#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hi7 h LYS 29 N 0.00 0.00 -0.16 2.89 1.57 -2.00 -3.24 116.57 115.63 3hi7 h LYS 29 Ca 0.00 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.83 3hi7 h LYS 29 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3hi7 h LYS 29 CO 0.00 0.33 0.26 0.00 -0.57 0.00 0.00 179.45 179.47 3hi7 h ALA 30 N 1.67 1.64 -0.29 3.86 0.00 -1.97 -2.39 119.26 121.78 3hi7 h ALA 30 Ca -0.00 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.99 3hi7 h ALA 30 Cb 0.78 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 3hi7 h ALA 30 CO 0.04 -0.34 0.33 0.78 0.00 0.00 0.00 179.25 180.06 3hi7 h GLY 31 N 0.00 0.00 1.80 0.00 0.00 -1.93 0.22 103.07 103.16 3hi7 h GLY 31 Ca 0.07 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.43 3hi7 h GLY 31 CO -0.00 0.00 0.07 -0.24 0.00 0.00 0.00 176.54 176.37 3hi7 h VAL 32 N 0.00 0.81 -0.01 4.60 3.04 -1.71 -2.14 116.25 120.84 3hi7 h VAL 32 Ca 0.14 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.83 3hi7 h VAL 32 Cb 0.80 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 31.02 3hi7 h VAL 32 CO -0.00 0.00 -0.26 0.49 -1.01 0.00 0.00 177.57 176.78 3hi7 n PHE 33 N -4.30 0.00 -2.64 3.17 3.72 0.06 -4.81 117.46 112.67 3hi7 n PHE 33 Ca -0.01 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.03 3hi7 n PHE 33 Cb 0.19 -0.06 -0.05 0.00 -0.94 0.00 0.00 39.48 38.61 3hi7 n PHE 33 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3hi7 s SER 34 N -2.39 6.99 0.94 4.37 1.04 -0.81 -4.59 113.70 119.25 3hi7 s SER 34 Ca 0.25 1.96 -0.11 0.00 0.48 0.00 0.00 55.95 58.53 3hi7 s SER 34 Cb 0.19 -2.58 0.16 0.00 0.10 0.00 0.00 66.02 63.89 3hi7 s SER 34 CO 0.49 -0.32 1.10 -1.81 0.98 0.00 0.00 173.24 173.68 3hi7 s ASP 35 N -1.59 2.92 0.31 7.02 1.01 -1.26 -4.88 116.67 120.20 3hi7 s ASP 35 Ca 0.55 1.78 -0.29 0.00 0.71 0.00 0.00 52.55 55.30 3hi7 s ASP 35 Cb -0.20 -2.38 -0.10 0.00 1.01 0.00 0.00 42.92 41.24 3hi7 s ASP 35 CO 0.26 -3.03 1.24 -0.76 0.21 0.00 0.00 175.17 173.09 3hi7 s LEU 36 N -6.51 4.47 0.93 1.23 1.43 -1.26 -5.00 118.68 113.96 3hi7 s LEU 36 Ca 0.65 2.55 -0.12 0.00 -1.03 0.00 0.00 54.13 56.18 3hi7 s LEU 36 Cb -0.21 -3.64 0.15 0.00 0.03 0.00 0.00 46.19 42.52 3hi7 s LEU 36 CO 0.59 -0.41 1.13 -0.94 0.23 0.00 0.00 176.35 176.94 3hi7 s SER 37 N -0.57 3.32 0.18 2.29 1.04 -1.26 -4.72 113.70 113.97 3hi7 s SER 37 Ca 0.48 0.99 -0.14 0.00 0.48 0.00 0.00 55.95 57.76 3hi7 s SER 37 Cb -0.37 -1.57 0.16 0.00 0.10 0.00 0.00 66.02 64.34 3hi7 s SER 37 CO 0.49 -2.68 1.71 -1.13 0.98 0.00 0.00 173.24 172.61 3hi7 h ASN 38 N -1.58 -0.06 -0.32 7.02 -1.24 -1.95 -1.05 115.58 116.40 3hi7 h ASN 38 Ca -0.51 0.09 0.02 0.00 0.71 0.00 0.00 56.30 56.61 3hi7 h ASN 38 Cb 1.33 0.14 -0.02 0.00 0.73 0.00 0.00 38.32 40.49 3hi7 h ASN 38 CO 0.61 0.00 0.16 1.56 -1.29 0.00 0.00 177.43 178.47 3hi7 h GLN 39 N 0.19 0.33 -0.61 6.67 1.08 -1.97 -0.63 115.11 120.16 3hi7 h GLN 39 Ca 0.23 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.40 3hi7 h GLN 39 Cb 0.31 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.64 3hi7 h GLN 39 CO -0.32 0.22 0.34 0.93 -0.95 0.00 0.00 178.83 179.04 3hi7 h GLU 40 N 0.34 0.86 -0.42 1.46 5.08 -1.87 -0.43 114.58 119.60 3hi7 h GLU 40 Ca 0.13 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 3hi7 h GLU 40 Cb 0.04 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 3hi7 h GLU 40 CO -0.08 0.65 0.21 -0.07 -1.00 0.00 0.00 179.01 178.72 3hi7 h LEU 41 N 0.84 0.54 -1.06 1.33 3.38 -0.87 -1.37 115.31 118.09 3hi7 h LEU 41 Ca 0.22 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 58.11 3hi7 h LEU 41 Cb 0.04 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.60 3hi7 h LEU 41 CO -0.03 0.50 0.63 0.11 0.09 0.00 0.00 178.44 179.74 3hi7 h LYS 42 N 0.54 1.15 -0.40 1.13 1.57 -0.95 -1.19 116.57 118.41 3hi7 h LYS 42 Ca 0.14 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.74 3hi7 h LYS 42 Cb 0.10 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 3hi7 h LYS 42 CO -0.02 0.76 -0.19 0.00 -0.57 0.00 0.00 179.45 179.44 3hi7 h ALA 43 N 1.45 0.56 -0.42 3.86 0.00 -0.59 0.73 119.26 124.85 3hi7 h ALA 43 Ca 0.39 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3hi7 h ALA 43 Cb 0.06 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3hi7 h ALA 43 CO -0.13 0.51 0.09 0.28 0.00 0.00 0.00 179.25 179.99 3hi7 h VAL 44 N 0.64 1.24 -0.20 0.00 2.07 -1.10 -1.32 116.25 117.58 3hi7 h VAL 44 Ca 0.09 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 3hi7 h VAL 44 Cb 0.74 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 3hi7 h VAL 44 CO 0.06 0.29 0.11 -0.74 0.02 0.00 0.00 177.57 177.31 3hi7 h HIS 45 N 0.55 0.27 -0.60 1.57 6.17 -1.10 -1.61 115.15 120.40 3hi7 h HIS 45 Ca 0.13 -0.01 0.03 0.00 0.71 0.00 0.00 60.37 61.24 3hi7 h HIS 45 Cb 0.34 -0.09 -0.04 0.00 2.52 0.00 0.00 27.41 30.15 3hi7 h HIS 45 CO 0.02 0.24 0.36 1.03 0.71 0.00 0.00 177.93 180.29 3hi7 h SER 46 N 0.22 0.57 -0.16 3.26 0.87 -0.80 -0.13 113.55 117.38 3hi7 h SER 46 Ca 0.07 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.65 3hi7 h SER 46 Cb 0.06 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 3hi7 h SER 46 CO -0.01 0.39 0.08 0.15 -0.53 0.00 0.00 176.83 176.91 3hi7 h PHE 47 N 0.70 0.16 -0.39 2.24 3.57 -1.01 -0.94 116.94 121.26 3hi7 h PHE 47 Ca 0.25 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.72 3hi7 h PHE 47 Cb 0.06 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 3hi7 h PHE 47 CO -0.06 0.09 0.09 -0.07 -2.23 0.00 0.00 178.31 176.13 3hi7 h LEU 48 N 0.18 0.59 -2.32 0.59 3.38 -1.01 -2.58 115.31 114.14 3hi7 h LEU 48 Ca 0.06 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 3hi7 h LEU 48 Cb 0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 3hi7 h LEU 48 CO -0.04 0.67 -0.00 -0.50 0.09 0.00 0.00 178.44 178.66 3hi7 h TRP 49 N 0.48 0.00 0.00 1.13 4.06 -0.86 -1.59 115.95 119.17 3hi7 h TRP 49 Ca 0.12 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.07 3hi7 h TRP 49 Cb 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.47 3hi7 h TRP 49 CO 0.02 0.00 0.00 -1.13 -3.56 0.00 0.00 178.44 173.77 3hi7 n SER 50 N -3.09 0.72 -4.42 -3.49 3.41 -0.37 -4.55 113.62 101.82 3hi7 n SER 50 Ca -0.01 0.65 -0.44 0.00 -0.26 0.00 0.00 58.87 58.80 3hi7 n SER 50 Cb 0.17 -0.81 -0.03 0.00 -0.26 0.00 0.00 64.21 63.28 3hi7 n SER 50 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3hi7 s LYS 51 N -3.27 3.38 0.52 4.33 1.02 -0.60 -4.90 119.74 120.21 3hi7 s LYS 51 Ca 0.06 -1.53 0.17 0.00 0.02 0.00 0.00 55.97 54.69 3hi7 s LYS 51 Cb 0.10 -4.58 1.31 0.00 -0.52 0.00 0.00 37.83 34.14 3hi7 s LYS 51 CO 0.45 -1.69 2.15 1.57 -0.92 0.00 0.00 175.35 176.90 3hi7 h LYS 52 N 8.97 0.00 0.00 1.68 5.09 -1.85 -1.52 116.57 128.93 3hi7 h LYS 52 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.70 3hi7 h LYS 52 Cb 1.05 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.38 3hi7 h LYS 52 CO 1.09 0.02 0.00 1.05 -2.09 0.00 0.00 179.45 179.52 3hi7 h GLU 53 N 0.00 0.00 0.00 0.07 9.09 -1.95 -1.91 114.58 119.88 3hi7 h GLU 53 Ca -0.00 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.41 3hi7 h GLU 53 Cb 0.04 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.14 3hi7 h GLU 53 CO 0.00 0.00 -0.02 -0.07 0.05 0.00 0.00 179.01 178.98 3hi7 h LEU 54 N 0.00 0.00 -1.29 3.06 3.38 -1.62 -3.47 115.31 115.36 3hi7 h LEU 54 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 3hi7 h LEU 54 Cb 0.37 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 3hi7 h LEU 54 CO 0.00 0.02 -0.80 0.54 0.09 0.00 0.00 178.44 178.29 3hi7 n ARG 55 N -3.11 -4.98 -2.16 1.13 1.74 -0.72 -4.75 116.66 103.80 3hi7 n ARG 55 Ca 0.02 0.57 -0.39 0.00 -0.77 0.00 0.00 57.85 57.28 3hi7 n ARG 55 Cb 0.39 -5.29 -0.01 0.00 -1.02 0.00 0.00 32.46 26.53 3hi7 n ARG 55 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hi7 s LEU 56 N -7.09 4.22 0.14 0.55 1.43 -1.26 -4.24 118.68 112.43 3hi7 s LEU 56 Ca 0.43 2.52 0.04 0.00 -1.03 0.00 0.00 54.13 56.09 3hi7 s LEU 56 Cb -0.22 -3.93 -0.04 0.00 0.03 0.00 0.00 46.19 42.03 3hi7 s LEU 56 CO 0.84 -0.75 -0.08 -1.10 0.23 0.00 0.00 176.35 175.48 3hi7 s GLN 57 N -2.22 1.02 0.54 1.70 -0.21 0.55 -4.98 119.66 116.06 3hi7 s GLN 57 Ca 0.56 -1.44 -0.20 0.00 0.02 0.00 0.00 55.36 54.31 3hi7 s GLN 57 Cb -0.35 -0.50 -0.05 0.00 1.00 0.00 0.00 33.01 33.11 3hi7 s GLN 57 CO 0.45 0.03 1.17 -2.14 -2.12 0.00 0.00 175.29 172.68 3hi7 s PRO 58 N -3.78 3.31 0.41 2.91 0.02 -1.26 -4.42 135.00 132.19 3hi7 s PRO 58 Ca 0.16 1.72 0.21 0.00 0.02 0.00 0.00 61.00 63.12 3hi7 s PRO 58 Cb 0.04 -2.06 1.17 0.00 0.02 0.00 0.00 34.50 33.67 3hi7 s PRO 58 CO -0.00 -0.91 1.75 0.66 -0.33 0.00 0.00 177.00 178.17 3hi7 h SER 59 N 1.27 0.39 1.00 2.53 4.64 -1.89 -2.28 113.55 119.21 3hi7 h SER 59 Ca -0.50 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3hi7 h SER 59 Cb 1.27 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3hi7 h SER 59 CO 0.57 0.04 0.00 0.77 -0.87 0.00 0.00 176.83 177.34 3hi7 h SER 60 N 0.33 0.00 -2.80 4.97 4.64 -1.90 -3.40 113.55 115.38 3hi7 h SER 60 Ca 0.62 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 61.42 3hi7 h SER 60 Cb 1.69 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 63.82 3hi7 h SER 60 CO -0.29 0.00 0.89 -0.89 -0.87 0.00 0.00 176.83 175.67 3hi7 s THR 61 N -3.39 2.60 -1.27 2.95 2.01 -0.86 -4.85 115.64 112.84 3hi7 s THR 61 Ca 0.04 0.42 -0.06 0.00 0.31 0.00 0.00 61.69 62.40 3hi7 s THR 61 Cb 0.09 -3.27 0.16 0.00 0.01 0.00 0.00 72.50 69.50 3hi7 s THR 61 CO 0.48 0.03 2.15 0.35 -0.69 0.00 0.00 174.62 176.95 3hi7 n THR 62 N 4.01 5.14 -3.91 -0.82 -2.24 -1.26 -4.80 114.28 110.40 3hi7 n THR 62 Ca 0.14 -4.62 -0.10 0.00 -2.27 0.00 0.00 64.05 57.20 3hi7 n THR 62 Cb 0.38 -2.08 -0.10 0.00 -2.10 0.00 0.00 70.33 66.43 3hi7 n THR 62 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3hi7 s THR 63 N -1.24 0.10 -0.48 4.28 -1.32 -1.26 -5.01 115.64 110.72 3hi7 s THR 63 Ca 0.48 -0.85 0.24 0.00 -1.21 0.00 0.00 61.69 60.34 3hi7 s THR 63 Cb 0.16 -0.53 0.10 0.00 -1.51 0.00 0.00 72.50 70.72 3hi7 s THR 63 CO -0.06 -0.47 1.32 0.24 -2.21 0.00 0.00 174.62 173.44 3hi7 h MET 64 N 4.17 0.00 -2.75 7.08 0.00 -1.87 -3.39 114.93 118.17 3hi7 h MET 64 Ca -0.32 0.00 -0.69 0.00 0.00 0.00 0.00 59.70 58.69 3hi7 h MET 64 Cb 1.19 0.00 -0.06 0.00 0.00 0.00 0.00 31.60 32.74 3hi7 h MET 64 CO 0.43 0.00 2.92 0.00 0.00 0.00 0.00 176.91 180.26 3hi7 n ALA 65 N -1.99 7.13 -2.66 6.32 0.00 -1.23 -4.51 120.51 123.55 3hi7 n ALA 65 Ca 0.02 -3.77 -0.09 0.00 0.00 0.00 0.00 53.44 49.61 3hi7 n ALA 65 Cb 0.49 -3.00 -0.09 0.00 0.00 0.00 0.00 19.45 16.84 3hi7 n ALA 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 3hi7 s LYS 66 N 0.29 0.58 -0.17 0.00 -2.85 -1.25 -4.36 119.74 111.98 3hi7 s LYS 66 Ca 0.61 -0.80 -0.14 0.00 -1.00 0.00 0.00 55.97 54.64 3hi7 s LYS 66 Cb 0.19 0.22 -0.05 0.00 -2.06 0.00 0.00 37.83 36.14 3hi7 s LYS 66 CO -0.08 -0.14 0.29 -0.80 0.10 0.00 0.00 175.35 174.72 3hi7 s ASN 67 N -2.19 6.41 -0.04 0.03 0.01 -1.26 -1.30 114.94 116.59 3hi7 s ASN 67 Ca -0.04 0.47 -0.10 0.00 -0.71 0.00 0.00 52.86 52.48 3hi7 s ASN 67 Cb -0.01 -2.18 0.02 0.00 0.41 0.00 0.00 41.25 39.49 3hi7 s ASN 67 CO -0.05 0.08 0.24 0.42 -1.51 0.00 0.00 177.10 176.27 3hi7 s THR 68 N 0.60 0.04 -0.43 1.60 -4.23 -0.44 -0.33 115.64 112.45 3hi7 s THR 68 Ca 0.16 -0.33 -0.25 0.00 -1.18 0.00 0.00 61.69 60.08 3hi7 s THR 68 Cb -0.13 -0.45 0.02 0.00 1.34 0.00 0.00 72.50 73.28 3hi7 s THR 68 CO 0.04 -0.18 0.91 -0.69 -0.54 0.00 0.00 174.62 174.16 3hi7 s VAL 69 N -0.71 4.53 -0.03 2.29 1.01 -1.26 -0.79 120.40 125.44 3hi7 s VAL 69 Ca -0.08 0.84 -0.09 0.00 0.00 0.00 0.00 61.98 62.65 3hi7 s VAL 69 Cb -0.04 -4.39 -0.30 0.00 0.00 0.00 0.00 36.38 31.64 3hi7 s VAL 69 CO 0.02 -0.73 0.75 0.15 0.00 0.00 0.00 175.10 175.29 3hi7 h PHE 70 N 8.89 0.67 -3.02 5.22 3.57 -1.06 -3.45 116.94 127.77 3hi7 h PHE 70 Ca -0.24 -0.49 -0.16 0.00 3.53 0.00 0.00 57.97 60.61 3hi7 h PHE 70 Cb 1.08 -0.03 -0.26 0.00 2.79 0.00 0.00 35.95 39.53 3hi7 h PHE 70 CO 0.85 1.58 -0.40 -1.17 -2.23 0.00 0.00 178.31 176.95 3hi7 s LEU 71 N -7.23 0.75 -0.07 0.59 2.96 -1.20 -0.35 118.68 114.13 3hi7 s LEU 71 Ca -0.13 0.58 0.02 0.00 -0.22 0.00 0.00 54.13 54.38 3hi7 s LEU 71 Cb 0.06 0.95 0.02 0.00 0.50 0.00 0.00 46.19 47.71 3hi7 s LEU 71 CO 0.86 -0.12 -0.10 -0.63 -1.32 0.00 0.00 176.35 175.05 3hi7 s ILE 72 N 0.45 0.99 0.19 6.68 1.01 -0.79 -0.91 121.20 128.82 3hi7 s ILE 72 Ca -0.02 -0.38 -0.11 0.00 0.00 0.00 0.00 60.65 60.13 3hi7 s ILE 72 Cb -0.04 -0.94 -0.00 0.00 0.01 0.00 0.00 42.46 41.49 3hi7 s ILE 72 CO -0.02 0.33 0.38 -1.83 0.00 0.00 0.00 174.94 173.79 3hi7 s GLU 73 N 0.83 1.29 0.29 2.79 -1.05 -0.49 -4.28 118.70 118.08 3hi7 s GLU 73 Ca -0.12 -1.13 -0.29 0.00 -0.15 0.00 0.00 54.97 53.28 3hi7 s GLU 73 Cb -0.15 0.43 -0.10 0.00 -0.44 0.00 0.00 34.13 33.87 3hi7 s GLU 73 CO 0.02 -0.50 1.30 1.41 0.95 0.00 0.00 175.26 178.44 3hi7 s MET 74 N -3.96 4.38 -0.34 -4.83 -2.45 -1.26 0.04 119.30 110.87 3hi7 s MET 74 Ca 0.17 2.16 -0.09 0.00 -1.25 0.00 0.00 55.69 56.68 3hi7 s MET 74 Cb 0.02 -3.11 0.02 0.00 1.25 0.00 0.00 34.83 33.01 3hi7 s MET 74 CO 0.01 -0.19 0.15 -1.17 1.05 0.00 0.00 175.02 174.88 3hi7 s LEU 75 N -1.26 4.40 0.30 4.11 2.96 -0.11 -4.61 118.68 124.47 3hi7 s LEU 75 Ca 0.51 -0.92 -0.30 0.00 -0.22 0.00 0.00 54.13 53.21 3hi7 s LEU 75 Cb -0.39 -1.96 -0.11 0.00 0.50 0.00 0.00 46.19 44.23 3hi7 s LEU 75 CO 0.48 -0.31 1.52 -0.22 -1.32 0.00 0.00 176.35 176.50 3hi7 s LEU 76 N 1.52 4.35 1.03 -0.68 2.96 -1.26 -4.33 118.68 122.27 3hi7 s LEU 76 Ca 0.02 2.89 -0.12 0.00 -0.22 0.00 0.00 54.13 56.69 3hi7 s LEU 76 Cb -0.19 -3.64 0.21 0.00 0.50 0.00 0.00 46.19 43.07 3hi7 s LEU 76 CO 0.05 -0.84 1.07 -2.84 -1.32 0.00 0.00 176.35 172.48 3hi7 s PRO 77 N -0.81 0.17 0.36 0.98 0.02 -1.26 -4.96 135.00 129.49 3hi7 s PRO 77 Ca 0.60 0.71 -0.28 0.00 0.02 0.00 0.00 61.00 62.04 3hi7 s PRO 77 Cb -0.46 -1.69 -0.11 0.00 0.02 0.00 0.00 34.50 32.26 3hi7 s PRO 77 CO 0.50 -2.96 1.42 0.15 -0.33 0.00 0.00 177.00 175.78 3hi7 s LYS 78 N -4.79 4.21 0.31 5.54 1.02 -1.26 -4.84 119.74 119.92 3hi7 s LYS 78 Ca 0.66 2.43 0.02 0.00 0.02 0.00 0.00 55.97 59.10 3hi7 s LYS 78 Cb -0.21 -3.01 0.58 0.00 -0.52 0.00 0.00 37.83 34.68 3hi7 s LYS 78 CO 0.60 -0.40 1.89 -0.22 -0.92 0.00 0.00 175.35 176.30 3hi7 h LYS 79 N 3.22 0.94 -0.46 1.68 3.64 -1.98 -0.69 116.57 122.91 3hi7 h LYS 79 Ca -0.50 -0.06 0.09 0.00 -1.27 0.00 0.00 60.65 58.92 3hi7 h LYS 79 Cb 1.23 -0.21 -0.09 0.00 -0.41 0.00 0.00 32.23 32.76 3hi7 h LYS 79 CO 0.65 0.62 -0.09 -0.92 -2.27 0.00 0.00 179.45 177.44 3hi7 h TYR 80 N 0.97 -0.20 -0.14 1.91 3.20 -2.00 -0.16 116.97 120.55 3hi7 h TYR 80 Ca 0.41 0.04 -0.21 0.00 3.14 0.00 0.00 58.73 62.12 3hi7 h TYR 80 Cb 0.33 0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.76 3hi7 h TYR 80 CO -0.00 -0.18 -0.75 0.45 -1.64 0.00 0.00 178.16 176.04 3hi7 h HIS 81 N 0.02 0.90 -0.28 -3.82 3.86 -1.67 -2.65 115.15 111.51 3hi7 h HIS 81 Ca 0.22 -0.39 0.00 0.00 -1.16 0.00 0.00 60.37 59.04 3hi7 h HIS 81 Cb 0.34 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 3hi7 h HIS 81 CO -0.38 1.20 0.18 0.28 0.86 0.00 0.00 177.93 180.07 3hi7 h VAL 82 N 0.46 1.09 -0.25 2.45 2.07 -0.81 -2.19 116.25 119.08 3hi7 h VAL 82 Ca -0.04 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.18 3hi7 h VAL 82 Cb 1.36 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 3hi7 h VAL 82 CO 0.15 0.09 -0.29 -0.07 0.02 0.00 0.00 177.57 177.47 3hi7 h LEU 83 N 0.37 0.50 -1.20 2.57 3.38 -1.04 0.20 115.31 120.09 3hi7 h LEU 83 Ca 0.10 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 3hi7 h LEU 83 Cb -0.01 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 3hi7 h LEU 83 CO -0.02 0.77 0.24 0.03 0.09 0.00 0.00 178.44 179.55 3hi7 h ARG 84 N 0.43 0.80 -0.22 1.13 3.08 -1.36 0.45 114.38 118.69 3hi7 h ARG 84 Ca 0.06 -0.11 -0.11 0.00 0.07 0.00 0.00 59.98 59.89 3hi7 h ARG 84 Cb 0.72 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.62 3hi7 h ARG 84 CO 0.06 0.64 -0.28 0.35 -1.07 0.00 0.00 179.97 179.67 3hi7 h PHE 85 N 0.79 0.70 -0.04 3.04 3.57 -0.82 -0.97 116.94 123.21 3hi7 h PHE 85 Ca 0.19 -0.22 -0.18 0.00 3.53 0.00 0.00 57.97 61.29 3hi7 h PHE 85 Cb 0.13 -0.14 0.01 0.00 2.79 0.00 0.00 35.95 38.74 3hi7 h PHE 85 CO 0.01 0.94 -0.68 -0.07 -2.23 0.00 0.00 178.31 176.27 3hi7 h LEU 86 N 0.26 0.67 0.00 0.59 3.38 -0.74 -3.35 115.31 116.12 3hi7 h LEU 86 Ca 0.03 -0.71 -0.12 0.00 0.09 0.00 0.00 57.88 57.16 3hi7 h LEU 86 Cb 0.85 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 3hi7 h LEU 86 CO 0.07 1.29 -1.84 0.47 0.09 0.00 0.00 178.44 178.52 3hi7 n ASP 87 N -4.12 1.47 -0.04 -0.43 8.00 0.16 -4.64 116.55 116.95 3hi7 n ASP 87 Ca -0.10 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.45 3hi7 n ASP 87 Cb 0.70 1.30 0.06 0.00 -0.02 0.00 0.00 41.12 43.17 3hi7 n ASP 87 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3hi7 n LYS 88 N -2.27 2.06 -2.10 -1.24 5.02 -0.43 -5.01 118.16 114.19 3hi7 n LYS 88 Ca -0.12 -1.93 -0.17 0.00 -2.02 0.00 0.00 58.31 54.07 3hi7 n LYS 88 Cb 0.67 -1.19 -0.03 0.00 -0.02 0.00 0.00 35.03 34.46 3hi7 n LYS 88 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hi7 n GLY 89 N -0.88 0.20 4.00 0.72 0.00 -0.91 -4.93 105.19 103.38 3hi7 n GLY 89 Ca 0.07 -0.18 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 3hi7 n GLY 89 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hi7 s GLU 90 N -4.48 1.43 0.52 1.61 2.02 -0.81 -4.99 118.70 114.00 3hi7 s GLU 90 Ca 0.00 -1.21 -0.21 0.00 0.02 0.00 0.00 54.97 53.56 3hi7 s GLU 90 Cb 0.00 -2.29 -0.06 0.00 0.10 0.00 0.00 34.13 31.88 3hi7 s GLU 90 CO 0.00 -1.65 1.21 -0.98 0.02 0.00 0.00 175.26 173.86 3hi7 s ARG 91 N -5.24 3.39 0.12 1.61 1.70 -1.26 -4.44 118.95 114.83 3hi7 s ARG 91 Ca 0.69 1.87 -0.35 0.00 -0.47 0.00 0.00 55.73 57.46 3hi7 s ARG 91 Cb -0.04 -2.22 -0.16 0.00 -0.57 0.00 0.00 34.95 31.97 3hi7 s ARG 91 CO 0.46 -0.88 1.43 1.58 -1.08 0.00 0.00 175.30 176.81 3hi7 n HIS 92 N -0.95 1.82 -0.95 5.89 -0.00 -1.26 -4.52 115.22 115.25 3hi7 n HIS 92 Ca 0.10 0.49 -0.31 0.00 0.46 0.00 0.00 57.72 58.46 3hi7 n HIS 92 Cb 0.48 -2.42 0.14 0.00 -0.12 0.00 0.00 29.99 28.07 3hi7 n HIS 92 CO 0.00 0.00 0.00 -2.14 0.46 0.00 0.00 176.34 174.66 3hi7 s PRO 93 N 0.62 1.50 0.24 1.57 0.02 -1.26 -4.94 135.00 132.75 3hi7 s PRO 93 Ca 0.82 1.48 -0.31 0.00 0.02 0.00 0.00 61.00 63.01 3hi7 s PRO 93 Cb -0.84 -1.79 -0.11 0.00 0.02 0.00 0.00 34.50 31.78 3hi7 s PRO 93 CO 0.43 -2.26 1.58 0.08 -0.33 0.00 0.00 177.00 176.50 3hi7 s VAL 94 N -2.63 2.30 -0.09 3.83 1.01 -1.26 -4.99 120.40 118.57 3hi7 s VAL 94 Ca 0.66 0.24 -0.15 0.00 0.00 0.00 0.00 61.98 62.73 3hi7 s VAL 94 Cb -0.22 -3.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.96 3hi7 s VAL 94 CO 0.56 0.03 0.39 -0.60 0.00 0.00 0.00 175.10 175.47 3hi7 s ARG 95 N 0.17 4.15 0.05 2.72 3.52 -1.26 -4.76 118.95 123.55 3hi7 s ARG 95 Ca 0.66 0.31 -0.01 0.00 -0.13 0.00 0.00 55.73 56.55 3hi7 s ARG 95 Cb -0.46 -3.36 -0.04 0.00 -1.56 0.00 0.00 34.95 29.53 3hi7 s ARG 95 CO 0.40 0.37 -0.02 -1.21 -0.81 0.00 0.00 175.30 174.04 3hi7 s GLU 96 N -0.02 0.63 0.04 5.12 2.02 -1.26 -1.48 118.70 123.75 3hi7 s GLU 96 Ca 0.22 -1.22 0.04 0.00 0.02 0.00 0.00 54.97 54.02 3hi7 s GLU 96 Cb -0.15 0.21 -0.04 0.00 0.10 0.00 0.00 34.13 34.26 3hi7 s GLU 96 CO 0.09 -0.12 -0.05 0.00 0.02 0.00 0.00 175.26 175.20 3hi7 s ALA 97 N -3.92 3.11 -0.15 5.21 0.00 0.41 -0.93 121.76 125.49 3hi7 s ALA 97 Ca 0.08 -1.06 -0.21 0.00 0.00 0.00 0.00 51.96 50.76 3hi7 s ALA 97 Cb 0.08 -1.