#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 2.88 -4.27 0.03 2.13 -1.26 -4.95 120.64 115.20 1ocp n GLU 2 Ca 0.00 -3.50 -0.22 0.00 0.66 0.00 0.00 57.16 54.10 1ocp n GLU 2 Cb 0.00 -2.27 -0.12 0.00 0.27 0.00 0.00 31.44 29.32 1ocp n GLU 2 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 1ocp s THR 3 N -4.82 1.61 -0.36 6.31 -1.32 -1.26 -5.07 115.64 110.74 1ocp s THR 3 Ca 0.52 -1.56 0.14 0.00 -1.21 0.00 0.00 61.69 59.58 1ocp s THR 3 Cb 0.42 -1.51 0.43 0.00 -1.51 0.00 0.00 72.50 70.33 1ocp s THR 3 CO -0.39 -0.14 0.94 0.00 -2.21 0.00 0.00 174.62 172.82 1ocp n LEU 4 N 0.99 1.98 -1.01 9.08 -0.00 -1.26 -4.82 117.00 121.96 1ocp n LEU 4 Ca -0.19 -4.25 -0.01 0.00 -0.00 0.00 0.00 56.01 51.57 1ocp n LEU 4 Cb 0.54 0.30 -0.02 0.00 -0.00 0.00 0.00 43.42 44.24 1ocp n LEU 4 CO 0.23 1.82 0.21 0.52 -0.00 0.00 0.00 177.39 180.18 1ocp n VAL 5 N -0.08 0.00 -2.76 1.47 0.31 -1.26 -4.94 118.33 111.08 1ocp n VAL 5 Ca 0.17 -0.36 -0.10 0.00 -0.01 0.00 0.00 64.34 64.05 1ocp n VAL 5 Cb 0.75 0.60 0.05 0.00 -0.91 0.00 0.00 33.84 34.33 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 0.18 1.12 -1.41 5.55 6.02 -1.26 -5.12 117.38 122.45 1ocp n GLN 6 Ca -0.07 -2.83 -0.30 0.00 -0.01 0.00 0.00 57.00 53.79 1ocp n GLN 6 Cb 0.83 -1.01 0.23 0.00 1.02 0.00 0.00 30.24 31.31 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 -1.97 1.19 -0.26 -1.58 0.00 -1.26 -5.02 121.76 112.85 1ocp s ALA 7 Ca 0.28 -1.15 -0.16 0.00 0.00 0.00 0.00 51.96 50.92 1ocp s ALA 7 Cb 0.42 -2.80 -0.14 0.00 0.00 0.00 0.00 23.12 20.60 1ocp s ALA 7 CO -0.02 -3.27 -0.22 0.54 0.00 0.00 0.00 175.76 172.79 1ocp n ARG 8 N -4.47 0.58 -0.04 0.00 1.74 -1.26 -4.86 116.66 108.36 1ocp n ARG 8 Ca 0.15 0.34 -0.09 0.00 -0.77 0.00 0.00 57.85 57.48 1ocp n ARG 8 Cb 0.60 -1.55 -0.03 0.00 -1.02 0.00 0.00 32.46 30.45 1ocp n ARG 8 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1ocp n LYS 9 N -4.29 0.21 0.00 5.56 4.76 -1.26 -5.07 118.16 118.07 1ocp n LYS 9 Ca -0.49 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.04 1ocp n LYS 9 Cb 0.84 -0.86 0.00 0.00 -1.84 0.00 0.00 35.03 33.17 1ocp n LYS 9 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1ocp n ARG 10 N -3.55 0.00 -3.52 1.97 3.00 -1.26 -5.17 116.66 108.14 1ocp n ARG 10 Ca -0.17 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.58 1ocp n ARG 10 Cb 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.98 1ocp n ARG 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 