#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a7m s PRO 2 N 0.00 -0.44 -0.62 1.43 0.04 -1.26 -5.03 135.00 129.13 1a7m s PRO 2 Ca 0.00 0.23 0.06 0.00 0.04 0.00 0.00 61.00 61.32 1a7m s PRO 2 Cb 0.00 -1.66 0.28 0.00 0.04 0.00 0.00 34.50 33.15 1a7m s PRO 2 CO 0.00 -3.25 0.80 1.28 0.04 0.00 0.00 177.00 175.87 1a7m n LEU 3 N -4.49 3.91 -3.88 -3.56 4.77 -1.26 -5.00 117.00 107.49 1a7m n LEU 3 Ca 0.09 -5.50 -0.38 0.00 -0.03 0.00 0.00 56.01 50.18 1a7m n LEU 3 Cb 0.58 -0.61 -0.08 0.00 -2.33 0.00 0.00 43.42 40.98 1a7m n LEU 3 CO 0.52 2.14 1.76 -0.81 -1.33 0.00 0.00 177.39 179.67 1a7m n PRO 4 N 0.55 1.09 -0.00 3.23 -0.04 -1.26 -4.48 135.00 134.08 1a7m n PRO 4 Ca 0.30 -1.79 0.02 0.00 -0.04 0.00 0.00 63.50 61.99 1a7m n PRO 4 Cb 0.41 -3.09 -0.12 0.00 -0.04 0.00 0.00 33.50 30.66 1a7m n PRO 4 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1a7m n ILE 5 N 6.86 0.86 -4.29 0.52 5.41 -1.26 -4.94 119.36 122.53 1a7m n ILE 5 Ca 0.47 -0.67 -0.24 0.00 1.00 0.00 0.00 62.75 63.32 1a7m n ILE 5 Cb 0.43 -0.43 -0.12 0.00 -0.71 0.00 0.00 39.64 38.80 1a7m n ILE 5 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1a7m s THR 6 N -3.03 1.71 -1.15 1.39 -1.32 -1.26 -5.05 115.64 106.93 1a7m s THR 6 Ca -0.06 -1.54 -0.23 0.00 -1.21 0.00 0.00 61.69 58.66 1a7m s THR 6 Cb 0.10 -1.56 -0.06 0.00 -1.51 0.00 0.00 72.50 69.47 1a7m s THR 6 CO 0.84 -0.06 1.91 -2.16 -2.21 0.00 0.00 174.62 172.94 1a7m s PRO 7 N -1.90 2.67 -0.55 7.08 0.04 -1.26 -4.76 135.00 136.31 1a7m s PRO 7 Ca 0.06 -1.10 0.07 0.00 0.04 0.00 0.00 61.00 60.06 1a7m s PRO 7 Cb -0.10 -5.24 0.31 0.00 0.04 0.00 0.00 34.50 29.51 1a7m s PRO 7 CO 0.04 -3.69 0.83 1.55 0.04 0.00 0.00 177.00 175.77 1a7m n VAL 8 N 7.67 2.15 -0.03 -0.36 3.14 -1.26 -4.78 118.33 124.86 1a7m n VAL 8 Ca 0.44 -5.23 0.05 0.00 -2.96 0.00 0.00 64.34 56.64 1a7m n VAL 8 Cb 0.47 -1.46 0.12 0.00 -1.06 0.00 0.00 33.84 31.91 1a7m n VAL 8 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1a7m n ASN 9 N 0.24 2.66 -2.70 6.55 5.03 -1.26 -4.59 115.26 121.18 1a7m n ASN 9 Ca 0.29 -1.87 -0.15 0.00 0.87 0.00 0.00 54.58 53.72 1a7m n ASN 9 Cb 0.45 -0.17 0.01 0.00 -1.02 0.00 0.00 39.78 39.05 1a7m n ASN 9 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1a7m n ALA 10 N 0.50 3.63 -1.77 5.41 0.00 -1.26 -4.89 120.51 122.13 1a7m n ALA 10 Ca 0.10 -3.48 -0.26 0.00 0.00 0.00 0.00 53.44 49.79 1a7m n ALA 10 Cb 0.38 -0.85 0.05 0.00 0.00 0.00 0.00 19.45 19.04 1a7m n ALA 10 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1a7m n THR 11 N -0.11 2.88 -0.50 0.00 -1.04 -1.26 -2.40 114.28 111.84 1a7m n THR 11 Ca 0.18 -3.73 0.40 0.00 -2.04 0.00 0.00 64.05 58.86 1a7m n THR 11 Cb 0.75 -1.10 0.64 0.00 -1.82 0.00 0.00 70.33 68.80 1a7m n THR 11 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1a7m n ALA 13 N -2.65 0.73 -1.53 0.00 0.00 -1.26 0.15 120.51 115.95 1a7m n ALA 13 Ca 0.36 0.86 -0.27 0.00 0.00 0.00 0.00 53.44 54.40 1a7m n ALA 13 Cb 1.52 -0.79 0.09 0.00 0.00 0.00 0.00 19.45 20.27 1a7m n ALA 13 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1a7m n ILE 14 N -4.96 3.14 0.00 0.00 -6.64 -0.53 -4.75 119.36 105.62 1a7m n ILE 14 Ca 0.28 -3.16 0.00 0.00 -1.77 0.00 0.00 62.75 58.10 1a7m n ILE 14 Cb 0.95 -0.97 0.00 0.00 -1.44 0.00 0.00 39.64 38.18 1a7m n ILE 14 CO 0.00 0.00 0.00 -1.14 -1.77 0.00 0.00 176.55 173.64 1a7m n ARG 15 N -0.91 0.00 -3.89 6.28 0.63 0.40 -5.02 116.66 114.15 1a7m n ARG 15 Ca 0.53 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 57.16 1a7m n ARG 15 Cb 0.90 0.00 -0.15 0.00 0.45 0.00 0.00 32.46 33.66 1a7m n ARG 15 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 1a7m s HIS 16 N 0.25 2.68 -1.08 -0.14 3.76 -1.26 -5.06 115.29 114.45 1a7m s HIS 16 Ca 0.00 -2.26 -0.25 0.00 -0.15 0.00 0.00 55.06 52.40 1a7m s HIS 16 Cb 0.00 -2.19 -0.16 0.00 1.11 0.00 0.00 32.58 31.34 1a7m s HIS 16 CO 0.00 -0.89 1.99 -0.35 -0.85 0.00 0.00 174.74 174.64 1a7m n PRO 17 N 4.57 0.96 -3.01 8.40 -0.04 -1.26 -4.76 135.00 139.86 1a7m n PRO 17 Ca -0.01 -2.09 -0.42 0.00 -0.04 0.00 0.00 63.50 60.94 1a7m n PRO 17 Cb 0.42 -3.72 -0.06 0.00 -0.04 0.00 0.00 33.50 30.11 1a7m n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a7m n HIS 19 N 6.42 0.00 0.00 0.00 8.25 -1.26 -4.58 115.22 124.06 1a7m n HIS 19 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1a7m n HIS 19 Cb 0.48 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.59 1a7m n HIS 19 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a7m n GLY 20 N 2.31 1.91 0.89 -1.41 0.00 -1.26 -4.08 105.19 103.55 1a7m n GLY 20 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1a7m n GLY 20 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1a7m n ASN 21 N 3.80 0.00 0.00 1.61 3.02 -1.26 -5.00 115.26 117.43 1a7m n ASN 21 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1a7m n ASN 21 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1a7m n ASN 21 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1a7m n LEU 22 N -2.14 0.00 -0.19 3.41 7.99 -1.26 -3.73 117.00 121.08 1a7m n LEU 22 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 56.01 55.91 1a7m n LEU 22 Cb 0.00 0.00 -0.07 0.00 -0.11 0.00 0.00 43.42 43.24 1a7m n LEU 22 CO 0.00 0.00 0.49 -0.03 -1.51 0.00 0.00 177.39 176.34 1a7m h MET 23 N 0.00 -0.13 -0.83 3.23 4.05 -1.94 0.36 114.93 119.66 1a7m h MET 23 Ca 0.00 0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.37 1a7m h MET 23 Cb 0.00 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.80 1a7m h MET 23 CO 0.00 -0.09 0.07 0.09 0.23 0.00 0.00 176.91 177.21 1a7m n ASN 24 N -4.54 3.44 -0.06 1.39 3.02 -1.24 -3.81 115.26 113.45 1a7m n ASN 24 Ca -0.01 -2.55 -0.05 0.00 -0.03 0.00 0.00 54.58 51.94 1a7m n ASN 24 Cb 0.21 -0.61 -0.02 0.00 -0.61 0.00 0.00 39.78 38.75 1a7m n ASN 24 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1a7m n GLN 25 N 0.18 0.40 0.29 3.52 -0.06 0.12 -2.50 117.38 119.32 1a7m n GLN 25 Ca 0.18 0.41 0.18 0.00 -2.00 0.00 0.00 57.00 55.76 1a7m n GLN 25 Cb 0.82 -1.48 0.88 0.00 -4.06 