#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j8y h LEU 4 N 0.00 0.58 -1.03 -1.96 3.38 -1.99 0.17 115.31 114.46 1j8y h LEU 4 Ca 0.00 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 1j8y h LEU 4 Cb 0.00 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1j8y h LEU 4 CO 0.00 0.74 -0.28 0.44 0.09 0.00 0.00 178.44 179.42 1j8y h ASP 5 N 0.55 0.35 0.13 -0.43 3.32 -2.00 -1.24 116.42 117.10 1j8y h ASP 5 Ca 0.10 -0.12 -0.21 0.00 0.02 0.00 0.00 57.03 56.82 1j8y h ASP 5 Cb 0.53 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1j8y h ASP 5 CO 0.03 0.63 -0.80 0.78 -1.72 0.00 0.00 179.24 178.16 1j8y h ASN 6 N 0.31 0.66 0.05 6.45 2.35 -1.90 -2.97 115.58 120.53 1j8y h ASN 6 Ca 0.04 -0.46 -0.04 0.00 -0.55 0.00 0.00 56.30 55.30 1j8y h ASN 6 Cb 0.66 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1j8y h ASN 6 CO 0.05 1.23 -0.11 -0.07 -1.65 0.00 0.00 177.43 176.87 1j8y h LEU 7 N 0.36 0.14 -0.82 1.61 3.38 -0.61 -2.56 115.31 116.80 1j8y h LEU 7 Ca -0.05 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.93 1j8y h LEU 7 Cb 1.41 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 42.07 1j8y h LEU 7 CO 0.15 0.27 0.52 -0.09 0.09 0.00 0.00 178.44 179.38 1j8y h ARG 8 N 0.15 0.97 -0.05 1.13 2.43 -1.07 0.33 114.38 118.28 1j8y h ARG 8 Ca 0.03 -0.06 -0.18 0.00 -0.81 0.00 0.00 59.98 58.96 1j8y h ARG 8 Cb 0.30 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1j8y h ARG 8 CO 0.02 0.64 -0.74 -0.44 -1.51 0.00 0.00 179.97 177.94 1j8y h ASP 9 N 1.00 0.36 -0.44 -3.80 3.32 -1.51 -2.26 116.42 113.09 1j8y h ASP 9 Ca 0.34 -0.24 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 1j8y h ASP 9 Cb 0.04 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1j8y h ASP 9 CO -0.13 0.98 -0.07 0.74 -1.72 0.00 0.00 179.24 179.04 1j8y h THR 10 N 0.20 1.27 -0.23 0.35 2.02 -1.21 -1.68 112.91 113.63 1j8y h THR 10 Ca -0.03 -1.16 0.00 0.00 0.77 0.00 0.00 66.41 65.99 1j8y h THR 10 Cb 1.31 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.84 1j8y h THR 10 CO 0.12 0.39 0.15 0.58 0.37 0.00 0.00 175.52 177.13 1j8y h VAL 11 N 0.65 1.06 -0.25 3.16 2.07 -0.90 -1.55 116.25 120.49 1j8y h VAL 11 Ca 0.12 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.56 1j8y h VAL 11 Cb 0.59 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 31.06 1j8y h VAL 11 CO 0.04 0.06 -0.04 -0.09 0.02 0.00 0.00 177.57 177.55 1j8y h ARG 12 N 0.30 0.02 -0.74 1.57 2.43 -1.24 0.69 114.38 117.41 1j8y h ARG 12 Ca 0.08 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1j8y h ARG 12 Cb -0.03 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.48 1j8y h ARG 12 CO -0.02 0.02 0.46 0.87 -1.51 0.00 0.00 179.97 179.79 1j8y h LYS 13 N 0.02 0.99 -0.02 0.20 1.57 -1.10 -2.01 116.57 116.23 1j8y h LYS 13 Ca 0.12 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1j8y h LYS 13 Cb 0.18 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 1j8y h LYS 13 CO -0.24 0.68 -0.00 0.35 -0.57 0.00 0.00 179.45 179.67 1j8y h PHE 14 N 1.01 0.03 -0.64 -1.35 3.57 -0.42 -3.24 116.94 115.90 1j8y h PHE 14 Ca 0.27 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 1j8y h PHE 14 Cb -0.07 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.64 1j8y h PHE 14 CO 0.00 0.36 0.39 -0.07 -2.23 0.00 0.00 178.31 176.76 1j8y h LEU 15 N -0.30 0.75 -6.62 0.59 3.38 -0.60 -3.28 115.31 109.24 1j8y h LEU 15 Ca 0.00 -0.04 -0.66 0.00 0.09 0.00 0.00 57.88 57.28 1j8y h LEU 15 Cb 0.34 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1j8y h LEU 15 CO 0.00 0.58 2.57 0.35 0.09 0.00 0.00 178.44 182.03 1j8y n THR 16 N -4.41 2.96 -0.48 0.22 -2.24 -0.78 -4.85 114.28 104.70 1j8y n THR 16 Ca 0.06 -2.72 -0.04 0.00 -2.27 0.00 0.00 64.05 59.08 1j8y n THR 16 Cb 0.07 -2.45 -0.05 0.00 -2.10 0.00 0.00 70.33 65.80 1j8y n THR 16 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j8y n GLY 17 N 4.59 -0.10 0.00 3.38 0.00 -1.24 -4.79 105.19 107.03 1j8y n GLY 17 Ca 0.50 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.52 1j8y n GLY 17 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1j8y n SER 18 N 1.91 0.00 -0.93 1.61 2.88 -1.26 -5.03 113.62 112.80 1j8y n SER 18 Ca 0.13 0.24 0.00 0.00 -1.33 0.00 0.00 58.87 57.92 1j8y n SER 18 Cb 0.12 -0.29 0.00 0.00 -0.75 0.00 0.00 64.21 63.29 1j8y n SER 18 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1j8y n SER 19 N -1.49 0.00 -4.74 -3.46 3.41 -1.26 -5.07 113.62 101.01 1j8y n SER 19 Ca 0.00 -0.22 -0.35 0.00 -0.26 0.00 0.00 58.87 58.04 1j8y n SER 19 Cb 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.01 1j8y n SER 19 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1j8y s SER 20 N -1.00 4.76 0.13 4.04 1.04 -1.26 -4.79 113.70 116.61 1j8y s SER 20 Ca 0.00 2.31 -0.25 0.00 0.48 0.00 0.00 55.95 58.49 1j8y s SER 20 Cb 0.00 -2.59 -0.04 0.00 0.10 0.00 0.00 66.02 63.49 1j8y s SER 20 CO 0.00 -1.88 1.63 0.22 0.98 0.00 0.00 173.24 174.19 1j8y h TYR 21 N 0.25 -0.70 -0.48 5.02 3.20 -1.98 0.26 116.97 122.54 1j8y h TYR 21 Ca -0.49 0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.49 1j8y h TYR 21 Cb 1.29 0.32 -0.07 0.00 1.54 0.00 0.00 36.73 39.80 1j8y h TYR 21 CO 0.48 -0.35 0.05 -0.44 -1.64 0.00 0.00 178.16 176.26 1j8y h ASP 22 N -0.38 -0.10 -0.20 -2.11 5.19 -1.99 0.03 116.42 116.85 1j8y h ASP 22 Ca 0.07 0.10 -0.11 0.00 -0.62 0.00 0.00 57.03 56.47 1j8y h ASP 22 Cb 0.48 0.16 -0.01 0.00 0.18 0.00 0.00 39.33 40.14 1j8y h ASP 22 CO -0.25 -0.02 -0.26 0.50 -3.12 0.00 0.00 179.24 176.08 1j8y h LYS 23 N 0.17 0.68 -0.68 3.56 3.64 -1.88 -1.20 116.57 120.87 1j8y h LYS 23 Ca 0.24 -0.28 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1j8y h LYS 23 Cb 0.34 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 1j8y h LYS 23 CO -0.35 0.87 0.45 0.00 -2.27 0.00 0.00 179.45 178.15 1j8y h ALA 24 N 1.12 0.86 -0.28 5.00 0.00 0.04 0.12 119.26 126.12 1j8y h ALA 24 Ca 0.08 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1j8y h ALA 24 Cb 0.75 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1j8y h ALA 24 CO 0.06 0.29 0.09 0.28 0.00 0.00 0.00 179.25 179.96 1j8y h VAL 25 N 0.92 1.20 -0.04 0.00 2.07 -0.78 -0.72 116.25 118.90 1j8y h VAL 25 Ca 0.25 -0.64 0.02 0.00 0.82 0.00 0.00 66.70 67.14 1j8y h VAL 25 Cb -0.10 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1j8y h VAL 25 CO -0.05 0.21 -0.08 -0.33 0.02 0.00 0.00 177.57 177.34 1j8y h GLU 26 N 0.29 -0.11 -0.39 1.57 5.08 -0.69 0.88 114.58 121.21 1j8y h GLU 26 Ca 0.09 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.50 1j8y h GLU 26 Cb 0.25 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 1j8y h GLU 26 CO -0.00 -0.07 0.15 -0.44 -1.00 0.00 0.00 179.01 177.64 1j8y h ASP 27 N -0.12 0.18 -0.23 1.42 3.45 -0.71 -1.67 116.42 118.74 1j8y h ASP 27 Ca 0.04 0.04 0.01 0.00 0.43 0.00 0.00 57.03 57.55 1j8y h ASP 27 Cb 0.18 0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 38.95 1j8y h ASP 27 CO -0.11 0.14 0.14 0.15 -1.57 0.00 0.00 179.24 177.99 1j8y h PHE 28 N 0.32 0.26 -0.90 4.55 3.57 -0.59 -2.04 116.94 122.10 1j8y h PHE 28 Ca 0.18 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 1j8y h PHE 28 Cb 0.14 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 1j8y h PHE 28 CO -0.14 0.16 0.55 0.82 -2.23 0.00 0.00 178.31 177.47 1j8y h ILE 29 N 0.29 1.25 -0.64 1.41 1.08 -0.54 -0.35 117.51 120.00 1j8y h ILE 29 Ca 0.09 -0.52 -0.02 0.00 -0.39 0.00 0.00 64.86 64.01 1j8y h ILE 29 Cb -0.01 -0.03 -0.03 0.00 -3.07 0.00 0.00 36.82 33.68 1j8y h ILE 29 CO -0.03 0.25 0.30 0.11 -0.69 0.00 0.00 178.15 178.09 1j8y h LYS 30 N 1.24 0.92 -0.45 2.37 1.57 -1.05 0.48 116.57 121.65 1j8y h LYS 30 Ca 0.32 -0.14 -0.12 0.00 -1.87 0.00 0.00 60.65 58.85 1j8y h LYS 30 Cb -0.06 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.07 1j8y h LYS 30 CO -0.06 0.74 -0.19 0.93 -0.57 0.00 0.00 179.45 180.30 1j8y h GLU 31 N 0.88 0.88 -0.04 3.15 4.39 -0.93 -0.68 114.58 122.24 1j8y h GLU 31 Ca 0.22 -0.35 -0.00 0.00 0.34 0.00 0.00 59.36 59.57 1j8y h GLU 31 Cb 0.12 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1j8y h GLU 31 CO -0.03 1.00 0.03 1.25 -1.16 0.00 0.00 179.01 180.10 1j8y h LEU 32 N 0.77 0.05 -0.39 1.33 5.85 -0.70 0.55 115.31 122.78 1j8y h LEU 32 Ca 0.11 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.81 1j8y h LEU 32 Cb 0.73 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 1j8y h LEU 32 CO 0.06 0.10 0.17 1.56 -0.34 0.00 0.00 178.44 179.99 1j8y h GLN 33 N 0.00 0.35 -0.61 1.25 4.20 -0.75 -0.01 115.11 119.54 1j8y h GLN 33 Ca 0.02 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1j8y h GLN 33 Cb 0.06 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 1j8y h GLN 33 CO -0.00 0.23 0.31 0.87 -0.67 0.00 0.00 178.83 179.57 1j8y h LYS 34 N 0.36 0.87 -0.63 1.46 1.57 -0.88 -0.47 116.57 118.85 1j8y h LYS 34 Ca 0.17 -0.12 -0.08 0.00 -1.87 0.00 0.00 60.65 58.76 1j8y h LYS 34 Cb 0.11 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1j8y h LYS 34 CO -0.14 0.68 0.08 0.77 -0.57 0.00 0.00 179.45 180.27 1j8y h SER 35 N 0.84 1.02 -0.45 0.86 0.02 -0.48 -0.51 113.55 114.84 1j8y h SER 35 Ca 0.21 -0.27 -0.07 0.00 -0.84 0.00 0.00 61.79 60.82 1j8y h SER 35 Cb 0.08 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 1j8y h SER 35 CO -0.03 1.04 0.00 -0.07 -1.14 0.00 0.00 176.83 176.63 1j8y h LEU 36 N 0.97 0.78 -0.40 5.07 3.38 -0.82 -0.72 115.31 123.56 1j8y h LEU 36 Ca 0.19 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1j8y h LEU 36 Cb 0.46 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1j8y h LEU 36 CO 0.02 0.90 0.27 0.40 0.09 0.00 0.00 178.44 180.11 1j8y h ILE 37 N 0.65 1.10 0.00 1.22 2.04 -0.86 -0.87 117.51 120.78 1j8y h ILE 37 Ca 0.13 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 1j8y h ILE 37 Cb 0.49 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1j8y h ILE 37 CO 0.02 0.10 -0.05 0.28 0.00 0.00 0.00 178.15 178.50 1j8y h SER 38 N 0.55 0.00 -0.11 1.72 0.02 -0.85 -0.79 113.55 114.09 1j8y h SER 38 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1j8y h SER 38 Cb -0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.48 1j8y h SER 38 CO -0.03 0.05 0.00 0.00 -1.14 0.00 0.00 176.83 175.71 1j8y n ALA 39 N -2.41 2.52 -2.19 3.77 