#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ocx n THR 3 N 0.00 1.71 -0.16 0.44 -2.24 -1.26 -4.88 114.28 107.89 1ocx n THR 3 Ca 0.00 -0.39 0.03 0.00 -2.27 0.00 0.00 64.05 61.42 1ocx n THR 3 Cb 0.00 -0.73 0.31 0.00 -2.10 0.00 0.00 70.33 67.81 1ocx n THR 3 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1ocx h GLU 4 N -0.41 0.83 -0.32 -0.78 4.39 -1.97 -2.02 114.58 114.28 1ocx h GLU 4 Ca -0.45 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.23 1ocx h GLU 4 Cb 1.35 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 29.78 1ocx h GLU 4 CO 0.42 0.55 0.13 -0.22 -1.16 0.00 0.00 179.01 178.73 1ocx h LYS 5 N 0.85 0.28 -0.17 2.33 3.64 -1.92 0.15 116.57 121.73 1ocx h LYS 5 Ca 0.25 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.52 1ocx h LYS 5 Cb -0.02 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1ocx h LYS 5 CO -0.06 0.18 -0.30 1.05 -2.27 0.00 0.00 179.45 178.04 1ocx h GLU 6 N 0.28 0.34 -0.44 1.90 4.11 -1.75 -1.58 114.58 117.44 1ocx h GLU 6 Ca 0.14 -0.13 -0.04 0.00 0.07 0.00 0.00 59.36 59.40 1ocx h GLU 6 Cb 0.09 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1ocx h GLU 6 CO -0.13 0.61 0.11 0.87 0.07 0.00 0.00 179.01 180.54 1ocx h LYS 7 N 0.30 0.70 0.18 1.06 1.57 -0.90 -0.94 116.57 118.54 1ocx h LYS 7 Ca 0.04 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1ocx h LYS 7 Cb 0.69 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 1ocx h LYS 7 CO 0.05 0.70 -0.16 1.98 -0.57 0.00 0.00 179.45 181.45 1ocx h MET 8 N 0.57 -0.35 -0.35 3.15 4.05 -0.32 0.10 114.93 121.78 1ocx h MET 8 Ca 0.14 0.02 -0.06 0.00 -0.28 0.00 0.00 59.70 59.52 1ocx h MET 8 Cb 0.32 0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.18 1ocx h MET 8 CO 0.00 -0.24 -0.04 0.82 0.23 0.00 0.00 176.91 177.68 1ocx h ILE 9 N -0.37 1.22 0.00 1.77 2.04 -1.25 -1.55 117.51 119.37 1ocx h ILE 9 Ca -0.00 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 64.95 1ocx h ILE 9 Cb 0.34 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1ocx h ILE 9 CO -0.03 0.31 0.00 0.00 0.00 0.00 0.00 178.15 178.43 1ocx n ALA 10 N -2.48 2.31 -2.03 1.87 0.00 -0.36 -4.56 120.51 115.26 1ocx n ALA 10 Ca 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1ocx n ALA 10 Cb 0.28 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1ocx n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ocx n GLY 11 N 0.72 0.54 3.71 0.00 0.00 -0.58 -5.05 105.19 104.52 1ocx n GLY 11 Ca 0.14 -0.82 -0.25 0.00 0.00 0.00 0.00 46.02 45.09 1ocx n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ocx s GLU 12 N -4.08 2.17 0.20 1.61 2.02 0.30 -4.71 118.70 116.22 1ocx s GLU 12 Ca 0.00 -1.86 -0.33 0.00 0.02 0.00 0.00 54.97 52.80 1ocx s GLU 12 Cb 0.00 -1.93 -0.14 0.00 0.10 0.00 0.00 34.13 32.16 1ocx s GLU 12 CO 0.00 -0.06 1.51 1.28 0.02 0.00 0.00 175.26 178.01 1ocx n LEU 13 N -1.16 3.14 -4.10 1.80 4.77 -1.26 -4.27 117.00 115.92 1ocx n LEU 13 Ca -0.02 1.11 -0.11 0.00 -0.03 0.00 0.00 56.01 56.96 1ocx n LEU 13 Cb 0.64 -1.43 -0.08 0.00 -2.33 0.00 0.00 43.42 40.22 1ocx n LEU 13 CO 0.46 -0.35 -0.07 -0.72 -1.33 0.00 0.00 177.39 175.38 1ocx s TYR 14 N 0.51 0.79 -0.27 -1.77 1.13 0.41 -4.73 117.35 113.41 1ocx s TYR 14 Ca 0.74 -1.08 -0.03 0.00 -1.41 0.00 0.00 57.07 55.30 1ocx s TYR 14 Cb -0.66 -0.24 0.03 0.00 -1.10 0.00 0.00 41.96 39.99 1ocx s TYR 14 CO 0.43 -0.77 -0.02 0.50 -2.51 0.00 0.00 175.55 173.18 1ocx s ARG 15 N -4.09 2.75 0.50 -3.49 6.06 -1.26 -3.56 118.95 115.86 1ocx s ARG 15 Ca 0.30 -1.05 0.19 0.00 -2.50 0.00 0.00 55.73 52.67 1ocx s ARG 15 Cb 0.04 -3.11 1.28 0.00 0.06 0.00 0.00 34.95 33.21 1ocx s ARG 15 CO 0.09 -0.48 2.09 0.66 -2.50 0.00 0.00 175.30 175.16 1ocx h SER 16 N 8.05 0.00 0.10 -2.12 4.64 -1.94 -2.50 113.55 119.78 1ocx h SER 16 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1ocx h SER 16 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1ocx h SER 16 CO 0.57 0.09 0.00 0.00 -0.87 0.00 0.00 176.83 176.62 1ocx n ALA 17 N -2.45 2.19 -1.59 5.18 0.00 -1.26 -4.19 120.51 118.39 1ocx n ALA 17 Ca -0.03 -0.12 -0.50 0.00 0.00 0.00 0.00 53.44 52.79 1ocx n ALA 17 Cb 0.18 -1.33 -0.05 0.00 0.00 0.00 0.00 19.45 18.25 1ocx n ALA 17 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ocx n ASP 18 N -1.08 1.62 -0.12 0.00 2.03 -0.94 -4.81 116.55 113.25 1ocx n ASP 18 Ca 0.14 1.13 0.00 0.00 0.52 0.00 0.00 54.79 56.58 1ocx n ASP 18 Cb 0.09 -1.22 0.28 0.00 -0.72 0.00 0.00 41.12 39.56 1ocx n ASP 18 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1ocx h GLU 19 N 4.17 0.80 -0.60 -0.67 4.11 -1.92 -1.29 114.58 119.18 1ocx h GLU 19 Ca -0.46 -0.09 -0.09 0.00 0.07 0.00 0.00 59.36 58.80 1ocx h GLU 19 Cb 1.33 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 1ocx h GLU 19 CO 0.75 0.60 0.02 1.15 0.07 0.00 0.00 179.01 181.60 1ocx h THR 20 N 0.80 1.26 -0.17 -1.06 2.02 -1.95 -1.49 112.91 112.33 1ocx h THR 20 Ca 0.20 -1.12 -0.11 0.00 0.77 0.00 0.00 66.41 66.16 1ocx h THR 20 Cb 0.04 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1ocx h THR 20 CO -0.03 0.41 -0.37 -0.07 0.37 0.00 0.00 175.52 175.82 1ocx h LEU 21 N 0.94 0.38 -0.60 2.58 3.38 -1.67 -1.89 115.31 118.44 1ocx h LEU 21 Ca 0.17 -0.15 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 1ocx h LEU 21 Cb 0.53 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1ocx h LEU 21 CO 0.03 0.72 -0.57 0.28 0.09 0.00 0.00 178.44 178.99 1ocx h SER 22 N 0.31 0.45 -0.32 -0.43 0.02 -0.95 -1.54 113.55 111.08 1ocx h SER 22 Ca 0.03 -0.24 -0.13 0.00 -0.84 0.00 0.00 61.79 60.61 1ocx h SER 22 Cb 0.80 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1ocx h SER 22 CO 0.06 0.92 -0.26 0.03 -1.14 0.00 0.00 176.83 176.44 1ocx h ARG 23 N 0.30 0.82 -0.47 3.45 2.47 -1.20 -2.60 114.38 117.16 1ocx h ARG 23 Ca 0.00 -0.36 -0.02 0.00 -1.26 0.00 0.00 59.98 58.34 1ocx h ARG 23 Cb 1.08 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 29.36 1ocx h ARG 23 CO 0.10 0.99 0.20 -0.44 0.56 0.00 0.00 179.97 181.37 1ocx h ASP 24 N 0.71 0.64 -0.16 7.04 3.32 -0.88 -1.03 116.42 126.06 1ocx h ASP 24 Ca 0.09 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 56.91 1ocx h ASP 24 Cb 