#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 0.51 -1.59 2.12 4.07 -1.26 -5.12 120.64 119.37 1ocp n GLU 2 Ca 0.00 -3.19 -0.20 0.00 -0.06 0.00 0.00 57.16 53.71 1ocp n GLU 2 Cb 0.00 -1.38 0.13 0.00 -0.06 0.00 0.00 31.44 30.13 1ocp n GLU 2 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1ocp n THR 3 N 1.95 0.00 -3.18 6.31 -2.24 -1.26 -5.05 114.28 110.80 1ocp n THR 3 Ca 0.24 -0.85 -0.20 0.00 -2.27 0.00 0.00 64.05 60.97 1ocp n THR 3 Cb 0.51 -1.45 -0.04 0.00 -2.10 0.00 0.00 70.33 67.25 1ocp n THR 3 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ocp n LEU 4 N 0.00 0.53 -3.01 3.22 -0.00 -1.26 -5.00 117.00 111.48 1ocp n LEU 4 Ca 0.12 -4.86 -0.08 0.00 -0.00 0.00 0.00 56.01 51.19 1ocp n LEU 4 Cb 0.42 0.69 -0.02 0.00 -0.00 0.00 0.00 43.42 44.52 1ocp n LEU 4 CO 0.30 2.20 0.02 0.54 -0.00 0.00 0.00 177.39 180.46 1ocp s VAL 5 N -1.90 -0.74 -0.44 1.47 0.11 -1.26 -5.10 120.40 112.54 1ocp s VAL 5 Ca 0.38 -1.01 -0.06 0.00 -2.93 0.00 0.00 61.98 58.35 1ocp s VAL 5 Cb 0.28 -0.25 0.11 0.00 -1.53 0.00 0.00 36.38 35.00 1ocp s VAL 5 CO -0.09 -0.24 0.27 0.00 -3.33 0.00 0.00 175.10 171.72 1ocp s GLN 6 N 1.03 2.25 0.00 1.54 -2.07 -1.26 -5.08 119.66 116.06 1ocp s GLN 6 Ca 0.26 -1.78 0.00 0.00 -1.82 0.00 0.00 55.36 52.02 1ocp s GLN 6 Cb -0.02 -3.76 0.00 0.00 -1.09 0.00 0.00 33.01 28.14 1ocp s GLN 6 CO -0.07 -1.13 0.00 0.00 -1.32 0.00 0.00 175.29 172.77 1ocp n ALA 7 N 4.76 0.00 -2.20 2.60 0.00 -1.26 -4.99 120.51 119.41 1ocp n ALA 7 Ca -0.05 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.41 1ocp n ALA 7 Cb 0.41 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.88 1ocp n ALA 7 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1ocp n ARG 8 N -0.05 0.07 -0.72 0.00 1.85 -1.26 -4.82 116.66 111.72 1ocp n ARG 8 Ca 0.00 -1.55 -0.00 0.00 -1.00 0.00 0.00 57.85 55.30 1ocp n ARG 8 Cb 0.00 -0.32 -0.00 0.00 -1.05 0.00 0.00 32.46 31.09 1ocp n ARG 8 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1ocp n LYS 9 N 0.17 0.00 -2.60 2.89 4.76 -1.26 -4.91 118.16 117.21 1ocp n LYS 9 Ca 0.04 -0.86 -0.02 0.00 -2.87 0.00 0.00 58.31 54.60 1ocp n LYS 9 Cb 0.91 -0.16 0.12 0.00 -1.84 0.00 0.00 35.03 34.06 1ocp n LYS 9 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 1ocp n ARG 10 N 0.08 1.29 -2.54 1.97 1.85 -1.26 -5.06 116.66 113.00 1ocp n ARG 10 Ca -0.02 -1.15 -0.41 0.00 -1.00 0.00 0.00 57.85 55.27 1ocp n ARG 10 Cb 0.71 0.41 -0.02 0.00 -1.05 0.00 0.00 32.46 32.51 1ocp n ARG 10 