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 3hi7 s ALA 97 CO -0.09 0.64 0.64 0.50 0.00 0.00 0.00 175.76 177.45 3hi7 s ARG 98 N -1.74 4.30 -0.14 0.00 3.52 0.11 -0.43 118.95 124.56 3hi7 s ARG 98 Ca 0.20 0.69 0.02 0.00 -0.13 0.00 0.00 55.73 56.51 3hi7 s ARG 98 Cb -0.11 -3.52 0.02 0.00 -1.56 0.00 0.00 34.95 29.77 3hi7 s ARG 98 CO 0.11 -0.11 -0.19 0.00 -0.81 0.00 0.00 175.30 174.31 3hi7 s ALA 99 N 1.45 2.08 -0.26 6.12 0.00 -0.17 -1.40 121.76 129.57 3hi7 s ALA 99 Ca 0.31 -1.01 -0.10 0.00 0.00 0.00 0.00 51.96 51.16 3hi7 s ALA 99 Cb -0.16 -1.01 -0.04 0.00 0.00 0.00 0.00 23.12 21.90 3hi7 s ALA 99 CO 0.13 -0.18 0.15 0.08 0.00 0.00 0.00 175.76 175.94 3hi7 s VAL 100 N 1.08 5.03 -0.14 0.00 1.01 -0.08 -1.13 120.40 126.17 3hi7 s VAL 100 Ca -0.02 0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.03 3hi7 s VAL 100 Cb -0.14 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 3hi7 s VAL 100 CO -0.06 0.29 -0.13 -0.63 0.00 0.00 0.00 175.10 174.57 3hi7 s ILE 101 N 1.57 2.93 -0.42 2.22 1.01 -0.40 -0.34 121.20 127.76 3hi7 s ILE 101 Ca 0.07 -0.69 -0.24 0.00 0.00 0.00 0.00 60.65 59.78 3hi7 s ILE 101 Cb -0.15 -2.24 0.02 0.00 0.01 0.00 0.00 42.46 40.10 3hi7 s ILE 101 CO 0.08 0.51 0.84 -0.36 0.00 0.00 0.00 174.94 176.01 3hi7 s PHE 102 N 0.59 3.02 -1.06 3.97 0.40 0.03 -1.81 117.98 123.12 3hi7 s PHE 102 Ca -0.08 0.40 -0.13 0.00 -0.60 0.00 0.00 56.93 56.53 3hi7 s PHE 102 Cb -0.16 -3.66 0.21 0.00 0.51 0.00 0.00 43.02 39.93 3hi7 s PHE 102 CO 0.03 -0.92 1.15 -0.06 0.70 0.00 0.00 175.22 176.12 3hi7 s PHE 103 N 3.37 3.78 -0.75 0.36 0.40 0.61 -1.33 117.98 124.43 3hi7 s PHE 103 Ca 0.33 -2.21 0.23 0.00 -0.60 0.00 0.00 56.93 54.68 3hi7 s PHE 103 Cb -0.12 -4.05 0.17 0.00 0.51 0.00 0.00 43.02 39.54 3hi7 s PHE 103 CO 0.21 -1.17 1.15 0.41 0.70 0.00 0.00 175.22 176.52 3hi7 n GLY 104 N 3.76 -1.23 2.71 4.36 0.00 -0.42 -2.06 105.19 112.32 3hi7 n GLY 104 Ca 0.26 -0.39 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 3hi7 n GLY 104 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hi7 n ASP 105 N -1.82 7.22 -3.63 1.61 2.03 -1.23 -3.96 116.55 116.77 3hi7 n ASP 105 Ca 0.03 -3.72 -0.10 0.00 0.52 0.00 0.00 54.79 51.52 3hi7 n ASP 105 Cb 0.40 -1.11 -0.02 0.00 -0.72 0.00 0.00 41.12 39.67 3hi7 n ASP 105 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hi7 s GLN 106 N -4.23 1.46 0.26 -0.67 -2.07 -1.26 -4.91 119.66 108.24 3hi7 s GLN 106 Ca 0.43 -0.72 -0.04 0.00 -1.82 0.00 0.00 55.36 53.21 3hi7 s GLN 106 Cb 0.25 0.58 0.38 0.00 -1.09 0.00 0.00 33.01 33.13 3hi7 s GLN 106 CO -0.20 -0.64 1.86 1.05 -1.32 0.00 0.00 175.29 176.04 3hi7 h GLU 107 N 2.05 1.04 -3.16 9.60 4.11 -1.95 -3.31 114.58 122.94 3hi7 h GLU 107 Ca -0.28 -0.06 -0.63 0.00 0.07 0.00 0.00 59.36 58.46 3hi7 h GLU 107 Cb 1.28 -0.23 -0.41 0.00 0.50 0.00 0.00 28.75 29.89 3hi7 h GLU 107 CO 0.33 0.69 -0.64 -1.01 0.07 0.00 0.00 179.01 178.45 3hi7 s HIS 108 N -6.05 3.06 0.49 2.06 3.76 -1.26 -5.10 115.29 112.25 3hi7 s HIS 108 Ca -0.12 -3.09 -0.23 0.00 -0.15 0.00 0.00 55.06 51.46 3hi7 s HIS 108 Cb 0.19 -2.55 -0.08 0.00 1.11 0.00 0.00 32.58 31.26 3hi7 s HIS 108 CO 0.80 -0.68 1.17 -2.30 -0.85 0.00 0.00 174.74 172.89 3hi7 n PRO 109 N 2.72 1.53 -3.98 8.40 -0.02 -1.25 -5.02 135.00 137.37 3hi7 n PRO 109 Ca 0.12 0.56 -0.09 0.00 -2.02 0.00 0.00 63.50 62.07 3hi7 n PRO 109 Cb 0.34 -2.31 -0.05 0.00 -0.02 0.00 0.00 33.50 31.47 3hi7 n PRO 109 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hi7 s ASN 110 N -0.82 -0.05 -0.16 2.55 2.20 -0.88 -4.40 114.94 113.38 3hi7 s ASN 110 Ca 0.67 -0.93 -0.04 0.00 -0.94 0.00 0.00 52.86 51.62 3hi7 s ASN 110 Cb -0.48 0.62 -0.03 0.00 -2.00 0.00 0.00 41.25 39.36 3hi7 s ASN 110 CO 0.53 -1.19 -0.01 -0.69 -2.94 0.00 0.00 177.10 172.79 3hi7 s VAL 111 N -3.89 4.11 0.01 3.54 1.01 -1.26 -0.29 120.40 123.63 3hi7 s VAL 111 Ca 0.21 -0.28 0.06 0.00 0.00 0.00 0.00 61.98 61.97 3hi7 s VAL 111 Cb -0.01 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 3hi7 s VAL 111 CO 0.10 0.49 -0.18 -0.89 0.00 0.00 0.00 175.10 174.61 3hi7 s THR 112 N 0.32 1.44 0.06 3.92 2.01 -0.75 -4.99 115.64 117.65 3hi7 s THR 112 Ca -0.02 -0.91 0.03 0.00 0.31 0.00 0.00 61.69 61.10 3hi7 s THR 112 Cb -0.14 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 3hi7 s THR 112 CO 0.02 0.30 0.05 -1.61 -0.69 0.00 0.00 174.62 172.68 3hi7 s GLU 113 N -0.71 2.81 0.02 4.92 2.02 -1.26 -1.28 118.70 125.22 3hi7 s GLU 113 Ca 0.06 -0.68 0.02 0.00 0.02 0.00 0.00 54.97 54.40 3hi7 s GLU 113 Cb -0.07 -2.69 -0.02 0.00 0.10 0.00 0.00 34.13 31.45 3hi7 s GLU 113 CO 0.00 0.58 -0.08 -0.06 0.02 0.00 0.00 175.26 175.72 3hi7 s PHE 114 N -1.29 0.69 -0.21 1.61 0.40 -0.28 0.30 117.98 119.20 3hi7 s PHE 114 Ca 0.26 -0.32 -0.23 0.00 -0.60 0.00 0.00 56.93 56.04 3hi7 s PHE 114 Cb -0.12 -0.42 -0.02 0.00 0.51 0.00 0.00 43.02 42.97 3hi7 s PHE 114 CO 0.18 -0.04 0.74 0.00 0.70 0.00 0.00 175.22 176.80 3hi7 s ALA 115 N -0.81 3.58 -0.16 5.36 0.00 0.72 -1.00 121.76 129.44 3hi7 s ALA 115 Ca -0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 51.96 51.72 3hi7 s ALA 115 Cb -0.07 -3.14 -0.02 0.00 0.00 0.00 0.00 23.12 19.90 3hi7 s ALA 115 CO 0.00 -0.73 -0.09 0.08 0.00 0.00 0.00 175.76 175.02 3hi7 s VAL 116 N 2.35 3.31 0.15 0.00 1.01 0.43 -0.70 120.40 126.94 3hi7 s VAL 116 Ca 0.32 -0.55 -0.23 0.00 0.00 0.00 0.00 61.98 61.51 3hi7 s VAL 116 Cb -0.16 -2.43 0.08 0.00 0.00 0.00 0.00 36.38 33.87 3hi7 s VAL 116 CO 0.10 0.49 1.08 -0.83 0.00 0.00 0.00 175.10 175.94 3hi7 s GLY 117 N 0.64 0.05 0.75 4.51 0.00 -1.11 -0.44 107.32 111.73 3hi7 s GLY 117 Ca -0.05 -0.24 -0.09 0.00 0.00 0.00 0.00 44.72 44.34 3hi7 s GLY 117 CO 0.03 2.80 1.09 2.56 0.00 0.00 0.00 173.10 179.58 3hi7 s PRO 118 N -2.19 2.08 -0.13 2.90 0.04 -1.26 0.14 135.00 136.57 3hi7 s PRO 118 Ca 0.23 -0.09 0.03 0.00 0.04 0.00 0.00 61.00 61.20 3hi7 s PRO 118 Cb -0.02 -2.07 0.01 0.00 0.04 0.00 0.00 34.50 32.46 3hi7 s PRO 118 CO 0.04 -1.41 -0.22 -0.51 0.04 0.00 0.00 177.00 174.94 3hi7 s LEU 119 N -5.40 2.09 0.85 -3.56 1.43 -0.55 -1.49 118.68 112.04 3hi7 s LEU 119 Ca 0.61 -0.59 -0.12 0.00 -1.03 0.00 0.00 54.13 53.00 3hi7 s LEU 119 Cb -0.11 -1.42 0.10 0.00 0.03 0.00 0.00 46.19 44.79 3hi7 s LEU 119 CO 0.47 0.09 1.11 -2.16 0.23 0.00 0.00 176.35 176.09 3hi7 s PRO 120 N 0.76 1.67 -0.23 1.29 0.04 -1.26 -4.48 135.00 132.80 3hi7 s PRO 120 Ca -0.09 0.52 -0.01 0.00 0.04 0.00 0.00 61.00 61.46 3hi7 s PRO 120 Cb -0.16 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 3hi7 s PRO 120 CO -0.01 -1.88 0.21 0.41 0.04 0.00 0.00 177.00 175.77 3hi7 n GLY 121 N -2.08 0.16 3.77 0.56 0.00 -1.22 -4.99 105.19 101.40 3hi7 n GLY 121 Ca 0.07 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3hi7 n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hi7 s PRO 122 N -3.24 3.89 0.00 1.61 0.04 -0.56 -4.13 135.00 132.60 3hi7 s PRO 122 Ca 0.08 2.47 0.00 0.00 0.04 0.00 0.00 61.00 63.59 3hi7 s PRO 122 Cb -0.01 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.73 3hi7 s PRO 122 CO 0.18 -0.67 0.05 0.00 0.04 0.00 0.00 177.00 176.59 3hi7 s TYR 124 N 0.00 1.11 -0.28 0.00 -0.85 -0.46 -5.00 117.35 111.87 3hi7 s TYR 124 Ca 0.00 -1.16 -0.01 0.00 -0.52 0.00 0.00 57.07 55.37 3hi7 s TYR 124 Cb 0.00 -0.62 0.13 0.00 0.38 0.00 0.00 41.96 41.85 3hi7 s TYR 124 CO 0.00 -0.39 0.28 1.41 -1.52 0.00 0.00 175.55 175.32 3hi7 s MET 125 N -4.01 0.30 -0.23 -3.49 1.75 -1.26 -2.73 119.30 109.63 3hi7 s MET 125 Ca 0.27 -0.10 -0.05 0.00 -1.25 0.00 0.00 55.69 54.57 3hi7 s MET 125 Cb 0.07 -0.76 -0.01 0.00 2.84 0.00 0.00 34.83 36.97 3hi7 s MET 125 CO 0.05 -0.97 -0.01 1.03 -0.65 0.00 0.00 175.02 174.47 3hi7 s ARG 126 N 2.34 3.39 0.39 4.11 0.52 0.12 -4.93 118.95 124.90 3hi7 s ARG 126 Ca 0.09 -0.62 -0.27 0.00 -0.52 0.00 0.00 55.73 54.41 3hi7 s ARG 126 Cb -0.14 -3.09 -0.10 0.00 0.52 0.00 0.00 34.95 32.14 3hi7 s ARG 126 CO -0.30 -0.22 1.43 0.00 0.02 0.00 0.00 175.30 176.23 3hi7 s ALA 127 N 1.50 3.46 0.23 2.13 0.00 -1.26 -0.20 121.76 127.61 3hi7 s ALA 127 Ca 0.06 1.48 0.09 0.00 0.00 0.00 0.00 51.96 53.58 3hi7 s ALA 127 Cb -0.15 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 3hi7 s ALA 127 CO -0.02 -1.01 -0.05 -0.51 0.00 0.00 0.00 175.76 174.17 3hi7 s LEU 128 N -2.23 3.08 -1.12 0.00 1.43 0.15 -4.85 118.68 115.14 3hi7 s LEU 128 Ca 0.54 -0.63 -0.24 0.00 -1.03 0.00 0.00 54.13 52.78 3hi7 s LEU 128 Cb -0.44 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.13 3hi7 s LEU 128 CO 0.59 0.05 0.71 -1.54 0.23 0.00 0.00 176.35 176.39 3hi7 n SER 129 N -0.46 -4.78 -4.75 2.29 3.41 -1.26 -4.57 113.62 103.50 3hi7 n SER 129 Ca -0.08 -1.12 -0.37 0.00 -0.26 0.00 0.00 58.87 57.04 3hi7 n SER 129 Cb 0.57 -2.36 0.03 0.00 -0.26 0.00 0.00 64.21 62.20 3hi7 n SER 129 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 3hi7 s PRO 130 N -6.44 3.13 -0.54 4.33 0.04 -1.26 -5.01 135.00 129.25 3hi7 s PRO 130 Ca 0.40 2.05 0.04 0.00 0.04 0.00 0.00 61.00 63.53 3hi7 s PRO 130 Cb -0.19 -2.16 0.16 0.00 0.04 0.00 0.00 34.50 32.36 3hi7 s PRO 130 CO 0.92 -1.14 0.38 1.03 0.04 0.00 0.00 177.00 178.23 3hi7 s ARG 131 N -3.02 1.66 0.26 4.56 0.52 -1.26 -5.11 118.95 116.55 3hi7 s ARG 131 Ca 0.73 -2.62 -0.31 0.00 -0.52 0.00 0.00 55.73 53.01 3hi7 s ARG 131 Cb -0.36 -2.48 -0.12 0.00 0.52 0.00 0.00 34.95 32.51 3hi7 s ARG 131 CO 0.41 -1.29 1.54 -2.30 0.02 0.00 0.00 175.30 173.68 3hi7 n PRO 132 N 2.63 2.45 -0.00 3.54 -0.02 -1.26 -1.95 135.00 140.38 3hi7 n PRO 132 Ca 0.21 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.56 3hi7 n PRO 132 Cb 0.39 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 3hi7 n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hi7 n GLY 133 N 2.38 1.86 3.66 -1.23 0.00 -1.26 -5.02 105.19 105.58 3hi7 n GLY 133 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3hi7 n GLY 133 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3hi7 s TYR 134 N -2.63 3.38 -1.30 1.61 6.14 -0.82 -4.95 117.35 118.77 3hi7 s TYR 134 Ca 0.00 0.90 0.11 0.00 0.64 0.00 0.00 57.07 58.72 3hi7 s TYR 134 Cb 0.00 -2.77 0.12 0.00 0.42 0.00 0.00 41.96 39.73 3hi7 s TYR 134 CO 0.00 -0.15 0.90 1.04 0.64 0.00 0.00 175.55 177.99 3hi7 n GLN 135 N 4.94 0.85 -0.45 4.97 6.02 -1.26 -4.67 117.38 127.78 3hi7 n GLN 135 Ca -0.02 -1.28 0.08 0.00 -0.01 0.00 0.00 57.00 55.77 3hi7 n GLN 135 Cb 0.50 -1.22 0.26 0.00 1.02 0.00 0.00 30.24 30.80 3hi7 n GLN 135 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3hi7 n SER 136 N 0.60 3.95 -0.24 1.08 7.64 -1.26 -4.68 113.62 120.72 3hi7 n SER 136 Ca 0.07 -2.81 0.02 0.00 1.01 0.00 0.00 58.87 57.16 3hi7 n SER 136 Cb 0.30 -0.51 0.11 0.00 -1.01 0.00 0.00 64.21 63.10 3hi7 n SER 136 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 3hi7 h SER 137 N 2.17 -0.47 -0.20 6.43 0.87 -1.91 -1.17 113.55 119.26 3hi7 h SER 137 Ca 0.00 0.19 -0.02 0.00 -1.23 0.00 0.00 61.79 60.73 3hi7 h SER 137 Cb 1.38 0.37 -0.01 0.00 -0.44 0.00 0.00 62.40 63.70 3hi7 h SER 137 CO 0.21 -0.19 0.03 -0.25 -0.53 0.00 0.00 176.83 176.10 3hi7 h TRP 138 N 0.05 0.35 0.00 2.24 2.91 -1.83 -2.77 115.95 116.91 3hi7 h TRP 138 Ca 0.36 -0.05 -0.04 0.00 1.13 0.00 0.00 58.89 60.29 3hi7 h TRP 138 Cb 0.59 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 29.14 3hi7 h TRP 138 CO -0.47 0.48 -0.19 0.00 -1.03 0.00 0.00 178.44 177.22 3hi7 h ALA 139 N 0.84 1.50 0.00 2.65 0.00 -1.70 -2.61 119.26 119.92 3hi7 h ALA 139 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3hi7 h ALA 139 Cb 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hi7 h ALA 139 CO 0.00 0.24 0.00 -1.13 0.00 0.00 0.00 179.25 178.36 3hi7 n SER 140 N -4.04 0.66 -4.78 0.00 3.41 -0.50 -4.74 113.62 103.63 3hi7 n SER 140 Ca -0.02 0.61 -0.34 0.00 -0.26 0.00 0.00 58.87 58.86 3hi7 n SER 140 Cb 0.27 -0.77 -0.01 0.00 -0.26 0.00 0.00 64.21 63.44 3hi7 n SER 140 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hi7 s ARG 141 N -3.19 3.52 0.77 4.33 1.70 -0.99 -4.24 118.95 120.84 3hi7 s ARG 141 Ca 0.08 1.48 -0.15 0.00 -0.47 0.00 0.00 55.73 56.67 3hi7 s ARG 141 Cb 0.11 -2.04 0.03 0.00 -0.57 0.00 0.00 34.95 32.48 3hi7 s ARG 141 CO 0.48 -0.69 0.94 -2.30 -1.08 0.00 0.00 175.30 172.65 3hi7 n PRO 142 N -1.23 0.33 -1.99 3.89 -0.02 -1.26 -4.89 135.00 129.82 3hi7 n PRO 142 Ca 0.10 0.17 -0.33 0.00 -2.02 0.00 0.00 63.50 61.43 3hi7 n PRO 142 Cb 0.52 -2.21 0.02 0.00 -0.02 0.00 0.00 33.50 31.80 3hi7 n PRO 142 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3hi7 s ILE 143 N -1.96 3.67 0.19 4.25 2.07 -1.26 -5.07 121.20 123.08 3hi7 s ILE 143 Ca 0.71 0.80 0.04 0.00 -1.41 0.00 0.00 60.65 60.78 3hi7 s ILE 143 Cb -0.32 -3.32 -0.05 0.00 0.13 0.00 0.00 42.46 38.90 3hi7 s ILE 143 CO 0.53 -0.46 -0.05 -0.94 -1.91 0.00 0.00 174.94 172.11 3hi7 s SER 144 N -2.71 1.75 0.23 4.50 1.04 -1.26 -5.03 113.70 112.22 3hi7 s SER 144 Ca 0.65 -1.12 -0.07 0.00 0.48 0.00 0.00 55.95 55.89 3hi7 s SER 144 Cb -0.17 0.01 0.33 0.00 0.10 0.00 0.00 66.02 66.29 3hi7 s SER 144 CO 0.37 -0.44 1.80 0.74 0.98 0.00 0.00 173.24 176.70 3hi7 h THR 145 N 2.63 0.92 -0.80 2.02 2.02 -1.91 -1.20 112.91 116.59 3hi7 h THR 145 Ca -0.37 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.55 3hi7 h THR 145 Cb 1.21 0.13 -0.04 0.00 -1.74 0.00 0.00 68.15 67.71 3hi7 h THR 145 CO 0.64 0.13 0.46 0.00 0.37 0.00 0.00 175.52 177.12 3hi7 h ALA 146 N 1.41 1.03 -0.74 6.16 0.00 -1.89 -1.12 119.26 124.11 3hi7 h ALA 146 Ca 0.35 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 3hi7 h ALA 146 Cb 0.29 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3hi7 h ALA 146 CO -0.23 0.51 0.27 1.49 0.00 0.00 0.00 179.25 181.30 3hi7 h GLU 147 N 1.11 1.12 -0.79 0.00 4.81 -1.72 -2.02 114.58 117.08 3hi7 h GLU 147 Ca 0.29 -0.22 -0.03 0.00 -0.13 0.00 0.00 59.36 59.27 3hi7 h GLU 147 Cb -0.01 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.16 3hi7 h GLU 147 CO -0.05 0.93 0.38 1.88 -0.73 0.00 0.00 179.01 181.42 3hi7 h TYR 148 N 1.07 1.14 -0.72 0.92 0.99 -0.62 -0.24 116.97 119.52 3hi7 h TYR 148 Ca 0.24 -0.06 0.04 0.00 2.00 0.00 0.00 58.73 60.96 3hi7 h TYR 148 Cb 0.25 -0.35 -0.05 0.00 1.00 0.00 0.00 36.73 37.57 3hi7 h TYR 148 CO 0.02 0.83 0.44 0.00 -0.00 0.00 0.00 178.16 179.45 3hi7 h ALA 149 N 1.20 0.95 -0.42 3.88 0.00 -0.94 0.12 119.26 124.05 3hi7 h ALA 149 Ca 0.27 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.04 3hi7 h ALA 149 Cb 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3hi7 h ALA 149 CO -0.03 0.18 -0.26 -0.07 0.00 0.00 0.00 179.25 179.07 3hi7 h LEU 150 N 0.83 0.92 -0.61 0.00 3.38 -0.99 -2.34 115.31 116.50 3hi7 h LEU 150 Ca 0.30 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3hi7 h LEU 150 Cb 0.08 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 3hi7 h LEU 150 CO -0.14 1.12 0.36 -0.07 0.09 0.00 0.00 178.44 179.80 3hi7 h LEU 151 N 0.76 0.74 -0.19 1.67 3.38 -0.57 -0.12 115.31 120.98 3hi7 h LEU 151 Ca 0.09 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.02 3hi7 h LEU 151 Cb 0.81 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 3hi7 h LEU 151 CO 0.07 0.59 0.04 1.88 0.09 0.00 0.00 178.44 181.11 3hi7 h TYR 152 N 0.83 0.06 -0.57 1.13 0.05 -0.88 0.16 116.97 117.76 3hi7 h TYR 152 Ca 0.22 0.01 0.05 0.00 0.05 0.00 0.00 58.73 59.06 3hi7 h TYR 152 Cb -0.00 -0.00 -0.05 0.00 1.01 0.00 0.00 36.73 37.69 3hi7 h TYR 152 CO -0.02 0.02 0.29 1.25 -1.05 0.00 0.00 178.16 178.65 3hi7 h HIS 153 N 0.12 0.53 -0.62 4.88 2.76 -1.12 0.13 115.15 121.83 3hi7 h HIS 153 Ca 0.09 0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.35 3hi7 h HIS 153 Cb 0.08 -0.15 -0.06 0.00 1.55 0.00 0.00 27.41 28.82 3hi7 h HIS 153 CO -0.14 0.25 0.29 1.15 -1.30 0.00 0.00 177.93 178.18 3hi7 h THR 154 N 0.55 0.87 -0.38 6.26 2.02 -0.45 -2.06 112.91 119.72 3hi7 h THR 154 Ca 0.25 -0.18 -0.07 0.00 0.77 0.00 0.00 66.41 67.19 3hi7 h THR 154 Cb 0.17 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 3hi7 h THR 154 CO -0.18 0.10 -0.02 -0.07 0.37 0.00 0.00 175.52 175.71 3hi7 h LEU 155 N 0.53 0.69 -0.47 2.58 3.38 0.19 0.81 115.31 123.02 3hi7 h LEU 155 Ca 0.29 -0.32 0.06 0.00 0.09 0.00 0.00 57.88 58.00 3hi7 h LEU 155 Cb 0.28 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 3hi7 h LEU 155 CO -0.24 0.85 0.18 1.56 0.09 0.00 0.00 178.44 180.88 3hi7 h GLN 156 N 0.51 0.36 -0.01 1.13 4.20 -0.53 -0.88 115.11 119.90 3hi7 h GLN 156 Ca 0.11 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 3hi7 h GLN 156 Cb 0.51 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.21 3hi7 h GLN 156 CO 0.02 0.24 -0.02 0.93 -0.67 0.00 0.00 178.83 179.33 3hi7 h GLU 157 N 0.37 0.02 0.00 1.46 4.39 -1.27 -3.23 114.58 116.32 3hi7 h GLU 157 Ca 0.22 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.86 3hi7 h GLU 157 Cb 0.20 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 3hi7 h GLU 157 CO -0.21 0.61 -0.23 0.00 -1.16 0.00 0.00 179.01 178.03 3hi7 h ALA 158 N 0.41 1.50 -0.37 3.43 0.00 -0.69 -2.69 119.26 120.85 3hi7 h ALA 158 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3hi7 h ALA 158 Cb 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3hi7 h ALA 158 CO 0.00 0.28 0.00 0.25 0.00 0.00 0.00 179.25 179.79 3hi7 n THR 159 N -4.08 0.49 -0.34 0.00 -2.24 -0.35 -4.43 114.28 103.33 3hi7 n THR 159 Ca -0.02 -0.59 0.14 0.00 -2.27 0.00 0.00 64.05 61.31 3hi7 n THR 159 Cb 0.29 0.51 0.35 0.00 -2.10 0.00 0.00 70.33 69.38 3hi7 n THR 159 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3hi7 h LYS 160 N 3.10 0.70 0.00 -0.78 1.57 -1.49 0.11 116.57 119.77 3hi7 h LYS 160 Ca 0.00 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3hi7 h LYS 160 Cb 0.69 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 3hi7 h LYS 160 CO 0.00 0.46 -0.01 -1.35 -0.57 0.00 0.00 179.45 177.98 3hi7 h PRO 161 N 0.72 0.00 -0.28 3.15 0.11 -1.84 -2.41 132.00 131.45 3hi7 h PRO 161 Ca 0.57 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.68 3hi7 h PRO 161 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3hi7 h PRO 161 CO -0.37 0.01 0.00 1.28 -0.21 0.00 0.00 178.00 178.71 3hi7 n LEU 162 N -3.42 2.21 -0.09 2.35 4.77 0.37 -4.58 117.00 118.61 3hi7 n LEU 162 Ca -0.03 -0.98 -0.06 0.00 -0.03 0.00 0.00 56.01 54.91 3hi7 n LEU 162 Cb 0.10 -0.18 0.01 0.00 -2.33 0.00 0.00 43.42 41.01 3hi7 n LEU 162 CO 0.24 0.49 0.86 -0.74 -1.33 0.00 0.00 177.39 176.90 3hi7 h HIS 163 N 2.78 -0.02 -0.55 -1.77 2.76 -1.43 0.22 115.15 117.16 3hi7 h HIS 163 Ca 0.00 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.13 3hi7 h HIS 163 Cb 0.62 0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.61 3hi7 h HIS 163 CO 0.18 -0.05 0.10 1.96 -1.30 0.00 0.00 177.93 178.81 3hi7 h GLN 164 N 0.09 0.90 -0.61 5.26 7.50 -1.84 -2.05 115.11 124.36 3hi7 h GLN 164 Ca 0.15 -0.24 0.09 0.00 0.50 0.00 0.00 58.65 59.16 3hi7 h GLN 164 Cb 0.21 -0.11 -0.07 0.00 0.05 0.00 0.00 27.48 27.56 3hi7 h GLN 164 CO -0.26 0.86 0.24 0.35 -1.50 0.00 0.00 178.83 178.53 3hi7 h PHE 165 N 0.79 0.42 -0.07 2.96 3.57 -1.63 0.13 116.94 123.11 3hi7 h PHE 165 Ca 0.17 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.70 3hi7 h PHE 165 Cb 0.39 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.03 3hi7 h PHE 165 CO 0.03 0.12 0.04 0.74 -2.23 0.00 0.00 178.31 177.01 3hi7 h PHE 166 N 0.43 0.09 -0.47 0.41 0.04 -0.34 -0.31 116.94 116.79 3hi7 h PHE 166 Ca 0.30 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.05 3hi7 h PHE 166 Cb 0.36 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.46 3hi7 h PHE 166 CO -0.16 0.08 0.21 -0.07 -0.60 0.00 0.00 178.31 177.77 3hi7 h LEU 167 N 0.06 0.63 -0.60 1.54 3.38 -0.94 0.59 115.31 119.97 3hi7 h LEU 167 Ca 0.02 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 57.72 3hi7 h LEU 167 Cb 0.02 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3hi7 h LEU 167 CO -0.00 0.60 -0.29 0.78 0.09 0.00 0.00 178.44 179.62 3hi7 h ASN 168 N 0.61 0.83 0.64 -0.43 4.21 -0.81 -0.28 115.58 120.35 3hi7 h ASN 168 Ca 0.16 -0.33 -0.23 0.00 1.21 0.00 0.00 56.30 57.11 3hi7 h ASN 168 Cb 0.16 -0.23 -0.04 0.00 -1.12 0.00 0.00 38.32 37.09 3hi7 h ASN 168 CO -0.02 1.06 -1.51 0.71 -1.29 0.00 0.00 177.43 176.39 3hi7 h THR 169 N 0.69 0.72 0.00 2.81 1.35 -0.94 -3.42 112.91 114.11 3hi7 h THR 169 Ca 0.08 -2.39 0.00 0.00 -0.55 0.00 0.00 66.41 63.55 3hi7 h THR 169 Cb 0.82 2.26 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 3hi7 h THR 169 CO 0.07 0.41 -0.35 0.35 -0.25 0.00 0.00 175.52 175.75 3hi7 n THR 170 N -2.99 0.00 -0.87 6.82 -2.24 0.18 -0.56 114.28 114.62 3hi7 n THR 170 Ca -0.12 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 3hi7 n THR 170 Cb 0.94 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 3hi7 n THR 170 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hi7 n GLY 171 N 1.03 0.52 3.61 3.38 0.00 -0.11 -4.93 105.19 108.70 3hi7 n GLY 171 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 3hi7 n GLY 171 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hi7 s PHE 172 N -2.48 2.50 0.23 1.61 0.40 -1.25 -4.92 117.98 114.07 3hi7 s PHE 172 Ca 0.00 -0.59 -0.10 0.00 -0.60 0.00 0.00 56.93 55.64 3hi7 s PHE 172 Cb 0.00 -1.66 0.04 0.00 0.51 0.00 0.00 43.02 41.91 3hi7 s PHE 172 CO 0.00 