1ocp s LYS 11 N -0.99 1.36 -0.01 -0.14 -2.85 -1.26 -4.74 119.74 111.11 1ocp s LYS 11 Ca 0.00 -0.57 0.01 0.00 -1.00 0.00 0.00 55.97 54.41 1ocp s LYS 11 Cb 0.00 0.58 0.02 0.00 -2.06 0.00 0.00 37.83 36.37 1ocp s LYS 11 CO 0.00 -0.60 0.84 2.89 0.10 0.00 0.00 175.35 178.58 1ocp n ARG 12 N -0.39 0.18 0.09 1.78 0.00 -1.26 -4.45 116.66 112.61 1ocp n ARG 12 Ca -0.14 -0.95 -0.04 0.00 -0.00 0.00 0.00 57.85 56.72 1ocp n ARG 12 Cb 0.64 -0.58 -0.06 0.00 -0.00 0.00 0.00 32.46 32.46 1ocp n ARG 12 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.63 178.78 1ocp h THR 13 N 5.01 1.47 -0.02 8.89 2.02 -2.02 -3.39 112.91 124.87 1ocp h THR 13 Ca 0.00 -3.01 -0.15 0.00 0.77 0.00 0.00 66.41 64.02 1ocp h THR 13 Cb 1.21 2.68 -0.21 0.00 -1.74 0.00 0.00 68.15 70.09 1ocp h THR 13 CO 0.00 0.82 -0.52 -1.54 0.37 0.00 0.00 175.52 174.65 1ocp n SER 14 N -3.35 -0.42 -2.96 4.18 3.41 -1.26 -4.99 113.62 108.23 1ocp n SER 14 Ca 0.00 -2.03 -0.15 0.00 -0.26 0.00 0.00 58.87 56.44 1ocp n SER 14 Cb 0.86 0.15 -0.01 0.00 -0.26 0.00 0.00 64.21 64.95 1ocp n SER 14 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1ocp n ILE 15 N -0.07 -0.35 -1.59 -1.33 2.08 -1.26 -4.52 119.36 112.31 1ocp n ILE 15 Ca -0.17 -2.55 -0.33 0.00 0.56 0.00 0.00 62.75 60.27 1ocp n ILE 15 Cb 0.84 -0.07 0.07 0.00 -0.75 0.00 0.00 39.64 39.73 1ocp n ILE 15 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1ocp s GLU 16 N -0.05 2.50 0.61 0.38 0.41 -1.26 -4.47 118.70 116.82 1ocp s GLU 16 Ca 0.33 1.50 0.33 0.00 -0.41 0.00 0.00 54.97 56.72 1ocp s GLU 16 Cb 0.18 -1.90 1.95 0.00 -1.78 0.00 0.00 34.13 32.58 1ocp s GLU 16 CO -0.18 -1.50 2.28 -0.97 -0.49 0.00 0.00 175.26 174.40 1ocp h ASN 17 N -0.20 0.00 0.90 -0.19 -1.24 -1.98 0.05 115.58 112.93 1ocp h ASN 17 Ca -0.47 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.32 1ocp h ASN 17 Cb 1.26 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.29 1ocp h ASN 17 CO 0.52 0.00 -1.08 -0.09 -1.29 0.00 0.00 177.43 175.50 1ocp h ARG 18 N 0.00 0.06 -0.32 6.67 9.65 -1.98 -3.17 114.38 125.28 1ocp h ARG 18 Ca -0.00 -0.10 -0.02 0.00 -1.10 0.00 0.00 59.98 58.76 1ocp h ARG 18 Cb 0.01 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 1ocp h ARG 18 CO 0.00 1.03 0.10 -0.24 2.80 0.00 0.00 179.97 183.66 1ocp h VAL 19 N 0.02 1.20 -0.35 0.20 3.04 -1.32 0.20 116.25 119.24 1ocp h VAL 19 Ca -0.05 -0.65 0.01 0.00 -1.01 0.00 0.00 66.70 65.01 1ocp h VAL 19 Cb 1.82 1.02 -0.02 0.00 -2.01 0.00 