0.79 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 1ocx h ASP 24 CO 0.07 0.62 -0.11 0.03 -1.72 0.00 0.00 179.24 178.13 1ocx h ARG 25 N 0.62 0.52 -0.15 3.56 3.08 -1.27 -1.69 114.38 119.04 1ocx h ARG 25 Ca 0.16 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1ocx h ARG 25 Cb 0.17 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1ocx h ARG 25 CO -0.02 0.63 0.03 1.25 -1.07 0.00 0.00 179.97 180.80 1ocx h LEU 26 N 0.48 0.24 -0.57 3.04 5.85 -1.07 -0.84 115.31 122.44 1ocx h LEU 26 Ca 0.09 -0.25 0.05 0.00 0.84 0.00 0.00 57.88 58.62 1ocx h LEU 26 Cb 0.49 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1ocx h LEU 26 CO 0.03 0.42 0.29 -0.09 -0.34 0.00 0.00 178.44 178.76 1ocx h ARG 27 N 0.04 0.54 -0.52 1.25 9.65 -0.92 -0.89 114.38 123.54 1ocx h ARG 27 Ca 0.05 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.90 1ocx h ARG 27 Cb 0.28 -0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 28.72 1ocx h ARG 27 CO 0.00 0.36 0.33 0.00 2.80 0.00 0.00 179.97 183.46 1ocx h ALA 28 N 1.31 0.66 -0.57 2.80 0.00 -1.11 -0.76 119.26 121.59 1ocx h ALA 28 Ca 0.26 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1ocx h ALA 28 Cb 0.17 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1ocx h ALA 28 CO -0.18 0.12 0.35 -0.09 0.00 0.00 0.00 179.25 179.45 1ocx h ARG 29 N 0.70 0.77 -0.33 0.00 2.43 -0.65 0.19 114.38 117.49 1ocx h ARG 29 Ca 0.19 -0.07 0.05 0.00 -0.81 0.00 0.00 59.98 59.34 1ocx h ARG 29 Cb -0.05 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.29 1ocx h ARG 29 CO -0.04 0.55 0.07 1.96 -1.51 0.00 0.00 179.97 181.00 1ocx h GLN 30 N 0.77 0.18 -0.34 0.20 4.20 -0.60 0.12 115.11 119.64 1ocx h GLN 30 Ca 0.21 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.82 1ocx h GLN 30 Cb -0.03 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1ocx h GLN 30 CO -0.04 0.12 -0.11 -0.07 -0.67 0.00 0.00 178.83 178.06 1ocx h LEU 31 N 0.19 0.68 -0.29 1.46 3.38 -0.77 -2.04 115.31 117.92 1ocx h LEU 31 Ca 0.16 -0.38 0.01 0.00 0.09 0.00 0.00 57.88 57.75 1ocx h LEU 31 Cb 0.17 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1ocx h LEU 31 CO -0.20 0.91 0.17 0.40 0.09 0.00 0.00 178.44 179.81 1ocx h ILE 32 N 0.45 1.04 -0.86 1.22 1.08 -0.38 0.14 117.51 120.20 1ocx h ILE 32 Ca 0.08 -0.12 0.07 0.00 -0.39 0.00 0.00 64.86 64.50 1ocx h ILE 32 Cb 0.63 0.66 -0.06 0.00 -3.07 0.00 0.00 36.82 34.97 1ocx h ILE 32 CO 0.04 0.06 0.53 -0.74 -0.69 0.00 0.00 178.15 177.35 1ocx h HIS 33 N 0.35 0.97 -0.36 1.37 2.76 -0.70 0.15 115.15 119.71 1ocx h HIS 33 Ca 0.11 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.22 1ocx h HIS 33 Cb -0.01 -0.31 -0.01 0.00 1.55 0.00 0.00 27.41 28.63 1ocx h HIS 33 CO -0.07 0.48 -0.11 0.00 -1.30 0.00 0.00 177.93 176.92 1ocx h ARG 34 N 0.95 0.71 -0.16 5.26 3.08 -0.85 -2.63 114.38 120.75 1ocx h ARG 34 Ca 0.38 -0.28 0.01 0.00 0.07 0.00 0.00 59.98 60.16 1ocx h ARG 34 Cb 0.20 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1ocx h ARG 34 CO -0.19 0.88 0.07 -0.92 -1.07 0.00 0.00 179.97 178.74 1ocx h TYR 35 N 0.50 0.13 0.00 3.04 3.20 -0.23 -2.22 116.97 121.38 1ocx h TYR 35 Ca 0.09 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.91 1ocx h TYR 35 Cb 0.63 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.86 1ocx h TYR 35 CO 0.05 0.08 -0.26 -0.91 -1.64 0.00 0.00 178.16 175.48 1ocx h ASN 36 N 0.16 0.00 -0.04 -2.11 2.35 -0.61 -2.67 115.58 112.66 1ocx h ASN 36 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1ocx h ASN 36 Cb 0.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1ocx h ASN 36 CO -0.05 0.26 0.00 1.41 -1.65 0.00 0.00 177.43 177.40 1ocx n HIS 37 N -3.66 0.01 -1.87 1.19 8.25 -1.00 -4.93 115.22 113.21 1ocx n HIS 37 Ca -0.01 -0.01 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 1ocx n HIS 37 Cb 0.38 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.46 1ocx n HIS 37 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1ocx s SER 38 N -1.99 6.53 1.35 0.41 1.04 -0.85 -4.99 113.70 115.22 1ocx s SER 38 Ca 0.30 2.66 -0.21 0.00 0.48 0.00 0.00 55.95 59.17 1ocx s SER 38 Cb 0.20 -2.59 0.33 0.00 0.10 0.00 0.00 66.02 64.07 1ocx s SER 38 CO 0.31 -0.89 0.76 0.18 0.98 0.00 0.00 173.24 174.58 1ocx n LEU 39 N 4.50 -0.62 -0.07 2.42 4.77 -1.26 -4.94 117.00 121.80 1ocx n LEU 39 Ca 0.15 -0.72 -0.16 0.00 -0.03 0.00 0.00 56.01 55.25 1ocx n LEU 39 Cb 0.38 -0.96 -0.13 0.00 -2.33 0.00 0.00 43.42 40.38 1ocx n LEU 39 CO 0.63 -4.24 0.22 0.00 -1.33 0.00 0.00 177.39 172.67 1ocx h ALA 40 N -3.39 0.03 0.00 -1.18 0.00 -2.01 -3.25 119.26 109.46 1ocx h ALA 40 Ca -0.37 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 53.91 1ocx h ALA 40 Cb 1.19 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ocx h ALA 40 CO 0.23 0.14 0.00 -0.85 0.00 0.00 0.00 179.25 178.77 1ocx n GLU 41 N -4.54 0.52 -0.59 0.00 0.28 -1.26 -3.90 120.64 111.15 1ocx n GLU 41 Ca -0.14 0.00 -0.04 0.00 -0.16 0.00 0.00 57.16 56.83 1ocx n GLU 41 Cb 0.54 -1.45 0.00 0.00 1.43 0.00 0.00 31.44 31.97 1ocx n GLU 41 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1ocx n GLU 42 N -0.95 1.19 -0.02 3.44 1.02 -1.23 -4.61 120.64 119.47 1ocx n GLU 42 Ca 0.11 -0.34 0.16 0.00 -0.02 0.00 0.00 57.16 57.07 1ocx n GLU 42 Cb 0.05 -1.15 0.61 0.00 -0.02 0.00 0.00 31.44 30.93 1ocx n GLU 42 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ocx h HIS 43 N 1.14 0.19 -0.12 -0.32 3.86 -1.86 -1.83 115.15 116.21 1ocx h HIS 43 Ca 0.06 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.24 1ocx h HIS 43 Cb 0.99 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 29.40 1ocx h HIS 43 CO 0.38 0.08 -0.10 1.79 0.86 0.00 0.00 177.93 180.95 1ocx h THR 44 N 0.17 1.34 -0.31 2.45 1.35 -1.95 -1.36 112.91 114.61 1ocx h THR 44 Ca 0.25 -1.22 0.04 0.00 -0.55 0.00 0.00 66.41 64.94 1ocx h THR 44 Cb 0.77 1.89 -0.04 0.00 -1.73 0.00 0.00 68.15 69.05 1ocx h THR 44 CO -0.04 0.35 0.09 0.25 -0.25 0.00 0.00 175.52 175.92 1ocx h LEU 45 N -0.11 0.07 -0.66 3.87 5.85 -1.80 -0.27 115.31 122.26 1ocx h LEU 45 Ca 0.02 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1ocx h LEU 45 Cb 0.60 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.63 