0.46 0.52 -1.13 0.70 0.00 0.00 175.22 175.77 3hi7 n SER 173 N -0.95 -1.40 -0.26 1.36 3.41 -0.89 -3.37 113.62 111.52 3hi7 n SER 173 Ca -0.04 -1.94 0.10 0.00 -0.26 0.00 0.00 58.87 56.73 3hi7 n SER 173 Cb 0.65 2.32 -0.06 0.00 -0.26 0.00 0.00 64.21 66.86 3hi7 n SER 173 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3hi7 n PHE 174 N -0.35 0.00 -5.15 7.33 3.72 -1.26 -0.95 117.46 120.80 3hi7 n PHE 174 Ca -0.05 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.04 3hi7 n PHE 174 Cb 0.37 0.00 -0.17 0.00 -0.94 0.00 0.00 39.48 38.74 3hi7 n PHE 174 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3hi7 s GLN 175 N -2.67 2.88 -1.43 -1.08 -0.21 -1.26 -4.72 119.66 111.17 3hi7 s GLN 175 Ca 0.13 -0.83 -0.02 0.00 0.02 0.00 0.00 55.36 54.67 3hi7 s GLN 175 Cb 0.17 -2.19 0.02 0.00 1.00 0.00 0.00 33.01 32.00 3hi7 s GLN 175 CO 0.69 0.17 0.49 -0.25 -2.12 0.00 0.00 175.29 174.27 3hi7 n ASP 176 N 3.54 -0.77 -0.09 5.90 8.00 -1.26 -4.88 116.55 126.99 3hi7 n ASP 176 Ca -0.19 -0.98 -0.10 0.00 0.71 0.00 0.00 54.79 54.23 3hi7 n ASP 176 Cb 0.53 -3.14 -0.13 0.00 -0.02 0.00 0.00 41.12 38.35 3hi7 n ASP 176 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hi7 n HIS 178 N -2.72 0.00 0.37 0.00 8.25 -1.26 -0.24 115.22 119.63 3hi7 n HIS 178 Ca -0.30 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.26 3hi7 n HIS 178 Cb 1.05 0.00 0.26 0.00 1.12 0.00 0.00 29.99 32.41 3hi7 n HIS 178 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 3hi7 n ASP 179 N 7.96 2.89 -2.98 0.41 5.75 -1.26 -4.36 116.55 124.95 3hi7 n ASP 179 Ca 0.00 -1.96 -0.18 0.00 -0.01 0.00 0.00 54.79 52.63 3hi7 n ASP 179 Cb 0.00 -0.32 -0.02 0.00 -1.03 0.00 0.00 41.12 39.75 3hi7 n ASP 179 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3hi7 n ARG 180 N 1.08 1.61 -3.97 0.11 1.74 0.67 -4.99 116.66 112.91 3hi7 n ARG 180 Ca 0.18 -3.71 -0.34 0.00 -0.77 0.00 0.00 57.85 53.20 3hi7 n ARG 180 Cb 0.47 -1.75 -0.06 0.00 -1.02 0.00 0.00 32.46 30.10 3hi7 n ARG 180 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hi7 s LEU 182 N -1.54 3.72 0.33 0.00 1.43 -0.12 -0.99 118.68 121.50 3hi7 s LEU 182 Ca 0.22 1.75 0.03 0.00 -1.03 0.00 0.00 54.13 55.10 3hi7 s LEU 182 Cb -0.12 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.52 3hi7 s LEU 182 CO 0.12 -0.73 0.14 0.00 0.23 0.00 0.00 176.35 176.10 3hi7 s ALA 183 N -2.32 2.20 0.07 4.21 0.00 0.45 -4.75 121.76 121.62 3hi7 s ALA 183 Ca 0.63 -1.69 0.01 0.00 0.00 0.00 0.00 51.96 50.91 3hi7 s ALA 183 Cb -0.13 0.99 -0.03 0.00 0.00 0.00 0.00 23.12 23.95 3hi7 s ALA 183 CO 0.26 -0.44 -0.06 -0.59 0.00 0.00 0.00 175.76 174.92 3hi7 s PHE 184 N -3.49 0.72 -0.16 0.00 -0.71 -1.26 -1.03 117.98 112.06 3hi7 s PHE 184 Ca 0.33 -0.75 0.01 0.00 -1.04 0.00 0.00 56.93 55.49 3hi7 s PHE 184 Cb 0.05 -0.44 0.02 0.00 -1.21 0.00 0.00 43.02 41.44 3hi7 s PHE 184 CO 0.16 -0.15 -0.18 0.99 -1.34 0.00 0.00 175.22 174.70 3hi7 s THR 185 N -2.65 1.86 0.24 -4.49 2.01 -0.51 -4.95 115.64 107.15 3hi7 s THR 185 Ca 0.01 -0.83 -0.20 0.00 0.31 0.00 0.00 61.69 60.98 3hi7 s THR 185 Cb -0.01 -1.69 -0.08 0.00 0.01 0.00 0.00 72.50 70.72 3hi7 s THR 185 CO -0.03 0.51 0.74 1.51 -0.69 0.00 0.00 174.62 176.66 3hi7 s ASP 186 N 1.24 7.07 0.32 3.53 -4.77 -1.26 -0.38 116.67 122.42 3hi7 s ASP 186 Ca 0.02 1.45 0.07 0.00 -3.30 0.00 0.00 52.55 50.79 3hi7 s ASP 186 Cb -0.14 -2.43 -0.03 0.00 -1.09 0.00 0.00 42.92 39.23 3hi7 s ASP 186 CO -0.09 0.01 0.26 0.68 0.70 0.00 0.00 175.17 176.73 3hi7 s VAL 187 N -1.55 3.63 0.04 2.11 -7.23 -0.62 -4.98 120.40 111.81 3hi7 s VAL 187 Ca 0.44 -1.41 -0.05 0.00 -1.81 0.00 0.00 61.98 59.15 3hi7 s VAL 187 Cb -0.17 -3.20 -0.01 0.00 0.56 0.00 0.00 36.38 33.56 3hi7 s VAL 187 CO 0.21 -0.20 0.08 0.00 -0.31 0.00 0.00 175.10 174.88 3hi7 s ALA 188 N -2.29 -0.00 1.12 1.32 0.00 -1.26 -4.42 121.76 116.22 3hi7 s ALA 188 Ca 0.39 -0.63 -0.16 0.00 0.00 0.00 0.00 51.96 51.55 3hi7 s ALA 188 Cb -0.06 0.27 0.25 0.00 0.00 0.00 0.00 23.12 23.58 3hi7 s ALA 188 CO 0.26 -0.33 1.11 -1.25 0.00 0.00 0.00 175.76 175.54 3hi7 s PRO 189 N -2.82 -0.54 -0.63 0.00 0.04 -1.25 -1.06 135.00 128.74 3hi7 s PRO 189 Ca -0.03 0.14 0.06 0.00 0.04 0.00 0.00 61.00 61.21 3hi7 s PRO 189 Cb 0.00 -1.66 0.25 0.00 0.04 0.00 0.00 34.50 33.13 3hi7 s PRO 189 CO -0.06 -3.30 0.73 0.54 0.04 0.00 0.00 177.00 174.96 3hi7 n ARG 190 N -4.51 2.44 0.00 4.56 1.74 -1.26 -4.86 116.66 114.78 3hi7 n ARG 190 Ca 0.10 -4.61 0.00 0.00 -0.77 0.00 0.00 57.85 52.57 3hi7 n ARG 190 Cb 0.59 -2.22 0.00 0.00 -1.02 0.00 0.00 32.46 29.81 3hi7 n ARG 190 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hi7 n GLY 191 N 0.90 0.88 0.00 -0.13 0.00 -0.93 -0.69 105.19 105.22 3hi7 n GLY 191 Ca 0.29 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.34 3hi7 n GLY 191 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hi7 n VAL 192 N 6.98 0.04 -3.49 1.61 0.24 -1.26 -5.05 118.33 117.41 3hi7 n VAL 192 Ca 0.00 -0.49 -0.12 0.00 -2.04 0.00 0.00 64.34 61.69 3hi7 n VAL 192 Cb 0.00 1.04 -0.03 0.00 -1.47 0.00 0.00 33.84 33.38 3hi7 n VAL 192 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hi7 s ALA 193 N -0.04 -1.74 0.06 2.33 0.00 -1.26 -5.10 121.76 115.99 3hi7 s ALA 193 Ca 0.00 0.96 -0.36 0.00 0.00 0.00 0.00 51.96 52.56 3hi7 s ALA 193 Cb 0.00 0.36 -0.15 0.00 0.00 0.00 0.00 23.12 23.34 3hi7 s ALA 193 CO 0.00 -0.61 1.54 0.45 0.00 0.00 0.00 175.76 177.15 3hi7 n SER 194 N 0.06 2.52 0.00 0.00 2.88 -1.26 -2.22 113.62 115.61 3hi7 n SER 194 Ca -0.14 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 3hi7 n SER 194 Cb 0.61 -1.30 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 3hi7 n SER 194 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hi7 n GLY 195 N 3.29 0.30 3.86 0.46 0.00 -1.26 -5.00 105.19 106.83 3hi7 n GLY 195 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 3hi7 n GLY 195 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hi7 s GLN 196 N -0.83 3.94 -0.40 1.61 -0.21 -0.94 -4.76 119.66 118.07 3hi7 s GLN 196 Ca 0.00 0.55 0.07 0.00 0.02 0.00 0.00 55.36 56.00 3hi7 s GLN 196 Cb 0.00 -2.50 0.24 0.00 1.00 0.00 0.00 33.01 31.75 3hi7 s GLN 196 CO 0.00 0.20 0.49 -2.13 -2.12 0.00 0.00 175.29 171.74 3hi7 n ARG 197 N -0.30 0.63 -3.98 2.91 0.63 -1.14 -4.72 116.66 110.69 3hi7 n ARG 197 Ca 0.03 -3.22 -0.31 0.00 -0.92 0.00 0.00 57.85 53.43 3hi7 n ARG 197 Cb 0.53 -1.29 -0.15 0.00 0.45 0.00 0.00 32.46 31.99 3hi7 n ARG 197 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3hi7 s ARG 198 N -0.98 1.76 -0.16 -0.14 0.52 0.14 -1.29 118.95 118.81 3hi7 s ARG 198 Ca 0.35 -1.21 -0.04 0.00 -0.52 0.00 0.00 55.73 54.30 3hi7 s ARG 198 Cb 0.15 -2.73 -0.03 0.00 0.52 0.00 0.00 34.95 32.86 3hi7 s ARG 198 CO -0.12 -0.65 -0.02 -1.12 0.02 0.00 0.00 175.30 173.41 3hi7 s SER 199 N 1.25 4.98 0.05 0.23 0.01 0.01 -2.19 113.70 118.04 3hi7 s SER 199 Ca -0.04 -0.08 -0.30 0.00 1.31 0.00 0.00 55.95 56.84 3hi7 s SER 199 Cb -0.19 -1.80 -0.05 0.00 0.21 0.00 0.00 66.02 64.19 3hi7 s SER 199 CO -0.07 0.18 1.06 0.26 0.41 0.00 0.00 173.24 175.08 3hi7 s TRP 200 N 0.31 3.60 -0.14 2.43 0.52 -1.26 -1.40 118.94 122.99 3hi7 s TRP 200 Ca -0.02 1.57 0.02 0.00 0.02 0.00 0.00 56.10 57.69 3hi7 s TRP 200 Cb -0.14 -3.23 0.00 0.00 -1.15 0.00 0.00 33.47 28.96 3hi7 s TRP 200 CO 0.02 -0.46 -0.20 -0.51 0.02 0.00 0.00 176.95 175.83 3hi7 s LEU 201 N 0.81 2.24 -0.29 2.99 1.43 0.11 -1.58 118.68 124.39 3hi7 s LEU 201 Ca 0.53 -0.55 -0.19 0.00 -1.03 0.00 0.00 54.13 52.89 3hi7 s LEU 201 Cb -0.25 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.47 3hi7 s LEU 201 CO 0.29 0.09 0.58 -0.63 0.23 0.00 0.00 176.35 176.91 3hi7 s ILE 202 N 0.78 4.99 0.15 -0.59 1.01 0.49 -1.19 121.20 126.84 3hi7 s ILE 202 Ca -0.07 0.87 -0.27 0.00 0.00 0.00 0.00 60.65 61.18 3hi7 s ILE 202 Cb -0.16 -3.93 -0.07 0.00 0.01 0.00 0.00 42.46 38.31 3hi7 s ILE 202 CO -0.00 -0.04 0.85 -0.63 0.00 0.00 0.00 174.94 175.11 3hi7 s ILE 203 N 2.48 4.40 0.04 2.92 -1.09 -0.77 -1.43 121.20 127.75 3hi7 s ILE 203 Ca 0.24 1.85 -0.00 0.00 -2.23 0.00 0.00 60.65 60.51 3hi7 s ILE 203 Cb -0.15 -4.22 -0.03 0.00 -1.58 0.00 0.00 42.46 36.48 3hi7 s ILE 203 CO 0.10 0.44 -0.04 -1.10 -1.23 0.00 0.00 174.94 173.12 3hi7 s GLN 204 N -0.69 0.51 -0.06 2.79 -0.21 -0.20 -1.12 119.66 120.69 3hi7 s GLN 204 Ca 0.40 -0.96 -0.29 0.00 0.02 0.00 0.00 55.36 54.53 3hi7 s GLN 204 Cb -0.23 0.09 -0.02 0.00 1.00 0.00 0.00 33.01 33.84 3hi7 s GLN 204 CO 0.28 -0.06 0.96 1.03 -2.12 0.00 0.00 175.29 175.37 3hi7 s ARG 205 N -2.77 4.48 -1.07 2.91 0.52 -0.38 -0.41 118.95 122.23 3hi7 s ARG 205 Ca -0.03 1.35 -0.21 0.00 -0.52 0.00 0.00 55.73 56.32 3hi7 s ARG 205 Cb -0.01 -3.50 0.06 0.00 0.52 0.00 0.00 34.95 32.03 3hi7 s ARG 205 CO -0.05 -0.16 1.47 -0.47 0.02 0.00 0.00 175.30 176.11 3hi7 s TYR 206 N 1.46 2.65 0.40 -0.53 5.04 -0.16 -4.60 117.35 121.62 3hi7 s TYR 206 Ca 0.49 -1.07 0.04 0.00 -2.44 0.00 0.00 57.07 54.09 3hi7 s TYR 206 Cb -0.19 -4.66 -0.03 0.00 0.35 0.00 0.00 41.96 37.43 3hi7 s TYR 206 CO 0.22 -1.86 0.12 0.14 -1.34 0.00 0.00 175.55 172.83 3hi7 s VAL 207 N 4.55 0.67 0.04 3.14 -7.23 -1.26 -4.62 120.40 115.68 3hi7 s VAL 207 Ca 0.46 -2.00 -0.34 0.00 -1.81 0.00 0.00 61.98 58.29 3hi7 s VAL 207 Cb 0.00 -2.39 -0.12 0.00 0.56 0.00 0.00 36.38 34.43 3hi7 s VAL 207 CO -0.06 0.00 1.76 1.21 -0.31 0.00 0.00 175.10 177.69 3hi7 n GLU 208 N -0.89 2.24 -3.27 4.82 2.13 -1.26 -1.04 120.64 123.36 3hi7 n GLU 208 Ca -0.06 0.82 -0.17 0.00 0.66 0.00 0.00 57.16 58.41 3hi7 n GLU 208 Cb 0.65 -2.64 0.06 0.00 0.27 0.00 0.00 31.44 29.78 3hi7 n GLU 208 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3hi7 n GLY 209 N 3.99 -0.13 0.43 8.31 0.00 -1.26 -4.59 105.19 111.94 3hi7 n GLY 209 Ca 0.20 -0.01 0.23 0.00 0.00 0.00 0.00 46.02 46.45 3hi7 n GLY 209 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3hi7 h TYR 210 N -1.90 0.00 -0.71 1.61 -0.00 -1.34 -1.87 116.97 112.76 3hi7 h TYR 210 Ca -0.41 0.00 0.20 0.00 0.00 0.00 0.00 58.73 58.52 3hi7 h TYR 210 Cb 1.27 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.97 3hi7 h TYR 210 CO 0.36 0.00 0.60 0.74 -0.00 0.00 0.00 178.16 179.86 3hi7 h PHE 211 N 0.00 0.00 -0.51 0.10 -1.00 -1.88 -1.28 116.94 112.37 3hi7 h PHE 211 Ca 0.29 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.07 3hi7 h PHE 211 Cb 1.63 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.19 3hi7 h PHE 211 CO 0.00 0.00 0.00 1.28 -1.61 0.00 0.00 178.31 177.98 3hi7 n LEU 212 N -3.96 5.01 -2.80 1.54 4.77 -0.70 -4.53 117.00 116.32 3hi7 n LEU 212 Ca 0.14 -2.82 -0.24 0.00 -0.03 0.00 0.00 56.01 53.05 3hi7 n LEU 212 Cb 0.86 -0.61 -0.02 0.00 -2.33 0.00 0.00 43.42 41.32 3hi7 n LEU 212 CO 0.33 0.68 0.10 1.41 -1.33 0.00 0.00 177.39 178.58 3hi7 n HIS 213 N 0.45 3.16 -2.00 -1.77 8.25 -0.48 -4.91 115.22 117.91 3hi7 n HIS 213 Ca 0.25 -3.60 -0.39 0.00 -0.26 0.00 0.00 57.72 53.72 3hi7 n HIS 213 Cb 1.04 -0.34 0.01 0.00 1.12 0.00 0.00 29.99 31.81 3hi7 n HIS 213 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3hi7 s PRO 214 N -3.34 3.71 0.14 -0.41 0.04 -1.26 -1.24 135.00 132.63 3hi7 s PRO 214 Ca 0.46 2.13 0.23 0.00 0.04 0.00 0.00 61.00 63.86 3hi7 s PRO 214 Cb 0.34 -2.56 0.10 0.00 0.04 0.00 0.00 34.50 32.42 3hi7 s PRO 214 CO -0.13 -0.70 1.10 0.25 0.04 0.00 0.00 177.00 177.56 3hi7 n THR 215 N -0.29 0.42 0.00 1.26 -2.24 -0.28 -4.86 114.28 108.29 3hi7 n THR 215 Ca 0.06 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 3hi7 n THR 215 Cb 0.45 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 3hi7 n THR 215 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hi7 n GLY 216 N 1.27 0.51 3.82 3.38 0.00 -1.26 -4.97 105.19 107.94 3hi7 n GLY 216 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 3hi7 n GLY 216 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hi7 s LEU 217 N 0.00 4.40 0.01 0.99 2.96 -1.26 -1.56 118.68 124.22 3hi7 s LEU 217 Ca 0.00 0.78 0.02 0.00 -0.22 0.00 0.00 54.13 54.71 3hi7 s LEU 217 Cb 0.00 -2.46 -0.01 0.00 0.50 0.00 0.00 46.19 44.22 3hi7 s LEU 217 CO 0.00 0.28 -0.08 -1.61 -1.32 0.00 0.00 176.35 173.62 3hi7 s GLU 218 N -0.66 0.60 -0.01 1.98 2.02 0.46 -1.85 118.70 121.23 3hi7 s GLU 218 Ca 0.21 -0.43 0.04 0.00 0.02 0.00 0.00 54.97 54.81 3hi7 s GLU 218 Cb -0.15 -0.53 -0.01 0.00 0.10 0.00 0.00 34.13 33.54 3hi7 s GLU 218 CO 0.10 0.14 -0.13 -0.51 0.02 0.00 0.00 175.26 174.87 3hi7 s LEU 219 N -0.61 2.00 -0.26 1.80 1.43 -0.33 -0.77 118.68 121.93 3hi7 s LEU 219 Ca -0.00 -0.24 -0.09 0.00 -1.03 0.00 0.00 54.13 52.76 3hi7 s LEU 219 Cb -0.05 -0.69 -0.04 0.00 0.03 0.00 0.00 46.19 45.44 3hi7 s LEU 219 CO 0.00 0.16 0.12 -0.22 0.23 0.00 0.00 176.35 176.64 3hi7 s LEU 220 N -0.25 3.72 -0.13 1.79 2.96 -0.40 0.05 118.68 126.42 3hi7 s LEU 220 Ca 0.04 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.85 3hi7 s LEU 220 Cb -0.06 -2.02 -0.01 0.00 0.50 0.00 0.00 46.19 44.61 3hi7 s LEU 220 CO -0.00 -0.03 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.14 3hi7 s VAL 221 N 1.64 2.66 -0.43 1.68 1.01 -0.49 -0.32 120.40 126.15 3hi7 s VAL 221 Ca 0.07 -0.79 -0.22 0.00 0.00 0.00 0.00 61.98 61.03 3hi7 s VAL 221 Cb -0.15 -2.10 0.02 0.00 0.00 0.00 0.00 36.38 34.15 3hi7 s VAL 221 CO 0.07 0.53 0.73 -0.62 0.00 0.00 0.00 175.10 175.81 3hi7 s ASP 222 N 0.50 6.41 -0.26 3.32 -1.08 -0.28 -0.81 116.67 124.47 3hi7 s ASP 222 Ca -0.11 -0.08 0.09 0.00 -0.52 0.00 0.00 52.55 51.93 3hi7 s ASP 222 Cb -0.16 -2.36 0.45 0.00 -1.46 0.00 0.00 42.92 39.39 3hi7 s ASP 222 CO 0.05 -0.82 1.19 0.00 0.52 0.00 0.00 175.17 176.11 3hi7 n HIS 223 N 6.49 1.92 0.04 -5.34 1.44 -0.41 -2.80 115.22 116.56 3hi7 n HIS 223 Ca 0.01 -2.00 -0.13 0.00 -2.01 0.00 0.00 57.72 53.59 3hi7 n HIS 223 Cb 0.48 -0.31 -0.02 0.00 0.12 0.00 0.00 29.99 30.27 3hi7 n HIS 223 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 3hi7 h GLY 224 N 1.87 0.55 -3.15 -1.39 0.00 -1.91 -3.46 103.07 95.59 3hi7 h GLY 224 Ca 0.24 -0.84 -0.53 0.00 0.00 0.00 0.00 47.33 46.20 3hi7 h GLY 224 CO 0.53 0.74 0.60 -0.45 0.00 0.00 0.00 176.54 177.96 3hi7 s SER 225 N -7.05 5.98 0.10 0.19 0.15 -1.26 -4.90 113.70 106.92 3hi7 s SER 225 Ca -0.07 2.66 0.18 0.00 0.70 0.00 0.00 55.95 59.42 3hi7 s SER 225 Cb 0.09 -2.63 0.77 0.00 -1.71 0.00 0.00 66.02 62.54 3hi7 s SER 225 CO 0.86 -1.07 1.57 0.35 1.20 0.00 0.00 173.24 176.15 3hi7 n THR 226 N -0.29 0.91 -3.37 6.45 -2.24 -1.26 -4.34 114.28 110.14 3hi7 n THR 226 Ca 0.06 0.23 -0.44 0.00 -2.27 0.00 0.00 64.05 61.63 3hi7 n THR 226 Cb 0.44 -1.04 -0.07 0.00 -2.10 0.00 0.00 70.33 67.56 3hi7 n THR 226 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hi7 s ASP 227 N -3.48 6.16 0.44 3.42 -1.08 -1.26 -3.57 116.67 117.30 3hi7 s ASP 227 Ca 0.06 -1.33 0.30 0.00 -0.52 0.00 0.00 52.55 51.06 3hi7 s ASP 227 Cb 0.10 -2.19 1.51 0.00 -1.46 0.00 0.00 42.92 40.87 3hi7 s ASP 227 CO 0.32 -0.68 1.92 0.00 0.52 0.00 0.00 175.17 177.26 3hi7 h ALA 228 N 8.78 1.00 0.00 3.66 0.00 -1.99 -0.00 119.26 130.71 3hi7 h ALA 228 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3hi7 h ALA 228 Cb 1.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3hi7 h ALA 228 CO 0.89 0.00 0.00 0.78 0.00 0.00 0.00 179.25 180.92 3hi7 h GLY 229 N 0.85 0.00 1.61 0.00 0.00 -1.94 -2.21 103.07 101.39 3hi7 h GLY 229 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hi7 h GLY 229 CO 0.00 0.00 -0.29 0.45 0.00 0.00 0.00 176.54 176.70 3hi7 h HIS 230 N 0.00 0.00 -3.94 5.60 3.86 -1.37 -3.47 115.15 115.82 3hi7 h HIS 230 Ca 0.00 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.69 3hi7 h HIS 230 Cb 0.21 0.00 0.08 0.00 1.06 0.00 0.00 27.41 28.76 3hi7 h HIS 230 CO 0.00 0.00 0.60 -1.58 0.86 0.00 0.00 177.93 177.81 3hi7 s TRP 231 N -3.14 2.86 -0.00 2.45 0.51 -0.83 -5.00 118.94 115.79 3hi7 s TRP 231 Ca 0.08 1.43 -0.03 0.00 -2.12 0.00 0.00 56.10 55.46 3hi7 s TRP 231 Cb 0.13 -3.64 -0.00 0.00 -0.81 0.00 0.00 33.47 29.14 3hi7 s TRP 231 CO 0.66 -1.99 0.06 0.00 -0.51 0.00 0.00 176.95 175.17 3hi7 s ALA 232 N -1.27 -0.13 -0.32 0.98 0.00 -1.12 -4.99 121.76 114.91 3hi7 s ALA 232 Ca 0.56 -0.17 -0.29 0.00 0.00 0.00 0.00 51.96 52.06 3hi7 s ALA 232 Cb -0.37 0.04 0.01 0.00 0.00 0.00 0.00 23.12 22.80 3hi7 s ALA 232 CO 0.48 -0.13 1.24 0.08 0.00 0.00 0.00 175.76 177.43 3hi7 s VAL 233 N -0.92 4.22 -0.53 0.00 1.01 -1.26 -1.13 120.40 121.79 3hi7 s VAL 233 Ca -0.10 1.37 0.22 0.00 0.00 0.00 0.00 61.98 63.47 3hi7 s VAL 233 Cb -0.06 -4.24 -0.26 0.00 0.00 0.00 0.00 36.38 31.82 3hi7 s VAL 233 CO 0.00 -0.52 0.74 -1.84 0.00 0.00 0.00 175.10 173.49 3hi7 n GLU 234 N 7.27 0.33 -3.54 2.72 0.28 0.57 -4.92 120.64 123.34 3hi7 n GLU 234 Ca 0.14 -0.08 -0.17 0.00 -0.16 0.00 0.00 57.16 56.88 3hi7 n GLU 234 Cb 0.47 -1.52 -0.06 0.00 1.43 0.00 0.00 31.44 31.75 3hi7 n GLU 234 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 177.13 175.83 3hi7 s GLN 235 N -3.25 1.02 -0.04 3.44 2.00 -1.22 -4.82 119.66 116.78 3hi7 s GLN 235 Ca 0.01 0.34 0.02 0.00 -2.00 0.00 0.00 55.36 53.73 3hi7 s GLN 235 Cb 0.15 0.48 0.01 0.00 0.80 0.00 0.00 33.01 34.45 3hi7 s GLN 235 CO 0.88 -0.30 -0.08 0.08 -0.50 0.00 0.00 175.29 175.36 3hi7 s VAL 236 N -1.00 0.79 -0.09 1.34 1.01 -1.26 -1.28 120.40 119.91 3hi7 s VAL 236 Ca -0.10 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 61.61 3hi7 s VAL 236 Cb -0.01 -0.74 -0.00 0.00 0.00 0.00 0.00 36.38 35.63 3hi7 s VAL 236 CO 0.09 0.27 -0.24 0.86 0.00 0.00 0.00 175.10 176.07 3hi7 s TRP 237 N 0.53 2.52 -0.05 5.22 -0.00 0.05 -0.55 118.94 126.66 3hi7 s TRP 237 Ca -0.09 -1.00 -0.01 0.00 -0.00 0.00 0.00 56.10 55.00 3hi7 s TRP 237 Cb -0.12 -1.68 0.03 0.00 -0.00 0.00 0.00 33.47 31.69 3hi7 s TRP 237 CO 0.01 -0.40 0.03 -0.47 -0.00 0.00 0.00 176.95 176.13 3hi7 s TYR 238 N 0.29 0.27 -1.47 5.86 5.04 0.10 -0.41 117.35 127.04 3hi7 s TYR 238 Ca -0.17 0.09 -0.04 0.00 -2.44 0.00 0.00 57.07 54.51 3hi7 s TYR 238 Cb -0.17 -0.55 0.00 0.00 0.35 0.00 0.00 41.96 41.59 3hi7 s TYR 238 CO 0.08 -0.21 0.18 -1.71 -1.34 0.00 0.00 175.55 172.55 3hi7 n ASN 239 N 5.00 0.02 0.00 4.32 5.15 -0.60 -2.00 115.26 127.15 3hi7 n ASN 239 Ca -0.09 -1.21 0.00 0.00 -0.60 0.00 0.00 54.58 52.67 3hi7 n ASN 239 Cb 0.50 -1.99 0.00 0.00 -0.53 0.00 0.00 39.78 37.76 3hi7 n ASN 239 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3hi7 n GLY 240 N -2.38 0.58 3.10 8.20 0.00 -1.26 -4.98 105.19 108.45 3hi7 n GLY 240 Ca -0.30 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.55 3hi7 n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hi7 s LYS 241 N -0.82 0.71 0.09 1.61 -0.14 -0.85 -5.14 119.74 115.20 3hi7 s LYS 241 Ca 0.00 -0.71 -0.20 0.00 -1.36 0.00 0.00 55.97 53.70 3hi7 s LYS 241 Cb 0.00 -0.64 -0.07 0.00 -1.68 0.00 0.00 37.83 35.44 3hi7 s LYS 241 CO 0.00 0.15 0.60 -0.06 -0.76 0.00 0.00 175.35 175.28 3hi7 s PHE 242 N -0.98 3.82 0.00 3.18 0.08 -1.26 -0.72 117.98 122.10 3hi7 s PHE 242 Ca -0.03 1.32 0.00 0.00 0.12 0.00 0.00 56.93 58.35 3hi7 s PHE 242 Cb -0.08 -2.53 0.00 0.00 -0.57 0.00 0.00 43.02 39.84 3hi7 s PHE 242 CO 0.01 0.57 0.43 0.66 -0.10 0.00 0.00 175.22 176.79 3hi7 n TYR 243 N 1.67 0.00 0.00 0.36 4.01 0.28 -4.98 117.16 118.50 3hi7 n TYR 243 Ca -0.09 -0.03 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 3hi7 n TYR 243 Cb 0.50 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.53 3hi7 n TYR 243 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hi7 n GLY 244 N -0.03 1.68 3.32 2.72 0.00 -1.25 -4.27 105.19 107.36 3hi7 n GLY 244 Ca 0.00 -0.10 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 3hi7 n GLY 244 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hi7 s SER 245 N 0.00 -0.17 0.25 1.61 1.04 -1.26 -3.84 113.70 111.34 3hi7 s SER 245 Ca 0.00 -0.41 -0.05 0.00 0.48 0.00 0.00 55.95 55.97 3hi7 s SER 245 Cb 0.00 0.46 0.34 0.00 0.10 0.00 0.00 66.02 66.92 3hi7 s SER 245 CO 0.00 -0.85 1.88 -0.65 0.98 0.00 0.00 173.24 174.59 3hi7 h PRO 246 N 2.42 1.08 -0.77 4.02 0.11 -1.87 -1.96 132.00 135.03 3hi7 h PRO 246 Ca -0.33 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 65.76 3hi7 h PRO 246 Cb 1.25 -0.24 -0.05 0.00 0.11 0.00 0.00 31.00 32.06 3hi7 h PRO 246 CO 0.48 0.71 0.47 0.93 -0.21 0.00 0.00 178.00 180.38 3hi7 h GLU 247 N 1.11 0.85 -0.34 1.05 3.07 -1.94 -0.87 114.58 117.52 3hi7 h GLU 247 Ca 0.39 -0.05 -0.08 0.00 -0.50 0.00 0.00 59.36 59.12 3hi7 h GLU 247 Cb 0.11 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 27.82 3hi7 h GLU 