#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j8m h LEU 4 N 0.00 0.97 -1.54 -1.96 3.38 -1.99 0.27 115.31 114.44 1j8m h LEU 4 Ca 0.00 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.51 1j8m h LEU 4 Cb 0.00 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1j8m h LEU 4 CO 0.00 1.20 -0.24 0.44 0.09 0.00 0.00 178.44 179.93 1j8m h ASP 5 N 0.77 0.00 0.53 -0.43 3.32 -2.00 0.13 116.42 118.74 1j8m h ASP 5 Ca 0.08 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.84 1j8m h ASP 5 Cb 0.90 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.46 1j8m h ASP 5 CO 0.08 0.24 -1.37 0.78 -1.72 0.00 0.00 179.24 177.26 1j8m h ASN 6 N 0.00 0.46 0.32 6.45 2.35 -1.93 -2.98 115.58 120.25 1j8m h ASN 6 Ca -0.00 -0.54 -0.04 0.00 -0.55 0.00 0.00 56.30 55.17 1j8m h ASN 6 Cb 0.46 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 1j8m h ASN 6 CO 0.03 1.43 -0.20 -0.07 -1.65 0.00 0.00 177.43 176.97 1j8m h LEU 7 N 0.08 0.00 -0.47 1.61 3.38 0.47 -2.59 115.31 117.80 1j8m h LEU 7 Ca -0.18 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1j8m h LEU 7 Cb 2.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.74 1j8m h LEU 7 CO 0.20 0.20 0.26 -0.09 0.09 0.00 0.00 178.44 179.09 1j8m h ARG 8 N 0.00 0.65 -0.25 1.13 2.43 -0.84 -0.46 114.38 117.03 1j8m h ARG 8 Ca -0.00 -0.08 -0.11 0.00 -0.81 0.00 0.00 59.98 58.98 1j8m h ARG 8 Cb 0.41 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1j8m h ARG 8 CO 0.03 0.51 -0.33 -0.44 -1.51 0.00 0.00 179.97 178.23 1j8m h ASP 9 N 0.61 0.54 -0.38 -3.80 3.32 -1.53 -1.42 116.42 113.76 1j8m h ASP 9 Ca 0.16 -0.21 -0.06 0.00 0.02 0.00 0.00 57.03 56.94 1j8m h ASP 9 Cb 0.05 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1j8m h ASP 9 CO -0.03 0.83 -0.00 0.74 -1.72 0.00 0.00 179.24 179.06 1j8m h THR 10 N 0.45 1.26 -0.22 0.35 2.02 -1.24 -0.84 112.91 114.68 1j8m h THR 10 Ca 0.05 -1.00 0.03 0.00 0.77 0.00 0.00 66.41 66.26 1j8m h THR 10 Cb 0.79 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 68.31 1j8m h THR 10 CO 0.06 0.34 0.01 0.58 0.37 0.00 0.00 175.52 176.88 1j8m h VAL 11 N 0.50 0.86 -0.73 3.16 2.07 -0.88 -1.07 116.25 120.17 1j8m h VAL 11 Ca 0.11 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.66 1j8m h VAL 11 Cb 0.47 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 30.95 1j8m h VAL 11 CO 0.02 0.02 0.42 -0.09 0.02 0.00 0.00 177.57 177.96 1j8m h ARG 12 N 0.08 0.74 -0.41 1.57 2.43 -0.98 0.18 114.38 118.00 1j8m h ARG 12 Ca 0.10 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.12 1j8m h ARG 12 Cb 0.12 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1j8m h ARG 12 CO -0.16 0.49 -0.20 0.87 -1.51 0.00 0.00 179.97 179.46 1j8m h LYS 13 N 0.77 0.80 -0.24 0.20 1.57 -0.78 -1.87 116.57 117.02 1j8m h LYS 13 Ca 0.33 -0.31 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1j8m h LYS 13 Cb 0.20 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1j8m h LYS 13 CO -0.18 0.93 0.03 0.35 -0.57 0.00 0.00 179.45 180.01 1j8m h PHE 14 N 0.70 0.43 0.00 -1.35 3.57 -0.47 -3.26 116.94 116.56 1j8m h PHE 14 Ca 0.10 -0.06 -0.12 0.00 3.53 0.00 0.00 57.97 61.42 1j8m h PHE 14 Cb 0.71 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1j8m h PHE 14 CO 0.04 0.53 -0.55 -0.07 -2.23 0.00 0.00 178.31 176.03 1j8m h LEU 15 N 0.21 0.00 -6.78 0.59 3.38 -0.40 -3.32 115.31 108.98 1j8m h LEU 15 Ca 0.07 0.00 -0.75 0.00 0.09 0.00 0.00 57.88 57.29 1j8m h LEU 15 Cb 0.34 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.93 1j8m h LEU 15 CO 0.01 0.55 1.85 0.35 0.09 0.00 0.00 178.44 181.29 1j8m n THR 16 N -3.68 4.33 0.00 0.22 -2.24 -0.73 -4.88 114.28 107.30 1j8m n THR 16 Ca -0.01 -4.49 0.00 0.00 -2.27 0.00 0.00 64.05 57.28 1j8m n THR 16 Cb 0.60 -2.38 0.00 0.00 -2.10 0.00 0.00 70.33 66.44 1j8m n THR 16 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j8m n GLY 17 N 3.13 0.00 0.00 3.38 0.00 -1.25 -4.91 105.19 105.54 1j8m n GLY 17 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 1j8m n GLY 17 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1j8m n SER 18 N 0.00 0.00 -1.77 1.61 2.88 -1.26 -4.90 113.62 110.18 1j8m n SER 18 Ca 0.00 0.13 0.00 0.00 -1.33 0.00 0.00 58.87 57.67 1j8m n SER 18 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1j8m n SER 18 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1j8m n SER 19 N -0.29 0.00 -4.66 -3.46 3.41 -1.26 -5.05 113.62 102.31 1j8m n SER 19 Ca 0.00 -0.46 -0.32 0.00 -0.26 0.00 0.00 58.87 57.83 1j8m n SER 19 Cb 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.10 1j8m n SER 19 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1j8m n SER 20 N -1.38 0.42 0.17 4.04 3.41 -1.26 -4.78 113.62 114.23 1j8m n SER 20 Ca 0.00 0.49 -0.14 0.00 -0.26 0.00 0.00 58.87 58.96 1j8m n SER 20 Cb 0.00 -1.47 -0.07 0.00 -0.26 0.00 0.00 64.21 62.42 1j8m n SER 20 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1j8m h TYR 21 N -1.42 -0.70 -0.79 7.33 3.20 -1.96 0.14 116.97 122.77 1j8m h TYR 21 Ca -0.44 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.39 1j8m h TYR 21 Cb 1.29 0.28 -0.04 0.00 1.54 0.00 0.00 36.73 39.80 1j8m h TYR 21 CO 0.47 -0.38 0.33 -0.44 -1.64 0.00 0.00 178.16 176.50 1j8m h ASP 22 N -0.55 1.07 0.38 -2.11 5.19 -1.99 -0.58 116.42 117.84 1j8m h ASP 22 Ca -0.00 -0.16 -0.13 0.00 -0.62 0.00 0.00 57.03 56.12 1j8m h ASP 22 Cb 0.51 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.73 1j8m h ASP 22 CO -0.07 0.94 -0.54 0.50 -3.12 0.00 0.00 179.24 176.95 1j8m h LYS 23 N 1.14 0.17 -0.46 3.56 3.64 -1.88 -0.76 116.57 121.98 1j8m h LYS 23 Ca 0.27 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1j8m h LYS 23 Cb 0.19 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 1j8m h LYS 23 CO -0.02 0.67 0.15 0.00 -2.27 0.00 0.00 179.45 177.97 1j8m h ALA 24 N 1.31 0.61 -0.60 5.00 0.00 0.05 -0.31 119.26 125.31 1j8m h ALA 24 Ca 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1j8m h ALA 24 Cb 1.00 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1j8m h ALA 24 CO 0.08 0.26 0.35 0.28 0.00 0.00 0.00 179.25 180.22 1j8m h VAL 25 N 0.61 1.18 -0.05 0.00 2.07 -1.03 0.24 116.25 119.28 1j8m h VAL 25 Ca 0.15 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 1j8m h VAL 25 Cb 0.26 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1j8m h VAL 25 CO -0.01 0.19 0.02 -0.33 0.02 0.00 0.00 177.57 177.47 1j8m h GLU 26 N 0.82 0.07 -0.03 1.57 5.08 -0.71 0.21 114.58 121.59 1j8m h GLU 26 Ca 0.22 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.59 1j8m h GLU 26 Cb 0.00 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1j8m h GLU 26 CO -0.04 0.16 -0.13 -0.44 -1.00 0.00 0.00 179.01 177.56 1j8m h ASP 27 N -0.03 -0.38 -0.01 1.42 3.45 -1.01 -1.50 116.42 118.35 1j8m h ASP 27 Ca 0.02 0.06 0.01 0.00 0.43 0.00 0.00 57.03 57.55 1j8m h ASP 27 Cb 0.11 0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.04 1j8m h ASP 27 CO -0.00 -0.18 -0.05 0.15 -1.57 0.00 0.00 179.24 177.59 1j8m h PHE 28 N -0.20 -0.13 -0.91 4.55 3.57 -0.59 -1.50 116.94 121.73 1j8m h PHE 28 Ca 0.06 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.62 1j8m h PHE 28 Cb 0.28 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 39.02 1j8m h PHE 28 CO -0.20 -0.08 0.59 0.82 -2.23 0.00 0.00 178.31 177.21 1j8m h ILE 29 N -0.09 1.09 -0.59 1.41 1.08 -0.31 -1.53 117.51 118.57 1j8m h ILE 29 Ca 0.02 -0.37 -0.06 0.00 -0.39 0.00 0.00 64.86 64.07 1j8m h ILE 29 Cb 0.12 -0.07 -0.02 0.00 -3.07 0.00 0.00 36.82 33.78 1j8m h ILE 29 CO -0.06 0.19 0.14 0.11 -0.69 0.00 0.00 178.15 177.84 1j8m h LYS 30 N 1.07 0.95 -0.25 2.37 1.57 -0.90 0.12 116.57 121.50 1j8m h LYS 30 Ca 0.38 -0.23 -0.14 0.00 -1.87 0.00 0.00 60.65 58.79 1j8m h LYS 30 Cb 0.14 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1j8m h LYS 30 CO -0.14 0.88 -0.41 0.93 -0.57 0.00 0.00 179.45 180.14 1j8m h GLU 31 N 0.86 0.59 0.17 3.15 4.39 -0.89 -0.63 114.58 122.21 1j8m h GLU 31 Ca 0.19 -0.30 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 1j8m h GLU 31 Cb 0.36 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1j8m h GLU 31 CO 0.00 0.89 -0.08 1.25 -1.16 0.00 0.00 179.01 179.92 1j8m h LEU 32 N 0.48 -0.19 -0.51 1.33 5.85 -0.96 -0.45 115.31 120.86 1j8m h LEU 32 Ca 0.04 -0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.76 1j8m h LEU 32 Cb 0.92 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 1j8m h LEU 32 CO 0.08 -0.09 0.28 1.56 -0.34 0.00 0.00 178.44 179.94 1j8m h GLN 33 N -0.28 0.54 -0.09 1.25 4.20 -0.64 -0.67 115.11 119.42 1j8m h GLN 33 Ca -0.02 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.66 1j8m h GLN 33 Cb 0.22 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 1j8m h GLN 33 CO 0.04 0.36 0.04 0.87 -0.67 0.00 0.00 178.83 179.47 1j8m h LYS 34 N 0.56 0.09 -0.38 1.46 1.57 -0.95 -0.19 116.57 118.73 1j8m h LYS 34 Ca 0.22 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.94 1j8m h LYS 34 Cb 0.08 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1j8m h LYS 34 CO -0.12 0.06 0.02 0.77 -0.57 0.00 0.00 179.45 179.60 1j8m h SER 35 N 0.09 0.56 -0.20 0.86 0.02 -0.83 -1.08 113.55 112.97 1j8m h SER 35 Ca 0.04 -0.11 -0.14 0.00 -0.84 0.00 0.00 61.79 60.74 1j8m h SER 35 Cb 0.01 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.41 1j8m h SER 35 CO -0.03 0.61 -0.44 -0.07 -1.14 0.00 0.00 176.83 175.77 1j8m h LEU 36 N 0.57 0.73 -0.22 5.07 3.38 -1.01 -1.22 115.31 122.60 1j8m h LEU 36 Ca 0.12 -0.56 0.03 0.00 0.09 0.00 0.00 57.88 57.56 1j8m h LEU 36 Cb 0.33 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1j8m h LEU 36 CO 0.01 1.15 0.03 0.40 0.09 0.00 0.00 178.44 180.12 1j8m h ILE 37 N 0.33 0.88 -0.30 1.22 2.04 -0.89 -1.49 117.51 119.31 1j8m h ILE 37 Ca 0.00 -0.04 0.07 0.00 1.00 0.00 0.00 64.86 65.89 1j8m h ILE 37 Cb 1.04 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1j8m h ILE 37 CO 0.10 0.02 0.21 0.28 0.00 0.00 0.00 178.15 178.76 1j8m h SER 38 N 0.11 0.08 -0.06 1.72 0.02 -1.02 -1.12 113.55 113.28 1j8m h SER 38 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1j8m h SER 38 Cb 0.11 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1j8m h SER 38 CO -0.15 0.05 0.00 0.00 -1.14 0.00 0.00 176.83 175.60 1j8m n ALA 39 N -2.57 2.51 -2.20 3.77 0.00 -0.48 -4.74 120.51 116.80 1j8m n ALA 39 Ca 0.04 -0.13 -0.14 0.00 0.00 0.00 0.00 53.44 53.21 1j8m n ALA 39 Cb 0.31 