 175.30 179.26 1ocp n LYS 9 N 3.84 2.25 0.00 3.54 4.81 -1.26 -4.21 118.16 127.12 1ocp n LYS 9 Ca -0.23 -2.03 0.00 0.00 -0.87 0.00 0.00 58.31 55.18 1ocp n LYS 9 Cb 0.53 -2.03 0.00 0.00 0.02 0.00 0.00 35.03 33.55 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 1.01 0.00 -2.69 1.64 3.00 -1.26 -4.98 116.66 113.38 1ocp n ARG 10 Ca 0.45 0.00 -0.07 0.00 -0.01 0.00 0.00 57.85 58.22 1ocp n ARG 10 Cb 0.60 -0.12 0.11 0.00 0.00 0.00 0.00 32.46 33.06 1ocp n ARG 10 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 1ocp n LYS 11 N -0.32 1.12 0.00 5.56 2.85 -1.26 -4.97 118.16 121.14 1ocp n LYS 11 Ca 0.00 -1.70 0.00 0.00 -1.05 0.00 0.00 58.31 55.56 1ocp n LYS 11 Cb 0.00 -0.02 0.00 0.00 -0.65 0.00 0.00 35.03 34.36 1ocp n LYS 11 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1ocp n ARG 12 N -0.63 0.00 0.09 -1.58 1.74 -1.26 -4.87 116.66 110.15 1ocp n ARG 12 Ca -0.06 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 56.95 1ocp n ARG 12 Cb 0.83 -0.12 -0.03 0.00 -1.02 0.00 0.00 32.46 32.12 1ocp n ARG 12 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1ocp h THR 13 N 0.00 1.58 -3.52 0.55 2.02 -1.94 -3.45 112.91 108.16 1ocp h THR 13 Ca 0.00 -2.91 -0.31 0.00 0.77 0.00 0.00 66.41 63.96 1ocp h THR 13 Cb 0.00 2.61 0.12 0.00 -1.74 0.00 0.00 68.15 69.14 1ocp h THR 13 CO 0.00 0.84 0.27 -1.20 0.37 0.00 0.00 175.52 175.80 1ocp n SER 14 N -3.54 0.19 -4.48 4.18 7.64 -1.26 -4.73 113.62 111.61 1ocp n SER 14 Ca -0.02 -1.40 -0.43 0.00 1.01 0.00 0.00 58.87 58.02 1ocp n SER 14 Cb 0.85 -0.69 -0.01 0.00 -1.01 0.00 0.00 64.21 63.35 1ocp n SER 14 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1ocp s ILE 15 N -2.94 4.68 0.67 0.44 -1.09 -1.26 -4.98 121.20 116.72 1ocp s ILE 15 Ca 0.53 -1.91 -0.16 0.00 -2.23 0.00 0.00 60.65 56.88 1ocp s ILE 15 Cb -0.02 -4.90 0.01 0.00 -1.58 0.00 0.00 42.46 35.97 1ocp s ILE 15 CO 0.37 -1.65 1.17 -0.70 -1.23 0.00 0.00 174.94 172.89 1ocp s GLU 16 N 2.70 2.57 0.59 2.79 2.12 -1.26 -4.80 118.70 123.42 1ocp s GLU 16 Ca 0.40 1.63 0.30 0.00 0.36 0.00 0.00 54.97 57.66 1ocp s GLU 16 Cb -0.03 -1.90 1.85 0.00 0.26 0.00 0.00 34.13 34.32 1ocp s GLU 16 CO -0.04 -1.47 2.26 -0.97 -0.54 0.00 0.00 175.26 174.50 1ocp h ASN 17 N 0.09 0.00 0.93 -1.70 -0.73 -1.97 0.03 115.58 112.22 1ocp h ASN 17 Ca -0.48 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 57.47 1ocp h ASN 17 Cb 1.28 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.83 1ocp h ASN 17 CO 0.52 0.00 -1.11 0.03 -0.37 0.00 0.00 177.43 176.50 1ocp h ARG 18 N 0.00 0.00 -0.21 6.67 3.08 -1.98 -3.14 114.38 118.80 1ocp h ARG 18 