0.00 0.00 30.24 26.39 1a7m n GLN 25 CO 0.00 0.00 0.00 -0.84 -0.20 0.00 0.00 177.06 176.02 1a7m h ILE 26 N -0.84 0.12 0.33 1.69 3.07 -1.47 0.68 117.51 121.08 1a7m h ILE 26 Ca 0.00 0.00 -0.02 0.00 1.55 0.00 0.00 64.86 66.39 1a7m h ILE 26 Cb 0.53 0.74 0.00 0.00 -0.27 0.00 0.00 36.82 37.83 1a7m h ILE 26 CO 0.00 0.00 -0.16 0.50 -1.05 0.00 0.00 178.15 177.44 1a7m h LYS 27 N 0.00 -0.43 -1.02 0.16 3.64 -1.68 0.31 116.57 117.55 1a7m h LYS 27 Ca 0.04 0.03 0.26 0.00 -1.27 0.00 0.00 60.65 59.71 1a7m h LYS 27 Cb 0.59 0.10 -0.12 0.00 -0.41 0.00 0.00 32.23 32.39 1a7m h LYS 27 CO -0.00 -0.29 0.62 -0.91 -2.27 0.00 0.00 179.45 176.61 1a7m h ASN 28 N -1.04 0.59 0.13 4.20 4.21 -0.66 -0.42 115.58 122.59 1a7m h ASN 28 Ca -0.05 0.12 -0.21 0.00 1.21 0.00 0.00 56.30 57.38 1a7m h ASN 28 Cb 0.34 0.03 0.02 0.00 -1.12 0.00 0.00 38.32 37.59 1a7m h ASN 28 CO 0.07 0.08 -0.95 -0.61 -1.29 0.00 0.00 177.43 174.73 1a7m h GLN 29 N 0.50 0.28 -0.96 0.81 4.15 -1.00 -3.29 115.11 115.60 1a7m h GLN 29 Ca 0.64 -0.49 0.24 0.00 0.77 0.00 0.00 58.65 59.81 1a7m h GLN 29 Cb 1.37 0.18 -0.13 0.00 0.21 0.00 0.00 27.48 29.12 1a7m h GLN 29 CO -0.43 1.23 0.51 1.25 -1.93 0.00 0.00 178.83 179.46 1a7m h LEU 30 N -0.37 0.53 -0.76 -2.39 7.12 0.12 0.27 115.31 119.83 1a7m h LEU 30 Ca -0.18 0.15 0.17 0.00 0.13 0.00 0.00 57.88 58.14 1a7m h LEU 30 Cb 1.66 0.08 -0.14 0.00 -0.53 0.00 0.00 40.66 41.74 1a7m h LEU 30 CO 0.13 0.05 -0.07 0.00 -0.13 0.00 0.00 178.44 178.42 1a7m h ALA 31 N 1.73 0.68 -0.94 1.25 0.00 -1.32 0.90 119.26 121.56 1a7m h ALA 31 Ca 0.61 0.26 0.24 0.00 0.00 0.00 0.00 54.91 56.03 1a7m h ALA 31 Cb 1.18 0.48 -0.13 0.00 0.00 0.00 0.00 17.79 19.32 1a7m h ALA 31 CO -0.50 -0.43 0.47 0.37 0.00 0.00 0.00 179.25 179.16 1a7m h GLN 32 N 0.06 0.42 -0.06 0.00 -0.00 -0.59 0.21 115.11 115.15 1a7m h GLN 32 Ca 0.40 -0.03 -0.07 0.00 -0.00 0.00 0.00 58.65 58.95 1a7m h GLN 32 Cb 0.67 -0.10 0.00 0.00 0.00 0.00 0.00 27.48 28.06 1a7m h GLN 32 CO -0.71 0.28 -0.24 -0.07 0.00 0.00 0.00 178.83 178.10 1a7m h LEU 33 N 0.44 0.31 -0.16 -2.39 3.38 0.65 -2.61 115.31 114.92 1a7m h LEU 33 Ca 0.61 -0.64 0.03 0.00 0.09 0.00 0.00 57.88 57.97 1a7m h LEU 33 Cb 1.19 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.78 1a7m h LEU 33 CO -0.53 0.89 -0.54 -1.13 0.09 0.00 0.00 178.44 177.22 1a7m h ASN 34 N -0.26 -1.73 -0.99 -0.43 -1.24 0.22 1.06 115.58 112.22 1a7m h ASN 34 Ca -0.01 0.21 0.31 0.00 0.71 0.00 0.00 56.30 57.51 1a7m h ASN 34 Cb 0.88 0.68 -0.15 0.00 0.73 0.00 0.00 38.32 40.46 1a7m h ASN 34 CO 0.05 -0.48 0.54 1.23 -1.29 0.00 0.00 177.43 177.48 1a7m h GLY 35 N -0.57 1.99 1.35 1.57 0.00 -0.77 0.16 103.07 106.81 1a7m h GLY 35 Ca 0.04 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 1a7m h GLY 35 CO -0.45 -0.47 -0.89 1.48 0.00 0.00 0.00 176.54 176.22 1a7m h SER 36 N 0.33 0.00 -0.92 0.19 4.64 -0.23 -2.32 113.55 115.24 1a7m h SER 36 Ca 0.71 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 62.15 1a7m h SER 36 Cb 1.59 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.60 1a7m h SER 36 CO -0.60 0.30 0.55 0.00 -0.87 0.00 0.00 176.83 176.20 1a7m h ALA 37 N 1.70 1.37 0.01 5.18 0.00 0.40 1.46 119.26 129.38 1a7m h ALA 37 Ca -0.05 0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.58 1a7m h ALA 37 Cb 1.27 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 1a7m h ALA 37 CO 0.03 0.15 -1.81 -1.71 0.00 0.00 0.00 179.25 175.91 1a7m n ASN 38 N -4.69 0.89 -0.08 0.00 4.05 -1.03 -3.95 115.26 110.45 1a7m n ASN 38 Ca 0.17 0.35 -0.10 0.00 0.45 0.00 0.00 54.58 55.45 1a7m n ASN 38 Cb 0.34 -0.02 -0.05 0.00 1.23 0.00 0.00 39.78 41.28 1a7m n ASN 38 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1a7m n ALA 39 N -2.61 0.56 0.00 5.20 0.00 -0.40 -4.05 120.51 119.20 1a7m n ALA 39 Ca -0.20 -0.45 -0.15 0.00 0.00 0.00 0.00 53.44 52.64 1a7m n ALA 39 Cb 1.06 -0.15 -0.09 0.00 0.00 0.00 0.00 19.45 20.27 1a7m n ALA 39 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1a7m h LEU 40 N -1.00 -1.65 -0.46 0.00 7.12 0.17 -0.44 115.31 119.06 1a7m h LEU 40 Ca -0.11 0.20 0.12 0.00 0.13 0.00 0.00 57.88 58.22 1a7m h LEU 40 Cb 0.76 0.65 -0.09 0.00 -0.53 0.00 0.00 40.66 41.45 1a7m h LEU 40 CO -0.07 -0.48 -0.00 0.33 -0.13 0.00 0.00 178.44 178.09 1a7m n PHE 41 N -5.44 0.28 0.09 1.25 7.35 -0.76 0.14 117.46 120.37 1a7m n PHE 41 Ca -0.06 0.55 -0.06 0.00 -0.76 0.00 0.00 57.45 57.13 1a7m n PHE 41 Cb 0.38 -0.84 -0.03 0.00 0.35 0.00 0.00 39.48 39.35 1a7m n PHE 41 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1a7m h ILE 42 N 0.00 0.05 -0.96 -2.13 5.03 -1.28 0.15 117.51 118.37 1a7m h ILE 42 Ca 0.27 -0.78 0.28 0.00 -0.12 0.00 0.00 64.86 64.51 1a7m h ILE 42 Cb 0.55 0.08 -0.04 0.00 -3.03 0.00 0.00 36.82 34.38 1a7m h ILE 42 CO -0.44 0.01 0.85 -1.28 -0.68 0.00 0.00 178.15 176.61 1a7m h SER 43 N -1.08 0.00 0.00 1.72 0.87 0.58 0.33 113.55 115.97 1a7m h SER 43 Ca -0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1a7m h SER 43 Cb 0.28 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.24 1a7m h SER 43 CO 0.06 0.00 -0.14 0.22 -0.53 0.00 0.00 176.83 176.43 1a7m h TYR 44 N 0.00 0.00 -0.77 2.24 3.20 0.13 -3.38 116.97 118.39 1a7m h TYR 44 Ca 0.46 0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.34 1a7m h TYR 44 Cb 2.14 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 40.37 1a7m h TYR 44 CO 0.00 0.00 0.51 0.10 -1.64 0.00 0.00 178.16 177.13 1a7m h TYR 45 N -0.52 0.96 -0.70 -3.82 -0.00 0.12 -1.14 116.97 111.87 1a7m h TYR 45 Ca 0.00 0.02 0.12 0.00 0.00 0.00 0.00 58.73 58.88 1a7m h TYR 45 Cb 0.14 -0.32 -0.05 0.00 0.00 0.00 0.00 36.73 36.51 1a7m h TYR 45 CO -0.06 0.59 0.47 1.79 -0.00 0.00 0.00 178.16 180.95 1a7m h THR 46 N 1.02 0.85 0.00 -0.90 1.35 -0.58 0.28 112.91 114.93 1a7m h THR 46 Ca 0.29 -0.15 -0.01 0.00 -0.55 0.00 0.00 66.41 65.99 1a7m h THR 46 Cb -0.08 0.36 -0.00 0.00 -1.73 0.00 0.00 68.15 66.70 1a7m h THR 46 CO -0.07 0.08 -0.05 0.00 -0.25 0.00 0.00 175.52 175.23 1a7m h ALA 47 N 1.66 1.04 -0.28 6.62 0.00 -1.37 -2.55 119.26 