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.71 1j8m n ALA 39 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1j8m n ASP 40 N -0.36 -4.32 -4.76 0.00 2.03 -0.42 -0.84 116.55 107.88 1j8m n ASP 40 Ca 0.04 0.01 -0.39 0.00 0.52 0.00 0.00 54.79 54.98 1j8m n ASP 40 Cb 0.07 -3.45 -0.05 0.00 -0.72 0.00 0.00 41.12 36.96 1j8m n ASP 40 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1j8m s VAL 41 N -2.68 3.84 0.25 5.18 1.01 -0.66 -3.53 120.40 123.81 1j8m s VAL 41 Ca 0.00 1.74 -0.31 0.00 0.00 0.00 0.00 61.98 63.41 1j8m s VAL 41 Cb 0.00 -4.06 -0.13 0.00 0.00 0.00 0.00 36.38 32.19 1j8m s VAL 41 CO 0.00 0.32 1.36 -3.20 0.00 0.00 0.00 175.10 173.58 1j8m n ASN 42 N 1.02 2.59 -0.07 3.32 5.15 -1.26 -4.62 115.26 121.39 1j8m n ASN 42 Ca -0.00 1.15 -0.05 0.00 -0.60 0.00 0.00 54.58 55.08 1j8m n ASN 42 Cb 0.47 -1.42 0.15 0.00 -0.53 0.00 0.00 39.78 38.46 1j8m n ASN 42 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 1j8m h VAL 43 N 2.90 1.25 -0.92 3.44 3.04 -1.97 0.18 116.25 124.17 1j8m h VAL 43 Ca -0.45 -1.15 0.03 0.00 -1.01 0.00 0.00 66.70 64.13 1j8m h VAL 43 Cb 1.28 1.08 -0.05 0.00 -2.01 0.00 0.00 31.29 31.59 1j8m h VAL 43 CO 0.73 0.39 0.60 0.50 -1.01 0.00 0.00 177.57 178.77 1j8m h LYS 44 N 0.64 1.13 -0.40 4.17 3.11 -2.00 -0.43 116.57 122.79 1j8m h LYS 44 Ca 0.11 -0.07 -0.09 0.00 -2.81 0.00 0.00 60.65 57.80 1j8m h LYS 44 Cb 0.58 -0.25 -0.02 0.00 -1.00 0.00 0.00 32.23 31.53 1j8m h LYS 44 CO 0.04 0.75 -0.11 -0.07 -2.81 0.00 0.00 179.45 177.25 1j8m h LEU 45 N 1.16 0.70 -0.27 5.20 3.38 -1.07 -2.11 115.31 122.30 1j8m h LEU 45 Ca 0.37 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1j8m h LEU 45 Cb 0.00 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1j8m h LEU 45 CO -0.12 0.84 0.16 0.58 0.09 0.00 0.00 178.44 179.98 1j8m h VAL 46 N 0.65 1.11 -0.45 1.22 2.07 -0.70 -0.88 116.25 119.26 1j8m h VAL 46 Ca 0.11 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.32 1j8m h VAL 46 Cb 0.56 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1j8m h VAL 46 CO 0.03 0.11 0.07 0.15 0.02 0.00 0.00 177.57 177.95 1j8m h PHE 47 N 0.33 0.80 -0.33 1.57 3.57 -1.08 -1.81 116.94 120.00 1j8m h PHE 47 Ca 0.10 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 1j8m h PHE 47 Cb 0.03 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 1j8m h PHE 47 CO -0.04 0.76 0.20 0.77 -2.23 0.00 0.00 178.31 177.77 1j8m h SER 48 N 0.62 0.40 0.29 0.41 0.02 -1.33 0.87 113.55 114.82 1j8m h SER 48 Ca 0.14 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1j8m h SER 48 Cb 0.39 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.79 1j8m h SER 48 CO 0.01 0.33 -0.52 0.25 -1.14 0.00 0.00 176.83 175.76 1j8m h LEU 49 N 0.43 -1.50 -1.82 5.07 5.85 -0.89 0.60 115.31 123.05 1j8m h LEU 49 Ca 0.12 0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 1j8m h LEU 49 Cb 0.01 0.53 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 1j8m h LEU 49 CO -0.02 -0.61 -0.10 0.71 -0.34 0.00 0.00 178.44 178.08 1j8m h THR 50 N -0.87 1.04 -0.11 1.05 1.35 -1.26 0.82 112.91 114.94 1j8m h THR 50 Ca -0.03 -0.34 -0.17 0.00 -0.55 0.00 0.00 66.41 65.32 1j8m h THR 50 Cb 0.81 1.19 -0.01 0.00 -1.73 0.00 0.00 68.15 68.41 1j8m h THR 50 CO -0.19 0.10 -0.64 0.78 -0.25 0.00 0.00 175.52 175.32 1j8m h ASN 51 N 0.00 0.47 -0.31 5.36 2.35 -0.52 -1.54 115.58 121.39 1j8m h ASN 51 Ca -0.00 -0.28 -0.15 0.00 -0.55 0.00 0.00 56.30 55.32 1j8m h ASN 51 Cb 0.18 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1j8m h ASN 51 CO 0.01 0.98 -0.37 0.50 -1.65 0.00 0.00 177.43 176.91 1j8m h LYS 52 N 0.30 0.85 -0.25 0.81 3.64 -0.18 -1.74 116.57 119.99 1j8m h LYS 52 Ca -0.01 -0.43 0.02 0.00 -1.27 0.00 0.00 60.65 58.96 1j8m h LYS 52 Cb 1.18 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.99 1j8m h LYS 52 CO 0.11 1.07 0.11 0.82 -2.27 0.00 0.00 179.45 179.29 1j8m h ILE 53 N 0.70 0.96 -0.17 2.00 2.04 -0.66 -1.52 117.51 120.86 1j8m h ILE 53 Ca 0.06 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.79 1j8m h ILE 53 Cb 0.94 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1j8m h ILE 53 CO 0.09 0.04 -0.14 0.11 0.00 0.00 0.00 178.15 178.25 1j8m h LYS 54 N 0.23 0.27 -0.02 2.37 1.57 -1.09 -1.92 116.57 117.99 1j8m h LYS 54 Ca 0.11 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.73 1j8m h LYS 54 Cb 0.06 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.34 1j8m h LYS 54 CO -0.09 0.42 -0.33 1.49 -0.57 0.00 0.00 179.45 180.37 1j8m h GLU 55 N 0.26 0.26 -0.35 3.15 4.57 -0.92 -2.19 114.58 119.36 1j8m h GLU 55 Ca 0.05 -0.25 0.07 0.00 -1.18 0.00 0.00 59.36 58.04 1j8m h GLU 55 Cb 0.41 0.07 -0.06 0.00 -0.16 0.00 0.00 28.75 29.01 1j8m h GLU 55 CO 0.02 0.95 -0.02 0.00 -1.18 0.00 0.00 179.01 178.79 1j8m h ARG 56 N -0.34 0.08 -0.31 1.92 3.08 -1.17 -0.53 114.38 117.11 1j8m h ARG 56 Ca -0.04 -0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.07 1j8m h ARG 56 Cb 1.05 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.07 1j8m h ARG 56 CO 0.07 0.05 0.22 1.25 -1.07 0.00 0.00 179.97 180.48 1j8m h LEU 57 N 0.08 0.12 0.05 3.04 7.12 -1.28 0.35 115.31 124.80 1j8m h LEU 57 Ca 0.17 0.00 -0.26 0.00 0.13 0.00 0.00 57.88 57.93 1j8m h LEU 57 Cb 0.24 -0.03 -0.02 0.00 -0.53 0.00 0.00 40.66 40.33 1j8m h LEU 57 CO -0.30 0.08 -1.27 0.07 -0.13 0.00 0.00 178.44 176.89 1j8m h LYS 58 N 0.14 0.11 0.00 1.25 2.10 -0.73 -3.37 116.57 116.07 1j8m h LYS 58 Ca 0.14 -0.19 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 1j8m h LYS 58 Cb 0.39 0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 1j8m h LYS 58 CO -0.02 1.00 -1.06 0.09 -2.00 0.00 0.00 179.45 177.46 1j8m n ASN 59 N -3.37 0.69 -3.91 7.07 3.02 -0.27 -4.83 115.26 113.67 1j8m n ASN 59 Ca -0.08 0.16 -0.30 0.00 -0.03 0.00 0.00 54.58 54.33 1j8m n ASN 59 Cb 1.00 0.63 -0.15 0.00 -0.61 0.00 0.00 39.78 40.65 1j8m n ASN 59 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1j8m s GLU 60 N -3.32 1.42 0.82 3.52 2.02 0.12 -5.07 118.70 118.20 1j8m s GLU 60 Ca 0.00 -1.90 -0.11 0.00 0.02 0.00 0.00 54.97 52.98 1j8m s GLU 60 Cb 0.11 -2.89 0.09 0.00 0.10 0.00 0.00 34.13 31.54 1j8m s GLU 60 CO 0.79 -1.01 1.09 -1.59 0.02 0.00 0.00 175.26 174.56 1j8m s LYS 61 N 0.72 1.86 0.41 1.61 0.00 -1.26 -4.70 119.74 118.37 1j8m s LYS 61 Ca 0.13 0.93 -0.26 0.00 0.00 0.00 0.00 55.97 56.78 1j8m s LYS 61 Cb -0.21 -1.87 -0.08 0.00 0.00 0.00 0.00 37.83 35.67 1j8m s LYS 61 CO -0.09 -1.85 1.26 -2.14 0.00 0.00 0.00 175.35 172.53 1j8m s PRO 62 N -4.96 3.96 0.82 1.78 0.02 -1.26 -4.97 135.00 130.39 1j8m s PRO 62 Ca 0.62 2.06 -0.13 0.00 0.02 0.00 0.00 61.00 63.56 1j8m s PRO 62 Cb -0.17 -2.71 0.08 0.00 0.02 0.00 0.00 34.50 31.72 1j8m s PRO 62 CO 0.56 -0.46 1.08 -2.30 -0.33 0.00 0.00 177.00 175.55 1j8m n PRO 63 N 0.07 0.09 -1.70 5.54 -0.02 -1.26 -4.89 135.00 132.82 1j8m n PRO 63 Ca 0.04 0.10 -0.39 0.00 -2.02 0.00 0.00 63.50 61.23 1j8m n PRO 63 Cb 0.45 -2.34 0.04 0.00 -0.02 0.00 0.00 33.50 31.62 1j8m n PRO 63 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1j8m n THR 64 N -3.35 3.51 0.00 3.45 -2.24 -1.26 -1.80 114.28 112.59 1j8m n THR 64 Ca 0.13 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1j8m n THR 64 Cb 0.51 -1.49 0.00 0.00 -2.10 0.00 0.00 70.33 67.25 1j8m n THR 64 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1j8m n TYR 65 N -1.03 0.00 -3.13 4.78 4.02 -1.26 -4.99 117.16 115.55 1j8m n TYR 65 Ca 0.11 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.60 1j8m n TYR 65 Cb 0.44 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.70 1j8m n TYR 65 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1j8m s ILE 66 N -1.57 5.05 0.80 -0.72 -1.09 -0.74 -5.07 121.20 117.85 1j8m s ILE 66 Ca 0.00 1.21 -0.12 0.00 -2.23 0.00 0.00 60.65 59.51 1j8m s ILE 66 Cb 0.00 -3.95 0.08 0.00 -1.58 0.00 0.00 42.46 37.01 1j8m s ILE 66 CO 0.00 0.16 1.14 -1.61 -1.23 0.00 0.00 174.94 173.40 1j8m s GLU 67 N 1.53 1.84 0.23 2.79 2.02 -1.26 -4.71 118.70 121.15 1j8m s GLU 67 Ca 0.30 1.46 -0.02 0.00 0.02 0.00 0.00 54.97 56.73 1j8m s GLU 67 Cb -0.16 -1.83 0.25 0.00 0.10 0.00 0.00 34.13 32.49 1j8m s GLU 67 CO 0.12 -2.00 1.65 0.00 0.02 0.00 0.00 175.26 175.05 1j8m h ARG 68 N -1.08 0.67 0.03 1.61 3.08 -1.97 0.29 114.38 117.01 1j8m h ARG 68 Ca -0.45 -0.27 -0.26 0.00 0.07 0.00 0.00 59.98 59.07 1j8m h ARG 68 Cb 1.26 -0.03 0.02 0.00 0.08 0.00 0.00 29.97 31.30 1j8m h ARG 68 CO 0.48 0.86 -1.07 0.00 -1.07 0.00 0.00 179.97 179.17 1j8m h ARG 69 N 0.59 0.61 -0.90 0.04 3.08 -1.98 -1.17 114.38 114.65 1j8m h ARG 69 Ca 0.08 -0.69 0.03 0.00 0.07 0.00 0.00 59.98 59.47 1j8m h ARG 69 Cb 0.73 0.21 -0.05 0.00 0.08 0.00 0.00 29.97 30.94 1j8m h ARG 69 CO 0.06 1.29 0.58 0.93 -1.07 0.00 0.00 179.97 181.76 1j8m h GLU 70 N 0.33 1.11 -0.17 0.04 4.39 -1.89 -2.24 114.58 116.15 1j8m h GLU 70 Ca -0.13 -0.07 -0.15 0.00 0.34 0.00 0.00 59.36 59.35 1j8m h GLU 70 Cb 1.72 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 30.12 1j8m h GLU 70 CO 0.20 0.73 -0.52 2.35 -1.16 0.00 0.00 179.01 180.62 1j8m h TRP 71 N 1.14 0.59 -0.03 4.33 2.91 -0.71 -1.75 115.95 122.43 1j8m h TRP 71 Ca 0.35 -0.20 0.02 0.00 1.13 0.00 0.00 58.89 60.19 1j8m h TRP 71 Cb -0.02 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 28.50 1j8m h TRP 71 CO -0.01 0.89 -0.09 0.35 -1.03 0.00 0.00 178.44 178.55 1j8m h PHE 72 N 0.37 -0.22 -0.19 2.65 3.57 -0.95 -2.18 116.94 119.99 1j8m h PHE 72 Ca 0.01 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1j8m h PHE 72 Cb 1.03 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.86 1j8m h PHE 72 CO 0.04 -0.13 0.09 0.82 -2.23 0.00 0.00 178.31 176.90 1j8m h ILE 73 N -0.14 1.07 -0.47 1.41 1.08 -1.16 -0.28 117.51 119.02 1j8m h ILE 73 Ca 0.04 -0.19 -0.05 0.00 -0.39 0.00 0.00 64.86 64.27 1j8m h ILE 73 Cb 0.20 0.82 -0.02 0.00 -3.07 0.00 0.00 36.82 34.75 1j8m h ILE 73 CO -0.11 0.08 0.10 0.50 -0.69 0.00 0.00 178.15 178.03 1j8m h LYS 74 N 0.26 0.76 -0.37 2.37 3.11 -1.00 0.12 116.57 121.82 1j8m h LYS 74 Ca 0.07 -0.19 -0.15 0.00 -2.81 0.00 0.00 60.65 57.56 1j8m h LYS 74 Cb 0.03 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.16 1j8m h LYS 74 CO -0.01 0.76 -0.37 0.82 -2.81 0.00 0.00 179.45 177.84 1j8m h ILE 75 N 0.63 1.28 0.27 2.00 2.04 -0.90 -0.16 117.51 122.68 1j8m h ILE 75 Ca 0.14 -1.54 0.00 0.00 1.00 0.00 0.00 64.86 64.47 1j8m h ILE 75 Cb 0.35 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1j8m