#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 0.00 -3.01 2.12 2.13 -1.26 -5.10 120.64 115.53 1ocp n GLU 2 Ca 0.00 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.52 1ocp n GLU 2 Cb 0.00 -0.30 -0.03 0.00 0.27 0.00 0.00 31.44 31.37 1ocp n GLU 2 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1ocp s THR 3 N -1.41 4.85 0.23 6.31 2.01 -1.26 -5.09 115.64 121.29 1ocp s THR 3 Ca 0.00 0.48 0.02 0.00 0.31 0.00 0.00 61.69 62.50 1ocp s THR 3 Cb 0.00 -3.73 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 1ocp s THR 3 CO 0.00 -0.44 0.26 0.00 -0.69 0.00 0.00 174.62 173.74 1ocp n LEU 4 N -1.14 0.00 -3.51 4.42 -0.00 -1.26 -5.10 117.00 110.41 1ocp n LEU 4 Ca 0.01 -2.05 -0.27 0.00 -0.00 0.00 0.00 56.01 53.70 1ocp n LEU 4 Cb 0.54 1.41 -0.09 0.00 -0.00 0.00 0.00 43.42 45.29 1ocp n LEU 4 CO 0.47 -0.40 0.05 0.55 -0.00 0.00 0.00 177.39 178.06 1ocp n VAL 5 N -0.41 2.15 -2.16 1.47 3.14 -1.26 -4.75 118.33 116.50 1ocp n VAL 5 Ca 0.03 -5.13 -0.01 0.00 -2.96 0.00 0.00 64.34 56.28 1ocp n VAL 5 Cb 0.41 -2.11 -0.01 0.00 -1.06 0.00 0.00 33.84 31.06 1ocp n VAL 5 CO 0.00 0.00 0.00 1.67 -6.46 0.00 0.00 176.83 172.04 1ocp n GLN 6 N 1.08 0.00 -1.40 1.45 7.27 -1.26 -5.12 117.38 119.39 1ocp n GLN 6 Ca 0.28 -1.15 -0.23 0.00 0.07 0.00 0.00 57.00 55.97 1ocp n GLN 6 Cb 0.40 0.04 0.16 0.00 2.41 0.00 0.00 30.24 33.25 1ocp n GLN 6 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1ocp n ALA 7 N 0.16 -1.33 -0.07 1.69 0.00 -1.26 -5.04 120.51 114.66 1ocp n ALA 7 Ca -0.06 -1.33 -0.13 0.00 0.00 0.00 0.00 53.44 51.92 1ocp n ALA 7 Cb 0.81 -0.07 -0.05 0.00 0.00 0.00 0.00 19.45 20.14 1ocp n ALA 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ocp n ARG 8 N -3.27 0.29 -3.19 0.00 3.00 -1.26 -4.85 116.66 107.39 1ocp n ARG 8 Ca 0.13 0.11 -0.22 0.00 -0.01 0.00 0.00 57.85 57.86 1ocp n ARG 8 Cb 0.45 -1.06 -0.05 0.00 0.00 0.00 0.00 32.46 31.80 1ocp n ARG 8 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 1ocp n LYS 9 N -3.39 1.27 -2.70 5.56 2.85 -1.26 -4.97 118.16 115.52 1ocp n LYS 9 Ca -0.25 -3.61 -0.39 0.00 -1.05 0.00 0.00 58.31 53.01 1ocp n LYS 9 Cb 0.70 -1.63 0.01 0.00 -0.65 0.00 0.00 35.03 33.46 1ocp n LYS 9 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 1ocp n ARG 10 N 0.72 5.10 -3.28 -1.58 0.63 -1.26 -4.81 116.66 112.19 1ocp n ARG 10 Ca 0.25 -4.69 -0.20 0.00 -0.92 0.00 0.00 57.85 52.28 1ocp n ARG 10 Cb 0.56 -2.44 -0.08 0.00 0.45 0.00 0.00 32.46 30.95 1ocp n ARG 10 