124.39 1a7m h ALA 47 Ca 0.33 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 1a7m h ALA 47 Cb 0.69 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1a7m h ALA 47 CO -0.10 0.06 -0.13 1.96 0.00 0.00 0.00 179.25 181.04 1a7m h GLN 48 N 0.00 0.47 0.00 0.00 7.50 -0.49 -3.46 115.11 119.13 1a7m h GLN 48 Ca -0.00 -0.14 0.00 0.00 0.50 0.00 0.00 58.65 59.01 1a7m h GLN 48 Cb 0.44 -0.05 0.00 0.00 0.05 0.00 0.00 27.48 27.92 1a7m h GLN 48 CO 0.01 0.60 0.00 0.41 -1.50 0.00 0.00 178.83 178.35 1a7m n GLY 49 N -0.64 1.26 3.49 3.46 0.00 -0.96 -5.00 105.19 106.80 1a7m n GLY 49 Ca 0.00 -0.99 -0.24 0.00 0.00 0.00 0.00 46.02 44.79 1a7m n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1a7m s GLU 50 N 0.00 1.70 -0.34 1.61 -1.05 -1.26 -4.35 118.70 115.01 1a7m s GLU 50 Ca 0.00 -1.90 0.06 0.00 -0.15 0.00 0.00 54.97 52.98 1a7m s GLU 50 Cb 0.00 -1.36 0.61 0.00 -0.44 0.00 0.00 34.13 32.95 1a7m s GLU 50 CO 0.00 0.03 1.74 -0.35 0.95 0.00 0.00 175.26 177.63 1a7m n PRO 51 N -0.72 2.66 0.25 -4.83 -0.04 -1.26 -4.98 135.00 126.08 1a7m n PRO 51 Ca -0.05 -2.63 -0.16 0.00 -0.04 0.00 0.00 63.50 60.62 1a7m n PRO 51 Cb 0.64 -2.06 -0.08 0.00 -0.04 0.00 0.00 33.50 31.97 1a7m n PRO 51 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1a7m h PHE 52 N 1.51 -0.88 0.00 0.54 -1.00 -1.87 1.29 116.94 116.53 1a7m h PHE 52 Ca 0.41 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.19 1a7m h PHE 52 Cb 2.42 0.33 0.00 0.00 3.61 0.00 0.00 35.95 42.31 1a7m h PHE 52 CO 1.28 -0.49 0.72 -1.00 -1.61 0.00 0.00 178.31 177.21 1a7m h PRO 53 N -0.75 0.00 0.00 1.51 0.13 -1.89 0.94 132.00 131.94 1a7m h PRO 53 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1a7m h PRO 53 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1a7m h PRO 53 CO -0.01 0.00 -0.89 -1.71 -0.23 0.00 0.00 178.00 175.17 1a7m n ASN 54 N -2.11 4.43 -0.32 1.44 2.85 -0.90 -4.83 115.26 115.82 1a7m n ASN 54 Ca -0.00 0.00 0.06 0.00 -0.11 0.00 0.00 54.58 54.52 1a7m n ASN 54 Cb 0.72 0.63 0.09 0.00 1.24 0.00 0.00 39.78 42.46 1a7m n ASN 54 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1a7m n ASN 55 N -1.61 1.36 0.14 1.20 3.02 0.44 -4.75 115.26 115.06 1a7m n ASN 55 Ca 0.00 -2.67 0.11 0.00 -0.03 0.00 0.00 54.58 51.99 1a7m n ASN 55 Cb 0.25 -0.34 0.51 0.00 -0.61 0.00 0.00 39.78 39.59 1a7m n ASN 55 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1a7m n LEU 56 N -0.80 0.61 -0.29 3.41 -0.00 0.30 -0.74 117.00 119.49 1a7m n LEU 56 Ca 0.10 0.69 -0.03 0.00 -0.00 0.00 0.00 56.01 56.77 1a7m n LEU 56 Cb 0.69 -0.66 0.13 0.00 -0.00 0.00 0.00 43.42 43.58 1a7m n LEU 56 CO 0.00 -0.68 1.17 -2.24 -0.00 0.00 0.00 177.39 175.64 1a7m h ASP 57 N 0.00 1.04 0.00 1.45 2.03 -1.80 1.30 116.42 120.43 1a7m h ASP 57 Ca 0.00 -0.09 -0.41 0.00 -0.73 0.00 0.00 57.03 55.80 1a7m h ASP 57 Cb 0.24 -0.26 -0.07 0.00 -0.83 0.00 0.00 39.33 38.41 1a7m h ASP 57 CO 0.00 0.83 -2.47 1.17 -1.03 0.00 0.00 179.24 177.75 1a7m n LYS 58 N -4.34 0.61 0.15 4.15 4.81 -0.84 -3.63 118.16 119.08 1a7m n LYS 58 Ca 0.09 0.18 0.13 0.00 -0.87 0.00 0.00 58.31 57.84 1a7m n LYS 58 Cb 0.10 -1.49 0.39 0.00 0.02 0.00 0.00 35.03 34.04 1a7m n LYS 58 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1a7m h LEU 59 N -0.34 0.00 -5.50 3.14 4.07 -0.97 -3.37 115.31 112.35 1a7m h LEU 59 Ca -0.61 0.00 -0.41 0.00 0.08 0.00 0.00 57.88 56.94 1a7m h LEU 59 Cb 1.78 0.00 -0.39 0.00 1.08 0.00 0.00 40.66 43.13 1a7m h LEU 59 CO -0.20 0.00 -1.16 0.00 -1.08 0.00 0.00 178.44 176.00 1a7m n GLY 61 N 0.11 -0.46 2.44 0.00 0.00 -1.13 -3.42 105.19 102.73 1a7m n GLY 61 Ca 0.17 0.04 -0.19 0.00 0.00 0.00 0.00 46.02 46.04 1a7m n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1a7m n PRO 62 N -3.18 -0.99 -3.75 1.61 -0.04 -1.26 -1.16 135.00 126.23 1a7m n PRO 62 Ca 0.00 -1.29 -0.36 0.00 -0.04 0.00 0.00 63.50 61.80 1a7m n PRO 62 Cb 0.00 -0.89 -0.07 0.00 -0.04 0.00 0.00 33.50 32.50 1a7m n PRO 62 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1a7m s ASN 63 N -4.03 6.36 0.00 3.54 2.20 -1.26 -4.25 114.94 117.48 1a7m s ASN 63 Ca 0.48 0.42 0.02 0.00 -0.94 0.00 0.00 52.86 52.83 1a7m s ASN 63 Cb -0.02 -2.11 0.03 0.00 -2.00 0.00 0.00 41.25 37.16 1a7m s ASN 63 CO 0.34 0.27 0.86 0.55 -2.94 0.00 0.00 177.10 176.18 1a7m n VAL 64 N 2.79 0.64 -2.30 3.54 3.14 -1.26 -5.00 118.33 119.87 1a7m n VAL 64 Ca -0.17 -0.82 0.00 0.00 -2.96 0.00 0.00 64.34 60.39 1a7m n VAL 64 Cb 0.53 0.69 0.00 0.00 -1.06 0.00 0.00 33.84 34.01 1a7m n VAL 64 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 1a7m n THR 65 N -0.19 0.00 -1.41 1.55 5.66 -1.26 -4.53 114.28 114.10 1a7m n THR 65 Ca 0.01 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.66 1a7m n THR 65 Cb 0.19 0.00 0.07 0.00 -1.55 0.00 0.00 70.33 69.05 1a7m n THR 65 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1a7m n ASP 66 N 0.00 7.69 -4.55 1.09 5.75 -1.26 -4.94 116.55 120.33 1a7m n ASP 66 Ca 0.00 -3.80 -0.33 0.00 -0.01 0.00 0.00 54.79 50.65 1a7m n ASP 66 Cb 0.00 -0.99 -0.04 0.00 -1.03 0.00 0.00 41.12 39.06 1a7m n ASP 66 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1a7m s PHE 67 N -3.87 1.67 0.94 2.11 2.19 -1.26 -4.92 117.98 114.84 1a7m s PHE 67 Ca 0.63 0.80 -0.10 0.00 0.33 0.00 0.00 56.93 58.59 1a7m s PHE 67 Cb 0.50 -4.03 0.16 0.00 -1.31 0.00 0.00 43.02 38.34 1a7m s PHE 67 CO -0.07 -2.09 1.12 -0.35 1.83 0.00 0.00 175.22 175.66 1a7m n PRO 68 N 9.05 -0.58 -1.08 10.12 -0.04 -1.26 -4.79 135.00 146.42 1a7m n PRO 68 Ca 0.29 -0.10 -0.31 0.00 -0.04 0.00 0.00 63.50 63.34 1a7m n PRO 68 Cb 0.50 -2.36 -0.04 0.00 -0.04 0.00 0.00 33.50 31.57 1a7m n PRO 68 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1a7m n PRO 69 N -4.25 2.99 -1.40 0.54 -0.04 -1.26 -4.91 135.00 126.67 1a7m n PRO 69 Ca 0.11 -1.83 -0.62 0.00 -0.04 0.00 0.00 63.50 61.12 1a7m n PRO 69 Cb 0.52 -2.60 -0.11 0.00 -0.04 0.00 0.00 33.50 31.27 1a7m n PRO 69 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1a7m n PHE 70 N 3.69 1.34 -3.35 0.54 -0.00 -1.26 -4.84 117.46 113.58 1a7m n PHE 70 Ca 