0.00 31.29 32.10 1ocp h VAL 19 CO 0.14 0.22 0.22 0.03 -1.01 0.00 0.00 177.57 177.17 1ocp h ARG 20 N 0.36 0.43 0.00 4.17 3.08 -1.57 -0.72 114.38 120.14 1ocp h ARG 20 Ca 0.10 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1ocp h ARG 20 Cb 0.24 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.19 1ocp h ARG 20 CO -0.00 0.29 0.00 0.91 -1.07 0.00 0.00 179.97 180.09 1ocp n TRP 21 N -4.87 0.00 0.05 3.04 5.03 -1.14 -1.94 117.44 117.61 1ocp n TRP 21 Ca -0.00 0.00 -0.18 0.00 3.03 0.00 0.00 57.50 60.35 1ocp n TRP 21 Cb 0.04 -0.32 -0.08 0.00 -1.03 0.00 0.00 31.31 29.92 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 0.79 -0.50 -0.99 0.87 0.81 -2.86 113.55 111.68 1ocp h SER 22 Ca 0.00 -0.63 0.05 0.00 -1.23 0.00 0.00 61.79 59.98 1ocp h SER 22 Cb 0.30 -0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 61.97 1ocp h SER 22 CO 0.00 1.43 0.22 -0.07 -0.53 0.00 0.00 176.83 177.88 1ocp h LEU 23 N 0.35 0.28 -0.29 2.23 3.38 -0.59 -2.56 115.31 118.11 1ocp h LEU 23 Ca -0.11 0.04 0.07 0.00 0.09 0.00 0.00 57.88 57.97 1ocp h LEU 23 Cb 1.65 -0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.32 1ocp h LEU 23 CO 0.19 0.20 -0.27 -0.08 0.09 0.00 0.00 178.44 178.57 1ocp h GLU 24 N 0.43 -0.25 0.00 1.13 4.81 -1.29 0.67 114.58 120.09 1ocp h GLU 24 Ca 0.23 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1ocp h GLU 24 Cb 0.19 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.62 1ocp h GLU 24 CO -0.19 -0.17 -0.09 0.00 -0.73 0.00 0.00 179.01 177.83 1ocp h THR 25 N -0.26 0.92 0.00 0.32 1.03 -1.28 -0.88 112.91 112.75 1ocp h THR 25 Ca 0.15 -0.34 -0.09 0.00 -0.01 0.00 0.00 66.41 66.12 1ocp h THR 25 Cb 0.49 1.19 -0.01 0.00 -1.07 0.00 0.00 68.15 68.75 1ocp h THR 25 CO -0.43 0.09 -0.44 0.24 -0.01 0.00 0.00 175.52 174.97 1ocp h MET 26 N 0.00 0.00 0.00 0.00 2.86 -0.56 -3.17 114.93 114.06 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 0.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.84 1ocp h MET 26 CO 0.01 0.44 -0.94 1.19 1.06 0.00 0.00 176.91 178.67 1ocp n PHE 27 N -3.36 0.57 -0.18 -0.22 3.72 -0.18 -4.01 117.46 113.79 1ocp n PHE 27 Ca 0.01 0.16 -0.01 0.00 -0.05 0.00 0.00 57.45 57.56 1ocp n PHE 27 Cb 0.62 -0.67 0.20 0.00 -0.94 0.00 0.00 39.48 38.69 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 -2.25 4.24 -0.12 4.37 4.77 -0.46 -3.99 117.00 123.57 1ocp n LEU 28 Ca 0.01 -2.18 -0.20 0.00 -0.03 0.00 0.00 56.01 53.61 1ocp n LEU 28 Cb 0.48 -0.64 -0.12 