#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 0.46 -0.32 1.43 0.04 -1.26 -5.07 135.00 130.28 1a7m s PRO 2 Ca 0.00 -0.08 0.03 0.00 0.04 0.00 0.00 61.00 60.99 1a7m s PRO 2 Cb 0.00 -1.79 0.09 0.00 0.04 0.00 0.00 34.50 32.84 1a7m s PRO 2 CO 0.00 -2.59 0.02 -0.48 0.04 0.00 0.00 177.00 173.99 1a7m s LEU 3 N -6.15 4.47 -0.06 -3.56 0.05 -1.26 -5.03 118.68 107.14 1a7m s LEU 3 Ca 0.69 -1.95 -0.05 0.00 0.05 0.00 0.00 54.13 52.87 1a7m s LEU 3 Cb -0.09 -1.63 -0.20 0.00 -2.05 0.00 0.00 46.19 42.22 1a7m s LEU 3 CO 0.53 -0.34 2.91 -0.81 -0.55 0.00 0.00 176.35 178.09 1a7m n PRO 4 N 4.32 1.61 -3.10 1.48 -0.04 -1.26 -4.47 135.00 133.55 1a7m n PRO 4 Ca -0.01 -0.82 -0.25 0.00 -0.04 0.00 0.00 63.50 62.37 1a7m n PRO 4 Cb 0.42 -1.92 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 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 2.67 2.05 -3.68 0.52 -0.00 -1.26 -4.96 119.36 114.71 1a7m n ILE 5 Ca 0.35 -5.22 -0.29 0.00 -0.00 0.00 0.00 62.75 57.59 1a7m n ILE 5 Cb 0.69 -1.34 -0.10 0.00 -0.00 0.00 0.00 39.64 38.89 1a7m n ILE 5 CO 0.00 0.00 0.00 1.07 -0.00 0.00 0.00 176.55 177.62 1a7m n THR 6 N 0.17 2.12 -0.75 1.39 5.66 -1.26 -4.94 114.28 116.67 1a7m n THR 6 Ca 0.29 -5.05 -0.12 0.00 -3.05 0.00 0.00 64.05 56.11 1a7m n THR 6 Cb 0.46 -2.17 -0.10 0.00 -1.55 0.00 0.00 70.33 66.97 1a7m n THR 6 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1a7m n PRO 7 N 1.54 1.65 -3.15 1.09 -0.04 -1.26 -4.26 135.00 130.57 1a7m n PRO 7 Ca 0.24 -0.90 -0.19 0.00 -0.04 0.00 0.00 63.50 62.61 1a7m n PRO 7 Cb 0.37 -1.99 -0.03 0.00 -0.04 0.00 0.00 33.50 31.81 1a7m n PRO 7 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1a7m n VAL 8 N 2.90 -0.34 -2.89 0.52 3.14 -1.26 -5.01 118.33 115.39 1a7m n VAL 8 Ca 0.35 -4.09 -0.43 0.00 -2.96 0.00 0.00 64.34 57.21 1a7m n VAL 8 Cb 0.56 -0.70 0.01 0.00 -1.06 0.00 0.00 33.84 32.64 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 0.74 6.10 -2.23 6.55 4.13 -1.26 -4.58 115.26 124.71 1a7m n ASN 9 Ca 0.22 -3.33 -0.21 0.00 1.68 0.00 0.00 54.58 52.94 1a7m n ASN 9 Cb 0.61 -1.32 0.02 0.00 -1.54 0.00 0.00 39.78 37.55 1a7m n ASN 9 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1a7m n ALA 10 N 1.96 4.65 -1.71 5.41 0.00 -1.26 -4.62 120.51 124.93 1a7m n ALA 10 Ca 0.29 -3.71 0.05 0.00 0.00 0.00 0.00 53.44 50.06 1a7m n ALA 10 Cb 0.34 -0.45 0.18 0.00 0.00 0.00 0.00 19.45 19.52 1a7m n ALA 10 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1a7m n THR 11 N -0.64 1.96 -2.90 0.00 -2.24 -1.26 -4.40 114.28 104.80 1a7m n THR 11 Ca 0.37 -3.01 -0.17 0.00 -2.27 0.00 0.00 64.05 58.97 1a7m n THR 11 Cb 0.89 -0.11 -0.04 0.00 -2.10 0.00 0.00 70.33 68.97 1a7m n THR 11 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1a7m n ALA 13 N -2.13 2.19 -1.00 0.00 0.00 -1.26 -4.84 120.51 113.47 1a7m n ALA 13 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1a7m n ALA 13 Cb 0.22 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.92 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 -3.07 2.93 0.00 0.00 -6.64 -1.26 -4.64 119.36 106.68 1a7m n ILE 14 Ca 0.00 -1.64 0.00 0.00 -1.77 0.00 0.00 62.75 59.34 1a7m n ILE 14 Cb 0.00 -0.42 0.00 0.00 -1.44 0.00 0.00 39.64 37.78 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 -0.45 0.00 -4.18 6.28 0.63 -1.26 -4.91 116.66 112.77 1a7m n ARG 15 Ca 0.46 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 57.27 1a7m n ARG 15 Cb 1.45 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 34.26 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 0.00 1.09 -1.25 -0.14 3.76 -1.26 -5.00 115.29 112.48 1a7m s HIS 16 Ca 0.00 -1.33 0.00 0.00 -0.15 0.00 0.00 55.06 53.58 1a7m s HIS 16 Cb 0.00 -0.51 0.00 0.00 1.11 0.00 0.00 32.58 33.18 1a7m s HIS 16 CO 0.00 -0.65 0.55 -0.35 -0.85 0.00 0.00 174.74 173.45 1a7m n PRO 17 N -0.26 0.89 0.00 8.40 -0.04 -1.26 -4.71 135.00 138.02 1a7m n PRO 17 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1a7m n PRO 17 Cb 0.66 -1.33 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 1a7m n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a7m s HIS 19 N 0.00 1.27 0.00 0.00 0.09 -1.26 -5.12 115.29 110.27 1a7m s HIS 19 Ca 0.00 -1.43 0.00 0.00 -0.00 0.00 0.00 55.06 53.63 1a7m s HIS 19 Cb 0.00 -0.58 0.00 0.00 -0.00 0.00 0.00 32.58 32.00 1a7m s HIS 19 CO 0.00 -0.69 0.00 0.41 -0.00 0.00 0.00 174.74 174.46 1a7m n GLY 20 N -0.34 0.00 1.71 -2.22 0.00 -1.26 -4.74 105.19 98.34 1a7m n GLY 20 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 0.18 0.00 1.61 5.03 -1.26 -5.04 115.26 115.78 1a7m n ASN 21 Ca 0.00 0.36 0.00 0.00 0.87 0.00 0.00 54.58 55.81 1a7m n ASN 21 Cb 0.00 0.18 0.00 0.00 -1.02 0.00 0.00 39.78 38.94 1a7m n ASN 21 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1a7m n LEU 22 N -3.41 0.00 -0.32 3.41 4.32 -1.26 -4.50 117.00 115.25 1a7m n LEU 22 Ca 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1a7m n LEU 22 Cb 0.02 -0.04 0.06 0.00 -1.62 0.00 0.00 43.42 41.83 1a7m n LEU 22 CO 0.00 0.00 0.63 -0.03 -1.22 0.00 0.00 177.39 176.77 1a7m h MET 23 N 1.07 -0.04 -0.05 3.23 4.05 -1.95 0.70 114.93 121.94 1a7m h MET 23 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1a7m h MET 23 Cb 0.00 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 30.81 1a7m h MET 23 CO 0.00 -0.02 0.00 0.09 0.23 0.00 0.00 176.91 177.21 1a7m n ASN 24 N -5.50 0.92 -0.07 1.39 3.02 -1.26 -3.18 115.26 110.57 1a7m n ASN 24 Ca 0.10 -1.44 -0.10 0.00 -0.03 0.00 0.00 54.58 53.11 1a7m n ASN 24 Cb 0.41 -0.03 -0.07 0.00 -0.61 0.00 0.00 39.78 39.48 1a7m n ASN 24 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1a7m h GLN 25 N 1.33 0.00 -0.64 3.52 1.08 -0.05 -2.63 115.11 117.72 1a7m h GLN 25 Ca 0.00 0.00 0.10 0.00 -1.45 0.00 0.00 58.65 57.30 1a7m h GLN 25 Cb 0.29 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.68 1a7m h GLN 25 CO 0.00 0.51 0.43 -0.84 -0.95 0.00 0.00 178.83 177.98 1a7m h ILE 26 N -1.00 0.91 0.02 2.54 3.07 -1.22 0.33 117.51 122.16 1a7m h ILE 