247 CO -0.15 0.56 -0.08 1.49 -1.40 0.00 0.00 179.01 179.43 3hi7 h GLU 248 N 0.88 0.65 -0.73 2.33 4.81 -1.66 -0.80 114.58 120.07 3hi7 h GLU 248 Ca 0.33 -0.25 0.01 0.00 -0.13 0.00 0.00 59.36 59.31 3hi7 h GLU 248 Cb 0.12 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 3hi7 h GLU 248 CO -0.15 0.83 0.48 1.25 -0.73 0.00 0.00 179.01 180.68 3hi7 h LEU 249 N 0.44 0.83 -0.67 1.64 5.85 -1.19 0.04 115.31 122.25 3hi7 h LEU 249 Ca 0.09 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 3hi7 h LEU 249 Cb 0.59 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 3hi7 h LEU 249 CO 0.03 0.60 0.26 0.00 -0.34 0.00 0.00 178.44 179.00 3hi7 h ALA 250 N 1.27 0.86 -0.14 1.25 0.00 -0.93 0.43 119.26 122.00 3hi7 h ALA 250 Ca 0.27 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3hi7 h ALA 250 Cb -0.11 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 3hi7 h ALA 250 CO -0.06 0.49 -0.04 0.07 0.00 0.00 0.00 179.25 179.71 3hi7 h ARG 251 N 0.94 0.27 -0.82 0.00 -0.00 -0.87 -0.89 114.38 113.02 3hi7 h ARG 251 Ca 0.22 -0.11 0.00 0.00 -0.00 0.00 0.00 59.98 60.10 3hi7 h ARG 251 Cb 0.21 -0.01 -0.04 0.00 -0.00 0.00 0.00 29.97 30.13 3hi7 h ARG 251 CO -0.02 0.57 0.52 0.87 -0.00 0.00 0.00 179.97 181.92 3hi7 h LYS 252 N -0.04 1.09 0.19 0.08 1.57 -0.82 -1.21 116.57 117.43 3hi7 h LYS 252 Ca 0.03 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 3hi7 h LYS 252 Cb 0.47 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3hi7 h LYS 252 CO 0.02 0.73 -0.09 -0.92 -0.57 0.00 0.00 179.45 178.62 3hi7 h TYR 253 N 1.11 -0.23 -0.66 -1.35 3.20 -0.75 0.18 116.97 118.48 3hi7 h TYR 253 Ca 0.30 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.24 3hi7 h TYR 253 Cb -0.10 0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.20 3hi7 h TYR 253 CO 0.00 -0.14 0.44 0.00 -1.64 0.00 0.00 178.16 176.82 3hi7 h ALA 254 N 0.56 1.84 -0.01 1.82 0.00 -0.81 -1.99 119.26 120.67 3hi7 h ALA 254 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hi7 h ALA 254 Cb 0.19 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3hi7 h ALA 254 CO 0.04 0.03 -0.00 -0.25 0.00 0.00 0.00 179.25 179.07 3hi7 n ASP 255 N -4.48 0.95 -0.34 0.00 8.00 -0.49 -4.92 116.55 115.27 3hi7 n ASP 255 Ca 0.10 -1.31 -0.02 0.00 0.71 0.00 0.00 54.79 54.27 3hi7 n ASP 255 Cb 0.29 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.39 3hi7 n ASP 255 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hi7 n GLY 256 N 1.11 0.36 0.94 0.44 0.00 -0.75 -4.96 105.19 102.34 3hi7 n GLY 256 Ca 0.21 -0.76 -0.00 0.00 0.00 0.00 0.00 46.02 45.46 3hi7 n GLY 256 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hi7 n GLU 257 N -1.17 1.79 -4.47 1.61 1.02 0.59 -4.97 120.64 115.04 3hi7 n GLU 257 Ca -0.02 -3.18 -0.23 0.00 -0.02 0.00 0.00 57.16 53.70 3hi7 n GLU 257 Cb 0.52 -1.75 -0.16 0.00 -0.02 0.00 0.00 31.44 30.02 3hi7 n GLU 257 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3hi7 s VAL 258 N -3.21 0.97 -0.76 2.62 1.01 -1.25 -4.80 120.40 114.97 3hi7 s VAL 258 Ca 0.42 -0.38 -0.26 0.00 0.00 0.00 0.00 61.98 61.76 3hi7 s VAL 258 Cb 0.39 -0.90 0.02 0.00 0.00 0.00 0.00 36.38 35.89 3hi7 s VAL 258 CO -0.02 0.32 1.42 -0.62 0.00 0.00 0.00 175.10 176.20 3hi7 s ASP 259 N 0.73 6.03 0.05 3.32 2.15 -1.26 -4.99 116.67 122.70 3hi7 s ASP 259 Ca -0.14 -0.47 -0.15 0.00 0.43 0.00 0.00 52.55 52.22 3hi7 s ASP 259 Cb -0.15 -2.56 -0.06 0.00 -0.30 0.00 0.00 42.92 39.85 3hi7 s ASP 259 CO 0.03 -1.91 0.46 -0.69 -0.17 0.00 0.00 175.17 172.89 3hi7 s VAL 260 N 6.30 4.95 -0.30 1.11 1.01 -1.26 -4.88 120.40 127.34 3hi7 s VAL 260 Ca 0.43 0.87 -0.04 0.00 0.00 0.00 0.00 61.98 63.23 3hi7 s VAL 260 Cb -0.08 -3.75 0.03 0.00 0.00 0.00 0.00 36.38 32.59 3hi7 s VAL 260 CO 0.12 0.49 0.03 -0.69 0.00 0.00 0.00 175.10 175.05 3hi7 s VAL 261 N -1.18 3.41 -0.27 2.92 1.01 -1.26 -5.08 120.40 119.95 3hi7 s VAL 261 Ca 0.28 -1.06 -0.25 0.00 0.00 0.00 0.00 61.98 60.94 3hi7 s VAL 261 Cb -0.17 -2.85 0.00 0.00 0.00 0.00 0.00 36.38 33.37 3hi7 s VAL 261 CO 0.16 -0.01 0.88 -0.69 0.00 0.00 0.00 175.10 175.44 3hi7 s VAL 262 N 1.37 4.76 0.00 2.92 1.01 -1.26 -4.82 120.40 124.37 3hi7 s VAL 262 Ca -0.01 1.52 0.00 0.00 0.00 0.00 0.00 61.98 63.49 3hi7 s VAL 262 Cb -0.18 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.00 3hi7 s VAL 262 CO 0.00 -0.20 0.00 0.18 0.00 0.00 0.00 175.10 175.08 3hi7 n LEU 263 N 6.23 0.00 -3.46 3.92 4.77 0.27 -5.04 117.00 123.70 3hi7 n LEU 263 Ca 0.07 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.94 3hi7 n LEU 263 Cb 0.47 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.47 3hi7 n LEU 263 CO 0.51 0.00 -0.06 -0.70 -1.33 0.00 0.00 177.39 175.80 3hi7 s GLU 278 N 0.00 0.31 0.94 3.23 2.12 -1.26 -4.90 118.70 119.14 3hi7 s GLU 278 Ca 0.00 0.62 -0.11 0.00 0.36 0.00 0.00 54.97 55.84 3hi7 s GLU 278 Cb 0.00 -0.35 0.16 0.00 0.26 0.00 0.00 34.13 34.20 3hi7 s GLU 278 CO 0.00 -0.53 1.09 -1.25 -0.54 0.00 0.00 175.26 174.03 3hi7 s PRO 279 N 2.52 0.87 0.77 4.30 0.04 -1.26 -4.99 135.00 137.27 3hi7 s PRO 279 Ca 0.08 0.98 -0.13 0.00 0.04 0.00 0.00 61.00 61.97 3hi7 s PRO 279 Cb -0.14 -1.75 0.06 0.00 0.04 0.00 0.00 34.50 32.71 3hi7 s PRO 279 CO -0.14 -2.55 1.15 -2.14 0.04 0.00 0.00 177.00 173.36 3hi7 s PRO 280 N -4.79 2.00 0.61 0.56 0.02 -1.26 -4.98 135.00 127.16 3hi7 s PRO 280 Ca 0.65 1.50 -0.19 0.00 0.02 0.00 0.00 61.00 62.98 3hi7 s PRO 280 Cb -0.20 -1.84 -0.02 0.00 0.02 0.00 0.00 34.50 32.45 3hi7 s PRO 280 CO 0.58 -1.88 1.30 -1.17 -0.33 0.00 0.00 177.00 175.50 3hi7 s LEU 281 N -5.65 3.66 0.54 -5.54 2.96 -1.26 -4.89 118.68 108.50 3hi7 s LEU 281 Ca 0.68 2.63 0.23 0.00 -0.22 0.00 0.00 54.13 57.45 3hi7 s LEU 281 Cb -0.23 -4.53 1.48 0.00 0.50 0.00 0.00 46.19 43.42 3hi7 s LEU 281 CO 0.50 -1.84 2.16 2.19 -1.32 0.00 0.00 176.35 178.04 3hi7 h PHE 282 N 0.83 0.00 -0.05 5.38 -5.15 -1.95 -1.66 116.94 114.33 3hi7 h PHE 282 Ca -0.51 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.26 3hi7 h PHE 282 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.49 3hi7 h PHE 282 CO 0.43 0.05 0.00 -1.13 -2.00 0.00 0.00 178.31 175.66 3hi7 n SER 283 N -4.09 0.73 -4.89 -0.68 3.41 -1.26 -4.01 113.62 102.83 3hi7 n SER 283 Ca -0.03 -1.44 -0.31 0.00 -0.26 0.00 0.00 58.87 56.83 3hi7 n SER 283 Cb 0.13 -0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 64.01 3hi7 n SER 283 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3hi7 s SER 284 N -1.71 6.55 0.00 4.04 0.15 -0.63 -4.28 113.70 117.82 3hi7 s SER 284 Ca 0.34 0.85 0.29 0.00 0.70 0.00 0.00 55.95 58.14 3hi7 s SER 284 Cb 0.17 -2.20 1.29 0.00 -1.71 0.00 0.00 66.02 63.57 3hi7 s SER 284 CO 0.27 -0.14 1.89 1.41 1.20 0.00 0.00 173.24 177.88 3hi7 n HIS 285 N -0.51 0.00 -1.79 3.44 8.25 -1.26 -4.68 115.22 118.67 3hi7 n HIS 285 Ca -0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 3hi7 n HIS 285 Cb 0.53 -0.17 -0.01 0.00 1.12 0.00 0.00 29.99 31.46 3hi7 n HIS 285 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3hi7 s LYS 286 N -2.42 4.12 0.47 -0.41 1.02 -1.26 -4.90 119.74 116.35 3hi7 s LYS 286 Ca 0.31 2.58 -0.25 0.00 0.02 0.00 0.00 55.97 58.63 3hi7 s LYS 286 Cb 0.20 -3.00 -0.08 0.00 -0.52 0.00 0.00 37.83 34.43 3hi7 s LYS 286 CO 0.46 -0.59 1.41 -2.30 -0.92 0.00 0.00 175.35 173.41 3hi7 n PRO 287 N 1.46 2.13 -3.80 -1.68 -0.02 -1.26 -4.91 135.00 126.92 3hi7 n PRO 287 Ca 0.05 0.76 -0.09 0.00 -2.02 0.00 0.00 63.50 62.20 3hi7 n PRO 287 Cb 0.38 -2.61 -0.04 0.00 -0.02 0.00 0.00 33.50 31.22 3hi7 n PRO 287 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 3hi7 s ARG 288 N -2.52 1.44 0.00 -0.52 3.03 -1.26 -4.87 118.95 114.26 3hi7 s ARG 288 Ca 0.63 -0.94 0.00 0.00 2.03 0.00 0.00 55.73 57.45 3hi7 s ARG 288 Cb -0.45 0.52 0.00 0.00 -1.03 0.00 0.00 34.95 33.99 3hi7 s ARG 288 CO 0.56 -0.62 0.00 0.41 -1.13 0.00 0.00 175.30 174.52 3hi7 n GLY 289 N -0.36 -1.58 2.82 3.88 0.00 -1.26 -5.00 105.19 103.70 3hi7 n GLY 289 Ca -0.08 -1.54 -0.17 0.00 0.00 0.00 0.00 46.02 44.23 3hi7 n GLY 289 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hi7 s ASP 290 N -3.79 0.39 0.64 1.61 1.01 -1.26 -5.14 116.67 110.14 3hi7 s ASP 290 Ca 0.00 -0.03 -0.16 0.00 0.71 0.00 0.00 52.55 53.08 3hi7 s ASP 290 Cb 0.00 -0.21 -0.01 0.00 1.01 0.00 0.00 42.92 43.71 3hi7 s ASP 290 CO 0.00 -0.09 1.12 -0.36 0.21 0.00 0.00 175.17 176.05 3hi7 s PHE 291 N 0.95 2.61 0.45 4.23 0.08 -1.26 -4.94 117.98 120.10 3hi7 s PHE 291 Ca -0.10 1.55 0.18 0.00 0.12 0.00 0.00 56.93 58.69 3hi7 s PHE 291 Cb -0.13 -3.21 1.16 0.00 -0.57 0.00 0.00 43.02 40.27 3hi7 s PHE 291 CO -0.02 -1.71 2.03 -1.35 -0.10 0.00 0.00 175.22 174.07 3hi7 h PRO 292 N 0.24 0.00 -2.83 0.24 0.11 -2.07 -3.27 132.00 124.43 3hi7 h PRO 292 Ca -0.47 0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.02 3hi7 h PRO 292 Cb 1.25 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.95 3hi7 h PRO 292 CO 0.54 0.15 -0.64 0.43 -0.21 0.00 0.00 178.00 178.28 3hi7 n SER 293 N -4.16 2.65 -4.65 -2.05 7.64 -1.26 -5.11 113.62 106.68 3hi7 n SER 293 Ca -0.02 -3.14 -0.39 0.00 1.01 0.00 0.00 58.87 56.33 3hi7 n SER 293 Cb 0.23 -0.72 0.04 0.00 -1.01 0.00 0.00 64.21 62.75 3hi7 n SER 293 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3hi7 n PRO 294 N 1.87 1.22 -4.69 1.43 -0.02 -1.23 -5.01 135.00 128.57 3hi7 n PRO 294 Ca 0.23 0.46 -0.33 0.00 -2.02 0.00 0.00 63.50 61.84 3hi7 n PRO 294 Cb 0.38 -2.26 -0.16 0.00 -0.02 0.00 0.00 33.50 31.44 3hi7 n PRO 294 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3hi7 s ILE 295 N -1.40 2.25 -0.42 4.25 1.01 -1.26 -5.00 121.20 120.63 3hi7 s ILE 295 Ca 0.72 -0.92 0.04 0.00 0.00 0.00 0.00 60.65 60.49 3hi7 s ILE 295 Cb -0.44 -1.91 0.04 0.00 0.01 0.00 0.00 42.46 40.16 3hi7 s ILE 295 CO 0.50 0.54 0.70 1.41 0.00 0.00 0.00 174.94 178.08 3hi7 n HIS 296 N 4.00 0.03 -4.38 3.97 8.25 -1.26 -5.03 115.22 120.79 3hi7 n HIS 296 Ca -0.20 -0.09 -0.20 0.00 -0.26 0.00 0.00 57.72 56.98 3hi7 n HIS 296 Cb 0.52 -0.01 -0.10 0.00 1.12 0.00 0.00 29.99 31.52 3hi7 n HIS 296 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3hi7 s VAL 297 N -0.42 1.74 0.50 1.59 -7.23 -1.26 -5.13 120.40 110.20 3hi7 s VAL 297 Ca 0.05 -2.19 -0.22 0.00 -1.81 0.00 0.00 61.98 57.81 3hi7 s VAL 297 Cb 0.03 -2.19 -0.06 0.00 0.56 0.00 0.00 36.38 34.72 3hi7 s VAL 297 CO 0.05 -0.49 1.20 -0.44 -0.31 0.00 0.00 175.10 175.11 3hi7 s SER 298 N -3.37 5.82 0.86 4.85 0.01 -1.26 -5.05 113.70 115.57 3hi7 s SER 298 Ca 0.25 2.38 -0.10 0.00 1.31 0.00 0.00 55.95 59.79 3hi7 s SER 298 Cb 0.00 -2.60 0.16 0.00 0.21 0.00 0.00 66.02 63.79 3hi7 s SER 298 CO 0.09 -1.16 1.18 -0.83 0.41 0.00 0.00 173.24 172.93 3hi7 s GLY 299 N -1.38 1.76 0.64 3.44 0.00 -1.26 -5.03 107.32 105.49 3hi7 s GLY 299 Ca 0.68 -1.34 -0.18 0.00 0.00 0.00 0.00 44.72 43.89 3hi7 s GLY 299 CO 0.35 -0.67 1.25 -4.14 0.00 0.00 0.00 173.10 169.90 3hi7 s PRO 300 N -5.58 2.64 0.09 2.90 0.02 -1.26 -5.03 135.00 128.77 3hi7 s PRO 300 Ca 0.70 1.94 0.02 0.00 0.02 0.00 0.00 61.00 63.68 3hi7 s PRO 300 Cb -0.05 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 3hi7 s PRO 300 CO 0.49 -1.50 -0.08 -0.98 -0.33 0.00 0.00 177.00 174.61 3hi7 s ARG 301 N -3.44 0.78 0.42 5.54 1.70 -1.26 -5.15 118.95 117.56 3hi7 s ARG 301 Ca 0.80 -1.19 -0.24 0.00 -0.47 0.00 0.00 55.73 54.64 3hi7 s ARG 301 Cb -0.34 -0.31 -0.08 0.00 -0.57 0.00 0.00 34.95 33.65 3hi7 s ARG 301 CO 0.38 0.02 1.11 -0.51 -1.08 0.00 0.00 175.30 175.22 3hi7 s LEU 302 N -2.63 4.09 0.08 -1.89 1.02 -1.26 -5.08 118.68 113.02 3hi7 s LEU 302 Ca 0.06 2.18 0.06 0.00 0.02 0.00 0.00 54.13 56.46 3hi7 s LEU 302 Cb 0.00 -4.19 -0.03 0.00 0.02 0.00 0.00 46.19 41.99 3hi7 s LEU 302 CO -0.03 -0.69 -0.17 0.68 0.02 0.00 0.00 176.35 176.17 3hi7 s VAL 303 N -1.59 1.37 -0.40 -1.59 -7.23 -1.26 -4.75 120.40 104.95 3hi7 s VAL 303 Ca 0.60 -1.38 0.10 0.00 -1.81 0.00 0.00 61.98 59.49 3hi7 s VAL 303 Cb -0.26 -1.27 0.30 0.00 0.56 0.00 0.00 36.38 35.71 3hi7 s VAL 303 CO 0.32 -0.14 0.63 1.67 -0.31 0.00 0.00 175.10 177.27 3hi7 n GLN 304 N 1.25 0.96 0.29 4.82 7.27 -1.26 -4.97 117.38 125.75 3hi7 n GLN 304 Ca -0.20 -3.39 0.16 0.00 0.07 0.00 0.00 57.00 53.64 3hi7 n GLN 304 Cb 0.54 -1.49 0.91 0.00 2.41 0.00 0.00 30.24 32.61 3hi7 n GLN 304 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 3hi7 h PRO 305 N 3.55 0.00 -0.72 3.69 0.13 -1.92 -2.55 132.00 134.18 3hi7 h PRO 305 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3hi7 h PRO 305 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 3hi7 h PRO 305 CO 0.50 0.04 0.00 0.72 -0.23 0.00 0.00 178.00 179.03 3hi7 n HIS 306 N -3.57 0.96 -0.07 1.56 8.25 -1.26 -5.03 115.22 116.06 3hi7 n HIS 306 Ca -0.02 -0.48 0.01 0.00 -0.26 0.00 0.00 57.72 56.96 3hi7 n HIS 306 Cb 0.14 -0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.25 3hi7 n HIS 306 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hi7 n GLY 307 N 1.66 -1.60 3.77 -1.41 0.00 -0.96 -4.90 105.19 101.74 3hi7 n GLY 307 Ca 0.24 -1.50 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 3hi7 n GLY 307 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hi7 s PRO 308 N -1.51 3.96 0.00 1.61 0.02 -1.26 -4.92 135.00 132.90 3hi7 s PRO 308 Ca 0.00 2.51 0.23 0.00 0.02 0.00 0.00 61.00 63.76 3hi7 s PRO 308 Cb 0.00 -2.86 0.47 0.00 0.02 0.00 0.00 34.50 32.14 3hi7 s PRO 308 CO 0.00 -0.63 1.43 0.54 -0.33 0.00 0.00 177.00 178.00 3hi7 n ARG 309 N 0.23 2.42 -4.11 5.54 1.74 -1.26 -4.87 116.66 116.34 3hi7 n ARG 309 Ca 0.02 -2.14 -0.25 0.00 -0.77 0.00 0.00 57.85 54.71 3hi7 n ARG 309 Cb 0.40 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.29 3hi7 n ARG 309 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 3hi7 s PHE 310 N -1.52 3.09 -0.17 -1.55 -0.12 -1.26 -4.55 117.98 111.91 3hi7 s PHE 310 Ca 0.38 -0.07 -0.04 0.00 -0.05 0.00 0.00 56.93 57.16 3hi7 s PHE 310 Cb 0.22 -1.45 -0.03 0.00 -0.63 0.00 0.00 43.02 41.14 3hi7 s PHE 310 CO 0.31 0.52 -0.03 -0.98 -0.05 0.00 0.00 175.22 174.99 3hi7 s ARG 311 N -3.36 3.63 -0.18 1.99 1.04 0.32 -4.96 118.95 117.44 3hi7 s ARG 311 Ca 0.31 -0.53 -0.00 0.00 -1.04 0.00 0.00 55.73 54.47 3hi7 s ARG 311 Cb -0.09 -2.94 0.00 0.00 -2.04 0.00 0.00 34.95 29.88 3hi7 s ARG 311 CO 0.23 0.17 -0.15 -1.17 -0.04 0.00 0.00 175.30 174.35 3hi7 s LEU 312 N 0.55 2.43 -0.24 -1.89 2.96 -1.26 -0.86 118.68 120.37 3hi7 s LEU 312 Ca -0.03 -0.52 -0.02 0.00 -0.22 0.00 0.00 54.13 53.35 3hi7 s LEU 312 Cb -0.14 -1.57 0.07 0.00 0.50 0.00 0.00 46.19 45.05 3hi7 s LEU 312 CO 0.03 0.03 0.04 -1.61 -1.32 0.00 0.00 176.35 173.52 3hi7 s GLU 313 N 1.13 0.85 7.45 1.98 8.01 -0.43 -5.00 118.70 132.68 3hi7 s GLU 313 Ca 0.01 -0.73 0.00 0.00 0.01 0.00 0.00 54.97 54.25 3hi7 s GLU 313 Cb -0.14 -2.16 0.00 0.00 -4.31 0.00 0.00 34.13 27.52 3hi7 s GLU 313 CO -0.05 -0.74 0.00 0.41 0.01 0.00 0.00 175.26 174.88 3hi7 n GLY 314 N 4.92 3.27 1.18 -1.39 0.00 -1.26 -0.94 105.19 110.97 3hi7 n GLY 314 Ca -0.07 0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.13 3hi7 n GLY 314 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3hi7 n ASN 315 N 9.72 4.42 -4.61 1.61 6.94 -1.26 -4.97 115.26 127.11 3hi7 n ASN 315 Ca 0.00 -3.00 -0.34 0.00 -0.02 0.00 0.00 54.58 51.22 3hi7 n ASN 315 Cb 0.00 -0.59 -0.10 0.00 -2.36 0.00 0.00 39.78 36.73 3hi7 n ASN 315 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hi7 s ALA 316 N -2.82 3.26 -0.05 -2.53 0.00 -0.11 -1.76 121.76 117.75 3hi7 s ALA 316 Ca 0.46 -0.78 0.06 0.00 0.00 0.00 0.00 51.96 51.70 3hi7 s ALA 316 Cb 0.36 -1.69 -0.01 0.00 0.00 0.00 0.00 23.12 21.79 3hi7 s ALA 316 CO 0.11 0.32 -0.22 0.08 0.00 0.00 0.00 175.76 176.04 3hi7 s VAL 317 N -0.02 1.84 -0.07 0.00 1.01 0.79 -1.31 120.40 122.64 3hi7 s VAL 317 Ca 0.04 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.13 3hi7 s VAL 317 Cb -0.13 -1.56 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 3hi7 s VAL 317 CO 0.02 0.52 -0.24 -0.76 0.00 0.00 0.00 175.10 174.63 3hi7 s LEU 318 N -0.11 2.13 -0.27 3.92 1.43 -0.04 -1.67 118.68 124.06 3hi7 s LEU 318 Ca -0.03 -0.50 -0.01 0.00 -1.03 0.00 0.00 54.13 52.57 3hi7 s LEU 318 Cb -0.13 -1.40 0.16 0.00 0.03 0.00 0.00 46.19 44.85 3hi7 s LEU 318 CO 0.03 0.24 0.45 -0.47 0.23 0.00 0.00 176.35 176.83 3hi7 s TYR 319 N -0.11 -1.13 0.00 0.29 5.04 -0.38 -0.52 117.35 120.54 3hi7 s TYR 319 Ca -0.05 0.97 0.00 0.00 -2.44 0.00 0.00 57.07 55.55 3hi7 s TYR 319 Cb -0.14 0.14 0.00 0.00 0.35 0.00 0.00 41.96 42.31 3hi7 s TYR 319 CO 0.04 -0.84 0.00 0.41 -1.34 0.00 0.00 175.55 173.82 3hi7 n GLY 320 N 5.38 3.97 0.14 8.97 0.00 -1.26 -0.19 105.19 122.20 3hi7 n GLY 320 Ca -0.02 0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.32 3hi7 n GLY 320 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3hi7 h GLY 321 N 0.00 0.00 -4.20 -0.02 0.00 -1.95 -3.47 103.07 93.43 3hi7 h GLY 321 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.78 3hi7 h GLY 321 CO 0.00 0.00 -0.02 -0.98 0.00 0.00 0.00 176.54 175.54 3hi7 s TRP 322 N -3.26 3.69 -0.01 5.60 0.52 0.73 -1.02 118.94 125.19 3hi7 s TRP 322 Ca 0.07 1.21 -0.00 0.00 0.02 0.00 0.00 56.10 57.39 3hi7 s TRP 322 Cb 0.10 -2.47 0.02 0.00 -1.15 0.00 0.00 33.47 29.97 3hi7 s TRP 322 CO 0.51 0.46 0.02 -1.54 0.02 0.00 0.00 176.95 176.42 3hi7 s SER 323 N -1.49 0.04 0.23 2.95 1.04 -0.67 -1.25 113.70 114.54 3hi7 s SER 323 Ca 0.36 0.03 -0.18 0.00 0.48 0.00 0.00 55.95 56.64 3hi7 s SER 323 Cb -0.17 -0.03 0.02 0.00 0.10 0.00 0.00 66.02 65.94 3hi7 s SER 323 CO 0.20 -0.07 0.56 0.72 0.98 0.00 0.00 173.24 175.63 3hi7 s PHE 324 N 0.62 -0.05 0.28 5.02 -0.12 -0.67 -0.53 117.98 122.53 3hi7 s PHE 324 Ca -0.05 -0.32 0.10 0.00 -0.05 0.00 0.00 56.93 56.61 3hi7 s PHE 324 Cb -0.07 0.43 -0.05 0.00 -0.63 0.00 0.00 43.02 42.70 3hi7 s PHE 324 CO -0.02 -1.01 -0.05 0.00 -0.05 0.00 0.00 175.22 174.09 3hi7 s ALA 325 N -3.91 3.07 0.07 1.99 0.00 -0.42 -0.15 121.76 122.42 3hi7 s ALA 325 Ca 0.12 -1.75 -0.01 0.00 0.00 0.00 0.00 51.96 50.32 3hi7 s ALA 325 Cb -0.02 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 3hi7 s ALA 325 CO 0.02 0.24 -0.01 -0.59 0.00 0.00 0.00 175.76 175.42 3hi7 s PHE 326 N -2.40 0.59 0.10 0.00 -0.12 -0.72 -0.52 117.98 114.91 3hi7 s PHE 326 Ca 0.32 -1.10 -0.15 0.00 -0.05 0.00 0.00 56.93 55.94 3hi7 s PHE 326 Cb -0.05 -0.41 0.03 0.00 -0.63 0.00 0.00 43.02 41.96 3hi7 s PHE 326 CO 0.19 -0.41 0.36 -0.98 -0.05 0.00 0.00 175.22 174.32 3hi7 s ARG 327 N -3.95 0.99 -0.39 1.99 1.70 -0.82 -4.66 118.95 113.81 3hi7 s ARG 327 Ca 0.11 -0.68 0.03 0.00 -0.47 0.00 0.00 55.73 54.72 3hi7 s ARG 327 Cb 0.08 0.43 0.11 0.00 -0.57 0.00 0.00 34.95 35.00 3hi7 s ARG 327 CO -0.07 -0.36 0.12 -1.17 -1.08 0.00 0.00 175.30 172.73 3hi7 s LEU 328 N -2.64 4.75 -0.21 -1.89 2.96 -1.26 -0.66 118.68 119.74 3hi7 s LEU 328 Ca 0.01 -2.33 -0.29 0.00 -0.22 0.00 0.00 54.13 51.30 3hi7 s LEU 328 Cb 0.02 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 45.05 3hi7 s LEU 328 CO -0.10 -0.37 1.14 -0.60 -1.32 0.00 0.00 176.35 175.10 3hi7 s ARG 329 N 0.67 4.23 0.38 1.98 3.52 -0.67 -4.90 118.95 124.17 3hi7 s ARG 329 Ca 0.12 1.47 0.08 0.00 -0.13 0.00 0.00 55.73 57.27 3hi7 s ARG 329 Cb -0.21 -3.70 0.83 0.00 -1.56 0.00 0.00 34.95 30.31 3hi7 s ARG 329 CO -0.06 -0.68 1.96 0.77 -0.81 0.00 0.00 175.30 176.47 3hi7 h SER 330 N 7.83 0.58 -0.04 -2.12 0.02 -1.87 0.17 113.55 118.12 3hi7 h SER 330 Ca -0.22 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.66 3hi7 h SER 330 Cb 1.08 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.51 3hi7 h SER 330 CO 0.98 0.36 -0.27 0.77 -1.14 0.00 0.00 176.83 177.52 3hi7 h SER 331 N 0.65 0.31 -0.00 3.07 4.64 -1.90 -1.23 113.55 119.08 3hi7 h SER 331 Ca 0.31 -0.69 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3hi7 h SER 331 Cb 0.38 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3hi7 h SER 331 CO -0.11 0.95 -0.05 -1.54 -0.87 0.00 0.00 176.83 175.22 3hi7 n SER 332 N -4.48 0.05 0.00 4.97 3.41 -0.95 -2.55 113.62 114.07 3hi7 n SER 332 Ca -0.09 -0.53 0.00 0.00 -0.26 0.00 0.00 58.87 58.00 3hi7 n SER 332 Cb 0.49 0.99 0.00 0.00 -0.26 0.00 0.00 64.21 65.43 3hi7 n SER 332 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hi7 n GLY 333 N 1.02 -1.31 3.77 5.00 0.00 0.57 -4.41 105.19 109.83 3hi7 n GLY 333 Ca 0.00 -2.09 -0.38 0.00 0.00 0.00 0.00 46.02 43.55 3hi7 n GLY 333 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hi7 s LEU 334 N 0.00 4.21 0.00 0.99 2.96 -1.26 -1.67 118.68 