1ocx h LEU 45 CO 0.02 0.08 0.41 0.03 -0.34 0.00 0.00 178.44 178.64 1ocx h ARG 46 N 0.21 0.79 -0.55 1.25 3.08 -1.26 0.18 114.38 118.09 1ocx h ARG 46 Ca 0.14 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 1ocx h ARG 46 Cb 0.13 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1ocx h ARG 46 CO -0.16 0.52 0.11 0.37 -1.07 0.00 0.00 179.97 179.75 1ocx h GLN 47 N 0.81 0.89 -0.37 0.04 4.15 -0.86 -1.88 115.11 117.89 1ocx h GLN 47 Ca 0.26 -0.23 -0.11 0.00 0.77 0.00 0.00 58.65 59.35 1ocx h GLN 47 Cb 0.00 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 1ocx h GLN 47 CO -0.10 0.85 -0.20 1.96 -1.93 0.00 0.00 178.83 179.41 1ocx h GLN 48 N 0.78 0.72 -0.04 1.69 4.20 -0.65 -1.17 115.11 120.65 1ocx h GLN 48 Ca 0.17 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 1ocx h GLN 48 Cb 0.37 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 1ocx h GLN 48 CO 0.01 0.87 0.01 0.82 -0.67 0.00 0.00 178.83 179.86 1ocx h ILE 49 N 0.63 1.18 -0.82 2.54 2.04 -0.77 -1.64 117.51 120.68 1ocx h ILE 49 Ca 0.09 -0.53 0.06 0.00 1.00 0.00 0.00 64.86 65.48 1ocx h ILE 49 Cb 0.69 1.46 -0.05 0.00 -0.74 0.00 0.00 36.82 38.18 1ocx h ILE 49 CO 0.05 0.14 0.54 -0.07 0.00 0.00 0.00 178.15 178.81 1ocx h LEU 50 N -0.14 0.80 -0.96 1.44 3.38 -1.23 0.73 115.31 119.32 1ocx h LEU 50 Ca 0.01 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1ocx h LEU 50 Cb 0.22 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1ocx h LEU 50 CO -0.00 0.52 0.09 0.00 0.09 0.00 0.00 178.44 179.14 1ocx h ALA 51 N 1.55 1.15 0.00 1.53 0.00 -0.90 -1.76 119.26 120.84 1ocx h ALA 51 Ca 0.35 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 1ocx h ALA 51 Cb 0.21 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1ocx h ALA 51 CO -0.12 0.57 -0.57 -0.44 0.00 0.00 0.00 179.25 178.68 1ocx h ASP 52 N 0.81 0.00 0.04 0.00 3.32 -0.59 -3.37 116.42 116.63 1ocx h ASP 52 Ca 0.17 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.03 1ocx h ASP 52 Cb 0.35 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1ocx h ASP 52 CO 0.01 0.57 -1.00 0.25 -1.72 0.00 0.00 179.24 177.35 1ocx h LEU 53 N 0.00 0.14-10.36 1.55 5.85 -0.55 -3.48 115.31 108.46 1ocx h LEU 53 Ca -0.01 -0.76 -0.49 0.00 0.84 0.00 0.00 57.88 57.47 1ocx h LEU 53 Cb 1.24 -0.05 0.05 0.00 0.37 0.00 0.00 40.66 42.27 1ocx h LEU 53 CO 0.07 1.42 0.19 -0.36 -0.34 0.00 0.00 178.44 179.42 1ocx s PHE 54 N -2.37 3.46 0.20 1.25 0.08 -0.69 -1.96 117.98 117.96 1ocx s PHE 54 Ca -0.23 0.83 0.12 0.00 0.12 0.00 0.00 56.93 57.77 1ocx s PHE 54 Cb 0.03 -2.54 0.30 0.00 -0.57 0.00 0.00 43.02 40.25 1ocx s PHE 54 CO 0.68 -0.56 1.57 0.78 -0.10 0.00 0.00 175.22 177.59 1ocx h GLY 55 N -0.02 0.00 -5.01 4.36 0.00 -0.54 -3.44 103.07 98.42 1ocx h GLY 55 Ca -0.46 0.00 0.01 0.00 0.00 0.00 0.00 47.33 46.88 1ocx h GLY 55 CO 0.61 0.00 0.02 1.62 0.00 0.00 0.00 176.54 178.80 1ocx s GLN 56 N -3.42 0.72 -0.23 4.80 2.00 -1.09 -4.96 119.66 117.47 1ocx s GLN 56 Ca -0.00 1.21 -0.26 0.00 -2.00 0.00 0.00 55.36 54.30 1ocx s GLN 56 Cb 0.12 0.16 0.10 0.00 0.80 0.00 0.00 33.01 34.18 1ocx s GLN 56 CO 0.76 -0.15 0.87 0.54 -0.50 0.00 0.00 175.29 176.81 1ocx s VAL 57 N 1.54 0.00 0.00 1.34 0.11 -1.26 -0.58 120.40 121.55 1ocx s VAL 57 Ca -0.09 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.96 1ocx s VAL 57 Cb -0.05 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.80 1ocx s VAL 57 CO -0.18 0.00 0.00 0.35 -3.33 0.00 0.00 175.10 171.94 1ocx n THR 58 N 2.05 0.00 -3.36 5.04 -2.24 -1.26 -4.98 114.28 109.52 1ocx n THR 58 Ca -0.14 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.27 1ocx n THR 58 Cb 0.56 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.73 1ocx n THR 58 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1ocx s GLU 59 N 0.44 4.29 -0.24 -0.78 8.01 -1.26 -4.98 118.70 124.19 1ocx s GLU 59 Ca 0.00 0.39 -0.09 0.00 0.01 0.00 0.00 54.97 55.28 1ocx s GLU 59 Cb 0.00 -3.42 0.10 0.00 -4.31 0.00 0.00 34.13 26.50 1ocx s GLU 59 CO 0.00 0.22 0.52 0.00 0.01 0.00 0.00 175.26 176.01 1ocx s ALA 60 N 0.44 -1.50 -0.25 5.21 0.00 -1.26 -1.65 121.76 122.75 1ocx s ALA 60 Ca 0.24 1.87 -0.05 0.00 0.00 0.00 0.00 51.96 54.03 1ocx s ALA 60 Cb -0.15 -1.43 0.00 0.00 0.00 0.00 0.00 23.12 21.55 1ocx s ALA 60 CO 0.10 -0.71 0.00 -0.47 0.00 0.00 0.00 175.76 174.68 1ocx s TYR 61 N 2.44 3.05 -0.20 0.00 6.14 -0.01 -4.97 117.35 123.81 1ocx s TYR 61 Ca -0.05 -1.06 -0.02 0.00 0.64 0.00 0.00 57.07 56.59 1ocx s TYR 61 Cb -0.11 -2.15 0.06 0.00 0.42 0.00 0.00 41.96 40.18 1ocx s TYR 61 CO -0.16 -0.58 0.01 0.42 0.64 0.00 0.00 175.55 175.88 1ocx s ILE 62 N 1.46 0.78 0.14 3.14 1.01 -1.26 -1.10 121.20 125.38 1ocx s ILE 62 Ca 0.04 -0.70 -0.30 0.00 0.00 0.00 0.00 60.65 59.68 1ocx s ILE 62 Cb -0.16 -1.21 -0.07 0.00 0.01 0.00 0.00 42.46 41.02 1ocx s ILE 62 CO -0.01 -0.16 1.23 -1.61 0.00 0.00 0.00 174.94 174.39 1ocx s GLU 63 N 1.74 4.44 0.67 2.79 2.02 -0.40 -4.97 118.70 124.99 1ocx s GLU 63 Ca -0.02 1.89 -0.15 0.00 0.02 0.00 0.00 54.97 56.71 1ocx s GLU 63 Cb -0.17 -3.27 0.00 0.00 0.10 0.00 0.00 34.13 30.80 1ocx s GLU 63 CO -0.07 -0.19 1.13 -2.14 0.02 0.00 0.00 175.26 174.00 1ocx s PRO 64 N 0.30 2.69 0.20 0.39 0.02 -1.26 -4.05 135.00 133.30 1ocx s PRO 64 Ca 0.56 1.49 -0.15 0.00 0.02 0.00 0.00 61.00 62.93 1ocx s PRO 64 Cb -0.33 -1.93 -0.08 0.00 0.02 0.00 0.00 34.50 32.19 1ocx s PRO 64 CO 0.34 -1.35 0.61 0.95 -0.33 0.00 0.00 177.00 177.22 1ocx s THR 65 N -2.21 4.78 0.19 0.99 -4.23 -1.26 -4.38 115.64 109.52 1ocx s THR 65 Ca 0.69 0.88 0.10 0.00 -1.18 0.00 0.00 61.69 62.18 1ocx s THR 65 Cb -0.23 -3.72 -0.04 0.00 1.34 0.00 0.00 72.50 69.85 1ocx s THR 65 CO 0.41 0.12 -0.22 0.12 -0.54 0.00 0.00 174.62 174.52 1ocx s PHE 66 N -1.61 2.14 -0.13 3.99 5.36 -1.26 -0.59 117.98 125.89 1ocx s PHE 66 Ca 0.43 -0.39 -0.10 0.00 -0.96 0.00 0.00 56.93 55.90 1ocx s PHE 66 Cb -0.14 -1.05 0.04 0.00 -0.34 0.00 0.00 43.02 41.53 1ocx s PHE 66 CO 0.20 0.46 0.33 0.50 -1.46 0.00 0.00 175.22 175.25 1ocx s ARG 67 N -2.76 0.37 0.26 10.12 3.52 -1.05 -4.92 118.95 124.48 1ocx s ARG 67 Ca 0.20 0.52 -0.07 0.00 -0.13 0.00 0.00 55.73 56.25 1ocx s ARG 