26 Ca -0.08 -0.17 -0.00 0.00 1.55 0.00 0.00 64.86 66.16 1a7m h ILE 26 Cb 0.70 0.38 0.00 0.00 -0.27 0.00 0.00 36.82 37.63 1a7m h ILE 26 CO -0.05 0.09 -0.01 0.50 -1.05 0.00 0.00 178.15 177.63 1a7m h LYS 27 N 0.48 -0.03 0.00 0.16 3.11 -1.62 0.32 116.57 119.00 1a7m h LYS 27 Ca 0.30 0.00 -0.07 0.00 -2.81 0.00 0.00 60.65 58.07 1a7m h LYS 27 Cb 0.52 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.75 1a7m h LYS 27 CO -0.09 0.07 -0.33 -0.91 -2.81 0.00 0.00 179.45 175.38 1a7m h ASN 28 N -0.12 0.00 0.00 4.20 4.21 -0.77 -2.81 115.58 120.29 1a7m h ASN 28 Ca -0.00 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.48 1a7m h ASN 28 Cb 0.11 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.31 1a7m h ASN 28 CO 0.00 0.33 -0.19 1.56 -1.29 0.00 0.00 177.43 177.85 1a7m h GLN 29 N 0.00 0.00 -0.99 0.81 1.08 -0.15 -3.35 115.11 112.51 1a7m h GLN 29 Ca -0.00 0.00 0.22 0.00 -1.45 0.00 0.00 58.65 57.41 1a7m h GLN 29 Cb 0.68 0.00 -0.19 0.00 -0.05 0.00 0.00 27.48 27.92 1a7m h GLN 29 CO 0.04 0.50 -0.18 -0.11 -0.95 0.00 0.00 178.83 178.13 1a7m n LEU 30 N -4.66 -0.30 -0.24 1.46 -0.00 0.11 0.43 117.00 113.80 1a7m n LEU 30 Ca -0.08 1.70 0.04 0.00 -0.00 0.00 0.00 56.01 57.67 1a7m n LEU 30 Cb 0.29 -0.54 0.15 0.00 -0.00 0.00 0.00 43.42 43.32 1a7m n LEU 30 CO 0.16 -1.65 0.86 0.00 -0.00 0.00 0.00 177.39 176.77 1a7m h ALA 31 N 1.98 0.79 -0.39 1.96 0.00 -1.63 0.92 119.26 122.89 1a7m h ALA 31 Ca 0.50 0.20 0.11 0.00 0.00 0.00 0.00 54.91 55.73 1a7m h ALA 31 Cb 0.85 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1a7m h ALA 31 CO -1.00 -0.39 0.34 1.96 0.00 0.00 0.00 179.25 180.16 1a7m h GLN 32 N 0.16 0.00 0.10 0.00 4.20 -0.17 0.34 115.11 119.74 1a7m h GLN 32 Ca 0.39 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.78 1a7m h GLN 32 Cb 0.67 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 1a7m h GLN 32 CO -0.58 0.00 -1.72 -0.07 -0.67 0.00 0.00 178.83 175.80 1a7m h LEU 33 N 0.00 0.34 0.59 1.46 3.38 0.72 -3.25 115.31 118.56 1a7m h LEU 33 Ca 0.19 -0.59 -0.03 0.00 0.09 0.00 0.00 57.88 57.54 1a7m h LEU 33 Cb 0.86 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.50 1a7m h LEU 33 CO -0.00 1.51 -0.29 -1.13 0.09 0.00 0.00 178.44 178.62 1a7m h ASN 34 N 0.06 -0.68 -0.79 -0.43 -1.24 0.36 0.64 115.58 113.51 1a7m h ASN 34 Ca -0.31 0.02 0.15 0.00 0.71 0.00 0.00 56.30 56.87 1a7m h ASN 34 Cb 2.03 0.17 -0.15 0.00 0.73 0.00 0.00 38.32 41.11 1a7m h ASN 34 CO 0.13 -0.42 -0.26 1.23 -1.29 0.00 0.00 177.43 176.82 1a7m h GLY 35 N -0.93 0.37 0.71 1.57 0.00 -0.95 -0.42 103.07 103.42 1a7m h GLY 35 Ca -0.08 0.34 -0.07 0.00 0.00 0.00 0.00 47.33 47.52 1a7m h GLY 35 CO 0.13 -0.27 -0.19 1.48 0.00 0.00 0.00 176.54 177.69 1a7m h SER 36 N -0.04 0.37 -1.11 0.19 4.64 -1.58 -2.62 113.55 113.41 1a7m h SER 36 Ca 0.35 -0.54 0.39 0.00 -0.47 0.00 0.00 61.79 61.52 1a7m h SER 36 Cb 0.59 -0.11 -0.11 0.00 -0.31 0.00 0.00 62.40 62.45 1a7m h SER 36 CO -0.82 0.84 0.71 0.00 -0.87 0.00 0.00 176.83 176.68 1a7m n ALA 37 N -2.45 1.10 0.02 5.18 0.00 0.22 0.26 120.51 124.84 1a7m n ALA 37 Ca -0.07 0.71 -0.18 0.00 0.00 0.00 0.00 53.44 53.90 1a7m n ALA 37 Cb 0.40 -0.86 -0.14 0.00 0.00 0.00 0.00 19.45 18.85 1a7m n ALA 37 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1a7m h ASN 38 N 0.00 0.36 0.00 0.00 -0.00 -1.36 -3.27 115.58 111.31 1a7m h ASN 38 Ca 0.71 -0.70 0.00 0.00 -0.00 0.00 0.00 56.30 56.32 1a7m h ASN 38 Cb 2.29 -0.12 0.00 0.00 -0.00 0.00 0.00 38.32 40.49 1a7m h ASN 38 CO -0.39 1.61 -0.15 0.00 -0.00 0.00 0.00 177.43 178.51 1a7m h ALA 39 N 0.33 0.00 -0.79 1.57 0.00 0.28 -3.35 119.26 117.30 1a7m h ALA 39 Ca -0.36 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.44 1a7m h ALA 39 Cb 2.04 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 19.88 1a7m h ALA 39 CO 0.11 0.15 -0.46 -0.11 0.00 0.00 0.00 179.25 178.94 1a7m n LEU 40 N -3.86 -0.82 -0.12 0.00 -0.00 0.73 0.39 117.00 113.32 1a7m n LEU 40 Ca -0.02 1.41 -0.01 0.00 -0.00 0.00 0.00 56.01 57.38 1a7m n LEU 40 Cb 0.08 -0.19 -0.00 0.00 -0.00 0.00 0.00 43.42 43.30 1a7m n LEU 40 CO 0.03 -1.15 0.16 0.33 -0.00 0.00 0.00 177.39 176.76 1a7m n PHE 41 N -5.00 -0.05 0.22 1.96 7.35 -1.18 0.14 117.46 120.90 1a7m n PHE 41 Ca 0.02 0.37 -0.09 0.00 -0.76 0.00 0.00 57.45 56.99 1a7m n PHE 41 Cb 0.21 -0.58 -0.04 0.00 0.35 0.00 0.00 39.48 39.42 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 0.00 0.00 -2.13 5.03 -0.20 0.15 117.51 120.36 1a7m h ILE 42 Ca 0.08 -0.29 0.00 0.00 -0.12 0.00 0.00 64.86 64.53 1a7m h ILE 42 Cb 0.16 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 33.95 1a7m h ILE 42 CO -0.29 0.00 0.36 0.77 -0.68 0.00 0.00 178.15 178.30 1a7m h SER 43 N -0.89 0.00 0.00 1.72 4.64 0.13 0.41 113.55 119.56 1a7m h SER 43 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1a7m h SER 43 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1a7m h SER 43 CO 0.10 0.00 -0.29 0.00 -0.87 0.00 0.00 176.83 175.77 1a7m n TYR 44 N -2.34 0.44 -0.03 4.77 9.36 0.36 -4.29 117.16 125.43 1a7m n TYR 44 Ca -0.01 0.19 0.07 0.00 3.32 0.00 0.00 57.90 61.47 1a7m n TYR 44 Cb 0.38 -0.49 0.46 0.00 -0.63 0.00 0.00 39.34 39.06 1a7m n TYR 44 CO 0.00 0.00 0.00 0.10 0.22 0.00 0.00 176.86 177.18 1a7m h TYR 45 N -0.52 0.48 -0.55 2.98 -0.00 0.45 -2.18 116.97 117.64 1a7m h TYR 45 Ca 0.00 0.01 0.08 0.00 0.00 0.00 0.00 58.73 58.82 1a7m h TYR 45 Cb 0.29 -0.16 -0.07 0.00 0.00 0.00 0.00 36.73 36.79 1a7m h TYR 45 CO -0.12 0.27 0.18 1.79 -0.00 0.00 0.00 178.16 180.28 1a7m h THR 46 N 0.49 0.78 -1.13 -0.90 1.35 -1.20 -0.43 112.91 111.87 1a7m h THR 46 Ca 0.20 -0.12 0.32 0.00 -0.55 0.00 0.00 66.41 66.25 1a7m h THR 46 Cb 0.18 0.39 -0.09 0.00 -1.73 0.00 0.00 68.15 66.91 1a7m h THR 46 CO -0.05 0.06 0.75 0.00 -0.25 0.00 0.00 175.52 176.03 1a7m h ALA 47 N 1.38 2.54 0.04 6.62 0.00 -1.57 0.23 119.26 128.50 1a7m h ALA 47 Ca 0.27 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.08 1a7m h ALA 47 Cb 0.33 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.20 