#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 -7.01 -1.85 0.03 2.13 -1.26 -4.88 120.64 107.80 1ocp n GLU 2 Ca 0.00 0.74 -0.37 0.00 0.66 0.00 0.00 57.16 58.19 1ocp n GLU 2 Cb 0.00 -5.73 0.04 0.00 0.27 0.00 0.00 31.44 26.02 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 -4.87 3.44 -2.30 6.31 -1.04 -1.26 -4.51 114.28 110.05 1ocp n THR 3 Ca 0.01 -4.05 -0.06 0.00 -2.04 0.00 0.00 64.05 57.91 1ocp n THR 3 Cb 0.55 -1.22 0.06 0.00 -1.82 0.00 0.00 70.33 67.90 1ocp n THR 3 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1ocp n LEU 4 N -0.63 2.75 -2.77 -4.42 7.94 -1.26 -4.89 117.00 113.72 1ocp n LEU 4 Ca 0.54 -3.55 -0.08 0.00 -1.11 0.00 0.00 56.01 51.81 1ocp n LEU 4 Cb 0.40 -0.04 0.04 0.00 0.53 0.00 0.00 43.42 44.35 1ocp n LEU 4 CO 0.55 1.35 0.17 0.55 -1.11 0.00 0.00 177.39 178.90 1ocp n VAL 5 N -0.53 -0.03 -2.61 1.96 3.14 -1.26 -5.15 118.33 113.85 1ocp n VAL 5 Ca 0.21 -1.50 -0.24 0.00 -2.96 0.00 0.00 64.34 59.85 1ocp n VAL 5 Cb 0.90 1.30 0.12 0.00 -1.06 0.00 0.00 33.84 35.10 1ocp n VAL 5 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1ocp s GLN 6 N 0.67 1.51 -0.50 1.45 -0.21 -1.26 -4.95 119.66 116.36 1ocp s GLN 6 Ca 0.32 -1.24 -0.26 0.00 0.02 0.00 0.00 55.36 54.19 1ocp s GLN 6 Cb 0.19 -2.32 -0.05 0.00 1.00 0.00 0.00 33.01 31.83 1ocp s GLN 6 CO -0.21 -1.58 2.19 0.00 -2.12 0.00 0.00 175.29 173.56 1ocp s ALA 7 N -3.20 1.93 0.07 6.09 0.00 -1.26 -4.31 121.76 121.09 1ocp s ALA 7 Ca 0.68 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.51 1ocp s ALA 7 Cb -0.04 -4.30 0.00 0.00 0.00 0.00 0.00 23.12 18.78 1ocp s ALA 7 CO 0.45 -4.09 0.00 0.54 0.00 0.00 0.00 175.76 172.67 1ocp n ARG 8 N 9.02 0.00 -2.65 0.00 5.12 -1.26 -5.01 116.66 121.89 1ocp n ARG 8 Ca 0.30 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.79 1ocp n ARG 8 Cb 0.53 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.83 1ocp n ARG 8 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1ocp n LYS 9 N -2.64 3.24 -2.91 5.56 4.81 -1.26 -4.73 118.16 120.23 1ocp n LYS 9 Ca 0.00 -3.41 -0.02 0.00 -0.87 0.00 0.00 58.31 54.01 1ocp n LYS 9 Cb 0.00 -3.38 0.00 0.00 0.02 0.00 0.00 35.03 31.68 1ocp n LYS 9 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1ocp s ARG 10 N 3.51 0.99 -0.73 1.64 0.52 -1.26 -5.10 118.95 118.52 1ocp s ARG 10 Ca 0.51 -0.80 -0.22 0.00 -0.52 0.00 0.00 55.73 54.70 1ocp s ARG 10 Cb 0.03 -0.00 0.08 0.00 0.52 0.00 0.00 34.95 35.57 1ocp s ARG 10 CO 0.06 -1.28 1.05 0.15 0.02 0.00 0.00 175.30 175.30 1ocp s LYS 11 N 1.20 3.23 -0.23 3.54 3.01 -1.26 -4.69 119.74 124.53 1ocp s LYS 11 Ca 0.25 -0.94 0.11 0.00 -1.01 0.00 0.00 55.97 54.38 1ocp s LYS 11 Cb -0.01 -4.41 0.31 0.00 -1.01 0.00 0.00 37.83 32.71 1ocp s LYS 11 CO -0.06 -1.87 1.35 2.89 0.51 0.00 0.00 175.35 178.18 1ocp n ARG 12 N 7.76 0.98 0.10 1.68 1.85 -1.26 -4.78 116.66 122.99 1ocp n ARG 12 Ca 0.04 -1.36 -0.14 0.00 -1.00 