#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 1.76 -3.12 3.17 -0.58 -1.26 -5.00 120.64 115.62 1ocp n GLU 2 Ca 0.00 -3.94 -0.44 0.00 -0.42 0.00 0.00 57.16 52.36 1ocp n GLU 2 Cb 0.00 -1.83 0.00 0.00 -0.57 0.00 0.00 31.44 29.05 1ocp n GLU 2 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1ocp n THR 3 N 0.48 4.78 0.06 2.62 -2.24 -1.26 -4.58 114.28 114.15 1ocp n THR 3 Ca 0.26 -5.43 0.00 0.00 -2.27 0.00 0.00 64.05 56.62 1ocp n THR 3 Cb 0.52 -2.39 0.00 0.00 -2.10 0.00 0.00 70.33 66.36 1ocp n THR 3 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ocp n LEU 4 N 2.64 -0.41 -3.51 3.22 4.77 -1.26 -5.02 117.00 117.42 1ocp n LEU 4 Ca 0.27 0.22 -0.27 0.00 -0.03 0.00 0.00 56.01 56.21 1ocp n LEU 4 Cb 0.37 0.52 -0.10 0.00 -2.33 0.00 0.00 43.42 41.89 1ocp n LEU 4 CO 0.60 -0.52 -0.18 0.52 -1.33 0.00 0.00 177.39 176.48 1ocp n VAL 5 N -2.87 0.20 -1.57 4.08 0.31 -1.26 -5.11 118.33 112.11 1ocp n VAL 5 Ca 0.00 -4.20 -0.14 0.00 -0.01 0.00 0.00 64.34 60.00 1ocp n VAL 5 Cb 0.00 -1.92 0.09 0.00 -0.91 0.00 0.00 33.84 31.10 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 2.07 -0.49 -1.65 5.55 6.02 -1.26 -4.90 117.38 122.72 1ocp n GLN 6 Ca 0.25 -1.02 -0.40 0.00 -0.01 0.00 0.00 57.00 55.83 1ocp n GLN 6 Cb 0.44 -0.60 -0.03 0.00 1.02 0.00 0.00 30.24 31.07 1ocp n GLN 6 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ocp s ALA 7 N -3.84 2.26 0.77 -1.58 0.00 -1.26 -4.95 121.76 113.15 1ocp s ALA 7 Ca 0.35 0.34 -0.06 0.00 0.00 0.00 0.00 51.96 52.60 1ocp s ALA 7 Cb -0.01 -4.19 0.13 0.00 0.00 0.00 0.00 23.12 19.04 1ocp s ALA 7 CO 0.24 -3.53 1.07 1.03 0.00 0.00 0.00 175.76 174.57 1ocp s ARG 8 N 7.12 1.56 -0.56 0.00 1.81 -1.26 -4.98 118.95 122.64 1ocp s ARG 8 Ca 0.96 -0.75 -0.02 0.00 -1.72 0.00 0.00 55.73 54.20 1ocp s ARG 8 Cb -0.24 -2.18 0.39 0.00 -0.45 0.00 0.00 34.95 32.46 1ocp s ARG 8 CO 0.30 -1.62 2.02 1.63 -0.68 0.00 0.00 175.30 176.96 1ocp n LYS 9 N -3.06 2.42 -0.00 3.54 5.02 -1.26 -4.46 118.16 120.35 1ocp n LYS 9 Ca 0.13 -2.78 -0.21 0.00 -2.02 0.00 0.00 58.31 53.43 1ocp n LYS 9 Cb 0.60 -2.09 -0.14 0.00 -0.02 0.00 0.00 35.03 33.39 1ocp n LYS 9 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 1ocp h ARG 10 N 1.81 0.22 0.00 1.97 9.65 -2.00 -3.47 114.38 122.57 1ocp h ARG 10 Ca 0.52 -0.38 -0.31 0.00 -1.10 0.00 0.00 59.98 58.71 1ocp h ARG 10 Cb 0.90 0.14 0.12 0.00 -1.39 0.00 0.00 29.97 29.74 1ocp h ARG 10 CO 1.34 1.18 0.27 1.63 2.80 0.00 0.00 179.97 187.20 1ocp