0.00 -0.30 -4.74 120.51 117.17 1j8y n ALA 39 Ca -0.03 -0.29 -0.13 0.00 0.00 0.00 0.00 53.44 53.00 1j8y n ALA 39 Cb 0.14 -1.10 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 1j8y n ALA 39 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1j8y n ASP 40 N -0.17 -4.04 -4.73 0.00 2.03 -0.30 -0.78 116.55 108.56 1j8y n ASP 40 Ca 0.10 0.01 -0.41 0.00 0.52 0.00 0.00 54.79 55.01 1j8y n ASP 40 Cb 0.16 -3.21 -0.04 0.00 -0.72 0.00 0.00 41.12 37.31 1j8y n ASP 40 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1j8y s VAL 41 N -2.63 4.52 0.11 5.18 1.01 -0.80 -3.49 120.40 124.30 1j8y s VAL 41 Ca 0.00 2.06 -0.36 0.00 0.00 0.00 0.00 61.98 63.68 1j8y s VAL 41 Cb 0.00 -4.31 -0.16 0.00 0.00 0.00 0.00 36.38 31.91 1j8y s VAL 41 CO 0.00 0.30 1.42 -3.20 0.00 0.00 0.00 175.10 173.62 1j8y n ASN 42 N 2.89 2.12 -0.06 3.32 5.15 -1.26 -4.63 115.26 122.79 1j8y n ASN 42 Ca 0.03 1.11 0.10 0.00 -0.60 0.00 0.00 54.58 55.22 1j8y n ASN 42 Cb 0.49 -1.27 0.49 0.00 -0.53 0.00 0.00 39.78 38.97 1j8y n ASN 42 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 1j8y h VAL 43 N 3.44 0.93 -0.76 3.44 3.04 -1.96 0.29 116.25 124.67 1j8y h VAL 43 Ca -0.47 -0.14 -0.01 0.00 -1.01 0.00 0.00 66.70 65.07 1j8y h VAL 43 Cb 1.31 0.48 -0.04 0.00 -2.01 0.00 0.00 31.29 31.03 1j8y h VAL 43 CO 0.81 0.08 0.45 0.50 -1.01 0.00 0.00 177.57 178.40 1j8y h LYS 44 N 0.42 1.03 -0.29 4.17 3.11 -2.00 -0.38 116.57 122.64 1j8y h LYS 44 Ca 0.25 -0.10 -0.12 0.00 -2.81 0.00 0.00 60.65 57.87 1j8y h LYS 44 Cb 0.42 -0.21 -0.01 0.00 -1.00 0.00 0.00 32.23 31.43 1j8y h LYS 44 CO -0.07 0.74 -0.30 -0.07 -2.81 0.00 0.00 179.45 176.95 1j8y h LEU 45 N 1.04 0.62 -0.33 5.20 3.38 -1.32 -1.52 115.31 122.38 1j8y h LEU 45 Ca 0.27 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1j8y h LEU 45 Cb -0.02 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1j8y h LEU 45 CO -0.05 0.88 0.12 0.58 0.09 0.00 0.00 178.44 180.06 1j8y h VAL 46 N 0.52 1.20 -0.16 1.22 2.07 -0.77 -0.74 116.25 119.58 1j8y h VAL 46 Ca 0.06 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1j8y h VAL 46 Cb 0.77 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1j8y h VAL 46 CO 0.06 0.21 0.08 0.15 0.02 0.00 0.00 177.57 178.10 1j8y h PHE 47 N 0.38 0.22 -0.77 1.57 3.57 -0.98 -2.07 116.94 118.87 1j8y h PHE 47 Ca 0.11 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.57 1j8y h PHE 47 Cb 0.22 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.85 1j8y h PHE 47 CO 0.00 0.24 0.36 0.77 -2.23 0.00 0.00 178.31 177.45 1j8y h SER 48 N 0.14 1.01 0.22 0.41 0.02 -1.20 -1.56 113.55 112.59 1j8y h SER 48 Ca 0.06 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.85 1j8y h SER 48 Cb 0.10 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.38 1j8y h SER 48 CO -0.01 0.87 -0.11 0.25 -1.14 0.00 0.00 176.83 176.70 1j8y h LEU 49 N 1.09 -0.25 -1.19 5.07 5.85 -0.94 -0.25 115.31 124.68 1j8y h LEU 49 Ca 0.26 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.90 1j8y h LEU 49 Cb 0.14 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1j8y h LEU 49 CO -0.03 -0.16 -0.34 0.71 -0.34 0.00 0.00 178.44 178.27 1j8y h THR 50 N -0.31 1.26 -0.16 1.05 1.35 -1.31 -1.16 112.91 113.63 1j8y h THR 50 Ca -0.03 -1.26 -0.16 0.00 -0.55 0.00 0.00 66.41 64.40 1j8y h THR 50 Cb 0.24 1.60 -0.01 0.00 -1.73 0.00 0.00 68.15 68.26 1j8y h THR 50 CO 0.05 0.37 -0.58 0.78 -0.25 0.00 0.00 175.52 175.89 1j8y h ASN 51 N 0.10 0.59 -0.47 5.36 2.35 -1.08 -1.16 115.58 121.27 1j8y h ASN 51 Ca 0.01 -0.33 -0.09 0.00 -0.55 0.00 0.00 56.30 55.34 1j8y h ASN 51 Cb 0.65 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.84 1j8y h ASN 51 CO 0.05 1.04 -0.06 0.50 -1.65 0.00 0.00 177.43 177.31 1j8y h LYS 52 N 0.40 0.87 -0.38 0.81 3.64 -0.69 -0.73 116.57 120.49 1j8y h LYS 52 Ca 0.00 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 1j8y h LYS 52 Cb 1.13 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.87 1j8y h LYS 52 CO 0.11 0.95 0.25 0.82 -2.27 0.00 0.00 179.45 179.30 1j8y h ILE 53 N 0.72 1.10 -0.49 2.00 2.04 -1.08 -0.57 117.51 121.23 1j8y h ILE 53 Ca 0.12 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.74 1j8y h ILE 53 Cb 0.59 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 1j8y h ILE 53 CO 0.04 0.10 0.12 0.11 0.00 0.00 0.00 178.15 178.51 1j8y h LYS 54 N 0.51 0.75 0.30 2.37 1.57 -1.01 -1.84 116.57 119.22 1j8y h LYS 54 Ca 0.14 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1j8y h LYS 54 Cb -0.05 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.15 1j8y h LYS 54 CO -0.03 0.68 -0.14 1.49 -0.57 0.00 0.00 179.45 180.88 1j8y h GLU 55 N 0.73 -0.39 -0.91 3.15 4.57 -0.66 -2.87 114.58 118.20 1j8y h GLU 55 Ca 0.16 0.03 0.14 0.00 -1.18 0.00 0.00 59.36 58.51 1j8y h GLU 55 Cb 0.27 0.09 -0.07 0.00 -0.16 0.00 0.00 28.75 28.88 1j8y h GLU 55 CO -0.00 -0.07 0.58 0.00 -1.18 0.00 0.00 179.01 178.34 1j8y h ARG 56 N -0.73 0.72 0.00 1.92 3.08 -1.03 0.36 114.38 118.70 1j8y h ARG 56 Ca -0.04 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1j8y h ARG 56 Cb 0.49 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 1j8y h ARG 56 CO 0.07 0.47 -0.07 1.25 -1.07 0.00 0.00 179.97 180.62 1j8y h LEU 57 N 0.74 0.00 0.00 3.04 7.12 -1.21 0.16 115.31 125.15 1j8y h LEU 57 Ca 0.46 0.00 -0.12 0.00 0.13 0.00 0.00 57.88 58.34 1j8y h LEU 57 Cb 0.68 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.79 1j8y h LEU 57 CO -0.22 0.07 -1.72 2.29 -0.13 0.00 0.00 178.44 178.74 1j8y n LYS 58 N -3.44 0.64 -0.00 1.25 2.85 0.06 -4.36 118.16 115.16 1j8y n LYS 58 Ca -0.02 0.03 0.10 0.00 -1.05 0.00 0.00 58.31 57.37 1j8y n LYS 58 Cb 0.21 -1.66 -0.14 0.00 -0.65 0.00 0.00 35.03 32.79 1j8y n LYS 58 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1j8y n ASN 59 N -2.62 0.59 -3.97 -5.58 3.02 -0.83 -4.83 115.26 101.04 1j8y n ASN 59 Ca -0.11 -0.49 -0.31 0.00 -0.03 0.00 0.00 54.58 53.64 1j8y n ASN 59 Cb 0.76 1.47 -0.15 0.00 -0.61 0.00 0.00 39.78 41.26 1j8y n ASN 59 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1j8y s GLU 60 N -3.18 1.50 0.70 3.52 2.02 0.52 -5.08 118.70 118.71 1j8y s GLU 60 Ca 0.00 -1.96 -0.12 0.00 0.02 0.00 0.00 54.97 52.90 1j8y s GLU 60 Cb 0.14 -3.09 0.02 0.00 0.10 0.00 0.00 34.13 31.30 1j8y s GLU 60 CO 0.85 -0.99 1.08 -1.59 0.02 0.00 0.00 175.26 174.63 1j8y s LYS 61 N 0.70 2.71 0.44 1.61 0.00 -1.26 -4.71 119.74 119.22 1j8y s LYS 61 Ca 0.12 1.15 -0.25 0.00 0.00 0.00 0.00 55.97 56.99 1j8y s LYS 61 Cb -0.20 -1.95 -0.08 0.00 0.00 0.00 0.00 37.83 35.59 1j8y s LYS 61 CO -0.08 -1.29 1.30 -2.14 0.00 0.00 0.00 175.35 173.15 1j8y s PRO 62 N -4.68 3.79 0.77 1.78 0.02 -1.26 -4.96 135.00 130.45 1j8y s PRO 62 Ca 0.62 2.14 -0.13 0.00 0.02 0.00 0.00 61.00 63.65 1j8y s PRO 62 Cb -0.17 -2.62 0.06 0.00 0.02 0.00 0.00 34.50 31.79 1j8y s PRO 62 CO 0.50 -0.64 1.13 -2.14 -0.33 0.00 0.00 177.00 175.53 1j8y s PRO 63 N -2.43 2.09 0.45 5.54 0.02 -1.26 -4.88 135.00 134.54 1j8y s PRO 63 Ca 0.60 1.44 -0.24 0.00 0.02 0.00 0.00 61.00 62.82 1j8y s PRO 63 Cb -0.38 -1.86 -0.09 0.00 0.02 0.00 0.00 34.50 32.19 1j8y s PRO 63 CO 0.47 -1.80 1.11 0.25 -0.33 0.00 0.00 177.00 176.70 1j8y n THR 64 N -3.22 2.70 0.00 0.99 -2.24 -1.26 -1.68 114.28 109.57 1j8y n THR 64 Ca 0.11 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1j8y n THR 64 Cb 0.52 -1.32 0.00 0.00 -2.10 0.00 0.00 70.33 67.43 1j8y n THR 64 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1j8y n TYR 65 N -0.56 0.00 -3.44 4.78 4.02 -1.26 -5.00 117.16 115.70 1j8y n TYR 65 Ca 0.09 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.59 1j8y n TYR 65 Cb 0.40 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.63 1j8y n TYR 65 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1j8y s ILE 66 N -2.18 5.21 0.65 -0.72 -1.09 -0.67 -5.06 121.20 117.34 1j8y s ILE 66 Ca 0.00 0.52 -0.18 0.00 -2.23 0.00 0.00 60.65 58.76 1j8y s ILE 66 Cb 0.00 -3.67 -0.01 0.00 -1.58 0.00 0.00 42.46 37.21 1j8y s ILE 66 CO 0.00 0.21 1.29 -1.61 -1.23 0.00 0.00 174.94 173.59 1j8y s GLU 67 N 1.77 2.53 0.24 2.79 2.02 -1.26 -4.64 118.70 122.15 1j8y s GLU 67 Ca 0.14 2.04 -0.07 0.00 0.02 0.00 0.00 54.97 57.10 1j8y s GLU 67 Cb -0.15 -1.85 0.22 0.00 0.10 0.00 0.00 34.13 32.45 1j8y s GLU 67 CO 0.09 -1.61 1.88 0.00 0.02 0.00 0.00 175.26 175.64 1j8y h ARG 68 N 0.49 1.28 -0.14 1.61 3.08 -1.97 -0.87 114.38 117.86 1j8y h ARG 68 Ca -0.51 -0.13 -0.19 0.00 0.07 0.00 0.00 59.98 59.23 1j8y h ARG 68 Cb 1.33 -0.26 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 1j8y h ARG 68 CO 0.53 0.91 -0.67 0.00 -1.07 0.00 0.00 179.97 179.66 1j8y h ARG 69 N 1.29 0.57 -0.65 0.04 3.08 -1.98 -1.69 114.38 115.04 1j8y h ARG 69 Ca 0.33 -0.42 -0.08 0.00 0.07 0.00 0.00 59.98 59.88 1j8y h ARG 69 Cb -0.03 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 1j8y h ARG 69 CO -0.06 1.05 0.09 0.93 -1.07 0.00 0.00 179.97 180.91 1j8y h GLU 70 N 0.41 1.09 -0.59 0.04 4.39 -1.88 -2.54 114.58 115.49 1j8y h GLU 70 Ca -0.02 -0.30 -0.03 0.00 0.34 0.00 0.00 59.36 59.35 1j8y h GLU 70 Cb 1.25 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.75 1j8y h GLU 70 CO 0.13 1.01 0.24 2.35 -1.16 0.00 0.00 179.01 181.58 1j8y h TRP 71 N 1.01 0.90 -0.18 4.33 -0.00 -1.03 -1.44 115.95 119.54 1j8y h TRP 71 Ca 0.20 -0.06 0.03 0.00 -0.00 0.00 0.00 58.89 59.05 1j8y h TRP 71 Cb 0.46 -0.27 -0.03 0.00 -0.00 0.00 0.00 29.16 29.32 1j8y h TRP 71 CO 0.03 0.72 -0.02 0.35 -0.00 0.00 0.00 178.44 179.52 1j8y h PHE 72 N 0.82 -0.05 -0.66 2.65 3.57 -1.09 -1.85 116.94 120.33 1j8y h PHE 72 Ca 0.20 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.68 1j8y h PHE 72 Cb 0.19 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 1j8y h PHE 72 CO 0.01 -0.05 0.26 0.82 -2.23 0.00 0.00 178.31 177.12 1j8y h ILE 73 N 0.03 1.23 -0.65 1.41 1.08 -1.24 -0.60 117.51 118.77 1j8y h ILE 73 Ca 0.09 -0.73 0.01 0.00 -0.39 0.00 0.00 64.86 63.84 1j8y h ILE 73 Cb 0.12 0.44 -0.04 0.00 -3.07 0.00 0.00 36.82 34.28 1j8y h ILE 73 CO -0.17 0.29 0.42 0.50 -0.69 0.00 0.00 178.15 178.51 1j8y h LYS 74 N 0.96 0.82 -0.65 2.37 3.11 -0.83 0.16 116.57 122.52 1j8y h LYS 74 Ca 0.22 -0.05 -0.08 0.00 -2.81 0.00 0.00 60.65 57.93 1j8y h LYS 74 Cb 0.19 -0.19 -0.02 0.00 -1.00 0.00 0.00 32.23 31.21 1j8y h LYS 74 CO -0.02 0.54 0.08 0.82 -2.81 0.00 0.00 179.45 178.06 1j8y h ILE 75 N 0.85 1.26 -0.45 2.00 2.04 -0.79 -1.41 117.51 121.01 1j8y h ILE 75 Ca 0.25 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 65.04 1j8y h ILE 75 Cb -0.05 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 1j8y h ILE 75 CO -0.07 0.40 0.28 0.58 0.00 0.00 0.00 178.15 179.34 1j8y h VAL 76 N 1.01 1.13 -0.60 1.67 2.07 -0.04 -1.60 116.25 119.89 1j8y h VAL 76 Ca 0.19 -0.27 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 1j8y h VAL 76 Cb 0.47 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 1j8y h VAL 76 CO 0.02 0.13 0.25 1.88 0.02 0.00 0.00 177.57 179.87 1j8y h TYR 77 N 0.60 0.91 -0.43 1.57 0.05 -0.53 -1.28 116.97 117.85 1j8y h TYR 77 Ca 0.16 -0.06 0.04 0.00 0.05 0.00 0.00 58.73 58.92 1j8y h TYR 77 Cb -0.03 -0.27 -0.04 0.00 1.01 0.00 0.00 36.73 37.39 1j8y h TYR 77 CO -0.04 0.71 0.19 -0.44 -1.05 0.00 0.00 178.16 177.54 1j8y h ASP 78 N 0.83 0.25 0.72 3.88 3.32 -0.92 -1.55 116.42 122.95 1j8y h ASP 78 Ca 0.20 0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.17 1j8y h ASP 78 Cb 0.18 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1j8y h ASP 78 CO -0.02 0.18 -0.55 -0.33 -1.72 0.00 0.00 179.24 176.81 1j8y h GLU 79 N 0.39 0.00 -0.42 3.56 4.39 -1.11 -2.26 114.58 119.13 1j8y h GLU 79 Ca 0.19 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.79 1j8y h GLU 79 Cb 0.