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1ocp s LYS 11 N 0.12 3.69 -0.52 2.89 1.02 -1.26 -4.79 119.74 120.90 1ocp s LYS 11 Ca 0.08 -1.45 0.07 0.00 0.02 0.00 0.00 55.97 54.70 1ocp s LYS 11 Cb 0.42 -5.42 0.33 0.00 -0.52 0.00 0.00 37.83 32.65 1ocp s LYS 11 CO -0.12 -2.31 0.85 2.89 -0.92 0.00 0.00 175.35 175.74 1ocp n ARG 12 N 8.68 2.42 -0.04 1.68 1.85 -1.26 -4.82 116.66 125.17 1ocp n ARG 12 Ca 0.40 -4.35 -0.10 0.00 -1.00 0.00 0.00 57.85 52.80 1ocp n ARG 12 Cb 0.49 -2.05 -0.14 0.00 -1.05 0.00 0.00 32.46 29.71 1ocp n ARG 12 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1ocp n THR 13 N 0.05 1.58 -3.36 8.89 -1.04 -1.26 -4.84 114.28 114.30 1ocp n THR 13 Ca 0.29 -0.79 0.00 0.00 -2.04 0.00 0.00 64.05 61.51 1ocp n THR 13 Cb 0.48 -1.00 0.00 0.00 -1.82 0.00 0.00 70.33 67.99 1ocp n THR 13 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1ocp n SER 14 N -3.03 0.81 -4.56 8.00 3.41 -1.26 -4.63 113.62 112.36 1ocp n SER 14 Ca -0.22 -0.96 -0.41 0.00 -0.26 0.00 0.00 58.87 57.02 1ocp n SER 14 Cb 1.07 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.99 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 0.25 3.93 0.51 -1.33 -1.09 -1.26 -4.96 121.20 117.24 1ocp s ILE 15 Ca 0.00 -0.83 -0.20 0.00 -2.23 0.00 0.00 60.65 57.39 1ocp s ILE 15 Cb 0.00 -5.06 -0.07 0.00 -1.58 0.00 0.00 42.46 35.75 1ocp s ILE 15 CO 0.00 -1.93 1.08 -0.70 -1.23 0.00 0.00 174.94 172.15 1ocp s GLU 16 N 4.95 3.61 0.64 2.79 2.12 -1.26 -4.86 118.70 126.68 1ocp s GLU 16 Ca 0.47 1.46 0.37 0.00 0.36 0.00 0.00 54.97 57.63 1ocp s GLU 16 Cb 0.00 -2.06 2.08 0.00 0.26 0.00 0.00 34.13 34.42 1ocp s GLU 16 CO -0.09 -0.61 2.26 -0.97 -0.54 0.00 0.00 175.26 175.32 1ocp h ASN 17 N 1.39 0.00 0.69 -1.70 -0.73 -2.01 0.35 115.58 113.58 1ocp h ASN 17 Ca -0.50 0.00 -0.26 0.00 1.87 0.00 0.00 56.30 57.41 1ocp h ASN 17 Cb 1.24 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.79 1ocp h ASN 17 CO 0.58 0.00 -1.38 0.03 -0.37 0.00 0.00 177.43 176.29 1ocp h ARG 18 N 0.00 0.04 -0.35 6.67 -0.00 -1.98 -3.21 114.38 115.55 1ocp h ARG 18 Ca 0.01 -0.07 -0.04 0.00 -0.50 0.00 0.00 59.98 59.37 1ocp h ARG 18 Cb 0.14 0.03 -0.01 0.00 0.00 0.00 0.00 29.97 30.12 1ocp h ARG 18 CO -0.00 0.81 0.05 -0.24 0.00 0.00 0.00 179.97 180.59 1ocp h VAL 19 N 0.01 1.24 0.14 2.04 3.04 -1.29 0.13 116.25 121.56 1ocp h VAL 19 Ca -0.16 -0.86 -0.01 0.00 -1.01 0.00 0.00 66.70 64.66 1ocp h VAL 19 Cb 1.91 1.12 0.00 0.00 -2.01 0.00 0.00 31.29 32.31 1ocp h