n LYS 11 N -3.98 -0.81 -0.04 0.20 4.76 -1.26 -5.01 118.16 112.01 1ocp n LYS 11 Ca -0.24 -1.50 0.04 0.00 -2.87 0.00 0.00 58.31 53.74 1ocp n LYS 11 Cb 0.87 -0.91 0.06 0.00 -1.84 0.00 0.00 35.03 33.21 1ocp n LYS 11 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 1ocp n ARG 12 N -2.91 2.09 0.13 1.97 -4.01 -1.26 -4.64 116.66 108.03 1ocp n ARG 12 Ca 0.12 -1.90 0.01 0.00 -1.04 0.00 0.00 57.85 55.04 1ocp n ARG 12 Cb 0.41 -1.18 0.01 0.00 -3.04 0.00 0.00 32.46 28.67 1ocp n ARG 12 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1ocp h THR 13 N 0.31 1.03 -1.41 8.89 1.03 -1.95 -3.44 112.91 117.37 1ocp h THR 13 Ca 0.00 -2.42 0.00 0.00 -0.01 0.00 0.00 66.41 63.98 1ocp h THR 13 Cb 0.75 2.48 0.00 0.00 -1.07 0.00 0.00 68.15 70.31 1ocp h THR 13 CO 0.00 0.58 0.00 -1.54 -0.01 0.00 0.00 175.52 174.55 1ocp n SER 14 N -3.27 0.00 -4.48 0.00 3.41 -1.26 -4.10 113.62 103.92 1ocp n SER 14 Ca 0.01 -0.34 -0.43 0.00 -0.26 0.00 0.00 58.87 57.85 1ocp n SER 14 Cb 0.76 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.70 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 -0.27 4.63 0.55 -1.33 -1.09 -1.26 -4.88 121.20 117.54 1ocp s ILE 15 Ca 0.00 -1.79 -0.19 0.00 -2.23 0.00 0.00 60.65 56.43 1ocp s ILE 15 Cb 0.00 -4.90 -0.06 0.00 -1.58 0.00 0.00 42.46 35.92 1ocp s ILE 15 CO 0.00 -1.66 1.13 -0.70 -1.23 0.00 0.00 174.94 172.48 1ocp s GLU 16 N 2.88 3.34 0.64 2.79 2.56 -1.26 -4.85 118.70 124.79 1ocp s GLU 16 Ca 0.40 1.60 0.38 0.00 0.00 0.00 0.00 54.97 57.36 1ocp s GLU 16 Cb -0.03 -2.00 2.17 0.00 2.00 0.00 0.00 34.13 36.27 1ocp s GLU 16 CO -0.05 -0.86 2.32 -0.97 -0.56 0.00 0.00 175.26 175.14 1ocp h ASN 17 N 1.17 0.00 0.73 -1.70 -1.24 -2.00 0.06 115.58 112.60 1ocp h ASN 17 Ca -0.50 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.28 1ocp h ASN 17 Cb 1.26 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.27 1ocp h ASN 17 CO 0.57 0.00 -1.39 0.03 -1.29 0.00 0.00 177.43 175.35 1ocp h ARG 18 N 0.00 0.00 -0.37 6.67 3.08 -1.99 -3.27 114.38 118.51 1ocp h ARG 18 Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.99 1ocp h ARG 18 Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1ocp h ARG 18 CO -0.00 0.54 -0.03 -0.24 -1.07 0.00 0.00 179.97 179.16 1ocp h VAL 19 N 0.00 1.27 0.37 2.04 3.04 -1.34 0.16 116.25 121.78 1ocp h VAL 19 Ca -0.18 -1.05 -0.02 0.00 -1.01 0.00 0.00 66.70 64.45 1ocp h VAL 19 Cb 1.80 1.22 0.00 0.00 -2.01 0.00 0.00 31.29 32.30 1ocp h VAL 19 CO 0.08 0.35 -0.18 -0.09 -1.01 0.00 0.00 177.57 176.72 1ocp h ARG 20 N 0.47 -0.48 0.00 4.17 2.43 -1.57 -0.55 114.38 118.86 1ocp h ARG 20 Ca 0.10 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1ocp h ARG 20 Cb 0.51 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1ocp h ARG 20 CO 0.02 -0.27 0.00 0.91 -1.51 0.00 0.00 179.97 179.12 1ocp n TRP 21 N -5.27 0.00 0.06 2.20 5.03 -1.21 -1.22 117.44 117.02 1ocp n TRP 21 Ca -0.11 0.00 -0.12 0.00 3.03 0.00 0.00 57.50 60.30 1ocp n TRP 21 Cb 0.23 -0.47 -0.03 0.00 -1.03 0.00 0.00 31.31 30.02 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 0.53 -0.59 -0.99 0.87 0.35 -2.25 113.55 111.47 1ocp h SER 22 Ca 0.00 -0.40 0.05 0.00 -1.23 0.00 0.00 61.79 60.21 1ocp h SER 22 Cb 0.30 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 62.05 1ocp h SER 22 CO 0.00 1.18 0.32 -0.07 -0.53 0.00 0.00 176.83 177.73 1ocp h LEU 23 N 0.26 0.48 -0.47 2.23 3.38 0.31 -1.47 115.31 120.02 1ocp h LEU 23 Ca -0.06 0.03 0.05 0.00 0.09 0.00 0.00 57.88 57.98 1ocp h LEU 23 Cb 1.49 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 42.13 1ocp h LEU 23 CO 0.15 0.32 0.21 -0.08 0.09 0.00 0.00 178.44 179.13 1ocp h GLU 24 N 0.61 0.41 0.00 1.13 4.81 -1.27 -0.85 114.58 119.41 1ocp h GLU 24 Ca 0.26 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1ocp h GLU 24 Cb 0.14 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 1ocp h GLU 24 CO -0.16 0.27 -0.06 1.79 -0.73 0.00 0.00 179.01 180.12 1ocp h THR 25 N 0.42 0.60 0.00 0.32 1.35 -0.69 -1.37 112.91 113.54 1ocp h THR 25 Ca 0.21 -0.24 -0.13 0.00 -0.55 0.00 0.00 66.41 65.70 1ocp h THR 25 Cb 0.16 1.15 -0.02 0.00 -1.73 0.00 0.00 68.15 67.71 1ocp h THR 25 CO -0.18 0.06 -1.22 0.24 -0.25 0.00 0.00 175.52 174.17 1ocp h MET 26 N 0.00 0.00 0.00 4.72 2.86 -0.60 -3.35 114.93 118.56 1ocp h MET 26 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1ocp h MET 26 Cb 0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.81 1ocp h MET 26 CO 0.01 0.26 -0.76 1.19 1.06 0.00 0.00 176.91 178.67 1ocp n PHE 27 N -2.90 0.30 0.21 -0.22 3.72 -0.45 -3.94 117.46 114.18 1ocp n PHE 27 Ca -0.07 0.09 0.04 0.00 -0.05 0.00 0.00 57.45 57.46 1ocp n PHE 27 Cb 0.78 -0.46 0.19 0.00 -0.94 0.00 0.00 39.48 39.05 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 -1.90 3.08 -0.13 4.37 4.77 -0.57 -3.91 117.00 122.71 1ocp n LEU 28 Ca 0.03 -1.56 -0.21 0.00 -0.03 0.00 0.00 56.01 54.24 1ocp n LEU 28 Cb 0.41 -0.53 -0.11 0.00 -2.33 0.00 0.00 43.42 40.86 