0.64 0.89 -0.26 0.00 -0.00 0.00 0.00 57.45 58.71 1a7m n PHE 70 Cb 0.25 -2.23 -0.09 0.00 -0.00 0.00 0.00 39.48 37.41 1a7m n PHE 70 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 1a7m n HIS 71 N 6.19 -0.13 -0.57 -5.13 8.25 -1.26 -5.03 115.22 117.54 1a7m n HIS 71 Ca 0.46 -3.53 -0.03 0.00 -0.26 0.00 0.00 57.72 54.36 1a7m n HIS 71 Cb -0.05 -0.09 -0.03 0.00 1.12 0.00 0.00 29.99 30.94 1a7m n HIS 71 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a7m n ALA 72 N 2.10 0.35 -0.96 -1.41 0.00 -1.26 -4.63 120.51 114.70 1a7m n ALA 72 Ca 0.26 -0.47 -0.09 0.00 0.00 0.00 0.00 53.44 53.14 1a7m n ALA 72 Cb 0.49 -0.54 0.27 0.00 0.00 0.00 0.00 19.45 19.67 1a7m n ALA 72 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1a7m n ASN 73 N 2.40 4.56 -0.37 0.00 2.85 -1.26 -4.81 115.26 118.62 1a7m n ASN 73 Ca 0.10 -3.22 0.00 0.00 -0.11 0.00 0.00 54.58 51.36 1a7m n ASN 73 Cb 0.20 -0.75 0.00 0.00 1.24 0.00 0.00 39.78 40.46 1a7m n ASN 73 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1a7m n GLY 74 N -0.27 0.94 2.76 8.20 0.00 -1.26 -5.05 105.19 110.51 1a7m n GLY 74 Ca 0.42 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 1a7m n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a7m s THR 75 N -2.75 0.92 0.07 2.61 2.01 -1.26 -5.01 115.64 112.23 1a7m s THR 75 Ca 0.00 -1.24 -0.14 0.00 0.31 0.00 0.00 61.69 60.62 1a7m s THR 75 Cb 0.00 -1.58 -0.03 0.00 0.01 0.00 0.00 72.50 70.90 1a7m s THR 75 CO 0.00 -0.52 1.10 -0.62 -0.69 0.00 0.00 174.62 173.89 1a7m n GLU 76 N 4.85 -0.20 -0.16 4.92 1.02 -1.26 0.75 120.64 130.57 1a7m n GLU 76 Ca -0.04 1.09 0.18 0.00 -0.02 0.00 0.00 57.16 58.36 1a7m n GLU 76 Cb 0.43 -1.61 0.55 0.00 -0.02 0.00 0.00 31.44 30.79 1a7m n GLU 76 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1a7m h LYS 77 N 0.00 0.31 -0.00 3.49 2.10 -1.97 0.12 116.57 120.62 1a7m h LYS 77 Ca 0.07 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 58.70 1a7m h LYS 77 Cb 0.18 -0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 31.44 1a7m h LYS 77 CO -0.42 0.21 -0.00 0.00 -2.00 0.00 0.00 179.45 177.23 1a7m h ALA 78 N 1.64 0.00 -0.28 0.07 0.00 -0.08 0.31 119.26 120.94 1a7m h ALA 78 Ca 0.38 -0.26 0.06 0.00 0.00 0.00 0.00 54.91 55.09 1a7m h ALA 78 Cb 1.00 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.73 1a7m h ALA 78 CO -0.10 -0.24 -0.11 0.87 0.00 0.00 0.00 179.25 179.67 1a7m h LYS 79 N -0.50 -0.05 0.09 0.00 1.57 -0.09 0.36 116.57 117.94 1a7m h LYS 79 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1a7m h LYS 79 Cb 0.51 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1a7m h LYS 79 CO 0.00 -0.04 -0.04 -0.07 -0.57 0.00 0.00 179.45 178.73 1a7m h LEU 80 N -0.06 -0.10 0.07 2.94 -0.00 -0.77 -2.58 115.31 114.81 1a7m h LEU 80 Ca 0.14 -0.16 -0.00 0.00 -0.00 0.00 0.00 57.88 57.86 1a7m h LEU 80 Cb 0.27 0.03 0.00 0.00 -0.00 0.00 0.00 40.66 40.96 1a7m h LEU 80 CO -0.32 0.10 -0.03 0.58 -0.00 0.00 0.00 178.44 178.77 1a7m h VAL 81 N -0.30 1.23 -0.79 1.22 2.07 -0.14 0.72 116.25 120.26 1a7m h VAL 81 Ca -0.01 -1.14 0.14 0.00 0.82 0.00 0.00 66.70 66.51 1a7m h VAL 81 Cb 0.25 1.95 -0.09 0.00 -1.52 0.00 0.00 31.29 31.88 1a7m h VAL 81 CO 0.02 0.28 0.36 -0.33 0.02 0.00 0.00 177.57 177.91 1a7m h GLU 82 N -0.61 0.51 0.32 1.57 5.08 -0.40 0.37 114.58 121.42 1a7m h GLU 82 Ca -0.01 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1a7m h GLU 82 Cb 0.52 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1a7m h GLU 82 CO 0.01 0.34 -0.17 1.25 -1.00 0.00 0.00 179.01 179.44 1a7m h LEU 83 N 0.52 -0.41 0.00 1.33 5.85 -1.38 0.49 115.31 121.71 1a7m h LEU 83 Ca 0.43 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.17 1a7m h LEU 83 Cb 0.62 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.76 1a7m h LEU 83 CO -0.38 -0.27 0.00 0.00 -0.34 0.00 0.00 178.44 177.45 1a7m n TYR 84 N -3.28 0.00 -0.04 1.25 4.19 0.24 0.91 117.16 120.43 1a7m n TYR 84 Ca -0.06 0.00 0.14 0.00 3.31 0.00 0.00 57.90 61.30 1a7m n TYR 84 Cb 0.18 -0.28 0.57 0.00 0.49 0.00 0.00 39.34 40.30 1a7m n TYR 84 CO 0.00 0.00 0.00 -0.09 0.91 0.00 0.00 176.86 177.68 1a7m h ARG 85 N 0.00 0.26 0.00 2.98 9.65 -0.39 1.27 114.38 128.14 1a7m h ARG 85 Ca 0.00 -0.02 -0.12 0.00 -1.10 0.00 0.00 59.98 58.75 1a7m h ARG 85 Cb 0.00 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.51 1a7m h ARG 85 CO 0.00 0.17 -0.56 0.52 2.80 0.00 0.00 179.97 182.89 1a7m h MET 86 N 0.26 0.00 0.00 0.20 2.86 0.29 -2.75 114.93 115.79 1a7m h MET 86 Ca 0.26 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.90 1a7m h MET 86 Cb 0.68 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.34 1a7m h MET 86 CO -0.06 0.56 -0.27 0.28 1.06 0.00 0.00 176.91 178.49 1a7m n VAL 87 N -3.67 0.71 -0.23 -2.22 0.31 0.19 -2.05 118.33 111.37 1a7m n VAL 87 Ca -0.01 0.36 -0.01 0.00 -0.01 0.00 0.00 64.34 64.67 1a7m n VAL 87 Cb 0.61 -1.94 0.02 0.00 -0.91 0.00 0.00 33.84 31.61 1a7m n VAL 87 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1a7m n ALA 88 N -2.98 -0.09 0.03 3.52 0.00 0.39 0.19 120.51 121.57 1a7m n ALA 88 Ca -0.04 0.59 -0.11 0.00 0.00 0.00 0.00 53.44 53.88 1a7m n ALA 88 Cb 0.14 -0.26 0.02 0.00 0.00 0.00 0.00 19.45 19.35 1a7m n ALA 88 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 1a7m h TYR 89 N 0.00 0.68 0.47 0.00 -0.00 -1.67 -2.85 116.97 113.59 1a7m h TYR 89 Ca 0.20 -0.28 -0.02 0.00 -0.00 0.00 0.00 58.73 58.63 1a7m h TYR 89 Cb 0.35 -0.11 0.00 0.00 -0.00 0.00 0.00 36.73 36.97 1a7m h TYR 89 CO -0.53 1.05 -0.22 1.25 -0.00 0.00 0.00 178.16 179.70 1a7m h LEU 90 N 0.36 -0.53 -0.64 0.10 5.85 0.28 -2.79 115.31 117.94 1a7m h LEU 90 Ca -0.02 0.02 0.19 0.00 0.84 0.00 0.00 57.88 58.90 1a7m h LEU 90 Cb 1.27 0.14 -0.12 0.00 0.37 0.00 0.00 40.66 42.31 1a7m h LEU 90 CO 0.13 -0.14 0.05 -1.20 -0.34 0.00 0.00 178.44 176.94 1a7m n SER 91 N -5.03 -0.04 -0.03 1.25 7.64 0.45 0.18 113.62 118.04 1a7m n SER 91 Ca -0.08 1.09 -0.12 0.00 1.01 0.00 0.00 58.87 60.77 1a7m n SER 91 Cb 0.25 -0.41 -0.06 0.00 -1.01 0.00 0.00 64.21 62.97 1a7m n SER 91 