VAL 19 CO 0.11 0.29 -0.07 0.03 -1.01 0.00 0.00 177.57 176.92 1ocp h ARG 20 N 0.42 -0.19 0.00 4.17 3.08 -1.55 -1.03 114.38 119.29 1ocp h ARG 20 Ca 0.11 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1ocp h ARG 20 Cb 0.37 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1ocp h ARG 20 CO 0.01 -0.06 0.00 0.91 -1.07 0.00 0.00 179.97 179.76 1ocp n TRP 21 N -5.14 0.00 0.06 3.04 5.03 -1.20 -1.59 117.44 117.64 1ocp n TRP 21 Ca -0.09 0.00 -0.17 0.00 3.03 0.00 0.00 57.50 60.27 1ocp n TRP 21 Cb 0.13 -0.39 -0.08 0.00 -1.03 0.00 0.00 31.31 29.94 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 0.74 -0.49 -0.99 0.87 0.23 -2.92 113.55 111.00 1ocp h SER 22 Ca 0.00 -0.60 0.06 0.00 -1.23 0.00 0.00 61.79 60.02 1ocp h SER 22 Cb 0.29 -0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 61.97 1ocp h SER 22 CO 0.00 1.40 0.21 -0.07 -0.53 0.00 0.00 176.83 177.83 1ocp h LEU 23 N 0.31 0.25 -0.67 2.23 3.38 -0.21 -1.92 115.31 118.68 1ocp h LEU 23 Ca -0.11 0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.02 1ocp h LEU 23 Cb 1.66 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 42.33 1ocp h LEU 23 CO 0.19 0.18 0.25 -0.08 0.09 0.00 0.00 178.44 179.07 1ocp h GLU 24 N 0.40 0.41 -0.13 1.13 4.81 -1.36 -0.67 114.58 119.18 1ocp h GLU 24 Ca 0.23 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.36 1ocp h GLU 24 Cb 0.19 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1ocp h GLU 24 CO -0.20 0.27 -0.23 1.15 -0.73 0.00 0.00 179.01 179.28 1ocp h THR 25 N 0.42 1.22 0.00 0.32 2.02 -1.18 -1.12 112.91 114.59 1ocp h THR 25 Ca 0.35 -1.03 -0.16 0.00 0.77 0.00 0.00 66.41 66.34 1ocp h THR 25 Cb 0.48 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.24 1ocp h THR 25 CO -0.35 0.31 -0.75 0.24 0.37 0.00 0.00 175.52 175.35 1ocp h MET 26 N 0.21 0.00 0.00 6.66 2.86 -0.75 -3.26 114.93 120.65 1ocp h MET 26 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1ocp h MET 26 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1ocp h MET 26 CO 0.04 0.75 -1.00 1.19 1.06 0.00 0.00 176.91 178.94 1ocp n PHE 27 N -3.51 0.64 1.24 -0.22 3.72 -0.54 -4.00 117.46 114.80 1ocp n PHE 27 Ca -0.00 0.19 0.12 0.00 -0.05 0.00 0.00 57.45 57.71 1ocp n PHE 27 Cb 0.76 -0.74 0.40 0.00 -0.94 0.00 0.00 39.48 38.96 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 -2.35 1.85 -0.11 4.37 4.77 -0.45 -4.04 117.00 121.03 1ocp n LEU 28 Ca 0.01 -0.71 -0.15 0.00 -0.03 0.00 0.00 56.01 55.14 1ocp n LEU 28 Cb 0.50 -0.07 -0.14 0.00 -2.33 0.00 0.00 43.42 41.39 1ocp n LEU 28 CO 0.40 0.35 -1.23 2.29 -1.33 0.00 0.00 177.39 177.87 1ocp n LYS 29 N 0.44 0.67 -3.70 3.23 2.85 -1.23 -4.92 118.16 115.49 1ocp n LYS 29 Ca 0.17 0.09 -0.18 0.00 -1.05 0.00 0.00 58.31 57.34 1ocp n LYS 29 Cb 0.38 -1.53 -0.17 0.00 -0.65 0.00 0.00 35.03 33.06 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 4.95 1.67 -2.39 0.00 -0.04 -1.26 -4.45 135.00 133.48 1ocp n PRO 31 Ca -0.11 -1.33 -0.22 0.00 -0.04 0.00 0.00 63.50 61.80 1ocp n PRO 31 Cb 0.50 -1.52 0.01 0.00 -0.04 0.00 0.00 33.50 32.45 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 0.41 3.07 -2.68 0.54 2.85 -1.26 -5.06 118.16 116.03 1ocp n LYS 32 Ca 0.26 -4.17 -0.41 0.00 -1.05 0.00 0.00 58.31 52.94 1ocp n LYS 32 Cb 0.63 -2.08 -0.05 0.00 -0.65 0.00 0.00 35.03 32.88 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 -3.53 4.71 0.25 -1.58 0.04 -1.26 -5.04 135.00 128.59 1ocp s PRO 33 Ca 0.45 1.53 -0.11 0.00 0.04 0.00 0.00 61.00 62.91 1ocp s PRO 33 Cb 0.40 -3.33 -0.08 0.00 0.04 0.00 0.00 34.50 31.54 1ocp s PRO 33 CO -0.08 0.25 0.60 -1.12 0.04 0.00 0.00 177.00 176.69 1ocp s SER 34 N -0.29 6.67 0.62 6.66 0.01 -1.26 -4.94 113.70 121.17 1ocp s SER 34 Ca 0.46 1.02 0.35 0.00 1.31 0.00 0.00 55.95 59.10 1ocp s SER 34 Cb -0.26 -2.27 2.05 0.00 0.21 0.00 0.00 66.02 65.76 1ocp s SER 34 CO 0.32 -0.11 2.30 -0.07 0.41 0.00 0.00 173.24 176.09 1ocp h LEU 35 N 2.48 0.00 -0.17 2.44 4.07 -1.99 0.25 115.31 122.39 1ocp h LEU 35 Ca -0.47 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.26 1ocp h LEU 35 Cb 1.17 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.92 1ocp h LEU 35 CO 0.68 0.00 -0.85 -0.61 -1.08 0.00 0.00 178.44 176.58 1ocp h GLN 36 N 0.00 0.67 0.00 1.13 -0.00 -2.00 -2.70 115.11 112.20 1ocp h GLN 36 Ca -0.00 -0.60 0.00 0.00 -0.00 0.00 0.00 58.65 58.05 1ocp h GLN 36 Cb 0.00 0.14 0.00 0.00 0.00 0.00 0.00 27.48 27.62 1ocp h GLN 36 CO 0.00 1.21 0.00 0.37 0.00 0.00 0.00 178.83 180.41 1ocp h GLN 37 N 0.43 0.00 0.14 1.69 4.15 -0.95 -2.03 115.11 118.54 1ocp h GLN 37 Ca -0.07 0.00 -0.29 0.00 0.77 0.00 0.00 58.65 59.06 1ocp h GLN 37 Cb 1.48 0.00 0.02 0.00 0.21 0.00 0.00 27.48 29.18 1ocp h GLN 37 CO 0.17 0.00 -1.26 0.82 -1.93 0.00 0.00 178.83 176.63 1ocp h ILE 38 N 0.00 1.38 -0.44 2.39 1.08 -0.79 0.15 117.51 121.28 1ocp h ILE 38 Ca 0.00 -2.74 -0.07 0.00 -0.39 0.00 0.00 64.86 61.65 1ocp h ILE 38 Cb 0.55 2.83 -0.02 0.00 -3.07 0.00 0.00 36.82 37.11 1ocp h ILE 38 