0.00 0.00 57.85 55.38 1ocp n ARG 12 Cb 0.47 0.27 -0.12 0.00 -1.05 0.00 0.00 32.46 32.03 1ocp n ARG 12 CO 0.00 0.00 0.00 1.15 -0.01 0.00 0.00 177.63 178.77 1ocp h THR 13 N 4.50 1.52 -0.00 8.89 2.02 -2.02 -3.41 112.91 124.41 1ocp h THR 13 Ca -0.45 -3.03 -0.14 0.00 0.77 0.00 0.00 66.41 63.56 1ocp h THR 13 Cb 1.35 2.86 -0.16 0.00 -1.74 0.00 0.00 68.15 70.46 1ocp h THR 13 CO -0.18 0.88 -0.38 -1.20 0.37 0.00 0.00 175.52 175.01 1ocp n SER 14 N -3.54 -0.77 -2.96 4.18 7.64 -1.26 -5.00 113.62 111.91 1ocp n SER 14 Ca -0.07 -2.01 -0.15 0.00 1.01 0.00 0.00 58.87 57.66 1ocp n SER 14 Cb 0.98 0.24 -0.01 0.00 -1.01 0.00 0.00 64.21 64.42 1ocp n SER 14 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1ocp n ILE 15 N -0.01 -0.36 -1.60 0.44 2.08 -1.26 -4.37 119.36 114.27 1ocp n ILE 15 Ca -0.23 -2.43 -0.34 0.00 0.56 0.00 0.00 62.75 60.31 1ocp n ILE 15 Cb 0.76 -0.02 0.07 0.00 -0.75 0.00 0.00 39.64 39.70 1ocp n ILE 15 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1ocp s GLU 16 N 0.06 2.45 0.61 0.38 2.12 -1.26 -4.57 118.70 118.49 1ocp s GLU 16 Ca 0.33 1.63 0.33 0.00 0.36 0.00 0.00 54.97 57.62 1ocp s GLU 16 Cb 0.16 -1.88 1.97 0.00 0.26 0.00 0.00 34.13 34.63 1ocp s GLU 16 CO -0.17 -1.57 2.28 -0.97 -0.54 0.00 0.00 175.26 174.29 1ocp h ASN 17 N -0.07 0.00 0.87 -1.70 -1.24 -1.99 0.21 115.58 111.67 1ocp h ASN 17 Ca -0.48 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.30 1ocp h ASN 17 Cb 1.28 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 40.29 1ocp h ASN 17 CO 0.52 0.00 -1.16 0.03 -1.29 0.00 0.00 177.43 175.52 1ocp h ARG 18 N 0.00 0.01 -0.36 6.67 3.08 -1.98 -3.15 114.38 118.65 1ocp h ARG 18 Ca 0.00 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 1ocp h ARG 18 Cb 0.01 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 1ocp h ARG 18 CO -0.00 0.90 0.09 -0.24 -1.07 0.00 0.00 179.97 179.65 1ocp h VAL 19 N 0.00 1.22 -0.70 2.04 3.04 -1.29 0.47 116.25 121.04 1ocp h VAL 19 Ca -0.07 -0.76 -0.02 0.00 -1.01 0.00 0.00 66.70 64.84 1ocp h VAL 19 Cb 1.83 1.03 -0.03 0.00 -2.01 0.00 0.00 31.29 32.10 1ocp h VAL 19 CO 0.12 0.26 0.35 0.03 -1.01 0.00 0.00 177.57 177.32 1ocp h ARG 20 N 0.44 1.00 -0.00 4.17 3.08 -1.56 -0.93 114.38 120.58 1ocp h ARG 20 Ca 0.11 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1ocp h ARG 20 Cb 0.30 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1ocp h ARG 20 CO 0.00 0.77 -0.06 0.91 -1.07 0.00 0.00 179.97 180.52 1ocp n TRP 21 N -4.46 0.00 0.11 3.04 5.03 -1.08 -2.28 117.44 117.80 1ocp n TRP 21 Ca 0.06 0.00 -0.18 0.00 3.03 0.00 0.00 57.50 60.40 1ocp n TRP 21 Cb 0.12 -0.15 -0.14 0.00 -1.03 0.00 0.00 31.31 30.11 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 0.52 0.56 -0.17 -0.99 0.87 0.12 -2.38 113.55 112.08 1ocp h SER 22 Ca 0.00 -0.59 0.02 0.00 -1.23 0.00 0.00 61.79 60.00 1ocp h SER 22 Cb 0.29 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 