0.00 -2.33 0.00 0.00 43.42 40.81 1ocp n LEU 28 CO 0.39 0.58 -1.31 2.29 -1.33 0.00 0.00 177.39 178.02 1ocp n LYS 29 N 0.11 0.65 -3.91 3.23 2.85 -1.25 -4.98 118.16 114.86 1ocp n LYS 29 Ca 0.22 0.18 -0.11 0.00 -1.05 0.00 0.00 58.31 57.55 1ocp n LYS 29 Cb 0.93 -1.54 -0.12 0.00 -0.65 0.00 0.00 35.03 33.66 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 2.17 1.37 -3.14 0.00 -0.04 -1.26 -4.33 135.00 129.77 1ocp n PRO 31 Ca -0.19 -0.57 -0.26 0.00 -0.04 0.00 0.00 63.50 62.44 1ocp n PRO 31 Cb 0.57 -1.21 -0.06 0.00 -0.04 0.00 0.00 33.50 32.77 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 2.68 -2.46 0.54 2.85 -1.26 -5.06 118.16 115.35 1ocp n LYS 32 Ca 0.09 -4.60 -0.42 0.00 -1.05 0.00 0.00 58.31 52.33 1ocp n LYS 32 Cb 0.16 -2.15 -0.03 0.00 -0.65 0.00 0.00 35.03 32.36 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 -2.92 4.36 0.48 -1.58 0.04 -1.26 -5.01 135.00 129.10 1ocp s PRO 33 Ca 0.44 1.68 -0.17 0.00 0.04 0.00 0.00 61.00 62.99 1ocp s PRO 33 Cb 0.23 -3.54 -0.09 0.00 0.04 0.00 0.00 34.50 31.15 1ocp s PRO 33 CO -0.09 -0.43 0.95 -1.12 0.04 0.00 0.00 177.00 176.36 1ocp s SER 34 N 1.44 6.70 0.62 6.66 0.01 -1.26 -4.92 113.70 122.96 1ocp s SER 34 Ca 0.56 1.56 0.38 0.00 1.31 0.00 0.00 55.95 59.75 1ocp s SER 34 Cb -0.25 -2.50 2.04 0.00 0.21 0.00 0.00 66.02 65.52 1ocp s SER 34 CO 0.23 -0.50 2.26 0.17 0.41 0.00 0.00 173.24 175.81 1ocp h LEU 35 N 1.25 0.00 -0.36 2.44 -0.00 -1.99 0.20 115.31 116.85 1ocp h LEU 35 Ca -0.47 0.00 -0.15 0.00 -0.00 0.00 0.00 57.88 57.26 1ocp h LEU 35 Cb 1.18 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.84 1ocp h LEU 35 CO 0.62 0.02 -0.35 1.56 -0.00 0.00 0.00 178.44 180.29 1ocp h GLN 36 N 0.00 0.87 0.00 0.17 1.08 -2.00 -1.41 115.11 113.82 1ocp h GLN 36 Ca -0.00 -0.46 -0.03 0.00 -1.45 0.00 0.00 58.65 56.71 1ocp h GLN 36 Cb 0.10 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1ocp h GLN 36 CO 0.00 1.10 -0.16 0.37 -0.95 0.00 0.00 178.83 179.19 1ocp h GLN 37 N 0.67 0.00 -0.02 1.46 5.75 -1.03 -0.59 115.11 121.35 1ocp h GLN 37 Ca 0.06 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.44 1ocp h GLN 37 Cb 0.94 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.47 1ocp h GLN 37 CO 0.09 0.16 -0.55 0.82 -2.65 0.00 0.00 178.83 176.70 1ocp h ILE 38 N 0.00 1.39 -0.27 2.39 1.08 -0.16 0.40 117.51 122.34 1ocp h ILE 38 Ca -0.00 -1.88 -0.05 0.00 -0.39 0.00 0.00 64.86 62.53 1ocp h ILE 38 Cb 0.43 2.00 -0.01 0.00 -3.07 0.00 0.00 