h ILE 75 CO 0.00 0.51 -0.31 0.58 0.00 0.00 0.00 178.15 178.93 1j8m h VAL 76 N 0.72 0.34 -0.55 1.67 2.07 -0.48 -0.93 116.25 119.09 1j8m h VAL 76 Ca 0.06 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.66 1j8m h VAL 76 Cb 0.96 0.34 -0.07 0.00 -1.52 0.00 0.00 31.29 31.00 1j8m h VAL 76 CO 0.09 0.00 0.19 1.88 0.02 0.00 0.00 177.57 179.75 1j8m h TYR 77 N -0.63 0.34 -0.54 1.57 0.05 -0.89 0.11 116.97 116.98 1j8m h TYR 77 Ca -0.01 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.81 1j8m h TYR 77 Cb 0.59 -0.07 -0.03 0.00 1.01 0.00 0.00 36.73 38.24 1j8m h TYR 77 CO -0.21 0.09 0.36 -0.44 -1.05 0.00 0.00 178.16 176.91 1j8m h ASP 78 N 0.37 0.61 1.36 3.88 3.32 -0.65 -1.84 116.42 123.47 1j8m h ASP 78 Ca 0.27 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.24 1j8m h ASP 78 Cb 0.32 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1j8m h ASP 78 CO -0.28 0.44 -0.66 -0.33 -1.72 0.00 0.00 179.24 176.68 1j8m h GLU 79 N 0.72 0.00 -0.58 3.56 4.39 -0.28 -2.43 114.58 119.97 1j8m h GLU 79 Ca 0.20 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.80 1j8m h GLU 79 Cb -0.07 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 1j8m h GLU 79 CO -0.04 0.21 -0.02 -0.07 -1.16 0.00 0.00 179.01 177.92 1j8m h LEU 80 N 0.00 1.02 -0.54 1.33 3.38 -0.56 -0.59 115.31 119.36 1j8m h LEU 80 Ca -0.03 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.64 1j8m h LEU 80 Cb 1.23 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 1j8m h LEU 80 CO 0.03 1.09 0.33 -1.28 0.09 0.00 0.00 178.44 178.70 1j8m h SER 81 N 0.93 0.54 -0.50 -0.43 0.87 -1.18 -2.13 113.55 111.65 1j8m h SER 81 Ca 0.16 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.70 1j8m h SER 81 Cb 0.58 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.40 1j8m h SER 81 CO 0.03 0.38 0.26 0.78 -0.53 0.00 0.00 176.83 177.76 1j8m h ASN 82 N 0.66 0.67 -0.52 6.23 -0.26 -1.11 0.41 115.58 121.66 1j8m h ASN 82 Ca 0.21 -0.06 0.00 0.00 -0.56 0.00 0.00 56.30 55.90 1j8m h ASN 82 Cb 0.00 -0.17 -0.03 0.00 -1.06 0.00 0.00 38.32 37.07 1j8m h ASN 82 CO -0.09 0.56 0.34 0.25 -1.06 0.00 0.00 177.43 177.44 1j8m h LEU 83 N 0.75 0.60 -1.92 1.61 5.85 -0.69 0.15 115.31 121.65 1j8m h LEU 83 Ca 0.19 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1j8m h LEU 83 Cb 0.07 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.95 1j8m h LEU 83 CO -0.03 0.44 0.00 0.49 -0.34 0.00 0.00 178.44 179.00 1j8m n PHE 84 N -4.46 0.62 0.00 1.25 3.72 -0.84 -4.45 117.46 113.31 1j8m n PHE 84 Ca 0.05 -0.31 0.00 0.00 -0.05 0.00 0.00 57.45 57.14 1j8m n PHE 84 Cb 0.05 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 1j8m n PHE 84 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1j8m n GLY 85 N 1.35 1.30 0.00 1.37 0.00 0.52 -4.69 105.19 105.05 1j8m n GLY 85 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1j8m n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j8m n GLY 86 N 0.00 -0.98 3.59 -0.02 0.00 0.14 -4.82 105.19 103.09 1j8m n GLY 86 Ca 0.00 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 1j8m n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1j8m s ASP 87 N -3.52 5.34 -0.25 1.61 3.68 -1.26 -3.99 116.67 118.28 1j8m s ASP 87 Ca 0.00 1.57 -0.21 0.00 2.13 0.00 0.00 52.55 56.04 1j8m s ASP 87 Cb 0.00 -2.51 0.07 0.00 -1.45 0.00 0.00 42.92 39.02 1j8m s ASP 87 CO 0.00 -2.10 0.65 -0.75 0.13 0.00 0.00 175.17 173.10 1j8m s LYS 88 N 6.60 0.73 -0.29 4.34 2.20 -1.26 -5.00 119.74 127.06 1j8m s LYS 88 Ca 0.95 0.96 -0.01 0.00 -0.36 0.00 0.00 55.97 57.50 1j8m s LYS 88 Cb -0.27 0.31 0.05 0.00 -1.51 0.00 0.00 37.83 36.41 1j8m s LYS 88 CO 0.33 -0.10 -0.01 -2.00 -0.36 0.00 0.00 175.35 173.20 1j8m s GLU 89 N 0.63 2.43 0.91 4.03 2.56 -1.26 -4.34 118.70 123.67 1j8m s GLU 89 Ca -0.02 -1.26 -0.12 0.00 0.00 0.00 0.00 54.97 53.57 1j8m s GLU 89 Cb -0.05 -3.15 0.14 0.00 2.00 0.00 0.00 34.13 33.07 1j8m s GLU 89 CO -0.04 -0.60 1.09 -1.25 -0.56 0.00 0.00 175.26 173.90 1j8m s PRO 90 N 1.24 1.13 -0.52 4.30 0.04 -1.26 -4.98 135.00 134.95 1j8m s PRO 90 Ca -0.05 0.78 -0.21 0.00 0.04 0.00 0.00 61.00 61.56 1j8m s PRO 90 Cb -0.20 -1.80 0.05 0.00 0.04 0.00 0.00 34.50 32.60 1j8m s PRO 90 CO -0.02 -2.32 0.73 0.21 0.04 0.00 0.00 177.00 175.64 1j8m s LYS 91 N -4.93 3.18 0.00 4.56 2.20 -1.26 -4.88 119.74 118.61 1j8m s LYS 91 Ca 0.64 -0.70 0.13 0.00 -0.36 0.00 0.00 55.97 55.67 1j8m s LYS 91 Cb -0.18 -4.09 -0.13 0.00 -1.51 0.00 0.00 37.83 31.92 1j8m s LYS 91 CO 0.57 -1.31 0.57 1.33 -0.36 0.00 0.00 175.35 176.15 1j8m n VAL 92 N 5.79 0.00 -3.74 4.02 0.24 -1.26 -4.87 118.33 118.52 1j8m n VAL 92 Ca -0.04 -0.20 -0.37 0.00 -2.04 0.00 0.00 64.34 61.69 1j8m n VAL 92 Cb 0.46 1.01 -0.12 0.00 -1.47 0.00 0.00 33.84 33.71 1j8m n VAL 92 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1j8m s ILE 93 N -2.21 4.24 0.37 1.34 -1.09 -1.26 -5.07 121.20 117.53 1j8m s ILE 93 Ca 0.05 -0.37 -0.27 0.00 -2.23 0.00 0.00 60.65 57.83 1j8m s ILE 93 Cb 0.10 -3.07 -0.09 0.00 -1.58 0.00 0.00 42.46 37.81 1j8m s ILE 93 CO 0.53 0.22 1.26 -2.16 -1.23 0.00 0.00 174.94 173.56 1j8m s PRO 94 N 1.58 4.16 -0.19 2.79 0.04 -1.26 -4.95 135.00 137.16 1j8m s PRO 94 Ca 0.05 2.09 0.16 0.00 0.04 0.00 0.00 61.00 63.34 1j8m s PRO 94 Cb -0.16 -2.87 0.61 0.00 0.04 0.00 0.00 34.50 32.12 1j8m s PRO 94 CO 0.04 -0.31 1.52 -0.40 0.04 0.00 0.00 177.00 177.88 1j8m n ASP 95 N 0.41 4.41 -4.04 6.66 5.68 -1.26 -4.92 116.55 123.48 1j8m n ASP 95 Ca 0.02 -2.98 -0.23 0.00 -0.50 0.00 0.00 54.79 51.10 1j8m n ASP 95 Cb 0.44 -0.58 -0.16 0.00 -1.14 0.00 0.00 41.12 39.67 1j8m n ASP 95 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1j8m s LYS 96 N -2.78 1.42 -0.06 0.11 2.20 -1.26 -5.11 119.74 114.26 1j8m s LYS 96 Ca 0.46 -0.42 0.01 0.00 -0.36 0.00 0.00 55.97 55.66 1j8m s LYS 96 Cb 0.36 -1.24 0.02 0.00 -1.51 0.00 0.00 37.83 35.46 1j8m s LYS 96 CO 0.11 0.11 -0.07 0.42 -0.36 0.00 0.00 175.35 175.56 1j8m s ILE 97 N 0.33 0.78 0.63 5.43 1.09 -1.26 -3.81 121.20 124.38 1j8m s ILE 97 Ca -0.07 -0.26 -0.09 0.00 -1.10 0.00 0.00 60.65 59.13 1j8m s ILE 97 Cb -0.12 -0.77 -0.00 0.00 -1.06 0.00 0.00 42.46 40.51 1j8m s ILE 97 CO 0.02 0.28 0.98 -2.16 -0.10 0.00 0.00 174.94 173.97 1j8m s PRO 98 N 0.89 3.07 -0.13 2.79 0.04 -1.26 -5.12 135.00 135.28 1j8m s PRO 98 Ca -0.11 0.32 -0.01 0.00 0.04 0.00 0.00 61.00 61.24 1j8m s PRO 98 Cb -0.15 -2.16 0.03 0.00 0.04 0.00 0.00 34.50 32.27 1j8m s PRO 98 CO 0.01 -0.75 -0.06 -0.47 0.04 0.00 0.00 177.00 175.76 1j8m s TYR 99 N -3.14 1.52 -0.23 0.56 5.04 0.14 -5.00 117.35 116.24 1j8m s TYR 99 Ca 0.55 -0.84 -0.09 0.00 -2.44 0.00 0.00 57.07 54.25 1j8m s TYR 99 Cb -0.11 -1.24 -0.04 0.00 0.35 0.00 0.00 41.96 40.92 1j8m s TYR 99 CO 0.49 -0.54 0.12 0.08 -1.34 0.00 0.00 175.55 174.35 1j8m s VAL 100 N 1.70 4.99 -0.20 3.14 1.01 -1.26 0.07 120.40 129.85 1j8m s VAL 100 Ca 0.03 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.08 1j8m s VAL 100 Cb -0.14 -3.31 0.03 0.00 0.00 0.00 0.00 36.38 32.97 1j8m s VAL 100 CO -0.08 0.37 -0.16 -0.63 0.00 0.00 0.00 175.10 174.60 1j8m s ILE 101 N 1.01 2.00 -0.28 2.22 1.01 0.23 -1.47 121.20 125.91 1j8m s ILE 101 Ca 0.06 -1.08 -0.12 0.00 0.00 0.00 0.00 60.65 59.51 1j8m s ILE 101 Cb -0.14 -1.90 -0.05 0.00 0.01 0.00 0.00 42.46 40.38 1j8m s ILE 101 CO 0.04 0.37 0.23 -0.32 0.00 0.00 0.00 174.94 175.25 1j8m s MET 102 N 1.28 3.94 -0.05 2.79 -2.45 -0.16 -0.11 119.30 124.53 1j8m s MET 102 Ca 0.01 -0.27 -0.18 0.00 -1.25 0.00 0.00 55.69 54.01 1j8m s MET 102 Cb -0.15 -3.67 -0.05 0.00 1.25 0.00 0.00 34.83 32.21 1j8m s MET 102 CO -0.11 -0.22 0.50 -0.51 1.05 0.00 0.00 175.02 175.74 1j8m s LEU 103 N 1.82 4.38 0.22 4.11 1.43 0.43 -0.65 118.68 130.43 1j8m s LEU 103 Ca 0.09 0.97 0.01 0.00 -1.03 0.00 0.00 54.13 54.16 1j8m s LEU 103 Cb -0.16 -2.74 -0.05 0.00 0.03 0.00 0.00 46.19 43.27 1j8m s LEU 103 CO 0.11 0.12 0.08 0.68 0.23 0.00 0.00 176.35 177.57 1j8m s VAL 104 N -0.10 0.47 0.00 -1.59 -7.23 -0.36 -1.96 120.40 109.63 1j8m s VAL 104 Ca 0.27 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.45 1j8m s VAL 104 Cb -0.17 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.31 1j8m s VAL 104 CO 0.13 -0.13 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1j8m n GLY 105 N -0.36 1.58 3.78 2.32 0.00 -1.05 -1.56 105.19 109.89 1j8m n GLY 105 Ca -0.01 -1.24 -0.31 0.00 0.00 0.00 0.00 46.02 44.46 1j8m n GLY 105 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j8m s VAL 106 N -1.97 3.42 0.07 1.61 -7.23 -1.26 -3.48 120.40 111.57 1j8m s VAL 106 Ca 0.00 0.46 -0.37 0.00 -1.81 0.00 0.00 61.98 60.26 1j8m s VAL 106 Cb 0.00 -2.99 -0.18 0.00 0.56 0.00 0.00 36.38 33.77 1j8m s VAL 106 CO 0.00 -0.60 1.21 0.00 -0.31 0.00 0.00 175.10 175.40 1j8m n GLN 107 N -3.47 0.76 -2.80 4.82 1.13 -1.26 -3.95 117.38 112.61 1j8m n GLN 107 Ca 0.09 0.27 -0.06 0.00 -1.94 0.00 0.00 57.00 55.36 1j8m n GLN 107 Cb 0.53 -1.84 0.01 0.00 0.11 0.00 0.00 30.24 29.05 1j8m n GLN 107 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1j8m n GLY 108 N 2.13 -1.26 0.63 1.08 0.00 -1.26 -4.98 105.19 101.53 1j8m n GLY 108 Ca 0.18 1.06 0.05 0.00 0.00 0.00 0.00 46.02 47.32 1j8m n GLY 108 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1j8m n THR 109 N -0.55 1.16 -3.75 2.61 -2.24 -1.25 -4.73 114.28 105.53 1j8m n THR 109 Ca 0.09 -1.79 -0.26 0.00 -2.27 0.00 0.00 64.05 59.82 1j8m n THR 109 Cb 0.44 0.19 0.05 0.00 -2.10 0.00 0.00 70.33 68.92 1j8m n THR 109 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j8m n GLY 110 N -0.61 -0.49 3.17 3.38 0.00 -1.26 -4.28 105.19 105.10 1j8m n GLY 110 Ca 0.11 0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.95 1j8m n GLY 110 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j8m s LYS 111 N -6.37 2.34 0.00 1.61 -2.85 -1.26 -1.09 119.74 112.11 1j8m s LYS 111 Ca 0.53 -1.89 0.00 0.00 -1.00 0.00 0.00 55.97 53.61 1j8m s LYS 111 Cb -0.25 -3.79 0.00 0.00 -2.06 0.00 0.00 37.83 31.73 1j8m s LYS 111 CO 0.78 -1.15 0.00 2.41 0.10 0.00 0.00 175.35 177.50 1j8m n THR 112 N 4.60 0.00 -0.03 3.79 -1.04 -1.26 -4.74 114.28 115.60 1j8m n THR 112 Ca -0.03 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.86 1j8m n THR 112 Cb 0.41 -0.84 -0.06 0.00 -1.82 0.00 0.00 70.33 68.01 1j8m n THR 112 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1j8m h THR 113 N 0.00 1.21 -0.48 12.58 2.02 -1.98 -1.62 112.91 124.64 1j8m h THR 