CO 0.00 0.82 -0.03 0.74 -0.69 0.00 0.00 178.15 178.99 1ocp h THR 39 N 0.16 1.24 0.00 -0.27 2.02 -1.19 -0.40 112.91 114.47 1ocp h THR 39 Ca -0.17 -1.01 -0.05 0.00 0.77 0.00 0.00 66.41 65.95 1ocp h THR 39 Cb 1.95 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 69.29 1ocp h THR 39 CO 0.22 0.35 -0.24 -0.74 0.37 0.00 0.00 175.52 175.48 1ocp h HIS 40 N 0.69 0.00 -0.52 3.16 -0.00 -1.22 -2.63 115.15 114.63 1ocp h HIS 40 Ca 0.13 0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.44 1ocp h HIS 40 Cb 0.47 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.86 1ocp h HIS 40 CO 0.02 0.24 0.09 0.82 -0.00 0.00 0.00 177.93 179.11 1ocp h ILE 41 N 0.00 1.25 0.46 6.26 5.03 0.10 0.21 117.51 130.83 1ocp h ILE 41 Ca -0.00 -0.93 -0.02 0.00 -0.12 0.00 0.00 64.86 63.78 1ocp h ILE 41 Cb 0.80 0.86 0.00 0.00 -3.03 0.00 0.00 36.82 35.45 1ocp h ILE 41 CO 0.03 0.33 -0.22 0.00 -0.68 0.00 0.00 178.15 177.62 1ocp h ALA 42 N 0.98 -0.62 0.00 1.87 0.00 -1.06 0.41 119.26 120.84 1ocp h ALA 42 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ocp h ALA 42 Cb 0.39 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1ocp h ALA 42 CO 0.01 -0.84 0.00 -0.97 0.00 0.00 0.00 179.25 177.45 1ocp h ASN 43 N -0.63 0.00 0.00 0.00 -1.24 -1.39 -0.54 115.58 111.78 1ocp h ASN 43 Ca -0.06 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.72 1ocp h ASN 43 Cb 0.48 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.54 1ocp h ASN 43 CO 0.10 0.00 -0.87 1.56 -1.29 0.00 0.00 177.43 176.94 1ocp h GLN 44 N 0.00 0.67 -0.12 6.67 7.50 0.15 -3.28 115.11 126.71 1ocp h GLN 44 Ca 0.00 -0.62 0.00 0.00 0.50 0.00 0.00 58.65 58.53 1ocp h GLN 44 Cb 0.15 0.15 0.00 0.00 0.05 0.00 0.00 27.48 27.83 1ocp h GLN 44 CO 0.00 1.22 0.00 1.47 -1.50 0.00 0.00 178.83 180.02 1ocp n LEU 45 N -3.88 2.78 0.00 1.46 -0.00 -0.59 -4.97 117.00 111.81 1ocp n LEU 45 Ca -0.08 -1.16 0.00 0.00 -0.00 0.00 0.00 56.01 54.77 1ocp n LEU 45 Cb 0.79 -0.06 0.00 0.00 -0.00 0.00 0.00 43.42 44.15 1ocp n LEU 45 CO 0.53 0.52 0.00 0.61 -0.00 0.00 0.00 177.39 179.05 1ocp n GLY 46 N 1.12 0.66 0.00 1.47 0.00 -0.30 -4.58 105.19 103.56 1ocp n GLY 46 Ca 0.13 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 0.00 0.00 -4.94 0.99 -0.00 -0.65 -4.90 117.00 107.50 1ocp n LEU 47 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 56.01 55.77 1ocp n LEU 47 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.41 1ocp n LEU 47 CO 0.00 0.00 0.22 -0.70 -0.00 0.00 0.00 