36.82 36.17 1ocp h ILE 38 CO 0.02 0.54 -0.04 0.74 -0.69 0.00 0.00 178.15 178.73 1ocp h THR 39 N 0.04 1.27 0.00 -0.27 2.02 -0.29 -1.65 112.91 114.03 1ocp h THR 39 Ca -0.00 -1.01 -0.01 0.00 0.77 0.00 0.00 66.41 66.15 1ocp h THR 39 Cb 0.99 1.40 -0.00 0.00 -1.74 0.00 0.00 68.15 68.79 1ocp h THR 39 CO 0.07 0.32 -0.04 -0.74 0.37 0.00 0.00 175.52 175.50 1ocp h HIS 40 N 0.26 0.00 -0.22 3.16 -0.00 -1.13 -2.06 115.15 115.15 1ocp h HIS 40 Ca 0.07 0.00 -0.12 0.00 -0.00 0.00 0.00 60.37 60.32 1ocp h HIS 40 Cb 0.49 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.90 1ocp h HIS 40 CO 0.04 0.04 -0.33 0.82 -0.00 0.00 0.00 177.93 178.51 1ocp h ILE 41 N 0.00 1.32 0.21 6.26 5.03 -0.07 0.84 117.51 131.10 1ocp h ILE 41 Ca -0.00 -1.53 -0.01 0.00 -0.12 0.00 0.00 64.86 63.20 1ocp h ILE 41 Cb 0.41 1.77 0.00 0.00 -3.03 0.00 0.00 36.82 35.98 1ocp h ILE 41 CO 0.01 0.48 -0.10 0.00 -0.68 0.00 0.00 178.15 177.85 1ocp h ALA 42 N 0.63 -0.28 0.00 1.87 0.00 -0.65 0.13 119.26 120.96 1ocp h ALA 42 Ca 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ocp h ALA 42 Cb 0.91 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1ocp h ALA 42 CO 0.08 -0.61 0.00 -0.91 0.00 0.00 0.00 179.25 177.81 1ocp h ASN 43 N -0.38 0.00 0.64 0.00 2.35 -1.46 0.72 115.58 117.46 1ocp h ASN 43 Ca -0.03 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.56 1ocp h ASN 43 Cb 0.29 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1ocp h ASN 43 CO 0.05 0.00 -0.74 1.56 -1.65 0.00 0.00 177.43 176.64 1ocp h GLN 44 N 0.00 0.08 0.00 0.81 1.08 0.11 -3.34 115.11 113.86 1ocp h GLN 44 Ca 0.00 -0.08 -0.05 0.00 -1.45 0.00 0.00 58.65 57.07 1ocp h GLN 44 Cb 0.17 0.02 -0.12 0.00 -0.05 0.00 0.00 27.48 27.50 1ocp h GLN 44 CO 0.00 0.79 -0.57 1.47 -0.95 0.00 0.00 178.83 179.56 1ocp n LEU 45 N -3.70 1.13 -2.99 1.46 -0.00 -0.59 -5.01 117.00 107.29 1ocp n LEU 45 Ca -0.02 -2.11 -0.12 0.00 -0.00 0.00 0.00 56.01 53.77 1ocp n LEU 45 Cb 0.72 -0.16 -0.02 0.00 -0.00 0.00 0.00 43.42 43.96 1ocp n LEU 45 CO 0.45 0.58 -0.05 0.61 -0.00 0.00 0.00 177.39 178.98 1ocp n GLY 46 N -0.27 -0.48 4.03 1.47 0.00 0.24 -4.64 105.19 105.54 1ocp n GLY 46 Ca 0.08 0.02 -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 -5.62 3.06 0.11 0.99 2.34 -1.19 -4.93 118.68 113.44 1ocp s LEU 47 Ca 0.21 -0.89 -0.14 0.00 0.06 0.00 0.00 54.13 53.38 1ocp s LEU 47 Cb -0.12 -1.56 -0.07 0.00 -0.56 0.00 0.00 46.19 43.89 1ocp s LEU 47 CO 0.25 -1.37 0.50 -0.70 -1.06 0.00 