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 1ocp s LYS 11 N -4.13 0.83 -0.30 -0.14 2.20 -1.26 -4.96 119.74 111.97 1ocp s LYS 11 Ca 0.40 -1.51 0.11 0.00 -0.36 0.00 0.00 55.97 54.60 1ocp s LYS 11 Cb 0.19 -0.98 0.65 0.00 -1.51 0.00 0.00 37.83 36.19 1ocp s LYS 11 CO -0.12 -1.31 1.67 -2.13 -0.36 0.00 0.00 175.35 173.11 1ocp n ARG 12 N 3.35 3.07 -0.05 4.03 0.63 -1.26 -4.46 116.66 121.97 1ocp n ARG 12 Ca 0.21 -3.06 0.09 0.00 -0.92 0.00 0.00 57.85 54.17 1ocp n ARG 12 Cb 0.47 -2.06 0.40 0.00 0.45 0.00 0.00 32.46 31.72 1ocp n ARG 12 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1ocp n THR 13 N -0.51 0.12 -4.09 5.15 -1.04 -1.26 -4.83 114.28 107.82 1ocp n THR 13 Ca 0.37 -0.18 -0.05 0.00 -2.04 0.00 0.00 64.05 62.15 1ocp n THR 13 Cb 1.25 0.05 -0.02 0.00 -1.82 0.00 0.00 70.33 69.79 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 -0.20 0.25 -4.42 8.00 3.41 -1.26 -4.81 113.62 114.58 1ocp n SER 14 Ca 0.13 -1.54 -0.44 0.00 -0.26 0.00 0.00 58.87 56.76 1ocp n SER 14 Cb 0.19 0.36 -0.01 0.00 -0.26 0.00 0.00 64.21 64.49 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 -2.19 5.23 0.61 -1.33 -1.09 -1.26 -4.78 121.20 116.39 1ocp s ILE 15 Ca 0.08 -2.60 -0.17 0.00 -2.23 0.00 0.00 60.65 55.74 1ocp s ILE 15 Cb 0.00 -4.79 -0.02 0.00 -1.58 0.00 0.00 42.46 36.07 1ocp s ILE 15 CO 0.06 -1.46 1.12 -0.70 -1.23 0.00 0.00 174.94 172.72 1ocp s GLU 16 N 1.07 3.02 0.57 2.79 2.56 -1.26 -4.86 118.70 122.60 1ocp s GLU 16 Ca 0.36 1.47 0.29 0.00 0.00 0.00 0.00 54.97 57.10 1ocp s GLU 16 Cb -0.05 -1.97 1.73 0.00 2.00 0.00 0.00 34.13 35.84 1ocp s GLU 16 CO -0.04 -1.09 2.21 -0.91 -0.56 0.00 0.00 175.26 174.87 1ocp h ASN 17 N 0.49 0.00 1.14 -1.70 2.35 -2.01 -0.21 115.58 115.64 1ocp h ASN 17 Ca -0.48 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.12 1ocp h ASN 17 Cb 1.25 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.60 1ocp h ASN 17 CO 0.55 0.03 -0.89 0.03 -1.65 0.00 0.00 177.43 175.50 1ocp h ARG 18 N 0.00 0.00 -0.28 0.81 3.08 -1.98 -3.20 114.38 112.81 1ocp h ARG 18 Ca -0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 1ocp h ARG 18 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1ocp h ARG 18 CO 0.00 0.56 -0.09 -0.24 -1.07 0.00 0.00 179.97 179.13 1ocp h VAL 19 N 0.00 1.29 0.10 2.04 3.04 -1.38 0.44 116.25 121.77 1ocp h VAL 19 Ca -0.06 -1.13 -0.01 0.00 -1.01 0.00 0.00 66.70 64.49 1ocp h VAL 19 Cb 1.55 1.45 0.00 0.00 -2.01 0.00 0.00 31.29 32.28 1ocp h VAL 19 CO 0.08 0.36 -0.05 0.03 -1.01 0.00 0.00 177.57 176.97 1ocp h ARG 20 N 0.30 -0.14 0.00 4.17 3.08 -1.56 -0.76 114.38 119.47 1ocp h ARG 20 Ca 0.07 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1ocp h ARG 20 Cb 0.58 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1ocp h ARG 20 CO 0.03 -0.04 0.00 0.91 -1.07 0.00 0.00 179.97 179.81 1ocp n TRP 21 N -5.12 0.00 0.07 3.04 5.03 -1.21 -1.77 117.44 117.47 1ocp n TRP 21 Ca -0.08 0.00 -0.15 0.00 3.03 0.00 0.00 57.50 60.30 1ocp n TRP 21 Cb 0.11 -0.25 -0.07 0.00 -1.03 0.00 0.00 31.31 30.07 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 0.60 -0.69 -0.99 0.87 0.10 -1.13 113.55 112.30 1ocp h SER 22 Ca 0.00 -0.50 0.04 0.00 -1.23 0.00 0.00 61.79 60.10 1ocp h SER 22 Cb 0.22 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 61.95 1ocp h SER 22 CO 0.00 1.31 0.42 -0.07 -0.53 0.00 0.00 176.83 177.97 1ocp h LEU 23 N 0.24 0.68 -1.55 2.23 3.38 -0.36 -0.05 115.31 119.88 1ocp h LEU 23 Ca -0.10 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1ocp h LEU 23 Cb 1.67 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 1ocp h LEU 23 CO 0.18 0.46 0.05 -0.08 0.09 0.00 0.00 178.44 179.14 1ocp h GLU 24 N 0.82 0.34 0.00 1.13 4.81 -1.22 -1.80 114.58 118.66 1ocp h GLU 24 Ca 0.29 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.38 1ocp h GLU 24 Cb 0.06 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1ocp h GLU 24 CO -0.13 0.33 -0.43 1.15 -0.73 0.00 0.00 179.01 179.20 1ocp h THR 25 N 0.34 1.07 0.00 0.32 2.02 0.26 -1.78 112.91 115.14 1ocp h THR 25 Ca 0.08 -1.62 -0.21 0.00 0.77 0.00 0.00 66.41 65.43 1ocp h THR 25 Cb 0.15 1.94 -0.03 0.00 -1.74 0.00 0.00 68.15 68.46 1ocp h THR 25 CO -0.00 0.42 -1.31 -0.03 0.37 0.00 0.00 175.52 174.97 1ocp h MET 26 N 0.00 0.00 0.00 6.66 4.05 -0.79 -3.35 114.93 121.50 1ocp h MET 26 Ca -0.00 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 1ocp h MET 26 Cb 0.90 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.70 1ocp h MET 26 CO 0.06 0.53 -1.11 1.19 0.23 0.00 0.00 176.91 177.81 1ocp n PHE 27 N -3.08 0.89 1.17 1.39 3.01 -0.77 -3.99 117.46 116.08 1ocp n PHE 27 Ca -0.09 0.26 0.11 0.00 1.01 0.00 0.00 57.45 58.74 1ocp n PHE 27 Cb 0.92 -0.93 0.36 0.00 -0.01 0.00 0.00 39.48 39.82 1ocp n PHE 27 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1ocp n LEU 28 N -2.65 1.82 -0.11 4.37 4.77 -0.68 -3.94 117.00 120.57 1ocp n LEU 28 Ca -0.01 -0.75 -0.17 0.00 -0.03 0.00 0.00 56.01 55.05 1ocp n LEU 28 Cb 0.57 -0.11 -0.13 0.00 -2.33 0.00 0.00 43.42 41.42 1ocp n LEU 28 CO 0.41 0.38 -1.27 2.29 -1.33 0.00 0.00 177.39 177.86 1ocp n LYS 29 N 0.42 0.66 -3.73 3.23 2.85 -1.26 -4.93 118.16 115.42 1ocp n LYS 29 Ca 0.16 0.14 -0.16 0.00 -1.05 0.00 0.00 58.31 57.40 1ocp n LYS 29 Cb 0.36 -1.54 -0.16 0.00 -0.65 0.00 0.00 35.03 33.04 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 4.61 1.51 -2.41 0.00 -0.04 -1.26 -4.39 135.00 133.01 1ocp n PRO 31 Ca -0.19 -1.14 -0.23 0.00 -0.04 0.00 0.00 63.50 61.91 1ocp n PRO 31 Cb 0.50 -1.45 0.01 0.00 -0.04 0.00 0.00 33.50 32.53 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 0.10 3.13 -2.66 0.54 2.85 -1.26 -5.07 118.16 115.79 1ocp n LYS 32 Ca 0.22 -4.24 -0.36 0.00 -1.05 0.00 0.00 58.31 52.88 1ocp n LYS 32 Cb 0.83 -2.11 -0.05 0.00 -0.65 0.00 0.00 35.03 33.04 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 -3.52 4.30 0.21 -1.58 0.04 -1.26 -5.04 135.00 128.14 1ocp s PRO 33 Ca 0.45 1.38 -0.10 0.00 0.04 0.00 0.00 61.00 62.77 1ocp s PRO 33 Cb 0.41 -2.55 -0.07 0.00 0.04 0.00 0.00 34.50 32.33 1ocp s PRO 33 CO -0.10 -0.00 0.54 -1.12 0.04 0.00 0.00 177.00 176.35 1ocp s SER 34 N -1.70 6.66 0.63 6.66 0.01 -1.26 -4.94 113.70 119.76 1ocp s SER 34 Ca 0.56 0.94 0.39 0.00 1.31 0.00 0.00 55.95 59.15 1ocp s SER 34 Cb -0.19 -2.23 2.14 0.00 0.21 0.00 0.00 66.02 65.95 1ocp s SER 34 CO 0.24 -0.03 2.30 0.17 0.41 0.00 0.00 173.24 176.32 1ocp h LEU 35 N 2.78 0.00 -0.34 2.44 -0.00 -1.99 0.21 115.31 118.41 1ocp h LEU 35 Ca -0.47 0.00 -0.11 0.00 -0.00 0.00 0.00 57.88 57.30 1ocp h LEU 35 Cb 1.17 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.83 1ocp h LEU 35 CO 0.68 0.01 -0.21 -0.61 -0.00 0.00 0.00 178.44 178.31 1ocp h GLN 36 N 0.00 0.75 0.00 0.17 5.75 -2.00 -1.29 115.11 118.48 1ocp h GLN 36 Ca -0.00 -0.35 -0.02 0.00 -0.15 0.00 0.00 58.65 58.13 1ocp h GLN 36 Cb 0.07 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.60 1ocp h GLN 36 CO 0.00 0.96 -0.09 0.37 -2.65 0.00 0.00 178.83 177.42 1ocp h GLN 37 N 0.52 0.00 -0.21 1.69 5.75 -1.01 -0.70 115.11 121.15 1ocp h GLN 37 Ca 0.07 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.45 1ocp h GLN 37 Cb 0.77 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.30 1ocp h GLN 37 CO 0.06 0.09 -0.39 0.82 -2.65 0.00 0.00 178.83 176.77 1ocp h ILE 38 N 0.00 1.30 -0.16 2.39 1.08 -0.10 0.37 117.51 122.39 1ocp h ILE 38 Ca -0.00 -1.53 -0.01 0.00 -0.39 0.00 0.00 64.86 62.93 1ocp h ILE 38 Cb 0.34 1.56 -0.01 0.00 -3.07 0.00 0.00 36.82 35.64 