1a7m h ALA 47 CO -0.29 -0.97 -0.62 1.96 0.00 0.00 0.00 179.25 179.34 1a7m h GLN 48 N 0.25 0.34 0.00 0.00 7.50 -1.18 -3.42 115.11 118.60 1a7m h GLN 48 Ca 0.63 -0.43 0.00 0.00 0.50 0.00 0.00 58.65 59.35 1a7m h GLN 48 Cb 1.88 0.13 0.00 0.00 0.05 0.00 0.00 27.48 29.55 1a7m h GLN 48 CO -0.25 1.12 0.00 0.41 -1.50 0.00 0.00 178.83 178.62 1a7m n GLY 49 N 1.26 2.66 2.93 3.46 0.00 0.07 -5.09 105.19 110.48 1a7m n GLY 49 Ca -0.11 -1.84 -0.31 0.00 0.00 0.00 0.00 46.02 43.76 1a7m n GLY 49 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a7m n GLU 50 N 0.78 0.00 -2.41 1.61 1.02 -1.26 -4.58 120.64 115.81 1a7m n GLU 50 Ca 0.00 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.77 1a7m n GLU 50 Cb 0.00 -0.99 -0.04 0.00 -0.02 0.00 0.00 31.44 30.39 1a7m n GLU 50 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1a7m s PRO 51 N -1.99 3.26 0.10 3.49 0.04 -1.26 -5.05 135.00 133.59 1a7m s PRO 51 Ca 0.29 -0.79 0.00 0.00 0.04 0.00 0.00 61.00 60.54 1a7m s PRO 51 Cb 0.09 -5.18 0.00 0.00 0.04 0.00 0.00 34.50 29.45 1a7m s PRO 51 CO 0.53 -2.54 0.00 1.19 0.04 0.00 0.00 177.00 176.22 1a7m n PHE 52 N 10.41 -0.89 0.18 0.56 3.01 -1.26 -4.81 117.46 124.66 1a7m n PHE 52 Ca 0.33 0.16 0.00 0.00 1.01 0.00 0.00 57.45 58.94 1a7m n PHE 52 Cb 0.50 0.50 0.00 0.00 -0.01 0.00 0.00 39.48 40.46 1a7m n PHE 52 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1a7m n PRO 53 N -2.86 0.02 -0.03 -1.08 -0.04 -1.26 0.80 135.00 130.54 1a7m n PRO 53 Ca 0.00 0.52 -0.00 0.00 -0.04 0.00 0.00 63.50 63.98 1a7m n PRO 53 Cb 0.00 -2.12 -0.09 0.00 -0.04 0.00 0.00 33.50 31.25 1a7m n PRO 53 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1a7m n ASN 54 N -1.75 2.37 -0.23 3.54 5.15 -1.26 -4.61 115.26 118.46 1a7m n ASN 54 Ca 0.00 0.00 0.08 0.00 -0.60 0.00 0.00 54.58 54.06 1a7m n ASN 54 Cb 0.73 1.10 0.13 0.00 -0.53 0.00 0.00 39.78 41.20 1a7m n ASN 54 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1a7m n ASN 55 N -2.18 1.92 -0.21 1.20 3.02 0.24 -4.70 115.26 114.54 1a7m n ASN 55 Ca -0.11 -3.02 0.13 0.00 -0.03 0.00 0.00 54.58 51.56 1a7m n ASN 55 Cb 0.61 -0.41 0.44 0.00 -0.61 0.00 0.00 39.78 39.81 1a7m n ASN 55 CO 0.00 0.00 0.00 0.17 -2.62 0.00 0.00 177.26 174.81 1a7m h LEU 56 N 0.15 0.52 -1.98 3.41 8.10 -0.33 0.23 115.31 125.42 1a7m h LEU 56 Ca -0.01 0.03 0.30 0.00 0.11 0.00 0.00 57.88 58.31 1a7m h LEU 56 Cb 1.08 -0.08 -0.04 0.00 -0.44 0.00 0.00 40.66 41.18 1a7m h LEU 56 CO 0.00 0.27 0.74 0.44 -4.11 0.00 0.00 178.44 175.79 1a7m h ASP 57 N 0.56 0.01 0.00 0.17 5.19 -1.84 1.24 116.42 121.76 1a7m h ASP 57 Ca 0.40 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.62 1a7m h ASP 57 Cb 0.75 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.23 1a7m h ASP 57 CO -0.16 0.00 -1.73 1.17 -3.12 0.00 0.00 179.24 175.41 1a7m n LYS 58 N -4.23 1.37 0.00 3.56 4.81 0.37 -3.97 118.16 120.06 1a7m n LYS 58 Ca 0.22 0.03 0.13 0.00 -0.87 0.00 0.00 58.31 57.82 1a7m n LYS 58 Cb 1.09 -1.26 0.45 0.00 0.02 0.00 0.00 35.03 35.33 1a7m n LYS 58 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1a7m n LEU 59 N -2.62 0.24 -0.03 3.14 4.32 0.52 -3.42 117.00 119.14 1a7m n LEU 59 Ca -0.20 0.27 0.02 0.00 -0.02 0.00 0.00 56.01 56.08 1a7m n LEU 59 Cb 0.79 -0.38 0.03 0.00 -1.62 0.00 0.00 43.42 42.24 1a7m n LEU 59 CO 0.18 0.05 0.48 0.00 -1.22 0.00 0.00 177.39 176.88 1a7m n GLY 61 N -0.62 0.00 1.41 0.00 0.00 -1.20 -3.83 105.19 100.95 1a7m n GLY 61 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.68 0.59 0.00 1.61 -0.04 -1.26 -3.39 135.00 131.82 1a7m n PRO 62 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1a7m n PRO 62 Cb 0.00 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 1a7m n PRO 62 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1a7m n ASN 63 N 1.29 0.00 0.03 3.54 2.85 -1.26 -4.36 115.26 117.35 1a7m n ASN 63 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1a7m n ASN 63 Cb 0.29 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.31 1a7m n ASN 63 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1a7m n VAL 64 N -1.65 0.19 -4.62 3.44 0.31 -1.22 -4.74 118.33 110.04 1a7m n VAL 64 Ca 0.00 0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1a7m n VAL 64 Cb 0.00 -1.00 0.00 0.00 -0.91 0.00 0.00 33.84 31.93 1a7m n VAL 64 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1a7m n THR 65 N -2.98 0.00 -1.10 2.52 -1.04 -1.25 -3.24 114.28 107.19 1a7m n THR 65 Ca 0.00 0.00 -0.16 0.00 -2.04 0.00 0.00 64.05 61.85 1a7m n THR 65 Cb 0.17 0.00 0.23 0.00 -1.82 0.00 0.00 70.33 68.90 1a7m n THR 65 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1a7m n ASP 66 N -3.08 4.17 -4.91 8.00 5.75 -1.26 -4.98 116.55 120.25 1a7m n ASP 66 Ca 0.00 -3.42 -0.28 0.00 -0.01 0.00 0.00 54.79 51.08 1a7m n ASP 66 Cb 0.00 -0.80 0.04 0.00 -1.03 0.00 0.00 41.12 39.34 1a7m n ASP 66 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1a7m s PHE 67 N -3.10 3.23 -0.32 2.11 -0.71 -1.20 -4.76 117.98 113.23 1a7m s PHE 67 Ca 0.55 0.78 -0.27 0.00 -1.04 0.00 0.00 56.93 56.94 1a7m s PHE 67 Cb 0.45 -2.95 -0.05 0.00 -1.21 0.00 0.00 43.02 39.26 1a7m s PHE 67 CO 0.12 -1.07 2.25 -1.25 -1.34 0.00 0.00 175.22 173.93 1a7m s PRO 68 N -5.18 2.79 -0.13 1.99 0.04 -1.26 -4.88 135.00 128.37 1a7m s PRO 68 Ca 0.56 1.76 -0.16 0.00 0.04 0.00 0.00 61.00 63.21 1a7m s PRO 68 Cb -0.11 -4.43 -0.19 0.00 0.04 0.00 0.00 34.50 29.81 1a7m s PRO 68 CO 0.48 -2.49 1.19 -0.35 0.04 0.00 0.00 177.00 175.87 1a7m n PRO 69 N 8.84 0.01 -1.40 0.56 -0.04 -1.26 -4.83 135.00 136.88 1a7m n PRO 69 Ca 0.31 -0.62 -0.49 0.00 -0.04 0.00 0.00 63.50 62.67 1a7m n PRO 69 Cb 0.48 -1.97 -0.13 0.00 -0.04 0.00 0.00 33.50 31.85 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 7.85 0.92 -3.45 0.54 -0.00 -1.26 -4.86 117.46 117.20 1a7m n PHE 70 Ca 0.24 0.51 -0.27 0.00 -0.00 0.00 0.00 57.45 57.93 1a7m n PHE 70 Cb 0.37 -2.37 -0.10 0.00 -0.00 0.00 0.00 39.48 37.38 1a7m n PHE 70 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.76 178.34 