0.00 176.35 173.98 1ocp s GLU 48 N -4.67 3.94 0.64 1.48 2.12 -1.26 -4.83 118.70 116.11 1ocp s GLU 48 Ca 0.61 0.43 0.32 0.00 0.36 0.00 0.00 54.97 56.69 1ocp s GLU 48 Cb -0.05 -2.99 1.75 0.00 0.26 0.00 0.00 34.13 33.09 1ocp s GLU 48 CO 0.39 0.52 2.03 0.87 -0.54 0.00 0.00 175.26 178.54 1ocp h LYS 49 N 3.74 0.00 -0.25 4.30 1.57 -1.98 -1.04 116.57 122.91 1ocp h LYS 49 Ca -0.49 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.10 1ocp h LYS 49 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1ocp h LYS 49 CO 0.65 0.00 -0.59 0.22 -0.57 0.00 0.00 179.45 179.17 1ocp h ASP 50 N 0.00 0.92 1.67 0.86 3.58 -2.00 -1.69 116.42 119.78 1ocp h ASP 50 Ca 0.05 -0.51 -0.06 0.00 0.42 0.00 0.00 57.03 56.92 1ocp h ASP 50 Cb 0.59 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 1ocp h ASP 50 CO -0.00 1.31 -0.33 1.62 -2.88 0.00 0.00 179.24 178.96 1ocp h VAL 51 N 0.62 0.50 0.00 2.25 3.04 -1.60 -2.86 116.25 118.19 1ocp h VAL 51 Ca 0.00 -1.71 -0.14 0.00 -1.01 0.00 0.00 66.70 63.84 1ocp h VAL 51 Cb 1.19 2.23 -0.02 0.00 -2.01 0.00 0.00 31.29 32.69 1ocp h VAL 51 CO 0.13 0.28 -0.69 1.62 -1.01 0.00 0.00 177.57 177.91 1ocp h VAL 52 N 0.00 1.20 0.05 1.51 3.04 -1.37 -1.95 116.25 118.73 1ocp h VAL 52 Ca -0.01 -2.63 -0.10 0.00 -1.01 0.00 0.00 66.70 62.96 1ocp h VAL 52 Cb 1.23 2.55 0.01 0.00 -2.01 0.00 0.00 31.29 33.07 1ocp h VAL 52 CO 0.04 0.67 -0.41 -0.09 -1.01 0.00 0.00 177.57 176.77 1ocp h ARG 53 N 0.00 0.19 -0.08 4.17 1.12 -1.28 -1.78 114.38 116.71 1ocp h ARG 53 Ca -0.01 -0.27 -0.07 0.00 -1.11 0.00 0.00 59.98 58.52 1ocp h ARG 53 Cb 1.49 0.09 -0.01 0.00 -0.01 0.00 0.00 29.97 31.54 1ocp h ARG 53 CO 0.09 1.07 -0.28 0.28 -3.11 0.00 0.00 179.97 178.02 1ocp h VAL 54 N -0.56 1.24 -0.10 0.20 2.07 -1.60 0.52 116.25 118.01 1ocp h VAL 54 Ca -0.06 -1.11 -0.17 0.00 0.82 0.00 0.00 66.70 66.17 1ocp h VAL 54 Cb 1.25 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 1ocp h VAL 54 CO 0.08 0.33 -0.67 -0.25 0.02 0.00 0.00 177.57 177.07 1ocp h TRP 55 N 0.14 0.56 0.00 1.57 7.01 -1.39 -2.78 115.95 121.05 1ocp h TRP 55 Ca 0.02 -0.23 0.00 0.00 2.11 0.00 0.00 58.89 60.79 1ocp h TRP 55 Cb 0.57 -0.09 0.00 0.00 -2.10 0.00 0.00 29.16 27.54 1ocp h TRP 55 CO 0.01 0.97 -0.18 0.34 -2.79 0.00 0.00 178.44 176.78 1ocp n PHE 56 N -3.87 0.03 -0.12 2.65 7.35 -0.67 -3.01 117.46 119.82 1ocp n PHE 56 Ca -0.04 0.01 -0.11 0.00 -0.76 0.00 0.00 57.45 56.55 1ocp n PHE 56 Cb 0.67 -0.42 -0.02 0.00 0.35 0.00 0.00 39.48 