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a7m h ALA 92 N 1.28 0.15 -0.39 -0.43 0.00 -1.46 0.22 119.26 118.63 1a7m h ALA 92 Ca 0.41 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 1a7m h ALA 92 Cb 0.88 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1a7m h ALA 92 CO -0.59 -0.21 0.06 0.77 0.00 0.00 0.00 179.25 179.27 1a7m h SER 93 N -0.02 0.55 -0.05 0.00 0.02 0.22 -1.16 113.55 113.11 1a7m h SER 93 Ca 0.04 -0.09 -0.12 0.00 -0.84 0.00 0.00 61.79 60.78 1a7m h SER 93 Cb 0.26 -0.14 0.01 0.00 0.14 0.00 0.00 62.40 62.66 1a7m h SER 93 CO 0.00 0.58 -0.42 -0.07 -1.14 0.00 0.00 176.83 175.78 1a7m h LEU 94 N 0.58 0.45 -0.68 5.07 4.07 -0.44 -3.19 115.31 121.18 1a7m h LEU 94 Ca 0.13 -0.70 0.10 0.00 0.08 0.00 0.00 57.88 57.49 1a7m h LEU 94 Cb 0.28 -0.14 -0.07 0.00 1.08 0.00 0.00 40.66 41.81 1a7m h LEU 94 CO 0.00 1.08 0.31 0.74 -1.08 0.00 0.00 178.44 179.49 1a7m h THR 95 N -0.14 0.80 -0.11 0.22 2.02 0.17 0.77 112.91 116.65 1a7m h THR 95 Ca -0.04 -0.18 0.03 0.00 0.77 0.00 0.00 66.41 66.99 1a7m h THR 95 Cb 1.11 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.72 1a7m h THR 95 CO 0.09 0.09 -0.10 -0.55 0.37 0.00 0.00 175.52 175.42 1a7m h ASN 96 N 0.52 -0.31 -0.63 4.18 -1.07 -1.27 -1.38 115.58 115.62 1a7m h ASN 96 Ca 0.34 0.06 0.13 0.00 0.07 0.00 0.00 56.30 56.91 1a7m h ASN 96 Cb 0.39 0.16 -0.11 0.00 -2.07 0.00 0.00 38.32 36.69 1a7m h ASN 96 CO -0.29 -0.13 -0.01 0.40 0.07 0.00 0.00 177.43 177.46 1a7m h ILE 97 N -0.12 0.47 -0.97 6.14 1.08 -1.26 0.59 117.51 123.44 1a7m h ILE 97 Ca 0.08 -0.04 0.17 0.00 -0.39 0.00 0.00 64.86 64.68 1a7m h ILE 97 Cb 0.23 0.35 -0.17 0.00 -3.07 0.00 0.00 36.82 34.16 1a7m h ILE 97 CO -0.18 0.02 -0.33 0.74 -0.69 0.00 0.00 178.15 177.71 1a7m h THR 98 N 0.11 0.02 0.09 -0.27 2.02 0.27 0.46 112.91 115.60 1a7m h THR 98 Ca 0.33 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.51 1a7m h THR 98 Cb 0.54 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1a7m h THR 98 CO -0.55 0.00 -0.04 -0.09 0.37 0.00 0.00 175.52 175.20 1a7m h ARG 99 N -0.01 -0.12 -0.08 6.66 2.43 -0.99 -2.75 114.38 119.52 1a7m h ARG 99 Ca 0.39 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.58 1a7m h ARG 99 Cb 0.64 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1a7m h ARG 99 CO -0.99 -0.08 -0.05 -0.25 -1.51 0.00 0.00 179.97 177.09 1a7m n ASP 100 N -3.44 -0.09 -0.08 -3.80 8.00 0.04 0.38 116.55 117.56 1a7m n ASP 100 Ca -0.02 0.54 -0.14 0.00 0.71 0.00 0.00 54.79 55.89 1a7m n ASP 100 Cb 0.05 -0.22 -0.09 0.00 -0.02 0.00 0.00 41.12 40.84 1a7m n ASP 100 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1a7m h GLN 101 N 0.00 -0.44 -1.28 -1.24 1.08 -0.25 0.84 115.11 113.82 1a7m h GLN 101 Ca 0.01 0.03 0.41 0.00 -1.45 0.00 0.00 58.65 57.65 1a7m h GLN 101 Cb 0.03 0.10 -0.12 0.00 -0.05 0.00 0.00 27.48 27.44 1a7m h GLN 101 CO -0.08 -0.30 0.83 -0.22 -0.95 0.00 0.00 178.83 178.11 1a7m h LYS 102 N -0.46 0.12 0.00 1.46 3.11 0.25 0.25 116.57 121.29 1a7m h LYS 102 Ca 0.07 -0.01 -0.00 0.00 -2.81 0.00 0.00 60.65 57.90 1a7m h LYS 102 Cb 0.63 -0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 31.83 1a7m h LYS 102 CO -0.53 0.08 -1.81 0.28 -2.81 0.00 0.00 179.45 174.67 1a7m n VAL 103 N -4.68 0.13 0.01 2.00 0.31 0.01 -4.50 118.33 111.60 1a7m n VAL 103 Ca 0.35 -0.51 -0.21 0.00 -0.01 0.00 0.00 64.34 63.96 1a7m n VAL 103 Cb 1.35 -0.07 -0.14 0.00 -0.91 0.00 0.00 33.84 34.08 1a7m n VAL 103 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1a7m n LEU 104 N -2.34 2.56 -3.86 7.52 4.77 0.27 -4.95 117.00 120.98 1a7m n LEU 104 Ca -0.03 0.22 -0.21 0.00 -0.03 0.00 0.00 56.01 55.96 1a7m n LEU 104 Cb 0.57 -1.07 -0.17 0.00 -2.33 0.00 0.00 43.42 40.42 1a7m n LEU 104 CO 0.45 0.84 -0.40 0.20 -1.33 0.00 0.00 177.39 177.14 1a7m s ASN 105 N -7.01 1.25 0.54 -1.43 -0.87 0.51 -5.05 114.94 102.89 1a7m s ASN 105 Ca -0.21 -0.13 0.23 0.00 -1.57 0.00 0.00 52.86 51.17 1a7m s ASN 105 Cb 0.07 -0.48 1.44 0.00 -0.02 0.00 0.00 41.25 42.26 1a7m s ASN 105 CO 0.77 -0.10 2.10 1.55 -2.57 0.00 0.00 177.10 178.86 1a7m h PRO 106 N 7.61 0.00 0.00 -0.60 0.13 -1.86 0.25 132.00 137.54 1a7m h PRO 106 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1a7m h PRO 106 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1a7m h PRO 106 CO 0.40 0.00 -1.63 0.45 -0.23 0.00 0.00 178.00 176.99 1a7m n SER 107 N -4.27 0.56 -0.28 1.44 2.88 -1.26 -4.13 113.62 108.57 1a7m n SER 107 Ca 0.02 -0.27 -0.02 0.00 -1.33 0.00 0.00 58.87 57.27 1a7m n SER 107 Cb 0.29 1.66 0.11 0.00 -0.75 0.00 0.00 64.21 65.51 1a7m n SER 107 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1a7m h ALA 108 N 2.09 1.04 -0.75 -1.46 0.00 -0.80 0.61 119.26 119.98 1a7m h ALA 108 Ca 0.00 -0.02 0.30 0.00 0.00 0.00 0.00 54.91 55.20 1a7m h ALA 108 Cb 0.79 -0.23 -0.12 0.00 0.00 0.00 0.00 17.79 18.23 1a7m h ALA 108 CO 0.00 0.25 0.43 1.33 0.00 0.00 0.00 179.25 181.26 1a7m n VAL 109 N -4.64 -0.27 0.04 0.00 0.24 -1.03 0.21 118.33 112.88 1a7m n VAL 109 Ca 0.10 1.40 -0.11 0.00 -2.04 0.00 0.00 64.34 63.68 1a7m n VAL 109 Cb 0.12 -2.27 -0.08 0.00 -1.47 0.00 0.00 33.84 30.14 1a7m n VAL 109 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1a7m h SER 110 N 0.00 -0.15 -0.68 -1.34 0.02 -1.15 -0.92 113.55 109.33 1a7m h SER 110 Ca 0.60 -0.41 0.13 0.00 -0.84 0.00 0.00 61.79 61.28 1a7m h SER 110 Cb 1.66 0.04 -0.13 0.00 0.14 0.00 0.00 62.40 64.11 1a7m h SER 110 CO -0.50 0.42 -0.20 0.17 -1.14 0.00 0.00 176.83 175.58 1a7m h LEU 111 N -0.80 -0.72 -1.23 5.07 8.10 0.27 0.49 115.31 126.49 1a7m h LEU 111 Ca -0.02 0.21 0.09 0.00 0.11 0.00 0.00 57.88 58.27 1a7m h LEU 111 Cb 0.55 0.45 -0.06 0.00 -0.44 0.00 0.00 40.66 41.16 1a7m h LEU 111 CO 0.03 -0.24 0.56 -0.74 -4.11 0.00 0.00 178.44 173.94 1a7m h HIS 112 N -0.02 0.93 -0.08 0.17 2.76 -0.77 -1.01 115.15 117.13 1a7m h HIS 112 Ca 0.32 0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.55 1a7m h HIS 112 Cb 0.51 -0.30 -0.04 0.00 1.55 0.00 0.00 27.41 29.13 1a7m h HIS 112 CO -0.57 0.44 -0.16 0.77 -1.30 