1ocp h SER 22 CO 0.00 1.45 0.03 -0.07 -0.53 0.00 0.00 176.83 177.71 1ocp h LEU 23 N 0.11 -0.01 -2.06 2.23 3.38 -0.82 -0.38 115.31 117.77 1ocp h LEU 23 Ca -0.16 0.03 0.06 0.00 0.09 0.00 0.00 57.88 57.90 1ocp h LEU 23 Cb 2.00 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.78 1ocp h LEU 23 CO 0.22 0.02 0.17 -0.08 0.09 0.00 0.00 178.44 178.86 1ocp h GLU 24 N 0.09 0.00 -0.39 1.13 4.81 -1.43 -0.18 114.58 118.61 1ocp h GLU 24 Ca 0.08 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.19 1ocp h GLU 24 Cb 0.08 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1ocp h GLU 24 CO -0.11 0.00 -0.21 1.15 -0.73 0.00 0.00 179.01 179.11 1ocp h THR 25 N 0.00 1.27 0.00 0.32 2.02 -0.53 -0.81 112.91 115.18 1ocp h THR 25 Ca 0.10 -1.32 -0.07 0.00 0.77 0.00 0.00 66.41 65.89 1ocp h THR 25 Cb 0.44 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1ocp h THR 25 CO -0.00 0.44 -0.63 0.24 0.37 0.00 0.00 175.52 175.95 1ocp h MET 26 N 0.68 0.00 0.00 6.66 2.86 -0.74 -3.32 114.93 121.06 1ocp h MET 26 Ca 0.10 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1ocp h MET 26 Cb 0.72 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.38 1ocp h MET 26 CO 0.06 0.26 -1.06 1.19 1.06 0.00 0.00 176.91 178.42 1ocp n PHE 27 N -3.05 0.79 0.90 -0.22 3.72 -0.44 -3.91 117.46 115.24 1ocp n PHE 27 Ca 0.00 0.23 0.09 0.00 -0.05 0.00 0.00 57.45 57.72 1ocp n PHE 27 Cb 0.67 -0.85 0.27 0.00 -0.94 0.00 0.00 39.48 38.64 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 -2.52 2.07 -0.12 4.37 4.77 -0.32 -3.94 117.00 121.30 1ocp n LEU 28 Ca 0.00 -0.95 -0.16 0.00 -0.03 0.00 0.00 56.01 54.87 1ocp n LEU 28 Cb 0.53 -0.20 -0.13 0.00 -2.33 0.00 0.00 43.42 41.29 1ocp n LEU 28 CO 0.40 0.48 -1.29 2.29 -1.33 0.00 0.00 177.39 177.94 1ocp n LYS 29 N 0.60 0.66 -3.80 3.23 2.85 -1.25 -4.96 118.16 115.50 1ocp n LYS 29 Ca 0.15 0.11 -0.13 0.00 -1.05 0.00 0.00 58.31 57.39 1ocp n LYS 29 Cb 0.36 -1.52 -0.14 0.00 -0.65 0.00 0.00 35.03 33.07 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 3.73 2.11 -2.81 0.00 -0.04 -1.26 -4.36 135.00 132.36 1ocp n PRO 31 Ca -0.21 -1.11 -0.24 0.00 -0.04 0.00 0.00 63.50 61.90 1ocp n PRO 31 Cb 0.54 -1.67 -0.02 0.00 -0.04 0.00 0.00 33.50 32.32 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 2.76 -2.47 0.54 2.85 -1.26 -5.07 118.16 115.63 1ocp n LYS 32 Ca 0.13 -4.38 -0.41 0.00 -1.05 0.00 0.00 58.31 52.60 1ocp n LYS 32 Cb 0.69 -2.07 -0.04 0.00 -0.65 0.00 0.00 35.03 32.97 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 -3.31 4.53 0.32 -1.58 0.04 -1.26 -5.03 135.00 128.72 1ocp s PRO 33 Ca 0.45 1.75 -0.06 0.00 0.04 0.00 0.00 61.00 63.18 1ocp s PRO 33 Cb 0.34 -3.29 -0.05 0.00 0.04 0.00 0.00 34.50 31.54 1ocp s PRO 33 CO -0.13 -0.04 0.62 -1.54 0.04 0.00 0.00 177.00 175.95 1ocp s SER 34 N 0.26 6.46 0.63 6.66 1.04 -1.26 -4.94 113.70 122.55 1ocp s SER 34 Ca 0.52 0.83 0.39 