113 Ca 0.00 -0.67 0.07 0.00 0.77 0.00 0.00 66.41 66.59 1j8m h THR 113 Cb 0.97 1.43 -0.06 0.00 -1.74 0.00 0.00 68.15 68.75 1j8m h THR 113 CO 0.00 0.19 0.14 0.74 0.37 0.00 0.00 175.52 176.96 1j8m h THR 114 N -0.02 0.79 -0.91 3.16 2.02 -1.40 0.20 112.91 116.74 1j8m h THR 114 Ca 0.04 -0.10 0.02 0.00 0.77 0.00 0.00 66.41 67.13 1j8m h THR 114 Cb 0.28 0.47 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 1j8m h THR 114 CO 0.00 0.05 0.60 0.00 0.37 0.00 0.00 175.52 176.55 1j8m h ALA 115 N 1.35 1.37 -0.26 6.16 0.00 -1.79 0.78 119.26 126.87 1j8m h ALA 115 Ca 0.24 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 1j8m h ALA 115 Cb 0.28 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1j8m h ALA 115 CO -0.27 0.57 -0.55 0.78 0.00 0.00 0.00 179.25 179.78 1j8m h GLY 116 N 1.20 0.85 1.07 0.00 0.00 -0.23 -1.82 103.07 104.14 1j8m h GLY 116 Ca 0.34 -0.98 -0.10 0.00 0.00 0.00 0.00 47.33 46.58 1j8m h GLY 116 CO -0.08 0.88 -0.07 0.50 0.00 0.00 0.00 176.54 177.77 1j8m h LYS 117 N 0.59 1.00 -0.58 4.80 1.57 -0.43 0.23 116.57 123.75 1j8m h LYS 117 Ca 0.01 -0.36 -0.08 0.00 -1.87 0.00 0.00 60.65 58.36 1j8m h LYS 117 Cb 1.13 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.35 1j8m h LYS 117 CO 0.12 1.03 0.05 1.25 -0.57 0.00 0.00 179.45 181.33 1j8m h LEU 118 N 0.87 0.96 -0.65 2.94 5.85 -0.74 -0.97 115.31 123.57 1j8m h LEU 118 Ca 0.14 -0.28 -0.09 0.00 0.84 0.00 0.00 57.88 58.49 1j8m h LEU 118 Cb 0.63 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1j8m h LEU 118 CO 0.04 1.00 0.03 0.00 -0.34 0.00 0.00 178.44 179.17 1j8m h ALA 119 N 0.99 0.87 -0.20 1.25 0.00 -0.73 -1.38 119.26 120.06 1j8m h ALA 119 Ca 0.17 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1j8m h ALA 119 Cb 0.48 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1j8m h ALA 119 CO 0.02 0.67 0.03 -0.92 0.00 0.00 0.00 179.25 179.05 1j8m h TYR 120 N 0.99 0.06 -0.51 0.00 3.20 -0.40 0.14 116.97 120.45 1j8m h TYR 120 Ca 0.18 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.15 1j8m h TYR 120 Cb 0.53 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 38.73 1j8m h TYR 120 CO 0.04 0.02 0.08 0.35 -1.64 0.00 0.00 178.16 177.00 1j8m h PHE 121 N 0.11 0.12 0.00 -3.82 3.57 -0.73 -0.72 116.94 115.48 1j8m h PHE 121 Ca 0.09 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.43 1j8m h PHE 121 Cb 0.09 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 1j8m h PHE 121 CO -0.14 -0.04 -0.89 1.88 -2.23 0.00 0.00 178.31 176.89 1j8m h TYR 122 N 0.21 0.05 -0.76 0.41 0.05 -0.97 -2.76 116.97 113.20 1j8m h TYR 122 Ca 0.26 -0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.99 1j8m h TYR 122 Cb 0.36 -0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.06 1j8m h TYR 122 CO -0.25 0.90 0.41 -0.22 -1.05 0.00 0.00 178.16 177.95 1j8m h LYS 123 N 0.01 1.05 -0.60 4.88 3.64 -0.39 -1.09 116.57 124.08 1j8m h LYS 123 Ca -0.02 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.24 1j8m h LYS 123 Cb 1.56 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 33.14 1j8m h LYS 123 CO 0.12 0.78 0.35 0.87 -2.27 0.00 0.00 179.45 179.30 1j8m h LYS 124 N 1.04 0.82 0.00 1.90 1.57 -1.00 -1.15 116.57 119.76 1j8m h LYS 124 Ca 0.27 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1j8m h LYS 124 Cb 0.03 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.17 1j8m h LYS 124 CO -0.04 0.58 0.00 1.63 -0.57 0.00 0.00 179.45 181.05 1j8m n LYS 125 N -4.41 0.30 -0.33 3.15 4.76 -0.46 -4.86 118.16 116.31 1j8m n LYS 125 Ca 0.06 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.59 1j8m n LYS 125 Cb 0.08 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.77 1j8m n LYS 125 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j8m n GLY 126 N -0.08 0.83 3.91 0.72 0.00 -0.43 -5.08 105.19 105.06 1j8m n GLY 126 Ca 0.08 -0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1j8m n GLY 126 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j8m s PHE 127 N -2.00 3.53 -0.34 1.61 0.08 -0.89 -5.01 117.98 114.96 1j8m s PHE 127 Ca 0.00 0.75 -0.16 0.00 0.12 0.00 0.00 56.93 57.65 1j8m s PHE 127 Cb 0.00 -2.31 -0.01 0.00 -0.57 0.00 0.00 43.02 40.13 1j8m s PHE 127 CO 0.00 -0.30 0.38 0.15 -0.10 0.00 0.00 175.22 175.35 1j8m s LYS 128 N -4.73 3.62 0.10 0.44 -0.14 -1.26 -4.28 119.74 113.49 1j8m s LYS 128 Ca 0.47 -0.34 0.09 0.00 -1.36 0.00 0.00 55.97 54.83 1j8m s LYS 128 Cb -0.10 -3.79 -0.04 0.00 -1.68 0.00 0.00 37.83 32.22 1j8m s LYS 128 CO 0.44 -0.51 -0.19 0.08 -0.76 0.00 0.00 175.35 174.41 1j8m s VAL 129 N 2.07 2.76 0.00 3.17 1.01 -1.26 -0.41 120.40 127.74 1j8m s VAL 129 Ca 0.13 -1.44 0.06 0.00 0.00 0.00 0.00 61.98 60.73 1j8m s VAL 129 Cb -0.16 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 1j8m s VAL 129 CO 0.12 0.17 -0.19 -0.83 0.00 0.00 0.00 175.10 174.37 1j8m s GLY 130 N -1.93 0.94 -0.13 4.51 0.00 -0.07 -4.28 107.32 106.36 1j8m s GLY 130 Ca 0.17 -0.85 -0.04 0.00 0.00 0.00 0.00 44.72 43.99 1j8m s GLY 130 CO 0.08 -0.74 0.00 1.08 0.00 0.00 0.00 173.10 173.52 1j8m s LEU 131 N -0.66 3.52 -0.24 0.66 1.43 0.10 -1.53 118.68 121.96 1j8m s LEU 131 Ca 0.07 0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 53.17 1j8m s LEU 131 Cb -0.08 -1.84 0.00 0.00 0.03 0.00 0.00 46.19 44.31 1j8m s LEU 131 CO 0.00 0.26 -0.02 -0.69 0.23 0.00 0.00 176.35 176.13 1j8m s VAL 132 N -0.19 3.37 -0.94 -1.59 1.01 0.93 0.14 120.40 123.15 1j8m s VAL 132 Ca 0.05 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.24 1j8m s VAL 132 Cb -0.12 -2.61 0.20 0.00 0.00 0.00 0.00 36.38 33.84 1j8m s VAL 132 CO 0.02 0.31 0.99 -0.83 0.00 0.00 0.00 175.10 175.59 1j8m s GLY 133 N 1.45 2.50 -0.28 4.51 0.00 0.08 -0.41 107.32 115.17 1j8m s GLY 133 Ca 0.04 -3.23 0.11 0.00 0.00 0.00 0.00 44.72 41.63 1j8m s GLY 133 CO -0.02 1.57 1.53 0.00 0.00 0.00 0.00 173.10 176.17 1j8m n ALA 134 N 4.74 4.07 -3.12 3.20 0.00 -0.07 -4.65 120.51 124.67 1j8m n ALA 134 Ca 0.21 -2.81 -0.45 0.00 0.00 0.00 0.00 53.44 50.39 1j8m n ALA 134 Cb 0.46 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 19.05 1j8m n ALA 134 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1j8m s ASP 135 N -2.12 6.89 0.00 0.00 -1.08 -0.86 -4.49 116.67 115.02 1j8m s ASP 135 Ca 0.46 -2.72 0.23 0.00 -0.52 0.00 0.00 52.55 50.00 1j8m s ASP 135 Cb 0.40 -2.31 0.27 0.00 -1.46 0.00 0.00 42.92 39.81 1j8m s ASP 135 CO 0.05 -0.71 1.30 1.33 0.52 0.00 0.00 175.17 177.65 1j8m n VAL 136 N 4.36 0.18 -0.05 1.11 0.24 -1.26 -4.30 118.33 118.62 1j8m n VAL 136 Ca 0.24 -0.59 -0.07 0.00 -2.04 0.00 0.00 64.34 61.88 1j8m n VAL 136 Cb 0.45 1.31 -0.07 0.00 -1.47 0.00 0.00 33.84 34.07 1j8m n VAL 136 CO 0.00 0.00 0.00 1.88 -2.14 0.00 0.00 176.83 176.57 1j8m h TYR 137 N 4.54 -0.02 -3.20 6.34 0.99 -1.93 -3.40 116.97 120.29 1j8m h TYR 137 Ca 0.00 -0.00 -0.53 0.00 2.00 0.00 0.00 58.73 60.20 1j8m h TYR 137 Cb 0.98 0.01 0.01 0.00 1.00 0.00 0.00 36.73 38.73 1j8m h TYR 137 CO 0.09 0.46 0.60 -0.98 -0.00 0.00 0.00 178.16 178.33 1j8m s ARG 138 N -2.03 4.42 0.03 4.88 1.70 -1.26 -4.90 118.95 121.80 1j8m s ARG 138 Ca -0.10 1.86 0.07 0.00 -0.47 0.00 0.00 55.73 57.09 1j8m s ARG 138 Cb -0.01 -3.30 -0.23 0.00 -0.57 0.00 0.00 34.95 30.83 1j8m s ARG 138 CO 0.35 -0.27 0.95 -1.00 -1.08 0.00 0.00 175.30 174.26 1j8m h PRO 139 N 6.52 0.05 -0.00 3.89 0.13 -1.86 -3.33 132.00 137.40 1j8m h PRO 139 Ca -0.42 -0.09 -0.09 0.00 -0.87 0.00 0.00 66.00 64.52 1j8m h PRO 139 Cb 1.21 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1j8m h PRO 139 CO 0.81 0.84 -0.44 0.00 -0.23 0.00 0.00 178.00 178.98 1j8m h ALA 140 N 0.88 1.27 -0.52 -0.56 0.00 -1.93 -3.30 119.26 115.11 1j8m h ALA 140 Ca -0.16 -0.40 0.10 0.00 0.00 0.00 0.00 54.91 54.45 1j8m h ALA 140 Cb 1.91 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 19.53 1j8m h ALA 140 CO 0.12 0.55 -0.13 0.00 0.00 0.00 0.00 179.25 179.79 1j8m h ALA 141 N 1.56 0.35 0.15 0.00 0.00 -1.84 -1.60 119.26 117.88 1j8m h ALA 141 Ca -0.00 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1j8m h ALA 141 Cb 0.78 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1j8m h ALA 141 CO 0.06 -0.44 -0.08 1.25 0.00 0.00 0.00 179.25 180.04 1j8m h LEU 142 N 0.00 -0.18 -0.57 0.00 5.85 -1.79 0.21 115.31 118.83 1j8m h LEU 142 Ca 0.25 0.01 0.07 0.00 0.84 0.00 0.00 57.88 59.04 1j8m h LEU 142 Cb 0.38 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.40 1j8m h LEU 142 CO -0.53 -0.13 0.26 -0.33 -0.34 0.00 0.00 178.44 177.37 1j8m h GLU 143 N -0.21 0.47 -0.21 1.25 5.08 -1.67 0.34 114.58 119.63 1j8m h GLU 143 Ca -0.02 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 1j8m h GLU 143 Cb 0.17 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 1j8m h GLU 143 CO 0.03 0.31 -0.04 0.37 -1.00 0.00 0.00 179.01 178.68 1j8m h GLN 144 N 0.49 0.01 -0.02 2.33 4.15 -1.07 0.16 115.11 121.16 1j8m h GLN 144 Ca 0.27 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.69 1j8m h GLN 144 Cb 0.24 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.93 1j8m h GLN 144 CO -0.22 0.01 0.01 1.25 -1.93 0.00 0.00 178.83 177.95 1j8m h LEU 145 N 0.01 0.02 -0.98 -2.39 6.46 -0.20 0.40 115.31 118.64 1j8m h LEU 145 Ca 0.10 -0.00 0.10 0.00 -0.12 0.00 0.00 57.88 57.96 1j8m h LEU 145 Cb 0.15 -0.01 -0.08 0.00 -0.73 0.00 0.00 40.66 40.00 1j8m h LEU 145 CO -0.21 0.02 0.62 1.56 -0.62 0.00 0.00 178.44 179.80 1j8m h GLN 146 N 0.02 0.99 -0.01 1.25 4.20 0.10 -0.76 115.11 120.90 1j8m h GLN 146 Ca 0.01 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 1j8m h GLN 146 Cb -0.00 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 27.55 1j8m h GLN 146 CO -0.00 0.66 0.00 1.96 -0.67 0.00 0.00 178.83 180.78 1j8m h GLN 147 N 1.02 0.02 -0.22 1.46 4.20 0.14 -2.03 115.11 119.70 1j8m h GLN 147 Ca 0.47 -0.00 0.06 0.00 0.06 0.00 0.00 58.65 59.23 1j8m h GLN 147 Cb 0.38 -0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.08 1j8m h GLN 147 CO -0.24 0.20 -0.31 -0.07 -0.67 0.00 0.00 178.83 177.74 1j8m h LEU 148 N -0.16 -0.99 -0.49 1.46 3.38 -0.77 -1.82 115.31 115.91 1j8m h LEU 148 Ca 0.00 0.16 0.08 0.00 0.09 0.00 0.00 57.88 58.21 1j8m h LEU 148 Cb 0.19 0.44 -0.07 0.00 0.09 0.00 0.00 40.66 41.31 1j8m h LEU 148 CO -0.00 -0.34 0.11 1.23 0.09 0.00 0.00 178.44 179.54 1j8m h GLY 149 N -0.34 0.60 0.99 0.83 0.00 -0.90 0.56 103.07 104.81 1j8m h GLY 149 Ca 0.12 -0.04 0.01 0.00 0.00 0.00 0.00 47.33 47.42 1j8m h GLY 149 CO -0.41 -0.05 0.54 -1.61 0.00 0.00 0.00 176.54 175.01 1j8m h GLN 150 N 0.26 1.06 0.00 4.80 5.75 -1.35 0.61 115.11 126.24 1j8m h GLN 150 Ca 0.24 -0.06 -0.10 0.00 -0.15 0.00 0.00 58.65 58.58 1j8m h GLN 150 Cb 0.31 -0.24 -0.01 0.00 1.07 0.00 0.00 27.48 28.60 1j8m h GLN 150 CO -0.30 0.70 -0.45 0.37 -2.65 0.00 0.00 178.83 176.50 1j8m h GLN 151 N 1.09 0.00 -0.16 1.69 5.75 -0.51 -3.20 115.11 119.78 1j8m h GLN 151 Ca 0.30 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.80 1j8m h GLN 151 Cb -0.11 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.44 1j8m h GLN 151 CO -0.07 0.45 0.00 0.44 -2.65 0.00 0.00 178.83 177.00 1j8m n ILE 152 N -3.72 0.45 -2.99 2.39 -5.35 0.11 -5.00 119.36 105.25 1j8m n ILE 152 Ca -0.01 -0.72 -0.13 0.00 -0.27 0.00 0.00 62.75 61.62 1j8m n ILE 152 Cb 0.52 0.90 0.04 0.00 -1.74 0.00 0.00 39.64 39.36 1j8m n ILE 152 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1j8m n GLY 153 N 0.55 0.11 3.20 3.28 0.00 0.11 -5.01 105.19 107.42 1j8m n GLY 153 Ca 0.08 -0.20 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 1j8m n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j8m s VAL 154 N -3.10 1.52 0.31 1.61 1.01 0.17 -5.01 120.40 116.91 1j8m s VAL 154 Ca 0.28 -0.86 -0.27 0.00 0.00 0.00 0.00 61.98 61.13 1j8m s VAL 154 Cb -0.12 -1.27 -0.09 0.00 0.00 0.00 0.00 36.38 34.89 1j8m s VAL 154 CO 0.35 0.39 1.00 -2.84 0.00 0.00 0.00 175.10 174.01 1j8m s PRO 155 N -0.54 4.56 -0.15 2.72 0.02 -1.26 -4.09 135.00 136.26 1j8m s PRO 155 Ca 0.07 1.51 0.01 0.00 0.02 0.00 0.00 61.00 62.61 1j8m s PRO 155 Cb -0.08 -2.94 0.02 0.00 0.02 0.00 0.00 34.50 31.53 1j8m s PRO 155 CO -0.00 0.22 -0.17 0.08 -0.33 0.00 0.00 177.00 176.80 1j8m s VAL 156 N -1.43 1.77 -0.05 3.83 1.01 -1.26 -0.73 120.40 123.55 1j8m s VAL 156 Ca 0.49 -0.77 -0.17 0.00 0.00 0.00 0.00 61.98 61.53 1j8m s VAL 156 Cb -0.24 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.46 1j8m s VAL 156 CO 0.30 0.49 0.45 -0.47 0.00 0.00 0.00 175.10 175.87 1j8m s TYR 157 N 1.31 3.63 -0.12 5.22 5.04 0.12 -4.97 117.35 127.57 1j8m s TYR 157 Ca 0.03 0.95 -0.30 0.00 -2.44 0.00 0.00 57.07 55.31 1j8m s TYR 157 Cb -0.13 -2.43 0.09 0.00 0.35 0.00 0.00 41.96 39.84 1j8m s TYR 157 CO -0.10 0.40 0.82 0.20 -1.34 0.00 0.00 175.55 175.53 1j8m s GLY 158 N -0.23 -0.44 -0.49 8.97 0.00 -1.26 -0.75 107.32 113.13 1j8m s GLY 158 Ca 0.25 1.73 0.01 0.00 0.00 0.00 0.00 44.72 46.71 1j8m s GLY 158 CO 0.12 1.12 0.25 -0.54 0.00 0.00 0.00 173.10 174.04 1j8m s GLU 159 N -0.92 2.01 0.16 2.90 2.02 -1.26 -5.05 118.70 118.56 1j8m s GLU 159 Ca -0.06 -2.32 -0.34 0.00 0.02 0.00 0.00 54.97 52.28 1j8m s GLU 159 Cb -0.01 -3.43 -0.15 0.00 0.10 0.00 0.00 34.13 30.64 1j8m s GLU 159 CO 0.05 -1.08 1.34 -2.30 0.02 0.00 0.00 175.26 173.29 1j8m n PRO 160 N 3.67 1.54 -0.28 0.39 -0.02 -1.26 -1.03 135.00 138.01 1j8m n PRO 160 Ca 0.04 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1j8m n PRO 160 Cb 0.37 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1j8m n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j8m n GLY 161 N 2.43 1.02 3.77 -1.23 0.00 -1.26 -4.99 105.19 104.93 1j8m n GLY 161 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1j8m n GLY 161 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j8m s GLU 162 N -0.21 4.01 0.00 1.61 2.56 -0.20 -4.96 118.70 121.52 1j8m s GLU 162 Ca 0.00 1.90 0.00 0.00 0.00 0.00 0.00 54.97 56.87 1j8m s GLU 162 Cb 0.00 -2.67 0.00 0.00 2.00 0.00 0.00 34.13 33.46 1j8m s GLU 162 CO 0.00 -0.38 0.32 1.63 -0.56 0.00 0.00 175.26 176.27 1j8m n LYS 163 N 0.04 1.57 -2.48 4.30 5.02 -1.26 -4.84 118.16 120.51 1j8m n LYS 163 Ca 0.04 -0.32 -0.40 0.00 -2.02 0.00 0.00 58.31 55.62 1j8m n LYS 163 Cb 0.46 -0.81 -0.03 0.00 -0.02 0.00 0.00 35.03 34.63 1j8m n LYS 163 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1j8m s ASP 164 N -0.32 6.17 0.30 4.39 2.15 -1.26 -4.80 116.67 123.31 1j8m s ASP 164 Ca 0.00 -0.83 -0.01 0.00 0.43 0.00 0.00 52.55 52.14 1j8m s ASP 164 Cb 0.00 -2.56 0.47 0.00 -0.30 0.00 0.00 42.92 40.53 1j8m s ASP 164 CO 0.00 -1.80 1.94 1.62 -0.17 0.00 0.00 175.17 176.76 1j8m h VAL 165 N 6.50 1.20 -0.43 1.11 3.04 -1.88 -1.82 116.25 123.97 1j8m h VAL 165 Ca -0.05 -0.48 -0.09 0.00 -1.01 0.00 0.00 66.70 65.06 1j8m h VAL 165 Cb 1.04 0.23 -0.02 0.00 -2.01 0.00 0.00 31.29 30.53 1j8m h VAL 165 CO 1.33 0.22 -0.10 0.58 -1.01 0.00 0.00 177.57 178.60 1j8m h VAL 166 N 0.97 1.25 -0.23 1.51 2.07 -1.93 -1.72 116.25 118.17 1j8m h VAL 166 Ca 0.25 -1.14 -0.18 0.00 0.82 0.00 0.00 66.70 66.46 1j8m h VAL 166 Cb -0.00 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1j8m h VAL 166 CO -0.04 0.39 -0.54 1.23 0.02 0.00 0.00 177.57 178.63 1j8m h GLY 167 N 0.97 0.86 0.81 2.17 0.00 -1.81 -1.12 103.07 104.95 1j8m h GLY 167 Ca 0.12 -1.05 0.02 0.00 0.00 0.00 0.00 47.33 46.43 1j8m h GLY 167 CO 0.03 0.94 -0.01 -2.22 0.00 0.00 0.00 176.54 175.28 1j8m h ILE 168 N 0.52 0.91 -0.78 2.60 2.04 -1.20 0.15 117.51 121.76 1j8m h ILE 168 Ca -0.00 -0.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.80 1j8m h ILE 168 Cb 1.15 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 1j8m h ILE 168 CO 0.12 0.01 0.30 0.00 0.00 0.00 0.00 178.15 178.58 1j8m h ALA 169 N 1.10 1.01 -0.10 1.87 0.00 -1.30 0.45 119.26 122.28 1j8m h ALA 169 Ca 0.05 -0.20 -0.19 0.00 0.00 0.00 0.00 54.91 54.58 1j8m h ALA 169 Cb 0.07 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.57 1j8m h ALA 169 CO -0.10 0.64 -0.67 -0.22 0.00 0.00 0.00 179.25 178.91 1j8m h LYS 170 N 1.13 0.63 -0.46 0.00 3.64 -1.11 0.29 116.57 120.70 1j8m h LYS 170 Ca 0.26 -0.54 -0.11 0.00 -1.27 0.00 0.00 60.65 58.99 1j8m h LYS 170 Cb 0.23 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1j8m h LYS 170 CO -0.02 1.16 -0.14 0.00 -2.27 0.00 0.00 179.45 178.18 1j8m h ARG 171 N 0.28 0.91 -0.42 1.90 3.08 -0.37 -1.36 114.38 118.39 1j8m h ARG 171 Ca -0.06 -0.36 -0.05 0.00 0.07 0.00 0.00 59.98 59.59 1j8m h ARG 171 Cb 1.32 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.30 1j8m h ARG 171 CO 0.14 1.01 0.07 0.78 -1.07 0.00 0.00 179.97 180.90 1j8m h GLY 172 N 0.75 0.75 0.97 0.04 0.00 -0.03 -0.92 103.07 104.63 1j8m h GLY 172 Ca 0.11 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 1j8m h GLY 172 CO 0.05 0.46 -0.08 -2.08 0.00 0.00 0.00 176.54 174.89 1j8m h VAL 173 N 0.55 0.86 -0.96 4.60 2.07 -0.81 -0.64 116.25 121.92 1j8m h VAL 173 Ca 0.13 -0.06 0.13 0.00 0.82 0.00 0.00 66.70 67.71 1j8m h VAL 173 Cb 0.37 0.90 -0.09 0.00 -1.52 0.00 0.00 31.29 30.95 1j8m h VAL 173 CO 0.01 0.02 0.58 -0.08 0.02 0.00 0.00 177.57 178.11 1j8m h GLU 174 N -0.25 0.86 -0.22 1.57 4.81 -1.12 0.11 114.58 120.34 1j8m h GLU 174 Ca -0.02 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.14 1j8m h GLU 174 Cb 0.19 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1j8m h GLU 174 CO 0.04 0.57 0.06 -0.22 -0.73 0.00 0.00 179.01 178.73 1j8m h LYS 175 N 0.89 0.34 -0.47 1.92 3.64 -0.70 -1.09 116.57 121.10 1j8m h LYS 175 Ca 0.49 -0.08 -0.06 0.00 -1.27 0.00 0.00 60.65 59.73 1j8m h LYS 175 Cb 0.54 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 1j8m h LYS 175 CO -0.29 0.44 0.03 0.74 -2.27 0.00 0.00 179.45 178.10 1j8m h PHE 176 N 0.17 0.79 -0.08 1.91 0.04 -0.66 0.38 116.94 119.49 1j8m h PHE 176 Ca 0.07 -0.10 -0.04 0.00 2.80 0.00 0.00 57.97 60.70 1j8m h PHE 176 Cb 0.25 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 1j8m h PHE 176 CO 0.01 0.72 -0.15 -0.07 -0.60 0.00 0.00 178.31 178.22 1j8m h LEU 177 N 0.71 0.12 -0.34 1.54 3.38 -0.68 -1.91 115.31 118.13 1j8m h LEU 177 Ca 0.15 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 1j8m h LEU 177 Cb 0.39 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1j8m h LEU 177 CO 0.01 0.29 -0.33 0.28 0.09 0.00 0.00 178.44 178.78 1j8m h SER 178 N 0.12 0.00 0.36 -0.43 0.02 0.36 -2.57 113.55 111.42 1j8m h SER 178 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1j8m h SER 178 Cb 0.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1j8m h SER 178 CO 0.02 0.33 -0.03 -0.62 -1.14 0.00 0.00 176.83 175.39 1j8m n GLU 179 N -3.25 0.67 -2.42 3.45 1.02 -0.40 -4.88 120.64 114.83 1j8m n GLU 179 Ca 0.02 -0.08 -0.14 0.00 -0.02 0.00 0.00 57.16 56.94 1j8m n GLU 179 Cb 0.60 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 1j8m n GLU 179 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1j8m n LYS 180 N -1.10 -1.76 -1.63 3.49 4.76 -0.79 -4.98 118.16 116.15 1j8m n LYS 180 Ca 0.17 0.62 -0.39 0.00 -2.87 0.00 0.00 58.31 55.84 1j8m n LYS 180 Cb 0.22 -4.84 0.04 0.00 -1.84 0.00 0.00 35.03 28.61 1j8m n LYS 180 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1j8m n MET 181 N -2.46 1.14 -0.00 1.97 2.81 -0.79 -4.97 117.12 114.82 1j8m n MET 181 Ca -0.13 0.43 -0.21 0.00 -1.81 0.00 0.00 57.70 55.97 1j8m n MET 181 Cb 0.61 -2.19 -0.14 0.00 -0.71 0.00 0.00 33.22 30.78 1j8m n MET 181 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1j8m n GLU 182 N -0.70 0.75 -5.01 0.03 1.02 0.45 -4.70 120.64 112.49 1j8m n GLU 182 Ca 0.12 0.27 -0.32 0.00 -0.02 0.00 0.00 57.16 57.20 1j8m n GLU 182 Cb 0.45 -1.71 -0.15 0.00 -0.02 0.00 0.00 31.44 30.01 1j8m n GLU 182 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1j8m s ILE 183 N -2.55 2.58 -0.15 -3.67 1.01 -0.59 0.26 121.20 118.08 1j8m s ILE 183 Ca -0.23 -0.85 -0.00 0.00 0.00 0.00 0.00 60.65 59.57 1j8m s ILE 183 Cb 0.07 -2.03 0.03 0.00 0.01 0.00 0.00 42.46 40.55 1j8m s ILE 183 CO 0.76 0.55 -0.08 -0.63 0.00 0.00 0.00 174.94 175.54 1j8m s ILE 184 N 0.15 1.21 -0.24 2.92 1.01 0.11 -0.89 121.20 125.47 1j8m s ILE 184 Ca -0.10 -0.58 -0.07 0.00 0.00 0.00 0.00 60.65 59.89 1j8m s ILE 184 Cb -0.16 -1.