1ocp n LEU 28 CO 0.38 0.44 -1.38 2.29 -1.33 0.00 0.00 177.39 177.79 1ocp n LYS 29 N 0.35 0.63 -3.85 3.23 2.85 -1.25 -4.98 118.16 115.14 1ocp n LYS 29 Ca 0.13 0.18 -0.12 0.00 -1.05 0.00 0.00 58.31 57.45 1ocp n LYS 29 Cb 0.64 -1.51 -0.13 0.00 -0.65 0.00 0.00 35.03 33.38 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 3.07 2.21 -2.95 0.00 -0.04 -1.26 -4.37 135.00 131.66 1ocp n PRO 31 Ca -0.12 -1.07 -0.25 0.00 -0.04 0.00 0.00 63.50 62.02 1ocp n PRO 31 Cb 0.59 -1.65 -0.03 0.00 -0.04 0.00 0.00 33.50 32.37 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 0.23 2.76 -2.47 0.54 2.85 -1.26 -5.07 118.16 115.75 1ocp n LYS 32 Ca 0.10 -4.51 -0.42 0.00 -1.05 0.00 0.00 58.31 52.42 1ocp n LYS 32 Cb 0.51 -2.11 -0.03 0.00 -0.65 0.00 0.00 35.03 32.74 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 -3.27 4.41 0.49 -1.58 0.04 -1.26 -5.00 135.00 128.84 1ocp s PRO 33 Ca 0.47 1.70 -0.21 0.00 0.04 0.00 0.00 61.00 62.99 1ocp s PRO 33 Cb 0.31 -3.44 -0.07 0.00 0.04 0.00 0.00 34.50 31.34 1ocp s PRO 33 CO -0.13 -0.31 1.12 -1.12 0.04 0.00 0.00 177.00 176.61 1ocp s SER 34 N 1.22 6.07 0.53 6.66 0.01 -1.26 -4.89 113.70 122.03 1ocp s SER 34 Ca 0.57 2.17 0.22 0.00 1.31 0.00 0.00 55.95 60.22 1ocp s SER 34 Cb -0.27 -2.59 1.42 0.00 0.21 0.00 0.00 66.02 64.80 1ocp s SER 34 CO 0.26 -0.98 2.14 -0.07 0.41 0.00 0.00 173.24 175.01 1ocp h LEU 35 N 1.68 0.00 -0.49 2.44 4.07 -1.99 0.27 115.31 121.28 1ocp h LEU 35 Ca -0.50 0.00 -0.15 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 42.98 1ocp h LEU 35 CO 0.59 0.05 -0.36 -0.61 -1.08 0.00 0.00 178.44 177.03 1ocp h GLN 36 N 0.00 0.85 0.00 1.13 4.15 -2.00 -1.95 115.11 117.28 1ocp h GLN 36 Ca -0.00 -0.42 -0.03 0.00 0.77 0.00 0.00 58.65 58.96 1ocp h GLN 36 Cb 0.11 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.80 1ocp h GLN 36 CO 0.01 1.07 -0.16 0.37 -1.93 0.00 0.00 178.83 178.18 1ocp h GLN 37 N 0.70 0.00 -0.01 1.69 4.15 -0.87 -0.47 115.11 120.31 1ocp h GLN 37 Ca 0.06 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.35 1ocp h GLN 37 Cb 0.92 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.60 1ocp h GLN 37 CO 0.09 0.16 -0.64 0.82 -1.93 0.00 0.00 178.83 177.33 1ocp h ILE 38 N 0.00 1.44 -0.45 2.39 1.08 -0.48 -0.48 117.51 121.02 1ocp h ILE 38 Ca -0.00 -2.15 -0.04 0.00 -0.39 0.00 0.00 64.86 62.28 1ocp h ILE 38 Cb 0.30 2.15 -0.02 0.00 -3.07 0.00 0.00 36.82 36.18 1ocp h ILE 38 CO 0.02 0.62 0.15 0.74 -0.69 0.00 0.00 178.15 178.99 