0.00 0.00 177.93 177.12 1a7m h SER 113 N 0.88 -0.48 -0.20 3.26 0.02 0.14 0.51 113.55 117.68 1a7m h SER 113 Ca 0.39 0.08 0.05 0.00 -0.84 0.00 0.00 61.79 61.48 1a7m h SER 113 Cb 0.36 0.22 -0.06 0.00 0.14 0.00 0.00 62.40 63.06 1a7m h SER 113 CO -0.16 -0.21 -0.19 0.11 -1.14 0.00 0.00 176.83 175.24 1a7m h LYS 114 N -0.22 -0.20 -0.99 3.45 1.57 -1.02 -0.59 116.57 118.58 1a7m h LYS 114 Ca 0.08 0.01 0.21 0.00 -1.87 0.00 0.00 60.65 59.08 1a7m h LYS 114 Cb 0.33 0.04 -0.11 0.00 0.08 0.00 0.00 32.23 32.57 1a7m h LYS 114 CO -0.21 -0.13 0.58 1.25 -0.57 0.00 0.00 179.45 180.37 1a7m h LEU 115 N -0.20 0.70 -0.83 2.94 6.46 -0.14 0.13 115.31 124.37 1a7m h LEU 115 Ca 0.12 0.11 -0.02 0.00 -0.12 0.00 0.00 57.88 57.98 1a7m h LEU 115 Cb 0.38 -0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.27 1a7m h LEU 115 CO -0.32 0.20 0.45 0.78 -0.62 0.00 0.00 178.44 178.93 1a7m h ASN 116 N 0.67 1.03 0.47 1.25 4.21 0.16 -1.42 115.58 121.95 1a7m h ASN 116 Ca 0.59 -0.10 -0.02 0.00 1.21 0.00 0.00 56.30 57.98 1a7m h ASN 116 Cb 1.00 -0.26 0.00 0.00 -1.12 0.00 0.00 38.32 37.94 1a7m h ASN 116 CO -0.42 0.83 -0.22 0.00 -1.29 0.00 0.00 177.43 176.33 1a7m h ALA 117 N 1.24 -0.87 -0.71 -0.83 0.00 -0.42 0.74 119.26 118.42 1a7m h ALA 117 Ca 0.29 -0.14 0.13 0.00 0.00 0.00 0.00 54.91 55.20 1a7m h ALA 117 Cb 0.03 0.24 -0.13 0.00 0.00 0.00 0.00 17.79 17.93 1a7m h ALA 117 CO -0.05 -0.82 -0.21 0.25 0.00 0.00 0.00 179.25 178.42 1a7m n THR 118 N -4.24 -0.32 0.52 0.00 -2.24 -0.42 0.48 114.28 108.05 1a7m n THR 118 Ca -0.08 1.64 -0.20 0.00 -2.27 0.00 0.00 64.05 63.14 1a7m n THR 118 Cb 0.25 -2.24 -0.10 0.00 -2.10 0.00 0.00 70.33 66.14 1a7m n THR 118 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1a7m h ILE 119 N 0.00 0.03 -0.24 2.28 2.04 -1.18 0.79 117.51 121.23 1a7m h ILE 119 Ca 0.31 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 66.15 1a7m h ILE 119 Cb 0.49 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1a7m h ILE 119 CO -0.73 0.00 0.11 -0.78 0.00 0.00 0.00 178.15 176.76 1a7m h ASP 120 N -1.33 0.32 -0.84 1.72 3.58 0.21 0.69 116.42 120.76 1a7m h ASP 120 Ca -0.13 -0.13 0.03 0.00 0.42 0.00 0.00 57.03 57.22 1a7m h ASP 120 Cb 1.01 -0.08 -0.05 0.00 1.72 0.00 0.00 39.33 41.93 1a7m h ASP 120 CO 0.22 0.36 0.55 -0.37 -2.88 0.00 0.00 179.24 177.13 1a7m h VAL 121 N 0.25 1.15 -0.58 2.25 -1.51 -0.02 0.37 116.25 118.16 1a7m h VAL 121 Ca 0.08 -0.36 -0.07 0.00 -1.23 0.00 0.00 66.70 65.11 1a7m h VAL 121 Cb 0.13 -0.00 -0.02 0.00 -2.13 0.00 0.00 31.29 29.27 1a7m h VAL 121 CO -0.01 0.19 0.07 0.24 -1.23 0.00 0.00 177.57 176.84 1a7m h MET 122 N 1.06 0.98 -0.75 5.19 2.86 0.02 0.46 114.93 124.74 1a7m h MET 122 Ca 0.33 -0.27 0.04 0.00 -2.06 0.00 0.00 59.70 57.74 1a7m h MET 122 Cb 0.01 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.51 1a7m h MET 122 CO -0.10 0.94 0.47 -0.09 1.06 0.00 0.00 176.91 179.19 1a7m h ARG 123 N 0.87 0.87 -0.57 1.72 2.43 0.32 0.34 114.38 120.36 1a7m h ARG 123 Ca 0.17 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.22 1a7m h ARG 123 Cb 0.45 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 1a7m h ARG 123 CO 0.02 0.57 0.06 0.78 -1.51 0.00 0.00 179.97 179.89 1a7m h GLY 124 N 0.89 1.02 0.16 2.80 0.00 0.46 -1.46 103.07 106.93 1a7m h GLY 124 Ca 0.31 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 1a7m h GLY 124 CO -0.13 0.62 -0.11 -2.00 0.00 0.00 0.00 176.54 174.92 1a7m h LEU 125 N 0.88 -0.29 -0.92 3.11 7.12 0.27 -0.38 115.31 125.11 1a7m h LEU 125 Ca 0.17 0.02 0.25 0.00 0.13 0.00 0.00 57.88 58.45 1a7m h LEU 125 Cb 0.44 0.09 -0.16 0.00 -0.53 0.00 0.00 40.66 40.49 1a7m h LEU 125 CO 0.01 -0.16 0.09 -0.07 -0.13 0.00 0.00 178.44 178.18 1a7m h LEU 126 N -0.26 -0.31 -0.54 2.25 4.07 -0.37 0.97 115.31 121.12 1a7m h LEU 126 Ca -0.02 0.24 0.10 0.00 0.08 0.00 0.00 57.88 58.28 1a7m h LEU 126 Cb 0.21 0.40 -0.08 0.00 1.08 0.00 0.00 40.66 42.27 1a7m h LEU 126 CO 0.01 -0.28 0.10 0.28 -1.08 0.00 0.00 178.44 177.47 1a7m h SER 127 N 0.07 -0.02 -0.41 -0.43 0.02 -0.79 0.15 113.55 112.14 1a7m h SER 127 Ca 0.56 0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 61.58 1a7m h SER 127 Cb 1.14 0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 1a7m h SER 127 CO -0.81 0.01 0.14 0.78 -1.14 0.00 0.00 176.83 175.81 1a7m h ASN 128 N 0.23 0.58 0.48 3.07 2.35 0.25 -2.75 115.58 119.80 1a7m h ASN 128 Ca 0.28 -0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 1a7m h ASN 128 Cb 0.39 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.62 1a7m h ASN 128 CO -0.37 0.62 -0.23 0.58 -1.65 0.00 0.00 177.43 176.38 1a7m h VAL 129 N 0.51 0.53 -0.77 2.81 2.07 0.72 -1.24 116.25 120.88 1a7m h VAL 129 Ca 0.13 -0.06 0.18 0.00 0.82 0.00 0.00 66.70 67.77 1a7m h VAL 129 Cb 0.24 0.56 -0.12 0.00 -1.52 0.00 0.00 31.29 30.44 1a7m h VAL 129 CO -0.01 0.01 0.15 0.25 0.02 0.00 0.00 177.57 177.99 1a7m h LEU 130 N -0.68 -0.08 0.04 2.57 7.12 -0.76 0.30 115.31 123.81 1a7m h LEU 130 Ca -0.07 0.17 -0.00 0.00 0.13 0.00 0.00 57.88 58.11 1a7m h LEU 130 Cb 0.51 0.25 0.00 0.00 -0.53 0.00 0.00 40.66 40.89 1a7m h LEU 130 CO 0.11 -0.10 -0.02 0.00 -0.13 0.00 0.00 178.44 178.30 1a7m h ARG 132 N -0.62 0.42 0.11 0.00 3.08 -0.50 -3.04 114.38 113.83 1a7m h ARG 132 Ca -0.01 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.03 1a7m h ARG 132 Cb 0.56 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.47 1a7m h ARG 132 CO 0.01 0.27 -0.52 -0.07 -1.07 0.00 0.00 179.97 178.59 1a7m h LEU 133 N 0.43 -1.57 -1.49 3.04 4.07 -0.34 -2.68 115.31 116.77 1a7m h LEU 133 Ca 0.37 0.17 0.32 0.00 0.08 0.00 0.00 57.88 58.81 1a7m h LEU 133 Cb 0.53 0.58 -0.09 0.00 1.08 0.00 0.00 40.66 42.76 1a7m h LEU 133 CO -0.37 -0.55 0.74 0.00 -1.08 0.00 0.00 178.44 177.18 1a7m n ASN 135 N -4.55 -0.03 -0.58 0.00 5.15 -1.01 -3.55 115.26 110.68 1a7m n ASN 135 Ca 0.28 0.08 -0.02 0.00 -0.60 0.00 0.00 54.58 54.31 1a7m n ASN 135 Cb 1.06 -0.02 -0.02 0.00 -0.53 0.00 0.00 39.78 40.27 1a7m n ASN 135 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1a7m