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.98 1j8m s ILE 184 CO 0.06 0.24 0.07 -0.63 0.00 0.00 0.00 174.94 174.68 1j8m s ILE 185 N 1.61 4.43 -0.25 2.92 1.01 -0.58 0.74 121.20 131.07 1j8m s ILE 185 Ca 0.02 -0.14 -0.04 0.00 0.00 0.00 0.00 60.65 60.49 1j8m s ILE 185 Cb -0.14 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.27 1j8m s ILE 185 CO -0.08 0.36 -0.01 -0.69 0.00 0.00 0.00 174.94 174.51 1j8m s VAL 186 N 1.40 3.45 -0.30 2.92 1.01 0.84 -0.05 120.40 129.67 1j8m s VAL 186 Ca 0.05 -0.65 -0.17 0.00 0.00 0.00 0.00 61.98 61.22 1j8m s VAL 186 Cb -0.15 -2.67 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 1j8m s VAL 186 CO 0.04 0.28 0.45 -0.62 0.00 0.00 0.00 175.10 175.25 1j8m s ASP 187 N 1.45 6.31 0.11 3.32 2.15 0.45 -0.42 116.67 130.05 1j8m s ASP 187 Ca 0.04 0.19 0.03 0.00 0.43 0.00 0.00 52.55 53.24 1j8m s ASP 187 Cb -0.16 -2.25 -0.04 0.00 -0.30 0.00 0.00 42.92 40.18 1j8m s ASP 187 CO -0.02 -0.32 -0.08 0.42 -0.17 0.00 0.00 175.17 175.00 1j8m s THR 188 N 2.23 0.85 0.00 1.71 -4.23 -0.83 -0.89 115.64 114.48 1j8m s THR 188 Ca 0.17 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 58.71 1j8m s THR 188 Cb -0.16 -1.73 0.00 0.00 1.34 0.00 0.00 72.50 71.96 1j8m s THR 188 CO 0.11 -0.83 0.00 0.00 -0.54 0.00 0.00 174.62 173.36 1j8m n ALA 189 N -0.08 0.57 0.00 3.99 0.00 -1.26 -4.27 120.51 119.47 1j8m n ALA 189 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1j8m n ALA 189 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 1j8m n ALA 189 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j8m n GLY 190 N 4.47 4.36 0.34 0.00 0.00 -1.23 -2.54 105.19 110.59 1j8m n GLY 190 Ca 0.00 -0.92 0.13 0.00 0.00 0.00 0.00 46.02 45.23 1j8m n GLY 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j8m n ARG 191 N -1.64 1.14 -4.32 1.61 5.12 -1.26 -4.35 116.66 112.96 1j8m n ARG 191 Ca 0.00 -0.67 -0.24 0.00 -1.93 0.00 0.00 57.85 55.01 1j8m n ARG 191 Cb 0.00 -1.49 -0.08 0.00 -1.16 0.00 0.00 32.46 29.73 1j8m n ARG 191 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 1j8m s HIS 192 N -2.32 2.59 0.31 -1.55 3.76 -1.26 -5.06 115.29 111.75 1j8m s HIS 192 Ca 0.29 -0.32 0.04 0.00 -0.15 0.00 0.00 55.06 54.92 1j8m s HIS 192 Cb 0.20 -1.29 0.04 0.00 1.11 0.00 0.00 32.58 32.64 1j8m s HIS 192 CO 0.45 0.57 0.37 0.41 -0.85 0.00 0.00 174.74 175.69 1j8m n GLY 193 N -0.89 2.24 3.74 -2.22 0.00 -1.26 -4.34 105.19 102.45 1j8m n GLY 193 Ca -0.05 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.36 1j8m n GLY 193 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1j8m s TYR 194 N -1.10 3.28 0.00 1.61 2.02 -1.26 -2.02 117.35 119.89 1j8m s TYR 194 Ca 0.28 1.28 0.00 0.00 -0.37 0.00 0.00 57.07 58.26 1j8m s TYR 194 Cb -0.02 -3.57 0.00 0.00 -0.40 0.00 0.00 41.96 37.97 1j8m s TYR 194 CO 0.18 -1.72 0.00 0.41 -1.57 0.00 0.00 175.55 172.85 1j8m n GLY 195 N 2.19 2.30 1.77 0.71 0.00 -1.26 -4.93 105.19 105.96 1j8m n GLY 195 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1j8m n GLY 195 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1j8m n GLU 196 N -1.34 2.80 -0.18 1.61 1.02 -0.86 -4.89 120.64 118.80 1j8m n GLU 196 Ca 0.00 -3.81 -0.03 0.00 -0.02 0.00 0.00 57.16 53.30 1j8m n GLU 196 Cb 0.00 -1.96 0.07 0.00 -0.02 0.00 0.00 31.44 29.53 1j8m n GLU 196 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1j8m h GLU 197 N 1.91 0.49 -0.64 3.49 3.07 -1.92 -1.16 114.58 119.82 1j8m h GLU 197 Ca 0.20 -0.03 0.04 0.00 -0.50 0.00 0.00 59.36 59.07 1j8m h GLU 197 Cb 1.40 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 29.16 1j8m h GLU 197 CO 0.49 0.32 0.38 0.00 -1.40 0.00 0.00 179.01 178.81 1j8m h ALA 198 N 1.31 0.84 -0.03 3.43 0.00 -1.96 -0.23 119.26 122.61 1j8m h ALA 198 Ca 0.25 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.98 1j8m h ALA 198 Cb 0.19 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1j8m h ALA 198 CO -0.19 0.11 -0.73 0.00 0.00 0.00 0.00 179.25 178.44 1j8m h ALA 199 N 1.29 0.70 0.57 0.00 0.00 -1.83 0.15 119.26 120.15 1j8m h ALA 199 Ca 0.27 -0.63 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 1j8m h ALA 199 Cb 0.07 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1j8m h ALA 199 CO -0.13 0.82 -0.27 1.25 0.00 0.00 0.00 179.25 180.93 1j8m h LEU 200 N 0.13 -0.64 -0.14 0.00 5.85 -0.68 -1.94 115.31 117.89 1j8m h LEU 200 Ca -0.02 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.70 1j8m h LEU 200 Cb 1.29 0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.46 1j8m h LEU 200 CO 0.11 -0.37 -0.07 -0.07 -0.34 0.00 0.00 178.44 177.71 1j8m h LEU 201 N -0.90 -0.22 -0.53 2.25 3.38 -0.87 -2.22 115.31 116.20 1j8m h LEU 201 Ca -0.08 0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.05 1j8m h LEU 201 Cb 0.63 0.12 -0.11 0.00 0.09 0.00 0.00 40.66 41.40 1j8m h LEU 201 CO 0.13 -0.09 -0.22 -0.08 0.09 0.00 0.00 178.44 178.27 1j8m h GLU 202 N -0.05 -0.09 -0.05 1.13 4.81 -0.69 -1.44 114.58 118.19 1j8m h GLU 202 Ca 0.08 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.33 1j8m h GLU 202 Cb 0.17 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 1j8m h GLU 202 CO -0.17 -0.06 0.07 1.49 -0.73 0.00 0.00 179.01 179.60 1j8m h GLU 203 N -0.10 0.00 0.00 1.92 4.81 -0.78 -0.45 114.58 119.99 1j8m h GLU 203 Ca 0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1j8m h GLU 203 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1j8m h GLU 203 CO -0.60 0.00 0.00 0.52 -0.73 0.00 0.00 179.01 178.20 1j8m h MET 204 N 0.00 0.00 -0.87 1.92 2.86 -0.71 -3.37 114.93 114.76 1j8m h MET 204 Ca 0.02 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.65 1j8m h MET 204 Cb 0.16 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.78 1j8m h MET 204 CO -0.00 0.00 0.48 -0.22 1.06 0.00 0.00 176.91 178.23 1j8m h LYS 205 N 0.00 1.21 0.00 1.72 3.64 -1.11 -2.46 116.57 119.57 1j8m h LYS 205 Ca 0.00 -0.14 -0.16 0.00 -1.27 0.00 0.00 60.65 59.09 1j8m h LYS 205 Cb 0.64 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 1j8m h LYS 205 CO 0.00 0.88 -0.96 -0.91 -2.27 0.00 0.00 179.45 176.19 1j8m h ASN 206 N 1.22 0.00 -0.22 4.20 4.21 -1.77 -2.28 115.58 120.93 1j8m h ASN 206 Ca 0.31 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.79 1j8m h ASN 206 Cb 0.02 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.21 1j8m h ASN 206 CO -0.05 0.66 0.03 0.16 -1.29 0.00 0.00 177.43 176.94 1j8m h ILE 207 N 0.00 1.23 -0.28 2.81 3.07 -1.75 -1.88 117.51 120.72 1j8m h ILE 207 Ca -0.07 -0.79 0.03 0.00 1.55 0.00 0.00 64.86 65.58 1j8m h ILE 207 Cb 1.57 1.32 -0.03 0.00 -0.27 0.00 0.00 36.82 39.41 1j8m h ILE 207 CO 0.07 0.25 0.09 0.22 -1.05 0.00 0.00 178.15 177.73 1j8m h TYR 208 N 0.17 0.17 -0.73 0.16 5.03 -1.29 -0.24 116.97 120.24 1j8m h TYR 208 Ca 0.07 0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.40 1j8m h TYR 208 Cb 0.34 -0.04 -0.04 0.00 1.55 0.00 0.00 36.73 38.55 1j8m h TYR 208 CO 0.02 0.08 0.48 0.93 -1.32 0.00 0.00 178.16 178.35 1j8m h GLU 209 N 0.22 0.94 -0.36 1.82 4.39 -1.44 0.94 114.58 121.10 1j8m h GLU 209 Ca 0.12 -0.06 -0.10 0.00 0.34 0.00 0.00 59.36 59.66 1j8m h GLU 209 Cb 0.09 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 1j8m h GLU 209 CO -0.13 0.62 -0.21 0.00 -1.16 0.00 0.00 179.01 178.14 1j8m h ALA 210 N 1.55 0.97 0.00 3.43 0.00 -0.20 -3.32 119.26 121.69 1j8m h ALA 210 Ca 0.27 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1j8m h ALA 210 Cb -0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1j8m h ALA 210 CO -0.06 0.60 -1.74 -0.89 0.00 0.00 0.00 179.25 177.16 1j8m n ILE 211 N -4.13 0.31 -3.87 0.00 -0.00 -0.76 -4.87 119.36 106.04 1j8m n ILE 211 Ca 0.00 -0.41 -0.38 0.00 -0.00 0.00 0.00 62.75 61.97 1j8m n ILE 211 Cb 0.41 -0.11 0.03 0.00 -0.00 0.00 0.00 39.64 39.97 1j8m n ILE 211 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 1j8m n LYS 212 N -2.16 -0.75 -1.35 0.38 5.02 0.32 -4.89 118.16 114.73 1j8m n LYS 212 Ca -0.09 0.31 -0.32 0.00 -2.02 0.00 0.00 58.31 56.18 1j8m n LYS 212 Cb 0.56 -3.24 0.09 0.00 -0.02 0.00 0.00 35.03 32.42 1j8m n LYS 212 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1j8m s PRO 213 N -6.57 2.16 0.34 1.97 0.04 -1.26 -4.93 135.00 126.75 1j8m s PRO 213 Ca 0.45 1.46 0.18 0.00 0.04 0.00 0.00 61.00 63.12 1j8m s PRO 213 Cb -0.21 -1.87 0.31 0.00 0.04 0.00 0.00 34.50 32.77 1j8m s PRO 213 CO 0.92 -1.75 1.56 -0.44 0.04 0.00 0.00 177.00 177.32 1j8m h ASP 214 N -0.70 0.00 -3.61 6.66 3.32 -1.60 -3.46 116.42 117.04 1j8m h ASP 214 Ca -0.45 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.46 1j8m h ASP 214 Cb 1.26 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.55 1j8m h ASP 214 CO 0.50 0.37 -0.33 -0.70 -1.72 0.00 0.00 179.24 177.37 1j8m s GLU 215 N -3.16 0.38 -0.11 3.56 2.12 -1.02 -4.88 118.70 115.59 1j8m s GLU 215 Ca 0.04 0.58 0.00 0.00 0.36 0.00 0.00 54.97 55.95 1j8m s GLU 215 Cb 0.08 0.09 -0.02 0.00 0.26 0.00 0.00 34.13 34.54 1j8m s GLU 215 CO 0.71 -0.10 -0.10 0.08 -0.54 0.00 0.00 175.26 175.31 1j8m s VAL 216 N 0.69 3.33 -0.14 3.70 1.01 -0.77 -0.99 120.40 127.22 1j8m s VAL 216 Ca -0.04 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 1j8m s VAL 216 Cb -0.05 -2.38 0.04 0.00 0.00 0.00 0.00 36.38 33.98 1j8m s VAL 216 CO -0.05 0.54 -0.04 -0.89 0.00 0.00 0.00 175.10 174.67 1j8m s THR 217 N -0.06 0.91 -0.13 3.92 2.01 0.18 -1.01 115.64 121.45 1j8m s THR 217 Ca -0.01 -0.40 -0.22 0.00 0.31 0.00 0.00 61.69 61.37 1j8m s THR 217 Cb -0.14 -1.07 -0.03 0.00 0.01 0.00 0.00 72.50 71.27 1j8m s THR 217 CO 0.03 0.19 0.64 -0.22 -0.69 0.00 0.00 174.62 174.58 1j8m s LEU 218 N 1.73 4.24 -0.26 4.42 2.96 0.74 -1.23 118.68 131.29 1j8m s LEU 218 Ca 0.03 1.00 -0.10 0.00 -0.22 0.00 0.00 54.13 54.83 1j8m s LEU 218 Cb -0.14 -2.96 -0.05 0.00 0.50 0.00 0.00 46.19 43.55 1j8m s LEU 218 CO -0.07 -0.17 0.15 -0.69 -1.32 0.00 0.00 176.35 174.25 1j8m s VAL 219 N 1.24 5.14 -0.10 1.68 1.01 -0.60 -0.88 120.40 127.88 1j8m s VAL 219 Ca 0.32 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.44 1j8m s VAL 219 Cb -0.16 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.79 1j8m s VAL 219 CO 0.14 0.31 -0.19 -0.63 0.00 0.00 0.00 175.10 174.72 1j8m s ILE 220 N 1.43 2.55 0.01 2.22 1.01 -0.20 -4.48 121.20 123.74 1j8m s ILE 220 Ca 0.07 -0.85 -0.30 0.00 0.00 0.00 0.00 60.65 59.57 1j8m s ILE 220 Cb -0.15 -2.02 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 1j8m s ILE 220 CO 0.07 0.55 0.99 -0.62 0.00 0.00 0.00 174.94 175.93 1j8m s ASP 221 N 0.20 7.35 0.23 3.58 3.68 -1.26 -0.63 116.67 129.82 1j8m s ASP 221 Ca -0.11 1.69 0.17 0.00 2.13 0.00 0.00 52.55 56.43 1j8m s ASP 221 Cb -0.16 -2.57 0.88 0.00 -1.45 0.00 0.00 42.92 39.62 1j8m s ASP 221 CO 0.06 -0.27 1.53 0.00 0.13 0.00 0.00 175.17 176.63 1j8m n ALA 222 N 3.85 1.17 1.84 3.66 0.00 -0.06 -1.83 120.51 129.14 1j8m n ALA 222 Ca 0.06 0.13 0.16 0.00 0.00 0.00 0.00 53.44 53.79 1j8m n ALA 222 Cb 0.51 -1.26 0.87 0.00 0.00 0.00 0.00 19.45 19.56 1j8m n ALA 222 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1j8m n SER 223 N -2.07 0.13 0.22 0.00 3.41 -1.26 -1.99 113.62 112.06 1j8m n SER 