177.39 176.91 1ocp s GLU 48 N -0.22 3.43 0.01 1.47 2.12 -1.26 -3.88 118.70 120.37 1ocp s GLU 48 Ca 0.00 -0.31 0.17 0.00 0.36 0.00 0.00 54.97 55.20 1ocp s GLU 48 Cb 0.00 -2.62 0.74 0.00 0.26 0.00 0.00 34.13 32.51 1ocp s GLU 48 CO 0.00 0.05 1.56 1.17 -0.54 0.00 0.00 175.26 177.50 1ocp n LYS 49 N -1.88 0.01 0.08 4.30 0.00 -1.26 -2.82 118.16 116.59 1ocp n LYS 49 Ca -0.03 0.21 -0.10 0.00 0.00 0.00 0.00 58.31 58.39 1ocp n LYS 49 Cb 0.56 -1.52 -0.04 0.00 0.00 0.00 0.00 35.03 34.03 1ocp n LYS 49 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 1ocp h ASP 50 N 0.00 0.28 -0.14 3.14 3.58 -1.95 -1.64 116.42 119.69 1ocp h ASP 50 Ca 0.00 -0.25 -0.17 0.00 0.42 0.00 0.00 57.03 57.04 1ocp h ASP 50 Cb 0.30 -0.09 0.01 0.00 1.72 0.00 0.00 39.33 41.27 1ocp h ASP 50 CO 0.00 1.08 -0.56 1.62 -2.88 0.00 0.00 179.24 178.50 1ocp h VAL 51 N 0.10 1.33 0.00 2.25 3.04 -1.93 -2.62 116.25 118.42 1ocp h VAL 51 Ca -0.06 -1.83 -0.04 0.00 -1.01 0.00 0.00 66.70 63.76 1ocp h VAL 51 Cb 1.61 2.06 -0.01 0.00 -2.01 0.00 0.00 31.29 32.95 1ocp h VAL 51 CO 0.15 0.56 -0.21 1.62 -1.01 0.00 0.00 177.57 178.68 1ocp h VAL 52 N 0.29 0.75 -0.10 1.51 3.04 -1.59 -2.86 116.25 117.29 1ocp h VAL 52 Ca -0.03 -0.86 -0.16 0.00 -1.01 0.00 0.00 66.70 64.63 1ocp h VAL 52 Cb 1.20 1.53 0.01 0.00 -2.01 0.00 0.00 31.29 32.01 1ocp h VAL 52 CO 0.12 0.21 -0.58 -0.09 -1.01 0.00 0.00 177.57 176.22 1ocp h ARG 53 N 0.00 0.56 -0.65 4.17 9.65 -1.08 -1.06 114.38 125.97 1ocp h ARG 53 Ca -0.00 -0.47 -0.02 0.00 -1.10 0.00 0.00 59.98 58.38 1ocp h ARG 53 Cb 0.51 0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 29.17 1ocp h ARG 53 CO 0.03 1.10 0.32 0.28 2.80 0.00 0.00 179.97 184.50 1ocp h VAL 54 N 0.17 1.22 0.00 0.20 2.07 -1.30 0.58 116.25 119.19 1ocp h VAL 54 Ca -0.04 -0.61 -0.08 0.00 0.82 0.00 0.00 66.70 66.78 1ocp h VAL 54 Cb 1.22 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1ocp h VAL 54 CO 0.12 0.25 -0.40 -0.25 0.02 0.00 0.00 177.57 177.31 1ocp h TRP 55 N 0.90 0.00 -0.01 1.57 7.01 -1.54 -2.20 115.95 121.68 1ocp h TRP 55 Ca 0.23 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.23 1ocp h TRP 55 Cb 0.11 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.17 1ocp h TRP 55 CO 0.00 0.40 -0.07 0.34 -2.79 0.00 0.00 178.44 176.32 1ocp n PHE 56 N -3.85 0.00 0.06 2.65 7.35 -0.19 -2.01 117.46 121.47 1ocp n PHE 56 Ca -0.01 0.00 -0.19 0.00 -0.76 0.00 0.00 57.45 56.49 1ocp n PHE 56 Cb 0.46 -0.05 -0.10 0.00 0.35 0.00 0.00 39.48 