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1j8y h GLU 79 CO -0.16 0.55 -0.11 -0.07 -1.16 0.00 0.00 179.01 178.06 1j8y h LEU 80 N 0.00 0.82 -0.69 1.33 3.38 -0.88 0.64 115.31 119.92 1j8y h LEU 80 Ca -0.01 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.62 1j8y h LEU 80 Cb 1.05 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 1j8y h LEU 80 CO 0.07 1.00 0.44 -1.28 0.09 0.00 0.00 178.44 178.76 1j8y h SER 81 N 0.63 0.75 -0.43 -0.43 0.87 -1.11 -2.19 113.55 111.65 1j8y h SER 81 Ca 0.10 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 1j8y h SER 81 Cb 0.64 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 1j8y h SER 81 CO 0.04 0.53 0.21 0.78 -0.53 0.00 0.00 176.83 177.86 1j8y h ASN 82 N 0.89 0.56 -0.90 6.23 -0.26 -1.06 0.38 115.58 121.43 1j8y h ASN 82 Ca 0.26 -0.13 0.21 0.00 -0.56 0.00 0.00 56.30 56.09 1j8y h ASN 82 Cb -0.05 -0.14 -0.06 0.00 -1.06 0.00 0.00 38.32 37.00 1j8y h ASN 82 CO -0.08 0.53 0.60 0.25 -1.06 0.00 0.00 177.43 177.67 1j8y h LEU 83 N 0.55 0.35 -1.94 1.61 5.85 -0.29 0.89 115.31 122.34 1j8y h LEU 83 Ca 0.15 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1j8y h LEU 83 Cb 0.12 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1j8y h LEU 83 CO -0.02 0.14 0.00 0.49 -0.34 0.00 0.00 178.44 178.71 1j8y n PHE 84 N -4.48 0.61 0.00 1.25 3.72 -0.80 -4.42 117.46 113.33 1j8y n PHE 84 Ca 0.19 -0.30 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1j8y n PHE 84 Cb 0.74 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.28 1j8y n PHE 84 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1j8y n GLY 85 N 1.36 1.76 0.00 1.37 0.00 0.30 -4.71 105.19 105.27 1j8y n GLY 85 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1j8y n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j8y n GLY 86 N 0.00 -0.86 3.58 -0.02 0.00 0.13 -4.81 105.19 103.21 1j8y n GLY 86 Ca 0.00 -1.67 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 1j8y n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1j8y s ASP 87 N -3.07 5.38 -0.25 1.61 3.68 -1.26 -3.93 116.67 118.83 1j8y s ASP 87 Ca 0.00 1.35 -0.11 0.00 2.13 0.00 0.00 52.55 55.91 1j8y s ASP 87 Cb 0.00 -2.52 0.09 0.00 -1.45 0.00 0.00 42.92 39.04 1j8y s ASP 87 CO 0.00 -2.11 0.58 -0.75 0.13 0.00 0.00 175.17 173.02 1j8y s LYS 88 N 6.57 0.54 -0.34 4.34 2.20 -1.26 -5.00 119.74 126.79 1j8y s LYS 88 Ca 0.89 1.17 -0.11 0.00 -0.36 0.00 0.00 55.97 57.56 1j8y s LYS 88 Cb -0.24 0.33 0.00 0.00 -1.51 0.00 0.00 37.83 36.42 1j8y s LYS 88 CO 0.31 -0.18 0.19 -2.00 -0.36 0.00 0.00 175.35 173.31 1j8y s GLU 89 N 2.09 3.18 0.70 4.03 2.56 -1.26 -4.31 118.70 125.69 1j8y s GLU 89 Ca -0.07 -0.84 -0.12 0.00 0.00 0.00 0.00 54.97 53.94 1j8y s GLU 89 Cb -0.09 -3.68 0.02 0.00 2.00 0.00 0.00 34.13 32.38 1j8y s GLU 89 CO -0.17 -0.53 1.08 -1.25 -0.56 0.00 0.00 175.26 173.83 1j8y s PRO 90 N 1.62 2.71 -0.48 4.30 0.04 -1.26 -4.99 135.00 136.93 1j8y s PRO 90 Ca 0.04 1.14 -0.23 0.00 0.04 0.00 0.00 61.00 61.98 1j8y s PRO 90 Cb -0.18 -1.95 0.03 0.00 0.04 0.00 0.00 34.50 32.44 1j8y s PRO 90 CO 0.07 -1.29 0.83 0.21 0.04 0.00 0.00 177.00 176.86 1j8y s LYS 91 N -4.71 3.37 -0.01 4.56 2.20 -1.26 -4.88 119.74 119.01 1j8y s LYS 91 Ca 0.61 -0.19 0.16 0.00 -0.36 0.00 0.00 55.97 56.20 1j8y s LYS 91 Cb -0.16 -3.98 -0.20 0.00 -1.51 0.00 0.00 37.83 31.97 1j8y s LYS 91 CO 0.51 -1.24 0.59 1.33 -0.36 0.00 0.00 175.35 176.18 1j8y n VAL 92 N 6.14 0.00 -3.66 4.02 0.24 -1.26 -4.87 118.33 118.94 1j8y n VAL 92 Ca 0.02 -0.19 -0.39 0.00 -2.04 0.00 0.00 64.34 61.73 1j8y n VAL 92 Cb 0.48 0.75 -0.12 0.00 -1.47 0.00 0.00 33.84 33.48 1j8y n VAL 92 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1j8y s ILE 93 N -2.70 4.35 0.40 1.34 -1.09 -1.26 -5.08 121.20 117.17 1j8y s ILE 93 Ca 0.03 -0.79 -0.26 0.00 -2.23 0.00 0.00 60.65 57.40 1j8y s ILE 93 Cb 0.12 -3.36 -0.08 0.00 -1.58 0.00 0.00 42.46 37.55 1j8y s ILE 93 CO 0.67 -0.11 1.24 -2.16 -1.23 0.00 0.00 174.94 173.34 1j8y s PRO 94 N 1.53 4.00 -0.17 2.79 0.04 -1.26 -4.93 135.00 137.00 1j8y s PRO 94 Ca 0.02 2.00 0.16 0.00 0.04 0.00 0.00 61.00 63.21 1j8y s PRO 94 Cb -0.18 -2.71 0.58 0.00 0.04 0.00 0.00 34.50 32.23 1j8y s PRO 94 CO 0.05 -0.42 1.49 -0.40 0.04 0.00 0.00 177.00 177.77 1j8y n ASP 95 N 0.09 4.24 -3.88 6.66 5.68 -1.26 -4.89 116.55 123.18 1j8y n ASP 95 Ca 0.04 -2.84 -0.25 0.00 -0.50 0.00 0.00 54.79 51.24 1j8y n ASP 95 Cb 0.45 -0.54 -0.17 0.00 -1.14 0.00 0.00 41.12 39.72 1j8y n ASP 95 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1j8y s LYS 96 N -2.53 1.27 -0.06 0.11 2.20 -1.26 -5.13 119.74 114.34 1j8y s LYS 96 Ca 0.43 -0.17 0.05 0.00 -0.36 0.00 0.00 55.97 55.92 1j8y s LYS 96 Cb 0.33 -1.36 -0.00 0.00 -1.51 0.00 0.00 37.83 35.29 1j8y s LYS 96 CO 0.12 -0.23 -0.21 0.42 -0.36 0.00 0.00 175.35 175.09 1j8y s ILE 97 N 1.60 1.79 0.68 5.43 1.09 -1.26 -3.45 121.20 127.07 1j8y s ILE 97 Ca 0.02 -0.90 -0.11 0.00 -1.10 0.00 0.00 60.65 58.56 1j8y s ILE 97 Cb -0.13 -1.53 -0.00 0.00 -1.06 0.00 0.00 42.46 39.74 1j8y s ILE 97 CO -0.06 0.50 1.05 -2.16 -0.10 0.00 0.00 174.94 174.18 1j8y s PRO 98 N 0.07 3.08 -0.17 2.79 0.04 -1.26 -5.12 135.00 134.43 1j8y s PRO 98 Ca -0.08 0.90 0.01 0.00 0.04 0.00 0.00 61.00 61.87 1j8y s PRO 98 Cb -0.14 -2.01 0.02 0.00 0.04 0.00 0.00 34.50 32.41 1j8y s PRO 98 CO 0.04 -0.98 -0.16 -0.47 0.04 0.00 0.00 177.00 175.47 1j8y s TYR 99 N -3.08 2.47 -0.24 0.56 5.04 0.98 -5.00 117.35 118.08 1j8y s TYR 99 Ca 0.57 -1.46 -0.08 0.00 -2.44 0.00 0.00 57.07 53.66 1j8y s TYR 99 Cb -0.13 -1.74 -0.04 0.00 0.35 0.00 0.00 41.96 40.40 1j8y s TYR 99 CO 0.55 -0.74 0.09 0.08 -1.34 0.00 0.00 175.55 174.19 1j8y s VAL 100 N 1.39 4.63 -0.16 3.14 1.01 -1.26 -0.52 120.40 128.63 1j8y s VAL 100 Ca 0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 61.94 1j8y s VAL 100 Cb -0.13 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 1j8y s VAL 100 CO -0.11 0.35 -0.09 -0.63 0.00 0.00 0.00 175.10 174.61 1j8y s ILE 101 N 1.38 3.22 -0.27 2.22 1.01 0.12 -0.69 121.20 128.19 1j8y s ILE 101 Ca 0.06 -0.58 -0.06 0.00 0.00 0.00 0.00 60.65 60.07 1j8y s ILE 101 Cb -0.15 -2.40 0.00 0.00 0.01 0.00 0.00 42.46 39.93 1j8y s ILE 101 CO 0.05 0.49 0.04 -0.32 0.00 0.00 0.00 174.94 175.20 1j8y s MET 102 N 0.73 3.21 -0.01 2.79 -2.45 0.03 -0.12 119.30 123.48 1j8y s MET 102 Ca -0.04 -0.76 -0.17 0.00 -1.25 0.00 0.00 55.69 53.46 1j8y s MET 102 Cb -0.15 -3.25 -0.06 0.00 1.25 0.00 0.00 34.83 32.62 1j8y s MET 102 CO 0.02 -0.35 0.48 -0.51 1.05 0.00 0.00 175.02 175.70 1j8y s LEU 103 N 1.50 4.44 0.19 4.11 1.43 0.14 -0.31 118.68 130.17 1j8y s LEU 103 Ca 0.04 1.01 -0.01 0.00 -1.03 0.00 0.00 54.13 54.13 1j8y s LEU 103 Cb -0.16 -2.71 -0.04 0.00 0.03 0.00 0.00 46.19 43.31 1j8y s LEU 103 CO 0.01 0.22 0.13 0.68 0.23 0.00 0.00 176.35 177.61 1j8y s VAL 104 N -0.60 0.02 0.00 -1.59 -7.23 -0.25 -2.24 120.40 108.51 1j8y s VAL 104 Ca 0.26 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.46 1j8y s VAL 104 Cb -0.17 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.36 1j8y s VAL 104 CO 0.14 -0.08 0.00 0.61 -0.31 0.00 0.00 175.10 175.46 1j8y n GLY 105 N -0.24 1.02 3.81 2.32 0.00 -1.18 -1.02 105.19 109.90 1j8y n GLY 105 Ca 0.01 -1.31 -0.31 0.00 0.00 0.00 0.00 46.02 44.41 1j8y n GLY 105 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j8y s VAL 106 N -1.93 3.95 -0.21 1.61 -7.23 -1.26 -3.28 120.40 112.06 1j8y s VAL 106 Ca 0.00 0.64 -0.32 0.00 -1.81 0.00 0.00 61.98 60.48 1j8y s VAL 106 Cb 0.00 -3.35 -0.09 0.00 0.56 0.00 0.00 36.38 33.50 1j8y s VAL 106 CO 0.00 -0.82 2.09 0.00 -0.31 0.00 0.00 175.10 176.06 1j8y n GLN 107 N -3.15 1.79 -0.59 4.82 1.13 -1.26 -4.83 117.38 115.29 1j8y n GLN 107 Ca 0.08 0.57 0.00 0.00 -1.94 0.00 0.00 57.00 55.70 1j8y n GLN 107 Cb 0.53 -2.79 0.00 0.00 0.11 0.00 0.00 30.24 28.09 1j8y n GLN 107 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1j8y n GLY 108 N 5.51 -1.03 2.74 1.08 0.00 -1.26 -5.05 105.19 107.18 1j8y n GLY 108 Ca 0.31 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1j8y n GLY 108 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1j8y n THR 113 N 0.71 0.00 -0.35 2.61 -1.04 -1.26 -4.74 114.28 110.21 1j8y n THR 113 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1j8y n THR 113 Cb 0.00 0.00 0.14 0.00 -1.82 0.00 0.00 70.33 68.65 1j8y n THR 113 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1j8y h THR 114 N 0.00 1.14 -0.56 12.58 2.02 -2.00 0.33 112.91 126.42 1j8y h THR 114 Ca 0.00 -0.41 -0.04 0.00 0.77 0.00 0.00 66.41 66.73 1j8y h THR 114 Cb 0.00 -0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 66.24 1j8y h THR 114 CO 0.00 0.22 0.18 0.00 0.37 0.00 0.00 175.52 176.29 1j8y h ALA 115 N 1.40 0.73 -0.49 6.16 0.00 -2.00 0.69 119.26 125.76 1j8y h ALA 115 Ca 0.39 