0.00 0.48 0.00 0.00 55.95 58.17 1ocp s SER 34 Cb -0.30 -2.19 2.13 0.00 0.10 0.00 0.00 66.02 65.76 1ocp s SER 34 CO 0.34 -0.26 2.30 -0.07 0.98 0.00 0.00 173.24 176.53 1ocp h LEU 35 N 1.54 0.00 -0.27 2.42 3.38 -1.99 0.18 115.31 120.56 1ocp h LEU 35 Ca -0.48 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.33 1ocp h LEU 35 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1ocp h LEU 35 CO 0.65 0.01 -0.48 -0.61 0.09 0.00 0.00 178.44 178.10 1ocp h GLN 36 N 0.00 0.80 0.00 1.13 5.75 -2.00 -2.27 115.11 118.52 1ocp h GLN 36 Ca -0.00 -0.50 0.00 0.00 -0.15 0.00 0.00 58.65 58.00 1ocp h GLN 36 Cb 0.06 0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.66 1ocp h GLN 36 CO 0.00 1.13 0.00 0.37 -2.65 0.00 0.00 178.83 177.68 1ocp h GLN 37 N 0.56 0.00 -0.01 1.69 4.15 -1.09 -2.42 115.11 117.99 1ocp h GLN 37 Ca 0.02 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.23 1ocp h GLN 37 Cb 1.08 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.77 1ocp h GLN 37 CO 0.11 0.00 -0.88 0.82 -1.93 0.00 0.00 178.83 176.95 1ocp h ILE 38 N 0.00 1.43 -0.13 2.39 1.08 -0.62 0.25 117.51 121.91 1ocp h ILE 38 Ca 0.00 -2.46 -0.03 0.00 -0.39 0.00 0.00 64.86 61.99 1ocp h ILE 38 Cb 0.53 2.38 -0.00 0.00 -3.07 0.00 0.00 36.82 36.66 1ocp h ILE 38 CO 0.00 0.73 -0.03 0.71 -0.69 0.00 0.00 178.15 178.87 1ocp h THR 39 N 0.19 1.28 0.00 -0.27 1.35 -0.98 -1.85 112.91 112.64 1ocp h THR 39 Ca -0.06 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.85 1ocp h THR 39 Cb 1.50 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.57 1ocp h THR 39 CO 0.14 0.28 0.00 -0.74 -0.25 0.00 0.00 175.52 174.95 1ocp h HIS 40 N -0.05 0.00 -0.34 4.73 -0.00 -1.41 -2.12 115.15 115.95 1ocp h HIS 40 Ca 0.03 0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.31 1ocp h HIS 40 Cb 0.44 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.84 1ocp h HIS 40 CO 0.05 0.00 -0.16 0.97 -0.00 0.00 0.00 177.93 178.79 1ocp h ILE 41 N 0.00 1.29 -0.09 6.26 6.09 0.26 0.49 117.51 131.81 1ocp h ILE 41 Ca 0.00 -1.28 0.00 0.00 -1.37 0.00 0.00 64.86 62.22 1ocp h ILE 41 Cb 0.42 1.38 -0.01 0.00 0.47 0.00 0.00 36.82 39.09 1ocp h ILE 41 CO 0.00 0.42 0.04 0.00 -3.07 0.00 0.00 178.15 175.54 1ocp h ALA 42 N 0.78 0.10 0.00 0.18 0.00 -0.68 0.15 119.26 119.79 1ocp h ALA 42 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1ocp h ALA 42 Cb 0.70 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1ocp h ALA 42 CO 0.05 -0.42 -0.02 -0.97 0.00 0.00 0.00 179.25 177.89 1ocp h ASN 43 N 0.10 0.00 1.29 0.00 -0.73 -1.35 0.50 115.58 115.39 1ocp h ASN 43 Ca 0.03 0.00 -0.10 0.00 1.87 0.00 0.00 56.30 58.10 1ocp h ASN 43 Cb 0.00 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.58 1ocp h ASN 43 CO -0.02 0.02 -0.49 0.06 -0.37 0.00 0.00 177.43 176.63 1ocp h GLN 44 N 0.00 0.00 0.00 6.67 -0.00 0.16 -3.33 115.11 118.60 1ocp h GLN 44 