1a7m n HIS 71 N 9.58 0.38 -0.45 -5.13 -0.00 -1.26 -5.04 115.22 113.30 1a7m n HIS 71 Ca 0.58 -3.63 0.00 0.00 0.46 0.00 0.00 57.72 55.14 1a7m n HIS 71 Cb 0.05 -0.10 0.00 0.00 -0.12 0.00 0.00 29.99 29.81 1a7m n HIS 71 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1a7m n ALA 72 N 2.20 0.01 -1.51 1.57 0.00 -1.26 -4.60 120.51 116.92 1a7m n ALA 72 Ca 0.26 -0.23 -0.26 0.00 0.00 0.00 0.00 53.44 53.21 1a7m n ALA 72 Cb 0.46 -0.01 0.10 0.00 0.00 0.00 0.00 19.45 20.00 1a7m n ALA 72 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1a7m n ASN 73 N 1.58 5.58 0.06 0.00 4.13 -1.26 -4.50 115.26 120.85 1a7m n ASN 73 Ca 0.00 -3.76 0.00 0.00 1.68 0.00 0.00 54.58 52.50 1a7m n ASN 73 Cb 0.12 -0.75 0.00 0.00 -1.54 0.00 0.00 39.78 37.61 1a7m n ASN 73 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1a7m n GLY 74 N -0.94 -0.14 0.00 7.41 0.00 -1.26 -4.91 105.19 105.36 1a7m n GLY 74 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.55 1a7m n GLY 74 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1a7m n THR 75 N -3.03 0.00 -0.33 2.61 5.66 -1.26 -4.68 114.28 113.24 1a7m n THR 75 Ca 0.00 0.00 0.14 0.00 -3.05 0.00 0.00 64.05 61.14 1a7m n THR 75 Cb 0.00 0.00 0.28 0.00 -1.55 0.00 0.00 70.33 69.06 1a7m n THR 75 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 1a7m h GLU 76 N 0.00 0.04 -0.84 1.09 3.07 -1.97 0.83 114.58 116.80 1a7m h GLU 76 Ca 0.00 -0.00 0.20 0.00 -0.50 0.00 0.00 59.36 59.06 1a7m h GLU 76 Cb 0.00 -0.01 -0.15 0.00 -0.84 0.00 0.00 28.75 27.75 1a7m h GLU 76 CO 0.00 0.02 0.00 -0.22 -1.40 0.00 0.00 179.01 177.42 1a7m h LYS 77 N 0.04 0.08 0.05 2.33 3.64 -1.96 0.41 116.57 121.15 1a7m h LYS 77 Ca 0.58 -0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.62 1a7m h LYS 77 Cb 1.20 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.96 1a7m h LYS 77 CO -0.87 0.05 -2.00 0.00 -2.27 0.00 0.00 179.45 174.36 1a7m n ALA 78 N -3.03 1.26 -0.30 5.00 0.00 0.25 -2.16 120.51 121.52 1a7m n ALA 78 Ca 0.16 -0.81 0.07 0.00 0.00 0.00 0.00 53.44 52.86 1a7m n ALA 78 Cb 0.55 -0.61 0.22 0.00 0.00 0.00 0.00 19.45 19.61 1a7m n ALA 78 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1a7m h LYS 79 N 0.03 0.66 0.00 0.00 1.57 0.33 0.38 116.57 119.54 1a7m h LYS 79 Ca -0.41 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.17 1a7m h LYS 79 Cb 2.04 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 34.18 1a7m h LYS 79 CO 0.06 0.44 -0.90 -0.07 -0.57 0.00 0.00 179.45 178.40 1a7m h LEU 80 N 0.68 0.00 -0.92 2.94 4.07 -0.36 -2.31 115.31 119.41 1a7m h LEU 80 Ca 0.46 -0.65 0.13 0.00 0.08 0.00 0.00 57.88 57.90 1a7m h LEU 80 Cb 0.61 -0.00 -0.09 0.00 1.08 0.00 0.00 40.66 42.26 1a7m h LEU 80 CO -0.34 1.35 0.53 0.58 -1.08 0.00 0.00 178.44 179.48 1a7m h VAL 81 N -0.99 0.82 -0.28 1.22 2.07 -1.22 0.30 116.25 118.16 1a7m h VAL 81 Ca -0.25 -0.27 -0.08 0.00 0.82 0.00 0.00 66.70 66.92 1a7m h VAL 81 Cb 1.22 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1a7m h VAL 81 CO -0.15 0.15 -0.13 -0.08 0.02 0.00 0.00 177.57 177.38 1a7m h GLU 82 N 0.80 0.59 0.16 1.57 4.57 -0.37 0.17 114.58 122.06 1a7m h GLU 82 Ca 0.48 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 58.41 1a7m h GLU 82 Cb 0.58 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.13 1a7m h GLU 82 CO -0.31 0.82 -0.28 1.25 -1.18 0.00 0.00 179.01 179.31 1a7m h LEU 83 N 0.34 -0.81 0.00 1.64 5.85 -0.48 0.21 115.31 122.06 1a7m h LEU 83 Ca 0.06 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1a7m h LEU 83 Cb 0.64 0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.95 1a7m h LEU 83 CO 0.04 -0.33 0.00 0.00 -0.34 0.00 0.00 178.44 177.81 1a7m n TYR 84 N -4.04 0.00 -0.37 1.25 4.19 0.88 0.52 117.16 119.60 1a7m n TYR 84 Ca -0.05 0.00 -0.07 0.00 3.31 0.00 0.00 57.90 61.08 1a7m n TYR 84 Cb 0.23 -0.23 -0.05 0.00 0.49 0.00 0.00 39.34 39.78 1a7m n TYR 84 CO 0.00 0.00 0.00 -2.13 0.91 0.00 0.00 176.86 175.64 1a7m n ARG 85 N -1.97 -0.34 -0.26 2.98 0.63 0.04 0.15 116.66 117.89 1a7m n ARG 85 Ca 0.00 1.36 0.17 0.00 -0.92 0.00 0.00 57.85 58.45 1a7m n ARG 85 Cb 0.00 -2.00 0.46 0.00 0.45 0.00 0.00 32.46 31.37 1a7m n ARG 85 CO 0.00 0.00 0.00 1.98 -2.51 0.00 0.00 177.63 177.10 1a7m h MET 86 N 0.00 0.50 0.00 -0.14 4.05 0.15 0.26 114.93 119.75 1a7m h MET 86 Ca 0.19 -0.03 -0.11 0.00 -0.28 0.00 0.00 59.70 59.47 1a7m h MET 86 Cb 0.41 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.08 1a7m h MET 86 CO -0.85 0.33 -1.08 0.28 0.23 0.00 0.00 176.91 175.82 1a7m h VAL 87 N 0.52 0.44 0.00 -5.77 2.07 0.49 -2.55 116.25 111.45 1a7m h VAL 87 Ca 0.48 -1.78 -0.00 0.00 0.82 0.00 0.00 66.70 66.21 1a7m h VAL 87 Cb 1.02 1.99 -0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1a7m h VAL 87 CO -0.21 0.25 -0.02 0.00 0.02 0.00 0.00 177.57 177.61 1a7m h ALA 88 N 1.59 0.00 -0.55 1.67 0.00 0.34 0.84 119.26 123.15 1a7m h ALA 88 Ca -0.09 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.78 1a7m h ALA 88 Cb 1.40 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 19.14 1a7m h ALA 88 CO 0.04 0.02 0.18 0.10 0.00 0.00 0.00 179.25 179.58 1a7m h TYR 89 N -1.00 0.30 -0.09 0.00 -0.00 -0.76 -1.75 116.97 113.68 1a7m h TYR 89 Ca -0.00 0.03 -0.01 0.00 0.00 0.00 0.00 58.73 58.75 1a7m h TYR 89 Cb 0.23 -0.05 -0.00 0.00 0.00 0.00 0.00 36.73 36.90 1a7m h TYR 89 CO 0.05 0.07 0.02 1.25 -0.00 0.00 0.00 178.16 179.54 1a7m h LEU 90 N 0.34 0.14 -0.94 0.10 6.46 -1.53 -2.05 115.31 117.83 1a7m h LEU 90 Ca 0.28 -0.25 0.27 0.00 -0.12 0.00 0.00 57.88 58.05 1a7m h LEU 90 Cb 0.34 -0.04 -0.18 0.00 -0.73 0.00 0.00 40.66 40.06 1a7m h LEU 90 CO -0.30 0.35 0.05 -0.24 -0.62 0.00 0.00 178.44 177.68 1a7m n SER 91 N -4.88 -0.09 0.25 1.25 2.88 0.29 0.70 113.62 114.02 1a7m n SER 91 Ca -0.06 1.60 -0.15 0.00 -1.33 0.00 0.00 58.87 58.93 1a7m n SER 91 Cb 0.16 -0.59 -0.08 0.00 -0.75 0.00 0.00 64.21 62.95 1a7m n SER 91 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1a7m h ALA 92 N 1.88 -0.63 -0.92 -1.46 0.00 -1.19 0.44 119.26 117.38 