n LYS 136 N -4.06 0.00 -0.13 1.20 5.02 -1.05 -5.06 118.16 114.08 1a7m n LYS 136 Ca 0.00 -0.32 -0.25 0.00 -2.02 0.00 0.00 58.31 55.72 1a7m n LYS 136 Cb 0.02 0.36 -0.09 0.00 -0.02 0.00 0.00 35.03 35.30 1a7m n LYS 136 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1a7m n TYR 137 N 0.00 0.22 -3.15 2.13 4.02 0.37 -4.79 117.16 115.96 1a7m n TYR 137 Ca -0.09 0.10 -0.22 0.00 -0.01 0.00 0.00 57.90 57.68 1a7m n TYR 137 Cb 0.39 -0.96 -0.04 0.00 -0.02 0.00 0.00 39.34 38.70 1a7m n TYR 137 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 1a7m n ARG 138 N -4.32 1.60 0.00 -0.72 3.00 -1.26 -4.88 116.66 110.08 1a7m n ARG 138 Ca -0.45 -3.82 0.00 0.00 -0.00 0.00 0.00 57.85 53.58 1a7m n ARG 138 Cb 0.79 -1.79 0.00 0.00 0.00 0.00 0.00 32.46 31.46 1a7m n ARG 138 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 1a7m n VAL 139 N 0.43 0.00 0.00 5.15 0.24 -1.26 -2.92 118.33 119.97 1a7m n VAL 139 Ca 0.26 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.56 1a7m n VAL 139 Cb 0.55 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.92 1a7m n VAL 139 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1a7m n GLY 140 N 0.00 -1.54 3.55 7.63 0.00 -1.26 -4.84 105.19 108.73 1a7m n GLY 140 Ca 0.00 0.55 -0.33 0.00 0.00 0.00 0.00 46.02 46.23 1a7m n GLY 140 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1a7m s HIS 141 N 0.00 2.87 0.50 1.61 5.65 -1.01 -2.09 115.29 122.83 1a7m s HIS 141 Ca 0.00 -0.03 0.27 0.00 0.25 0.00 0.00 55.06 55.56 1a7m s HIS 141 Cb 0.00 -1.68 1.37 0.00 -1.18 0.00 0.00 32.58 31.09 1a7m s HIS 141 CO 0.00 0.30 1.88 -0.24 -0.65 0.00 0.00 174.74 176.03 1a7m h VAL 142 N 4.25 0.59 -5.57 0.89 3.04 -1.93 -3.44 116.25 114.08 1a7m h VAL 142 Ca -0.48 -0.04 -0.03 0.00 -1.01 0.00 0.00 66.70 65.14 1a7m h VAL 142 Cb 1.17 0.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.92 1a7m h VAL 142 CO 0.52 0.02 -0.95 0.47 -1.01 0.00 0.00 177.57 176.62 1a7m n ASP 143 N -4.35 -7.49 -4.25 3.17 8.00 -1.26 -5.04 116.55 105.33 1a7m n ASP 143 Ca 0.18 0.95 -0.25 0.00 0.71 0.00 0.00 54.79 56.38 1a7m n ASP 143 Cb 0.87 -4.14 -0.13 0.00 -0.02 0.00 0.00 41.12 37.70 1a7m n ASP 143 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1a7m s VAL 144 N -1.60 1.64 0.12 2.53 0.11 -1.26 -5.16 120.40 116.78 1a7m s VAL 144 Ca 0.06 -1.30 0.02 0.00 -2.93 0.00 0.00 61.98 57.83 1a7m s VAL 144 Cb -0.01 -1.45 -0.04 0.00 -1.53 0.00 0.00 36.38 33.35 1a7m s VAL 144 CO 0.59 0.10 0.25 -2.16 -3.33 0.00 0.00 175.10 170.55 1a7m s PRO 145 N -1.42 3.41 -0.21 1.54 0.04 -1.26 -5.12 135.00 131.98 1a7m s PRO 145 Ca 0.07 -0.56 -0.12 0.00 0.04 0.00 0.00 61.00 60.43 1a7m s PRO 145 Cb -0.09 -2.98 -0.05 0.00 0.04 0.00 0.00 34.50 31.43 1a7m s PRO 145 CO 0.03 0.55 0.24 -1.25 0.04 0.00 0.00 177.00 176.60 1a7m s PRO 146 N -2.99 4.14 -0.41 0.56 0.04 -1.26 -5.04 135.00 130.05 1a7m s PRO 146 Ca 0.34 -0.09 0.08 0.00 0.04 0.00 0.00 61.00 61.37 1a7m s PRO 146 Cb -0.12 -3.51 0.26 0.00 0.04 0.00 0.00 34.50 31.18 1a7m s PRO 146 CO 0.28 0.09 0.63 1.55 0.04 0.00 0.00 177.00 179.60 1a7m n VAL 147 N 4.10 -0.48 -1.63 -0.36 3.14 -1.26 -5.14 118.33 116.70 1a7m n VAL 147 Ca -0.13 -3.49 -0.32 0.00 -2.96 0.00 0.00 64.34 57.44 1a7m n VAL 147 Cb 0.52 -0.99 0.05 0.00 -1.06 0.00 0.00 33.84 32.36 1a7m n VAL 147 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1a7m s PRO 148 N -0.89 2.81 -0.28 1.45 0.04 -1.26 -4.75 135.00 132.13 1a7m s PRO 148 Ca 0.35 1.15 -0.23 0.00 0.04 0.00 0.00 61.00 62.30 1a7m s PRO 148 Cb 0.20 -1.97 0.09 0.00 0.04 0.00 0.00 34.50 32.87 1a7m s PRO 148 CO -0.13 -1.21 0.80 0.34 0.04 0.00 0.00 177.00 176.84 1a7m s ASP 149 N -3.23 -0.69 0.00 6.66 -1.08 -1.26 -5.05 116.67 112.02 1a7m s ASP 149 Ca 0.62 1.29 0.00 0.00 -0.52 0.00 0.00 52.55 53.94 1a7m s ASP 149 Cb -0.16 1.30 0.00 0.00 -1.46 0.00 0.00 42.92 42.60 1a7m s ASP 149 CO 0.49 -0.22 0.85 1.41 0.52 0.00 0.00 175.17 178.22 1a7m n HIS 150 N 2.83 0.00 -1.67 -5.34 8.25 -1.26 -4.22 115.22 113.81 1a7m n HIS 150 Ca -0.15 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.00 1a7m n HIS 150 Cb 0.56 -0.02 -0.04 0.00 1.12 0.00 0.00 29.99 31.61 1a7m n HIS 150 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1a7m n SER 151 N 0.00 7.06 -0.12 0.41 7.64 -1.26 -4.22 113.62 123.13 1a7m n SER 151 Ca 0.00 -3.16 -0.16 0.00 1.01 0.00 0.00 58.87 56.56 1a7m n SER 151 Cb 0.64 -1.29 -0.12 0.00 -1.01 0.00 0.00 64.21 62.44 1a7m n SER 151 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1a7m n ASP 152 N 1.26 1.80 -3.89 6.43 2.03 -1.26 -4.97 116.55 117.95 1a7m n ASP 152 Ca 0.54 -0.11 -0.11 0.00 0.52 0.00 0.00 54.79 55.63 1a7m n ASP 152 Cb 0.44 -0.16 -0.10 0.00 -0.72 0.00 0.00 41.12 40.58 1a7m n ASP 152 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1a7m s LYS 153 N -2.49 0.45 0.00 -0.67 1.02 -1.26 -5.06 119.74 111.73 1a7m s LYS 153 Ca -0.29 -0.43 0.00 0.00 0.02 0.00 0.00 55.97 55.27 1a7m s LYS 153 Cb 0.08 0.18 0.00 0.00 -0.52 0.00 0.00 37.83 37.57 1a7m s LYS 153 CO 0.60 -0.10 0.00 -1.91 -0.92 0.00 0.00 175.35 173.02 1a7m n GLU 154 N 1.50 0.00 -0.29 1.68 4.07 -1.26 -1.20 120.64 125.14 1a7m n GLU 154 Ca -0.23 0.05 0.22 0.00 -0.06 0.00 0.00 57.16 57.14 1a7m n GLU 154 Cb 0.55 -0.35 0.41 0.00 -0.06 0.00 0.00 31.44 31.99 1a7m n GLU 154 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1a7m n VAL 155 N -1.30 -0.37 0.11 6.31 0.31 -1.26 0.14 118.33 122.27 1a7m n VAL 155 Ca 0.00 1.85 -0.05 0.00 -0.01 0.00 0.00 64.34 66.14 1a7m n VAL 155 Cb 0.00 -2.87 -0.02 0.00 -0.91 0.00 0.00 33.84 30.03 1a7m n VAL 155 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1a7m h PHE 156 N 0.00 -0.27 -0.46 3.52 -1.00 -1.98 -2.26 116.94 114.47 1a7m h PHE 156 Ca 0.66 -0.01 0.13 0.00 2.81 0.00 0.00 57.97 61.56 1a7m h PHE 156 Cb 1.61 0.09 -0.09 0.00 3.61 0.00 0.00 35.95 41.17 1a7m h PHE 156 CO -0.20 -0.17 0.01 0.94 -1.61 0.00 0.00 178.31 177.28 1a7m n GLN 157 N -3.02 -0.04 -0.03 1.51 0.00 0.37 0.18 117.38 116.36 1a7m n GLN 157 Ca -0.04 0.70 -0.12 0.00 -0.00 0.00 