1ocp h ILE 38 CO 0.01 0.48 0.04 0.74 -0.69 0.00 0.00 178.15 178.73 1ocp h THR 39 N 0.40 1.20 0.00 -0.27 2.02 -0.61 -1.05 112.91 114.60 1ocp h THR 39 Ca 0.04 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.60 1ocp h THR 39 Cb 0.86 1.31 0.00 0.00 -1.74 0.00 0.00 68.15 68.57 1ocp h THR 39 CO 0.07 0.19 0.00 0.45 0.37 0.00 0.00 175.52 176.60 1ocp h HIS 40 N 0.07 0.00 -0.23 3.16 3.86 -1.13 -2.00 115.15 118.88 1ocp h HIS 40 Ca 0.05 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.15 1ocp h HIS 40 Cb 0.25 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.72 1ocp h HIS 40 CO 0.01 0.00 -0.30 0.82 0.86 0.00 0.00 177.93 179.32 1ocp h ILE 41 N 0.00 1.32 0.35 2.45 5.03 0.10 0.70 117.51 127.47 1ocp h ILE 41 Ca 0.00 -1.49 -0.02 0.00 -0.12 0.00 0.00 64.86 63.23 1ocp h ILE 41 Cb 0.35 1.74 0.00 0.00 -3.03 0.00 0.00 36.82 35.88 1ocp h ILE 41 CO 0.00 0.47 -0.17 0.00 -0.68 0.00 0.00 178.15 177.76 1ocp h ALA 42 N 0.65 -0.47 0.00 1.87 0.00 -0.70 0.11 119.26 120.72 1ocp h ALA 42 Ca 0.03 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ocp h ALA 42 Cb 0.88 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1ocp h ALA 42 CO 0.07 -0.77 -0.01 -0.97 0.00 0.00 0.00 179.25 177.58 1ocp h ASN 43 N -0.47 0.00 0.38 0.00 -1.24 -1.48 0.54 115.58 113.30 1ocp h ASN 43 Ca -0.05 0.00 -0.16 0.00 0.71 0.00 0.00 56.30 56.80 1ocp h ASN 43 Cb 0.37 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.40 1ocp h ASN 43 CO 0.08 0.01 -0.67 1.56 -1.29 0.00 0.00 177.43 177.11 1ocp h GLN 44 N 0.00 0.26 0.00 6.67 7.50 0.16 -3.33 115.11 126.38 1ocp h GLN 44 Ca -0.00 -0.20 -0.01 0.00 0.50 0.00 0.00 58.65 58.94 1ocp h GLN 44 Cb 0.11 0.04 -0.02 0.00 0.05 0.00 0.00 27.48 27.65 1ocp h GLN 44 CO 0.00 0.84 -0.28 1.47 -1.50 0.00 0.00 178.83 179.35 1ocp n LEU 45 N -3.83 1.39 -2.34 1.46 -0.00 -0.55 -5.00 117.00 108.13 1ocp n LEU 45 Ca -0.03 -2.28 -0.06 0.00 -0.00 0.00 0.00 56.01 53.64 1ocp n LEU 45 Cb 0.66 -0.25 -0.01 0.00 -0.00 0.00 0.00 43.42 43.83 1ocp n LEU 45 CO 0.46 0.57 -0.08 0.61 -0.00 0.00 0.00 177.39 178.95 1ocp n GLY 46 N -0.76 -0.39 4.03 1.47 0.00 0.18 -4.32 105.19 105.41 1ocp n GLY 46 Ca 0.09 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 -5.06 3.07 0.12 0.99 2.34 -1.18 -4.95 118.68 114.00 1ocp s LEU 47 Ca 0.00 -0.85 -0.15 0.00 0.06 0.00 0.00 54.13 53.19 1ocp s LEU 47 Cb 0.00 -1.59 -0.07 0.00 -0.56 0.00 0.00 46.19 43.97 1ocp s LEU 47 CO 0.00 -1.41 0.54 -0.70 -1.06 0.00 0.00 176.35 173.72 1ocp