1a7m h ALA 92 Ca 0.58 -0.19 0.26 0.00 0.00 0.00 0.00 54.91 55.57 1a7m h ALA 92 Cb 1.23 0.24 -0.16 0.00 0.00 0.00 0.00 17.79 19.10 1a7m h ALA 92 CO -0.88 -0.73 0.19 0.77 0.00 0.00 0.00 179.25 178.60 1a7m h SER 93 N -0.87 -0.12 0.44 0.00 0.02 1.00 0.19 113.55 114.20 1a7m h SER 93 Ca -0.06 0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 1a7m h SER 93 Cb 0.58 0.33 0.00 0.00 0.14 0.00 0.00 62.40 63.46 1a7m h SER 93 CO 0.11 -0.24 -0.21 -0.07 -1.14 0.00 0.00 176.83 175.27 1a7m h LEU 94 N 0.13 -0.50 -0.56 5.07 4.07 -0.70 -3.02 115.31 119.79 1a7m h LEU 94 Ca 0.59 -0.10 0.11 0.00 0.08 0.00 0.00 57.88 58.56 1a7m h LEU 94 Cb 1.24 0.13 -0.11 0.00 1.08 0.00 0.00 40.66 43.00 1a7m h LEU 94 CO -0.74 -0.11 -0.16 0.74 -1.08 0.00 0.00 178.44 177.09 1a7m h THR 95 N -0.99 0.41 -0.03 0.22 2.02 0.76 0.77 112.91 116.08 1a7m h THR 95 Ca -0.06 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.15 1a7m h THR 95 Cb 0.57 0.41 -0.06 0.00 -1.74 0.00 0.00 68.15 67.33 1a7m h THR 95 CO 0.10 0.00 -0.42 0.78 0.37 0.00 0.00 175.52 176.35 1a7m h ASN 96 N -0.02 -1.28 -0.19 4.18 2.35 -1.11 0.66 115.58 120.16 1a7m h ASN 96 Ca 0.27 0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 56.17 1a7m h ASN 96 Cb 0.43 0.51 -0.01 0.00 0.05 0.00 0.00 38.32 39.29 1a7m h ASN 96 CO -0.58 -0.45 0.10 0.40 -1.65 0.00 0.00 177.43 175.25 1a7m h ILE 97 N -0.56 1.08 -0.03 2.81 1.08 -1.22 0.15 117.51 120.83 1a7m h ILE 97 Ca 0.05 -0.23 0.03 0.00 -0.39 0.00 0.00 64.86 64.32 1a7m h ILE 97 Cb 0.65 0.81 -0.04 0.00 -3.07 0.00 0.00 36.82 35.16 1a7m h ILE 97 CO -0.33 0.09 -0.22 0.74 -0.69 0.00 0.00 178.15 177.74 1a7m h THR 98 N 0.30 0.49 0.13 -0.27 2.02 0.29 0.13 112.91 115.99 1a7m h THR 98 Ca 0.08 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 1a7m h THR 98 Cb 0.04 0.49 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1a7m h THR 98 CO -0.01 0.00 -0.06 0.08 0.37 0.00 0.00 175.52 175.90 1a7m h ARG 99 N -0.33 -0.17 -0.80 6.66 0.11 -0.85 0.24 114.38 119.24 1a7m h ARG 99 Ca 0.07 0.01 0.15 0.00 0.10 0.00 0.00 59.98 60.31 1a7m h ARG 99 Cb 0.42 0.04 -0.15 0.00 1.11 0.00 0.00 29.97 31.39 1a7m h ARG 99 CO -0.22 0.29 -0.25 -0.44 0.10 0.00 0.00 179.97 179.46 1a7m h ASP 100 N -0.86 -0.90 -0.25 0.08 3.32 -0.63 0.16 116.42 117.34 1a7m h ASP 100 Ca -0.02 0.25 -0.20 0.00 0.02 0.00 0.00 57.03 57.08 1a7m h ASP 100 Cb 0.54 0.55 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1a7m h ASP 100 CO 0.03 -0.28 -0.62 1.56 -1.72 0.00 0.00 179.24 178.21 1a7m h GLN 101 N -0.03 0.86 -0.66 3.56 1.08 -0.83 0.68 115.11 119.77 1a7m h GLN 101 Ca 0.36 -0.59 0.19 0.00 -1.45 0.00 0.00 58.65 57.16 1a7m h GLN 101 Cb 0.59 0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 28.08 1a7m h GLN 101 CO -0.84 1.22 0.48 -0.22 -0.95 0.00 0.00 178.83 178.52 1a7m h LYS 102 N 0.64 0.00 0.02 1.46 3.64 0.14 0.47 116.57 122.94 1a7m h LYS 102 Ca -0.01 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.03 1a7m h LYS 102 Cb 1.24 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 33.00 1a7m h LYS 102 CO 0.13 0.00 -2.12 0.28 -2.27 0.00 0.00 179.45 175.47 1a7m n VAL 103 N -4.32 1.53 0.05 2.00 0.31 0.09 -4.47 118.33 113.52 1a7m n VAL 103 Ca 0.13 -0.77 -0.14 0.00 -0.01 0.00 0.00 64.34 63.55 1a7m n VAL 103 Cb 0.74 -0.98 -0.04 0.00 -0.91 0.00 0.00 33.84 32.65 1a7m n VAL 103 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1a7m h LEU 104 N 0.01 0.62 -7.79 7.52 3.38 0.19 -3.46 115.31 115.78 1a7m h LEU 104 Ca -0.45 -0.46 -0.37 0.00 0.09 0.00 0.00 57.88 56.69 1a7m h LEU 104 Cb 2.09 -0.19 -0.32 0.00 0.09 0.00 0.00 40.66 42.33 1a7m h LEU 104 CO 0.04 1.25 -0.76 0.21 0.09 0.00 0.00 178.44 179.26 1a7m s ASN 105 N -7.08 0.77 0.01 -0.43 3.84 0.00 -4.99 114.94 107.06 1a7m s ASN 105 Ca -0.07 -0.11 0.01 0.00 0.21 0.00 0.00 52.86 52.90 1a7m s ASN 105 Cb 0.09 -0.28 0.03 0.00 -0.55 0.00 0.00 41.25 40.54 1a7m s ASN 105 CO 0.87 -0.01 0.89 -0.81 -2.79 0.00 0.00 177.10 175.25 1a7m n PRO 106 N 3.65 0.00 -0.10 0.43 -0.04 -1.26 -0.57 135.00 137.11 1a7m n PRO 106 Ca -0.21 0.38 -0.21 0.00 -0.04 0.00 0.00 63.50 63.42 1a7m n PRO 106 Cb 0.53 -1.64 -0.07 0.00 -0.04 0.00 0.00 33.50 32.28 1a7m n PRO 106 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1a7m n SER 107 N -1.39 1.43 -0.34 3.54 3.41 -1.26 -4.45 113.62 114.56 1a7m n SER 107 Ca -0.00 0.22 0.19 0.00 -0.26 0.00 0.00 58.87 59.02 1a7m n SER 107 Cb 0.13 -0.56 0.41 0.00 -0.26 0.00 0.00 64.21 63.93 1a7m n SER 107 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a7m h ALA 108 N -0.66 1.82 -1.00 7.33 0.00 -1.21 0.61 119.26 126.14 1a7m h ALA 108 Ca -0.49 0.15 0.36 0.00 0.00 0.00 0.00 54.91 54.92 1a7m h ALA 108 Cb 1.44 0.06 -0.18 0.00 0.00 0.00 0.00 17.79 19.11 1a7m h ALA 108 CO -0.29 -0.36 0.33 -0.39 0.00 0.00 0.00 179.25 178.54 1a7m h VAL 109 N 0.50 0.01 -0.08 0.00 -1.51 -0.99 1.38 116.25 115.56 1a7m h VAL 109 Ca 0.67 -0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 66.11 1a7m h VAL 109 Cb 1.34 0.00 -0.00 0.00 -2.13 0.00 0.00 31.29 30.50 1a7m h VAL 109 CO -0.52 0.00 -0.05 0.28 -1.23 0.00 0.00 177.57 176.06 1a7m h SER 110 N 0.01 0.18 -0.78 4.19 0.02 -0.05 -2.66 113.55 114.45 1a7m h SER 110 Ca 0.74 -0.43 0.18 0.00 -0.84 0.00 0.00 61.79 61.44 1a7m h SER 110 Cb 1.82 -0.05 -0.13 0.00 0.14 0.00 0.00 62.40 64.18 1a7m h SER 110 CO -0.83 0.58 0.12 0.25 -1.14 0.00 0.00 176.83 175.81 1a7m h LEU 111 N -0.21 -0.14 -0.43 5.07 6.46 0.20 0.82 115.31 127.08 1a7m h LEU 111 Ca 0.02 0.18 -0.09 0.00 -0.12 0.00 0.00 57.88 57.87 1a7m h LEU 111 Cb 0.51 0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.71 1a7m h LEU 111 CO 0.01 -0.13 -0.09 1.12 -0.62 0.00 0.00 178.44 178.74 1a7m h HIS 112 N 0.19 0.92 -0.98 1.25 2.07 -0.86 -2.40 115.15 115.33 1a7m h HIS 112 Ca 0.45 -0.19 0.22 0.00 -2.85 0.00 0.00 60.37 58.00 1a7m h HIS 112 Cb 0.82 -0.23 -0.18 0.00 2.57 0.00 0.00 27.41 30.39 1a7m h HIS 112 CO -0.33 0.92 -0.14 1.03 -3.07 0.00 0.00 177.93 176.35 1a7m h SER 113 N 0.65 -0.74 0.42 3.10 0.87 -0.48 0.58 113.55 117.95 1a7m h SER 113 Ca 0.11 0.29 -0.02 0.00 -1.23 0.00 0.00 61.79 60.94 1a7m h SER 113 Cb 0.62 0.56 -0.01 0.00 -0.44 0.00 0.00 62.40 63.13 1a7m h SER 113 CO 0.04 -0.33 -0.32 0.50 -0.53 0.00 0.00 176.83 176.19 1a7m h LYS 114 N 0.00 -0.68 -0.88 2.24 1.63 -1.13 -2.70 116.57 115.06 1a7m h LYS 114 Ca 0.52 0.05 0.21 0.00 -0.85 0.00 0.00 60.65 60.58 1a7m h LYS 114 Cb 0.91 0.15 -0.16 0.00 -0.60 0.00 0.00 32.23 32.54 1a7m h LYS 114 CO -0.97 -0.45 -0.02 -0.07 -3.45 0.00 0.00 179.45 174.49 1a7m h LEU 115 N -0.70 -0.48 -0.73 5.20 3.38 0.38 0.24 115.31 122.59 1a7m h LEU 115 Ca -0.05 0.24 0.12 0.00 0.09 0.00 0.00 57.88 58.28 1a7m h LEU 115 Cb 0.58 0.44 -0.13 0.00 0.09 0.00 0.00 40.66 41.64 1a7m h LEU 115 CO 0.02 -0.27 -0.37 0.78 0.09 0.00 0.00 178.44 178.69 1a7m h ASN 116 N 0.05 -1.31 0.48 -0.43 4.21 0.12 0.47 115.58 119.18 1a7m h ASN 116 Ca 0.49 0.26 -0.02 0.00 1.21 0.00 0.00 56.30 58.24 1a7m h ASN 116 Cb 0.92 0.66 -0.01 0.00 -1.12 0.00 0.00 38.32 38.77 1a7m h ASN 116 CO -0.81 -0.30 -0.34 0.00 -1.29 0.00 0.00 177.43 174.68 1a7m h ALA 117 N 1.07 -1.12 -1.23 -0.83 0.00 -0.34 -1.50 119.26 115.32 1a7m h ALA 117 Ca 0.26 -0.16 0.35 0.00 0.00 0.00 0.00 54.91 55.36 1a7m h ALA 117 Cb 0.56 0.49 -0.07 0.00 0.00 0.00 0.00 17.79 18.78 1a7m h ALA 117 CO -0.79 -1.10 0.85 1.79 0.00 0.00 0.00 179.25 180.00 1a7m h THR 118 N -0.79 0.38 0.14 0.00 1.35 -0.75 0.20 112.91 113.44 1a7m h THR 118 Ca -0.06 -0.04 -0.01 0.00 -0.55 0.00 0.00 66.41 65.75 1a7m h THR 118 Cb 0.65 0.26 0.00 0.00 -1.73 0.00 0.00 68.15 67.33 1a7m h THR 118 CO 0.04 0.02 -0.07 0.40 -0.25 0.00 0.00 175.52 175.66 1a7m h ILE 119 N 0.11 0.93 -0.11 6.82 2.04 0.30 -2.00 117.51 125.59 1a7m h ILE 119 Ca 0.63 -1.17 -0.22 0.00 1.00 0.00 0.00 64.86 65.10 1a7m h ILE 119 Cb 2.23 1.56 0.01 0.00 -0.74 0.00 0.00 36.82 39.87 1a7m h ILE 119 CO -0.12 0.24 -0.80 0.44 0.00 0.00 0.00 178.15 177.91 1a7m h ASP 120 N -0.83 0.78 -0.48 1.72 3.32 -0.21 0.54 116.42 121.27 1a7m h ASP 120 Ca -0.02 -0.53 0.02 0.00 0.02 0.00 0.00 57.03 56.52 1a7m h ASP 120 Cb 0.54 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1a7m h ASP 120 CO 0.03 1.31 0.32 -0.37 -1.72 0.00 0.00 179.24 178.81 1a7m h VAL 121 N 0.43 1.08 0.04 -1.35 -1.51 -0.77 0.39 116.25 114.56 1a7m h VAL 121 Ca -0.06 -0.20 -0.18 0.00 -1.23 0.00 0.00 66.70 65.03 1a7m h VAL 121 Cb 1.42 0.44 0.02 0.00 -2.13 0.00 0.00 31.29 31.03 1a7m h VAL 121 CO 0.15 0.11 -0.72 0.24 -1.23 0.00 0.00 177.57 176.12 1a7m h MET 122 N 0.59 0.42 -0.93 5.19 2.86 -0.95 0.70 114.93 122.81 1a7m h MET 122 Ca 0.19 -0.51 0.09 0.00 -2.06 0.00 0.00 59.70 57.41 1a7m h MET 122 Cb 0.03 0.16 -0.07 0.00 0.06 0.00 0.00 31.60 31.78 1a7m h MET 122 CO -0.04 1.17 0.60 -0.09 1.06 0.00 0.00 176.91 179.60 1a7m h ARG 123 N -0.10 0.94 0.05 1.72 2.43 0.11 0.41 114.38 119.95 1a7m h ARG 123 Ca -0.10 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.01 1a7m h ARG 123 Cb 1.45 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1a7m h ARG 123 CO 0.14 0.62 -0.03 0.78 -1.51 0.00 0.00 179.97 179.97 1a7m h GLY 124 N 0.96 -0.08 -0.43 2.80 0.00 -0.22 -1.58 103.07 104.52 1a7m h GLY 124 Ca 0.43 0.03 0.06 0.00 0.00 0.00 0.00 47.33 47.85 1a7m h GLY 124 CO -0.19 -0.03 -0.53 -2.00 0.00 0.00 0.00 176.54 173.79 1a7m h LEU 125 N -0.42 -1.79 -0.41 3.11 5.85 0.17 0.43 115.31 122.25 1a7m h LEU 125 Ca -0.01 0.25 0.08 0.00 0.84 0.00 0.00 57.88 59.04 1a7m h LEU 125 Cb 0.37 0.75 -0.09 0.00 0.37 0.00 0.00 40.66 42.06 1a7m h LEU 125 CO 0.01 -0.39 -0.28 -0.07 -0.34 0.00 0.00 178.44 177.37 1a7m h LEU 126 N -0.36 -0.94 -0.68 2.25 4.07 -0.25 0.78 115.31 120.18 1a7m h LEU 126 Ca 0.10 0.18 0.14 0.00 0.08 0.00 0.00 57.88 58.38 1a7m h LEU 126 Cb 0.59 0.46 -0.10 0.00 1.08 0.00 0.00 40.66 42.68 1a7m h LEU 126 CO -0.62 -0.29 0.13 0.28 -1.08 0.00 0.00 178.44 176.86 1a7m h SER 127 N -0.21 -0.04 0.05 -0.43 0.02 0.13 0.35 113.55 113.43 1a7m h SER 127 Ca 0.19 0.14 -0.05 0.00 -0.84 0.00 0.00 61.79 61.23 1a7m h SER 127 Cb 0.51 0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 1a7m h SER 127 CO -0.53 -0.04 -0.14 0.78 -1.14 0.00 0.00 176.83 175.77 1a7m h ASN 128 N 0.24 0.19 0.22 3.07 2.35 0.32 -2.73 115.58 119.24 1a7m h ASN 128 Ca 0.37 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 56.08 1a7m h ASN 128 Cb 0.61 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.94 1a7m h ASN 128 CO -0.49 0.35 -0.10 0.58 -1.65 0.00 0.00 177.43 176.12 1a7m h VAL 129 N 0.19 0.00 -0.84 2.81 2.07 0.44 0.22 116.25 121.14 1a7m h VAL 129 Ca 0.04 -0.57 0.21 0.00 0.82 0.00 0.00 66.70 67.20 1a7m h VAL 129 Cb 0.37 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.99 1a7m h VAL 129 CO 0.02 0.00 0.09 -0.07 0.02 0.00 0.00 177.57 177.63 1a7m h LEU 130 N -0.86 -0.25 0.16 2.57 -0.00 -1.25 0.88 115.31 116.55 1a7m h LEU 130 Ca -0.03 0.21 -0.00 0.00 -0.00 0.00 0.00 57.88 58.06 1a7m h LEU 130 Cb 0.22 0.34 -0.01 0.00 -0.00 0.00 0.00 40.66 41.21 1a7m h LEU 130 CO 0.05 -0.20 -0.22 0.00 -0.00 0.00 0.00 178.44 178.06 1a7m h ARG 132 N -0.40 0.00 0.03 0.00 9.65 0.21 -0.12 114.38 123.75 1a7m h ARG 132 Ca -0.02 0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 58.74 1a7m h ARG 132 Cb 0.36 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 28.95 1a7m h ARG 132 CO -0.06 0.00 -0.48 -0.07 2.80 0.00 0.00 179.97 182.16 1a7m h LEU 133 N 0.00 0.37 -0.47 3.80 3.38 0.15 -3.32 115.31 119.21 1a7m h LEU 133 Ca 0.22 -0.83 0.08 0.00 0.09 0.00 0.00 57.88 57.45 1a7m h LEU 133 Cb 1.23 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.79 1a7m h LEU 133 CO -0.00 1.16 -0.16 0.00 0.09 0.00 0.00 178.44 179.53 1a7m n ASN 135 N -4.73 0.00 -0.07 0.00 4.13 -1.25 -1.24 115.26 112.10 1a7m n ASN 135 Ca 0.06 0.00 0.01 0.00 1.68 0.00 0.00 54.58 56.32 1a7m n ASN 135 Cb 0.21 0.00 0.01 0.00 -1.54 0.00 0.00 39.78 38.46 1a7m n ASN 135 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1a7m n LYS 136 N -3.43 0.76 -2.44 3.52 4.76 -0.98 -4.78 118.16 115.57 1a7m n LYS 136 Ca 0.00 -0.91 -0.21 0.00 -2.87 0.00 0.00 58.31 54.32 1a7m n LYS 136 Cb 0.00 -0.67 0.01 0.00 -1.84 0.00 0.00 35.03 32.53 1a7m n LYS 136 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1a7m n TYR 137 N -0.19 2.71 -2.39 2.13 4.01 -0.38 -4.86 117.16 118.19 1a7m n TYR 137 Ca 0.01 -2.81 -0.40 0.00 -0.16 0.00 0.00 57.90 54.54 1a7m n TYR 137 Cb 0.48 -0.20 0.02 0.00 -0.31 0.00 0.00 39.34 39.33 1a7m n TYR 137 CO 0.00 0.00 0.00 2.89 -0.46 0.00 0.00 176.86 179.29 1a7m n ARG 138 N -0.46 4.68 -0.08 -0.72 1.85 -0.92 -4.36 116.66 116.65 1a7m n ARG 138 Ca 0.32 -4.25 -0.08 0.00 -1.00 0.00 0.00 57.85 52.84 1a7m n ARG 138 Cb 0.76 -2.43 -0.03 0.00 -1.05 0.00 0.00 32.46 29.72 1a7m n ARG 138 CO 0.00 0.00 0.00 1.55 -0.01 0.00 0.00 177.63 179.17 1a7m n VAL 139 N -0.02 1.34 0.00 8.89 3.14 -1.26 -4.96 118.33 125.46 1a7m n VAL 139 Ca 0.50 0.18 0.00 0.00 -2.96 0.00 0.00 64.34 62.06 1a7m n VAL 139 Cb 0.26 -2.27 0.00 0.00 -1.06 0.00 0.00 33.84 30.77 1a7m n VAL 139 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1a7m n GLY 140 N 1.48 0.80 2.72 7.55 0.00 -1.26 -4.99 105.19 111.50 1a7m n GLY 140 Ca -0.12 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.61 1a7m n GLY 140 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1a7m n HIS 141 N 0.00 -2.48 -0.07 1.61 -0.00 -1.26 -4.94 115.22 108.08 1a7m n HIS 141 Ca 0.00 -1.84 -0.06 0.00 -0.00 0.00 0.00 57.72 55.82 1a7m n HIS 141 Cb 0.00 1.55 -0.02 0.00 -0.00 0.00 0.00 29.99 31.52 1a7m n HIS 141 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.34 177.89 1a7m n VAL 142 N 0.52 1.43 -0.86 3.57 3.14 -1.26 -5.10 118.33 119.76 1a7m n VAL 142 Ca 0.04 0.20 0.02 0.00 -2.96 0.00 0.00 64.34 61.64 1a7m n VAL 142 Cb 0.70 -2.38 -0.01 0.00 -1.06 0.00 0.00 33.84 31.10 1a7m n VAL 142 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1a7m n ASP 143 N -4.59 -4.66 -2.61 6.55 9.92 -1.26 -4.96 116.55 114.94 1a7m n ASP 143 Ca -0.09 1.01 -0.18 0.00 -0.53 0.00 0.00 54.79 55.00 1a7m n ASP 143 Cb 0.31 -2.46 0.01 0.00 -0.64 0.00 0.00 41.12 38.34 1a7m n ASP 143 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 1a7m n VAL 144 N -2.34 1.60 -1.49 2.53 0.24 -1.26 -4.88 118.33 112.73 1a7m n VAL 144 Ca -0.01 -4.00 -0.46 0.00 -2.04 0.00 0.00 64.34 57.83 1a7m n VAL 144 Cb 0.29 -0.26 -0.06 0.00 -1.47 0.00 0.00 33.84 32.33 1a7m n VAL 144 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1a7m n PRO 145 N -0.23 1.10 -0.08 7.34 -0.04 -1.26 -4.87 135.00 136.97 1a7m n PRO 145 Ca 0.23 0.24 -0.13 0.00 -0.04 0.00 0.00 63.50 63.80 1a7m n PRO 145 Cb 0.73 -2.68 -0.14 0.00 -0.04 0.00 0.00 33.50 31.37 1a7m n PRO 145 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1a7m n PRO 146 N 8.48 0.68 -0.06 0.54 -0.04 -1.26 -4.94 135.00 138.39 1a7m n PRO 146 Ca 0.41 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 64.01 1a7m n PRO 146 Cb 0.30 -1.60 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 1a7m n PRO 146 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1a7m n VAL 147 N -3.05 0.00 -2.86 0.52 0.31 -1.26 -4.82 118.33 107.17 1a7m n VAL 147 Ca -0.33 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.57 1a7m n VAL 147 Cb 1.08 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.97 1a7m n VAL 147 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1a7m s PRO 148 N 0.00 3.25 -0.80 5.55 0.04 -1.26 -4.98 135.00 136.79 1a7m s PRO 148 Ca 0.00 -0.48 0.02 0.00 0.04 0.00 0.00 61.00 60.58 1a7m s PRO 148 Cb 0.00 -4.11 0.22 0.00 0.04 0.00 0.00 34.50 30.65 1a7m s PRO 148 CO 0.00 -1.59 0.75 -0.25 0.04 0.00 0.00 177.00 175.95 1a7m n ASP 149 N 7.51 3.94 -2.23 6.66 8.00 -1.26 -4.88 116.55 134.29 1a7m n ASP 149 Ca -0.00 -3.25 -0.29 0.00 0.71 0.00 0.00 54.79 51.96 1a7m n ASP 149 Cb 0.47 -0.90 0.10 0.00 -0.02 0.00 0.00 41.12 40.77 1a7m n ASP 149 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1a7m n HIS 150 N 1.80 2.95 -1.30 1.24 8.25 -1.26 -4.61 115.22 122.30 1a7m n HIS 150 Ca 0.23 -2.51 -0.24 0.00 -0.26 0.00 0.00 57.72 54.94 1a7m n HIS 150 Cb 0.37 -1.23 -0.02 0.00 1.12 0.00 0.00 29.99 30.23 1a7m n HIS 150 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1a7m n SER 151 N -0.84 6.52 0.10 0.41 3.41 -1.26 -4.23 113.62 117.73 1a7m n SER 151 Ca 0.57 -3.18 -0.06 0.00 -0.26 0.00 0.00 58.87 55.94 1a7m n SER 151 Cb 0.96 -1.17 0.04 0.00 -0.26 0.00 0.00 64.21 63.78 1a7m n SER 151 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1a7m h ASP 152 N 2.48 0.12 -4.37 4.04 5.19 -2.01 -3.44 116.42 118.42 1a7m h ASP 152 Ca 0.37 -0.09 -0.38 0.00 -0.62 0.00 0.00 57.03 56.31 1a7m h ASP 152 Cb 0.78 -0.04 -0.24 0.00 0.18 0.00 0.00 39.33 40.01 1a7m h ASP 152 CO 0.87 0.86 -0.77 -0.54 -3.12 0.00 0.00 179.24 176.54 1a7m s LYS 153 N -3.29 0.74 0.00 3.56 1.02 -1.26 -5.08 119.74 115.44 1a7m s LYS 153 Ca -0.02 -0.67 0.00 0.00 0.02 0.00 0.00 55.97 55.30 1a7m s LYS 153 Cb 0.11 -0.68 0.00 0.00 -0.52 0.00 0.00 37.83 36.74 1a7m s LYS 153 CO 0.80 0.16 0.00 0.39 -0.92 0.00 0.00 175.35 175.79 1a7m n GLU 154 N 1.94 0.00 -0.27 1.68 -0.58 -1.26 -2.45 120.64 119.70 1a7m n GLU 154 Ca -0.18 0.00 0.18 0.00 -0.42 0.00 0.00 57.16 56.74 1a7m n GLU 154 Cb 0.55 0.00 0.34 0.00 -0.57 0.00 0.00 31.44 31.76 1a7m n GLU 154 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1a7m n VAL 155 N 0.00 -0.34 -0.32 2.62 0.31 -1.26 0.68 118.33 120.02 1a7m n VAL 155 Ca 0.00 1.74 -0.06 0.00 -0.01 0.00 0.00 64.34 66.01 1a7m n VAL 155 Cb 0.00 -2.65 -0.01 0.00 -0.91 0.00 0.00 33.84 30.26 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 -1.29 -0.20 3.52 -1.00 -1.99 0.14 116.94 116.12 1a7m h PHE 156 Ca 0.58 0.10 -0.18 0.00 2.81 0.00 0.00 57.97 61.28 1a7m h PHE 156 Cb 1.37 0.68 -0.00 0.00 3.61 0.00 0.00 35.95 41.60 1a7m h PHE 156 CO -0.24 -0.40 -0.60 0.37 -1.61 0.00 0.00 178.31 175.82 1a7m h GLN 157 N -0.09 0.67 -0.92 1.51 -0.00 0.59 0.58 115.11 117.45 1a7m h GLN 157 Ca 0.25 -0.45 0.08 0.00 -0.00 0.00 0.00 58.65 58.53 1a7m h