67 Cb -0.07 0.12 -0.01 0.00 -1.56 0.00 0.00 34.95 33.42 1ocx s ARG 67 CO 0.09 -0.08 0.37 0.00 -0.81 0.00 0.00 175.30 174.88 1ocx n ASP 69 N -0.61 2.01 -0.00 0.00 8.00 -1.24 -4.81 116.55 119.90 1ocx n ASP 69 Ca 0.00 0.17 -0.00 0.00 0.71 0.00 0.00 54.79 55.67 1ocx n ASP 69 Cb 0.63 -0.75 -0.00 0.00 -0.02 0.00 0.00 41.12 40.98 1ocx n ASP 69 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1ocx n TYR 70 N -3.73 0.00 0.00 1.24 4.01 -1.26 -4.41 117.16 113.01 1ocx n TYR 70 Ca -0.40 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.34 1ocx n TYR 70 Cb 0.94 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.93 1ocx n TYR 70 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ocx n GLY 71 N 3.16 1.90 0.03 2.72 0.00 -1.26 -4.70 105.19 107.04 1ocx n GLY 71 Ca -0.01 -0.22 0.08 0.00 0.00 0.00 0.00 46.02 45.87 1ocx n GLY 71 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1ocx n TYR 72 N 0.00 0.20 1.30 1.61 0.18 -0.83 -1.51 117.16 118.12 1ocx n TYR 72 Ca 0.00 0.08 0.12 0.00 1.88 0.00 0.00 57.90 59.98 1ocx n TYR 72 Cb 0.00 -0.63 0.42 0.00 -0.38 0.00 0.00 39.34 38.76 1ocx n TYR 72 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 1ocx n ASN 73 N -1.68 1.76 -4.64 9.48 3.02 -1.26 -3.60 115.26 118.34 1ocx n ASN 73 Ca 0.03 -1.64 -0.37 0.00 -0.03 0.00 0.00 54.58 52.57 1ocx n ASN 73 Cb 0.18 -0.05 -0.09 0.00 -0.61 0.00 0.00 39.78 39.20 1ocx n ASN 73 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ocx s ILE 74 N -1.89 5.30 -0.20 2.41 1.01 -0.57 -0.52 121.20 126.73 1ocx s ILE 74 Ca 0.35 0.32 0.01 0.00 0.00 0.00 0.00 60.65 61.33 1ocx s ILE 74 Cb 0.20 -3.57 0.04 0.00 0.01 0.00 0.00 42.46 39.13 1ocx s ILE 74 CO 0.30 0.28 -0.12 -0.36 0.00 0.00 0.00 174.94 175.05 1ocx s PHE 75 N 1.39 2.59 -0.11 3.97 0.40 -0.22 -0.31 117.98 125.69 1ocx s PHE 75 Ca 0.10 -1.70 0.02 0.00 -0.60 0.00 0.00 56.93 54.75 1ocx s PHE 75 Cb -0.15 -1.72 -0.01 0.00 0.51 0.00 0.00 43.02 41.65 1ocx s PHE 75 CO 0.07 -0.77 -0.16 -0.51 0.70 0.00 0.00 175.22 174.55 1ocx s LEU 76 N 1.34 2.57 0.00 -0.37 1.43 0.25 -0.49 118.68 123.42 1ocx s LEU 76 Ca -0.01 -0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 52.69 1ocx s LEU 76 Cb -0.16 -1.55 0.06 0.00 0.03 0.00 0.00 46.19 44.57 1ocx s LEU 76 CO -0.09 0.20 0.33 0.61 0.23 0.00 0.00 176.35 177.64 1ocx n GLY 77 N 3.29 -1.31 3.74 -3.19 0.00 0.68 -4.02 105.19 104.38 1ocx n GLY 77 Ca -0.18 -1.67 -0.36 0.00 0.00 0.00 0.00 46.02 43.81 1ocx n GLY 77 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ocx s ASN 78 N -2.24 4.70 -1.24 1.61 0.02 -1.26 -3.93 114.94 112.60 1ocx s ASN 78 Ca 0.19 2.53 -0.04 0.00 -1.02 0.00 0.00 52.86 54.52 1ocx s ASN 78 Cb -0.01 -2.61 -0.01 0.00 0.02 0.00 0.00 41.25 38.64 1ocx s ASN 78 CO 0.13 -1.93 0.77 0.59 0.02 0.00 0.00 177.10 176.68 1ocx n ASN 79 N -1.93 -2.59 -4.79 -1.22 3.02 -1.18 -0.61 115.26 105.97 1ocx n ASN 79 Ca 0.15 -0.82 -0.39 0.00 -0.03 0.00 0.00 54.58 53.50 1ocx n ASN 79 Cb 0.49 -4.22 -0.06 0.00 -0.61 0.00 0.00 39.78 35.38 1ocx n ASN 79 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1ocx s PHE 80 N -3.57 3.86 -0.03 3.10 5.36 -0.66 -3.72 117.98 122.31 1ocx s PHE 80 Ca 0.13 1.57 0.01 0.00 -0.96 0.00 0.00 56.93 57.67 1ocx s PHE 80 Cb -0.03 -2.72 0.03 0.00 -0.34 0.00 0.00 43.02 39.95 1ocx s PHE 80 CO 0.80 0.49 -0.01 0.12 -1.46 0.00 0.00 175.22 175.16 1ocx s PHE 81 N -1.21 0.37 -0.03 10.12 2.19 -0.48 -0.83 117.98 128.11 1ocx s PHE 81 Ca 0.36 -0.03 -0.01 0.00 0.33 0.00 0.00 56.93 57.59 1ocx s PHE 81 Cb -0.22 -0.43 0.03 0.00 -1.31 0.00 0.00 43.02 41.09 1ocx s PHE 81 CO 0.25 -0.13 0.03 0.00 1.83 0.00 0.00 175.22 177.20 1ocx s ALA 82 N 0.96 0.19 1.22 11.12 0.00 -0.26 -0.50 121.76 134.49 1ocx s ALA 82 Ca -0.10 0.23 -0.20 0.00 0.00 0.00 0.00 51.96 51.89 1ocx s ALA 82 Cb -0.13 -0.40 0.29 0.00 0.00 0.00 0.00 23.12 22.88 1ocx s ALA 82 CO -0.01 -0.24 1.11 -0.80 0.00 0.00 0.00 175.76 175.82 1ocx s ASN 83 N 1.45 0.77 0.84 0.00 0.02 -0.01 -1.27 114.94 116.73 1ocx s ASN 83 Ca -0.04 0.59 -0.12 0.00 -1.02 0.00 0.00 52.86 52.27 1ocx s ASN 83 Cb -0.13 -0.81 0.10 0.00 0.02 0.00 0.00 41.25 40.44 1ocx s ASN 83 CO -0.03 -4.21 1.18 0.72 0.02 0.00 0.00 177.10 174.77 1ocx s PHE 84 N -3.00 1.80 -1.66 2.20 -0.71 -1.26 -3.75 117.98 111.59 1ocx s PHE 84 Ca 0.71 1.71 0.00 0.00 -1.04 0.00 0.00 56.93 58.31 1ocx s PHE 84 Cb -0.09 -3.40 0.00 0.00 -1.21 0.00 0.00 43.02 38.32 1ocx s PHE 84 CO 0.56 -2.75 0.00 -0.25 -1.34 0.00 0.00 175.22 171.44 1ocx n ASP 85 N -3.62 -5.35 -4.83 1.98 9.92 0.25 -0.15 116.55 114.74 1ocx n ASP 85 Ca 0.13 0.10 -0.33 0.00 -0.53 0.00 0.00 54.79 54.16 1ocx n ASP 85 Cb 0.51 -4.51 -0.04 0.00 -0.64 0.00 0.00 41.12 36.44 1ocx n ASP 85 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ocx s VAL 87 N -2.42 -0.10 -0.34 0.00 1.01 -0.17 -2.54 120.40 115.84 1ocx s VAL 87 Ca 0.61 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.83 1ocx s VAL 87 Cb -0.10 -0.22 0.11 0.00 0.00 0.00 0.00 36.38 36.16 1ocx s VAL 87 CO 0.25 0.10 0.13 -0.04 0.00 0.00 0.00 175.10 175.53 1ocx s MET 88 N 1.47 0.89 -0.71 2.72 -1.94 -0.37 -0.53 119.30 120.82 1ocx s MET 88 Ca -0.06 -1.34 -0.21 0.00 -1.71 0.00 0.00 55.69 52.38 1ocx s MET 88 Cb -0.12 -2.14 0.10 0.00 2.01 0.00 0.00 34.83 34.68 1ocx s MET 88 CO -0.05 -1.03 0.94 -0.51 -0.01 0.00 0.00 175.02 174.36 1ocx s LEU 89 N 1.28 4.84 -0.99 -0.03 1.43 -0.45 -3.61 118.68 121.16 1ocx s LEU 89 Ca 0.12 -1.40 -0.01 0.00 -1.03 0.00 0.00 54.13 51.81 1ocx s LEU 89 Cb -0.19 -2.38 0.32 0.00 0.03 0.00 0.00 46.19 43.96 1ocx s LEU 89 CO -0.18 -1.25 1.60 -0.90 0.23 0.00 0.00 176.35 175.85 1ocx n ASP 90 N 7.01 6.67 -0.18 2.29 5.75 -1.26 -2.59 116.55 134.24 1ocx n ASP 90 Ca 0.02 -3.60 -0.04 0.00 -0.01 0.00 0.00 54.79 51.16 1ocx n ASP 90 Cb 0.46 -1.12 0.15 0.00 -1.03 0.00 0.00 41.12 39.57 1ocx n ASP 90 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1ocx h VAL 91 N 2.70 1.24 -2.01 2.12 2.07 -1.91 -3.40 116.25 117.05 1ocx h VAL 91 Ca 0.38 -0.86 -0.60 0.00 0.82 0.00 0.00 66.70 66.44 1ocx h VAL 91 Cb 0.44 0.60 -0.12 0.00 -1.52 0.00 0.00 31.29 30.69 1ocx h VAL 91 CO 1.18 0.33 -0.67 0.00 0.02 0.00 0.00 