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1j8y h ALA 115 Cb 0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1j8y h ALA 115 CO -0.13 0.39 0.06 0.78 0.00 0.00 0.00 179.25 180.34 1j8y h GLY 116 N 0.78 0.88 1.07 0.00 0.00 -1.71 -1.66 103.07 102.44 1j8y h GLY 116 Ca 0.18 -0.61 -0.05 0.00 0.00 0.00 0.00 47.33 46.85 1j8y h GLY 116 CO -0.01 0.56 0.27 0.50 0.00 0.00 0.00 176.54 177.86 1j8y h LYS 117 N 0.69 1.17 -0.49 4.80 1.57 -0.10 -0.47 116.57 123.73 1j8y h LYS 117 Ca 0.14 -0.23 -0.06 0.00 -1.87 0.00 0.00 60.65 58.63 1j8y h LYS 117 Cb 0.43 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1j8y h LYS 117 CO 0.01 0.97 0.08 1.25 -0.57 0.00 0.00 179.45 181.19 1j8y h LEU 118 N 1.13 0.78 -0.95 2.94 5.85 -0.70 -0.52 115.31 123.84 1j8y h LEU 118 Ca 0.25 -0.26 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 1j8y h LEU 118 Cb 0.27 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1j8y h LEU 118 CO -0.01 0.85 -0.11 0.00 -0.34 0.00 0.00 178.44 178.82 1j8y h ALA 119 N 0.96 1.12 -0.23 1.25 0.00 -1.02 -1.96 119.26 119.39 1j8y h ALA 119 Ca 0.15 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1j8y h ALA 119 Cb 0.40 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1j8y h ALA 119 CO 0.01 0.55 0.07 -0.92 0.00 0.00 0.00 179.25 178.96 1j8y h TYR 120 N 0.58 0.37 -0.47 0.00 3.20 -0.80 -0.16 116.97 119.69 1j8y h TYR 120 Ca 0.10 -0.04 0.08 0.00 3.14 0.00 0.00 58.73 62.02 1j8y h TYR 120 Cb 0.53 -0.11 -0.07 0.00 1.54 0.00 0.00 36.73 38.63 1j8y h TYR 120 CO 0.02 0.44 0.08 0.35 -1.64 0.00 0.00 178.16 177.42 1j8y h PHE 121 N 0.20 0.13 -0.03 -3.82 3.57 -0.77 -0.33 116.94 115.89 1j8y h PHE 121 Ca 0.07 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.43 1j8y h PHE 121 Cb 0.25 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1j8y h PHE 121 CO 0.01 -0.01 -0.74 1.88 -2.23 0.00 0.00 178.31 177.22 1j8y h TYR 122 N 0.22 0.26 -0.71 0.41 0.05 -1.20 -2.81 116.97 113.19 1j8y h TYR 122 Ca 0.24 -0.12 -0.07 0.00 0.05 0.00 0.00 58.73 58.82 1j8y h TYR 122 Cb 0.31 -0.04 -0.03 0.00 1.01 0.00 0.00 36.73 37.99 1j8y h TYR 122 CO -0.23 0.86 0.16 -0.22 -1.05 0.00 0.00 178.16 177.68 1j8y h LYS 123 N 0.13 1.14 0.00 4.88 3.64 -0.53 -1.63 116.57 124.21 1j8y h LYS 123 Ca -0.02 -0.28 -0.03 0.00 -1.27 0.00 0.00 60.65 59.05 1j8y h LYS 123 Cb 1.30 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1j8y h LYS 123 CO 0.11 1.01 -0.13 -0.22 -2.27 0.00 0.00 179.45 177.95 1j8y h LYS 124 N 1.08 0.00 -0.00 1.90 3.64 -0.95 0.59 116.57 122.83 1j8y h LYS 124 Ca 0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1j8y h LYS 124 Cb 0.39 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1j8y h LYS 124 CO 0.01 0.13 -0.01 1.63 -2.27 0.00 0.00 179.45 178.94 1j8y n LYS 125 N -4.02 0.71 -0.14 1.90 4.76 -0.68 -4.89 118.16 115.80 1j8y n LYS 125 Ca -0.02 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.38 1j8y n LYS 125 Cb 0.22 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.91 1j8y n LYS 125 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j8y n GLY 126 N 1.16 0.89 3.87 0.72 0.00 0.20 -5.09 105.19 106.94 1j8y n GLY 126 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1j8y n GLY 126 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j8y s PHE 127 N -2.03 3.45 -0.48 1.61 0.08 -0.81 -5.01 117.98 114.78 1j8y s PHE 127 Ca 0.00 1.06 -0.21 0.00 0.12 0.00 0.00 56.93 57.90 1j8y s PHE 127 Cb 0.00 -2.44 0.04 0.00 -0.57 0.00 0.00 43.02 40.05 1j8y s PHE 127 CO 0.00 -0.04 0.70 0.15 -0.10 0.00 0.00 175.22 175.94 1j8y s LYS 128 N -3.61 3.25 0.05 0.44 -0.14 -1.26 -4.36 119.74 114.11 1j8y s LYS 128 Ca 0.51 -0.50 0.03 0.00 -1.36 0.00 0.00 55.97 54.66 1j8y s LYS 128 Cb -0.10 -4.02 -0.04 0.00 -1.68 0.00 0.00 37.83 31.99 1j8y s LYS 128 CO 0.28 -1.17 0.02 0.08 -0.76 0.00 0.00 175.35 173.79 1j8y s VAL 129 N 3.00 4.19 -0.03 3.17 1.01 -1.26 -0.44 120.40 130.04 1j8y s VAL 129 Ca 0.22 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.44 1j8y s VAL 129 Cb -0.15 -2.95 0.00 0.00 0.00 0.00 0.00 36.38 33.28 1j8y s VAL 129 CO 0.17 0.22 -0.10 -0.83 0.00 0.00 0.00 175.10 174.55 1j8y s GLY 130 N -2.05 0.61 -0.12 4.51 0.00 -0.11 -4.06 107.32 106.11 1j8y s GLY 130 Ca 0.24 -0.38 -0.02 0.00 0.00 0.00 0.00 44.72 44.56 1j8y s GLY 130 CO 0.16 -0.09 -0.05 1.08 0.00 0.00 0.00 173.10 174.20 1j8y s LEU 131 N 0.23 3.25 -0.23 0.66 1.43 0.76 -1.29 118.68 123.49 1j8y s LEU 131 Ca -0.04 -0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 52.98 1j8y s LEU 131 Cb -0.10 -1.75 0.02 0.00 0.03 0.00 0.00 46.19 44.39 1j8y s LEU 131 CO 0.01 0.26 -0.09 -0.69 0.23 0.00 0.00 176.35 176.07 1j8y s VAL 132 N -0.19 2.79 -0.81 -1.59 1.01 0.17 0.68 120.40 122.46 1j8y s VAL 132 Ca 0.03 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 60.90 1j8y s VAL 132 Cb -0.13 -2.35 0.11 0.00 0.00 0.00 0.00 36.38 34.01 1j8y s VAL 132 CO 0.02 0.31 1.04 -0.83 0.00 0.00 0.00 175.10 175.64 1j8y s GLY 133 N 1.34 1.72 -0.27 4.51 0.00 0.38 -0.80 107.32 114.22 1j8y s GLY 133 Ca 0.02 -2.41 0.10 0.00 0.00 0.00 0.00 44.72 42.43 1j8y s GLY 133 CO -0.06 2.00 1.42 0.00 0.00 0.00 0.00 173.10 176.46 1j8y n ALA 134 N 6.94 4.05 -3.38 3.20 0.00 0.29 -4.61 120.51 127.00 1j8y n ALA 134 Ca 0.12 -3.08 -0.44 0.00 0.00 0.00 0.00 53.44 50.04 1j8y n ALA 134 Cb 0.47 -0.67 -0.02 0.00 0.00 0.00 0.00 19.45 19.23 1j8y n ALA 134 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1j8y s ASP 135 N -2.59 6.98 0.14 0.00 2.15 -0.96 -4.49 116.67 117.90 1j8y s ASP 135 Ca 0.43 -3.39 0.03 0.00 0.43 0.00 0.00 52.55 50.05 1j8y s ASP 135 Cb 0.39 -2.16 -0.09 0.00 -0.30 0.00 0.00 42.92 40.75 1j8y s ASP 135 CO -0.00 -0.34 1.32 -0.37 -0.17 0.00 0.00 175.17 175.60 1j8y h VAL 136 N 4.01 1.55 -0.26 1.11 -1.51 -1.87 -3.33 116.25 115.95 1j8y h VAL 136 Ca 0.15 -2.89 0.06 0.00 -1.23 0.00 0.00 66.70 62.80 1j8y h VAL 136 Cb 0.91 2.64 -0.08 0.00 -2.13 0.00 0.00 31.29 32.63 1j8y h VAL 136 CO 0.93 0.84 -0.29 1.88 -1.23 0.00 0.00 177.57 179.69 1j8y h TYR 137 N 0.07 -0.79 -3.43 5.19 0.99 -1.92 -3.32 116.97 113.76 1j8y h TYR 137 Ca -0.05 0.04 -0.57 0.00 2.00 0.00 0.00 58.73 60.16 1j8y h TYR 137 Cb 1.64 0.38 -0.06 0.00 1.00 0.00 0.00 36.73 39.69 1j8y h TYR 137 CO 0.03 -0.36 0.93 1.03 -0.00 0.00 0.00 178.16 179.79 1j8y s ARG 138 N -6.03 3.85 0.18 4.88 0.52 -1.25 -4.90 118.95 116.19 1j8y s ARG 138 Ca -0.15 0.90 -0.09 0.00 -0.52 0.00 0.00 55.73 55.87 1j8y s ARG 138 Cb 0.12 -3.87 0.06 0.00 0.52 0.00 0.00 34.95 31.79 1j8y s ARG 138 CO 0.67 -1.21 1.63 -1.00 0.02 0.00 0.00 175.30 175.41 1j8y h PRO 139 N 9.08 1.06 0.00 3.54 0.13 -1.84 -2.76 132.00 141.21 1j8y h PRO 139 Ca -0.23 -0.36 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 1j8y h PRO 139 Cb 1.07 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.12 1j8y h PRO 139 CO 1.08 1.06 0.00 0.00 -0.23 0.00 0.00 178.00 179.91 1j8y h ALA 140 N 0.97 1.00 -0.07 -0.56 0.00 -1.93 -3.30 119.26 115.38 1j8y h ALA 140 Ca 0.16 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1j8y h ALA 140 Cb 0.61 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 1j8y h ALA 140 CO 0.04 0.00 -0.53 0.00 0.00 0.00 0.00 179.25 178.76 1j8y h ALA 141 N 2.05 -0.91 -0.42 0.00 0.00 -1.76 -0.39 119.26 117.82 1j8y h ALA 141 Ca 0.00 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.92 1j8y h ALA 141 Cb 0.45 0.97 -0.07 0.00 0.00 0.00 0.00 17.79 19.14 1j8y h ALA 141 CO 0.00 -1.09 -0.02 1.25 0.00 0.00 0.00 179.25 179.40 1j8y h LEU 142 N -0.61 -0.21 -0.25 0.00 5.85 -1.75 0.69 115.31 119.04 1j8y h LEU 142 Ca 0.02 0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.88 1j8y h LEU 142 Cb 0.68 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 1j8y h LEU 142 CO -0.39 -0.07 0.05 -0.33 -0.34 0.00 0.00 178.44 177.37 1j8y h GLU 143 N 0.09 0.14 -0.12 1.25 5.08 -1.67 0.31 114.58 119.66 1j8y h GLU 143 Ca 0.21 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.60 1j8y h GLU 143 Cb 0.31 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1j8y h GLU 143 CO -0.36 0.09 -0.09 1.96 -1.00 0.00 0.00 179.01 179.61 1j8y h GLN 144 N 0.15 -0.10 -0.25 2.33 4.20 -0.37 -0.99 115.11 120.08 1j8y h GLN 144 Ca 0.11 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.88 1j8y h GLN 144 Cb 0.11 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 27.87 1j8y h GLN 144 CO -0.15 -0.07 -0.07 1.25 -0.67 0.00 0.00 178.83 179.13 1j8y h LEU 145 N -0.10 -0.25 -1.56 1.46 6.46 -0.40 0.16 115.31 121.07 1j8y h LEU 145 Ca 0.08 0.08 0.09 0.00 -0.12 0.00 0.00 57.88 58.00 1j8y h LEU 145 Cb 0.22 0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.27 1j8y h LEU 145 CO -0.19 -0.09 0.42 1.56 -0.62 0.00 0.00 178.44 179.52 1j8y h GLN 146 N -0.01 0.50 -0.14 1.25 4.20 -0.53 0.17 115.11 120.55 1j8y h GLN 146 Ca 0.12 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.75 1j8y h GLN 146 Cb 0.19 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 1j8y h GLN 146 CO -0.26 0.33 -0.09 1.96 -0.67 0.00 0.00 178.83 180.10 1j8y h GLN 147 N 0.51 0.30 -0.70 1.46 4.20 0.31 -0.84 115.11 120.36 1j8y h GLN 147 Ca 0.29 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 1j8y h GLN 147 Cb 0.45 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.19 1j8y h GLN 147 CO -0.09 0.66 0.41 -0.07 -0.67 0.00 0.00 178.83 179.07 1j8y h LEU 148 N -0.06 0.85 -0.75 1.46 3.38 -0.28 -0.69 115.31 119.22 1j8y h LEU 148 Ca 0.03 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1j8y h LEU 148 Cb 0.58 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 1j8y h LEU 148 CO 0.02 0.67 0.44 1.23 0.09 0.00 0.00 178.44 180.90 1j8y h GLY 149 N 0.95 1.10 1.07 0.83 0.00 -0.58 -0.65 103.07 105.79 1j8y h GLY 149 Ca 0.25 -0.47 -0.10 0.00 0.00 0.00 0.00 47.33 47.01 1j8y h GLY 149 CO -0.04 0.45 -0.03 -1.61 0.00 0.00 0.00 176.54 175.31 1j8y h GLN 150 N 1.03 1.03 -0.39 4.80 5.75 -0.87 -0.27 115.11 126.20 1j8y h GLN 150 Ca 0.27 -0.34 -0.07 0.00 -0.15 0.00 0.00 58.65 58.36 1j8y h GLN 150 Cb -0.02 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.43 1j8y h GLN 150 CO -0.05 1.03 -0.04 0.37 -2.65 0.00 0.00 178.83 177.49 1j8y h GLN 151 N 0.92 0.64 -0.22 1.69 5.75 -0.65 -3.16 115.11 120.07 1j8y h GLN 151 Ca 0.16 -0.17 