40.14 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 0.34 0.33 0.95 0.00 -1.07 -1.59 -1.84 115.58 112.71 1ocp h ASN 58 Ca -0.13 -0.39 -0.03 0.00 0.07 0.00 0.00 56.30 55.82 1ocp h ASN 58 Cb 1.71 -0.11 -0.00 0.00 -2.07 0.00 0.00 38.32 37.85 1ocp h ASN 58 CO 0.20 1.32 -0.14 -0.09 0.07 0.00 0.00 177.43 178.79 1ocp h ARG 59 N 0.06 0.00 0.02 4.14 1.12 -1.40 -1.48 114.38 116.83 1ocp h ARG 59 Ca -0.16 0.00 -0.30 0.00 -1.11 0.00 0.00 59.98 58.41 1ocp h ARG 59 Cb 1.96 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 31.87 1ocp h ARG 59 CO 0.17 0.14 -1.76 0.54 -3.11 0.00 0.00 179.97 175.95 1ocp n ARG 60 N -3.30 0.65 -3.21 0.20 1.74 -0.07 -4.41 116.66 108.26 1ocp n ARG 60 Ca 0.00 0.29 -0.26 0.00 -0.77 0.00 0.00 57.85 57.11 1ocp n ARG 60 Cb 0.38 -1.78 -0.06 0.00 -1.02 0.00 0.00 32.46 29.98 1ocp n ARG 60 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1ocp n GLN 61 N -3.09 2.66 0.21 5.56 7.27 -0.69 -4.84 117.38 124.45 1ocp n GLN 61 Ca -0.19 -4.62 0.10 0.00 0.07 0.00 0.00 57.00 52.36 1ocp n GLN 61 Cb 1.05 -2.17 0.24 0.00 2.41 0.00 0.00 30.24 31.77 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 3.63 0.00 0.00 3.69 2.10 -1.48 -3.44 116.57 121.07 1ocp h LYS 62 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 1ocp h LYS 62 Cb 0.62 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.95 1ocp h LYS 62 CO 0.80 0.14 0.00 0.41 -2.00 0.00 0.00 179.45 178.79 1ocp n GLY 63 N 0.88 0.14 0.10 0.07 0.00 -1.26 -5.05 105.19 100.07 1ocp n GLY 63 Ca 0.03 0.15 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 1ocp n GLY 63 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ocp h LYS 64 N 0.00 0.25 -2.57 1.61 3.64 -1.94 -3.43 116.57 114.14 1ocp h LYS 64 Ca 0.00 -0.43 -0.37 0.00 -1.27 0.00 0.00 60.65 58.58 1ocp h LYS 64 Cb 0.00 0.16 -0.37 0.00 -0.41 0.00 0.00 32.23 31.61 1ocp h LYS 64 CO 0.00 1.18 -0.66 0.50 -2.27 0.00 0.00 179.45 178.19 1ocp s ARG 65 N -2.65 0.19 -0.09 1.90 3.00 -1.26 -5.12 118.95 114.93 1ocp s ARG 65 Ca -0.05 0.01 -0.04 0.00 -1.00 0.00 0.00 55.73 54.65 1ocp s ARG 65 Cb 0.07 -1.20 0.05 0.00 0.00 0.00 0.00 34.95 33.87 1ocp s ARG 65 CO 0.87 -0.77 0.19 -1.12 0.00 0.00 0.00 175.30 174.48 1ocp s SER 66 N 2.28 0.09 0.00 -2.12 0.01 -1.26 -5.24 113.70 107.46 1ocp s SER 66 Ca 0.07 0.40 0.31 0.00 1.31 0.00 0.00 55.95 58.04 1ocp s SER 66 Cb -0.15 0.33 1.73 0.00 0.21 0.00 0.00 66.02 68.13 1ocp s SER 66 CO -0.18 -0.19 2.13 -0.24 0.41 0.00 0.00 173.24 175.17