177.57 178.43 1ocx n PRO 93 N -0.82 2.05 -3.94 0.00 -0.02 -1.26 -4.76 135.00 126.25 1ocx n PRO 93 Ca -0.05 0.73 -0.34 0.00 -2.02 0.00 0.00 63.50 61.82 1ocx n PRO 93 Cb 0.62 -2.39 -0.14 0.00 -0.02 0.00 0.00 33.50 31.57 1ocx n PRO 93 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ocx s ILE 94 N -0.03 2.77 -0.22 4.25 1.01 0.32 -1.10 121.20 128.20 1ocx s ILE 94 Ca 0.68 -1.58 -0.06 0.00 0.00 0.00 0.00 60.65 59.69 1ocx s ILE 94 Cb -0.65 -2.67 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 1ocx s ILE 94 CO 0.49 -0.18 0.03 -0.13 0.00 0.00 0.00 174.94 175.15 1ocx s ARG 95 N 1.18 3.63 -0.05 2.79 0.52 -0.22 -1.06 118.95 125.74 1ocx s ARG 95 Ca -0.04 -0.50 0.03 0.00 -0.52 0.00 0.00 55.73 54.70 1ocx s ARG 95 Cb -0.20 -3.18 0.01 0.00 0.52 0.00 0.00 34.95 32.09 1ocx s ARG 95 CO -0.03 -0.08 -0.13 0.42 0.02 0.00 0.00 175.30 175.50 1ocx s ILE 96 N 1.26 1.18 0.00 1.52 1.01 0.36 0.35 121.20 126.88 1ocx s ILE 96 Ca 0.04 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.15 1ocx s ILE 96 Cb -0.15 -1.05 0.00 0.00 0.01 0.00 0.00 42.46 41.27 1ocx s ILE 96 CO 0.02 0.36 0.00 0.61 0.00 0.00 0.00 174.94 175.93 1ocx n GLY 97 N 3.53 -1.28 3.85 6.18 0.00 -0.11 -0.23 105.19 117.13 1ocx n GLY 97 Ca -0.21 -1.55 -0.32 0.00 0.00 0.00 0.00 46.02 43.94 1ocx n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ocx s ASP 98 N -1.19 6.52 -1.46 1.61 1.01 -1.26 -3.11 116.67 118.79 1ocx s ASP 98 Ca 0.00 1.55 -0.09 0.00 0.71 0.00 0.00 52.55 54.73 1ocx s ASP 98 Cb 0.00 -2.50 0.04 0.00 1.01 0.00 0.00 42.92 41.46 1ocx s ASP 98 CO 0.00 -0.66 0.81 0.59 0.21 0.00 0.00 175.17 176.12 1ocx n ASN 99 N -1.81 -5.50 -4.75 0.27 3.02 0.23 -0.26 115.26 106.46 1ocx n ASN 99 Ca 0.07 -0.47 -0.40 0.00 -0.03 0.00 0.00 54.58 53.74 1ocx n ASN 99 Cb 0.54 -4.41 -0.06 0.00 -0.61 0.00 0.00 39.78 35.24 1ocx n ASN 99 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ocx s MET 101 N -1.14 1.74 -0.19 0.00 -1.94 -0.55 -1.38 119.30 115.85 1ocx s MET 101 Ca 0.41 -0.44 -0.04 0.00 -1.71 0.00 0.00 55.69 53.91 1ocx s MET 101 Cb -0.26 -1.89 -0.02 0.00 2.01 0.00 0.00 34.83 34.67 1ocx s MET 101 CO 0.32 -0.31 -0.02 -0.51 -0.01 0.00 0.00 175.02 174.48 1ocx s LEU 102 N 1.61 3.18 0.00 -0.03 1.43 0.35 -0.83 118.68 124.39 1ocx s LEU 102 Ca 0.03 -0.21 -0.10 0.00 -1.03 0.00 0.00 54.13 52.83 1ocx s LEU 102 Cb -0.14 -1.79 0.13 0.00 0.03 0.00 0.00 46.19 44.43 1ocx s LEU 102 CO -0.09 0.09 0.67 0.00 0.23 0.00 0.00 176.35 177.26 1ocx n ALA 103 N 4.05 -1.12 -1.77 4.21 0.00 -0.12 -0.83 120.51 124.92 1ocx n ALA 103 Ca -0.17 -0.91 -0.41 0.00 0.00 0.00 0.00 53.44 51.95 1ocx n ALA 103 Cb 0.52 -0.05 -0.00 0.00 0.00 0.00 0.00 19.45 19.92 1ocx n ALA 103 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1ocx s PRO 104 N -4.48 4.04 -1.27 0.00 0.02 -1.26 -3.72 135.00 128.33 1ocx s PRO 104 Ca 0.40 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.87 1ocx s PRO 104 Cb -0.02 -2.90 0.00 0.00 0.02 0.00 0.00 34.50 31.60 1ocx s PRO 104 CO 0.28 -0.54 0.00 0.41 -0.33 0.00 0.00 177.00 176.83 1ocx n GLY 105 N 0.55 0.38 3.74 0.52 0.00 0.78 -1.02 105.19 110.14 1ocx n GLY 105 Ca 0.02 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 1ocx n GLY 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ocx s VAL 106 N -2.62 3.47 -0.16 1.61 1.01 -1.24 -3.73 120.40 118.73 1ocx s VAL 106 Ca 0.00 1.23 -0.00 0.00 0.00 0.00 0.00 61.98 63.21 1ocx s VAL 106 Cb 0.00 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 1ocx s VAL 106 CO 0.00 0.20 -0.14 -1.00 0.00 0.00 0.00 175.10 174.16 1ocx s HIS 107 N -0.03 2.81 -0.18 5.22 3.76 -0.45 -1.00 115.29 125.41 1ocx s HIS 107 Ca 0.54 -0.94 -0.01 0.00 -0.15 0.00 0.00 55.06 54.50 1ocx s HIS 107 Cb -0.34 -1.90 0.00 0.00 1.11 0.00 0.00 32.58 31.45 1ocx s HIS 107 CO 0.37 -0.42 -0.12 0.42 -0.85 0.00 0.00 174.74 174.14 1ocx s ILE 108 N 0.78 2.83 0.15 0.60 1.01 0.31 -0.24 121.20 126.63 1ocx s ILE 108 Ca -0.05 -0.69 0.08 0.00 0.00 0.00 0.00 60.65 59.98 1ocx s ILE 108 Cb -0.15 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 1ocx s ILE 108 CO 0.01 0.49 -0.07 -0.31 0.00 0.00 0.00 174.94 175.05 1ocx s TYR 109 N 1.16 2.73 0.00 3.97 2.02 -0.32 -1.34 117.35 125.57 1ocx s TYR 109 Ca 0.01 -0.18 0.00 0.00 -0.37 0.00 0.00 57.07 56.54 1ocx s TYR 109 Cb -0.14 -1.36 0.00 0.00 -0.40 0.00 0.00 41.96 40.06 1ocx s TYR 109 CO -0.04 0.49 0.00 0.25 -1.57 0.00 0.00 175.55 174.67 1ocx n THR 110 N 0.21 0.00 -2.40 -0.71 -2.24 -1.07 -2.45 114.28 105.62 1ocx n THR 110 Ca -0.11 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.30 1ocx n THR 110 Cb 0.54 0.14 -0.03 0.00 -2.10 0.00 0.00 70.33 68.89 1ocx n THR 110 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ocx s ALA 111 N -0.96 3.04 0.32 6.98 0.00 -1.26 0.09 121.76 129.97 1ocx s ALA 111 Ca 0.00 0.82 -0.01 0.00 0.00 0.00 0.00 51.96 52.77 1ocx s ALA 111 Cb 0.00 -3.33 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 1ocx s ALA 111 CO 0.00 -0.43 0.40 -0.08 0.00 0.00 0.00 175.76 175.65 1ocx s THR 112 N -1.60 0.00 0.05 0.00 -1.32 0.33 -4.85 115.64 108.26 1ocx s THR 112 Ca 0.60 -1.71 0.01 0.00 -1.21 0.00 0.00 61.69 59.38 1ocx s THR 112 Cb -0.25 -2.56 -0.03 0.00 -1.51 0.00 0.00 72.50 68.14 1ocx s THR 112 CO 0.31 0.00 -0.06 -1.00 -2.21 0.00 0.00 174.62 171.67 1ocx s HIS 113 N -3.31 0.61 0.59 9.09 3.76 -1.26 -3.95 115.29 120.82 1ocx s HIS 113 Ca 0.33 -0.71 -0.20 0.00 -0.15 0.00 0.00 55.06 54.33 1ocx s HIS 113 Cb 0.01 -0.38 -0.03 0.00 1.11 0.00 0.00 32.58 33.28 1ocx s HIS 113 CO 0.20 -0.17 1.30 -2.14 -0.85 0.00 0.00 174.74 173.08 1ocx s PRO 114 N -2.52 2.93 0.33 8.40 0.02 -1.26 -4.92 135.00 137.97 1ocx s PRO 114 Ca -0.03 2.07 0.18 0.00 0.02 0.00 0.00 61.00 63.24 1ocx s PRO 114 Cb -0.03 -2.05 0.15 0.00 0.02 0.00 0.00 34.50 32.59 1ocx s PRO 114 CO -0.03 -1.31 1.48 0.82 -0.33 0.00 0.00 177.00 177.64 1ocx h ILE 115 N 1.04 0.55 -3.12 2.83 2.04 -2.00 -3.40 117.51 115.45 1ocx h ILE 115 Ca -0.51 -1.79 -0.53 0.00 1.00 0.00 0.00 64.86 63.04 1ocx h ILE 115 Cb 1.31 2.26 0.02 0.00 -0.74 0.00 0.00 36.82 39.67 1ocx h ILE 115 CO 0.55 0.32 0.66 -0.62 0.00 0.00 0.00 178.15 179.06 1ocx s ASP 116 