1ocp h THR 39 N 0.03 1.22 0.00 -0.27 2.02 -0.55 -1.35 112.91 114.02 1ocp h THR 39 Ca -0.01 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.42 1ocp h THR 39 Cb 1.13 0.84 -0.00 0.00 -1.74 0.00 0.00 68.15 68.38 1ocp h THR 39 CO 0.09 0.26 -0.10 0.45 0.37 0.00 0.00 175.52 176.59 1ocp h HIS 40 N 0.60 0.00 -0.15 3.16 3.86 -1.21 -2.81 115.15 118.60 1ocp h HIS 40 Ca 0.15 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.32 1ocp h HIS 40 Cb 0.26 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.72 1ocp h HIS 40 CO 0.01 0.10 -0.05 0.82 0.86 0.00 0.00 177.93 179.67 1ocp h ILE 41 N 0.00 1.30 0.25 2.45 5.03 0.01 0.32 117.51 126.86 1ocp h ILE 41 Ca -0.00 -1.03 -0.01 0.00 -0.12 0.00 0.00 64.86 63.69 1ocp h ILE 41 Cb 0.66 1.67 0.00 0.00 -3.03 0.00 0.00 36.82 36.12 1ocp h ILE 41 CO 0.01 0.30 -0.12 0.00 -0.68 0.00 0.00 178.15 177.66 1ocp h ALA 42 N 0.69 -0.34 0.00 1.87 0.00 -1.23 -0.11 119.26 120.15 1ocp h ALA 42 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ocp h ALA 42 Cb 0.49 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1ocp h ALA 42 CO 0.02 -0.63 0.00 -0.91 0.00 0.00 0.00 179.25 177.73 1ocp h ASN 43 N -0.46 0.00 0.56 0.00 4.21 -1.51 0.35 115.58 118.73 1ocp h ASN 43 Ca -0.03 0.00 -0.19 0.00 1.21 0.00 0.00 56.30 57.28 1ocp h ASN 43 Cb 0.35 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.53 1ocp h ASN 43 CO 0.06 0.00 -0.84 1.56 -1.29 0.00 0.00 177.43 176.91 1ocp h GLN 44 N 0.00 0.20 0.00 0.81 1.08 0.15 -3.34 115.11 114.01 1ocp h GLN 44 Ca 0.00 -0.21 0.00 0.00 -1.45 0.00 0.00 58.65 56.99 1ocp h GLN 44 Cb 0.15 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 1ocp h GLN 44 CO 0.00 0.93 -0.14 1.47 -0.95 0.00 0.00 178.83 180.14 1ocp n LEU 45 N -3.68 1.56 -1.91 1.46 -0.00 -0.68 -5.00 117.00 108.75 1ocp n LEU 45 Ca -0.03 -2.29 -0.14 0.00 -0.00 0.00 0.00 56.01 53.55 1ocp n LEU 45 Cb 0.78 -0.26 -0.03 0.00 -0.00 0.00 0.00 43.42 43.91 1ocp n LEU 45 CO 0.47 0.53 -0.16 0.61 -0.00 0.00 0.00 177.39 178.85 1ocp n GLY 46 N -0.90 0.43 4.03 1.47 0.00 0.11 -4.56 105.19 105.78 1ocp n GLY 46 Ca 0.10 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.92 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 -4.77 3.12 0.75 0.99 2.34 -1.14 -4.92 118.68 115.04 1ocp s LEU 47 Ca 0.00 -0.82 -0.02 0.00 0.06 0.00 0.00 54.13 53.36 1ocp s LEU 47 Cb 0.00 -1.68 0.14 0.00 -0.56 0.00 0.00 46.19 44.09 1ocp s LEU 47 CO 0.00 -1.34 1.03 -1.83 -1.06 0.00 0.00 176.35 