123.92 3hi7 s LEU 334 Ca 0.00 2.37 -0.02 0.00 -0.22 0.00 0.00 54.13 56.27 3hi7 s LEU 334 Cb 0.00 -3.99 -0.01 0.00 0.50 0.00 0.00 46.19 42.69 3hi7 s LEU 334 CO 0.00 -0.66 0.02 -1.10 -1.32 0.00 0.00 176.35 173.29 3hi7 s GLN 335 N -2.25 0.22 -0.00 1.98 -0.21 0.17 -2.01 119.66 117.56 3hi7 s GLN 335 Ca 0.56 -0.30 0.08 0.00 0.02 0.00 0.00 55.36 55.72 3hi7 s GLN 335 Cb -0.31 0.08 -0.02 0.00 1.00 0.00 0.00 33.01 33.76 3hi7 s GLN 335 CO 0.40 -0.04 -0.23 0.14 -2.12 0.00 0.00 175.29 173.43 3hi7 s VAL 336 N -0.82 2.32 0.05 1.09 -7.23 -0.23 -1.95 120.40 113.63 3hi7 s VAL 336 Ca -0.09 -1.13 0.02 0.00 -1.81 0.00 0.00 61.98 58.97 3hi7 s VAL 336 Cb -0.06 -1.86 -0.03 0.00 0.56 0.00 0.00 36.38 34.99 3hi7 s VAL 336 CO -0.00 0.50 -0.08 -0.76 -0.31 0.00 0.00 175.10 174.45 3hi7 s LEU 337 N -0.88 2.30 -1.39 1.32 1.43 0.32 -0.30 118.68 121.47 3hi7 s LEU 337 Ca 0.11 -0.63 -0.05 0.00 -1.03 0.00 0.00 54.13 52.53 3hi7 s LEU 337 Cb -0.10 -0.14 0.03 0.00 0.03 0.00 0.00 46.19 46.01 3hi7 s LEU 337 CO 0.01 -0.25 0.81 -3.20 0.23 0.00 0.00 176.35 173.95 3hi7 n ASN 338 N 1.20 -2.60 -4.67 2.29 5.15 0.15 -1.30 115.26 115.49 3hi7 n ASN 338 Ca -0.21 -0.80 -0.43 0.00 -0.60 0.00 0.00 54.58 52.54 3hi7 n ASN 338 Cb 0.56 -4.01 -0.02 0.00 -0.53 0.00 0.00 39.78 35.77 3hi7 n ASN 338 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hi7 s VAL 339 N -3.53 4.44 0.12 3.44 1.01 0.53 -4.40 120.40 122.01 3hi7 s VAL 339 Ca 0.26 1.74 0.11 0.00 0.00 0.00 0.00 61.98 64.08 3hi7 s VAL 339 Cb -0.13 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 3hi7 s VAL 339 CO 0.82 -0.10 -0.26 -1.00 0.00 0.00 0.00 175.10 174.55 3hi7 s HIS 340 N 2.98 2.26 -0.03 5.22 3.76 0.31 -0.40 115.29 129.40 3hi7 s HIS 340 Ca 0.51 -0.39 0.01 0.00 -0.15 0.00 0.00 55.06 55.05 3hi7 s HIS 340 Cb -0.20 -1.24 0.02 0.00 1.11 0.00 0.00 32.58 32.27 3hi7 s HIS 340 CO 0.14 0.31 -0.04 0.12 -0.85 0.00 0.00 174.74 174.42 3hi7 s PHE 341 N -1.05 0.60 -1.62 1.40 5.36 -0.47 -1.67 117.98 120.53 3hi7 s PHE 341 Ca 0.13 -0.13 -0.02 0.00 -0.96 0.00 0.00 56.93 55.94 3hi7 s PHE 341 Cb -0.10 -0.52 0.00 0.00 -0.34 0.00 0.00 43.02 42.06 3hi7 s PHE 341 CO 0.06 -0.13 0.31 0.41 -1.46 0.00 0.00 175.22 174.40 3hi7 n GLY 342 N 3.74 -0.48 2.40 13.12 0.00 -0.19 -2.07 105.19 121.72 3hi7 n GLY 342 Ca -0.22 0.04 -0.04 0.00 0.00 0.00 0.00 46.02 45.79 3hi7 n GLY 342 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hi7 n GLY 343 N -1.27 0.60 3.30 -0.02 0.00 -1.26 -5.02 105.19 101.52 3hi7 n GLY 343 Ca -0.17 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 3hi7 n GLY 343 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hi7 s GLU 344 N -1.67 2.01 0.24 1.61 2.02 -0.88 -5.08 118.70 116.96 3hi7 s GLU 344 Ca 0.00 -0.92 -0.30 0.00 0.02 0.00 0.00 54.97 53.78 3hi7 s GLU 344 Cb 0.00 -1.97 -0.09 0.00 0.10 0.00 0.00 34.13 32.17 3hi7 s GLU 344 CO 0.00 0.54 1.23 0.50 0.02 0.00 0.00 175.26 177.54 3hi7 s ARG 345 N -0.65 4.47 -0.04 1.61 3.52 -1.26 -1.37 118.95 125.23 3hi7 s ARG 345 Ca 0.10 1.98 0.01 0.00 -0.13 0.00 0.00 55.73 57.69 3hi7 s ARG 345 Cb -0.10 -3.18 -0.03 0.00 -1.56 0.00 0.00 34.95 30.08 3hi7 s ARG 345 CO -0.01 -0.08 -0.02 0.44 -0.81 0.00 0.00 175.30 174.83 3hi7 n ILE 346 N 1.83 0.22 -3.72 4.11 -5.35 0.47 -0.80 119.36 116.11 3hi7 n ILE 346 Ca 0.02 -0.10 -0.13 0.00 -0.27 0.00 0.00 62.75 62.27 3hi7 n ILE 346 Cb 0.44 -0.75 -0.14 0.00 -1.74 0.00 0.00 39.64 37.45 3hi7 n ILE 346 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hi7 s ALA 347 N -2.08 -0.43 0.13 -1.28 0.00 -1.04 -1.20 121.76 115.86 3hi7 s ALA 347 Ca -0.04 0.86 -0.11 0.00 0.00 0.00 0.00 51.96 52.67 3hi7 s ALA 347 Cb 0.01 -0.63 -0.09 0.00 0.00 0.00 0.00 23.12 22.41 3hi7 s ALA 347 CO 0.11 -0.26 1.38 -0.92 0.00 0.00 0.00 175.76 176.07 3hi7 h TYR 348 N 7.41 1.06 -2.67 0.00 3.20 -1.24 0.16 116.97 124.89 3hi7 h TYR 348 Ca -0.37 -0.41 -0.12 0.00 3.14 0.00 0.00 58.73 60.98 3hi7 h TYR 348 Cb 1.14 -0.19 -0.26 0.00 1.54 0.00 0.00 36.73 38.96 3hi7 h TYR 348 CO 0.39 1.23 -0.29 -2.00 -1.64 0.00 0.00 178.16 175.85 3hi7 s GLU 349 N -4.00 0.41 -0.17 1.82 2.12 -1.13 -0.67 118.70 117.06 3hi7 s GLU 349 Ca -0.10 0.74 -0.00 0.00 0.36 0.00 0.00 54.97 55.96 3hi7 s GLU 349 Cb 0.10 0.03 0.04 0.00 0.26 0.00 0.00 34.13 34.55 3hi7 s GLU 349 CO 0.89 -0.14 -0.07 0.08 -0.54 0.00 0.00 175.26 175.48 3hi7 s VAL 350 N 1.15 1.28 -0.00 3.70 1.01 0.58 0.06 120.40 128.18 3hi7 s VAL 350 Ca -0.08 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 3hi7 s VAL 350 Cb -0.07 -1.40 -0.00 0.00 0.00 0.00 0.00 36.38 34.90 3hi7 s VAL 350 CO -0.10 0.17 0.02 -0.94 0.00 0.00 0.00 175.10 174.25 3hi7 s SER 351 N 1.56 0.06 0.19 3.32 1.04 -0.13 -1.06 113.70 118.67 3hi7 s SER 351 Ca 0.01 -0.15 -0.31 0.00 0.48 0.00 0.00 55.95 55.98 3hi7 s SER 351 Cb -0.15 0.09 -0.09 0.00 0.10 0.00 0.00 66.02 65.97 3hi7 s SER 351 CO -0.08 -0.14 1.47 -0.69 0.98 0.00 0.00 173.24 174.77 3hi7 s VAL 352 N -0.61 2.82 -0.08 5.02 1.01 -0.85 -1.24 120.40 126.48 3hi7 s VAL 352 Ca -0.07 0.63 0.01 0.00 0.00 0.00 0.00 61.98 62.55 3hi7 s VAL 352 Cb -0.04 -3.40 -0.06 0.00 0.00 0.00 0.00 36.38 32.88 3hi7 s VAL 352 CO -0.00 0.07 -0.07 0.00 0.00 0.00 0.00 175.10 175.10 3hi7 n GLN 353 N 3.29 0.44 -3.51 2.72 1.13 0.04 -4.56 117.38 116.92 3hi7 n GLN 353 Ca 0.10 0.04 -0.10 0.00 -1.94 0.00 0.00 57.00 55.11 3hi7 n GLN 353 Cb 0.40 -1.17 -0.03 0.00 0.11 0.00 0.00 30.24 29.56 3hi7 n GLN 353 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3hi7 s GLU 354 N -2.17 0.82 -0.09 -1.09 2.56 -1.17 -4.49 118.70 113.08 3hi7 s GLU 354 Ca -0.11 -0.20 -0.04 0.00 0.00 0.00 0.00 54.97 54.63 3hi7 s GLU 354 Cb 0.03 0.38 0.05 0.00 2.00 0.00 0.00 34.13 36.58 3hi7 s GLU 354 CO 0.20 -0.34 0.19 0.00 -0.56 0.00 0.00 175.26 174.75 3hi7 s ALA 355 N -2.67 -0.35 0.09 6.30 0.00 -1.26 -1.48 121.76 122.39 3hi7 s ALA 355 Ca 0.03 0.76 0.04 0.00 0.00 0.00 0.00 51.96 52.79 3hi7 s ALA 355 Cb -0.01 -0.63 -0.03 0.00 0.00 0.00 0.00 23.12 22.44 3hi7 s ALA 355 CO -0.06 -0.30 -0.11 0.14 0.00 0.00 0.00 175.76 175.42 3hi7 s VAL 356 N 1.56 1.00 -0.13 0.00 -7.23 0.58 -0.80 120.40 115.37 3hi7 s VAL 356 Ca -0.06 -1.55 -0.02 0.00 -1.81 0.00 0.00 61.98 58.55 3hi7 s VAL 356 Cb -0.11 -1.28 0.04 0.00 0.56 0.00 0.00 36.38 35.59 3hi7 s VAL 356 CO -0.07 -0.46 0.01 0.00 -0.31 0.00 0.00 175.10 174.27 3hi7 s ALA 357 N -2.10 0.90 -0.29 1.32 0.00 -0.28 -1.30 121.76 120.02 3hi7 s ALA 357 Ca 0.03 -0.43 -0.04 0.00 0.00 0.00 0.00 51.96 51.52 3hi7 s ALA 357 Cb -0.05 -0.96 0.03 0.00 0.00 0.00 0.00 23.12 22.14 3hi7 s ALA 357 CO 0.01 -0.78 0.03 -0.51 0.00 0.00 0.00 175.76 174.51 3hi7 s LEU 358 N 1.89 3.75 0.21 0.00 1.43 -0.61 -1.31 118.68 124.05 3hi7 s LEU 358 Ca 0.02 -0.92 0.06 0.00 -1.03 0.00 0.00 54.13 52.25 3hi7 s LEU 358 Cb -0.14 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.25 3hi7 s LEU 358 CO -0.07 -0.21 0.22 -0.31 0.23 0.00 0.00 176.35 176.22 3hi7 s TYR 359 N 1.39 3.23 0.34 0.29 2.02 -0.51 -1.86 117.35 122.24 3hi7 s TYR 359 Ca -0.00 -0.04 0.09 0.00 -0.37 0.00 0.00 57.07 56.74 3hi7 s TYR 359 Cb -0.18 -1.49 -0.05 0.00 -0.40 0.00 0.00 41.96 39.84 3hi7 s TYR 359 CO -0.00 0.51 0.06 0.20 -1.57 0.00 0.00 175.55 174.75 3hi7 s GLY 360 N -3.60 2.04 -0.02 0.71 0.00 -0.89 -4.69 107.32 100.87 3hi7 s GLY 360 Ca 0.33 -1.92 -0.30 0.00 0.00 0.00 0.00 44.72 42.83 3hi7 s GLY 360 CO 0.26 -1.85 1.04 -0.32 0.00 0.00 0.00 173.10 172.23 3hi7 s GLY 361 N -3.77 -0.37 0.17 0.20 0.00 -1.25 -4.30 107.32 98.00 3hi7 s GLY 361 Ca 0.36 0.95 0.14 0.00 0.00 0.00 0.00 44.72 46.16 3hi7 s GLY 361 CO 0.21 0.29 1.20 1.12 0.00 0.00 0.00 173.10 175.92 3hi7 h HIS 362 N 2.00 0.00 -3.04 1.90 2.07 -1.86 -3.37 115.15 112.85 3hi7 h HIS 362 Ca -0.20 0.00 -0.51 0.00 -2.85 0.00 0.00 60.37 56.81 3hi7 h HIS 362 Cb 1.21 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.19 3hi7 h HIS 362 CO 0.30 0.66 -0.19 0.95 -3.07 0.00 0.00 177.93 176.58 3hi7 s THR 363 N -2.87 5.08 0.31 6.12 -4.23 -1.26 -4.95 115.64 113.84 3hi7 s THR 363 Ca 0.01 -0.15 -0.01 0.00 -1.18 0.00 0.00 61.69 60.36 3hi7 s THR 363 Cb 0.08 -3.76 0.26 0.00 1.34 0.00 0.00 72.50 70.42 3hi7 s THR 363 CO 0.78 -0.35 1.97 1.55 -0.54 0.00 0.00 174.62 178.03 3hi7 h PRO 364 N 1.51 1.05 -0.52 3.99 0.13 -1.99 -1.37 132.00 134.79 3hi7 h PRO 364 Ca -0.48 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 64.56 3hi7 h PRO 364 Cb 1.20 -0.24 -0.02 0.00 0.13 0.00 0.00 31.00 32.07 3hi7 h PRO 364 CO 0.65 0.69 0.24 0.00 -0.23 0.00 0.00 178.00 179.36 3hi7 h ALA 365 N 1.50 0.68 -0.05 -0.56 0.00 -1.94 -2.13 119.26 116.75 3hi7 h ALA 365 Ca 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3hi7 h ALA 365 Cb -0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3hi7 h ALA 365 CO -0.07 0.25 0.02 0.78 0.00 0.00 0.00 179.25 180.23 3hi7 h GLY 366 N 0.70 0.06 2.00 0.00 0.00 -1.81 -2.74 103.07 101.28 3hi7 h GLY 366 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.50 3hi7 h GLY 366 CO -0.02 0.01 0.00 0.00 0.00 0.00 0.00 176.54 176.53 3hi7 h MET 367 N 0.05 0.00 0.00 4.80 -0.00 -1.19 -2.68 114.93 115.90 3hi7 h MET 367 Ca 0.02 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.63 3hi7 h MET 367 Cb 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.60 3hi7 h MET 367 CO -0.02 0.00 -0.41 0.37 -0.00 0.00 0.00 176.91 176.85 3hi7 h GLN 368 N 0.00 0.00 -6.46 -0.10 5.75 -1.09 -3.46 115.11 109.74 3hi7 h GLN 368 Ca 0.00 0.00 -0.57 0.00 -0.15 0.00 0.00 58.65 57.93 3hi7 h GLN 368 Cb 0.46 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.95 3hi7 h GLN 368 CO 0.00 0.41 0.93 0.99 -2.65 0.00 0.00 178.83 178.52 3hi7 s THR 369 N -3.02 4.24 -0.38 2.39 2.01 -1.01 -4.01 115.64 115.87 3hi7 s THR 369 Ca 0.04 1.36 0.00 0.00 0.31 0.00 0.00 61.69 63.41 3hi7 s THR 369 Cb 0.07 -4.37 0.13 0.00 0.01 0.00 0.00 72.50 68.34 3hi7 s THR 369 CO 0.73 -0.66 0.19 -0.54 -0.69 0.00 0.00 174.62 173.65 3hi7 s LYS 370 N 4.19 0.87 -0.08 4.92 1.02 -0.22 -1.43 119.74 129.00 3hi7 s LYS 370 Ca 0.51 -1.52 -0.24 0.00 0.02 0.00 0.00 55.97 54.75 3hi7 s LYS 370 Cb -0.12 -1.87 -0.03 0.00 -0.52 0.00 0.00 37.83 35.28 3hi7 s LYS 370 CO 0.24 -1.13 0.72 0.71 -0.92 0.00 0.00 175.35 174.97 3hi7 s TYR 371 N 0.94 3.56 -0.26 3.18 2.02 -0.43 -3.92 117.35 122.43 3hi7 s TYR 371 Ca 0.16 1.26 0.03 0.00 -0.37 0.00 0.00 57.07 58.14 3hi7 s TYR 371 Cb -0.22 -2.84 0.06 0.00 -0.40 0.00 0.00 41.96 38.56 3hi7 s TYR 371 CO -0.07 0.04 -0.10 -0.51 -1.57 0.00 0.00 175.55 173.33 3hi7 s LEU 372 N 1.00 3.48 0.42 -1.29 1.02 -1.26 -1.12 118.68 120.93 3hi7 s LEU 372 Ca 0.38 -1.40 0.11 0.00 0.02 0.00 0.00 54.13 53.24 3hi7 s LEU 372 Cb -0.18 -1.56 0.92 0.00 0.02 0.00 0.00 46.19 45.39 3hi7 s LEU 372 CO 0.18 -0.19 1.99 0.44 0.02 0.00 0.00 176.35 178.78 3hi7 h ASP 373 N 7.78 0.18 0.10 2.29 3.32 -1.37 -2.05 116.42 126.66 3hi7 h ASP 373 Ca -0.19 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 3hi7 h ASP 373 Cb 1.04 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.54 3hi7 h ASP 373 CO 0.46 0.28 -0.09 0.58 -1.72 0.00 0.00 179.24 178.75 3hi7 h VAL 374 N 0.19 0.99 0.00 -1.35 2.07 -1.83 0.14 116.25 116.46 3hi7 h VAL 374 Ca 0.04 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.26 3hi7 h VAL 374 Cb 0.24 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3hi7 h VAL 374 CO 0.01 0.08 0.00 0.61 0.02 0.00 0.00 177.57 178.30 3hi7 n GLY 375 N -1.24 -0.49 0.03 2.17 0.00 -0.77 -2.35 105.19 102.54 3hi7 n GLY 375 Ca -0.03 -0.03 0.02 0.00 0.00 0.00 0.00 46.02 45.98 3hi7 n GLY 375 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3hi7 n TRP 376 N -1.26 0.00 -2.17 1.61 7.02 0.47 -4.64 117.44 118.47 3hi7 n TRP 376 Ca 0.03 -0.55 -0.05 0.00 -1.02 0.00 0.00 57.50 55.91 3hi7 n TRP 376 Cb 0.05 -0.07 0.02 0.00 -2.42 0.00 0.00 31.31 28.90 3hi7 n TRP 376 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3hi7 n GLY 377 N -0.64 0.21 0.34 6.99 0.00 -0.99 -4.90 105.19 106.19 3hi7 n GLY 377 Ca 0.03 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.13 3hi7 n GLY 377 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hi7 h LEU 378 N -0.42 0.63 -0.52 0.99 5.85 -1.39 0.73 115.31 121.18 3hi7 h LEU 378 Ca -0.20 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.63 3hi7 h LEU 378 Cb 1.11 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3hi7 h LEU 378 CO 0.15 0.17 0.00 0.61 -0.34 0.00 0.00 178.44 179.04 3hi7 n GLY 379 N -1.32 -0.46 0.45 3.75 0.00 -0.56 -3.90 105.19 103.14 3hi7 n GLY 379 Ca 0.23 -0.33 0.06 0.00 0.00 0.00 0.00 46.02 45.98 3hi7 n GLY 379 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hi7 n SER 380 N -0.37 1.93 -2.36 1.61 7.64 0.24 -4.40 113.62 117.90 3hi7 n SER 380 Ca 0.21 -1.46 -0.31 0.00 1.01 0.00 0.00 58.87 58.32 3hi7 n SER 380 Cb 0.24 0.01 0.04 0.00 -1.01 0.00 0.00 64.21 63.49 3hi7 n SER 380 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 3hi7 n VAL 381 N 0.62 3.07 -2.74 0.44 0.24 -1.16 -4.89 118.33 113.91 3hi7 n VAL 381 Ca 0.07 -3.92 -0.43 0.00 -2.04 0.00 0.00 64.34 58.01 3hi7 n VAL 381 Cb 0.28 -1.19 0.00 0.00 -1.47 0.00 0.00 33.84 31.47 3hi7 n VAL 381 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3hi7 n THR 382 N -0.71 4.45 -2.11 3.34 -2.24 -1.26 -1.62 114.28 114.13 3hi7 n THR 382 Ca 0.51 -4.80 -0.27 0.00 -2.27 0.00 0.00 64.05 57.23 3hi7 n THR 382 Cb 0.68 -2.39 0.08 0.00 -2.10 0.00 0.00 70.33 66.60 3hi7 n THR 382 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3hi7 s HIS 383 N 0.32 2.89 0.14 4.78 3.76 -1.26 -4.43 115.29 121.48 3hi7 s HIS 383 Ca 0.39 0.52 -0.31 0.00 -0.15 0.00 0.00 55.06 55.51 3hi7 s HIS 383 Cb 0.02 -3.30 -0.10 0.00 1.11 0.00 0.00 32.58 30.31 3hi7 s HIS 383 CO 0.01 -1.54 1.68 -2.00 -0.85 0.00 0.00 174.74 172.03 3hi7 s GLU 384 N -5.35 4.17 -0.03 1.40 2.12 -1.26 -4.69 118.70 115.06 3hi7 s GLU 384 Ca 0.61 2.46 -0.29 0.00 0.36 0.00 0.00 54.97 58.11 3hi7 s GLU 384 Cb -0.11 -3.33 -0.03 0.00 0.26 0.00 0.00 34.13 30.93 3hi7 s GLU 384 CO 0.46 -0.72 0.96 -0.51 -0.54 0.00 0.00 175.26 174.92 3hi7 s LEU 385 N 1.82 4.34 -0.32 2.70 1.43 -0.17 -5.01 118.68 123.47 3hi7 s LEU 385 Ca 0.74 1.60 -0.24 0.00 -1.03 0.00 0.00 54.13 55.20 3hi7 s LEU 385 Cb -0.45 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.25 3hi7 s LEU 385 CO 0.33 -0.29 0.81 0.00 0.23 0.00 0.00 176.35 177.43 3hi7 s ALA 386 N 1.20 3.50 0.22 4.21 0.00 -1.26 -4.93 121.76 124.70 3hi7 s ALA 386 Ca 0.50 -0.46 -0.31 0.00 0.00 0.00 0.00 51.96 51.69 3hi7 s ALA 386 Cb -0.20 -3.35 -0.11 0.00 0.00 0.00 0.00 23.12 19.45 3hi7 s ALA 386 CO 0.25 -1.31 1.64 -2.14 0.00 0.00 0.00 175.76 174.21 3hi7 s PRO 387 N 3.06 4.15 0.00 0.00 0.02 -1.26 -0.81 135.00 140.16 3hi7 s PRO 387 Ca 0.33 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.88 3hi7 s PRO 387 Cb -0.14 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.30 3hi7 s PRO 387 CO 0.14 -0.67 0.00 0.41 -0.33 0.00 0.00 177.00 176.55 3hi7 n GLY 388 N 3.38 2.78 0.74 0.52 0.00 0.12 -4.79 105.19 107.94 3hi7 n GLY 388 Ca 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.13 3hi7 n GLY 388 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hi7 n ILE 389 N -2.00 0.98 0.05 -0.61 5.41 -0.64 -4.70 119.36 117.85 3hi7 n ILE 389 Ca 0.00 0.28 -0.13 0.00 1.00 0.00 0.00 62.75 63.90 3hi7 n ILE 389 Cb 0.00 -1.65 -0.03 0.00 -0.71 0.00 0.00 39.64 37.24 3hi7 n ILE 389 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 3hi7 h ASP 390 N -0.23 0.58 -4.39 4.38 3.32 -1.28 -3.45 116.42 115.34 3hi7 h ASP 390 Ca 0.00 -0.44 -0.28 0.00 0.02 0.00 0.00 57.03 56.34 3hi7 h ASP 390 Cb 0.23 -0.18 -0.15 0.00 0.22 0.00 0.00 39.33 39.46 3hi7 h ASP 390 CO 0.00 1.22 -0.69 0.00 -1.72 0.00 0.00 179.24 178.05 3hi7 n PRO 392 N -0.17 0.44 0.30 0.00 -0.02 -1.26 0.13 135.00 134.42 3hi7 n PRO 392 Ca -0.09 0.21 0.16 0.00 -2.02 0.00 0.00 63.50 61.76 3hi7 n PRO 392 Cb 0.62 -2.24 0.95 0.00 -0.02 0.00 0.00 33.50 32.80 3hi7 n PRO 392 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3hi7 h GLU 393 N -0.39 0.00 -0.01 -0.52 3.07 -1.87 -0.45 114.58 114.42 3hi7 h GLU 393 Ca -0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.39 3hi7 h GLU 393 Cb 1.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 3hi7 h GLU 393 CO 0.46 0.01 -0.06 0.25 -1.40 0.00 0.00 179.01 178.27 3hi7 n THR 394 N -3.72 0.00 -1.91 1.13 -2.24 -1.26 -4.68 114.28 101.59 3hi7 n THR 394 Ca -0.03 -0.12 -0.33 0.00 -2.27 0.00 0.00 64.05 61.30 3hi7 n THR 394 Cb 0.09 0.06 0.03 0.00 -2.10 0.00 0.00 70.33 68.41 3hi7 n THR 394 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hi7 s ALA 395 N -2.22 2.56 -0.32 6.98 0.00 -0.18 -4.95 121.76 123.64 3hi7 s ALA 395 Ca 0.36 0.58 -0.23 0.00 0.00 0.00 0.00 51.96 52.66 3hi7 s ALA 395 Cb 0.21 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 20.02 3hi7 s ALA 395 CO 0.41 -1.09 0.78 0.99 0.00 0.00 0.00 175.76 176.86 3hi7 s THR 396 N -2.24 4.78 -0.14 0.00 2.01 -0.38 -4.96 115.64 114.72 3hi7 s THR 396 Ca 0.68 1.08 -0.08 0.00 0.31 0.00 0.00 61.69 63.68 3hi7 s THR 396 Cb -0.20 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 3hi7 s THR 396 CO 0.38 -0.30 0.15 -0.36 -0.69 0.00 0.00 174.62 173.79 3hi7 s PHE 397 N 2.99 3.55 -0.04 4.92 0.40 -1.26 -0.76 117.98 127.78 3hi7 s PHE 397 Ca 0.32 0.49 0.05 0.00 -0.60 0.00 0.00 56.93 57.19 3hi7 s PHE 397 Cb -0.14 -2.01 -0.01 0.00 0.51 0.00 0.00 43.02 41.37 3hi7 s PHE 397 CO 0.14 0.61 -0.18 -0.51 0.70 0.00 0.00 175.22 175.98 3hi7 s LEU 398 N -0.64 1.95 0.42 -0.37 1.02 0.04 -4.90 118.68 116.20 3hi7 s LEU 398 Ca 0.13 -0.37 -0.02 0.00 0.02 0.00 0.00 54.13 53.90 3hi7 s LEU 398 Cb -0.12 -1.02 -0.03 0.00 0.02 0.00 0.00 46.19 45.05 3hi7 s LEU 398 CO 0.03 0.18 0.66 -1.81 0.02 0.00 0.00 176.35 175.43 3hi7 s ASP 399 N -0.07 6.16 0.25 2.29 1.01 -1.26 -0.60 116.67 124.45 3hi7 s ASP 399 Ca -0.02 0.58 -0.02 0.00 0.71 0.00 0.00 52.55 53.80 3hi7 s ASP 399 Cb -0.11 -1.98 -0.03 0.00 1.01 0.00 0.00 42.92 41.81 3hi7 s ASP 399 CO 0.02 -0.50 0.26 0.28 0.21 0.00 0.00 175.17 175.44 3hi7 s THR 400 N -2.53 0.00 -0.01 -1.27 -1.32 -0.78 -4.84 115.64 104.89 3hi7 s THR 400 Ca 0.45 -1.83 0.06 0.00 -1.21 0.00 0.00 61.69 59.15 3hi7 s THR 400 Cb -0.10 -2.45 -0.03 0.00 -1.51 0.00 0.00 72.50 68.41 3hi7 s THR 400 CO 0.40 0.00 -0.19 -0.36 -2.21 0.00 0.00 174.62 172.25 3hi7 s PHE 401 N -3.90 2.54 0.02 9.09 0.40 -1.26 -0.68 117.98 124.20 3hi7 s PHE 401 Ca 0.35 -0.27 0.06 0.00 -0.60 0.00 0.00 56.93 56.46 3hi7 s PHE 401 Cb 0.04 -1.54 -0.02 0.00 0.51 0.00 0.00 43.02 42.01 3hi7 s PHE 401 CO 0.15 0.14 -0.17 -1.01 0.70 0.00 0.00 175.22 175.02 3hi7 s HIS 402 N -0.75 1.52 -0.47 0.36 3.76 -0.50 -4.94 115.29 114.27 3hi7 s HIS 402 Ca 0.12 -0.33 0.03 0.00 -0.15 0.00 0.00 55.06 54.73 3hi7 s HIS 402 Cb -0.10 -0.93 0.12 0.00 1.11 0.00 0.00 32.58 32.78 3hi7 s HIS 402 CO 0.01 0.03 0.21 -0.47 -0.85 0.00 0.00 174.74 173.68 3hi7 s TYR 403 N -0.67 3.01 -0.15 1.40 5.04 -1.26 -0.84 117.35 123.88 3hi7 s TYR 403 Ca 0.05 -2.96 -0.04 0.00 -2.44 0.00 0.00 57.07 51.68 3hi7 s TYR 403 Cb -0.08 -2.63 0.07 0.00 0.35 0.00 0.00 41.96 39.67 3hi7 s TYR 403 CO 0.01 -0.79 0.16 -0.47 -1.34 0.00 0.00 175.55 173.12 3hi7 s TYR 404 N 0.09 -0.10 -1.32 4.97 5.04 -1.26 -1.89 117.35 122.89 3hi7 s TYR 404 Ca 0.16 0.18 -0.07 0.00 -2.44 0.00 0.00 57.07 54.90 3hi7 s TYR 404 Cb -0.24 -0.43 -0.00 0.00 0.35 0.00 0.00 41.96 41.63 3hi7 s TYR 404 CO -0.02 -0.47 0.55 -3.47 -1.34 0.00 0.00 175.55 170.80 3hi7 n ASP 405 N 5.31 -1.81 -4.14 4.32 2.03 0.53 -4.99 116.55 117.80 3hi7 n ASP 405 Ca -0.06 -1.00 -0.09 0.00 0.52 0.00 0.00 54.79 54.16 3hi7 n ASP 405 Cb 0.49 -3.20 -0.10 0.00 -0.72 0.00 0.00 41.12 37.59 3hi7 n ASP 405 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hi7 s ALA 406 N -3.79 0.78 -0.03 -1.67 0.00 -1.26 -4.86 121.76 110.92 3hi7 s ALA 406 Ca 0.14 -1.34 0.12 0.00 0.00 0.00 0.00 51.96 50.88 3hi7 s ALA 406 Cb -0.05 0.39 -0.11 0.00 0.00 0.00 0.00 23.12 23.35 3hi7 s ALA 406 CO 0.88 -0.36 1.20 -0.44 0.00 0.00 0.00 175.76 177.05 3hi7 h ASP 407 N 3.00 0.00 -5.21 0.00 3.32 -1.94 -3.39 116.42 112.20 3hi7 h ASP 407 Ca -0.35 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.61 3hi7 h ASP 407 Cb 1.16 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.58 3hi7 h ASP 407 CO 0.64 0.77 -0.35 -1.81 -1.72 0.00 0.00 179.24 176.77 3hi7 s ASP 408 N -6.42 0.08 0.40 6.45 1.01 -1.26 -4.91 116.67 112.02 3hi7 s ASP 408 