N -6.35 6.92 0.19 1.72 -1.08 -1.26 -4.93 116.67 111.89 1ocx s ASP 116 Ca 0.05 2.23 -0.07 0.00 -0.52 0.00 0.00 52.55 54.23 1ocx s ASP 116 Cb 0.07 -2.59 0.11 0.00 -1.46 0.00 0.00 42.92 39.05 1ocx s ASP 116 CO 0.72 -0.57 1.62 1.55 0.52 0.00 0.00 175.17 179.02 1ocx h PRO 117 N 6.59 0.95 0.07 4.34 0.13 -1.98 0.50 132.00 142.60 1ocx h PRO 117 Ca -0.42 -0.35 -0.00 0.00 -0.87 0.00 0.00 66.00 64.36 1ocx h PRO 117 Cb 1.21 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 1ocx h PRO 117 CO 0.83 1.01 -0.04 0.28 -0.23 0.00 0.00 178.00 179.86 1ocx h VAL 118 N 0.85 0.91 -0.83 1.56 2.07 -1.97 0.19 116.25 119.03 1ocx h VAL 118 Ca 0.13 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.66 1ocx h VAL 118 Cb 0.67 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 1ocx h VAL 118 CO 0.05 0.00 0.55 0.00 0.02 0.00 0.00 177.57 178.18 1ocx h ALA 119 N 0.83 1.05 -0.31 1.67 0.00 -1.91 -2.29 119.26 118.29 1ocx h ALA 119 Ca -0.01 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1ocx h ALA 119 Cb 0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1ocx h ALA 119 CO 0.01 0.46 -0.02 -0.09 0.00 0.00 0.00 179.25 179.61 1ocx h ARG 120 N 1.12 0.56 0.00 0.00 2.43 -0.41 -2.41 114.38 115.68 1ocx h ARG 120 Ca 0.30 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1ocx h ARG 120 Cb -0.13 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.37 1ocx h ARG 120 CO -0.07 0.71 0.00 0.09 -1.51 0.00 0.00 179.97 179.20 1ocx n ASN 121 N -4.53 0.00 -0.05 -3.80 3.02 0.61 -3.33 115.26 107.18 1ocx n ASN 121 Ca -0.02 -0.86 0.14 0.00 -0.03 0.00 0.00 54.58 53.81 1ocx n ASN 121 Cb 0.28 0.00 0.63 0.00 -0.61 0.00 0.00 39.78 40.07 1ocx n ASN 121 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1ocx n SER 122 N -0.94 0.26 0.00 6.41 3.41 -0.88 -4.90 113.62 116.98 1ocx n SER 122 Ca 0.16 -0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1ocx n SER 122 Cb 0.08 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 1ocx n SER 122 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ocx n GLY 123 N 1.33 0.71 3.67 5.00 0.00 -1.21 -5.03 105.19 109.66 1ocx n GLY 123 Ca 0.13 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 1ocx n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ocx s ALA 124 N -2.00 3.62 -0.11 4.61 0.00 -1.26 -4.96 121.76 121.65 1ocx s ALA 124 Ca 0.00 0.74 0.02 0.00 0.00 0.00 0.00 51.96 52.72 1ocx s ALA 124 Cb 0.00 -3.65 -0.01 0.00 0.00 0.00 0.00 23.12 19.47 1ocx s ALA 124 CO 0.00 -1.14 -0.19 -1.21 0.00 0.00 0.00 175.76 173.22 1ocx s GLU 125 N 3.27 3.20 0.00 0.00 2.02 -1.23 -4.86 118.70 121.10 1ocx s GLU 125 Ca 0.63 -0.78 -0.24 0.00 0.02 0.00 0.00 54.97 54.60 1ocx s GLU 125 Cb -0.28 -2.46 0.05 0.00 0.10 0.00 0.00 34.13 31.54 1ocx s GLU 125 CO 0.23 0.20 0.54 -1.17 0.02 0.00 0.00 175.26 175.08 1ocx s LEU 126 N 0.33 -0.11 0.22 1.80 2.96 -1.25 -0.44 118.68 122.19 1ocx s LEU 126 Ca -0.15 0.34 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 1ocx s LEU 126 Cb -0.17 2.11 -0.04 0.00 0.50 0.00 0.00 46.19 48.59 1ocx s LEU 126 CO 0.07 -0.64 0.13 -0.83 -1.32 0.00 0.00 176.35 173.77 1ocx s GLY 127 N -1.60 1.58 -0.01 7.98 0.00 -1.26 -0.51 107.32 113.50 1ocx s GLY 127 Ca -0.09 -1.76 0.02 0.00 0.00 0.00 0.00 44.72 42.89 1ocx s GLY 127 CO 0.03 -1.45 -0.05 0.54 0.00 0.00 0.00 173.10 172.17 1ocx s LYS 128 N -4.08 0.47 0.71 2.90 1.02 0.11 -4.45 119.74 116.41 1ocx s LYS 128 Ca 0.39 -0.18 -0.14 0.00 0.02 0.00 0.00 55.97 56.06 1ocx s LYS 128 Cb 0.07 -0.46 0.03 0.00 -0.52 0.00 0.00 37.83 36.94 1ocx s LYS 128 CO 0.13 0.10 1.13 -1.25 -0.92 0.00 0.00 175.35 174.54 1ocx s PRO 129 N -0.01 2.47 -0.07 -1.68 0.04 -1.26 -3.33 135.00 131.16 1ocx s PRO 129 Ca 0.01 1.43 0.04 0.00 0.04 0.00 0.00 61.00 62.52 1ocx s PRO 129 Cb -0.03 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1ocx s PRO 129 CO -0.00 -1.51 -0.19 0.08 0.04 0.00 0.00 177.00 175.41 1ocx s VAL 130 N -2.39 1.65 -0.07 -0.36 1.01 -0.26 -1.18 120.40 118.81 1ocx s VAL 130 Ca 0.67 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.88 1ocx s VAL 130 Cb -0.22 -1.43 0.00 0.00 0.00 0.00 0.00 36.38 34.73 1ocx s VAL 130 CO 0.46 0.47 -0.18 -0.89 0.00 0.00 0.00 175.10 174.96 1ocx s THR 131 N 0.24 1.57 -0.03 3.92 2.01 -0.87 -1.05 115.64 121.42 1ocx s THR 131 Ca -0.11 -0.75 0.04 0.00 0.31 0.00 0.00 61.69 61.18 1ocx s THR 131 Cb -0.15 -1.37 -0.00 0.00 0.01 0.00 0.00 72.50 70.99 1ocx s THR 131 CO 0.05 0.45 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.66 1ocx s ILE 132 N 0.36 1.13 0.00 1.82 1.01 0.15 -0.74 121.20 124.93 1ocx s ILE 132 Ca -0.13 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 59.96 1ocx s ILE 132 Cb -0.15 -0.97 0.00 0.00 0.01 0.00 0.00 42.46 41.34 1ocx s ILE 132 CO 0.05 0.33 0.00 0.61 0.00 0.00 0.00 174.94 175.93 1ocx n GLY 133 N 3.13 -1.16 3.86 6.18 0.00 0.07 -0.94 105.19 116.33 1ocx n GLY 133 Ca -0.17 -1.60 -0.32 0.00 0.00 0.00 0.00 46.02 43.93 1ocx n GLY 133 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ocx s ASN 134 N -1.10 6.68 -1.44 1.61 0.01 -1.26 -2.69 114.94 116.74 1ocx s ASN 134 Ca 0.00 1.22 -0.11 0.00 -0.71 0.00 0.00 52.86 53.26 1ocx s ASN 134 Cb 0.00 -2.35 0.05 0.00 0.41 0.00 0.00 41.25 39.36 1ocx s ASN 134 CO 0.00 -0.28 1.06 0.59 -1.51 0.00 0.00 177.10 176.96 1ocx n ASN 135 N -0.71 -5.23 -4.75 -1.22 3.02 0.64 -0.47 115.26 106.55 1ocx n ASN 135 Ca 0.03 -0.68 -0.35 0.00 -0.03 0.00 0.00 54.58 53.55 1ocx n ASN 135 Cb 0.53 -4.42 -0.08 0.00 -0.61 0.00 0.00 39.78 35.21 1ocx n ASN 135 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ocx s VAL 136 N -3.33 5.42 -0.19 2.41 1.01 -1.26 -3.57 120.40 120.89 1ocx s VAL 136 Ca 0.58 0.22 -0.02 0.00 0.00 0.00 0.00 61.98 62.76 1ocx s VAL 136 Cb -0.28 -3.47 -0.00 0.00 0.00 0.00 0.00 36.38 32.63 1ocx s VAL 136 CO 0.78 0.46 -0.11 0.86 0.00 0.00 0.00 175.10 177.10 1ocx s TRP 137 N 0.17 2.87 -0.21 5.22 -0.00 -0.10 -1.48 118.94 125.42 1ocx s TRP 137 Ca 0.09 -1.12 -0.02 0.00 -0.00 0.00 0.00 56.10 55.05 1ocx s TRP 137 Cb -0.11 -2.00 0.00 0.00 -0.00 0.00 0.00 33.47 31.36 1ocx s TRP 137 CO -0.01 -0.58 -0.09 0.42 -0.00 0.00 0.00 176.95 176.70 1ocx s ILE 138 N 