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1ocp h ARG 18 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1ocp h ARG 18 CO -0.00 0.86 -0.12 -0.24 -1.07 0.00 0.00 179.97 179.40 1ocp h VAL 19 N 0.00 1.31 -0.61 2.04 3.04 -1.34 0.14 116.25 120.83 1ocp h VAL 19 Ca -0.06 -1.20 -0.03 0.00 -1.01 0.00 0.00 66.70 64.39 1ocp h VAL 19 Cb 1.79 1.65 -0.03 0.00 -2.01 0.00 0.00 31.29 32.69 1ocp h VAL 19 CO 0.11 0.37 0.28 0.08 -1.01 0.00 0.00 177.57 177.40 1ocp h ARG 20 N 0.15 0.89 0.00 4.17 0.11 -1.54 -0.02 114.38 118.14 1ocp h ARG 20 Ca 0.04 -0.14 0.00 0.00 0.10 0.00 0.00 59.98 59.99 1ocp h ARG 20 Cb 0.62 -0.16 0.00 0.00 1.11 0.00 0.00 29.97 31.55 1ocp h ARG 20 CO 0.03 0.72 0.00 0.91 0.10 0.00 0.00 179.97 181.74 1ocp n TRP 21 N -4.50 0.55 -0.06 4.08 5.03 -1.19 -1.67 117.44 119.69 1ocp n TRP 21 Ca 0.04 0.18 -0.11 0.00 3.03 0.00 0.00 57.50 60.64 1ocp n TRP 21 Cb 0.13 -0.79 0.03 0.00 -1.03 0.00 0.00 31.31 29.65 1ocp n TRP 21 CO 0.00 0.00 0.00 1.03 -0.03 0.00 0.00 177.69 178.69 1ocp h SER 22 N 0.00 0.81 -0.59 -0.99 0.87 0.11 -2.23 113.55 111.53 1ocp h SER 22 Ca 0.00 -0.39 0.06 0.00 -1.23 0.00 0.00 61.79 60.23 1ocp h SER 22 Cb 0.52 -0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 62.20 1ocp h SER 22 CO 0.00 1.13 0.30 -0.07 -0.53 0.00 0.00 176.83 177.67 1ocp h LEU 23 N 0.60 0.43 0.33 2.23 3.38 -0.33 -2.28 115.31 119.67 1ocp h LEU 23 Ca 0.04 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1ocp h LEU 23 Cb 1.00 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 1ocp h LEU 23 CO 0.10 0.28 -0.40 -0.08 0.09 0.00 0.00 178.44 178.42 1ocp h GLU 24 N 0.57 -0.75 -0.03 1.13 4.81 -1.21 -0.54 114.58 118.55 1ocp h GLU 24 Ca 0.27 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.56 1ocp h GLU 24 Cb 0.19 0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 1ocp h GLU 24 CO -0.19 -0.50 0.11 0.00 -0.73 0.00 0.00 179.01 177.71 1ocp h THR 25 N -0.77 0.14 0.00 0.32 1.03 -1.11 -0.60 112.91 111.91 1ocp h THR 25 Ca -0.02 0.00 -0.22 0.00 -0.01 0.00 0.00 66.41 66.16 1ocp h THR 25 Cb 0.72 0.89 -0.04 0.00 -1.07 0.00 0.00 68.15 68.65 1ocp h THR 25 CO -0.11 0.00 -1.30 -0.03 -0.01 0.00 0.00 175.52 174.07 1ocp h MET 26 N 0.00 0.00 0.00 0.00 1.85 -0.66 -3.34 114.93 112.78 1ocp h MET 26 Ca 0.02 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 1ocp h MET 26 Cb 0.24 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.27 1ocp h MET 26 CO -0.00 0.60 -0.72 1.19 -0.40 0.00 0.00 176.91 177.58 1ocp n PHE 27 N -3.12 0.14 -0.12 1.39 3.72 -0.33 -4.05 117.46 115.08 1ocp n PHE 27 Ca -0.08 0.04 0.02 0.00 -0.05 