Ca 0.01 -0.75 -0.27 0.00 0.71 0.00 0.00 52.55 52.25 3hi7 s ASP 408 Cb 0.09 0.39 -0.10 0.00 1.01 0.00 0.00 42.92 44.30 3hi7 s ASP 408 CO 0.79 -0.81 1.41 -2.65 0.21 0.00 0.00 175.17 174.13 3hi7 n PRO 409 N -0.13 2.37 -4.95 8.23 -0.02 -1.26 -4.85 135.00 134.39 3hi7 n PRO 409 Ca -0.11 0.84 -0.33 0.00 -2.02 0.00 0.00 63.50 61.88 3hi7 n PRO 409 Cb 0.63 -2.57 -0.15 0.00 -0.02 0.00 0.00 33.50 31.38 3hi7 n PRO 409 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hi7 s VAL 410 N -1.15 2.69 -0.14 -1.45 1.01 -0.02 -3.94 120.40 117.40 3hi7 s VAL 410 Ca 0.57 -0.80 -0.28 0.00 0.00 0.00 0.00 61.98 61.47 3hi7 s VAL 410 Cb -0.48 -2.09 -0.01 0.00 0.00 0.00 0.00 36.38 33.79 3hi7 s VAL 410 CO 0.61 0.54 0.96 -2.28 0.00 0.00 0.00 175.10 174.93 3hi7 s HIS 411 N 0.28 3.46 -0.40 5.22 2.46 -0.32 -1.41 115.29 124.58 3hi7 s HIS 411 Ca -0.12 1.48 -0.06 0.00 0.47 0.00 0.00 55.06 56.83 3hi7 s HIS 411 Cb -0.16 -3.14 0.09 0.00 -0.13 0.00 0.00 32.58 29.23 3hi7 s HIS 411 CO 0.06 -0.26 0.20 0.71 -2.47 0.00 0.00 174.74 172.99 3hi7 s TYR 412 N 2.20 3.43 0.35 3.88 1.51 0.15 -2.88 117.35 125.98 3hi7 s TYR 412 Ca 0.45 -1.95 -0.27 0.00 -1.01 0.00 0.00 57.07 54.29 3hi7 s TYR 412 Cb -0.17 -2.96 -0.09 0.00 -0.11 0.00 0.00 41.96 38.62 3hi7 s TYR 412 CO 0.15 -0.90 1.14 -1.25 -1.11 0.00 0.00 175.55 173.58 3hi7 s PRO 413 N 1.28 4.32 -1.42 -1.71 0.04 -1.26 -1.87 135.00 134.39 3hi7 s PRO 413 Ca 0.04 1.82 -0.02 0.00 0.04 0.00 0.00 61.00 62.88 3hi7 s PRO 413 Cb -0.23 -2.89 0.00 0.00 0.04 0.00 0.00 34.50 31.43 3hi7 s PRO 413 CO -0.01 -0.09 0.35 0.54 0.04 0.00 0.00 177.00 177.84 3hi7 n ARG 414 N 0.54 -2.55 0.09 4.56 1.74 -1.23 -4.08 116.66 115.73 3hi7 n ARG 414 Ca 0.02 0.33 -0.06 0.00 -0.77 0.00 0.00 57.85 57.37 3hi7 n ARG 414 Cb 0.46 -4.22 0.07 0.00 -1.02 0.00 0.00 32.46 27.74 3hi7 n ARG 414 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hi7 h ALA 415 N 0.85 0.72 -2.22 7.54 0.00 -0.93 -0.43 119.26 124.80 3hi7 h ALA 415 Ca -0.64 -0.63 -0.36 0.00 0.00 0.00 0.00 54.91 53.28 3hi7 h ALA 415 Cb 1.38 -0.09 -0.14 0.00 0.00 0.00 0.00 17.79 18.94 3hi7 h ALA 415 CO 0.63 0.82 -0.70 -0.51 0.00 0.00 0.00 179.25 179.49 3hi7 s LEU 416 N -7.65 2.45 0.03 0.00 1.02 -0.77 -4.31 118.68 109.45 3hi7 s LEU 416 Ca -0.03 -1.07 0.00 0.00 0.02 0.00 0.00 54.13 53.05 3hi7 s LEU 416 Cb 0.11 -0.38 -0.03 0.00 0.02 0.00 0.00 46.19 45.92 3hi7 s LEU 416 CO 0.81 -0.35 -0.04 0.00 0.02 0.00 0.00 176.35 176.79 3hi7 s LEU 418 N -1.93 1.26 -0.06 0.00 2.96 0.06 -1.05 118.68 119.92 3hi7 s LEU 418 Ca -0.08 -0.17 -0.28 0.00 -0.22 0.00 0.00 54.13 53.38 3hi7 s LEU 418 Cb -0.05 -0.56 0.06 0.00 0.50 0.00 0.00 46.19 46.15 3hi7 s LEU 418 CO -0.03 -0.07 0.62 0.72 -1.32 0.00 0.00 176.35 176.27 3hi7 s PHE 419 N 1.11 -0.59 -0.10 5.38 -0.12 -0.40 -1.25 117.98 122.01 3hi7 s PHE 419 Ca -0.08 1.06 -0.09 0.00 -0.05 0.00 0.00 56.93 57.78 3hi7 s PHE 419 Cb -0.14 0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 42.55 3hi7 s PHE 419 CO -0.01 -0.55 0.20 -2.00 -0.05 0.00 0.00 175.22 172.81 3hi7 s GLU 420 N -1.05 3.60 -0.01 1.99 2.12 -1.26 -0.27 118.70 123.81 3hi7 s GLU 420 Ca -0.10 -0.02 0.01 0.00 0.36 0.00 0.00 54.97 55.22 3hi7 s GLU 420 Cb -0.01 -3.21 0.00 0.00 0.26 0.00 0.00 34.13 31.17 3hi7 s GLU 420 CO 0.08 0.72 -0.03 1.41 -0.54 0.00 0.00 175.26 176.90 3hi7 s MET 421 N -0.93 0.34 0.22 4.30 -2.45 -0.15 -4.98 119.30 115.66 3hi7 s MET 421 Ca 0.16 -0.09 -0.30 0.00 -1.25 0.00 0.00 55.69 54.21 3hi7 s MET 421 Cb -0.13 -0.37 -0.09 0.00 1.25 0.00 0.00 34.83 35.49 3hi7 s MET 421 CO 0.06 0.03 1.29 -1.25 1.05 0.00 0.00 175.02 176.20 3hi7 s PRO 422 N 0.20 4.40 0.33 4.11 0.04 -1.26 -1.32 135.00 141.50 3hi7 s PRO 422 Ca -0.02 2.05 0.24 0.00 0.04 0.00 0.00 61.00 63.31 3hi7 s PRO 422 Cb -0.05 -3.18 0.45 0.00 0.04 0.00 0.00 34.50 31.76 3hi7 s PRO 422 CO -0.00 -0.21 1.59 1.79 0.04 0.00 0.00 177.00 180.20 3hi7 h THR 423 N 3.62 0.00 0.00 1.26 1.35 -1.80 -3.48 112.91 113.86 3hi7 h THR 423 Ca -0.45 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 64.60 3hi7 h THR 423 Cb 1.22 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 3hi7 h THR 423 CO 0.75 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.63 3hi7 n GLY 424 N 1.19 0.64 2.82 5.82 0.00 -1.26 -5.02 105.19 109.37 3hi7 n GLY 424 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 3hi7 n GLY 424 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hi7 s VAL 425 N -2.53 -0.02 0.47 1.61 0.11 -1.26 -5.04 120.40 113.74 3hi7 s VAL 425 Ca 0.00 0.11 -0.24 0.00 -2.93 0.00 0.00 61.98 58.92 3hi7 s VAL 425 Cb 0.00 -0.05 -0.07 0.00 -1.53 0.00 0.00 36.38 34.72 3hi7 s VAL 425 CO 0.00 0.05 1.38 -2.16 -3.33 0.00 0.00 175.10 171.04 3hi7 s PRO 426 N 0.56 3.59 0.28 1.54 0.04 -1.26 -3.29 135.00 136.45 3hi7 s PRO 426 Ca -0.05 2.30 -0.04 0.00 0.04 0.00 0.00 61.00 63.26 3hi7 s PRO 426 Cb -0.07 -2.56 0.36 0.00 0.04 0.00 0.00 34.50 32.28 3hi7 s PRO 426 CO -0.02 -0.85 1.92 1.25 0.04 0.00 0.00 177.00 179.35 3hi7 h LEU 427 N 2.14 1.00 -7.12 -3.56 6.46 -1.22 -3.44 115.31 109.57 3hi7 h LEU 427 Ca -0.51 -0.06 -0.07 0.00 -0.12 0.00 0.00 57.88 57.13 3hi7 h LEU 427 Cb 1.27 -0.25 -0.19 0.00 -0.73 0.00 0.00 40.66 40.76 3hi7 h LEU 427 CO 0.60 0.77 0.08 0.00 -0.62 0.00 0.00 178.44 179.27 3hi7 s ARG 428 N -5.86 0.97 0.00 1.25 1.70 -1.24 -5.02 118.95 110.75 3hi7 s ARG 428 Ca -0.12 0.16 -0.24 0.00 -0.47 0.00 0.00 55.73 55.06 3hi7 s ARG 428 Cb 0.17 0.45 0.05 0.00 -0.57 0.00 0.00 34.95 35.06 3hi7 s ARG 428 CO 0.81 -0.29 0.54 -0.98 -1.08 0.00 0.00 175.30 174.29 3hi7 s ARG 429 N -1.21 0.98 -0.17 3.89 1.04 -1.26 -1.07 118.95 121.15 3hi7 s ARG 429 Ca -0.12 -0.06 -0.10 0.00 -1.04 0.00 0.00 55.73 54.42 3hi7 s ARG 429 Cb -0.01 0.45 0.06 0.00 -2.04 0.00 0.00 34.95 33.41 3hi7 s ARG 429 CO 0.09 -0.33 0.42 -1.58 -0.04 0.00 0.00 175.30 173.86 3hi7 s HIS 430 N -1.83 -0.61 -0.47 5.89 2.46 -0.05 -4.99 115.29 115.69 3hi7 s HIS 430 Ca -0.09 1.30 -0.17 0.00 0.47 0.00 0.00 55.06 56.57 3hi7 s HIS 430 Cb -0.01 0.27 0.06 0.00 -0.13 0.00 0.00 32.58 32.76 3hi7 s HIS 430 CO 0.03 -0.34 0.49 0.12 -2.47 0.00 0.00 174.74 172.57 3hi7 s PHE 431 N 1.35 3.16 -0.96 3.88 2.19 -1.26 -1.38 117.98 124.96 3hi7 s PHE 431 Ca -0.09 -0.66 -0.17 0.00 0.33 0.00 0.00 56.93 56.34 3hi7 s PHE 431 Cb -0.08 -3.24 0.15 0.00 -1.31 0.00 0.00 43.02 38.55 3hi7 s PHE 431 CO -0.12 -0.86 1.11 1.21 1.83 0.00 0.00 175.22 178.39 3hi7 s ASN 432 N 2.45 6.73 0.56 6.13 3.84 -0.11 -5.02 114.94 129.53 3hi7 s ASN 432 Ca 0.10 -2.32 -0.19 0.00 0.21 0.00 0.00 52.86 50.66 3hi7 s ASN 432 Cb -0.21 -2.36 -0.05 0.00 -0.55 0.00 0.00 41.25 38.08 3hi7 s ASN 432 CO 0.10 -0.92 1.13 -0.55 -2.79 0.00 0.00 177.10 174.07 3hi7 s SER 433 N 3.22 5.61 0.00 -4.21 0.15 -1.26 0.03 113.70 117.25 3hi7 s SER 433 Ca 0.32 2.16 0.27 0.00 0.70 0.00 0.00 55.95 59.39 3hi7 s SER 433 Cb -0.05 -2.58 0.76 0.00 -1.71 0.00 0.00 66.02 62.43 3hi7 s SER 433 CO -0.08 -1.29 1.58 -0.46 1.20 0.00 0.00 173.24 174.19 3hi7 n ASN 434 N -1.48 1.99 -1.54 5.45 0.23 -0.52 -4.57 115.26 114.82 3hi7 n ASN 434 Ca 0.11 -1.66 -0.20 0.00 -0.53 0.00 0.00 54.58 52.31 3hi7 n ASN 434 Cb 0.51 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.13 3hi7 n ASN 434 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 3hi7 n PHE 435 N 0.55 -0.02 -2.35 -2.53 3.01 -1.26 -4.81 117.46 110.06 3hi7 n PHE 435 Ca 0.17 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.67 3hi7 n PHE 435 Cb 0.44 -3.36 0.06 0.00 -0.01 0.00 0.00 39.48 36.61 3hi7 n PHE 435 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3hi7 n LYS 436 N -2.43 0.44 -0.41 -1.08 5.02 -1.26 -4.97 118.16 113.48 3hi7 n LYS 436 Ca -0.20 -2.36 0.00 0.00 -2.02 0.00 0.00 58.31 53.73 3hi7 n LYS 436 Cb 0.66 -0.42 0.00 0.00 -0.02 0.00 0.00 35.03 35.24 3hi7 n LYS 436 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hi7 n GLY 437 N 0.12 0.74 0.00 0.72 0.00 -1.26 -5.03 105.19 100.49 3hi7 n GLY 437 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3hi7 n GLY 437 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hi7 n GLY 438 N -2.18 4.77 3.16 -0.02 0.00 -1.26 -5.07 105.19 104.59 3hi7 n GLY 438 Ca 0.00 -1.22 -0.09 0.00 0.00 0.00 0.00 46.02 44.71 3hi7 n GLY 438 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hi7 s PHE 439 N -1.03 0.16 -0.09 1.61 -0.00 -1.26 -1.43 117.98 115.93 3hi7 s PHE 439 Ca 0.00 -0.49 -0.00 0.00 -0.00 0.00 0.00 56.93 56.43 3hi7 s PHE 439 Cb 0.00 -0.10 -0.25 0.00 -0.00 0.00 0.00 43.02 42.67 3hi7 s PHE 439 CO 0.00 -0.44 0.47 0.09 -0.00 0.00 0.00 175.22 175.34 3hi7 n ASN 440 N 0.43 1.72 -3.56 1.98 3.02 0.10 -4.68 115.26 114.26 3hi7 n ASN 440 Ca -0.17 0.28 -0.06 0.00 -0.03 0.00 0.00 54.58 54.60 3hi7 n ASN 440 Cb 0.60 -0.61 -0.02 0.00 -0.61 0.00 0.00 39.78 39.14 3hi7 n ASN 440 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3hi7 s PHE 441 N -2.57 -0.20 -0.11 3.10 -0.71 -1.19 -4.30 117.98 112.01 3hi7 s PHE 441 Ca -0.16 0.12 0.02 0.00 -1.04 0.00 0.00 56.93 55.87 3hi7 s PHE 441 Cb 0.07 0.52 -0.01 0.00 -1.21 0.00 0.00 43.02 42.39 3hi7 s PHE 441 CO 0.79 -0.31 -0.16 -0.47 -1.34 0.00 0.00 175.22 173.72 3hi7 s TYR 442 N -2.64 2.72 -0.02 3.49 5.04 -0.70 -0.93 117.35 124.31 3hi7 s TYR 442 Ca 0.08 -0.66 0.06 0.00 -2.44 0.00 0.00 57.07 54.10 3hi7 s TYR 442 Cb -0.01 -1.77 -0.01 0.00 0.35 0.00 0.00 41.96 40.52 3hi7 s TYR 442 CO -0.06 -0.20 -0.19 0.00 -1.34 0.00 0.00 175.55 173.76 3hi7 s ALA 443 N 0.16 1.59 -0.02 3.97 0.00 -0.48 -0.29 121.76 126.69 3hi7 s ALA 443 Ca -0.09 -0.82 -0.26 0.00 0.00 0.00 0.00 51.96 50.80 3hi7 s ALA 443 Cb -0.15 -0.41 0.06 0.00 0.00 0.00 0.00 23.12 22.61 3hi7 s ALA 443 CO 0.05 0.39 0.56 0.20 0.00 0.00 0.00 175.76 176.96 3hi7 s GLY 444 N -0.43 -0.45 -0.17 0.00 0.00 -0.37 -0.87 107.32 105.03 3hi7 s GLY 444 Ca 0.07 0.95 -0.00 0.00 0.00 0.00 0.00 44.72 45.74 3hi7 s GLY 444 CO -0.01 0.64 -0.08 -2.27 0.00 0.00 0.00 173.10 171.39 3hi7 s LEU 445 N -1.37 1.81 0.35 0.66 2.96 -0.23 -1.27 118.68 121.58 3hi7 s LEU 445 Ca -0.11 -0.70 -0.28 0.00 -0.22 0.00 0.00 54.13 52.83 3hi7 s LEU 445 Cb -0.01 -1.03 -0.12 0.00 0.50 0.00 0.00 46.19 45.52 3hi7 s LEU 445 CO 0.06 -0.16 1.30 1.17 -1.32 0.00 0.00 176.35 177.40 3hi7 n LYS 446 N 4.81 2.14 -2.78 1.98 4.81 -1.26 -0.90 118.16 126.95 3hi7 n LYS 446 Ca -0.13 0.75 -0.42 0.00 -0.87 0.00 0.00 58.31 57.64 3hi7 n LYS 446 Cb 0.48 -2.34 -0.03 0.00 0.02 0.00 0.00 35.03 33.15 3hi7 n LYS 446 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 3hi7 s GLY 447 N -0.32 2.55 0.06 3.14 0.00 -1.21 -4.36 107.32 107.19 3hi7 s GLY 447 Ca 0.56 0.35 0.01 0.00 0.00 0.00 0.00 44.72 45.63 3hi7 s GLY 447 CO 0.62 1.69 -0.06 1.20 0.00 0.00 0.00 173.10 176.55 3hi7 s GLN 448 N 1.50 0.61 0.01 2.90 -1.52 -1.26 -2.36 119.66 119.55 3hi7 s GLN 448 Ca 0.46 -1.01 -0.03 0.00 -1.95 0.00 0.00 55.36 52.83 3hi7 s GLN 448 Cb -0.19 -0.12 -0.01 0.00 -0.22 0.00 0.00 33.01 32.48 3hi7 s GLN 448 CO 0.21 -0.02 0.05 0.54 -0.25 0.00 0.00 175.29 175.82 3hi7 s VAL 449 N -2.60 0.10 -0.13 1.09 0.11 -0.44 -4.29 120.40 114.24 3hi7 s VAL 449 Ca -0.00 -0.81 -0.11 0.00 -2.93 0.00 0.00 61.98 58.13 3hi7 s VAL 449 Cb -0.02 -0.34 -0.05 0.00 -1.53 0.00 0.00 36.38 34.45 3hi7 s VAL 449 CO -0.03 -0.44 0.23 -0.22 -3.33 0.00 0.00 175.10 171.31 3hi7 s LEU 450 N -1.42 4.31 -0.12 2.54 2.96 -0.44 -0.97 118.68 125.54 3hi7 s LEU 450 Ca -0.15 0.50 0.03 0.00 -0.22 0.00 0.00 54.13 54.29 3hi7 s LEU 450 Cb -0.09 -2.26 0.01 0.00 0.50 0.00 0.00 46.19 44.34 3hi7 s LEU 450 CO 0.00 0.23 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.35 3hi7 s VAL 451 N -0.18 2.01 -0.22 1.68 1.01 0.62 -0.50 120.40 124.82 3hi7 s VAL 451 Ca 0.15 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 3hi7 s VAL 451 Cb -0.13 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 3hi7 s VAL 451 CO 0.04 0.54 0.02 -0.22 0.00 0.00 0.00 175.10 175.49 3hi7 s LEU 452 N 0.57 3.32 0.01 3.92 2.96 -0.12 -1.27 118.68 128.08 3hi7 s LEU 452 Ca -0.14 -0.20 0.03 0.00 -0.22 0.00 0.00 54.13 53.60 3hi7 s LEU 452 Cb -0.17 -1.86 -0.01 0.00 0.50 0.00 0.00 46.19 44.65 3hi7 s LEU 452 CO 0.04 0.03 -0.09 -0.60 -1.32 0.00 0.00 176.35 174.42 3hi7 s ARG 453 N 1.19 0.65 0.24 1.98 3.52 -0.21 -0.86 118.95 125.46 3hi7 s ARG 453 Ca 0.04 -0.46 0.05 0.00 -0.13 0.00 0.00 55.73 55.23 3hi7 s ARG 453 Cb -0.14 -0.59 -0.02 0.00 -1.56 0.00 0.00 34.95 32.63 3hi7 s ARG 453 CO 0.02 0.15 0.20 -2.37 -0.81 0.00 0.00 175.30 172.49 3hi7 n THR 454 N 2.40 0.00 -4.33 4.11 5.66 -0.44 -1.40 114.28 120.29 3hi7 n THR 454 Ca -0.16 -1.74 -0.17 0.00 -3.05 0.00 0.00 64.05 58.93 3hi7 n THR 454 Cb 0.56 0.86 -0.10 0.00 -1.55 0.00 0.00 70.33 70.10 3hi7 n THR 454 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3hi7 s THR 455 N -2.96 0.74 -0.06 1.09 -4.23 -1.26 -0.72 115.64 108.25 3hi7 s THR 455 Ca 0.28 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.78 3hi7 s THR 455 Cb 0.01 -2.55 0.03 0.00 1.34 0.00 0.00 72.50 71.33 3hi7 s THR 455 CO 0.20 -0.11 -0.01 -0.94 -0.54 0.00 0.00 174.62 173.22 3hi7 s SER 456 N -3.32 1.22 -0.49 3.99 1.04 -0.11 -4.08 113.70 111.96 3hi7 s SER 456 Ca 0.34 -0.08 0.03 0.00 0.48 0.00 0.00 55.95 56.73 3hi7 s SER 456 Cb 0.07 -0.39 0.13 0.00 0.10 0.00 0.00 66.02 65.93 3hi7 s SER 456 CO 0.12 -0.15 0.25 -0.89 0.98 0.00 0.00 173.24 173.55 3hi7 s THR 457 N 1.58 2.14 0.12 2.02 2.01 -0.64 -1.11 115.64 121.76 3hi7 s THR 457 Ca -0.01 -3.02 -0.13 0.00 0.31 0.00 0.00 61.69 58.84 3hi7 s THR 457 Cb -0.13 -2.50 -0.05 0.00 0.01 0.00 0.00 72.50 69.84 3hi7 s THR 457 CO -0.03 -0.83 1.48 0.58 -0.69 0.00 0.00 174.62 175.13 3hi7 h VAL 458 N 5.43 1.29 0.00 3.82 2.07 -1.95 -3.46 116.25 123.45 3hi7 h VAL 458 Ca -0.06 -1.35 0.00 0.00 0.82 0.00 0.00 66.70 66.11 3hi7 h VAL 458 Cb 0.91 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 3hi7 h VAL 458 CO 0.61 0.45 0.00 0.00 0.02 0.00 0.00 177.57 178.65 3hi7 n TYR 459 N -4.26 0.00 0.55 1.57 9.36 -1.26 -5.12 117.16 118.00 3hi7 n TYR 459 Ca -0.02 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.22 3hi7 n TYR 459 Cb 0.43 0.00 0.13 0.00 -0.63 0.00 0.00 39.34 39.27 3hi7 n TYR 459 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 3hi7 n ASN 460 N -0.16 2.29 -3.35 2.98 6.94 -1.26 -4.99 115.26 117.70 3hi7 n ASN 460 Ca 0.00 -2.24 0.02 0.00 -0.02 0.00 0.00 54.58 52.34 3hi7 n ASN 460 Cb 0.00 -0.49 -0.03 0.00 -2.36 0.00 0.00 39.78 36.91 3hi7 n ASN 460 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3hi7 s ASP 462 N -0.38 -1.05 -0.12 0.53 1.11 -0.27 -0.60 116.67 115.90 3hi7 s ASP 462 Ca 0.17 1.01 -0.08 0.00 0.18 0.00 0.00 52.55 53.83 3hi7 s ASP 462 Cb 0.12 2.02 -0.04 0.00 1.07 0.00 0.00 42.92 46.09 3hi7 s ASP 462 CO 0.06 -0.20 0.15 -0.31 1.18 0.00 0.00 175.17 176.06 3hi7 s TYR 463 N 2.81 3.60 -0.23 4.23 2.02 -0.27 -0.86 117.35 128.66 3hi7 s TYR 463 Ca 0.05 0.55 -0.04 0.00 -0.37 0.00 0.00 57.07 57.26 3hi7 s TYR 463 Cb -0.12 -1.96 -0.01 0.00 -0.40 0.00 0.00 41.96 39.47 3hi7 s TYR 463 CO -0.18 0.72 -0.03 0.42 -1.57 0.00 0.00 175.55 174.91 3hi7 s ILE 464 N -1.00 3.45 -0.25 2.71 1.01 0.05 -0.94 121.20 126.23 3hi7 s ILE 464 Ca 0.15 -0.51 -0.06 0.00 0.00 0.00 0.00 60.65 60.24 3hi7 s ILE 464 Cb -0.12 -2.59 -0.01 0.00 0.01 0.00 0.00 42.46 39.75 3hi7 s ILE 464 CO 0.04 0.38 0.02 0.26 0.00 0.00 0.00 174.94 175.65 3hi7 s TRP 465 N 1.48 3.05 -0.02 3.97 0.52 0.11 -0.98 118.94 127.07 3hi7 s TRP 465 Ca 0.05 -0.83 0.08 0.00 0.02 0.00 0.00 56.10 55.42 3hi7 s TRP 465 Cb -0.15 -2.18 -0.02 0.00 -1.15 0.00 0.00 33.47 29.97 3hi7 s TRP 465 CO -0.03 -0.51 -0.26 -0.51 0.02 0.00 0.00 176.95 175.67 3hi7 s ASP 466 N 1.52 3.04 -0.13 2.95 1.01 0.27 -1.33 116.67 123.98 3hi7 s ASP 466 Ca 0.05 -0.47 0.03 0.00 0.71 0.00 0.00 52.55 52.86 3hi7 s ASP 466 Cb -0.15 -0.36 0.01 0.00 1.01 0.00 0.00 42.92 43.42 3hi7 s ASP 466 CO 0.00 0.32 -0.22 -0.36 0.21 0.00 0.00 175.17 175.12 3hi7 s PHE 467 N -0.59 2.66 -0.05 4.23 0.40 -0.04 -1.25 117.98 123.35 3hi7 s PHE 467 Ca 0.09 -1.25 0.05 0.00 -0.60 0.00 0.00 56.93 55.22 3hi7 s PHE 467 Cb -0.10 -1.80 -0.01 0.00 0.51 0.00 0.00 43.02 41.62 3hi7 s PHE 467 CO -0.01 -0.56 -0.21 0.42 0.70 0.00 0.00 175.22 175.56 3hi7 s ILE 468 N 0.72 1.73 -0.17 0.64 1.01 0.49 -0.94 121.20 124.69 3hi7 s ILE 468 Ca -0.09 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 59.67 3hi7 s ILE 468 Cb -0.16 -1.47 0.04 0.00 0.01 0.00 0.00 42.46 40.87 3hi7 s ILE 468 CO 0.00 0.49 -0.09 -0.36 0.00 0.00 0.00 174.94 174.98 3hi7 s PHE 469 N -0.09 2.03 0.24 3.97 0.40 0.34 -0.56 117.98 124.31 3hi7 s PHE 469 Ca -0.03 -1.26 -0.06 0.00 -0.60 0.00 0.00 56.93 54.99 3hi7 s PHE 469 Cb -0.12 -1.48 -0.06 0.00 0.51 0.00 0.00 43.02 41.87 3hi7 s PHE 469 CO 0.03 -0.66 0.51 0.71 0.70 0.00 0.00 175.22 176.50 3hi7 s TYR 470 N 1.53 3.46 -0.66 0.36 1.51 -0.29 -1.32 117.35 121.93 3hi7 s TYR 470 Ca 0.01 0.68 0.13 0.00 -1.01 0.00 0.00 57.07 56.88 3hi7 s TYR 470 Cb -0.15 -2.12 0.64 0.00 -0.11 0.00 0.00 41.96 40.23 3hi7 s TYR 470 CO -0.09 0.27 1.41 -2.30 -1.11 0.00 0.00 175.55 173.73 3hi7 n PRO 471 N -0.46 0.08 -0.87 -1.71 -0.02 -1.26 -2.28 135.00 128.48 3hi7 n PRO 471 Ca -0.01 0.49 0.02 0.00 -2.02 0.00 0.00 63.50 61.97 3hi7 n PRO 471 Cb 0.53 -1.71 0.34 0.00 -0.02 0.00 0.00 33.50 32.64 3hi7 n PRO 471 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3hi7 n ASN 472 N -1.86 5.03 0.00 2.55 6.94 -1.26 -4.03 115.26 122.62 3hi7 n ASN 472 Ca 0.01 -3.08 0.00 0.00 -0.02 0.00 0.00 54.58 51.48 3hi7 n ASN 472 Cb 0.08 -0.68 0.00 0.00 -2.36 0.00 0.00 39.78 36.82 3hi7 n ASN 472 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3hi7 n GLY 473 N 0.10 0.71 3.75 4.83 0.00 -0.96 -4.64 105.19 108.98 3hi7 n GLY 473 Ca 0.32 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.94 3hi7 n GLY 473 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hi7 s VAL 474 N -2.53 4.82 0.14 1.61 1.01 -1.26 -4.26 120.40 119.93 3hi7 s VAL 474 Ca 0.00 1.44 0.08 0.00 0.00 0.00 0.00 61.98 63.50 3hi7 s VAL 474 Cb 0.00 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 3hi7 s VAL 474 CO 0.00 0.39 -0.18 0.00 0.00 0.00 0.00 175.10 175.31 3hi7 s MET 475 N -0.13 1.19 -0.01 2.72 0.23 -0.42 -1.14 119.30 121.75 3hi7 s MET 475 Ca 0.35 -1.31 0.01 0.00 -1.03 0.00 0.00 55.69 53.71 3hi7 s MET 475 Cb -0.19 -1.28 -0.00 0.00 -1.53 0.00 0.00 34.83 31.83 3hi7 s MET 475 CO 0.20 0.27 -0.04 -2.00 -2.03 0.00 0.00 175.02 171.42 3hi7 s GLU 476 N -2.53 0.37 -0.12 3.16 2.12 0.28 -0.27 118.70 121.70 3hi7 s GLU 476 Ca 0.12 -0.14 -0.05 0.00 0.36 0.00 0.00 54.97 55.26 3hi7 s GLU 476 Cb -0.07 -0.37 -0.04 0.00 0.26 0.00 0.00 34.13 33.91 3hi7 s GLU 476 CO 0.05 0.07 0.06 0.00 -0.54 0.00 0.00 175.26 174.91 3hi7 s ALA 477 N 0.00 3.49 -0.01 6.30 0.00 -0.02 -0.37 121.76 131.14 3hi7 s ALA 477 Ca 0.00 -0.74 -0.02 0.00 0.00 0.00 0.00 51.96 51.20 3hi7 s ALA 477 Cb -0.03 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.34 3hi7 s ALA 477 CO -0.00 0.48 0.05 0.21 0.00 0.00 0.00 175.76 176.49 3hi7 s LYS 478 N -0.55 0.16 -0.07 0.00 2.20 -0.38 -1.59 119.74 119.51 3hi7 s LYS 478 Ca 0.11 -0.11 0.02 0.00 -0.36 0.00 0.00 55.97 55.63 3hi7 s LYS 478 Cb -0.12 0.07 0.01 0.00 -1.51 0.00 0.00 37.83 36.28 3hi7 s LYS 478 CO 0.02 -0.03 -0.14 1.41 -0.36 0.00 0.00 175.35 176.26 3hi7 s MET 479 N -0.42 1.90 -0.06 4.03 -2.45 -0.26 -0.57 119.30 121.48 3hi7 s MET 479 Ca -0.05 -0.48 0.04 0.00 -1.25 0.00 0.00 55.69 53.96 3hi7 s MET 479 Cb -0.03 -1.56 -0.02 0.00 1.25 0.00 0.00 34.83 34.47 3hi7 s MET 479 CO 0.00 0.03 -0.17 -1.01 1.05 0.00 0.00 175.02 174.92 3hi7 s HIS 480 N 0.68 2.62 -0.17 4.11 0.09 -0.15 -1.60 115.29 120.87 3hi7 s HIS 480 Ca -0.14 -0.34 -0.07 0.00 -0.00 0.00 0.00 55.06 54.50 3hi7 s HIS 480 Cb -0.16 -1.64 -0.04 0.00 -0.00 0.00 0.00 32.58 30.74 3hi7 s HIS 480 CO 0.04 0.04 0.08 0.00 -0.00 0.00 0.00 174.74 174.90 3hi7 s ALA 481 N -0.49 3.53 0.00 -1.40 0.00 -0.79 -0.77 121.76 121.85 3hi7 s ALA 481 Ca 0.06 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.30 3hi7 s ALA 481 Cb -0.12 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.06 3hi7 s ALA 481 CO 0.01 0.28 0.00 -2.37 0.00 0.00 0.00 175.76 173.68 3hi7 n THR 482 N 3.18 0.00 -3.26 0.00 5.66 -0.04 -3.92 114.28 115.90 3hi7 n THR 482 Ca -0.17 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.83 3hi7 n THR 482 Cb 0.53 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 