s GLU 48 N -4.71 4.00 0.66 1.48 2.12 -1.26 -4.80 118.70 116.19 1ocp s GLU 48 Ca 0.63 0.51 0.35 0.00 0.36 0.00 0.00 54.97 56.82 1ocp s GLU 48 Cb -0.05 -3.00 1.94 0.00 0.26 0.00 0.00 34.13 33.27 1ocp s GLU 48 CO 0.40 0.52 2.10 -0.22 -0.54 0.00 0.00 175.26 177.52 1ocp h LYS 49 N 3.80 0.00 -0.05 4.30 3.11 -1.97 -1.03 116.57 124.73 1ocp h LYS 49 Ca -0.49 0.00 -0.23 0.00 -2.81 0.00 0.00 60.65 57.12 1ocp h LYS 49 Cb 1.20 0.00 0.01 0.00 -1.00 0.00 0.00 32.23 32.44 1ocp h LYS 49 CO 0.65 0.00 -0.89 -0.44 -2.81 0.00 0.00 179.45 175.96 1ocp h ASP 50 N 0.00 0.72 1.53 4.20 3.32 -2.00 -2.41 116.42 121.79 1ocp h ASP 50 Ca 0.01 -0.53 -0.09 0.00 0.02 0.00 0.00 57.03 56.43 1ocp h ASP 50 Cb 0.42 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1ocp h ASP 50 CO -0.00 1.32 -0.47 1.62 -1.72 0.00 0.00 179.24 179.99 1ocp h VAL 51 N 0.36 0.72 -0.06 -1.35 3.04 -1.60 -2.82 116.25 114.54 1ocp h VAL 51 Ca -0.08 -2.02 -0.18 0.00 -1.01 0.00 0.00 66.70 63.41 1ocp h VAL 51 Cb 1.51 2.34 -0.01 0.00 -2.01 0.00 0.00 31.29 33.13 1ocp h VAL 51 CO 0.17 0.41 -0.74 1.62 -1.01 0.00 0.00 177.57 178.01 1ocp h VAL 52 N 0.00 1.40 -0.00 1.51 3.04 -1.42 -2.75 116.25 118.03 1ocp h VAL 52 Ca -0.01 -2.20 -0.12 0.00 -1.01 0.00 0.00 66.70 63.36 1ocp h VAL 52 Cb 1.33 2.16 0.01 0.00 -2.01 0.00 0.00 31.29 32.79 1ocp h VAL 52 CO 0.05 0.66 -0.48 -0.09 -1.01 0.00 0.00 177.57 176.70 1ocp h ARG 53 N 0.23 0.33 -0.38 4.17 1.12 -1.43 -1.97 114.38 116.44 1ocp h ARG 53 Ca -0.03 -0.35 0.02 0.00 -1.11 0.00 0.00 59.98 58.50 1ocp h ARG 53 Cb 1.31 0.10 -0.02 0.00 -0.01 0.00 0.00 29.97 31.35 1ocp h ARG 53 CO 0.12 1.04 0.23 0.28 -3.11 0.00 0.00 179.97 178.53 1ocp h VAL 54 N -0.24 1.04 -0.27 0.20 2.07 -1.56 0.31 116.25 117.79 1ocp h VAL 54 Ca -0.06 -0.16 -0.11 0.00 0.82 0.00 0.00 66.70 67.19 1ocp h VAL 54 Cb 1.21 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1ocp h VAL 54 CO 0.09 0.08 -0.29 -0.25 0.02 0.00 0.00 177.57 177.23 1ocp h TRP 55 N 0.46 0.63 -0.00 1.57 7.01 -1.58 -2.35 115.95 121.70 1ocp h TRP 55 Ca 0.15 -0.15 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1ocp h TRP 55 Cb 0.00 -0.15 0.00 0.00 -2.10 0.00 0.00 29.16 26.91 1ocp h TRP 55 CO -0.07 0.79 -0.02 1.19 -2.79 0.00 0.00 178.44 177.53 1ocp n PHE 56 N -4.09 0.00 0.11 2.65 3.72 -0.74 -0.94 117.46 118.17 1ocp n PHE 56 Ca -0.01 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.17 1ocp n PHE 56 Cb 0.44 -0.21 -0.14 0.00 -0.94 0.00 0.00 39.48 38.63 1ocp n PHE 56 