223 Ca -0.00 -0.87 0.11 0.00 -0.26 0.00 0.00 58.87 57.85 1j8m n SER 223 Cb 0.07 -0.05 0.39 0.00 -0.26 0.00 0.00 64.21 64.35 1j8m n SER 223 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1j8m h ILE 224 N 0.20 0.33 0.00 -1.33 6.09 -1.71 -3.47 117.51 117.61 1j8m h ILE 224 Ca 0.00 -1.09 0.00 0.00 -1.37 0.00 0.00 64.86 62.40 1j8m h ILE 224 Cb 0.10 1.85 0.00 0.00 0.47 0.00 0.00 36.82 39.24 1j8m h ILE 224 CO 0.00 0.15 0.00 0.61 -3.07 0.00 0.00 178.15 175.84 1j8m n GLY 225 N 0.50 2.02 0.13 8.18 0.00 -0.84 -2.50 105.19 112.67 1j8m n GLY 225 Ca 0.01 -0.57 0.12 0.00 0.00 0.00 0.00 46.02 45.58 1j8m n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j8m n GLN 226 N 12.45 0.19 0.00 1.61 10.64 -1.23 -1.66 117.38 139.37 1j8m n GLN 226 Ca 0.00 0.45 0.11 0.00 -1.83 0.00 0.00 57.00 55.73 1j8m n GLN 226 Cb 0.00 -1.88 0.60 0.00 -0.86 0.00 0.00 30.24 28.10 1j8m n GLN 226 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1j8m n LYS 227 N -2.24 0.57 0.11 2.61 5.02 -1.04 -1.93 118.16 121.26 1j8m n LYS 227 Ca 0.02 0.02 0.12 0.00 -2.02 0.00 0.00 58.31 56.45 1j8m n LYS 227 Cb 0.20 -1.50 0.45 0.00 -0.02 0.00 0.00 35.03 34.16 1j8m n LYS 227 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j8m n ALA 228 N -1.07 1.96 -0.02 7.82 0.00 -0.67 -3.97 120.51 124.56 1j8m n ALA 228 Ca 0.14 0.03 -0.12 0.00 0.00 0.00 0.00 53.44 53.49 1j8m n ALA 228 Cb 0.10 -1.42 -0.06 0.00 0.00 0.00 0.00 19.45 18.07 1j8m n ALA 228 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1j8m h TYR 229 N 0.00 -1.19 0.00 0.00 3.20 -1.63 -1.01 116.97 116.34 1j8m h TYR 229 Ca 0.00 0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.93 1j8m h TYR 229 Cb 0.53 0.55 -0.01 0.00 1.54 0.00 0.00 36.73 39.33 1j8m h TYR 229 CO 0.00 -0.47 -0.06 -0.44 -1.64 0.00 0.00 178.16 175.55 1j8m h ASP 230 N -0.46 -0.18 -0.25 -2.11 3.45 -1.84 0.12 116.42 115.16 1j8m h ASP 230 Ca 0.09 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.58 1j8m h ASP 230 Cb 0.61 0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 39.45 1j8m h ASP 230 CO -0.43 -0.09 0.16 0.25 -1.57 0.00 0.00 179.24 177.56 1j8m h LEU 231 N -0.11 0.27 -0.63 1.55 5.85 -1.79 -1.19 115.31 119.26 1j8m h LEU 231 Ca 0.03 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1j8m h LEU 231 Cb 0.14 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1j8m h LEU 231 CO -0.06 0.20 0.41 0.00 -0.34 0.00 0.00 178.44 178.64 1j8m h ALA 232 N 1.09 0.80 0.08 1.25 0.00 -0.88 0.86 119.26 122.46 1j8m h ALA 232 Ca 0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1j8m h ALA 232 Cb -0.03 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1j8m h ALA 232 CO -0.03 0.24 -0.04 1.03 0.00 0.00 0.00 179.25 180.45 1j8m h SER 233 N 0.85 -0.10 -0.04 0.00 0.87 -0.57 -0.78 113.55 113.79 1j8m h SER 233 Ca 0.23 -0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.68 1j8m h SER 233 Cb -0.09 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 1j8m h SER 233 CO -0.05 -0.04 -0.23 0.11 -0.53 0.00 0.00 176.83 176.09 1j8m h LYS 234 N -0.14 0.44 -0.31 2.24 1.79 -0.89 -2.41 116.57 117.30 1j8m h LYS 234 Ca -0.01 -0.16 -0.00 0.00 -2.18 0.00 0.00 60.65 58.30 1j8m h LYS 234 Cb 0.11 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 1j8m h LYS 234 CO 0.02 0.65 0.18 0.35 -1.08 0.00 0.00 179.45 179.57 1j8m h PHE 235 N 0.40 0.41 -0.31 -1.35 3.57 0.10 -2.97 116.94 116.79 1j8m h PHE 235 Ca 0.06 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.46 1j8m h PHE 235 Cb 0.63 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1j8m h PHE 235 CO 0.02 0.31 -0.22 -0.97 -2.23 0.00 0.00 178.31 175.22 1j8m h ASN 236 N 0.39 0.58 0.12 0.41 -1.24 -0.97 -2.66 115.58 112.22 1j8m h ASN 236 Ca 0.11 -0.19 -0.14 0.00 0.71 0.00 0.00 56.30 56.78 1j8m h ASN 236 Cb 0.02 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 38.91 1j8m h ASN 236 CO -0.02 0.80 -0.51 1.56 -1.29 0.00 0.00 177.43 177.97 1j8m h GLN 237 N 0.52 0.44 0.00 6.67 4.20 -1.39 -3.29 115.11 122.25 1j8m h GLN 237 Ca 0.08 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.52 1j8m h GLN 237 Cb 0.66 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.46 1j8m h GLN 237 CO 0.05 0.85 -0.02 0.00 -0.67 0.00 0.00 178.83 179.03 1j8m h ALA 238 N 1.11 1.05 -2.50 3.87 0.00 -1.31 -3.44 119.26 118.03 1j8m h ALA 238 Ca 0.01 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1j8m h ALA 238 Cb 1.02 -0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.65 1j8m h ALA 238 CO 0.09 0.03 -0.44 -1.54 0.00 0.00 0.00 179.25 177.40 1j8m s SER 239 N -5.58 0.15 0.00 0.00 1.04 -1.20 -4.98 113.70 103.13 1j8m s SER 239 Ca -0.02 -0.61 0.27 0.00 0.48 0.00 0.00 55.95 56.07 1j8m s SER 239 Cb 0.11 0.29 0.81 0.00 0.10 0.00 0.00 66.02 67.33 1j8m s SER 239 CO 0.50 -0.64 1.61 1.17 0.98 0.00 0.00 173.24 176.86 1j8m n LYS 240 N 0.26 0.32 -0.52 4.02 4.81 -1.26 -3.96 118.16 121.83 1j8m n LYS 240 Ca -0.16 -0.16 0.04 0.00 -0.87 0.00 0.00 58.31 57.16 1j8m n LYS 240 Cb 0.61 -1.50 0.20 0.00 0.02 0.00 0.00 35.03 34.36 1j8m n LYS 240 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 1j8m n ILE 241 N -1.20 2.27 -3.35 3.15 -5.35 -1.26 -5.04 119.36 108.58 1j8m n ILE 241 Ca 0.09 -2.59 -0.38 0.00 -0.27 0.00 0.00 62.75 59.60 1j8m n ILE 241 Cb 0.33 -0.27 -0.06 0.00 -1.74 0.00 0.00 39.64 37.90 1j8m n ILE 241 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1j8m s GLY 242 N -2.67 2.52 0.29 3.28 0.00 -1.25 -1.85 107.32 107.63 1j8m s GLY 242 Ca 0.40 -0.12 0.02 0.00 0.00 0.00 0.00 44.72 45.02 1j8m s GLY 242 CO 0.01 0.49 0.11 -0.51 0.00 0.00 0.00 173.10 173.20 1j8m s THR 243 N -0.45 0.58 -0.01 0.90 -4.23 -0.18 -4.66 115.64 107.59 1j8m s THR 243 Ca 0.27 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.81 1j8m s THR 243 Cb -0.17 -2.60 -0.01 0.00 1.34 0.00 0.00 72.50 71.06 1j8m s THR 243 CO 0.14 0.00 -0.10 -0.63 -0.54 0.00 0.00 174.62 173.49 1j8m s ILE 244 N -3.61 0.80 -0.11 2.99 1.01 -0.08 -0.18 121.20 122.00 1j8m s ILE 244 Ca 0.36 -0.42 0.02 0.00 0.00 0.00 0.00 60.65 60.61 1j8m s ILE 244 Cb 0.07 -0.68 -0.01 0.00 0.01 0.00 0.00 42.46 41.86 1j8m s ILE 244 CO 0.15 0.23 -0.20 -0.63 0.00 0.00 0.00 174.94 174.49 1j8m s ILE 245 N -0.16 2.44 -0.26 2.92 1.01 -0.06 -1.24 121.20 125.84 1j8m s ILE 245 Ca 0.03 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 59.70 1j8m s ILE 245 Cb -0.05 -1.97 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 1j8m s ILE 245 CO -0.00 0.55 0.12 -0.63 0.00 0.00 0.00 174.94 174.97 1j8m s ILE 246 N 0.37 4.75 0.37 2.92 -1.09 -0.96 -1.03 121.20 126.53 1j8m s ILE 246 Ca -0.15 -0.02 0.08 0.00 -2.23 0.00 0.00 60.65 58.32 1j8m s ILE 246 Cb -0.17 -3.24 -0.03 0.00 -1.58 0.00 0.00 42.46 37.44 1j8m s ILE 246 CO 0.07 0.30 0.28 0.42 -1.23 0.00 0.00 174.94 174.78 1j8m s THR 247 N 1.67 3.08 -1.30 2.92 -4.23 0.20 0.22 115.64 118.20 1j8m s THR 247 Ca 0.07 -1.45 -0.04 0.00 -1.18 0.00 0.00 61.69 59.09 1j8m s THR 247 Cb -0.15 -3.07 0.01 0.00 1.34 0.00 0.00 72.50 70.62 1j8m s THR 247 CO 0.07 -0.11 1.01 0.29 -0.54 0.00 0.00 174.62 175.33 1j8m n LYS 248 N -1.37 -6.67 0.28 3.99 5.02 -0.91 -0.89 118.16 117.61 1j8m n LYS 248 Ca -0.00 0.78 0.16 0.00 -2.02 0.00 0.00 58.31 57.23 1j8m n LYS 248 Cb 0.61 -5.73 0.79 0.00 -0.02 0.00 0.00 35.03 30.68 1j8m n LYS 248 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1j8m h MET 249 N -2.16 0.00 -0.01 1.97 2.86 -1.31 -2.22 114.93 114.06 1j8m h MET 249 Ca -0.59 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.05 1j8m h MET 249 Cb 1.36 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.02 1j8m h MET 249 CO 0.54 0.07 -0.18 -0.25 1.06 0.00 0.00 176.91 178.16 1j8m n ASP 250 N -3.37 1.22 -1.24 1.22 10.43 -1.19 -4.14 116.55 119.49 1j8m n ASP 250 Ca -0.01 -1.10 0.04 0.00 2.57 0.00 0.00 54.79 56.28 1j8m n ASP 250 Cb 0.24 0.10 0.27 0.00 1.84 0.00 0.00 41.12 43.57 1j8m n ASP 250 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1j8m n GLY 251 N 1.29 4.02 3.23 0.44 0.00 -0.83 -4.95 105.19 108.38 1j8m n GLY 251 Ca 0.14 -1.06 -0.09 0.00 0.00 0.00 0.00 46.02 45.01 1j8m n GLY 251 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j8m s THR 252 N -2.93 0.10 -1.18 2.61 -4.23 -1.26 -4.95 115.64 103.81 1j8m s THR 252 Ca 0.46 -1.61 0.23 0.00 -1.18 0.00 0.00 61.69 59.59 1j8m s THR 252 Cb 0.38 -1.85 -0.10 0.00 1.34 0.00 0.00 72.50 72.27 1j8m s THR 252 CO 0.09 -0.46 1.12 0.00 -0.54 0.00 0.00 174.62 174.83 1j8m n ALA 253 N -0.12 4.15 -0.42 3.99 0.00 -1.26 -4.29 120.51 122.56 1j8m n ALA 253 Ca -0.08 -0.52 0.09 0.00 0.00 0.00 0.00 53.44 52.93 1j8m n ALA 253 Cb 0.63 -0.90 0.28 0.00 0.00 0.00 0.00 19.45 19.46 1j8m n ALA 253 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1j8m n LYS 254 N -1.26 3.06 0.25 0.00 5.02 -1.26 -4.23 118.16 119.73 1j8m n LYS 254 Ca 0.06 -2.55 0.09 0.00 -2.02 0.00 0.00 58.31 53.89 1j8m n LYS 254 Cb 0.35 -1.58 0.66 0.00 -0.02 0.00 0.00 35.03 34.44 1j8m n LYS 254 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1j8m h GLY 255 N 3.36 0.00 1.78 0.72 0.00 -1.75 -1.51 103.07 105.68 1j8m h GLY 255 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1j8m h GLY 255 CO 0.08 0.00 -0.38 -1.33 0.00 0.00 0.00 176.54 174.91 1j8m h GLY 256 N 0.00 0.26 0.89 4.60 0.00 -1.79 0.26 103.07 107.30 1j8m h GLY 256 Ca 0.01 -0.24 -0.09 0.00 0.00 0.00 0.00 47.33 47.01 1j8m h GLY 256 CO -0.00 0.22 -0.20 -1.33 0.00 0.00 0.00 176.54 175.23 1j8m h GLY 257 N 1.17 0.64 0.90 4.60 0.00 -0.01 -0.34 103.07 110.04 1j8m h GLY 257 Ca 0.02 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 1j8m h GLY 257 CO 0.06 0.57 0.10 0.00 0.00 0.00 0.00 176.54 177.27 1j8m h ALA 258 N 0.70 0.35 -0.37 3.60 0.00 -0.85 0.05 119.26 122.75 1j8m h ALA 258 Ca 0.05 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1j8m h ALA 258 Cb 0.75 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1j8m h ALA 258 CO 0.05 -0.04 0.01 -0.07 0.00 0.00 0.00 179.25 179.20 1j8m h LEU 259 N 0.28 0.63 -1.31 0.00 4.07 -0.40 -0.23 115.31 118.36 1j8m h LEU 259 Ca 0.09 -0.30 -0.07 0.00 0.08 0.00 0.00 57.88 57.67 1j8m h LEU 259 Cb 0.20 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 41.76 1j8m h LEU 259 CO -0.01 0.78 -0.35 0.77 -1.08 0.00 0.00 178.44 178.56 1j8m h SER 260 N 0.46 0.00 0.16 -0.43 4.64 -0.97 0.38 113.55 117.79 1j8m h SER 260 Ca 0.10 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.14 