1.23 2.98 0.92 5.86 1.01 -0.01 -0.28 121.20 132.91 1ocx s ILE 138 Ca 0.03 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 59.89 1ocx s ILE 138 Cb -0.14 -2.35 0.14 0.00 0.01 0.00 0.00 42.46 40.12 1ocx s ILE 138 CO -0.05 0.43 1.10 -0.83 0.00 0.00 0.00 174.94 175.59 1ocx s GLY 139 N 1.41 1.59 0.10 6.18 0.00 0.21 -0.95 107.32 115.87 1ocx s GLY 139 Ca 0.05 -0.28 -0.34 0.00 0.00 0.00 0.00 44.72 44.15 1ocx s GLY 139 CO -0.06 0.26 1.60 0.61 0.00 0.00 0.00 173.10 175.51 1ocx n GLY 140 N -1.48 1.09 2.40 0.20 0.00 -1.26 -2.63 105.19 103.51 1ocx n GLY 140 Ca 0.06 0.70 -0.13 0.00 0.00 0.00 0.00 46.02 46.65 1ocx n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ocx n ARG 141 N 3.84 -0.96 -1.40 1.61 1.74 -0.19 -0.41 116.66 120.88 1ocx n ARG 141 Ca 0.18 0.96 -0.31 0.00 -0.77 0.00 0.00 57.85 57.91 1ocx n ARG 141 Cb 0.27 -5.04 0.07 0.00 -1.02 0.00 0.00 32.46 26.75 1ocx n ARG 141 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ocx s ALA 142 N -2.47 2.41 -0.11 7.54 0.00 -1.08 -4.11 121.76 123.94 1ocx s ALA 142 Ca 0.00 0.23 0.02 0.00 0.00 0.00 0.00 51.96 52.21 1ocx s ALA 142 Cb 0.00 -3.25 0.02 0.00 0.00 0.00 0.00 23.12 19.89 1ocx s ALA 142 CO 0.00 -1.55 -0.14 0.08 0.00 0.00 0.00 175.76 174.14 1ocx s VAL 143 N -2.90 1.44 -0.26 0.00 1.01 -0.07 -1.35 120.40 118.27 1ocx s VAL 143 Ca 0.61 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 61.92 1ocx s VAL 143 Cb -0.16 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 1ocx s VAL 143 CO 0.54 0.43 0.05 -0.63 0.00 0.00 0.00 175.10 175.49 1ocx s ILE 144 N 1.04 3.95 0.62 2.22 -1.09 0.66 -0.58 121.20 128.03 1ocx s ILE 144 Ca -0.06 -0.46 -0.06 0.00 -2.23 0.00 0.00 60.65 57.84 1ocx s ILE 144 Cb -0.15 -2.92 0.02 0.00 -1.58 0.00 0.00 42.46 37.83 1ocx s ILE 144 CO -0.02 0.25 0.93 0.20 -1.23 0.00 0.00 174.94 175.07 1ocx s ASN 145 N 1.54 5.40 0.44 3.58 0.01 -0.77 -1.17 114.94 123.96 1ocx s ASN 145 Ca 0.05 0.66 -0.26 0.00 -0.71 0.00 0.00 52.86 52.60 1ocx s ASN 145 Cb -0.16 -1.56 -0.09 0.00 0.41 0.00 0.00 41.25 39.85 1ocx s ASN 145 CO 0.02 -1.20 1.45 -2.84 -1.51 0.00 0.00 177.10 173.01 1ocx s PRO 146 N -5.07 3.74 0.00 -0.60 0.02 -1.03 -3.11 135.00 128.96 1ocx s PRO 146 Ca 0.56 2.47 0.00 0.00 0.02 0.00 0.00 61.00 64.05 1ocx s PRO 146 Cb -0.11 -2.71 0.00 0.00 0.02 0.00 0.00 34.50 31.71 1ocx s PRO 146 CO 0.45 -0.79 0.00 0.41 -0.33 0.00 0.00 177.00 176.74 1ocx n GLY 147 N 0.55 0.95 3.81 0.52 0.00 -0.33 -4.95 105.19 105.74 1ocx n GLY 147 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1ocx n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ocx s VAL 148 N -3.32 4.54 -0.14 1.61 1.01 -1.18 -4.89 120.40 118.04 1ocx s VAL 148 Ca 0.00 1.34 0.03 0.00 0.00 0.00 0.00 61.98 63.35 1ocx s VAL 148 Cb 0.00 -3.90 0.01 0.00 0.00 0.00 0.00 36.38 32.49 1ocx s VAL 148 CO 0.00 0.26 -0.22 -0.89 0.00 0.00 0.00 175.10 174.25 1ocx s THR 149 N -1.46 2.02 -0.16 3.92 2.01 -1.26 -2.06 115.64 118.65 1ocx s THR 149 Ca 0.42 -0.96 -0.04 0.00 0.31 0.00 0.00 61.69 61.42 1ocx s THR 149 Cb -0.18 -1.78 -0.03 0.00 0.01 0.00 0.00 72.50 70.52 1ocx s THR 149 CO 0.22 0.54 -0.03 -0.63 -0.69 0.00 0.00 174.62 174.03 1ocx s ILE 150 N 0.81 3.97 0.00 1.82 1.01 0.08 -1.38 121.20 127.52 1ocx s ILE 150 Ca -0.07 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.25 1ocx s ILE 150 Cb -0.16 -2.75 0.00 0.00 0.01 0.00 0.00 42.46 39.57 1ocx s ILE 150 CO -0.02 0.49 0.00 0.61 0.00 0.00 0.00 174.94 176.03 1ocx n GLY 151 N 3.53 -1.45 3.82 6.18 0.00 0.12 -0.75 105.19 116.64 1ocx n GLY 151 Ca -0.17 -1.61 -0.33 0.00 0.00 0.00 0.00 46.02 43.91 1ocx n GLY 151 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ocx s ASP 152 N -1.13 6.73 -1.33 1.61 1.01 -1.26 -3.73 116.67 118.58 1ocx s ASP 152 Ca 0.00 1.70 -0.06 0.00 0.71 0.00 0.00 52.55 54.90 1ocx s ASP 152 Cb 0.00 -2.53 0.01 0.00 1.01 0.00 0.00 42.92 41.40 1ocx s ASP 152 CO 0.00 -0.51 0.73 0.59 0.21 0.00 0.00 175.17 176.20 1ocx n ASN 153 N -0.98 -5.76 -4.87 0.27 3.02 0.38 -1.34 115.26 105.99 1ocx n ASN 153 Ca 0.07 -0.34 -0.37 0.00 -0.03 0.00 0.00 54.58 53.92 1ocx n ASN 153 Cb 0.54 -4.52 -0.06 0.00 -0.61 0.00 0.00 39.78 35.13 1ocx n ASN 153 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ocx s VAL 154 N -3.18 5.44 -0.19 2.41 1.01 -1.23 -3.78 120.40 120.87 1ocx s VAL 154 Ca 0.36 0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.48 1ocx s VAL 154 Cb -0.16 -3.37 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 1ocx s VAL 154 CO 0.45 0.61 -0.05 -0.69 0.00 0.00 0.00 175.10 175.42 1ocx s VAL 155 N -1.04 3.51 -0.30 2.92 1.01 -0.75 -0.92 120.40 124.84 1ocx s VAL 155 Ca 0.15 -0.46 -0.07 0.00 0.00 0.00 0.00 61.98 61.60 1ocx s VAL 155 Cb -0.12 -2.57 0.01 0.00 0.00 0.00 0.00 36.38 33.70 1ocx s VAL 155 CO 0.05 0.45 0.09 -0.69 0.00 0.00 0.00 175.10 175.00 1ocx s VAL 156 N 1.04 4.09 0.67 2.92 1.01 0.62 -0.58 120.40 130.17 1ocx s VAL 156 Ca 0.01 -0.64 -0.17 0.00 0.00 0.00 0.00 61.98 61.18 1ocx s VAL 156 Cb -0.15 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 33.14 1ocx s VAL 156 CO 0.00 0.08 1.22 0.00 0.00 0.00 0.00 175.10 176.40 1ocx s ALA 157 N 1.52 2.30 0.30 5.51 0.00 0.41 0.63 121.76 132.44 1ocx s ALA 157 Ca 0.03 0.96 -0.28 0.00 0.00 0.00 0.00 51.96 52.66 1ocx s ALA 157 Cb -0.17 -3.47 -0.13 0.00 0.00 0.00 0.00 23.12 19.34 1ocx s ALA 157 CO 0.03 -1.60 1.12 -1.13 0.00 0.00 0.00 175.76 174.18 1ocx n SER 158 N -2.25 1.83 0.00 0.00 3.41 -1.26 -1.35 113.62 114.00 1ocx n SER 158 Ca 0.14 1.19 0.00 0.00 -0.26 0.00 0.00 58.87 59.94 1ocx n SER 158 Cb 0.50 -1.