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ocp h ASN 58 N 0.20 0.00 1.30 0.00 -0.26 -1.49 -2.93 115.58 112.40 1ocp h ASN 58 Ca -0.21 -0.03 -0.02 0.00 -0.56 0.00 0.00 56.30 55.49 1ocp h ASN 58 Cb 2.01 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 39.27 1ocp h ASN 58 CO 0.25 0.02 -0.71 -0.09 -1.06 0.00 0.00 177.43 175.83 1ocp h ARG 59 N 0.00 0.00 0.00 0.81 1.12 -1.02 -2.24 114.38 113.06 1ocp h ARG 59 Ca 0.00 0.00 -0.25 0.00 -1.11 0.00 0.00 59.98 58.62 1ocp h ARG 59 Cb 0.95 0.00 -0.04 0.00 -0.01 0.00 0.00 29.97 30.87 1ocp h ARG 59 CO 0.00 0.05 -1.58 0.07 -3.11 0.00 0.00 179.97 175.40 1ocp h ARG 60 N 0.00 0.00 -2.03 0.20 0.11 -1.13 -3.40 114.38 108.13 1ocp h ARG 60 Ca -0.01 0.00 -0.54 0.00 0.10 0.00 0.00 59.98 59.52 1ocp h ARG 60 Cb 1.06 0.00 -0.40 0.00 1.11 0.00 0.00 29.97 31.75 1ocp h ARG 60 CO 0.01 0.48 -1.06 0.94 0.10 0.00 0.00 179.97 180.43 1ocp n GLN 61 N -3.03 1.06 0.15 0.08 7.27 -1.11 -4.91 117.38 116.89 1ocp n GLN 61 Ca -0.14 -3.47 0.13 0.00 0.07 0.00 0.00 57.00 53.59 1ocp n GLN 61 Cb 0.99 -1.48 0.32 0.00 2.41 0.00 0.00 30.24 32.48 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 3.72 0.00 0.00 3.69 2.10 -1.63 -3.20 116.57 121.26 1ocp h LYS 62 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.74 1ocp h LYS 62 Cb 0.87 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.20 1ocp h LYS 62 CO 0.52 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 178.38 1ocp n GLY 63 N 1.21 -0.93 2.07 0.07 0.00 -1.26 -3.04 105.19 103.31 1ocp n GLY 63 Ca 0.05 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 1ocp n GLY 63 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ocp n LYS 64 N -1.35 2.14 0.00 1.61 4.81 -1.21 -4.30 118.16 119.86 1ocp n LYS 64 Ca 0.07 -2.57 0.00 0.00 -0.87 0.00 0.00 58.31 54.94 1ocp n LYS 64 Cb 0.16 -2.01 0.00 0.00 0.02 0.00 0.00 35.03 33.20 1ocp n LYS 64 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1ocp n ARG 65 N -0.78 0.00 -3.07 1.64 5.12 -1.17 -4.92 116.66 113.48 1ocp n ARG 65 Ca 0.51 0.00 -0.44 0.00 -1.93 0.00 0.00 57.85 55.99 1ocp n ARG 65 Cb 1.25 -0.33 0.01 0.00 -1.16 0.00 0.00 32.46 32.22 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 -2.22 5.99 0.00 0.55 7.64 -1.26 -5.22 113.62 119.10 1ocp n SER 66 Ca 0.00 -3.25 0.00 0.00 1.01 0.00 0.00 58.87 56.63 1ocp n SER 66 Cb 0.11 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 61.98 1ocp n SER 66 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83