3hi7 n THR 482 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3hi7 n GLY 483 N 0.00 -1.50 3.85 1.09 0.00 -1.22 -1.11 105.19 106.30 3hi7 n GLY 483 Ca 0.00 -1.43 -0.37 0.00 0.00 0.00 0.00 46.02 44.22 3hi7 n GLY 483 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hi7 s TYR 484 N 0.00 3.68 0.65 1.61 1.51 0.23 -0.65 117.35 124.39 3hi7 s TYR 484 Ca 0.00 0.89 -0.14 0.00 -1.01 0.00 0.00 57.07 56.80 3hi7 s TYR 484 Cb 0.00 -2.21 -0.01 0.00 -0.11 0.00 0.00 41.96 39.63 3hi7 s TYR 484 CO 0.00 0.64 1.08 0.14 -1.11 0.00 0.00 175.55 176.30 3hi7 s VAL 485 N -1.13 3.57 -0.20 0.71 -7.23 -1.26 -4.74 120.40 110.12 3hi7 s VAL 485 Ca 0.24 0.67 -0.29 0.00 -1.81 0.00 0.00 61.98 60.80 3hi7 s VAL 485 Cb -0.15 -3.22 0.00 0.00 0.56 0.00 0.00 36.38 33.57 3hi7 s VAL 485 CO 0.13 -0.51 1.07 -2.28 -0.31 0.00 0.00 175.10 173.20 3hi7 s HIS 486 N -2.55 3.29 0.06 2.82 2.46 -1.26 -4.85 115.29 115.26 3hi7 s HIS 486 Ca 0.64 1.42 0.01 0.00 0.47 0.00 0.00 55.06 57.59 3hi7 s HIS 486 Cb -0.17 -3.30 -0.03 0.00 -0.13 0.00 0.00 32.58 28.95 3hi7 s HIS 486 CO 0.44 -0.63 -0.06 0.00 -2.47 0.00 0.00 174.74 172.01 3hi7 s ALA 487 N 3.09 0.65 0.31 1.58 0.00 -1.26 -3.61 121.76 122.51 3hi7 s ALA 487 Ca 0.46 -1.03 0.03 0.00 0.00 0.00 0.00 51.96 51.42 3hi7 s ALA 487 Cb -0.16 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 3hi7 s ALA 487 CO 0.09 -0.18 0.12 0.95 0.00 0.00 0.00 175.76 176.74 3hi7 s THR 488 N -2.65 0.57 0.24 0.00 -4.23 -0.47 -4.90 115.64 104.21 3hi7 s THR 488 Ca 0.00 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.21 3hi7 s THR 488 Cb -0.01 -2.57 -0.09 0.00 1.34 0.00 0.00 72.50 71.17 3hi7 s THR 488 CO -0.03 0.00 1.24 0.12 -0.54 0.00 0.00 174.62 175.40 3hi7 s PHE 489 N -3.55 3.33 0.02 3.99 5.36 -1.26 -0.82 117.98 125.04 3hi7 s PHE 489 Ca 0.35 1.41 -0.30 0.00 -0.96 0.00 0.00 56.93 57.43 3hi7 s PHE 489 Cb 0.06 -3.51 -0.06 0.00 -0.34 0.00 0.00 43.02 39.17 3hi7 s PHE 489 CO 0.16 -1.42 1.44 -0.47 -1.46 0.00 0.00 175.22 173.46 3hi7 s TYR 490 N -0.45 2.82 0.13 10.12 6.14 -0.33 -4.62 117.35 131.16 3hi7 s TYR 490 Ca 0.52 0.75 0.01 0.00 0.64 0.00 0.00 57.07 58.99 3hi7 s TYR 490 Cb -0.35 -3.71 -0.04 0.00 0.42 0.00 0.00 41.96 38.27 3hi7 s TYR 490 CO 0.41 -2.67 -0.02 0.95 0.64 0.00 0.00 175.55 174.86 3hi7 s THR 491 N 2.32 0.60 0.39 4.34 -4.23 -1.26 -4.89 115.64 112.91 3hi7 s THR 491 Ca 0.65 -1.94 0.11 0.00 -1.18 0.00 0.00 61.69 59.33 3hi7 s THR 491 Cb -0.33 -1.88 0.33 0.00 1.34 0.00 0.00 72.50 71.95 3hi7 s THR 491 CO 0.28 -0.68 1.92 -0.65 -0.54 0.00 0.00 174.62 174.94 3hi7 h PRO 492 N 2.86 0.57 0.00 3.99 0.11 -2.02 -0.60 132.00 136.91 3hi7 h PRO 492 Ca -0.36 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 3hi7 h PRO 492 Cb 1.18 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 3hi7 h PRO 492 CO 0.63 0.38 -0.02 0.93 -0.21 0.00 0.00 178.00 179.71 3hi7 h GLU 493 N 0.59 0.00 0.00 1.05 3.07 -1.99 -2.06 114.58 115.23 3hi7 h GLU 493 Ca 0.37 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.20 3hi7 h GLU 493 Cb 0.61 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.52 3hi7 h GLU 493 CO -0.14 0.02 -0.13 0.78 -1.40 0.00 0.00 179.01 178.15 3hi7 h GLY 494 N 0.40 0.00 2.00 -3.84 0.00 -1.47 -2.89 103.07 97.27 3hi7 h GLY 494 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hi7 h GLY 494 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 3hi7 n LEU 495 N -3.94 0.65 0.00 3.11 4.77 -0.78 -0.76 117.00 120.06 3hi7 n LEU 495 Ca -0.02 0.71 0.13 0.00 -0.03 0.00 0.00 56.01 56.80 3hi7 n LEU 495 Cb 0.22 -0.69 0.58 0.00 -2.33 0.00 0.00 43.42 41.20 3hi7 n LEU 495 CO 0.32 -0.74 0.92 0.54 -1.33 0.00 0.00 177.39 177.10 3hi7 n ARG 496 N -2.28 0.12 -0.65 3.23 1.74 -1.09 -3.94 116.66 113.79 3hi7 n ARG 496 Ca 0.01 0.05 0.03 0.00 -0.77 0.00 0.00 57.85 57.17 3hi7 n ARG 496 Cb 0.15 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.13 3hi7 n ARG 496 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3hi7 n HIS 497 N -1.43 0.00 -3.98 -1.55 8.25 0.06 -5.03 115.22 111.55 3hi7 n HIS 497 Ca 0.08 -0.34 0.00 0.00 -0.26 0.00 0.00 57.72 57.20 3hi7 n HIS 497 Cb 0.27 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.28 3hi7 n HIS 497 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hi7 n GLY 498 N -0.18 -1.11 3.10 -1.41 0.00 -1.07 -0.58 105.19 103.94 3hi7 n GLY 498 Ca 0.05 -1.19 -0.24 0.00 0.00 0.00 0.00 46.02 44.64 3hi7 n GLY 498 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hi7 s THR 499 N -3.00 1.24 -0.03 2.61 2.01 -0.83 -4.41 115.64 113.23 3hi7 s THR 499 Ca 0.00 -0.62 -0.30 0.00 0.31 0.00 0.00 61.69 61.08 3hi7 s THR 499 Cb 0.00 -1.07 -0.05 0.00 0.01 0.00 0.00 72.50 71.39 3hi7 s THR 499 CO 0.00 0.36 1.34 -0.60 -0.69 0.00 0.00 174.62 175.04 3hi7 s ARG 500 N 0.03 4.29 -0.01 4.92 3.52 -1.26 -0.64 118.95 129.81 3hi7 s ARG 500 Ca -0.02 1.87 0.09 0.00 -0.13 0.00 0.00 55.73 57.53 3hi7 s ARG 500 Cb -0.10 -3.60 -0.12 0.00 -1.56 0.00 0.00 34.95 29.56 3hi7 s ARG 500 CO 0.01 -0.56 0.26 1.28 -0.81 0.00 0.00 175.30 175.48 3hi7 n LEU 501 N 5.51 0.16 0.00 -0.88 4.77 0.04 -4.79 117.00 121.81 3hi7 n LEU 501 Ca 0.13 -0.19 -0.05 0.00 -0.03 0.00 0.00 56.01 55.87 3hi7 n LEU 501 Cb 0.44 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.55 3hi7 n LEU 501 CO 0.58 0.04 0.34 1.57 -1.33 0.00 0.00 177.39 178.58 3hi7 n HIS 502 N -1.58 -1.65 -0.15 -1.77 -0.00 -1.21 -4.91 115.22 103.94 3hi7 n HIS 502 Ca -0.00 -1.01 -0.02 0.00 0.46 0.00 0.00 57.72 57.14 3hi7 n HIS 502 Cb 0.19 0.50 0.06 0.00 -0.12 0.00 0.00 29.99 30.63 3hi7 n HIS 502 CO 0.00 0.00 0.00 1.15 0.46 0.00 0.00 176.34 177.95 3hi7 h THR 503 N 1.57 0.67 -0.17 3.57 2.02 -1.99 -2.99 112.91 115.58 3hi7 h THR 503 Ca -0.19 -0.06 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 3hi7 h THR 503 Cb 0.71 0.49 -0.00 0.00 -1.74 0.00 0.00 68.15 67.61 3hi7 h THR 503 CO 0.24 0.03 -0.00 1.41 0.37 0.00 0.00 175.52 177.57 3hi7 n HIS 504 N -5.17 0.62 -4.30 3.16 8.25 -1.26 -4.85 115.22 111.67 3hi7 n HIS 504 Ca 0.05 -0.94 -0.25 0.00 -0.26 0.00 0.00 57.72 56.32 3hi7 n HIS 504 Cb 0.25 -0.26 -0.17 0.00 1.12 0.00 0.00 29.99 30.93 3hi7 n HIS 504 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3hi7 s LEU 505 N -2.86 1.45 -0.17 2.41 2.96 -1.13 -1.19 118.68 120.15 3hi7 s LEU 505 Ca 0.39 -0.29 -0.03 0.00 -0.22 0.00 0.00 54.13 53.98 3hi7 s LEU 505 Cb 0.32 -0.81 -0.02 0.00 0.50 0.00 0.00 46.19 46.18 3hi7 s LEU 505 CO 0.07 -0.03 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.39 3hi7 s ILE 506 N 1.08 3.66 -0.53 6.68 -1.09 -0.01 -0.78 121.20 130.22 3hi7 s ILE 506 Ca -0.07 -0.43 -0.25 0.00 -2.23 0.00 0.00 60.65 57.68 3hi7 s ILE 506 Cb -0.14 -2.62 0.04 0.00 -1.58 0.00 0.00 42.46 38.16 3hi7 s ILE 506 CO -0.01 0.47 0.96 -0.83 -1.23 0.00 0.00 174.94 174.30 3hi7 s GLY 507 N 0.70 1.40 0.29 6.18 0.00 0.18 -1.37 107.32 114.71 3hi7 s GLY 507 Ca -0.02 -1.07 -0.29 0.00 0.00 0.00 0.00 44.72 43.34 3hi7 s GLY 507 CO 0.02 2.09 1.35 -1.31 0.00 0.00 0.00 173.10 175.25 3hi7 s ASN 508 N 2.68 6.75 0.35 1.64 -0.87 -1.24 -1.96 114.94 122.29 3hi7 s ASN 508 Ca 0.33 2.64 -0.29 0.00 -1.57 0.00 0.00 52.86 53.98 3hi7 s ASN 508 Cb -0.11 -2.64 -0.11 0.00 -0.02 0.00 0.00 41.25 38.37 3hi7 s ASN 508 CO 0.22 -0.59 1.48 -0.51 -2.57 0.00 0.00 177.10 175.13 3hi7 s ILE 509 N -0.60 2.16 0.23 0.60 2.07 0.25 -4.59 121.20 121.32 3hi7 s ILE 509 Ca 0.53 0.16 -0.21 0.00 -1.41 0.00 0.00 60.65 59.72 3hi7 s ILE 509 Cb -0.40 -3.10 0.04 0.00 0.13 0.00 0.00 42.46 39.13 3hi7 s ILE 509 CO 0.48 0.03 0.66 -1.38 -1.91 0.00 0.00 174.94 172.82 3hi7 s HIS 510 N -0.85 -0.30 -0.10 3.50 -3.43 -1.04 -2.09 115.29 110.98 3hi7 s HIS 510 Ca 0.55 -0.05 0.03 0.00 -0.80 0.00 0.00 55.06 54.79 3hi7 s HIS 510 Cb -0.46 0.62 -0.00 0.00 -1.43 0.00 0.00 32.58 31.31 3hi7 s HIS 510 CO 0.58 -1.07 -0.22 0.99 -2.00 0.00 0.00 174.74 173.02 3hi7 s THR 511 N -3.86 2.25 -0.05 -5.38 2.01 -0.78 -0.48 115.64 109.37 3hi7 s THR 511 Ca 0.07 -0.95 -0.23 0.00 0.31 0.00 0.00 61.69 60.89 3hi7 s THR 511 Cb -0.04 -1.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.56 3hi7 s THR 511 CO -0.01 0.55 0.70 -1.00 -0.69 0.00 0.00 174.62 174.17 3hi7 s HIS 512 N 0.29 3.61 -0.03 4.92 3.76 -0.19 -1.57 115.29 126.08 3hi7 s HIS 512 Ca -0.16 1.27 0.02 0.00 -0.15 0.00 0.00 55.06 56.04 3hi7 s HIS 512 Cb -0.17 -2.78 0.01 0.00 1.11 0.00 0.00 32.58 30.74 3hi7 s HIS 512 CO 0.08 0.14 -0.08 -0.51 -0.85 0.00 0.00 174.74 173.52 3hi7 s LEU 513 N 0.60 1.69 -0.04 0.89 1.43 -0.42 -1.26 118.68 121.58 3hi7 s LEU 513 Ca 0.37 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 3hi7 s LEU 513 Cb -0.18 -0.50 -0.00 0.00 0.03 0.00 0.00 46.19 45.54 3hi7 s LEU 513 CO 0.19 0.03 -0.17 -0.69 0.23 0.00 0.00 176.35 175.94 3hi7 s VAL 514 N 0.35 1.37 -0.10 -1.59 1.01 0.44 -0.31 120.40 121.58 3hi7 s VAL 514 Ca -0.05 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.23 3hi7 s VAL 514 Cb -0.10 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 3hi7 s VAL 514 CO 0.00 0.40 -0.09 -2.28 0.00 0.00 0.00 175.10 173.13 3hi7 s HIS 515 N -0.04 2.89 0.05 5.22 2.46 -0.55 -1.24 115.29 124.08 3hi7 s HIS 515 Ca -0.02 -0.21 0.09 0.00 0.47 0.00 0.00 55.06 55.39 3hi7 s HIS 515 Cb -0.10 -1.78 -0.03 0.00 -0.13 0.00 0.00 32.58 30.54 3hi7 s HIS 515 CO 0.01 0.12 -0.25 0.71 -2.47 0.00 0.00 174.74 172.87 3hi7 s TYR 516 N -0.32 2.18 -0.23 3.88 1.51 -0.08 -0.78 117.35 123.51 3hi7 s TYR 516 Ca 0.04 -0.40 -0.11 0.00 -1.01 0.00 0.00 57.07 55.59 3hi7 s TYR 516 Cb -0.13 -1.29 -0.05 0.00 -0.11 0.00 0.00 41.96 40.38 3hi7 s TYR 516 CO 0.02 0.14 0.17 0.50 -1.11 0.00 0.00 175.55 175.27 3hi7 s ARG 517 N -1.30 4.09 -0.54 -0.62 3.52 -0.37 -1.20 118.95 122.53 3hi7 s ARG 517 Ca 0.11 -0.23 0.04 0.00 -0.13 0.00 0.00 55.73 55.51 3hi7 s ARG 517 Cb -0.10 -3.52 0.15 0.00 -1.56 0.00 0.00 34.95 29.92 3hi7 s ARG 517 CO 0.02 0.08 0.35 0.08 -0.81 0.00 0.00 175.30 175.03 3hi7 s VAL 518 N 0.99 1.88 -1.28 7.11 1.01 0.11 -0.96 120.40 129.25 3hi7 s VAL 518 Ca 0.08 -3.29 -0.15 0.00 0.00 0.00 0.00 61.98 58.62 3hi7 s VAL 518 Cb -0.13 -2.27 0.11 0.00 0.00 0.00 0.00 36.38 34.09 3hi7 s VAL 518 CO 0.04 -0.99 1.68 -0.67 0.00 0.00 0.00 175.10 175.16 3hi7 n ASP 519 N 2.78 4.97 -4.75 3.32 2.03 0.11 -0.97 116.55 124.04 3hi7 n ASP 519 Ca 0.16 -2.95 -0.41 0.00 0.52 0.00 0.00 54.79 52.11 3hi7 n ASP 519 Cb 0.37 -1.66 -0.03 0.00 -0.72 0.00 0.00 41.12 39.09 3hi7 n ASP 519 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3hi7 s LEU 520 N 2.74 4.43 -0.60 -2.67 1.43 -1.26 -0.74 118.68 122.01 3hi7 s LEU 520 Ca 0.48 2.47 0.05 0.00 -1.03 0.00 0.00 54.13 56.10 3hi7 s LEU 520 Cb 0.03 -3.62 0.17 0.00 0.03 0.00 0.00 46.19 42.80 3hi7 s LEU 520 CO 0.03 -0.50 0.44 0.47 0.23 0.00 0.00 176.35 177.02 3hi7 n ASP 521 N 2.07 1.71 -4.60 2.29 9.92 -0.34 -4.57 116.55 123.03 3hi7 n ASP 521 Ca 0.04 -2.90 -0.43 0.00 -0.53 0.00 0.00 54.79 50.97 3hi7 n ASP 521 Cb 0.43 -0.68 -0.02 0.00 -0.64 0.00 0.00 41.12 40.20 3hi7 n ASP 521 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3hi7 s VAL 522 N -0.91 3.82 -1.26 2.53 1.01 -1.23 -2.10 120.40 122.26 3hi7 s VAL 522 Ca 0.28 0.85 -0.01 0.00 0.00 0.00 0.00 61.98 63.10 3hi7 s VAL 522 Cb -0.01 -4.05 0.01 0.00 0.00 0.00 0.00 36.38 32.33 3hi7 s VAL 522 CO -0.18 -0.63 0.07 0.00 0.00 0.00 0.00 175.10 174.36 3hi7 n ALA 523 N 9.01 -0.78 0.00 5.51 0.00 0.02 -4.53 120.51 129.74 3hi7 n ALA 523 Ca 0.18 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.74 3hi7 n ALA 523 Cb 0.47 -1.88 0.00 0.00 0.00 0.00 0.00 19.45 18.04 3hi7 n ALA 523 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hi7 n GLY 524 N -0.92 0.83 0.16 0.00 0.00 -0.89 -4.89 105.19 99.48 3hi7 n GLY 524 Ca -0.16 -2.22 -0.15 0.00 0.00 0.00 0.00 46.02 43.49 3hi7 n GLY 524 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hi7 h THR 525 N 0.00 1.37 -3.51 2.61 1.03 -1.84 -3.40 112.91 109.17 3hi7 h THR 525 Ca 0.00 -1.72 -0.62 0.00 -0.01 0.00 0.00 66.41 64.07 3hi7 h THR 525 Cb 0.00 2.11 -0.12 0.00 -1.07 0.00 0.00 68.15 69.07 3hi7 h THR 525 CO 0.00 0.51 0.24 -0.54 -0.01 0.00 0.00 175.52 175.72 3hi7 s LYS 526 N -3.82 3.87 0.29 0.00 1.02 -1.26 -3.78 119.74 116.05 3hi7 s LYS 526 Ca -0.13 0.34 0.03 0.00 0.02 0.00 0.00 55.97 56.23 3hi7 s LYS 526 Cb 0.06 -3.75 -0.06 0.00 -0.52 0.00 0.00 37.83 33.56 3hi7 s LYS 526 CO 0.81 -0.66 0.05 -0.80 -0.92 0.00 0.00 175.35 173.83 3hi7 s ASN 527 N 1.68 1.97 0.37 2.83 0.02 0.42 -4.60 114.94 117.63 3hi7 s ASN 527 Ca 0.28 -1.34 0.04 0.00 -1.02 0.00 0.00 52.86 50.82 3hi7 s ASN 527 Cb -0.14 -0.00 -0.06 0.00 0.02 0.00 0.00 41.25 41.06 3hi7 s ASN 527 CO 0.13 -0.61 0.05 -0.44 0.02 0.00 0.00 177.10 176.25 3hi7 s SER 528 N -3.40 2.97 -0.08 -1.22 0.01 -0.12 -1.44 113.70 110.42 3hi7 s SER 528 Ca 0.35 -1.44 0.04 0.00 1.31 0.00 0.00 55.95 56.21 3hi7 s SER 528 Cb 0.08 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.27 3hi7 s SER 528 CO 0.13 -0.63 -0.19 0.12 0.41 0.00 0.00 173.24 173.08 3hi7 s PHE 529 N -3.10 2.08 0.08 2.43 5.36 -1.26 -0.50 117.98 123.07 3hi7 s PHE 529 Ca 0.32 -0.80 -0.05 0.00 -0.96 0.00 0.00 56.93 55.44 3hi7 s PHE 529 Cb 0.08 -1.42 -0.02 0.00 -0.34 0.00 0.00 43.02 41.31 3hi7 s PHE 529 CO 0.15 -0.34 0.09 1.14 -1.46 0.00 0.00 175.22 174.80 3hi7 s GLN 530 N 0.40 0.77 0.13 10.12 -2.07 -0.16 -3.03 119.66 125.82 3hi7 s GLN 530 Ca -0.15 -1.12 0.07 0.00 -1.82 0.00 0.00 55.36 52.33 3hi7 s GLN 530 Cb -0.16 0.28 -0.04 0.00 -1.09 0.00 0.00 33.01 32.00 3hi7 s GLN 530 CO 0.06 -0.21 -0.15 0.95 -1.32 0.00 0.00 175.29 174.62 3hi7 s THR 531 N -3.91 1.45 0.03 3.63 -4.23 -0.69 -0.74 115.64 111.18 3hi7 s THR 531 Ca 0.08 -1.73 0.08 0.00 -1.18 0.00 0.00 61.69 58.95 3hi7 s THR 531 Cb 0.06 -1.58 -0.02 0.00 1.34 0.00 0.00 72.50 72.30 3hi7 s THR 531 CO -0.09 -0.36 -0.24 -0.76 -0.54 0.00 0.00 174.62 172.63 3hi7 s LEU 532 N -2.43 2.13 0.12 4.79 1.43 -0.96 -0.37 118.68 123.40 3hi7 s LEU 532 Ca 0.10 -0.53 0.03 0.00 -1.03 0.00 0.00 54.13 52.70 3hi7 s LEU 532 Cb -0.06 -1.21 -0.04 0.00 0.03 0.00 0.00 46.19 44.91 3hi7 s LEU 532 CO 0.04 0.25 -0.09 -1.10 0.23 0.00 0.00 176.35 175.68 3hi7 s GLN 533 N -1.02 0.95 -0.07 1.70 1.11 0.01 -3.45 119.66 118.89 3hi7 s GLN 533 Ca 0.10 -1.36 -0.16 0.00 0.01 0.00 0.00 55.36 53.95 3hi7 s GLN 533 Cb -0.10 -0.47 -0.05 0.00 -1.01 0.00 0.00 33.01 31.39 3hi7 s GLN 533 CO 0.01 0.05 0.43 1.41 0.01 0.00 0.00 175.29 177.19 3hi7 s MET 534 N -3.60 4.16 -0.03 2.91 1.75 -1.26 -0.93 119.30 122.30 3hi7 s MET 534 Ca 0.13 0.39 0.02 0.00 -1.25 0.00 0.00 55.69 54.98 3hi7 s MET 534 Cb 0.02 -3.34 0.01 0.00 2.84 0.00 0.00 34.83 34.36 3hi7 s MET 534 CO -0.01 0.39 -0.07 0.21 -0.65 0.00 0.00 175.02 174.89 3hi7 s LYS 535 N -0.12 0.85 0.45 4.11 2.20 -0.42 -4.94 119.74 121.87 3hi7 s LYS 535 Ca 0.24 -0.21 -0.21 0.00 -0.36 0.00 0.00 55.97 55.43 3hi7 s LYS 535 Cb -0.16 -0.81 -0.09 0.00 -1.51 0.00 0.00 37.83 35.26 3hi7 s LYS 535 CO 0.11 0.03 1.02 -0.51 -0.36 0.00 0.00 175.35 175.64 3hi7 s LEU 536 N 0.46 3.94 0.25 5.43 1.43 -1.26 -0.30 118.68 128.62 3hi7 s LEU 536 Ca -0.07 1.91 0.11 0.00 -1.03 0.00 0.00 54.13 55.06 3hi7 s LEU 536 Cb -0.10 -4.46 -0.05 0.00 0.03 0.00 0.00 46.19 41.61 3hi7 s LEU 536 CO 0.00 -0.64 -0.18 -1.83 0.23 0.00 0.00 176.35 173.94 3hi7 s GLU 537 N -3.04 1.73 -0.30 1.70 -1.05 0.13 -4.87 118.70 113.01 3hi7 s GLU 537 Ca 0.64 -1.62 0.00 0.00 -0.15 0.00 0.00 54.97 53.84 3hi7 s GLU 537 Cb -0.16 -1.86 0.09 0.00 -0.44 0.00 0.00 34.13 31.75 3hi7 s GLU 537 CO 0.20 0.36 0.06 1.21 0.95 0.00 0.00 175.26 178.05 3hi7 s ASN 538 N -3.24 4.08 0.28 0.83 3.84 -1.26 -1.30 114.94 118.17 3hi7 s ASN 538 Ca 0.27 -1.62 0.12 0.00 0.21 0.00 0.00 52.86 51.83 3hi7 s ASN 538 Cb -0.06 -1.04 -0.05 0.00 -0.55 0.00 0.00 41.25 39.55 3hi7 s ASN 538 CO 0.14 -0.38 -0.17 0.27 -2.79 0.00 0.00 177.10 174.17 3hi7 s ILE 539 N 1.46 2.57 0.22 -5.21 -4.36 -0.04 -4.97 121.20 110.88 3hi7 s ILE 539 Ca 0.07 -2.34 -0.31 0.00 -0.26 0.00 0.00 60.65 57.81 3hi7 s ILE 539 Cb -0.18 -2.38 -0.11 0.00 1.25 0.00 0.00 42.46 41.04 3hi7 s ILE 539 CO -0.18 -0.38 1.64 -0.89 0.24 0.00 0.00 174.94 175.37 3hi7 s THR 540 N -2.50 2.21 -0.12 8.37 2.01 -1.26 -0.44 115.64 123.91 3hi7 s THR 540 Ca 0.30 0.16 -0.29 0.00 0.31 0.00 0.00 61.69 62.17 3hi7 s THR 540 Cb -0.05 -3.10 -0.06 0.00 0.01 0.00 0.00 72.50 69.30 3hi7 s THR 540 CO 0.16 0.02 1.93 0.21 -0.69 0.00 0.00 174.62 176.24 3hi7 s ASN 541 N 0.96 6.14 0.59 3.53 3.84 -0.47 -4.62 114.94 124.92 3hi7 s ASN 541 Ca 0.70 2.11 0.38 0.00 0.21 0.00 0.00 52.86 56.26 3hi7 s ASN 541 Cb -0.47 -2.52 1.79 0.00 -0.55 0.00 0.00 41.25 39.49 3hi7 s ASN 541 CO 0.36 -1.38 2.13 1.55 -2.79 0.00 0.00 177.10 176.97 3hi7 h PRO 542 N 11.94 0.00 -0.09 0.43 0.13 -1.91 -2.35 132.00 140.14 3hi7 h PRO 542 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 3hi7 h PRO 542 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3hi7 h PRO 542 CO 0.97 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 176.07 3hi7 n TRP 543 N -3.07 0.10 -2.95 1.56 4.27 -1.26 -4.73 117.44 111.36 3hi7 n TRP 543 Ca -0.01 -0.08 -0.11 0.00 -3.89 0.00 0.00 57.50 53.40 3hi7 n TRP 543 Cb 0.21 -0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.14 3hi7 n TRP 543 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 3hi7 n SER 544 N 0.81 -2.47 0.00 -0.67 2.88 -0.90 -5.05 113.62 108.23 3hi7 n SER 544 Ca 0.10 -2.79 0.05 0.00 -1.33 0.00 0.00 58.87 54.89 3hi7 n SER 544 Cb 0.38 1.04 0.23 0.00 -0.75 0.00 0.00 64.21 65.11 3hi7 n SER 544 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3hi7 n PRO 545 N 2.74 0.06 0.03 -1.46 -0.05 -1.12 -0.66 135.00 134.54 3hi7 n PRO 545 Ca 0.21 0.27 0.13 0.00 -0.05 0.00 0.00 63.50 64.06 3hi7 n PRO 545 Cb 0.54 -1.50 0.53 0.00 -0.05 0.00 0.00 33.50 33.02 3hi7 n PRO 545 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 175.50 175.99 3hi7 n ARG 546 N -1.41 0.07 -4.13 0.54 1.74 -1.26 -4.73 116.66 107.49 3hi7 n ARG 546 Ca 0.03 0.10 -0.26 0.00 -0.77 0.00 0.00 57.85 56.95 3hi7 n ARG 546 Cb 0.10 -1.59 -0.05 0.00 -1.02 0.00 0.00 32.46 29.89 3hi7 n ARG 546 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3hi7 s HIS 547 N -3.04 2.23 0.17 -1.55 3.76 0.16 -5.04 115.29 111.98 3hi7 s HIS 547 Ca 0.12 -0.71 0.11 0.00 -0.15 0.00 0.00 55.06 54.43 3hi7 s HIS 547 Cb 0.16 -1.91 -0.04 0.00 1.11 0.00 0.00 32.58 31.90 3hi7 s HIS 547 CO 0.51 -0.01 -0.24 1.03 -0.85 0.00 0.00 174.74 175.18 3hi7 s ARG 548 N -4.02 1.46 -0.21 1.40 1.81 -1.26 -1.36 118.95 116.78 3hi7 s ARG 548 Ca 0.34 -1.47 -0.02 0.00 -1.72 0.00 0.00 55.73 52.86 3hi7 s ARG 548 Cb 0.02 -1.82 -0.00 0.00 -0.45 0.00 0.00 34.95 32.70 3hi7 s ARG 548 CO 0.19 0.40 -0.09 0.08 -0.68 0.00 0.00 175.30 175.21 3hi7 s VAL 549 N -1.52 3.00 -0.29 3.52 1.01 0.41 -4.63 120.40 121.89 3hi7 s VAL 549 Ca 0.18 -0.62 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 3hi7 s VAL 549 Cb -0.08 -2.34 0.04 0.00 0.00 0.00 0.00 36.38 34.00 3hi7 s VAL 549 CO 0.09 0.46 -0.00 -0.69 0.00 0.00 0.00 175.10 174.95 3hi7 s VAL 550 N 1.38 3.06 0.09 2.92 1.01 -1.26 -0.86 120.40 126.74 3hi7 s VAL 550 Ca 0.05 -1.26 -0.13 0.00 0.00 0.00 0.00 61.98 60.65 3hi7 s VAL 550 Cb -0.14 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.55 3hi7 s VAL 550 CO -0.06 -0.04 0.29 0.00 0.00 0.00 0.00 175.10 175.30 3hi7 s GLN 551 N 1.29 0.91 0.38 2.72 -2.07 -0.42 -4.96 119.66 117.51 3hi7 s GLN 551 Ca -0.04 -0.74 -0.27 0.00 -1.82 0.00 0.00 55.36 52.49 3hi7 s GLN 551 Cb -0.19 0.39 -0.11 0.00 -1.09 0.00 0.00 33.01 32.01 3hi7 s GLN 551 CO -0.01 -0.31 1.42 -2.30 -1.32 0.00 0.00 175.29 172.76 3hi7 n PRO 552 N 0.07 2.43 -4.32 9.60 -0.02 -1.26 -0.69 135.00 140.81 3hi7 n PRO 552 Ca -0.16 0.86 -0.17 0.00 -2.02 0.00 0.00 63.50 62.00 3hi7 n PRO 552 Cb 0.62 -2.56 -0.10 0.00 -0.02 0.00 0.00 33.50 31.44 3hi7 n PRO 552 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3hi7 s THR 553 N -1.13 1.17 -0.26 3.45 -4.23 0.59 -4.83 115.64 110.41 3hi7 s THR 553 Ca 0.55 -2.06 -0.10 0.00 -1.18 0.00 0.00 61.69 58.90 3hi7 s THR 553 Cb -0.50 -2.22 -0.05 0.00 1.34 0.00 0.00 72.50 71.08 3hi7 s THR 553 CO 0.62 -0.44 0.15 -0.22 -0.54 0.00 0.00 174.62 174.20 3hi7 s LEU 554 N -3.29 3.92 -0.11 4.79 2.96 -1.26 -1.30 118.68 124.39 3hi7 s LEU 554 Ca 0.25 -0.01 0.02 0.00 -0.22 0.00 0.00 54.13 54.17 3hi7 s LEU 554 Cb 0.04 -2.07 -0.01 0.00 0.50 0.00 0.00 46.19 44.65 3hi7 s LEU 554 CO 