GLN 157 Cb 0.55 0.06 -0.06 0.00 0.00 0.00 0.00 27.48 28.03 1a7m h GLN 157 CO -0.86 1.07 0.59 -0.22 0.00 0.00 0.00 178.83 179.42 1a7m h LYS 158 N 0.50 0.96 0.00 1.69 1.63 -0.78 1.44 116.57 122.02 1a7m h LYS 158 Ca -0.00 -0.06 -0.14 0.00 -0.85 0.00 0.00 60.65 59.60 1a7m h LYS 158 Cb 1.18 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 32.57 1a7m h LYS 158 CO 0.12 0.64 -0.83 0.87 -3.45 0.00 0.00 179.45 176.80 1a7m h LYS 159 N 0.99 0.00 -0.80 1.90 1.57 -0.72 -3.40 116.57 116.11 1a7m h LYS 159 Ca 0.41 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.10 1a7m h LYS 159 Cb 0.29 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.54 1a7m h LYS 159 CO -0.17 0.86 0.12 1.63 -0.57 0.00 0.00 179.45 181.32 1a7m n LYS 160 N -4.51 3.10 -0.45 3.15 4.01 0.20 -4.48 118.16 119.18 1a7m n LYS 160 Ca -0.23 -2.05 0.37 0.00 -0.51 0.00 0.00 58.31 55.90 1a7m n LYS 160 Cb 0.56 -1.94 0.66 0.00 -0.51 0.00 0.00 35.03 33.80 1a7m n LYS 160 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1a7m h LEU 161 N 2.19 0.23 0.00 -0.35 7.12 0.18 1.24 115.31 125.93 1a7m h LEU 161 Ca 0.11 0.13 -0.27 0.00 0.13 0.00 0.00 57.88 57.98 1a7m h LEU 161 Cb 1.68 0.12 -0.05 0.00 -0.53 0.00 0.00 40.66 41.89 1a7m h LEU 161 CO 0.43 -0.18 -1.55 1.23 -0.13 0.00 0.00 178.44 178.25 1a7m h GLY 162 N 0.08 0.00 0.80 3.75 0.00 -1.82 -3.29 103.07 102.59 1a7m h GLY 162 Ca 0.82 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 48.11 1a7m h GLY 162 CO -0.40 0.00 -0.03 0.00 0.00 0.00 0.00 176.54 176.11 1a7m h GLN 164 N 0.09 0.00 0.00 0.00 4.20 -1.25 -1.12 115.11 117.03 1a7m h GLN 164 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1a7m h GLN 164 Cb 0.46 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1a7m h GLN 164 CO 0.02 0.00 0.00 -0.11 -0.67 0.00 0.00 178.83 178.07 1a7m n LEU 165 N -2.44 0.61 -0.22 1.46 -0.00 -0.16 -3.73 117.00 112.53 1a7m n LEU 165 Ca -0.02 0.13 0.21 0.00 -0.00 0.00 0.00 56.01 56.33 1a7m n LEU 165 Cb 0.12 -0.28 0.37 0.00 -0.00 0.00 0.00 43.42 43.63 1a7m n LEU 165 CO 0.11 -0.28 0.67 0.18 -0.00 0.00 0.00 177.39 178.08 1a7m n LEU 166 N -1.72 0.20 0.35 -1.96 7.99 0.31 0.15 117.00 122.33 1a7m n LEU 166 Ca 0.00 0.99 -0.17 0.00 -0.01 0.00 0.00 56.01 56.82 1a7m n LEU 166 Cb 0.00 -0.48 -0.09 0.00 -0.11 0.00 0.00 43.42 42.74 1a7m n LEU 166 CO 0.00 -1.11 0.64 1.23 -1.51 0.00 0.00 177.39 176.64 1a7m h GLY 167 N 0.00 -0.90 0.25 -0.72 0.00 -1.34 0.32 103.07 100.68 1a7m h GLY 167 Ca 0.53 0.33 -0.01 0.00 0.00 0.00 0.00 47.33 48.18 1a7m h GLY 167 CO -0.44 -0.33 -0.12 -0.91 0.00 0.00 0.00 176.54 174.74 1a7m h THR 168 N -0.90 0.00 -0.50 4.70 1.35 0.62 -1.69 112.91 116.49 1a7m h THR 168 Ca -0.09 -0.33 0.10 0.00 -0.55 0.00 0.00 66.41 65.54 1a7m h THR 168 Cb 0.67 0.00 -0.09 0.00 -1.73 0.00 0.00 68.15 67.00 1a7m h THR 168 CO 0.15 0.00 -0.13 0.00 -0.25 0.00 0.00 175.52 175.28 1a7m n TYR 169 N -3.82 0.17 0.41 4.73 9.36 0.41 0.25 117.16 128.66 1a7m n TYR 169 Ca -0.04 0.61 -0.18 0.00 3.32 0.00 0.00 57.90 61.61 1a7m n TYR 169 Cb 0.13 -0.78 -0.09 0.00 -0.63 0.00 0.00 39.34 37.97 1a7m n TYR 169 CO 0.00 0.00 0.00 -0.22 0.22 0.00 0.00 176.86 176.86 1a7m h LYS 170 N 0.00 -0.99 -1.03 2.98 3.64 -0.28 0.91 116.57 121.81 1a7m h LYS 170 Ca 0.24 0.07 0.27 0.00 -1.27 0.00 0.00 60.65 59.95 1a7m h LYS 170 Cb 0.36 0.22 -0.12 0.00 -0.41 0.00 0.00 32.23 32.29 1a7m h LYS 170 CO -0.52 -0.64 0.63 0.37 -2.27 0.00 0.00 179.45 177.02 1a7m h GLN 171 N -1.11 0.46 0.07 1.90 5.75 0.43 0.19 115.11 122.80 1a7m h GLN 171 Ca -0.10 -0.03 -0.34 0.00 -0.15 0.00 0.00 58.65 58.03 1a7m h GLN 171 Cb 0.80 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.21 1a7m h GLN 171 CO 0.17 0.31 -1.91 1.33 -2.65 0.00 0.00 178.83 176.07 1a7m n VAL 172 N -4.81 1.70 -0.28 2.39 0.24 0.13 -3.96 118.33 113.75 1a7m n VAL 172 Ca 0.27 -0.71 -0.06 0.00 -2.04 0.00 0.00 64.34 61.80 1a7m n VAL 172 Cb 0.84 -1.44 0.06 0.00 -1.47 0.00 0.00 33.84 31.83 1a7m n VAL 172 CO 0.00 0.00 0.00 -0.29 -2.14 0.00 0.00 176.83 174.40 1a7m h ILE 173 N 0.04 1.25 0.00 1.34 6.09 0.16 0.24 117.51 126.63 1a7m h ILE 173 Ca -0.38 -0.77 0.00 0.00 -1.37 0.00 0.00 64.86 62.34 1a7m h ILE 173 Cb 2.03 0.35 0.00 0.00 0.47 0.00 0.00 36.82 39.66 1a7m h ILE 173 CO 0.08 0.31 0.00 -1.54 -3.07 0.00 0.00 178.15 173.93 1a7m n SER 174 N -4.34 0.00 -0.07 2.19 3.41 0.59 0.41 113.62 115.82 1a7m n SER 174 Ca 0.06 0.36 -0.07 0.00 -0.26 0.00 0.00 58.87 58.96 1a7m n SER 174 Cb 0.17 -0.40 -0.09 0.00 -0.26 0.00 0.00 64.21 63.63 1a7m n SER 174 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1a7m n VAL 175 N -1.40 0.86 0.06 -3.33 0.31 0.18 -4.05 118.33 110.96 1a7m n VAL 175 Ca 0.02 -0.49 -0.02 0.00 -0.01 0.00 0.00 64.34 63.84 1a7m n VAL 175 Cb 0.06 -0.75 -0.07 0.00 -0.91 0.00 0.00 33.84 32.17 1a7m n VAL 175 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1a7m h VAL 176 N 0.00 0.89 0.00 2.52 -1.51 0.94 -2.28 116.25 116.80 1a7m h VAL 176 Ca -0.34 -2.43 -0.01 0.00 -1.23 0.00 0.00 66.70 62.68 1a7m h VAL 176 Cb 1.72 2.36 -0.00 0.00 -2.13 0.00 0.00 31.29 33.23 1a7m h VAL 176 CO 0.00 0.50 -0.07 1.62 -1.23 0.00 0.00 177.57 178.40 1a7m h VAL 177 N 0.00 0.40 -0.29 7.19 3.04 -0.26 0.48 116.25 126.81 1a7m h VAL 177 Ca -0.11 -0.36 -0.13 0.00 -1.01 0.00 0.00 66.70 65.09 1a7m h VAL 177 Cb 1.62 1.25 -0.08 0.00 -2.01 0.00 0.00 31.29 32.08 1a7m h VAL 177 CO 0.07 0.07 -0.12 0.00 -1.01 0.00 0.00 177.57 176.58 1a7m n GLN 178 N -3.51 1.90 -0.06 4.17 6.02 -1.07 -4.56 117.38 120.26 1a7m n GLN 178 Ca -0.02 -3.14 -0.09 0.00 -0.01 0.00 0.00 57.00 53.74 1a7m n GLN 178 Cb 0.19 -1.78 -0.05 0.00 1.02 0.00 0.00 30.24 29.62 1a7m n GLN 178 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1a7m n ALA 179 N -1.07 1.81 -0.35 -1.58 0.00 0.15 -4.97 120.51 114.49 1a7m n ALA 179 Ca 0.30 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1a7m n ALA 179 Cb 0.96 0.24 0.00 0.00 0.00 0.00 0.00 19.45 20.65 1a7m n ALA 179 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47