173.15 1ocp s GLU 48 N -4.67 1.55 0.00 1.48 1.03 -1.26 -4.70 118.70 112.13 1ocp s GLU 48 Ca 0.62 -1.12 0.29 0.00 0.03 0.00 0.00 54.97 54.79 1ocp s GLU 48 Cb -0.06 -2.30 1.28 0.00 -0.80 0.00 0.00 34.13 32.25 1ocp s GLU 48 CO 0.39 -1.56 1.89 1.17 -1.33 0.00 0.00 175.26 175.82 1ocp n LYS 49 N -2.92 0.83 0.06 -4.83 4.81 -1.26 -3.07 118.16 111.79 1ocp n LYS 49 Ca 0.16 -0.29 -0.21 0.00 -0.87 0.00 0.00 58.31 57.10 1ocp n LYS 49 Cb 0.61 -1.49 -0.15 0.00 0.02 0.00 0.00 35.03 34.02 1ocp n LYS 49 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1ocp h ASP 50 N 0.71 0.53 1.15 3.14 3.32 -1.98 -2.45 116.42 120.84 1ocp h ASP 50 Ca 0.00 -0.84 -0.14 0.00 0.02 0.00 0.00 57.03 56.07 1ocp h ASP 50 Cb 0.33 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 1ocp h ASP 50 CO 0.00 1.71 -0.89 1.62 -1.72 0.00 0.00 179.24 179.96 1ocp h VAL 51 N 0.09 0.86 -0.00 -1.35 3.04 -1.97 -2.39 116.25 114.52 1ocp h VAL 51 Ca -0.34 -2.32 -0.22 0.00 -1.01 0.00 0.00 66.70 62.81 1ocp h VAL 51 Cb 2.07 2.35 0.00 0.00 -2.01 0.00 0.00 31.29 33.71 1ocp h VAL 51 CO 0.16 0.49 -0.93 1.62 -1.01 0.00 0.00 177.57 177.90 1ocp h VAL 52 N 0.00 1.40 0.06 1.51 3.04 -1.67 -2.79 116.25 117.80 1ocp h VAL 52 Ca -0.06 -2.43 -0.24 0.00 -1.01 0.00 0.00 66.70 62.96 1ocp h VAL 52 Cb 1.52 2.40 -0.01 0.00 -2.01 0.00 0.00 31.29 33.19 1ocp h VAL 52 CO 0.07 0.73 -1.08 -0.09 -1.01 0.00 0.00 177.57 176.18 1ocp h ARG 53 N 0.24 0.20 -0.21 4.17 1.12 -1.49 -2.63 114.38 115.78 1ocp h ARG 53 Ca -0.08 -0.29 -0.05 0.00 -1.11 0.00 0.00 59.98 58.45 1ocp h ARG 53 Cb 1.57 0.10 -0.01 0.00 -0.01 0.00 0.00 29.97 31.62 1ocp h ARG 53 CO 0.16 1.10 -0.06 0.28 -3.11 0.00 0.00 179.97 178.34 1ocp h VAL 54 N 0.07 1.29 -0.71 0.20 2.07 -1.47 0.29 116.25 117.99 1ocp h VAL 54 Ca -0.08 -1.07 -0.06 0.00 0.82 0.00 0.00 66.70 66.32 1ocp h VAL 54 Cb 1.79 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 33.09 1ocp h VAL 54 CO 0.17 0.33 0.23 -0.25 0.02 0.00 0.00 177.57 178.06 1ocp h TRP 55 N 0.13 1.14 -0.00 1.57 7.01 -1.58 -2.07 115.95 122.15 1ocp h TRP 55 Ca 0.05 -0.11 0.00 0.00 2.11 0.00 0.00 58.89 60.94 1ocp h TRP 55 Cb 0.52 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 27.25 1ocp h TRP 55 CO 0.05 0.91 -0.04 0.34 -2.79 0.00 0.00 178.44 176.91 1ocp n PHE 56 N -4.29 0.00 0.04 2.65 7.35 -0.99 -1.91 117.46 120.31 1ocp n PHE 56 Ca 0.05 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.61 1ocp n PHE 56 Cb 0.22 -0.24 -0.02 0.00 0.35 0.00 0.00 