0.00 57.00 57.54 1a7m n GLN 157 Cb 0.12 -1.11 -0.07 0.00 0.00 0.00 0.00 30.24 29.18 1a7m n GLN 157 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 1a7m h LYS 158 N 0.00 0.17 0.12 3.69 3.64 -1.24 0.22 116.57 123.18 1a7m h LYS 158 Ca 0.28 -0.05 -0.17 0.00 -1.27 0.00 0.00 60.65 59.44 1a7m h LYS 158 Cb 0.57 -0.02 0.02 0.00 -0.41 0.00 0.00 32.23 32.40 1a7m h LYS 158 CO -0.44 0.39 -0.75 0.87 -2.27 0.00 0.00 179.45 177.25 1a7m h LYS 159 N -0.07 0.29 -0.17 1.90 1.57 0.24 -3.33 116.57 117.01 1a7m h LYS 159 Ca 0.03 -0.48 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1a7m h LYS 159 Cb 0.30 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1a7m h LYS 159 CO 0.00 1.22 0.00 0.36 -0.57 0.00 0.00 179.45 180.46 1a7m n LYS 160 N -4.16 1.81 -0.25 3.15 2.85 0.26 -4.22 118.16 117.60 1a7m n LYS 160 Ca -0.13 -1.21 0.20 0.00 -1.05 0.00 0.00 58.31 56.11 1a7m n LYS 160 Cb 0.79 -1.42 0.37 0.00 -0.65 0.00 0.00 35.03 34.12 1a7m n LYS 160 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 1a7m n LEU 161 N 0.44 0.13 -0.05 -5.58 0.00 0.79 0.64 117.00 113.37 1a7m n LEU 161 Ca 0.17 1.28 -0.02 0.00 0.00 0.00 0.00 56.01 57.44 1a7m n LEU 161 Cb 0.36 -0.57 -0.13 0.00 0.00 0.00 0.00 43.42 43.09 1a7m n LEU 161 CO 0.14 -1.39 -0.89 0.61 0.00 0.00 0.00 177.39 175.86 1a7m n GLY 162 N -1.27 -0.77 0.07 -3.96 0.00 -1.26 -4.42 105.19 93.59 1a7m n GLY 162 Ca 0.25 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 1a7m n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a7m h GLN 164 N -0.34 0.00 0.08 0.00 -0.00 -0.24 0.15 115.11 114.76 1a7m h GLN 164 Ca 0.01 0.00 -0.34 0.00 -0.00 0.00 0.00 58.65 58.31 1a7m h GLN 164 Cb 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 27.48 27.96 1a7m h GLN 164 CO 0.01 0.00 -1.92 1.28 0.00 0.00 0.00 178.83 178.20 1a7m n LEU 165 N -3.17 2.08 -0.13 -2.39 4.77 -0.82 -3.72 117.00 113.62 1a7m n LEU 165 Ca -0.03 0.27 -0.12 0.00 -0.03 0.00 0.00 56.01 56.10 1a7m n LEU 165 Cb 0.10 -0.71 -0.02 0.00 -2.33 0.00 0.00 43.42 40.46 1a7m n LEU 165 CO 0.22 0.71 0.64 -0.07 -1.33 0.00 0.00 177.39 177.56 1a7m h LEU 166 N 0.05 0.87 -0.15 2.23 -0.00 0.43 0.16 115.31 118.89 1a7m h LEU 166 Ca -0.39 -0.41 0.02 0.00 -0.00 0.00 0.00 57.88 57.10 1a7m h LEU 166 Cb 2.03 -0.24 -0.04 0.00 -0.00 0.00 0.00 40.66 42.41 1a7m h LEU 166 CO 0.08 1.09 -0.27 1.23 -0.00 0.00 0.00 178.44 180.57 1a7m h GLY 167 N 0.65 -1.43 -0.13 0.83 0.00 -1.15 0.40 103.07 102.24 1a7m h GLY 167 Ca 0.08 0.74 0.02 0.00 0.00 0.00 0.00 47.33 48.18 1a7m h GLY 167 CO 0.06 -0.42 -0.26 -0.84 0.00 0.00 0.00 176.54 175.08 1a7m h THR 168 N -0.23 0.00 -0.96 4.70 2.02 -1.12 -1.50 112.91 115.81 1a7m h THR 168 Ca 0.03 0.00 0.35 0.00 0.77 0.00 0.00 66.41 67.56 1a7m h THR 168 Cb 0.31 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 66.54 1a7m h THR 168 CO -0.27 0.00 0.34 0.00 0.37 0.00 0.00 175.52 175.96 1a7m n TYR 169 N -3.93 0.94 0.14 3.16 4.19 0.54 -1.01 117.16 121.19 1a7m n TYR 169 Ca -0.02 1.15 -0.06 0.00 3.31 0.00 0.00 57.90 62.28 1a7m n TYR 169 Cb 0.17 -1.43 -0.03 0.00 0.49 0.00 0.00 39.34 38.55 1a7m n TYR 169 CO 0.00 0.00 0.00 -0.22 0.91 0.00 0.00 176.86 177.55 1a7m h LYS 170 N 0.00 -0.35 -1.01 2.98 3.64 0.87 0.49 116.57 123.19 1a7m h LYS 170 Ca 0.73 0.02 0.27 0.00 -1.27 0.00 0.00 60.65 60.41 1a7m h LYS 170 Cb 1.82 0.08 -0.07 0.00 -0.41 0.00 0.00 32.23 33.66 1a7m h LYS 170 CO -0.80 -0.23 0.68 0.37 -2.27 0.00 0.00 179.45 177.20 1a7m h GLN 171 N -0.36 0.22 0.13 1.90 -0.00 -0.96 -0.78 115.11 115.27 1a7m h GLN 171 Ca -0.04 -0.01 -0.32 0.00 -0.00 0.00 0.00 58.65 58.28 1a7m h GLN 171 Cb 0.28 -0.05 -0.00 0.00 0.00 0.00 0.00 27.48 27.70 1a7m h GLN 171 CO 0.06 0.15 -1.66 -0.39 0.00 0.00 0.00 178.83 176.99 1a7m h VAL 172 N 0.23 0.89 -0.72 2.39 -1.51 -1.27 -3.30 116.25 112.95 1a7m h VAL 172 Ca 0.52 -2.40 0.06 0.00 -1.23 0.00 0.00 66.70 63.65 1a7m h VAL 172 Cb 1.63 2.64 -0.06 0.00 -2.13 0.00 0.00 31.29 33.38 1a7m h VAL 172 CO -0.15 0.78 0.42 0.40 -1.23 0.00 0.00 177.57 177.80 1a7m h ILE 173 N -0.12 1.00 0.00 7.19 1.08 0.62 0.62 117.51 127.91 1a7m h ILE 173 Ca -0.35 -0.27 0.00 0.00 -0.39 0.00 0.00 64.86 63.85 1a7m h ILE 173 Cb 1.91 0.15 0.00 0.00 -3.07 0.00 0.00 36.82 35.81 1a7m h ILE 173 CO 0.09 0.14 0.02 0.77 -0.69 0.00 0.00 178.15 178.48 1a7m h SER 174 N 0.78 0.00 0.18 1.72 4.64 -1.28 0.38 113.55 119.98 1a7m h SER 174 Ca 0.32 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.30 1a7m h SER 174 Cb 0.16 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.19 1a7m h SER 174 CO -0.17 0.00 -2.14 0.52 -0.87 0.00 0.00 176.83 174.17 1a7m n VAL 175 N -2.33 1.45 -0.02 0.95 0.31 0.19 -3.56 118.33 115.32 1a7m n VAL 175 Ca -0.02 -0.83 -0.10 0.00 -0.01 0.00 0.00 64.34 63.38 1a7m n VAL 175 Cb 0.06 -0.66 -0.14 0.00 -0.91 0.00 0.00 33.84 32.19 1a7m n VAL 175 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1a7m n VAL 176 N -2.85 1.64 0.26 2.52 0.24 0.32 -2.02 118.33 118.45 1a7m n VAL 176 Ca -0.27 -0.78 0.13 0.00 -2.04 0.00 0.00 64.34 61.39 1a7m n VAL 176 Cb 1.11 -1.14 0.73 0.00 -1.47 0.00 0.00 33.84 33.07 1a7m n VAL 176 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 1a7m h VAL 177 N 0.01 0.51 -0.29 3.34 3.04 -0.54 0.22 116.25 122.54 1a7m h VAL 177 Ca -0.30 -0.55 -0.08 0.00 -1.01 0.00 0.00 66.70 64.76 1a7m h VAL 177 Cb 2.02 1.37 -0.05 0.00 -2.01 0.00 0.00 31.29 32.61 1a7m h VAL 177 CO 0.08 0.11 -0.03 1.67 -1.01 0.00 0.00 177.57 178.40 1a7m n GLN 178 N -3.58 2.31 -0.13 4.17 -0.06 -1.21 -4.60 117.38 114.28 1a7m n GLN 178 Ca -0.02 -2.97 -0.26 0.00 -2.00 0.00 0.00 57.00 51.75 1a7m n GLN 178 Cb 0.25 -1.81 -0.10 0.00 -4.06 0.00 0.00 30.24 24.52 1a7m n GLN 178 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1a7m n ALA 179 N -0.86 1.33 0.02 1.69 0.00 0.76 -4.95 120.51 118.49 1a7m n ALA 179 Ca 0.26 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.65 1a7m n ALA 179 Cb 0.94 0.12 0.00 0.00 0.00 0.00 0.00 19.45 20.51 1a7m n ALA 179 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47