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.09 1ocx n SER 158 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ocx n GLY 159 N 1.10 0.45 3.77 5.00 0.00 0.45 -4.81 105.19 111.14 1ocx n GLY 159 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 1ocx n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ocx s ALA 160 N -2.22 2.95 -0.30 4.61 0.00 -0.46 -4.74 121.76 121.60 1ocx s ALA 160 Ca 0.00 1.01 0.01 0.00 0.00 0.00 0.00 51.96 52.98 1ocx s ALA 160 Cb 0.00 -3.42 0.07 0.00 0.00 0.00 0.00 23.12 19.77 1ocx s ALA 160 CO 0.00 -0.78 -0.02 0.08 0.00 0.00 0.00 175.76 175.04 1ocx s VAL 161 N -1.50 2.51 -0.36 0.00 1.01 -0.65 -0.89 120.40 120.51 1ocx s VAL 161 Ca 0.65 -1.74 -0.18 0.00 0.00 0.00 0.00 61.98 60.70 1ocx s VAL 161 Cb -0.31 -2.56 -0.00 0.00 0.00 0.00 0.00 36.38 33.51 1ocx s VAL 161 CO 0.37 -0.22 0.53 -0.69 0.00 0.00 0.00 175.10 175.09 1ocx s VAL 162 N 1.11 5.00 -0.54 2.92 1.01 0.25 -1.62 120.40 128.52 1ocx s VAL 162 Ca -0.03 0.33 0.10 0.00 0.00 0.00 0.00 61.98 62.39 1ocx s VAL 162 Cb -0.20 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.11 1ocx s VAL 162 CO -0.04 -0.25 0.45 0.35 0.00 0.00 0.00 175.10 175.61 1ocx n THR 163 N 5.46 0.00 -4.23 3.92 -2.24 -1.26 -1.84 114.28 114.08 1ocx n THR 163 Ca -0.04 -0.29 -0.13 0.00 -2.27 0.00 0.00 64.05 61.31 1ocx n THR 163 Cb 0.49 1.02 -0.10 0.00 -2.10 0.00 0.00 70.33 69.64 1ocx n THR 163 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ocx s LYS 164 N -1.82 1.24 0.62 -0.78 1.02 -1.26 -4.89 119.74 113.87 1ocx s LYS 164 Ca 0.05 -1.65 -0.19 0.00 0.02 0.00 0.00 55.97 54.19 1ocx s LYS 164 Cb 0.07 0.08 -0.02 0.00 -0.52 0.00 0.00 37.83 37.44 1ocx s LYS 164 CO 0.37 -0.34 1.32 -0.51 -0.92 0.00 0.00 175.35 175.27 1ocx s ASP 165 N -3.20 4.79 -0.14 2.83 1.01 -1.26 -4.68 116.67 116.01 1ocx s ASP 165 Ca 0.37 2.68 0.02 0.00 0.71 0.00 0.00 52.55 56.33 1ocx s ASP 165 Cb 0.07 -2.63 0.01 0.00 1.01 0.00 0.00 42.92 41.38 1ocx s ASP 165 CO 0.11 -1.89 -0.20 -0.69 0.21 0.00 0.00 175.17 172.71 1ocx s VAL 166 N -1.36 2.21 0.97 -1.27 1.01 -0.48 -4.97 120.40 116.52 1ocx s VAL 166 Ca 0.79 -0.93 -0.15 0.00 0.00 0.00 0.00 61.98 61.69 1ocx s VAL 166 Cb -0.39 -1.89 0.18 0.00 0.00 0.00 0.00 36.38 34.28 1ocx s VAL 166 CO 0.43 0.54 1.22 -2.16 0.00 0.00 0.00 175.10 175.12 1ocx s PRO 167 N 0.78 0.63 0.68 2.72 0.04 -1.26 -0.71 135.00 137.89 1ocx s PRO 167 Ca -0.07 -0.09 -0.17 0.00 0.04 0.00 0.00 61.00 60.71 1ocx s PRO 167 Cb -0.16 -1.81 0.01 0.00 0.04 0.00 0.00 34.50 32.58 1ocx s PRO 167 CO -0.01 -2.47 1.26 -0.51 0.04 0.00 0.00 177.00 175.31 1ocx s ASP 168 N -4.45 4.43 -1.17 6.66 1.01 -1.26 -4.22 116.67 117.66 1ocx s ASP 168 Ca 0.69 2.53 -0.05 0.00 0.71 0.00 0.00 52.55 56.43 1ocx s ASP 168 Cb -0.09 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.24 1ocx s ASP 168 CO 0.53 -2.12 1.01 0.59 0.21 0.00 0.00 175.17 175.39 1ocx n ASN 169 N -2.21 -4.68 -4.18 0.27 3.02 -0.45 -4.91 115.26 102.12 1ocx n ASN 169 Ca 0.15 -0.51 -0.11 0.00 -0.03 0.00 0.00 54.58 54.09 1ocx n ASN 169 Cb 0.49 -4.59 -0.10 0.00 -0.61 0.00 0.00 39.78 34.97 1ocx n ASN 169 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1ocx s VAL 170 N -3.30 0.65 -0.20 2.41 -7.23 -1.25 0.91 120.40 112.39 1ocx s VAL 170 Ca 0.36 -1.94 -0.08 0.00 -1.81 0.00 0.00 61.98 58.51 1ocx s VAL 170 Cb -0.16 -1.75 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 1ocx s VAL 170 CO 0.65 -0.81 0.08 -0.69 -0.31 0.00 0.00 175.10 174.03 1ocx s VAL 171 N -3.66 4.84 0.19 1.32 1.01 -0.12 -1.81 120.40 122.18 1ocx s VAL 171 Ca 0.14 -0.01 0.10 0.00 0.00 0.00 0.00 61.98 62.21 1ocx s VAL 171 Cb 0.06 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 1ocx s VAL 171 CO -0.04 0.42 -0.17 0.68 0.00 0.00 0.00 175.10 175.99 1ocx s VAL 172 N 0.69 2.72 0.01 2.92 -7.23 0.26 -0.25 120.40 119.52 1ocx s VAL 172 Ca 0.04 -1.89 -0.28 0.00 -1.81 0.00 0.00 61.98 58.04 1ocx s VAL 172 Cb -0.13 -2.33 0.10 0.00 0.56 0.00 0.00 36.38 34.57 1ocx s VAL 172 CO 0.02 -0.13 0.91 -0.83 -0.31 0.00 0.00 175.10 174.76 1ocx s GLY 173 N -2.79 -0.42 0.00 2.32 0.00 -0.55 -0.44 107.32 105.44 1ocx s GLY 173 Ca 0.23 0.89 0.00 0.00 0.00 0.00 0.00 44.72 45.84 1ocx s GLY 173 CO 0.12 0.29 0.00 0.61 0.00 0.00 0.00 173.10 174.12 1ocx n GLY 174 N -0.28 1.39 2.65 0.20 0.00 -1.26 -0.65 105.19 107.24 1ocx n GLY 174 Ca -0.08 -2.03 -0.28 0.00 0.00 0.00 0.00 46.02 43.62 1ocx n GLY 174 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ocx s ASN 175 N 0.00 3.27 0.63 1.61 3.04 -1.26 -1.64 114.94 120.59 1ocx s ASN 175 Ca 0.00 -1.13 -0.16 0.00 0.04 0.00 0.00 52.86 51.61 1ocx s ASN 175 Cb 0.00 -0.51 -0.02 0.00 -1.54 0.00 0.00 41.25 39.19 1ocx s ASN 175 CO 0.00 -0.38 1.11 -2.84 -3.04 0.00 0.00 177.10 171.94 1ocx s PRO 176 N 1.94 2.96 0.15 0.43 0.02 -1.26 -5.01 135.00 134.23 1ocx s PRO 176 Ca 0.05 1.42 -0.30 0.00 0.02 0.00 0.00 61.00 62.19 1ocx s PRO 176 Cb -0.17 -1.97 -0.08 0.00 0.02 0.00 0.00 34.50 32.31 1ocx s PRO 176 CO -0.22 -1.13 1.29 0.00 -0.33 0.00 0.00 177.00 176.61 1ocx s ALA 177 N -2.24 3.50 0.18 -1.55 0.00 -0.64 -4.90 121.76 116.12 1ocx s ALA 177 Ca 0.68 1.04 0.06 0.00 0.00 0.00 0.00 51.96 53.73 1ocx s ALA 177 Cb -0.21 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.39 1ocx s ALA 177 CO 0.38 -0.51 -0.11 1.03 0.00 0.00 0.00 175.76 176.56 1ocx s ARG 178 N 0.34 1.21 -0.02 0.00 0.52 0.18 -4.84 118.95 116.34 1ocx s ARG 178 Ca 0.58 -1.54 -0.30 0.00 -0.52 0.00 0.00 55.73 53.95 1ocx s ARG 178 Cb -0.35 -0.85 -0.06 0.00 0.52 0.00 0.00 34.95 34.22 1ocx s ARG 178 CO 0.35 0.10 1.56 0.42 0.02 0.00 0.00 175.30 177.75 1ocx s ILE 179 N -3.18 3.54 -0.21 1.52 1.01 -1.26 -1.48 121.20 121.14 1ocx s ILE 179 Ca 0.20 0.82 -0.04 0.00 0.00 0.00 0.00 60.65 61.64 1ocx s ILE 179 Cb 0.02 -3.53 -0.20 0.00 0.01 0.00 0.00 42.46 38.76 1ocx s ILE 179 CO 0.04 -0.04 -0.03 -0.38 0.00 0.00 0.00 174.94 174.54 1ocx n ILE 180 N 5.07 1.59 -3.50 2.92 2.08 0.65 -4.95 119.36 123.22 1ocx n ILE 180 Ca 0.16 -0.55 -0.16 0.00 0.56 0.00 0.00 62.75 62.76 1ocx n ILE 180 Cb 0.43 -1.61 -0.05 0.00 -0.75 0.00 0.00 39.64 37.66 1ocx n ILE 180 CO 0.00 0.00 0.00 -1.59 0.56 0.00 0.00 176.55 175.52 1ocx s LYS 181 N -2.52 1.12 0.50 0.38 -2.85 -1.15 -5.00 119.74 110.21 1ocx s LYS 181 Ca -0.31 -0.02 -0.20 0.00 -1.00 0.00 0.00 55.97 54.43 1ocx s LYS 181 Cb 0.09 0.52 -0.08 0.00 -2.06 0.00 0.00 37.83 36.30 1ocx s LYS 181 CO 0.64 -0.40 1.08 0.15 0.10 0.00 0.00 175.35 176.92 1ocx s LYS 182 N -2.11 3.68 0.00 1.78 1.02 -1.26 -0.94 119.74 121.92 1ocx s LYS 182 Ca -0.07 1.48 0.30 0.00 0.02 0.00 0.00 55.97 57.70 1ocx s LYS 182 Cb -0.00 -2.12 1.77 0.00 -0.52 0.00 0.00 37.83 36.96 1ocx s LYS 182 CO 0.02 -0.55 2.10 1.28 -0.92 0.00 0.00 175.35 177.28