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 1j8y h GLN 151 Cb 0.58 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.06 1j8y h GLN 151 CO 0.03 0.69 0.00 0.44 -2.65 0.00 0.00 178.83 177.34 1j8y n ILE 152 N -4.22 0.36 -3.13 2.39 -5.35 -0.30 -4.99 119.36 104.12 1j8y n ILE 152 Ca 0.02 -0.68 -0.14 0.00 -0.27 0.00 0.00 62.75 61.68 1j8y n ILE 152 Cb 0.30 1.07 0.05 0.00 -1.74 0.00 0.00 39.64 39.31 1j8y n ILE 152 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1j8y n GLY 153 N 1.09 0.08 3.15 3.28 0.00 -0.27 -5.03 105.19 107.48 1j8y n GLY 153 Ca 0.14 -0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1j8y n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j8y s VAL 154 N -3.19 1.62 0.29 1.61 1.01 -0.29 -5.03 120.40 116.41 1j8y s VAL 154 Ca 0.33 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.22 1j8y s VAL 154 Cb -0.14 -1.41 -0.11 0.00 0.00 0.00 0.00 36.38 34.72 1j8y s VAL 154 CO 0.43 0.46 1.47 -2.84 0.00 0.00 0.00 175.10 174.61 1j8y s PRO 155 N 0.27 4.22 -0.15 2.72 0.02 -1.26 -4.35 135.00 136.47 1j8y s PRO 155 Ca -0.11 2.39 0.01 0.00 0.02 0.00 0.00 61.00 63.31 1j8y s PRO 155 Cb -0.15 -3.07 0.02 0.00 0.02 0.00 0.00 34.50 31.32 1j8y s PRO 155 CO 0.05 -0.46 -0.18 0.08 -0.33 0.00 0.00 177.00 176.16 1j8y s VAL 156 N -0.28 1.83 -0.13 3.83 1.01 -1.26 -0.17 120.40 125.23 1j8y s VAL 156 Ca 0.58 -0.81 -0.09 0.00 0.00 0.00 0.00 61.98 61.66 1j8y s VAL 156 Cb -0.44 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 1j8y s VAL 156 CO 0.48 0.50 0.17 -0.47 0.00 0.00 0.00 175.10 175.79 1j8y s TYR 157 N 1.21 3.55 0.05 5.22 5.04 0.21 -4.98 117.35 127.66 1j8y s TYR 157 Ca 0.01 0.52 -0.27 0.00 -2.44 0.00 0.00 57.07 54.89 1j8y s TYR 157 Cb -0.14 -2.06 0.09 0.00 0.35 0.00 0.00 41.96 40.20 1j8y s TYR 157 CO -0.08 0.57 0.77 0.20 -1.34 0.00 0.00 175.55 175.67 1j8y s GLY 158 N -0.54 -0.52 -0.38 8.97 0.00 -1.26 -0.47 107.32 113.12 1j8y s GLY 158 Ca 0.14 0.87 0.02 0.00 0.00 0.00 0.00 44.72 45.75 1j8y s GLY 158 CO 0.03 0.33 0.14 -0.54 0.00 0.00 0.00 173.10 173.06 1j8y s GLU 159 N -3.19 1.19 -0.09 2.90 2.02 -1.26 -5.06 118.70 115.22 1j8y s GLU 159 Ca 0.02 -1.69 -0.39 0.00 0.02 0.00 0.00 54.97 52.94 1j8y s GLU 159 Cb -0.01 -2.51 -0.17 0.00 0.10 0.00 0.00 34.13 31.55 1j8y s GLU 159 CO -0.09 -1.04 1.49 -2.30 0.02 0.00 0.00 175.26 173.34 1j8y n PRO 160 N 4.15 1.03 0.00 0.39 -0.02 -1.26 -1.28 135.00 138.01 1j8y n PRO 160 Ca 0.03 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 1j8y n PRO 160 Cb 0.39 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1j8y n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j8y n GLY 161 N 3.17 2.93 3.76 -1.23 0.00 -1.26 -5.00 105.19 107.55 1j8y n GLY 161 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 1j8y n GLY 161 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j8y s GLU 162 N 0.00 4.47 0.00 1.61 2.56 -0.41 -4.93 118.70 122.00 1j8y s GLU 162 Ca 0.00 2.02 0.03 0.00 0.00 0.00 0.00 54.97 57.01 1j8y s GLU 162 Cb 0.00 -3.15 0.02 0.00 2.00 0.00 0.00 34.13 32.99 1j8y s GLU 162 CO 0.00 -0.07 0.53 1.63 -0.56 0.00 0.00 175.26 176.79 1j8y n LYS 163 N 1.50 0.18 -2.63 4.30 5.02 -1.26 -4.79 118.16 120.48 1j8y n LYS 163 Ca 0.01 -0.58 -0.43 0.00 -2.02 0.00 0.00 58.31 55.29 1j8y n LYS 163 Cb 0.43 -1.00 -0.01 0.00 -0.02 0.00 0.00 35.03 34.43 1j8y n LYS 163 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1j8y s ASP 164 N -0.34 6.75 0.25 4.39 -1.08 -1.26 -4.82 116.67 120.55 1j8y s ASP 164 Ca 0.03 -2.19 -0.04 0.00 -0.52 0.00 0.00 52.55 49.83 1j8y s ASP 164 Cb 0.02 -2.55 0.48 0.00 -1.46 0.00 0.00 42.92 39.41 1j8y s ASP 164 CO 0.04 -1.22 1.71 1.62 0.52 0.00 0.00 175.17 177.84 1j8y h VAL 165 N 5.86 0.58 -0.60 1.11 3.04 -1.88 -0.75 116.25 123.61 1j8y h VAL 165 Ca 0.35 -0.12 -0.05 0.00 -1.01 0.00 0.00 66.70 65.86 1j8y h VAL 165 Cb 0.92 0.19 -0.03 0.00 -2.01 0.00 0.00 31.29 30.36 1j8y h VAL 165 CO 1.41 0.07 0.16 0.58 -1.01 0.00 0.00 177.57 178.78 1j8y h VAL 166 N 0.36 1.24 -0.43 1.51 2.07 -1.93 -1.32 116.25 117.74 1j8y h VAL 166 Ca 0.42 -0.85 -0.13 0.00 0.82 0.00 0.00 66.70 66.97 1j8y h VAL 166 Cb 0.69 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1j8y h VAL 166 CO -0.46 0.32 -0.23 1.23 0.02 0.00 0.00 177.57 178.45 1j8y h GLY 167 N 1.02 0.96 0.71 2.17 0.00 -1.58 -1.66 103.07 104.69 1j8y h GLY 167 Ca 0.20 -0.85 -0.00 0.00 0.00 0.00 0.00 47.33 46.67 1j8y h GLY 167 CO -0.00 0.77 0.00 -2.22 0.00 0.00 0.00 176.54 175.09 1j8y h ILE 168 N 0.77 1.24 -0.47 2.60 2.04 -1.00 -1.56 117.51 121.12 1j8y h ILE 168 Ca 0.10 -0.73 0.03 0.00 1.00 0.00 0.00 64.86 65.27 1j8y h ILE 168 Cb 0.78 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 38.51 1j8y h ILE 168 CO 0.06 0.19 0.26 0.00 0.00 0.00 0.00 178.15 178.67 1j8y h ALA 169 N 0.71 0.60 -0.00 1.87 0.00 -1.24 0.30 119.26 121.50 1j8y h ALA 169 Ca 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1j8y h ALA 169 Cb 0.31 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1j8y h ALA 169 CO 0.00 -0.07 0.00 -0.22 0.00 0.00 0.00 179.25 178.96 1j8y h LYS 170 N 0.51 0.01 -0.63 0.00 3.64 -1.28 0.19 116.57 119.01 1j8y h LYS 170 Ca 0.20 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.52 1j8y h LYS 170 Cb 0.07 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1j8y h LYS 170 CO -0.12 0.17 0.15 0.00 -2.27 0.00 0.00 179.45 177.39 1j8y h ARG 171 N -0.16 1.00 -0.14 1.90 3.08 -1.09 -0.88 114.38 118.09 1j8y h ARG 171 Ca 0.00 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 59.80 1j8y h ARG 171 Cb 0.17 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1j8y h ARG 171 CO -0.00 0.91 0.07 0.78 -1.07 0.00 0.00 179.97 180.66 1j8y h GLY 172 N 0.92 0.22 0.96 0.04 0.00 -0.28 -0.28 103.07 104.65 1j8y h GLY 172 Ca 0.20 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 1j8y h GLY 172 CO 0.00 0.10 0.17 -2.08 0.00 0.00 0.00 176.54 174.73 1j8y h VAL 173 N 0.11 1.22 -0.77 4.60 2.07 -0.88 -1.75 116.25 120.84 1j8y h VAL 173 Ca 0.05 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 66.90 1j8y h VAL 173 Cb 0.11 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 1j8y h VAL 173 CO -0.01 0.26 0.47 -0.08 0.02 0.00 0.00 177.57 178.24 1j8y h GLU 174 N 0.64 0.87 -0.22 1.57 4.81 -1.02 0.93 114.58 122.16 1j8y h GLU 174 Ca 0.16 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1j8y h GLU 174 Cb 0.24 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 1j8y h GLU 174 CO -0.01 0.57 0.09 -0.22 -0.73 0.00 0.00 179.01 178.72 1j8y h LYS 175 N 0.89 0.33 -0.03 1.92 3.64 -0.69 -2.24 116.57 120.40 1j8y h LYS 175 Ca 0.33 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.53 1j8y h LYS 175 Cb 0.10 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1j8y h LYS 175 CO -0.15 0.38 -0.55 0.74 -2.27 0.00 0.00 179.45 177.60 1j8y h PHE 176 N 0.21 0.10 -0.32 1.91 0.04 -0.94 -2.12 116.94 115.82 1j8y h PHE 176 Ca 0.07 -0.04 -0.07 0.00 2.80 0.00 0.00 57.97 60.74 1j8y h PHE 176 Cb 0.17 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 1j8y h PHE 176 CO -0.01 0.61 -0.11 -0.07 -0.60 0.00 0.00 178.31 178.13 1j8y h LEU 177 N 0.06 0.54 -0.55 1.54 3.38 -0.73 -1.20 115.31 118.35 1j8y h LEU 177 Ca -0.00 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.68 1j8y h LEU 177 Cb 0.99 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1j8y h LEU 177 CO 0.08 0.68 -0.48 0.28 0.09 0.00 0.00 178.44 179.09 1j8y h SER 178 N 0.51 0.67 0.00 -0.43 0.02 -1.04 -2.48 113.55 110.80 1j8y h SER 178 Ca 0.09 -0.33 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1j8y h SER 178 Cb 0.50 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1j8y h SER 178 CO 0.03 1.04 0.00 -0.62 -1.14 0.00 0.00 176.83 176.14 1j8y n GLU 179 N -4.00 0.90 -3.54 3.45 1.02 -0.83 -4.88 120.64 112.76 1j8y n GLU 179 Ca -0.03 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.89 1j8y n GLU 179 Cb 0.57 -1.40 0.08 0.00 -0.02 0.00 0.00 31.44 30.67 1j8y n GLU 179 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1j8y n LYS 180 N -0.90 -7.56 -1.94 3.49 4.76 -0.90 -4.98 118.16 110.12 1j8y n LYS 180 Ca 0.17 0.81 -0.34 0.00 -2.87 0.00 0.00 58.31 56.08 1j8y n LYS 180 Cb 0.08 -5.80 0.03 0.00 -1.84 0.00 0.00 35.03 27.51 1j8y n LYS 180 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1j8y s MET 181 N -6.12 2.95 -0.13 1.97 -1.94 -0.50 -4.97 119.30 110.56 1j8y s MET 181 Ca 0.47 1.58 -0.03 0.00 -1.71 0.00 0.00 55.69 56.01 1j8y s MET 181 Cb -0.21 -1.95 -0.25 0.00 2.01 0.00 0.00 34.83 34.43 1j8y s MET 181 CO 0.71 -1.16 0.31 0.39 -0.01 0.00 0.00 175.02 175.26 1j8y n GLU 182 N -1.91 0.73 -4.45 2.03 1.02 0.41 -4.63 120.64 113.84 1j8y n GLU 182 Ca 0.12 0.24 -0.25 0.00 -0.02 0.00 0.00 57.16 57.25 1j8y n GLU 182 Cb 0.51 -1.69 -0.17 0.00 -0.02 0.00 0.00 31.44 30.08 1j8y n GLU 182 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1j8y s ILE 183 N -2.56 1.09 -0.15 -3.67 1.01 -0.63 -0.01 121.20 116.28 1j8y s ILE 183 Ca -0.22 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.01 1j8y s ILE 183 Cb 0.07 -1.02 0.02 0.00 0.01 0.00 0.00 42.46 41.54 1j8y s ILE 183 CO 0.75 0.35 -0.17 -0.63 0.00 0.00 0.00 174.94 175.24 1j8y s ILE 184 N 0.85 1.79 -0.21 2.92 1.01 0.32 -0.93 121.20 126.95 1j8y s ILE 184 Ca -0.11 -0.78 -0.04 0.00 0.00 0.00 0.00 60.65 59.71 1j8y s ILE 184 Cb -0.15 -1.63 -0.02 0.00 0.01 0.00 0.00 42.46 40.67 1j8y s ILE 184 CO 0.02 0.50 -0.03 -0.63 0.00 0.00 0.00 174.94 174.79 1j8y s ILE 185 N 1.23 3.59 -0.27 2.92 1.01 -0.41 0.12 121.20 129.38 1j8y s ILE 185 Ca 0.01 -0.43 -0.08 0.00 0.00 0.00 0.00 60.65 60.15 1j8y s ILE 185 Cb -0.14 -2.63 -0.02 0.00 0.01 0.00 0.00 42.46 39.69 1j8y s ILE 185 CO -0.08 0.43 0.10 -0.69 0.00 0.00 0.00 174.94 174.69 1j8y s VAL 186 N 1.25 4.36 -0.25 2.92 1.01 0.82 -0.66 120.40 129.86 1j8y s VAL 186 Ca 0.03 -0.32 -0.18 0.00 0.00 0.00 0.00 61.98 61.52 1j8y s VAL 186 Cb -0.14 -3.