39.48 39.79 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 0.32 0.38 0.66 0.00 -1.24 -1.49 -2.66 115.58 111.55 1ocp h ASN 58 Ca -0.06 -0.47 -0.02 0.00 0.71 0.00 0.00 56.30 56.45 1ocp h ASN 58 Cb 1.44 -0.12 -0.00 0.00 0.73 0.00 0.00 38.32 40.36 1ocp h ASN 58 CO 0.15 1.39 -0.12 -0.09 -1.29 0.00 0.00 177.43 177.47 1ocp h ARG 59 N 0.07 0.00 0.01 6.67 1.12 -1.35 -2.28 114.38 118.62 1ocp h ARG 59 Ca -0.20 0.00 -0.27 0.00 -1.11 0.00 0.00 59.98 58.41 1ocp h ARG 59 Cb 1.99 0.00 -0.04 0.00 -0.01 0.00 0.00 29.97 31.91 1ocp h ARG 59 CO 0.17 0.12 -1.46 0.00 -3.11 0.00 0.00 179.97 175.69 1ocp h ARG 60 N 0.00 0.02 -2.18 0.20 3.08 -1.14 -3.37 114.38 110.99 1ocp h ARG 60 Ca -0.00 -0.03 -0.66 0.00 0.07 0.00 0.00 59.98 59.36 1ocp h ARG 60 Cb 0.48 0.01 -0.37 0.00 0.08 0.00 0.00 29.97 30.17 1ocp h ARG 60 CO 0.02 0.71 -0.11 1.04 -1.07 0.00 0.00 179.97 180.55 1ocp n GLN 61 N -3.18 3.84 0.14 0.04 1.13 -0.89 -4.76 117.38 113.69 1ocp n GLN 61 Ca -0.11 -4.71 0.02 0.00 -1.94 0.00 0.00 57.00 50.25 1ocp n GLN 61 Cb 1.01 -2.30 0.07 0.00 0.11 0.00 0.00 30.24 29.13 1ocp n GLN 61 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1ocp h LYS 62 N 3.27 0.00 0.00 -1.09 1.57 -1.63 -3.45 116.57 115.23 1ocp h LYS 62 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1ocp h LYS 62 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1ocp h LYS 62 CO 0.95 0.54 0.00 0.41 -0.57 0.00 0.00 179.45 180.78 1ocp n GLY 63 N 1.02 -0.36 0.95 3.86 0.00 -1.26 -5.05 105.19 104.35 1ocp n GLY 63 Ca 0.01 0.09 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 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 2.03 -2.67 1.61 5.02 -1.26 -4.72 118.16 118.16 1ocp n LYS 64 Ca 0.00 -3.48 -0.09 0.00 -2.02 0.00 0.00 58.31 52.72 1ocp n LYS 64 Cb 0.00 -1.74 0.03 0.00 -0.02 0.00 0.00 35.03 33.30 1ocp n LYS 64 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1ocp n ARG 65 N -0.99 1.34 -0.04 1.97 5.12 -1.26 -4.85 116.66 117.95 1ocp n ARG 65 Ca 0.24 -3.35 -0.04 0.00 -1.93 0.00 0.00 57.85 52.77 1ocp n ARG 65 Cb 0.76 -1.35 -0.07 0.00 -1.16 0.00 0.00 32.46 30.65 1ocp n ARG 65 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1ocp n SER 66 N -0.16 2.84 0.00 0.55 7.64 -1.26 -5.24 113.62 117.98 1ocp n SER 66 Ca 0.10 -0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.98 1ocp n SER 66 Cb 0.81 0.69 0.00 0.00 -1.01 0.00 0.00 64.21 64.70 1ocp n SER 66 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79