1j8m h SER 260 Cb 0.45 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.56 1j8m h SER 260 CO 0.02 0.35 -1.16 0.00 -0.87 0.00 0.00 176.83 175.17 1j8m h ALA 261 N 1.65 0.09 -0.38 5.18 0.00 -0.72 -0.63 119.26 124.46 1j8m h ALA 261 Ca -0.00 -0.75 -0.11 0.00 0.00 0.00 0.00 54.91 54.04 1j8m h ALA 261 Cb 0.62 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1j8m h ALA 261 CO 0.04 0.73 -0.20 0.28 0.00 0.00 0.00 179.25 180.10 1j8m h VAL 262 N 0.29 1.28 -0.34 0.00 2.07 -0.61 -2.72 116.25 116.22 1j8m h VAL 262 Ca -0.16 -1.34 -0.04 0.00 0.82 0.00 0.00 66.70 65.99 1j8m h VAL 262 Cb 1.82 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 32.91 1j8m h VAL 262 CO 0.22 0.44 0.06 0.00 0.02 0.00 0.00 177.57 178.31 1j8m h ALA 263 N 0.79 1.47 -0.02 1.67 0.00 -0.11 -0.97 119.26 122.10 1j8m h ALA 263 Ca 0.08 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1j8m h ALA 263 Cb 0.76 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1j8m h ALA 263 CO 0.06 0.38 0.07 0.00 0.00 0.00 0.00 179.25 179.76 1j8m h ALA 264 N 1.58 1.23 0.00 0.00 0.00 -0.78 -0.71 119.26 120.59 1j8m h ALA 264 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1j8m h ALA 264 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1j8m h ALA 264 CO 0.00 -0.08 -0.23 1.79 0.00 0.00 0.00 179.25 180.73 1j8m h THR 265 N 0.00 0.00 0.00 0.00 1.35 -1.20 -3.48 112.91 109.58 1j8m h THR 265 Ca 0.01 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1j8m h THR 265 Cb 0.15 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 1j8m h THR 265 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1j8m n GLY 266 N 1.28 0.84 3.76 5.82 0.00 -0.27 -4.98 105.19 111.64 1j8m n GLY 266 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1j8m n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j8m s ALA 267 N -3.30 2.18 -0.36 4.61 0.00 -1.25 -4.96 121.76 118.69 1j8m s ALA 267 Ca 0.00 0.25 -0.28 0.00 0.00 0.00 0.00 51.96 51.93 1j8m s ALA 267 Cb 0.00 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.87 1j8m s ALA 267 CO 0.00 -1.84 1.04 0.99 0.00 0.00 0.00 175.76 175.95 1j8m s THR 268 N -2.90 4.48 -0.53 0.00 2.01 -1.26 -4.81 115.64 112.63 1j8m s THR 268 Ca 0.61 1.51 -0.18 0.00 0.31 0.00 0.00 61.69 63.94 1j8m s THR 268 Cb -0.17 -4.42 0.08 0.00 0.01 0.00 0.00 72.50 68.00 1j8m s THR 268 CO 0.56 -0.58 0.62 -0.63 -0.69 0.00 0.00 174.62 173.91 1j8m s ILE 269 N 3.72 4.91 0.08 1.82 1.01 -1.26 -0.91 121.20 130.58 1j8m s ILE 269 Ca 0.44 -0.79 0.07 0.00 0.00 0.00 0.00 60.65 60.37 1j8m s ILE 269 Cb -0.11 -4.35 -0.22 0.00 0.01 0.00 0.00 42.46 37.79 1j8m s ILE 269 CO 0.19 -0.90 1.13 0.50 0.00 0.00 0.00 174.94 175.87 1j8m h LYS 270 N 9.03 0.03 -3.88 2.79 3.64 -1.48 -3.41 116.57 123.28 1j8m h LYS 270 Ca -0.28 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 58.94 1j8m h LYS 270 Cb 1.09 0.02 -0.16 0.00 -0.41 0.00 0.00 32.23 32.77 1j8m h LYS 270 CO 1.01 0.92 -0.52 -0.06 -2.27 0.00 0.00 179.45 178.52 1j8m s PHE 271 N -2.68 0.25 0.05 1.91 0.08 -1.24 -1.37 117.98 114.98 1j8m s PHE 271 Ca -0.01 -0.62 0.08 0.00 0.12 0.00 0.00 56.93 56.50 1j8m s PHE 271 Cb 0.09 -0.17 -0.03 0.00 -0.57 0.00 0.00 43.02 42.34 1j8m s PHE 271 CO 0.83 -0.40 -0.22 -1.50 -0.10 0.00 0.00 175.22 173.82 1j8m s ILE 272 N -3.10 1.79 -0.24 0.64 2.07 -0.47 -2.26 121.20 119.63 1j8m s ILE 272 Ca -0.01 -1.27 -0.12 0.00 -1.41 0.00 0.00 60.65 57.84 1j8m s ILE 272 Cb 0.02 -1.55 -0.05 0.00 0.13 0.00 0.00 42.46 41.01 1j8m s ILE 272 CO -0.07 0.23 0.23 -0.83 -1.91 0.00 0.00 174.94 172.59 1j8m s GLY 273 N -1.24 1.98 -0.01 1.50 0.00 0.13 -1.32 107.32 108.36 1j8m s GLY 273 Ca 0.08 -0.86 -0.01 0.00 0.00 0.00 0.00 44.72 43.93 1j8m s GLY 273 CO 0.02 0.58 -0.02 -1.30 0.00 0.00 0.00 173.10 172.38 1j8m n THR 274 N 4.54 0.10 -3.43 0.90 -2.24 -0.88 -1.46 114.28 111.81 1j8m n THR 274 Ca -0.13 0.48 0.00 0.00 -2.27 0.00 0.00 64.05 62.13 1j8m n THR 274 Cb 0.52 -1.56 0.00 0.00 -2.10 0.00 0.00 70.33 67.19 1j8m n THR 274 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j8m n GLY 275 N 1.58 3.19 0.05 3.38 0.00 -1.26 -3.13 105.19 108.99 1j8m n GLY 275 Ca -0.01 -2.16 0.13 0.00 0.00 0.00 0.00 46.02 43.98 1j8m n GLY 275 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1j8m n GLU 276 N -0.47 0.17 -2.35 1.61 1.02 -1.26 -4.75 120.64 114.61 1j8m n GLU 276 Ca 0.00 0.09 -0.38 0.00 -0.02 0.00 0.00 57.16 56.85 1j8m n GLU 276 Cb 0.00 -1.64 -0.02 0.00 -0.02 0.00 0.00 31.44 29.75 1j8m n GLU 276 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1j8m s LYS 277 N -3.08 4.09 0.44 3.49 1.02 -1.26 -4.93 119.74 119.50 1j8m s LYS 277 Ca 0.10 1.76 0.18 0.00 0.02 0.00 0.00 55.97 58.03 1j8m s LYS 277 Cb 0.15 -2.66 1.11 0.00 -0.52 0.00 0.00 37.83 35.92 1j8m s LYS 277 CO 0.65 -0.27 1.90 0.97 -0.92 0.00 0.00 175.35 177.68 1j8m h ILE 278 N 2.31 0.74 -0.07 2.17 6.09 -1.98 0.10 117.51 126.88 1j8m h ILE 278 Ca -0.49 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 62.88 1j8m h ILE 278 Cb 1.23 0.35 0.00 0.00 0.47 0.00 0.00 36.82 38.87 1j8m h ILE 278 CO 0.63 0.06 0.00 -0.90 -3.07 0.00 0.00 178.15 174.87 1j8m n ASP 279 N -4.47 1.67 -4.24 2.19 5.75 -1.26 -4.57 116.55 111.62 1j8m n ASP 279 Ca 0.16 -1.60 -0.43 0.00 -0.01 0.00 0.00 54.79 52.91 1j8m n ASP 279 Cb 0.61 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.67 1j8m n ASP 279 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1j8m n GLU 280 N 0.31 3.39 -3.72 0.11 1.02 0.36 -4.80 120.64 117.32 1j8m n GLU 280 Ca 0.18 -3.59 -0.15 0.00 -0.02 0.00 0.00 57.16 53.58 1j8m n GLU 280 Cb 0.37 -3.08 -0.15 0.00 -0.02 0.00 0.00 31.44 28.56 1j8m n GLU 280 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1j8m s LEU 281 N 1.39 0.42 0.11 -4.62 2.96 -1.26 -2.08 118.68 115.60 1j8m s LEU 281 Ca 0.43 0.30 0.06 0.00 -0.22 0.00 0.00 54.13 54.71 1j8m s LEU 281 Cb 0.03 0.31 -0.04 0.00 0.50 0.00 0.00 46.19 47.00 1j8m s LEU 281 CO 0.01 -0.19 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.10 1j8m s GLU 282 N 1.61 0.99 0.10 1.98 2.02 -0.43 -4.99 118.70 119.98 1j8m s GLU 282 Ca -0.04 -1.19 -0.29 0.00 0.02 0.00 0.00 54.97 53.47 1j8m s GLU 282 Cb -0.12 -0.91 -0.06 0.00 0.10 0.00 0.00 34.13 33.14 1j8m s GLU 282 CO -0.06 0.18 0.91 0.08 0.02 0.00 0.00 175.26 176.39 1j8m s VAL 283 N -1.95 4.55 -0.19 2.63 1.01 -1.26 -1.37 120.40 123.82 1j8m s VAL 283 Ca 0.07 1.96 -0.08 0.00 0.00 0.00 0.00 61.98 63.92 1j8m s VAL 283 Cb -0.06 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.01 1j8m s VAL 283 CO 0.03 0.34 0.08 0.12 0.00 0.00 0.00 175.10 175.67 1j8m s PHE 284 N -0.05 3.30 -0.17 5.22 5.36 -0.47 -4.86 117.98 126.30 1j8m s PHE 284 Ca 0.45 0.15 -0.04 0.00 -0.96 0.00 0.00 56.93 56.53 1j8m s PHE 284 Cb -0.23 -2.11 0.08 0.00 -0.34 0.00 0.00 43.02 40.43 1j8m s PHE 284 CO 0.28 0.19 0.21 1.21 -1.46 0.00 0.00 175.22 175.66 1j8m s ASN 285 N 0.37 1.18 0.30 6.13 3.04 -1.26 -4.43 114.94 120.27 1j8m s ASN 285 Ca 0.05 -0.04 0.05 0.00 0.04 0.00 0.00 52.86 52.95 1j8m s ASN 285 Cb -0.12 0.38 0.80 0.00 -1.54 0.00 0.00 41.25 40.78 1j8m s ASN 285 CO -0.01 -0.30 1.63 -0.65 -3.04 0.00 0.00 177.10 174.73 1j8m h PRO 286 N 8.32 0.16 -0.65 0.43 0.11 -1.80 0.38 132.00 138.95 1j8m h PRO 286 Ca -0.16 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.91 1j8m h PRO 286 Cb 1.14 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1j8m h PRO 286 CO 0.24 0.10 0.27 -0.09 -0.21 0.00 0.00 178.00 178.31 1j8m h ARG 287 N 0.16 0.97 -0.16 1.05 2.43 -1.84 0.15 114.38 117.13 1j8m h ARG 287 Ca 0.60 -0.17 -0.19 0.00 -0.81 0.00 0.00 59.98 59.42 1j8m h ARG 287 Cb 1.28 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1j8m h ARG 287 CO -0.71 0.80 -0.65 0.00 -1.51 0.00 0.00 179.97 177.90 1j8m h ARG 288 N 0.91 0.62 -0.18 0.20 3.08 -0.78 -0.42 114.38 117.81 1j8m h ARG 288 Ca 0.22 -0.45 0.03 0.00 0.07 0.00 0.00 59.98 59.86 1j8m h ARG 288 Cb 0.19 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 1j8m h ARG 288 CO -0.02 1.07 -0.03 0.35 -1.07 0.00 0.00 179.97 180.26 1j8m h PHE 289 N 0.45 -0.07 -0.22 3.04 3.57 -0.41 -2.58 116.94 120.71 1j8m h PHE 289 Ca -0.02 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 1j8m h PHE 289 Cb 1.23 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.02 1j8m h PHE 289 CO 0.06 -0.06 -0.17 0.28 -2.23 0.00 0.00 178.31 176.19 1j8m h VAL 290 N 0.02 1.23 0.00 1.41 2.07 -0.56 -3.23 116.25 117.18 1j8m h VAL 290 Ca 0.08 -1.03 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 1j8m h VAL 290 Cb 0.12 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1j8m h VAL 290 CO -0.17 0.33 -0.17 0.00 0.02 0.00 0.00 177.57 177.58 1j8m h ALA 291 N 1.47 1.47 -0.99 1.67 0.00 -0.67 -3.17 119.26 119.04 1j8m h ALA 291 Ca 0.06 -0.15 0.28 0.00 0.00 0.00 0.00 54.91 55.09 1j8m h ALA 291 Cb 0.51 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 18.14 1j8m h ALA 291 CO 0.03 0.21 0.56 -0.09 0.00 0.00 0.00 179.25 179.97 1j8m h ARG 292 N 0.00 0.44 -0.36 0.00 2.43 -1.54 -1.32 114.38 114.02 1j8m h ARG 292 Ca -0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1j8m h ARG 292 Cb 0.36 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1j8m h ARG 292 CO 0.02 0.29 0.00 1.47 -1.51 0.00 0.00 179.97 180.24 1j8m n LEU 293 N -4.98 2.12 -4.58 3.80 -0.00 -1.20 -4.98 117.00 107.19 1j8m n LEU 293 Ca 0.28 -1.03 -0.53 0.00 -0.00 0.00 0.00 56.01 54.74 1j8m n LEU 293 Cb 0.84 -0.24 -0.06 0.00 -0.00 0.00 0.00 43.42 43.96 1j8m n LEU 293 CO 0.13 0.51 0.85 1.57 -0.00 0.00 0.00 177.39 180.45 1j8m n HIS 294 N 0.65 1.39 0.52 1.47 -0.00 -0.50 -4.86 115.22 113.89 1j8m n HIS 294 Ca 0.14 0.69 0.07 0.00 0.46 0.00 0.00 57.72 59.08 1j8m n HIS 294 Cb 0.35 -2.30 0.31 0.00 -0.12 0.00 0.00 29.99 28.23 1j8m n HIS 294 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 1j8m n HIS 295 N 2.34 0.00 0.91 1.57 1.44 -1.26 -2.14 115.22 118.08 1j8m n HIS 295 Ca 0.18 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 55.99 1j8m n HIS 295 Cb 0.18 -0.46 0.28 0.00 0.12 0.00 0.00 29.99 30.11 1j8m n HIS 295 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1j8m n HIS 296 N -1.46 0.37 0.10 -1.40 8.25 -1.26 -5.15 115.22 114.66 1j8m n HIS 296 Ca 0.04 -0.19 0.01 0.00 -0.26 0.00 0.00 57.72 57.33 1j8m n HIS 296 Cb 0.16 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.28 1j8m n HIS 296 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59