0.00 0.00 57.45 57.38 1ocp n PHE 27 Cb 0.94 -0.32 0.22 0.00 -0.94 0.00 0.00 39.48 39.38 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 -1.70 3.92 -0.09 4.37 4.77 -0.50 -3.94 117.00 123.83 1ocp n LEU 28 Ca 0.04 -2.00 -0.15 0.00 -0.03 0.00 0.00 56.01 53.87 1ocp n LEU 28 Cb 0.37 -0.62 -0.08 0.00 -2.33 0.00 0.00 43.42 40.76 1ocp n LEU 28 CO 0.38 0.51 -1.12 2.29 -1.33 0.00 0.00 177.39 178.11 1ocp n LYS 29 N 0.26 0.45 -3.76 3.23 2.85 -1.26 -4.98 118.16 114.96 1ocp n LYS 29 Ca 0.18 0.13 -0.15 0.00 -1.05 0.00 0.00 58.31 57.42 1ocp n LYS 29 Cb 0.85 -1.33 -0.15 0.00 -0.65 0.00 0.00 35.03 33.74 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 4.25 1.62 -2.49 0.00 -0.04 -1.26 -4.37 135.00 132.71 1ocp n PRO 31 Ca -0.26 -1.15 -0.23 0.00 -0.04 0.00 0.00 63.50 61.82 1ocp n PRO 31 Cb 0.51 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.48 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 -0.07 2.96 -2.57 0.54 2.85 -1.26 -5.06 118.16 115.55 1ocp n LYS 32 Ca 0.21 -4.22 -0.42 0.00 -1.05 0.00 0.00 58.31 52.83 1ocp n LYS 32 Cb 0.90 -2.04 -0.03 0.00 -0.65 0.00 0.00 35.03 33.20 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 -3.46 4.55 0.46 -1.58 0.04 -1.26 -5.00 135.00 128.74 1ocp s PRO 33 Ca 0.44 1.62 -0.23 0.00 0.04 0.00 0.00 61.00 62.86 1ocp s PRO 33 Cb 0.41 -3.36 -0.07 0.00 0.04 0.00 0.00 34.50 31.52 1ocp s PRO 33 CO -0.13 -0.04 1.22 -1.12 0.04 0.00 0.00 177.00 176.97 1ocp s SER 34 N 0.55 6.07 0.50 6.66 0.01 -1.26 -4.88 113.70 121.36 1ocp s SER 34 Ca 0.53 2.44 0.19 0.00 1.31 0.00 0.00 55.95 60.41 1ocp s SER 34 Cb -0.26 -2.61 1.27 0.00 0.21 0.00 0.00 66.02 64.62 1ocp s SER 34 CO 0.31 -1.00 2.10 -0.07 0.41 0.00 0.00 173.24 174.99 1ocp h LEU 35 N 2.10 0.00 -0.55 2.44 4.07 -1.99 0.28 115.31 121.65 1ocp h LEU 35 Ca -0.50 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.32 1ocp h LEU 35 Cb 1.25 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.99 1ocp h LEU 35 CO 0.60 0.08 -0.36 1.56 -1.08 0.00 0.00 178.44 179.24 1ocp h GLN 36 N 0.00 0.77 0.00 1.13 7.50 -2.00 -1.71 115.11 120.80 1ocp h GLN 36 Ca -0.00 -0.38 -0.03 0.00 0.50 0.00 0.00 58.65 58.74 1ocp h GLN 36 Cb 0.15 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.68 1ocp h GLN 36 CO 0.01 1.01 -0.14 0.37 -1.50 0.00 0.00 178.83 178.57 1ocp h GLN 37 N 0.64 0.00 -0.06 1.46 4.15 -0.85 -0.26 115.11 120.19 1ocp h GLN 37 Ca 0.06 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.35 1ocp h GLN 37 Cb 0.91 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.58 1ocp h GLN 37 CO 0.08 0.14 -0.57 0.82 -1.93 0.00 0.00 