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 1j8y s VAL 186 CO -0.01 0.22 0.50 -0.62 0.00 0.00 0.00 175.10 175.20 1j8y s ASP 187 N 1.60 6.44 0.18 3.32 2.15 0.02 -0.68 116.67 129.70 1j8y s ASP 187 Ca 0.05 0.53 0.01 0.00 0.43 0.00 0.00 52.55 53.58 1j8y s ASP 187 Cb -0.16 -2.28 -0.05 0.00 -0.30 0.00 0.00 42.92 40.14 1j8y s ASP 187 CO 0.04 -0.26 0.02 0.42 -0.17 0.00 0.00 175.17 175.22 1j8y s THR 188 N 2.18 0.61 0.00 1.71 -4.23 -0.95 -0.55 115.64 114.41 1j8y s THR 188 Ca 0.21 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.74 1j8y s THR 188 Cb -0.16 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.50 1j8y s THR 188 CO 0.09 -0.40 0.00 0.00 -0.54 0.00 0.00 174.62 173.77 1j8y n ALA 189 N -0.26 0.00 0.00 3.99 0.00 -1.26 -4.26 120.51 118.72 1j8y n ALA 189 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1j8y n ALA 189 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 1j8y n ALA 189 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j8y n GLY 190 N 4.54 3.39 0.21 0.00 0.00 -1.20 -3.11 105.19 109.01 1j8y n GLY 190 Ca 0.00 -0.70 0.13 0.00 0.00 0.00 0.00 46.02 45.45 1j8y n GLY 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j8y n ARG 191 N -1.00 0.78 -4.48 1.61 5.12 -1.26 -4.17 116.66 113.26 1j8y n ARG 191 Ca 0.00 -0.42 -0.24 0.00 -1.93 0.00 0.00 57.85 55.27 1j8y n ARG 191 Cb 0.00 -1.49 -0.10 0.00 -1.16 0.00 0.00 32.46 29.71 1j8y n ARG 191 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 1j8y s HIS 192 N -2.50 2.22 0.02 -1.55 3.76 -1.26 -5.00 115.29 110.97 1j8y s HIS 192 Ca 0.25 -0.49 0.00 0.00 -0.15 0.00 0.00 55.06 54.68 1j8y s HIS 192 Cb 0.19 -1.15 0.00 0.00 1.11 0.00 0.00 32.58 32.73 1j8y s HIS 192 CO 0.51 0.55 0.01 0.41 -0.85 0.00 0.00 174.74 175.37 1j8y n GLY 193 N -0.66 3.29 3.71 -2.22 0.00 -1.26 -3.98 105.19 104.07 1j8y n GLY 193 Ca -0.05 -2.18 -0.42 0.00 0.00 0.00 0.00 46.02 43.36 1j8y n GLY 193 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1j8y s TYR 194 N -0.30 3.06 0.00 1.61 2.02 -1.26 -2.20 117.35 120.27 1j8y s TYR 194 Ca 0.01 0.69 0.00 0.00 -0.37 0.00 0.00 57.07 57.40 1j8y s TYR 194 Cb -0.00 -3.86 0.00 0.00 -0.40 0.00 0.00 41.96 37.69 1j8y s TYR 194 CO 0.01 -3.18 0.00 0.41 -1.57 0.00 0.00 175.55 171.22 1j8y n GLY 195 N 3.71 0.87 0.80 0.71 0.00 -1.26 -4.91 105.19 105.10 1j8y n GLY 195 Ca 0.13 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.21 1j8y n GLY 195 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1j8y n GLU 196 N -0.83 1.07 -0.28 1.61 1.02 -0.94 -4.89 120.64 117.41 1j8y n GLU 196 Ca 0.00 -2.81 0.08 0.00 -0.02 0.00 0.00 57.16 54.41 1j8y n GLU 196 Cb 0.00 -1.13 0.21 0.00 -0.02 0.00 0.00 31.44 30.50 1j8y n GLU 196 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1j8y h GLU 197 N 0.88 0.12 -0.32 3.49 3.07 -1.92 -1.37 114.58 118.54 1j8y h GLU 197 Ca -0.06 -0.01 0.07 0.00 -0.50 0.00 0.00 59.36 58.86 1j8y h GLU 197 Cb 1.26 -0.03 -0.07 0.00 -0.84 0.00 0.00 28.75 29.07 1j8y h GLU 197 CO 0.03 0.08 -0.18 0.00 -1.40 0.00 0.00 179.01 177.53 1j8y h ALA 198 N 1.76 0.04 -0.15 3.43 0.00 -1.96 0.54 119.26 122.92 1j8y h ALA 198 Ca 0.47 0.11 -0.11 0.00 0.00 0.00 0.00 54.91 55.38 1j8y h ALA 198 Cb 0.89 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1j8y h ALA 198 CO -0.70 -0.58 -0.41 0.00 0.00 0.00 0.00 179.25 177.57 1j8y h ALA 199 N 1.05 1.02 0.35 0.00 0.00 -1.77 -1.96 119.26 117.95 1j8y h ALA 199 Ca 0.16 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1j8y h ALA 199 Cb 0.40 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1j8y h ALA 199 CO -0.40 0.61 -0.17 1.25 0.00 0.00 0.00 179.25 180.54 1j8y h LEU 200 N 0.29 -0.39 -0.62 0.00 5.85 -0.22 -1.45 115.31 118.76 1j8y h LEU 200 Ca 0.03 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1j8y h LEU 200 Cb 0.84 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.94 1j8y h LEU 200 CO 0.07 -0.19 0.41 -0.07 -0.34 0.00 0.00 178.44 178.32 1j8y h LEU 201 N -0.58 0.71 -0.27 2.25 3.38 -0.91 -2.53 115.31 117.36 1j8y h LEU 201 Ca -0.05 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.97 1j8y h LEU 201 Cb 0.43 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 1j8y h LEU 201 CO 0.08 0.51 -0.22 -0.08 0.09 0.00 0.00 178.44 178.82 1j8y h GLU 202 N 0.84 -0.21 -0.12 1.13 4.81 -1.24 -0.31 114.58 119.48 1j8y h GLU 202 Ca 0.23 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.51 1j8y h GLU 202 Cb -0.09 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.33 1j8y h GLU 202 CO -0.05 -0.14 0.13 1.49 -0.73 0.00 0.00 179.01 179.71 1j8y h GLU 203 N -0.21 0.00 -0.34 1.92 4.81 -0.86 -2.49 114.58 117.40 1j8y h GLU 203 Ca 0.15 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.24 1j8y h GLU 203 Cb 0.44 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 1j8y h GLU 203 CO -0.39 0.00 -0.31 0.52 -0.73 0.00 0.00 179.01 178.09 1j8y h MET 204 N 0.00 0.82 -0.90 1.92 2.86 -0.67 -3.34 114.93 115.62 1j8y h MET 204 Ca 0.06 -0.42 0.24 0.00 -2.06 0.00 0.00 59.70 57.52 1j8y h MET 204 Cb 0.31 0.01 -0.15 0.00 0.06 0.00 0.00 31.60 31.82 1j8y h MET 204 CO -0.00 1.06 0.15 -0.22 1.06 0.00 0.00 176.91 178.95 1j8y h LYS 205 N 0.60 0.12 -0.34 1.72 3.64 -1.28 -1.99 116.57 119.04 1j8y h LYS 205 Ca 0.06 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1j8y h LYS 205 Cb 0.89 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.67 1j8y h LYS 205 CO 0.08 0.08 0.20 -0.91 -2.27 0.00 0.00 179.45 176.62 1j8y h ASN 206 N 0.12 0.42 -0.10 4.20 4.21 -1.74 -1.00 115.58 121.69 1j8y h ASN 206 Ca 0.56 -0.07 -0.01 0.00 1.21 0.00 0.00 56.30 57.99 1j8y h ASN 206 Cb 1.14 -0.11 -0.00 0.00 -1.12 0.00 0.00 38.32 38.23 1j8y h ASN 206 CO -0.74 0.37 0.04 0.40 -1.29 0.00 0.00 177.43 176.21 1j8y h ILE 207 N 0.44 1.14 -0.65 2.81 2.04 -1.61 -2.84 117.51 118.83 1j8y h ILE 207 Ca 0.12 -0.42 0.12 0.00 1.00 0.00 0.00 64.86 65.68 1j8y h ILE 207 Cb 0.03 1.24 -0.09 0.00 -0.74 0.00 0.00 36.82 37.27 1j8y h ILE 207 CO -0.02 0.12 0.20 0.22 0.00 0.00 0.00 178.15 178.68 1j8y h TYR 208 N 0.01 0.34 -0.70 1.37 5.03 -1.17 -1.76 116.97 120.09 1j8y h TYR 208 Ca 0.03 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.35 1j8y h TYR 208 Cb 0.16 -0.05 -0.03 0.00 1.55 0.00 0.00 36.73 38.36 1j8y h TYR 208 CO -0.02 0.03 0.33 0.93 -1.32 0.00 0.00 178.16 178.11 1j8y h GLU 209 N 0.35 1.00 -0.01 1.82 4.39 -1.07 0.47 114.58 121.53 1j8y h GLU 209 Ca 0.35 -0.14 -0.15 0.00 0.34 0.00 0.00 59.36 59.76 1j8y h GLU 209 Cb 0.50 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 1j8y h GLU 209 CO -0.39 0.78 -0.71 0.00 -1.16 0.00 0.00 179.01 177.54 1j8y h ALA 210 N 1.37 0.81 0.00 3.43 0.00 -1.11 -3.33 119.26 120.42 1j8y h ALA 210 Ca 0.24 -0.63 -0.12 0.00 0.00 0.00 0.00 54.91 54.40 1j8y h ALA 210 Cb 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1j8y h ALA 210 CO -0.03 0.85 -2.05 -0.89 0.00 0.00 0.00 179.25 177.14 1j8y n ILE 211 N -3.73 0.46 -3.86 0.00 -0.00 -0.81 -4.86 119.36 106.56 1j8y n ILE 211 Ca -0.01 -0.58 -0.39 0.00 -0.00 0.00 0.00 62.75 61.77 1j8y n ILE 211 Cb 0.69 -0.16 0.03 0.00 -0.00 0.00 0.00 39.64 40.20 1j8y n ILE 211 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 1j8y n LYS 212 N -2.37 -0.76 -1.38 0.38 4.76 0.16 -4.90 118.16 114.04 1j8y n LYS 212 Ca -0.13 0.29 -0.32 0.00 -2.87 0.00 0.00 58.31 55.27 1j8y n LYS 212 Cb 0.73 -3.37 0.08 0.00 -1.84 0.00 0.00 35.03 30.64 1j8y n LYS 212 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1j8y s PRO 213 N -6.63 2.31 0.32 1.97 0.04 -1.26 -4.94 135.00 126.81 1j8y s PRO 213 Ca 0.48 1.32 0.19 0.00 0.04 0.00 0.00 61.00 63.04 1j8y s PRO 213 Cb -0.22 -1.89 0.15 0.00 0.04 0.00 0.00 34.50 32.58 1j8y s PRO 213 CO 0.91 -1.62 1.42 -0.44 0.04 0.00 0.00 177.00 177.31 1j8y h ASP 214 N -0.75 0.00 -4.21 6.66 3.32 -1.25 -3.46 116.42 116.73 1j8y h ASP 214 Ca -0.45 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.48 1j8y h ASP 214 Cb 1.24 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.56 1j8y h ASP 214 CO 0.51 0.25 -0.25 -0.70 -1.72 0.00 0.00 179.24 177.33 1j8y s GLU 215 N -3.10 0.53 -0.13 3.56 2.12 -0.96 -4.88 118.70 115.84 1j8y s GLU 215 Ca 0.04 0.33 0.03 0.00 0.36 0.00 0.00 54.97 55.73 1j8y s GLU 215 Cb 0.07 0.25 0.01 0.00 0.26 0.00 0.00 34.13 34.72 1j8y s GLU 215 CO 0.73 -0.10 -0.21 0.08 -0.54 0.00 0.00 175.26 175.21 1j8y s VAL 216 N -0.25 1.97 -0.17 3.70 1.01 -0.68 -0.79 120.40 125.19 1j8y s VAL 216 Ca -0.04 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.01 1j8y s VAL 216 Cb -0.03 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.63 1j8y s VAL 216 CO 0.02 0.53 -0.17 -0.89 0.00 0.00 0.00 175.10 174.60 1j8y s THR 217 N 0.74 1.86 -0.16 3.92 2.01 0.58 -0.78 115.64 123.82 1j8y s THR 217 Ca -0.09 -0.87 -0.23 0.00 0.31 0.00 0.00 61.69 60.80 1j8y s THR 217 Cb -0.16 -1.74 -0.02 0.00 0.01 0.00 0.00 72.50 70.59 1j8y s THR 217 CO 0.00 0.45 0.73 -0.22 -0.69 0.00 0.00 174.62 174.89 1j8y s LEU 218 N 1.36 4.20 -0.22 4.42 2.96 -0.09 -1.09 118.68 130.22 1j8y s LEU 218 Ca 0.04 1.05 -0.12 0.00 -0.22 0.00 0.00 54.13 54.88 1j8y s LEU 218 Cb -0.14 -3.07 -0.05 0.00 0.50 0.00 0.00 46.19 43.43 1j8y s LEU 218 CO -0.11 -0.29 0.21 -0.69 -1.32 0.00 0.00 176.35 174.15 1j8y s VAL 219 N 1.74 5.33 -0.10 1.68 1.01 -0.19 -1.40 120.40 128.47 1j8y s VAL 219 Ca 0.35 0.32 0.03 0.00 0.00 0.00 0.00 61.98 62.67 1j8y s VAL 219 Cb -0.17 -3.55 0.01 0.00 0.00 0.00 0.00 36.38 32.67 1j8y s VAL 219 CO 0.13 0.35 -0.18 -0.63 0.00 0.00 0.00 175.10 174.76 1j8y s ILE 220 N 0.92 1.68 -0.12 2.22 1.01 0.04 -4.53 121.20 122.43 1j8y s ILE 220 Ca 0.11 -0.78 -0.29 0.00 0.00 0.00 0.00 60.65 59.69 1j8y s ILE 220 Cb -0.13 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 40.82 1j8y s ILE 220 CO 0.04 0.48 1.13 -0.62 0.00 0.00 0.00 174.94 175.96 1j8y s ASP 221 N 0.72 7.09 0.63 3.58 3.68 -1.26 -0.41 116.67 130.70 1j8y s ASP 221 Ca -0.12 1.63 0.27 0.00 2.13 0.00 0.00 52.55 56.46 1j8y s ASP 221 Cb -0.16 -2.55 1.44 0.00 -1.45 0.00 0.00 42.92 40.20 1j8y s ASP 221 CO 0.02 -0.60 1.83 0.00 0.13 0.00 0.00 175.17 176.56 1j8y h ALA 222 N 7.50 1.76 0.00 3.66 0.00 -1.12 -1.84 119.26 129.21 1j8y h ALA 222 Ca -0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1j8y h ALA 222 Cb 1.13 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1j8y h ALA 222 CO 0.91 -0.57 0.00 0.66 0.00 0.00 0.00 179.25 180.25 1j8y h SER 223 N 0.00 0.00 1.20 0.00 4.64 -1.82 -2.13 113.55 115.44 1j8y h SER 223 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1j8y h SER 223 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1j8y h SER 223 CO -0.00 