40.05 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 0.46 0.92 0.14 0.00 7.08 -1.59 -2.37 115.58 120.22 1ocp h ASN 58 Ca 0.09 -0.51 -0.00 0.00 -3.08 0.00 0.00 56.30 52.80 1ocp h ASN 58 Cb 0.54 -0.26 -0.00 0.00 -2.08 0.00 0.00 38.32 36.52 1ocp h ASN 58 CO 0.03 1.25 -0.01 -0.09 -2.08 0.00 0.00 177.43 176.53 1ocp h ARG 59 N 0.61 0.00 0.15 4.14 1.12 -1.40 -1.89 114.38 117.10 1ocp h ARG 59 Ca 0.03 0.00 -0.32 0.00 -1.11 0.00 0.00 59.98 58.58 1ocp h ARG 59 Cb 1.05 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.01 1ocp h ARG 59 CO 0.10 0.01 -1.55 0.00 -3.11 0.00 0.00 179.97 175.42 1ocp h ARG 60 N 0.00 0.31 -2.18 0.20 3.08 -0.44 -3.37 114.38 111.97 1ocp h ARG 60 Ca -0.00 -0.53 -0.63 0.00 0.07 0.00 0.00 59.98 58.89 1ocp h ARG 60 Cb 0.08 0.20 -0.39 0.00 0.08 0.00 0.00 29.97 29.94 1ocp h ARG 60 CO 0.00 1.20 -0.30 0.00 -1.07 0.00 0.00 179.97 179.80 1ocp n GLN 61 N -3.51 3.65 0.06 0.04 10.64 -0.75 -4.72 117.38 122.79 1ocp n GLN 61 Ca -0.17 -4.75 -0.10 0.00 -1.83 0.00 0.00 57.00 50.14 1ocp n GLN 61 Cb 1.05 -2.28 -0.13 0.00 -0.86 0.00 0.00 30.24 28.02 1ocp n GLN 61 CO 0.00 0.00 0.00 0.87 -1.83 0.00 0.00 177.06 176.10 1ocp h LYS 62 N 3.15 0.09 0.00 2.61 1.79 -1.65 -3.44 116.57 119.12 1ocp h LYS 62 Ca 0.24 -0.15 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 1ocp h LYS 62 Cb 0.50 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 1ocp h LYS 62 CO 0.91 1.00 0.00 0.41 -1.08 0.00 0.00 179.45 180.69 1ocp n GLY 63 N 1.45 0.00 0.09 3.86 0.00 -1.26 -5.02 105.19 104.30 1ocp n GLY 63 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 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 0.63 -3.40 1.61 5.02 -1.26 -4.58 118.16 116.17 1ocp n LYS 64 Ca 0.00 0.25 -0.26 0.00 -2.02 0.00 0.00 58.31 56.28 1ocp n LYS 64 Cb 0.00 -1.78 -0.09 0.00 -0.02 0.00 0.00 35.03 33.14 1ocp n LYS 64 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1ocp n ARG 65 N -2.97 0.85 -3.46 1.97 1.85 -1.26 -5.10 116.66 108.54 1ocp n ARG 65 Ca -0.15 -3.54 -0.37 0.00 -1.00 0.00 0.00 57.85 52.78 1ocp n ARG 65 Cb 0.98 -1.68 -0.06 0.00 -1.05 0.00 0.00 32.46 30.65 1ocp n ARG 65 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 1ocp s SER 66 N -0.84 6.63 0.00 2.89 1.04 -1.26 -5.14 113.70 117.01 1ocp s SER 66 Ca 0.33 0.74 0.00 0.00 0.48 0.00 0.00 55.95 57.51 1ocp s SER 66 Cb 0.08 -2.23 0.00 0.00 0.10 0.00 0.00 66.02 63.97 1ocp s SER 66 CO -0.15 0.15 0.19 -0.24 0.98 0.00 0.00 173.24 174.17