178.83 177.38 1ocp h ILE 38 N 0.00 1.38 -0.71 2.39 1.08 -0.25 -0.27 117.51 121.12 1ocp h ILE 38 Ca -0.00 -1.92 -0.06 0.00 -0.39 0.00 0.00 64.86 62.49 1ocp h ILE 38 Cb 0.29 1.98 -0.03 0.00 -3.07 0.00 0.00 36.82 35.99 1ocp h ILE 38 CO 0.02 0.56 0.20 0.74 -0.69 0.00 0.00 178.15 178.98 1ocp h THR 39 N 0.13 1.26 0.00 -0.27 2.02 -0.61 -0.16 112.91 115.28 1ocp h THR 39 Ca -0.00 -0.94 -0.05 0.00 0.77 0.00 0.00 66.41 66.19 1ocp h THR 39 Cb 1.04 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 1ocp h THR 39 CO 0.08 0.36 -0.23 0.45 0.37 0.00 0.00 175.52 176.56 1ocp h HIS 40 N 1.07 0.00 -0.29 3.16 3.86 -0.87 -2.51 115.15 119.58 1ocp h HIS 40 Ca 0.23 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.39 1ocp h HIS 40 Cb 0.34 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 1ocp h HIS 40 CO 0.03 0.23 -0.01 0.82 0.86 0.00 0.00 177.93 179.86 1ocp h ILE 41 N 0.00 1.26 0.38 2.45 5.03 0.73 0.60 117.51 127.97 1ocp h ILE 41 Ca -0.00 -0.96 -0.01 0.00 -0.12 0.00 0.00 64.86 63.77 1ocp h ILE 41 Cb 0.63 1.32 -0.01 0.00 -3.03 0.00 0.00 36.82 35.73 1ocp h ILE 41 CO 0.03 0.31 -0.28 0.00 -0.68 0.00 0.00 178.15 177.53 1ocp h ALA 42 N 0.82 -0.65 0.00 1.87 0.00 -0.92 0.15 119.26 120.53 1ocp h ALA 42 Ca 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ocp h ALA 42 Cb 0.45 0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1ocp h ALA 42 CO 0.02 -0.88 0.00 -0.91 0.00 0.00 0.00 179.25 177.47 1ocp h ASN 43 N -0.65 0.00 0.81 0.00 2.35 -1.48 0.27 115.58 116.89 1ocp h ASN 43 Ca -0.03 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.54 1ocp h ASN 43 Cb 0.56 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.90 1ocp h ASN 43 CO 0.00 0.00 -0.83 1.56 -1.65 0.00 0.00 177.43 176.51 1ocp h GLN 44 N 0.00 0.01 0.00 0.81 1.08 0.16 -3.34 115.11 113.84 1ocp h GLN 44 Ca 0.00 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1ocp h GLN 44 Cb 0.11 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 1ocp h GLN 44 CO 0.00 0.84 -0.16 1.47 -0.95 0.00 0.00 178.83 180.03 1ocp n LEU 45 N -3.56 1.42 -2.21 1.46 -0.00 -0.45 -5.00 117.00 108.67 1ocp n LEU 45 Ca -0.01 -2.12 -0.10 0.00 -0.00 0.00 0.00 56.01 53.79 1ocp n LEU 45 Cb 0.80 -0.22 -0.01 0.00 -0.00 0.00 0.00 43.42 43.98 1ocp n LEU 45 CO 0.45 0.50 -0.12 0.61 -0.00 0.00 0.00 177.39 178.83 1ocp n GLY 46 N -0.80 -0.20 4.03 1.47 0.00 0.87 -4.69 105.19 105.88 1ocp n GLY 46 Ca 0.08 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 1ocp n GLY 46 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ocp s LEU 47 N -5.02 3.26 0.17 0.99 2.34 -1.20 -4.90 118.68 114.32 