0.00 0.00 -0.29 -0.87 0.00 0.00 176.83 175.67 1j8y h ILE 224 N 0.00 0.00 0.00 0.95 6.09 -1.67 -3.47 117.51 119.41 1j8y h ILE 224 Ca 0.00 -0.59 0.00 0.00 -1.37 0.00 0.00 64.86 62.90 1j8y h ILE 224 Cb 0.25 1.57 0.00 0.00 0.47 0.00 0.00 36.82 39.11 1j8y h ILE 224 CO 0.00 0.00 0.00 0.61 -3.07 0.00 0.00 178.15 175.69 1j8y n GLY 225 N 0.27 2.38 0.11 8.18 0.00 -0.80 -2.59 105.19 112.73 1j8y n GLY 225 Ca 0.01 -0.43 0.09 0.00 0.00 0.00 0.00 46.02 45.70 1j8y n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j8y n GLN 226 N 9.65 0.13 0.00 1.61 10.64 -1.23 -2.22 117.38 135.96 1j8y n GLN 226 Ca 0.00 0.50 0.07 0.00 -1.83 0.00 0.00 57.00 55.73 1j8y n GLN 226 Cb 0.00 -1.82 0.33 0.00 -0.86 0.00 0.00 30.24 27.90 1j8y n GLN 226 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1j8y n LYS 227 N -2.07 0.10 0.16 2.61 5.02 -1.07 -2.00 118.16 120.92 1j8y n LYS 227 Ca 0.01 0.20 0.13 0.00 -2.02 0.00 0.00 58.31 56.63 1j8y n LYS 227 Cb 0.12 -1.50 0.49 0.00 -0.02 0.00 0.00 35.03 34.12 1j8y n LYS 227 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j8y h ALA 228 N 2.59 1.00 -0.22 7.82 0.00 -1.62 -3.35 119.26 125.48 1j8y h ALA 228 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1j8y h ALA 228 Cb 0.19 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 1j8y h ALA 228 CO 0.00 0.00 -0.49 -0.92 0.00 0.00 0.00 179.25 177.84 1j8y h TYR 229 N 0.00 -1.47 -0.29 0.00 3.20 -1.65 -1.51 116.97 115.25 1j8y h TYR 229 Ca 0.00 0.06 0.07 0.00 3.14 0.00 0.00 58.73 62.00 1j8y h TYR 229 Cb 0.52 0.67 -0.08 0.00 1.54 0.00 0.00 36.73 39.38 1j8y h TYR 229 CO 0.00 -0.46 -0.28 -0.44 -1.64 0.00 0.00 178.16 175.34 1j8y h ASP 230 N -0.45 -0.91 -0.24 -2.11 3.45 -1.84 0.12 116.42 114.45 1j8y h ASP 230 Ca 0.04 0.16 -0.01 0.00 0.43 0.00 0.00 57.03 57.65 1j8y h ASP 230 Cb 0.57 0.42 -0.01 0.00 -0.56 0.00 0.00 39.33 39.75 1j8y h ASP 230 CO -0.44 -0.30 0.10 0.25 -1.57 0.00 0.00 179.24 177.28 1j8y h LEU 231 N -0.26 0.32 -0.78 1.55 5.85 -1.78 -2.13 115.31 118.08 1j8y h LEU 231 Ca 0.15 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1j8y h LEU 231 Cb 0.50 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 1j8y h LEU 231 CO -0.44 0.38 0.51 0.00 -0.34 0.00 0.00 178.44 178.55 1j8y h ALA 232 N 0.95 0.99 0.55 1.25 0.00 -0.93 0.13 119.26 122.20 1j8y h ALA 232 Ca 0.08 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1j8y h ALA 232 Cb 0.15 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1j8y h ALA 232 CO -0.01 0.39 -0.30 1.03 0.00 0.00 0.00 179.25 180.37 1j8y h SER 233 N 1.05 -0.73 -0.50 0.00 0.87 -0.59 -0.71 113.55 112.94 1j8y h SER 233 Ca 0.29 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.83 1j8y h SER 233 Cb -0.11 0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.02 1j8y h SER 233 CO -0.06 -0.49 0.15 0.11 -0.53 0.00 0.00 176.83 176.00 1j8y h LYS 234 N -0.79 0.83 0.20 2.24 1.79 -1.25 -2.64 116.57 116.95 1j8y h LYS 234 Ca -0.07 -0.16 -0.01 0.00 -2.18 0.00 0.00 60.65 58.23 1j8y h LYS 234 Cb 0.62 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 1j8y h LYS 234 CO 0.10 0.74 -0.10 0.35 -1.08 0.00 0.00 179.45 179.46 1j8y h PHE 235 N 0.81 -0.25 -0.18 -1.35 3.57 -0.55 -1.87 116.94 117.12 1j8y h PHE 235 Ca 0.18 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 1j8y h PHE 235 Cb 0.27 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1j8y h PHE 235 CO 0.02 -0.08 0.05 -0.97 -2.23 0.00 0.00 178.31 175.10 1j8y h ASN 236 N -0.37 0.22 0.86 0.41 -1.24 -1.02 -1.48 115.58 112.96 1j8y h ASN 236 Ca -0.03 -0.02 -0.17 0.00 0.71 0.00 0.00 56.30 56.79 1j8y h ASN 236 Cb 0.29 -0.06 -0.02 0.00 0.73 0.00 0.00 38.32 39.26 1j8y h ASN 236 CO 0.05 0.22 -0.83 1.56 -1.29 0.00 0.00 177.43 177.14 1j8y h GLN 237 N 0.25 0.00 0.00 6.67 4.20 -1.37 -3.29 115.11 121.56 1j8y h GLN 237 Ca 0.06 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 1j8y h GLN 237 Cb 0.08 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 1j8y h GLN 237 CO -0.00 0.83 -0.02 0.00 -0.67 0.00 0.00 178.83 178.96 1j8y h ALA 238 N 1.17 1.24 -2.66 3.87 0.00 -0.40 -3.45 119.26 119.03 1j8y h ALA 238 Ca -0.01 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1j8y h ALA 238 Cb 1.48 -0.00 -0.15 0.00 0.00 0.00 0.00 17.79 19.12 1j8y h ALA 238 CO 0.11 0.03 0.01 -1.54 0.00 0.00 0.00 179.25 177.85 1j8y s SER 239 N -5.72 -0.37 0.00 0.00 1.04 -1.22 -5.02 113.70 102.40 1j8y s SER 239 Ca -0.04 -0.04 0.26 0.00 0.48 0.00 0.00 55.95 56.61 1j8y s SER 239 Cb 0.14 0.49 0.67 0.00 0.10 0.00 0.00 66.02 67.42 1j8y s SER 239 CO 0.50 -0.79 1.52 1.17 0.98 0.00 0.00 173.24 176.62 1j8y n LYS 240 N 0.09 0.24 -0.68 4.02 4.81 -1.26 -3.97 118.16 121.42 1j8y n LYS 240 Ca -0.17 -0.13 -0.00 0.00 -0.87 0.00 0.00 58.31 57.13 1j8y n LYS 240 Cb 0.62 -1.50 0.21 0.00 0.02 0.00 0.00 35.03 34.38 1j8y n LYS 240 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 1j8y n ILE 241 N -1.26 2.44 -3.56 3.15 -5.35 -1.26 -5.02 119.36 108.49 1j8y n ILE 241 Ca 0.08 -2.61 -0.38 0.00 -0.27 0.00 0.00 62.75 59.57 1j8y n ILE 241 Cb 0.33 -0.30 -0.06 0.00 -1.74 0.00 0.00 39.64 37.88 1j8y n ILE 241 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1j8y s GLY 242 N -2.52 2.42 0.18 3.28 0.00 -1.25 -1.68 107.32 107.75 1j8y s GLY 242 Ca 0.43 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.85 1j8y s GLY 242 CO 0.01 0.07 0.05 -0.51 0.00 0.00 0.00 173.10 172.73 1j8y s THR 243 N -1.00 0.38 0.04 0.90 -4.23 0.04 -4.61 115.64 107.16 1j8y s THR 243 Ca 0.22 -1.96 0.05 0.00 -1.18 0.00 0.00 61.69 58.81 1j8y s THR 243 Cb -0.16 -2.24 -0.02 0.00 1.34 0.00 0.00 72.50 71.43 1j8y s THR 243 CO 0.11 -0.33 -0.14 -0.63 -0.54 0.00 0.00 174.62 173.10 1j8y s ILE 244 N -3.87 1.07 -0.09 2.99 1.01 0.12 -0.91 121.20 121.51 1j8y s ILE 244 Ca 0.28 -0.98 0.03 0.00 0.00 0.00 0.00 60.65 59.98 1j8y s ILE 244 Cb 0.07 -0.97 0.01 0.00 0.01 0.00 0.00 42.46 41.58 1j8y s ILE 244 CO 0.06 -0.01 -0.18 -0.63 0.00 0.00 0.00 174.94 174.19 1j8y s ILE 245 N -0.85 1.62 -0.26 2.92 1.01 -0.49 -1.29 121.20 123.86 1j8y s ILE 245 Ca 0.01 -0.75 -0.08 0.00 0.00 0.00 0.00 60.65 59.83 1j8y s ILE 245 Cb -0.08 -1.44 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 1j8y s ILE 245 CO 0.01 0.46 0.11 -0.63 0.00 0.00 0.00 174.94 174.89 1j8y s ILE 246 N 0.64 4.55 0.42 2.92 -1.09 -1.03 -0.78 121.20 126.83 1j8y s ILE 246 Ca -0.14 -0.14 0.08 0.00 -2.23 0.00 0.00 60.65 58.22 1j8y s ILE 246 Cb -0.16 -3.16 -0.01 0.00 -1.58 0.00 0.00 42.46 37.54 1j8y s ILE 246 CO 0.04 0.28 0.46 0.42 -1.23 0.00 0.00 174.94 174.91 1j8y s THR 247 N 1.64 2.79 -1.49 2.92 -4.23 0.45 0.71 115.64 118.42 1j8y s THR 247 Ca 0.06 -1.21 -0.06 0.00 -1.18 0.00 0.00 61.69 59.31 1j8y s THR 247 Cb -0.16 -2.99 0.05 0.00 1.34 0.00 0.00 72.50 70.74 1j8y s THR 247 CO 0.05 0.00 0.57 0.29 -0.54 0.00 0.00 174.62 175.00 1j8y n LYS 248 N -1.67 -3.50 0.26 3.99 5.02 -0.91 -0.68 118.16 120.68 1j8y n LYS 248 Ca 0.05 0.42 0.12 0.00 -2.02 0.00 0.00 58.31 56.88 1j8y n LYS 248 Cb 0.61 -4.78 0.73 0.00 -0.02 0.00 0.00 35.03 31.57 1j8y n LYS 248 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1j8y h MET 249 N -1.77 0.00 -0.00 1.97 2.86 -1.46 -2.68 114.93 113.85 1j8y h MET 249 Ca -0.62 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.02 1j8y h MET 249 Cb 1.38 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.04 1j8y h MET 249 CO 0.67 0.11 -0.61 -0.25 1.06 0.00 0.00 176.91 177.89 1j8y n ASP 250 N -3.73 0.89 -1.33 1.22 10.43 -1.24 -4.09 116.55 118.69 1j8y n ASP 250 Ca -0.02 -0.70 0.06 0.00 2.57 0.00 0.00 54.79 56.70 1j8y n ASP 250 Cb 0.22 0.48 0.27 0.00 1.84 0.00 0.00 41.12 43.94 1j8y n ASP 250 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1j8y n GLY 251 N 1.47 2.21 3.41 0.44 0.00 -1.01 -4.92 105.19 106.79 1j8y n GLY 251 Ca 0.06 -0.64 -0.10 0.00 0.00 0.00 0.00 46.02 45.34 1j8y n GLY 251 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j8y s THR 252 N -1.94 0.04 -2.75 2.61 -4.23 -1.26 -4.96 115.64 103.16 1j8y s THR 252 Ca 0.38 -0.60 0.22 0.00 -1.18 0.00 0.00 61.69 60.52 1j8y s THR 252 Cb 0.26 -1.33 0.17 0.00 1.34 0.00 0.00 72.50 72.94 1j8y s THR 252 CO 0.16 -0.19 1.20 0.00 -0.54 0.00 0.00 174.62 175.25 1j8y n ALA 253 N -0.29 2.53 -0.47 3.99 0.00 -1.26 -4.34 120.51 120.66 1j8y n ALA 253 Ca -0.14 -0.67 0.10 0.00 0.00 0.00 0.00 53.44 52.73 1j8y n ALA 253 Cb 0.63 -0.76 0.34 0.00 0.00 0.00 0.00 19.45 19.67 1j8y n ALA 253 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1j8y n LYS 254 N 1.18 3.28 -0.33 0.00 5.02 -1.26 -4.24 118.16 121.80 1j8y n LYS 254 Ca 0.13 -2.75 0.04 0.00 -2.02 0.00 0.00 58.31 53.71 1j8y n LYS 254 Cb 0.55 -1.75 0.23 0.00 -0.02 0.00 0.00 35.03 34.03 1j8y n LYS 254 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1j8y h GLY 255 N 4.31 1.41 1.31 0.72 0.00 -1.76 -1.18 103.07 107.89 1j8y h GLY 255 Ca 0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 1j8y h GLY 255 CO 0.13 0.29 0.32 -1.33 0.00 0.00 0.00 176.54 175.95 1j8y h GLY 256 N 1.06 0.97 1.04 4.60 0.00 -1.79 -0.50 103.07 108.45 1j8y h GLY 256 Ca 0.42 -0.45 -0.12 0.00 0.00 0.00 0.00 47.33 47.18 1j8y h GLY 256 CO -0.17 0.43 -0.23 -1.33 0.00 0.00 0.00 176.54 175.24 1j8y h GLY 257 N 0.98 0.92 0.84 4.60 0.00 0.22 -1.30 103.07 109.33 1j8y h GLY 257 Ca 0.23 -0.86 -0.02 0.00 0.00 0.00 0.00 47.33 46.67 1j8y h GLY 257 CO -0.03 0.78 0.04 0.00 0.00 0.00 0.00 176.54 177.32 1j8y h ALA 258 N 0.80 0.27 -0.08 3.60 0.00 -0.94 -0.33 119.26 122.58 1j8y h ALA 258 Ca 0.08 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1j8y h ALA 258 Cb 0.80 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1j8y h ALA 258 CO 0.07 -0.07 0.04 -0.07 0.00 0.00 0.00 179.25 179.21 1j8y h LEU 259 N 0.13 0.11 -1.04 0.00 4.07 -1.09 -0.74 115.31 116.75 1j8y h LEU 259 Ca 0.06 -0.14 -0.06 0.00 0.08 0.00 0.00 57.88 57.82 1j8y h LEU 259 Cb 0.30 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 41.99 1j8y h LEU 259 CO 0.00 0.22 0.04 0.77 -1.08 0.00 0.00 178.44 178.39 1j8y h SER 260 N -0.01 0.68 -0.32 -0.43 4.64 -1.24 0.24 113.55 117.11 1j8y h SER 260 Ca 0.03 -0.14 -0.06 0.00 -0.47 0.00 0.00 61.79 61.15 1j8y h SER 260 Cb 0.14 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 1j8y h SER 260 CO -0.00 0.73 -0.03 0.00 -0.87 0.00 0.00 176.83 176.65 1j8y h ALA 261 N 1.36 0.44 -0.40 5.18 0.00 -0.87 -1.30 119.26 123.67 1j8y h ALA 261 Ca 0.14 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1j8y h ALA 261 Cb 0.37 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1j8y h ALA 261 CO 0.01 0.23 -0.20 0.28 0.00 0.00 0.00 179.25 179.56 1j8y h VAL 262 N 0.38 1.28 -0.21 0.00 2.07 -0.83 -2.83 116.25 116.11 1j8y h VAL 262 Ca 0.09 -1.