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.64 1ocp h GLN 44 Cb 0.24 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.71 1ocp h GLN 44 CO 0.00 0.49 -0.32 1.47 -0.00 0.00 0.00 178.83 180.48 1ocp n LEU 45 N -3.31 1.11 -2.12 0.06 -0.00 -0.67 -5.00 117.00 107.08 1ocp n LEU 45 Ca 0.01 -2.01 -0.09 0.00 -0.00 0.00 0.00 56.01 53.92 1ocp n LEU 45 Cb 0.68 -0.20 -0.01 0.00 -0.00 0.00 0.00 43.42 43.89 1ocp n LEU 45 CO 0.40 0.49 -0.11 0.61 -0.00 0.00 0.00 177.39 178.78 1ocp n GLY 46 N -0.61 -0.11 3.99 1.47 0.00 0.17 -4.57 105.19 105.53 1ocp n GLY 46 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 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 -4.81 3.00 0.00 0.99 2.34 -1.13 -4.89 118.68 114.18 1ocp s LEU 47 Ca 0.00 -0.96 -0.00 0.00 0.06 0.00 0.00 54.13 53.22 1ocp s LEU 47 Cb 0.00 -1.53 0.04 0.00 -0.56 0.00 0.00 46.19 44.14 1ocp s LEU 47 CO 0.00 -1.24 0.25 -1.84 -1.06 0.00 0.00 176.35 172.46 1ocp n GLU 48 N -2.07 0.37 0.00 1.48 0.00 -1.26 -4.72 120.64 114.43 1ocp n GLU 48 Ca 0.10 -0.65 0.12 0.00 0.00 0.00 0.00 57.16 56.73 1ocp n GLU 48 Cb 0.62 -0.18 0.27 0.00 0.00 0.00 0.00 31.44 32.16 1ocp n GLU 48 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1ocp n LYS 49 N -1.47 0.17 0.06 3.44 5.02 -1.26 -3.22 118.16 120.90 1ocp n LYS 49 Ca 0.04 -0.10 -0.22 0.00 -2.02 0.00 0.00 58.31 56.01 1ocp n LYS 49 Cb 0.14 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.51 1ocp n LYS 49 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1ocp h ASP 50 N 0.25 0.52 1.82 4.39 5.19 -1.99 -2.25 116.42 124.36 1ocp h ASP 50 Ca 0.00 -0.92 -0.03 0.00 -0.62 0.00 0.00 57.03 55.46 1ocp h ASP 50 Cb 0.50 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 39.84 1ocp h ASP 50 CO 0.00 1.54 -0.18 1.62 -3.12 0.00 0.00 179.24 179.11 1ocp h VAL 51 N -0.23 0.25 0.08 -1.35 3.04 -1.97 -2.51 116.25 113.55 1ocp h VAL 51 Ca -0.22 -1.35 -0.25 0.00 -1.01 0.00 0.00 66.70 63.87 1ocp h VAL 51 Cb 1.80 2.11 -0.01 0.00 -2.01 0.00 0.00 31.29 33.18 1ocp h VAL 51 CO 0.15 0.14 -1.13 1.62 -1.01 0.00 0.00 177.57 177.34 1ocp h VAL 52 N 0.00 1.57 0.09 1.51 3.04 -1.63 -1.70 116.25 119.12 1ocp h VAL 52 Ca -0.00 -3.12 -0.22 0.00 -1.01 0.00 0.00 66.70 62.34 1ocp h VAL 52 Cb 1.11 2.86 0.02 0.00 -2.01 0.00 0.00 31.29 33.28 1ocp h VAL 52 CO 0.02 0.91 -0.93 -0.09 -1.01 0.00 0.00 177.57 176.46 1ocp h ARG 53 N 0.06 0.48 -0.18 4.17 1.12 -1.40 -2.23 114.38 116.39 1ocp h ARG 53 Ca -0.09 -0.63 -0.15 0.00 -1.11 0.00 0.00 59.98 58.00 1ocp h ARG 53 Cb 1.86 0.21 -0.01 0.00 -0.01 0.00 0.00 29.97 32.02 1ocp h ARG 53 CO 0.17 1.26 -0.51 0.28 -3.11 0.00 0.00 179.97 178.06 1ocp h VAL 54 N -0.01 1.32 -0.23 0.20 2.07 -1.55 0.14 116.25 118.18 1ocp h VAL 54 Ca -0.14 -1.75 -0.11 0.00 0.82 0.00 0.00 66.70 65.51 1ocp h VAL 54 Cb 1.66 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 33.16 1ocp h VAL 54 CO 0.18 0.54 -0.35 -0.25 0.02 0.00 0.00 177.57 