1ocp s LEU 47 Ca 0.00 -0.72 -0.12 0.00 0.06 0.00 0.00 54.13 53.35 1ocp s LEU 47 Cb 0.00 -1.94 -0.07 0.00 -0.56 0.00 0.00 46.19 43.62 1ocp s LEU 47 CO 0.00 -1.18 0.54 -0.70 -1.06 0.00 0.00 176.35 173.95 1ocp s GLU 48 N -4.58 3.90 0.52 1.48 2.56 -1.26 -4.80 118.70 116.51 1ocp s GLU 48 Ca 0.60 0.39 0.32 0.00 0.00 0.00 0.00 54.97 56.28 1ocp s GLU 48 Cb -0.07 -2.83 1.74 0.00 2.00 0.00 0.00 34.13 34.97 1ocp s GLU 48 CO 0.37 0.43 1.97 0.87 -0.56 0.00 0.00 175.26 178.34 1ocp h LYS 49 N 3.21 0.00 -0.08 4.30 6.56 -1.98 -1.33 116.57 127.26 1ocp h LYS 49 Ca -0.48 0.00 -0.20 0.00 -1.06 0.00 0.00 60.65 58.91 1ocp h LYS 49 Cb 1.18 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.84 1ocp h LYS 49 CO 0.67 0.00 -0.77 0.22 -2.06 0.00 0.00 179.45 177.51 1ocp h ASP 50 N 0.00 0.58 1.31 0.86 3.58 -1.99 -1.69 116.42 119.07 1ocp h ASP 50 Ca 0.00 -0.40 -0.10 0.00 0.42 0.00 0.00 57.03 56.95 1ocp h ASP 50 Cb 0.13 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 1ocp h ASP 50 CO 0.00 1.16 -0.72 1.62 -2.88 0.00 0.00 179.24 178.41 1ocp h VAL 51 N 0.32 0.64 0.00 2.25 3.04 -1.65 -2.49 116.25 118.36 1ocp h VAL 51 Ca -0.04 -1.98 -0.17 0.00 -1.01 0.00 0.00 66.70 63.50 1ocp h VAL 51 Cb 1.37 2.23 -0.02 0.00 -2.01 0.00 0.00 31.29 32.85 1ocp h VAL 51 CO 0.14 0.36 -0.81 1.62 -1.01 0.00 0.00 177.57 177.87 1ocp h VAL 52 N 0.00 1.53 0.18 1.51 3.04 -1.44 -2.61 116.25 118.46 1ocp h VAL 52 Ca -0.04 -2.84 -0.32 0.00 -1.01 0.00 0.00 66.70 62.50 1ocp h VAL 52 Cb 1.38 2.55 0.01 0.00 -2.01 0.00 0.00 31.29 33.22 1ocp h VAL 52 CO 0.05 0.80 -1.47 -0.09 -1.01 0.00 0.00 177.57 175.84 1ocp h ARG 53 N 0.00 0.38 -0.60 4.17 1.12 -1.33 -2.37 114.38 115.75 1ocp h ARG 53 Ca -0.01 -0.64 -0.09 0.00 -1.11 0.00 0.00 59.98 58.13 1ocp h ARG 53 Cb 1.49 0.24 -0.02 0.00 -0.01 0.00 0.00 29.97 31.66 1ocp h ARG 53 CO 0.11 1.28 0.02 0.28 -3.11 0.00 0.00 179.97 178.55 1ocp h VAL 54 N 0.10 1.26 -0.27 0.20 2.07 -1.49 0.41 116.25 118.54 1ocp h VAL 54 Ca -0.23 -1.12 -0.12 0.00 0.82 0.00 0.00 66.70 66.04 1ocp h VAL 54 Cb 2.07 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 1ocp h VAL 54 CO 0.21 0.41 -0.35 -0.25 0.02 0.00 0.00 177.57 177.61 1ocp h TRP 55 N 0.95 0.69 -0.00 1.57 7.01 -1.55 -2.08 115.95 122.55 1ocp h TRP 55 Ca 0.17 -0.18 0.00 0.00 2.11 0.00 0.00 58.89 60.99 1ocp h TRP 55 Cb 0.53 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 27.43 1ocp h TRP 55 CO 0.04 0.86 -0.01 0.34 -2.79 0.00 0.00 178.44 176.88 1ocp n PHE 56 N -4.06 0.00 0.04 2.65 -0.00 -0.77 -1.59 117.46 113.73 1ocp n PHE 56 Ca -0.01 0.00 -0.15 0.00 -0.00 0.00 0.00 57.45 