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.26 1j8y h VAL 262 Cb 0.50 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1j8y h VAL 262 CO 0.02 0.45 0.10 0.00 0.02 0.00 0.00 177.57 178.16 1j8y h ALA 263 N 0.81 1.78 0.00 1.67 0.00 -0.43 -1.34 119.26 121.76 1j8y h ALA 263 Ca 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1j8y h ALA 263 Cb 0.76 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1j8y h ALA 263 CO 0.06 0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.49 1j8y h ALA 264 N 1.82 1.00 -0.00 0.00 0.00 -0.97 -0.65 119.26 120.46 1j8y h ALA 264 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1j8y h ALA 264 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1j8y h ALA 264 CO -0.01 0.00 -0.60 0.25 0.00 0.00 0.00 179.25 178.89 1j8y n THR 265 N -2.40 0.00 -0.94 0.00 -2.24 -0.51 -4.95 114.28 103.24 1j8y n THR 265 Ca 0.00 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1j8y n THR 265 Cb 0.15 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 1j8y n THR 265 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j8y n GLY 266 N 1.46 0.67 3.73 3.38 0.00 -0.25 -4.98 105.19 109.19 1j8y n GLY 266 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 1j8y n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j8y s ALA 267 N -2.85 2.08 -0.46 4.61 0.00 -1.25 -4.96 121.76 118.93 1j8y s ALA 267 Ca 0.00 0.67 -0.23 0.00 0.00 0.00 0.00 51.96 52.39 1j8y s ALA 267 Cb 0.00 -3.41 0.03 0.00 0.00 0.00 0.00 23.12 19.74 1j8y s ALA 267 CO 0.00 -1.92 0.80 0.99 0.00 0.00 0.00 175.76 175.64 1j8y s THR 268 N -2.32 4.62 -0.53 0.00 2.01 -1.26 -4.80 115.64 113.35 1j8y s THR 268 Ca 0.69 0.41 -0.21 0.00 0.31 0.00 0.00 61.69 62.90 1j8y s THR 268 Cb -0.24 -4.35 0.05 0.00 0.01 0.00 0.00 72.50 67.97 1j8y s THR 268 CO 0.49 -0.76 0.76 -0.63 -0.69 0.00 0.00 174.62 173.78 1j8y s ILE 269 N 3.36 4.66 -0.03 1.82 1.01 -1.26 -0.70 121.20 130.06 1j8y s ILE 269 Ca 0.30 -0.18 -0.17 0.00 0.00 0.00 0.00 60.65 60.60 1j8y s ILE 269 Cb -0.12 -4.41 -0.32 0.00 0.01 0.00 0.00 42.46 37.62 1j8y s ILE 269 CO 0.22 -0.95 0.84 0.50 0.00 0.00 0.00 174.94 175.55 1j8y h LYS 270 N 9.14 0.39 -4.88 2.79 3.64 -1.49 -3.41 116.57 122.74 1j8y h LYS 270 Ca -0.27 -0.67 -0.28 0.00 -1.27 0.00 0.00 60.65 58.16 1j8y h LYS 270 Cb 1.09 0.25 -0.15 0.00 -0.41 0.00 0.00 32.23 33.00 1j8y h LYS 270 CO 1.02 1.32 -0.71 -0.06 -2.27 0.00 0.00 179.45 178.75 1j8y s PHE 271 N -2.52 1.08 -0.04 1.91 0.08 -1.25 -0.85 117.98 116.40 1j8y s PHE 271 Ca -0.13 -0.80 0.03 0.00 0.12 0.00 0.00 56.93 56.14 1j8y s PHE 271 Cb 0.03 -0.58 0.01 0.00 -0.57 0.00 0.00 43.02 41.91 1j8y s PHE 271 CO 0.86 -0.02 -0.11 -1.50 -0.10 0.00 0.00 175.22 174.35 1j8y s ILE 272 N -3.31 1.00 -0.31 0.64 2.07 -0.40 -2.46 121.20 118.43 1j8y s ILE 272 Ca 0.13 -0.45 -0.17 0.00 -1.41 0.00 0.00 60.65 58.75 1j8y s ILE 272 Cb 0.03 -0.89 -0.02 0.00 0.13 0.00 0.00 42.46 41.71 1j8y s ILE 272 CO -0.02 0.31 0.46 -0.83 -1.91 0.00 0.00 174.94 172.95 1j8y s GLY 273 N 0.31 1.85 0.00 1.50 0.00 0.22 -1.72 107.32 109.48 1j8y s GLY 273 Ca -0.06 -0.90 0.00 0.00 0.00 0.00 0.00 44.72 43.76 1j8y s GLY 273 CO 0.02 1.15 0.00 -1.30 0.00 0.00 0.00 173.10 172.96 1j8y n THR 274 N 5.26 0.00 -3.14 0.90 -2.24 -0.99 -1.68 114.28 112.40 1j8y n THR 274 Ca -0.06 0.34 -0.03 0.00 -2.27 0.00 0.00 64.05 62.03 1j8y n THR 274 Cb 0.50 -1.18 0.01 0.00 -2.10 0.00 0.00 70.33 67.55 1j8y n THR 274 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j8y n GLY 275 N 1.99 2.20 0.21 3.38 0.00 -1.26 -3.66 105.19 108.06 1j8y n GLY 275 Ca 0.00 -2.15 0.13 0.00 0.00 0.00 0.00 46.02 44.00 1j8y n GLY 275 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1j8y n GLU 276 N -1.04 0.75 -2.53 1.61 1.02 -1.26 -4.77 120.64 114.42 1j8y n GLU 276 Ca 0.02 -0.43 -0.37 0.00 -0.02 0.00 0.00 57.16 56.36 1j8y n GLU 276 Cb 0.08 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 29.97 1j8y n GLU 276 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1j8y s LYS 277 N -2.55 4.15 0.56 3.49 1.02 -1.26 -4.93 119.74 120.22 1j8y s LYS 277 Ca 0.23 1.53 0.28 0.00 0.02 0.00 0.00 55.97 58.03 1j8y s LYS 277 Cb 0.19 -2.54 1.47 0.00 -0.52 0.00 0.00 37.83 36.43 1j8y s LYS 277 CO 0.53 -0.16 1.94 0.97 -0.92 0.00 0.00 175.35 177.71 1j8y h ILE 278 N 2.19 0.52 -0.26 2.17 6.09 -1.97 0.44 117.51 126.68 1j8y h ILE 278 Ca -0.48 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.01 1j8y h ILE 278 Cb 1.22 0.65 0.00 0.00 0.47 0.00 0.00 36.82 39.15 1j8y h ILE 278 CO 0.62 0.00 0.00 -0.90 -3.07 0.00 0.00 178.15 174.80 1j8y n ASP 279 N -4.04 2.72 -3.72 2.19 5.75 -1.26 -4.54 116.55 113.66 1j8y n ASP 279 Ca 0.11 -1.88 -0.42 0.00 -0.01 0.00 0.00 54.79 52.59 1j8y n ASP 279 Cb 0.70 -0.16 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 1j8y n ASP 279 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1j8y n GLU 280 N 1.03 3.90 -3.73 0.11 1.02 0.14 -4.80 120.64 118.32 1j8y n GLU 280 Ca 0.18 -3.43 -0.18 0.00 -0.02 0.00 0.00 57.16 53.71 1j8y n GLU 280 Cb 0.50 -2.84 -0.17 0.00 -0.02 0.00 0.00 31.44 28.91 1j8y n GLU 280 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1j8y s LEU 281 N -0.68 0.60 0.07 -4.62 2.96 -1.26 -2.34 118.68 113.41 1j8y s LEU 281 Ca 0.45 0.05 0.07 0.00 -0.22 0.00 0.00 54.13 54.49 1j8y s LEU 281 Cb 0.13 -0.12 -0.03 0.00 0.50 0.00 0.00 46.19 46.67 1j8y s LEU 281 CO -0.03 -0.19 -0.19 -1.61 -1.32 0.00 0.00 176.35 173.01 1j8y s GLU 282 N 1.64 1.10 0.14 1.98 2.02 -0.70 -4.97 118.70 119.92 1j8y s GLU 282 Ca -0.02 -1.00 -0.31 0.00 0.02 0.00 0.00 54.97 53.66 1j8y s GLU 282 Cb -0.13 -1.25 -0.08 0.00 0.10 0.00 0.00 34.13 32.78 1j8y s GLU 282 CO -0.03 0.30 1.39 0.08 0.02 0.00 0.00 175.26 177.01 1j8y s VAL 283 N -1.04 3.21 -0.20 2.63 1.01 -1.26 -1.28 120.40 123.48 1j8y s VAL 283 Ca 0.04 0.90 -0.10 0.00 0.00 0.00 0.00 61.98 62.82 1j8y s VAL 283 Cb -0.09 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.66 1j8y s VAL 283 CO 0.03 0.09 0.13 0.12 0.00 0.00 0.00 175.10 175.47 1j8y s PHE 284 N 0.84 3.41 -0.17 5.22 5.36 -0.03 -4.87 117.98 127.75 1j8y s PHE 284 Ca 0.63 0.34 -0.04 0.00 -0.96 0.00 0.00 56.93 56.89 1j8y s PHE 284 Cb -0.37 -2.16 0.07 0.00 -0.34 0.00 0.00 43.02 40.22 1j8y s PHE 284 CO 0.33 0.30 0.17 1.21 -1.46 0.00 0.00 175.22 175.77 1j8y s ASN 285 N 0.34 1.51 0.32 6.13 3.04 -1.26 -4.39 114.94 120.63 1j8y s ASN 285 Ca 0.08 -0.22 0.10 0.00 0.04 0.00 0.00 52.86 52.87 1j8y s ASN 285 Cb -0.11 0.19 0.97 0.00 -1.54 0.00 0.00 41.25 40.76 1j8y s ASN 285 CO -0.02 -0.32 1.64 -0.65 -3.04 0.00 0.00 177.10 174.71 1j8y h PRO 286 N 8.35 0.21 -0.41 0.43 0.11 -1.79 0.19 132.00 139.09 1j8y h PRO 286 Ca -0.16 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.93 1j8y h PRO 286 Cb 1.14 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1j8y h PRO 286 CO 0.26 0.14 0.21 -0.09 -0.21 0.00 0.00 178.00 178.31 1j8y h ARG 287 N 0.22 0.58 -0.14 1.05 2.43 -1.85 -0.54 114.38 116.14 1j8y h ARG 287 Ca 0.68 -0.08 -0.16 0.00 -0.81 0.00 0.00 59.98 59.61 1j8y h ARG 287 Cb 1.52 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.96 1j8y h ARG 287 CO -0.67 0.49 -0.59 0.00 -1.51 0.00 0.00 179.97 177.69 1j8y h ARG 288 N 0.53 0.44 -0.48 0.20 3.08 -1.24 -0.41 114.38 116.51 1j8y h ARG 288 Ca 0.14 -0.30 0.00 0.00 0.07 0.00 0.00 59.98 59.90 1j8y h ARG 288 Cb 0.09 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1j8y h ARG 288 CO -0.02 0.91 0.31 0.35 -1.07 0.00 0.00 179.97 180.45 1j8y h PHE 289 N 0.33 0.60 0.00 3.04 3.57 -0.48 -2.46 116.94 121.55 1j8y h PHE 289 Ca -0.00 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.39 1j8y h PHE 289 Cb 1.12 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 1j8y h PHE 289 CO 0.04 0.39 -0.57 0.28 -2.23 0.00 0.00 178.31 176.22 1j8y h VAL 290 N 0.64 1.16 0.00 1.41 2.07 -0.99 -3.23 116.25 117.31 1j8y h VAL 290 Ca 0.17 -2.13 -0.03 0.00 0.82 0.00 0.00 66.70 65.53 1j8y h VAL 290 Cb -0.07 2.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1j8y h VAL 290 CO -0.04 0.56 -0.16 0.00 0.02 0.00 0.00 177.57 177.94 1j8y h ALA 291 N 1.43 1.17 -0.99 1.67 0.00 -0.59 -3.22 119.26 118.73 1j8y h ALA 291 Ca -0.01 -0.15 0.21 0.00 0.00 0.00 0.00 54.91 54.96 1j8y h ALA 291 Cb 1.19 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.86 1j8y h ALA 291 CO 0.07 0.20 0.62 -0.09 0.00 0.00 0.00 179.25 180.06 1j8y h ARG 292 N 0.00 0.61 -0.55 0.00 2.43 -1.53 -1.49 114.38 113.85 1j8y h ARG 292 Ca -0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1j8y h ARG 292 Cb 0.50 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1j8y h ARG 292 CO 0.02 0.40 0.00 1.47 -1.51 0.00 0.00 179.97 180.36 1j8y n LEU 293 N -4.70 3.01 -4.64 3.80 -0.00 -1.22 -4.98 117.00 108.28 1j8y n LEU 293 Ca 0.23 -1.51 -0.47 0.00 -0.00 0.00 0.00 56.01 54.25 1j8y n LEU 293 Cb 0.65 -0.40 -0.04 0.00 -0.00 0.00 0.00 43.42 43.63 1j8y n LEU 293 CO 0.24 0.62 1.01 1.57 -0.00 0.00 0.00 177.39 180.83 1j8y n HIS 294 N 0.82 1.93 0.30 1.47 -0.00 -0.56 -4.83 115.22 114.34 1j8y n HIS 294 Ca 0.17 0.46 0.08 0.00 0.46 0.00 0.00 57.72 58.89 1j8y n HIS 294 Cb 0.53 -2.43 0.37 0.00 -0.12 0.00 0.00 29.99 28.33 1j8y n HIS 294 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 1j8y n HIS 295 N 2.52 0.41 -0.31 1.57 1.44 -1.26 -3.13 115.22 116.46 1j8y n HIS 295 Ca 0.16 0.18 0.07 0.00 -2.01 0.00 0.00 57.72 56.11 1j8y n HIS 295 Cb 0.27 -0.79 0.30 0.00 0.12 0.00 0.00 29.99 29.89 1j8y n HIS 295 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1j8y n HIS 296 N -1.89 1.39 -0.84 -1.40 8.25 -1.26 -5.16 115.22 114.32 1j8y n HIS 296 Ca 0.01 -0.52 0.00 0.00 -0.26 0.00 0.00 57.72 56.95 1j8y n HIS 296 Cb 0.13 -0.30 0.00 0.00 1.12 0.00 0.00 29.99 30.94 1j8y n HIS 296 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59