177.72 1ocp h TRP 55 N 0.40 0.56 -0.00 1.57 7.01 -1.37 -2.65 115.95 121.48 1ocp h TRP 55 Ca 0.01 -0.14 0.00 0.00 2.11 0.00 0.00 58.89 60.87 1ocp h TRP 55 Cb 1.04 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 27.97 1ocp h TRP 55 CO 0.04 0.77 -0.41 0.34 -2.79 0.00 0.00 178.44 176.40 1ocp n PHE 56 N -4.06 0.00 -0.07 2.65 7.35 -0.84 -3.12 117.46 119.36 1ocp n PHE 56 Ca -0.01 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.55 1ocp n PHE 56 Cb 0.47 -0.19 -0.01 0.00 0.35 0.00 0.00 39.48 40.10 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 0.65 0.85 0.19 0.00 -1.24 -1.65 -2.41 115.58 111.96 1ocp h ASN 58 Ca 0.02 -0.78 -0.00 0.00 0.71 0.00 0.00 56.30 56.25 1ocp h ASN 58 Cb 1.10 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 39.88 1ocp h ASN 58 CO 0.11 1.59 -0.02 0.03 -1.29 0.00 0.00 177.43 177.85 1ocp h ARG 59 N 0.27 0.00 0.16 6.67 -0.00 -1.47 0.44 114.38 120.44 1ocp h ARG 59 Ca -0.18 0.00 -0.34 0.00 -0.50 0.00 0.00 59.98 58.95 1ocp h ARG 59 Cb 1.91 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.88 1ocp h ARG 59 CO 0.24 0.02 -1.76 0.00 0.00 0.00 0.00 179.97 178.46 1ocp h ARG 60 N 0.00 0.34 -2.10 0.04 3.08 -0.94 -3.40 114.38 111.39 1ocp h ARG 60 Ca -0.00 -0.58 -0.56 0.00 0.07 0.00 0.00 59.98 58.91 1ocp h ARG 60 Cb 0.12 0.22 -0.41 0.00 0.08 0.00 0.00 29.97 29.98 1ocp h ARG 60 CO 0.00 1.28 -0.90 0.00 -1.07 0.00 0.00 179.97 179.28 1ocp n GLN 61 N -3.63 1.68 0.18 0.04 10.64 -0.85 -4.87 117.38 120.59 1ocp n GLN 61 Ca -0.27 -3.93 0.07 0.00 -1.83 0.00 0.00 57.00 51.04 1ocp n GLN 61 Cb 1.04 -1.77 0.15 0.00 -0.86 0.00 0.00 30.24 28.80 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 3.72 0.00 -0.05 2.61 2.10 -0.37 -3.39 116.57 121.19 1ocp h LYS 62 Ca 0.12 0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 58.57 1ocp h LYS 62 Cb 0.77 0.00 -0.17 0.00 -0.90 0.00 0.00 32.23 31.94 1ocp h LYS 62 CO 0.63 0.26 -0.37 0.41 -2.00 0.00 0.00 179.45 178.39 1ocp n GLY 63 N 1.03 1.70 2.16 0.07 0.00 -1.26 -4.96 105.19 103.93 1ocp n GLY 63 Ca 0.03 -0.21 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.05 2.49 -0.77 1.61 5.02 -1.26 -4.40 118.16 119.81 1ocp n LYS 64 Ca -0.09 -3.23 0.05 0.00 -2.02 0.00 0.00 58.31 53.02 1ocp n LYS 64 Cb 0.86 -2.20 0.18 0.00 -0.02 0.00 0.00 35.03 33.85 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 -1.02 1.37 -3.75 1.97 1.74 -1.26 -4.89 116.66 110.82 1ocp n ARG 65 Ca 0.58 -3.11 -0.28 0.00 -0.77 0.00 0.00 57.85 54.26 1ocp n ARG 65 Cb 1.12 -1.37 -0.12 0.00 -1.02 0.00 0.00 32.46 31.07 1ocp n ARG 65 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ocp s SER 66 N -3.05 3.80 0.00 0.55 0.15 -1.26 -5.27 113.70 108.61 1ocp s SER 66 Ca 0.38 -3.58 0.00 0.00 0.70 0.00 0.00 55.95 53.45 1ocp s SER 66 Cb 0.37 -1.27 0.00 0.00 -1.71 0.00 0.00 66.02 63.41 1ocp s SER 66 CO -0.08 -0.12 0.00 -0.24 1.20 0.00 0.00 173.24 174.00