57.29 1ocp n PHE 56 Cb 0.49 -0.29 -0.05 0.00 -0.00 0.00 0.00 39.48 39.63 1ocp n PHE 56 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1ocp h ASN 58 N 0.34 0.00 1.91 0.00 -0.00 -1.51 -2.89 115.58 113.43 1ocp h ASN 58 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.22 1ocp h ASN 58 Cb 1.51 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.83 1ocp h ASN 58 CO 0.16 0.50 -0.04 0.03 -0.00 0.00 0.00 177.43 178.08 1ocp h ARG 59 N 0.00 0.00 0.00 6.67 2.47 -1.22 -2.94 114.38 119.36 1ocp h ARG 59 Ca -0.08 0.00 -0.24 0.00 -1.26 0.00 0.00 59.98 58.40 1ocp h ARG 59 Cb 1.45 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.73 1ocp h ARG 59 CO 0.05 0.00 -1.67 2.89 0.56 0.00 0.00 179.97 181.80 1ocp n ARG 60 N -3.01 0.63 -2.78 0.04 1.85 -0.05 -4.36 116.66 108.97 1ocp n ARG 60 Ca 0.04 0.22 -0.28 0.00 -1.00 0.00 0.00 57.85 56.83 1ocp n ARG 60 Cb 0.52 -1.76 -0.03 0.00 -1.05 0.00 0.00 32.46 30.15 1ocp n ARG 60 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 1ocp n GLN 61 N -2.92 3.37 0.12 2.89 7.27 -1.09 -4.77 117.38 122.25 1ocp n GLN 61 Ca -0.15 -4.74 0.01 0.00 0.07 0.00 0.00 57.00 52.19 1ocp n GLN 61 Cb 0.96 -2.25 -0.00 0.00 2.41 0.00 0.00 30.24 31.36 1ocp n GLN 61 CO 0.00 0.00 0.00 1.57 0.07 0.00 0.00 177.06 178.70 1ocp h LYS 62 N 2.91 0.00 0.00 3.69 -0.00 -1.71 -3.45 116.57 118.01 1ocp h LYS 62 Ca 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.85 1ocp h LYS 62 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.84 1ocp h LYS 62 CO 0.85 0.51 0.00 0.41 -0.00 0.00 0.00 179.45 181.22 1ocp n GLY 63 N 1.26 -1.86 0.10 0.07 0.00 -1.26 -5.05 105.19 98.44 1ocp n GLY 63 Ca 0.00 0.83 -0.12 0.00 0.00 0.00 0.00 46.02 46.73 1ocp n GLY 63 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ocp n LYS 64 N 0.00 0.84 -3.69 1.61 5.02 -1.26 -4.87 118.16 115.81 1ocp n LYS 64 Ca 0.00 0.06 -0.29 0.00 -2.02 0.00 0.00 58.31 56.06 1ocp n LYS 64 Cb 0.00 -1.45 -0.15 0.00 -0.02 0.00 0.00 35.03 33.40 1ocp n LYS 64 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1ocp s ARG 65 N -2.44 0.60 -1.10 1.97 0.52 -1.26 -5.04 118.95 112.19 1ocp s ARG 65 Ca -0.20 -0.85 -0.06 0.00 -0.52 0.00 0.00 55.73 54.11 1ocp s ARG 65 Cb 0.07 -1.84 0.29 0.00 0.52 0.00 0.00 34.95 33.99 1ocp s ARG 65 CO 0.63 -0.93 1.37 0.45 0.02 0.00 0.00 175.30 176.83 1ocp n SER 66 N 4.97 6.04 0.00 0.23 2.88 -1.26 -5.19 113.62 121.29 1ocp n SER 66 Ca -0.04 -3.26 0.00 0.00 -1.33 0.00 0.00 58.87 54.24 1ocp n SER 66 Cb 0.43 -1.32 0.00 0.00 -0.75 0.00 0.00 64.21 62.57 1ocp n SER 66 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61