0.07 -0.01 -0.18 -0.70 -1.32 0.00 0.00 176.35 174.21 3hi7 s GLU 555 N 1.50 3.13 -0.09 1.98 2.12 -0.10 -4.95 118.70 122.28 3hi7 s GLU 555 Ca 0.07 -0.77 0.01 0.00 0.36 0.00 0.00 54.97 54.64 3hi7 s GLU 555 Cb -0.15 -2.46 -0.02 0.00 0.26 0.00 0.00 34.13 31.76 3hi7 s GLU 555 CO 0.08 0.25 -0.12 1.14 -0.54 0.00 0.00 175.26 176.06 3hi7 s GLN 556 N 0.22 2.93 -0.12 4.30 1.03 -1.26 -0.81 119.66 125.95 3hi7 s GLN 556 Ca -0.12 -0.65 0.03 0.00 0.04 0.00 0.00 55.36 54.66 3hi7 s GLN 556 Cb -0.16 -2.54 0.01 0.00 0.03 0.00 0.00 33.01 30.35 3hi7 s GLN 556 CO 0.06 0.46 -0.21 0.99 -2.54 0.00 0.00 175.29 174.05 3hi7 s THR 557 N -0.30 1.96 0.16 3.63 2.01 0.50 -5.00 115.64 118.60 3hi7 s THR 557 Ca 0.03 -0.93 -0.02 0.00 0.31 0.00 0.00 61.69 61.08 3hi7 s THR 557 Cb -0.13 -1.73 -0.05 0.00 0.01 0.00 0.00 72.50 70.61 3hi7 s THR 557 CO 0.03 0.53 0.35 -1.10 -0.69 0.00 0.00 174.62 173.74 3hi7 s GLN 558 N 0.71 3.53 -0.09 4.92 -1.52 -1.26 -1.71 119.66 124.24 3hi7 s GLN 558 Ca -0.10 -0.30 0.03 0.00 -1.95 0.00 0.00 55.36 53.03 3hi7 s GLN 558 Cb -0.16 -2.88 0.01 0.00 -0.22 0.00 0.00 33.01 29.76 3hi7 s GLN 558 CO 0.01 0.46 -0.17 0.71 -0.25 0.00 0.00 175.29 176.05 3hi7 s TYR 559 N -1.74 1.96 -0.14 0.91 1.51 -1.17 -5.00 117.35 113.67 3hi7 s TYR 559 Ca 0.38 -0.83 0.11 0.00 -1.01 0.00 0.00 57.07 55.72 3hi7 s TYR 559 Cb -0.12 -1.38 -0.16 0.00 -0.11 0.00 0.00 41.96 40.19 3hi7 s TYR 559 CO 0.28 -0.39 0.02 0.43 -1.11 0.00 0.00 175.55 174.77 3hi7 n SER 560 N 3.88 1.72 -4.24 2.29 7.64 -1.26 -4.55 113.62 119.10 3hi7 n SER 560 Ca -0.20 -0.01 -0.23 0.00 1.01 0.00 0.00 58.87 59.43 3hi7 n SER 560 Cb 0.52 0.67 -0.13 0.00 -1.01 0.00 0.00 64.21 64.26 3hi7 n SER 560 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 3hi7 s TRP 561 N -2.34 1.61 0.24 1.43 0.52 -1.26 -0.53 118.94 118.61 3hi7 s TRP 561 Ca -0.10 -0.40 -0.09 0.00 0.02 0.00 0.00 56.10 55.53 3hi7 s TRP 561 Cb 0.04 -0.91 0.39 0.00 -1.15 0.00 0.00 33.47 31.84 3hi7 s TRP 561 CO 0.55 0.13 1.63 0.93 0.02 0.00 0.00 176.95 180.20 3hi7 h GLU 562 N 4.43 0.06 -0.34 4.98 5.08 -1.27 -2.11 114.58 125.42 3hi7 h GLU 562 Ca -0.43 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 57.95 3hi7 h GLU 562 Cb 1.18 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 3hi7 h GLU 562 CO 0.41 0.04 0.23 -0.09 -1.00 0.00 0.00 179.01 178.60 3hi7 h ARG 563 N 0.06 0.33 0.00 2.33 9.65 -1.87 -0.42 114.38 124.46 3hi7 h ARG 563 Ca 0.39 -0.02 -0.06 0.00 -1.10 0.00 0.00 59.98 59.20 3hi7 h ARG 563 Cb 0.66 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.16 3hi7 h ARG 563 CO -0.69 0.22 -0.27 1.96 2.80 0.00 0.00 179.97 183.99 3hi7 h GLN 564 N 0.34 0.00 -0.71 0.20 4.20 -1.79 -2.91 115.11 114.45 3hi7 h GLN 564 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 3hi7 h GLN 564 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 3hi7 h GLN 564 CO -0.03 0.27 0.00 0.00 -0.67 0.00 0.00 178.83 178.40 3hi7 n ALA 565 N -2.46 2.49 -3.19 3.87 0.00 -0.20 -4.77 120.51 116.25 3hi7 n ALA 565 Ca -0.02 -1.35 -0.45 0.00 0.00 0.00 0.00 53.44 51.61 3hi7 n ALA 565 Cb 0.33 -0.92 -0.04 0.00 0.00 0.00 0.00 19.45 18.82 3hi7 n ALA 565 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hi7 s ALA 566 N -1.15 3.63 -0.29 0.00 0.00 -0.99 -3.22 121.76 119.74 3hi7 s ALA 566 Ca 0.48 -2.65 -0.21 0.00 0.00 0.00 0.00 51.96 49.58 3hi7 s ALA 566 Cb 0.26 -3.54 -0.01 0.00 0.00 0.00 0.00 23.12 19.83 3hi7 s ALA 566 CO 0.31 -2.34 0.66 -0.06 0.00 0.00 0.00 175.76 174.33 3hi7 s PHE 567 N 1.80 3.24 0.61 0.00 0.40 -0.11 -5.00 117.98 118.91 3hi7 s PHE 567 Ca 0.14 0.72 -0.10 0.00 -0.60 0.00 0.00 56.93 57.09 3hi7 s PHE 567 Cb -0.19 -2.98 -0.03 0.00 0.51 0.00 0.00 43.02 40.33 3hi7 s PHE 567 CO -0.00 -0.44 0.99 1.03 0.70 0.00 0.00 175.22 177.50 3hi7 s ARG 568 N 2.64 3.45 0.51 0.44 0.52 -1.26 -3.24 118.95 122.01 3hi7 s ARG 568 Ca 0.27 0.57 0.16 0.00 -0.52 0.00 0.00 55.73 56.21 3hi7 s ARG 568 Cb -0.15 -2.13 1.24 0.00 0.52 0.00 0.00 34.95 34.42 3hi7 s ARG 568 CO 0.11 -0.58 2.13 0.74 0.02 0.00 0.00 175.30 177.72 3hi7 h PHE 569 N -0.26 0.00 0.00 -0.53 -1.00 -1.92 -1.52 116.94 111.70 3hi7 h PHE 569 Ca -0.45 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.27 3hi7 h PHE 569 Cb 1.20 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.76 3hi7 h PHE 569 CO 0.61 0.02 -0.28 0.87 -1.61 0.00 0.00 178.31 177.93 3hi7 h LYS 570 N 0.00 0.00 -7.04 1.51 1.57 -1.93 -3.45 116.57 107.23 3hi7 h LYS 570 Ca -0.00 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.33 3hi7 h LYS 570 Cb 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 3hi7 h LYS 570 CO 0.00 0.28 0.35 0.50 -0.57 0.00 0.00 179.45 180.01 3hi7 s ARG 571 N -4.17 4.18 -0.25 3.15 3.52 -0.57 -5.00 118.95 119.81 3hi7 s ARG 571 Ca -0.03 1.20 -0.29 0.00 -0.13 0.00 0.00 55.73 56.49 3hi7 s ARG 571 Cb 0.14 -2.24 -0.02 0.00 -1.56 0.00 0.00 34.95 31.27 3hi7 s ARG 571 CO 0.68 -0.08 1.51 -1.59 -0.81 0.00 0.00 175.30 175.01 3hi7 s LYS 572 N -3.05 3.82 -0.19 5.12 0.00 -1.26 -4.87 119.74 119.32 3hi7 s LYS 572 Ca 0.62 1.50 -0.29 0.00 0.00 0.00 0.00 55.97 57.79 3hi7 s LYS 572 Cb -0.12 -3.99 -0.00 0.00 0.00 0.00 0.00 37.83 33.73 3hi7 s LYS 572 CO 0.16 -1.25 1.09 -1.17 0.00 0.00 0.00 175.35 174.18 3hi7 s LEU 573 N 4.96 4.15 0.69 2.77 2.96 -1.26 -5.00 118.68 127.94 3hi7 s LEU 573 Ca 0.66 1.49 -0.17 0.00 -0.22 0.00 0.00 54.13 55.89 3hi7 s LEU 573 Cb -0.22 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 42.95 3hi7 s LEU 573 CO 0.27 -0.65 1.25 -2.84 -1.32 0.00 0.00 176.35 173.06 3hi7 s PRO 574 N 3.05 2.32 0.38 0.98 0.02 -1.26 -4.91 135.00 135.58 3hi7 s PRO 574 Ca 0.47 1.93 0.20 0.00 0.02 0.00 0.00 61.00 63.62 3hi7 s PRO 574 Cb -0.17 -1.84 0.68 0.00 0.02 0.00 0.00 34.50 33.19 3hi7 s PRO 574 CO 0.10 -1.74 1.73 0.87 -0.33 0.00 0.00 177.00 177.63 3hi7 h LYS 575 N 0.12 0.00 -4.87 5.54 1.79 -1.95 -3.40 116.57 113.79 3hi7 h LYS 575 Ca -0.49 0.00 -0.67 0.00 -2.18 0.00 0.00 60.65 57.30 3hi7 h LYS 575 Cb 1.32 0.00 -0.36 0.00 -1.58 0.00 0.00 32.23 31.61 3hi7 h LYS 575 CO 0.51 0.34 -0.79 0.71 -1.08 0.00 0.00 179.45 179.15 3hi7 s TYR 576 N -3.55 3.22 -0.36 -1.35 1.51 -1.22 -5.00 117.35 110.60 3hi7 s TYR 576 Ca 0.01 -2.17 -0.07 0.00 -1.01 0.00 0.00 57.07 53.83 3hi7 s TYR 576 Cb 0.10 -1.96 0.05 0.00 -0.11 0.00 0.00 41.96 40.04 3hi7 s TYR 576 CO 0.68 -0.86 0.15 -0.51 -1.11 0.00 0.00 175.55 173.90 3hi7 s LEU 577 N 1.15 4.60 -0.09 -1.29 1.43 -1.26 -2.25 118.68 120.96 3hi7 s LEU 577 Ca -0.07 -1.28 0.03 0.00 -1.03 0.00 0.00 54.13 51.78 3hi7 s LEU 577 Cb -0.19 -1.90 -0.01 0.00 0.03 0.00 0.00 46.19 44.12 3hi7 s LEU 577 CO -0.05 -0.39 -0.21 -0.76 0.23 0.00 0.00 176.35 175.16 3hi7 s LEU 578 N 1.40 2.27 -0.28 1.79 1.43 0.08 -1.12 118.68 124.24 3hi7 s LEU 578 Ca 0.00 -0.47 -0.07 0.00 -1.03 0.00 0.00 54.13 52.55 3hi7 s LEU 578 Cb -0.21 -1.46 -0.00 0.00 0.03 0.00 0.00 46.19 44.55 3hi7 s LEU 578 CO 0.02 0.19 0.09 -0.36 0.23 0.00 0.00 176.35 176.52 3hi7 s PHE 579 N 0.17 3.13 0.05 0.29 0.40 -0.07 -0.99 117.98 120.97 3hi7 s PHE 579 Ca -0.12 -0.75 0.06 0.00 -0.60 0.00 0.00 56.93 55.52 3hi7 s PHE 579 Cb -0.16 -2.27 -0.04 0.00 0.51 0.00 0.00 43.02 41.07 3hi7 s PHE 579 CO 0.07 -0.50 -0.13 0.95 0.70 0.00 0.00 175.22 176.31 3hi7 s THR 580 N 1.55 3.17 0.03 0.64 -4.23 0.35 -1.32 115.64 115.83 3hi7 s THR 580 Ca 0.04 -1.12 -0.03 0.00 -1.18 0.00 0.00 61.69 59.40 3hi7 s THR 580 Cb -0.16 -2.40 -0.04 0.00 1.34 0.00 0.00 72.50 71.23 3hi7 s THR 580 CO 0.03 0.28 0.24 -0.55 -0.54 0.00 0.00 174.62 174.08 3hi7 s SER 581 N -1.68 6.42 0.61 3.99 0.15 0.03 -0.95 113.70 122.26 3hi7 s SER 581 Ca 0.17 0.41 0.39 0.00 0.70 0.00 0.00 55.95 57.62 3hi7 s SER 581 Cb -0.11 -2.03 1.94 0.00 -1.71 0.00 0.00 66.02 64.12 3hi7 s SER 581 CO 0.08 0.21 2.20 -0.65 1.20 0.00 0.00 173.24 176.29 3hi7 h PRO 582 N 3.53 0.00 -6.88 5.44 0.11 -1.87 -3.35 132.00 128.99 3hi7 h PRO 582 Ca -0.48 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.09 3hi7 h PRO 582 Cb 1.18 0.00 0.11 0.00 0.11 0.00 0.00 31.00 32.40 3hi7 h PRO 582 CO 0.71 0.01 0.73 1.04 -0.21 0.00 0.00 178.00 180.28 3hi7 n GLN 583 N -3.17 2.56 -4.06 1.05 6.02 -1.26 -4.87 117.38 113.65 3hi7 n GLN 583 Ca -0.02 0.90 -0.30 0.00 -0.01 0.00 0.00 57.00 57.58 3hi7 n GLN 583 Cb 0.17 -2.61 -0.06 0.00 1.02 0.00 0.00 30.24 28.76 3hi7 n GLN 583 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3hi7 s GLU 584 N -1.83 2.87 0.99 -1.09 2.02 -1.26 -1.02 118.70 119.38 3hi7 s GLU 584 Ca 0.55 -0.74 -0.17 0.00 0.02 0.00 0.00 54.97 54.64 3hi7 s GLU 584 Cb -0.50 -2.70 0.22 0.00 0.10 0.00 0.00 34.13 31.25 3hi7 s GLU 584 CO 0.61 0.55 1.31 0.54 0.02 0.00 0.00 175.26 178.29 3hi7 s ASN 585 N -2.53 2.82 0.09 -0.19 2.20 -0.07 -4.84 114.94 112.42 3hi7 s ASN 585 Ca 0.29 0.27 0.10 0.00 -0.94 0.00 0.00 52.86 52.58 3hi7 s ASN 585 Cb -0.12 -0.30 0.45 0.00 -2.00 0.00 0.00 41.25 39.28 3hi7 s ASN 585 CO 0.22 -2.92 1.29 -2.65 -2.94 0.00 0.00 177.10 170.11 3hi7 n PRO 586 N -3.89 0.04 -0.15 3.55 -0.02 -1.26 -2.13 135.00 131.14 3hi7 n PRO 586 Ca 0.15 0.46 0.08 0.00 -2.02 0.00 0.00 63.50 62.18 3hi7 n PRO 586 Cb 0.59 -1.62 0.16 0.00 -0.02 0.00 0.00 33.50 32.61 3hi7 n PRO 586 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3hi7 n TRP 587 N -1.71 0.40 -0.46 6.00 7.02 -1.26 -4.97 117.44 122.46 3hi7 n TRP 587 Ca 0.01 -0.32 0.00 0.00 -1.02 0.00 0.00 57.50 56.17 3hi7 n TRP 587 Cb 0.07 -0.01 0.00 0.00 -2.42 0.00 0.00 31.31 28.94 3hi7 n TRP 587 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3hi7 n GLY 588 N 0.88 0.75 3.61 6.99 0.00 -0.91 -5.06 105.19 111.45 3hi7 n GLY 588 Ca 0.13 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 3hi7 n GLY 588 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hi7 s HIS 589 N -2.00 2.99 0.24 1.61 3.76 -1.26 -4.89 115.29 115.75 3hi7 s HIS 589 Ca 0.00 0.06 -0.31 0.00 -0.15 0.00 0.00 55.06 54.66 3hi7 s HIS 589 Cb 0.00 -1.72 -0.11 0.00 1.11 0.00 0.00 32.58 31.86 3hi7 s HIS 589 CO 0.00 0.38 1.59 0.15 -0.85 0.00 0.00 174.74 176.00 3hi7 s LYS 590 N -0.93 4.17 0.00 1.40 1.02 -1.26 -0.89 119.74 123.25 3hi7 s LYS 590 Ca 0.13 2.49 -0.30 0.00 0.02 0.00 0.00 55.97 58.31 3hi7 s LYS 590 Cb -0.11 -3.08 -0.06 0.00 -0.52 0.00 0.00 37.83 34.06 3hi7 s LYS 590 CO 0.03 -0.61 1.47 1.03 -0.92 0.00 0.00 175.35 176.34 3hi7 s ARG 591 N 0.21 4.25 0.18 1.68 0.52 -0.19 -4.67 118.95 120.94 3hi7 s ARG 591 Ca 0.66 2.05 -0.07 0.00 -0.52 0.00 0.00 55.73 57.85 3hi7 s ARG 591 Cb -0.46 -3.62 -0.02 0.00 0.52 0.00 0.00 34.95 31.37 3hi7 s ARG 591 CO 0.40 -0.63 0.26 -1.54 0.02 0.00 0.00 175.30 173.81 3hi7 s SER 592 N 2.11 0.07 -0.02 0.23 1.04 -0.83 -0.79 113.70 115.50 3hi7 s SER 592 Ca 0.66 -0.99 0.07 0.00 0.48 0.00 0.00 55.95 56.17 3hi7 s SER 592 Cb -0.33 0.43 -0.02 0.00 0.10 0.00 0.00 66.02 66.21 3hi7 s SER 592 CO 0.27 -0.90 -0.23 -0.31 0.98 0.00 0.00 173.24 173.06 3hi7 s TYR 593 N -4.01 2.04 -0.12 5.02 1.51 -0.44 -0.82 117.35 120.53 3hi7 s TYR 593 Ca 0.22 -0.41 -0.05 0.00 -1.01 0.00 0.00 57.07 55.82 3hi7 s TYR 593 Cb 0.04 -1.32 -0.04 0.00 -0.11 0.00 0.00 41.96 40.53 3hi7 s TYR 593 CO 0.03 -0.05 0.07 0.50 -1.11 0.00 0.00 175.55 174.99 3hi7 s ARG 594 N -0.49 3.39 -0.20 -0.62 3.52 0.94 -0.89 118.95 124.60 3hi7 s ARG 594 Ca 0.08 -0.29 -0.07 0.00 -0.13 0.00 0.00 55.73 55.32 3hi7 s ARG 594 Cb -0.09 -3.04 -0.04 0.00 -1.56 0.00 0.00 34.95 30.22 3hi7 s ARG 594 CO -0.01 0.63 0.05 -1.17 -0.81 0.00 0.00 175.30 174.00 3hi7 s LEU 595 N -0.64 3.63 -0.16 -0.88 2.96 -0.27 -1.00 118.68 122.31 3hi7 s LEU 595 Ca 0.11 -0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.99 3hi7 s LEU 595 Cb -0.12 -1.93 0.03 0.00 0.50 0.00 0.00 46.19 44.68 3hi7 s LEU 595 CO 0.02 0.11 -0.10 -1.58 -1.32 0.00 0.00 176.35 173.48 3hi7 s GLN 596 N 0.75 1.90 -0.18 1.98 0.74 -0.13 -4.16 119.66 120.55 3hi7 s GLN 596 Ca 0.03 -0.60 -0.12 0.00 0.05 0.00 0.00 55.36 54.72 3hi7 s GLN 596 Cb -0.14 -2.11 -0.05 0.00 1.10 0.00 0.00 33.01 31.82 3hi7 s GLN 596 CO 0.02 -0.35 0.22 0.42 -0.55 0.00 0.00 175.29 175.05 3hi7 s ILE 597 N 1.52 5.35 -0.38 -2.34 1.01 -1.26 -0.46 121.20 124.65 3hi7 s ILE 597 Ca 0.02 0.39 -0.08 0.00 0.00 0.00 0.00 60.65 60.97 3hi7 s ILE 597 Cb -0.14 -3.56 0.05 0.00 0.01 0.00 0.00 42.46 38.82 3hi7 s ILE 597 CO -0.09 0.41 0.18 -2.28 0.00 0.00 0.00 174.94 173.17 3hi7 s HIS 598 N 0.43 3.29 -0.01 3.97 2.46 0.36 -4.98 115.29 120.81 3hi7 s HIS 598 Ca 0.13 -1.36 -0.29 0.00 0.47 0.00 0.00 55.06 54.01 3hi7 s HIS 598 Cb -0.12 -2.56 0.08 0.00 -0.13 0.00 0.00 32.58 29.85 3hi7 s HIS 598 CO 0.01 -0.75 0.71 0.45 -2.47 0.00 0.00 174.74 172.69 3hi7 s SER 599 N 1.68 -0.59 -0.17 9.88 0.15 -1.26 -1.28 113.70 122.11 3hi7 s SER 599 Ca 0.01 0.46 0.14 0.00 0.70 0.00 0.00 55.95 57.26 3hi7 s SER 599 Cb -0.21 0.52 0.38 0.00 -1.71 0.00 0.00 66.02 65.00 3hi7 s SER 599 CO 0.03 -0.67 1.19 0.23 1.20 0.00 0.00 173.24 175.22 3hi7 n MET 600 N 0.49 1.33 -1.73 5.44 2.81 0.44 -4.94 117.12 120.97 3hi7 n MET 600 Ca -0.17 -2.95 -0.31 0.00 -1.81 0.00 0.00 57.70 52.46 3hi7 n MET 600 Cb 0.59 -1.42 0.05 0.00 -0.71 0.00 0.00 33.22 31.73 3hi7 n MET 600 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3hi7 s ALA 601 N -2.78 2.75 0.32 3.04 0.00 -0.89 -4.27 121.76 119.93 3hi7 s ALA 601 Ca 0.35 -0.14 -0.13 0.00 0.00 0.00 0.00 51.96 52.04 3hi7 s ALA 601 Cb 0.34 -3.10 0.02 0.00 0.00 0.00 0.00 23.12 20.38 3hi7 s ALA 601 CO -0.05 -1.17 0.63 0.34 0.00 0.00 0.00 175.76 175.50 3hi7 s ASP 602 N -4.07 0.13 0.08 0.00 -1.08 -1.26 -4.99 116.67 105.48 3hi7 s ASP 602 Ca 0.58 -1.06 -0.31 0.00 -0.52 0.00 0.00 52.55 51.24 3hi7 s ASP 602 Cb -0.13 0.72 -0.08 0.00 -1.46 0.00 0.00 42.92 41.98 3hi7 s ASP 602 CO 0.54 -1.40 1.51 -1.58 0.52 0.00 0.00 175.17 174.76 3hi7 s GLN 603 N -3.23 4.25 -0.07 4.34 2.00 -1.26 -4.92 119.66 120.77 3hi7 s GLN 603 Ca 0.20 2.17 -0.08 0.00 -2.00 0.00 0.00 55.36 55.65 3hi7 s GLN 603 Cb -0.03 -3.43 -0.03 0.00 0.80 0.00 0.00 33.01 30.32 3hi7 s GLN 603 CO 0.12 -0.60 -0.15 0.28 -0.50 0.00 0.00 175.29 174.44 3hi7 n VAL 604 N 4.40 0.76 -3.17 1.34 0.31 -1.26 -5.02 118.33 115.69 3hi7 n VAL 604 Ca 0.14 0.29 -0.29 0.00 -0.01 0.00 0.00 64.34 64.47 3hi7 n VAL 604 Cb 0.41 -1.83 -0.03 0.00 -0.91 0.00 0.00 33.84 31.48 3hi7 n VAL 604 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3hi7 s LEU 605 N -6.44 3.97 0.12 7.52 1.43 -1.26 -5.03 118.68 118.99 3hi7 s LEU 605 Ca -0.12 0.84 -0.31 0.00 -1.03 0.00 0.00 54.13 53.51 3hi7 s LEU 605 Cb 0.02 -3.69 -0.08 0.00 0.03 0.00 0.00 46.19 42.47 3hi7 s LEU 605 CO 0.18 -0.27 1.36 -2.84 0.23 0.00 0.00 176.35 175.02 3hi7 s PRO 606 N -3.70 4.34 0.11 1.29 0.02 -1.26 -4.93 135.00 130.87 3hi7 s PRO 606 Ca 0.46 2.05 -0.34 0.00 0.02 0.00 0.00 61.00 63.19 3hi7 s PRO 606 Cb -0.11 -3.25 -0.14 0.00 0.02 0.00 0.00 34.50 31.03 3hi7 s PRO 606 CO 0.31 -0.40 1.60 -2.30 -0.33 0.00 0.00 177.00 175.88 3hi7 n PRO 607 N 3.76 2.04 -0.18 5.54 -0.02 -1.26 -1.77 135.00 143.10 3hi7 n PRO 607 Ca 0.10 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 3hi7 n PRO 607 Cb 0.43 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 3hi7 n PRO 607 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hi7 n GLY 608 N 3.47 1.04 3.50 -1.23 0.00 -1.26 -5.03 105.19 105.68 3hi7 n GLY 608 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 3hi7 n GLY 608 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3hi7 s TRP 609 N -2.60 3.09 0.00 1.61 -0.11 -0.73 -4.93 118.94 115.27 3hi7 s TRP 609 Ca 0.00 -0.23 0.00 0.00 1.22 0.00 0.00 56.10 57.09 3hi7 s TRP 609 Cb 0.00 -3.27 0.00 0.00 -1.50 0.00 0.00 33.47 28.70 3hi7 s TRP 609 CO 0.00 -0.86 0.00 1.04 -4.62 0.00 0.00 176.95 172.51 3hi7 n GLN 610 N 6.08 0.00 0.26 5.86 1.13 -1.26 -1.39 117.38 128.06 3hi7 n GLN 610 Ca -0.04 0.00 0.18 0.00 -1.94 0.00 0.00 57.00 55.20 3hi7 n GLN 610 Cb 0.47 0.00 0.85 0.00 0.11 0.00 0.00 30.24 31.68 3hi7 n GLN 610 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 3hi7 h GLU 611 N 0.00 0.00 -0.14 -1.09 3.07 -1.93 -2.02 114.58 112.47 3hi7 h GLU 611 Ca 0.00 0.00 0.04 0.00 -0.50 0.00 0.00 59.36 58.90 3hi7 h GLU 611 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 3hi7 h GLU 611 CO 0.00 0.00 0.19 1.49 -1.40 0.00 0.00 179.01 179.29 3hi7 h GLU 612 N 0.00 0.00 -0.24 2.33 4.22 -1.51 -1.41 114.58 117.98 3hi7 h GLU 612 Ca 0.00 0.00 0.07 0.00 0.08 0.00 0.00 59.36 59.51 3hi7 h GLU 612 Cb 0.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 3hi7 h GLU 612 CO 0.00 0.00 0.27 0.37 -2.18 0.00 0.00 179.01 177.47 3hi7 h GLN 613 N 0.00 0.00 0.00 1.92 5.75 -1.54 -0.49 115.11 120.76 3hi7 h GLN 613 Ca 0.06 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 3hi7 h GLN 613 Cb 0.44 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.99 3hi7 h GLN 613 CO -0.00 0.00 0.00 0.00 -2.65 0.00 0.00 178.83 176.18 3hi7 h ALA 614 N 1.69 1.00 -0.69 3.38 0.00 -1.01 -3.37 119.26 120.27 3hi7 h ALA 614 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.66 3hi7 h ALA 614 Cb 0.65 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 18.03 3hi7 h ALA 614 CO -0.00 0.00 -1.03 0.44 0.00 0.00 0.00 179.25 178.65 3hi7 n ILE 615 N -2.85 1.60 0.28 0.00 -5.35 -0.20 -4.86 119.36 107.96 3hi7 n ILE 615 Ca 0.04 -3.40 0.16 0.00 -0.27 0.00 0.00 62.75 59.28 3hi7 n ILE 615 Cb 0.48 0.43 0.78 0.00 -1.74 0.00 0.00 39.64 39.59 3hi7 n ILE 615 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 3hi7 h THR 616 N 4.13 0.29 -0.32 7.28 1.35 -1.69 -0.31 112.91 123.64 3hi7 h THR 616 Ca 0.02 -0.50 0.09 0.00 -0.55 0.00 0.00 66.41 65.48 3hi7 h THR 616 Cb 1.29 1.38 -0.01 0.00 -1.73 0.00 0.00 68.15 69.07 3hi7 h THR 616 CO 0.42 0.07 0.24 4.11 -0.25 0.00 0.00 175.52 180.11 3hi7 h TRP 617 N 0.00 0.00 0.00 4.73 5.08 -1.91 -2.17 115.95 121.68 3hi7 h TRP 617 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 3hi7 h TRP 617 Cb 0.37 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.53 3hi7 h TRP 617 CO 0.00 0.00 0.00 0.00 -1.28 0.00 0.00 178.44 177.16 3hi7 n ALA 618 N -2.58 2.39 0.31 0.11 0.00 -0.13 -1.76 120.51 118.85 3hi7 n ALA 618 Ca 0.05 -0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.52 3hi7 n ALA 618 Cb 0.41 -1.25 0.36 0.00 0.00 0.00 0.00 19.45 18.96 3hi7 n ALA 618 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hi7 h ARG 619 N 0.00 0.00 -4.33 0.00 3.08 -1.55 -3.43 114.38 108.15 3hi7 h ARG 619 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 3hi7 h ARG 619 Cb 0.00 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 29.67 3hi7 h ARG 619 CO 0.00 0.00 -0.79 0.71 -1.07 0.00 0.00 179.97 178.82 3hi7 s TYR 620 N -3.31 2.21 0.35 3.04 1.51 -0.72 -3.18 117.35 117.25 3hi7 s TYR 620 Ca 0.06 -1.56 0.06 0.00 -1.01 0.00 0.00 57.07 54.63 3hi7 s TYR 620 Cb 0.07 -1.52 0.74 0.00 -0.11 0.00 0.00 41.96 41.15 3hi7 s TYR 620 CO 0.61 -0.73 1.92 -1.00 -1.11 0.00 0.00 175.55 175.24 3hi7 h PRO 621 N 8.00 0.74 -3.40 -1.71 0.13 -1.81 -3.28 132.00 130.67 3hi7 h PRO 621 Ca -0.21 -0.04 -0.28 0.00 -0.87 0.00 0.00 66.00 64.60 3hi7 h PRO 621 Cb 1.09 -0.17 -0.33 0.00 0.13 0.00 0.00 31.00 31.72 3hi7 h PRO 621 CO 0.42 0.49 -0.67 -1.17 -0.23 0.00 0.00 178.00 176.84 3hi7 s LEU 622 N -9.77 0.91 0.04 1.56 2.96 -1.26 -1.48 118.68 111.64 3hi7 s LEU 622 Ca -0.10 0.15 0.03 0.00 -0.22 0.00 0.00 54.13 53.99 3hi7 s LEU 622 Cb 0.20 0.12 -0.02 0.00 0.50 0.00 0.00 46.19 46.99 3hi7 s LEU 622 CO 0.78 -0.14 -0.09 0.00 -1.32 0.00 0.00 176.35 175.58 3hi7 s ALA 623 N 1.13 0.71 -0.11 5.97 0.00 -0.75 -0.93 121.76 127.77 3hi7 s ALA 623 Ca -0.09 -0.69 0.03 0.00 0.00 0.00 0.00 51.96 51.21 3hi7 s ALA 623 Cb -0.12 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 22.96 3hi7 s ALA 623 CO -0.04 0.07 -0.21 0.08 0.00 0.00 0.00 175.76 175.65 3hi7 s VAL 624 N -1.02 1.91 0.21 0.00 1.01 -1.20 -0.41 120.40 120.90 3hi7 s VAL 624 Ca -0.05 -0.91 0.10 0.00 0.00 0.00 0.00 61.98 61.13 3hi7 s VAL 624 Cb -0.08 -1.68 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 3hi7 s VAL 624 CO 0.01 0.52 -0.20 0.42 0.00 0.00 0.00 175.10 175.85 3hi7 s THR 625 N 0.63 2.17 0.07 3.92 -4.23 -0.11 -4.74 115.64 113.36 3hi7 s THR 625 Ca -0.12 -2.14 -0.30 0.00 -1.18 0.00 0.00 61.69 57.94 3hi7 s THR 625 Cb -0.16 -2.09 -0.06 0.00 1.34 0.00 0.00 72.50 71.53 3hi7 s THR 625 CO 0.03 -0.32 1.14 -0.75 -0.54 0.00 0.00 174.62 174.18 3hi7 s LYS 626 N -3.09 4.48 0.11 3.99 2.20 -1.26 -0.37 119.74 125.80 3hi7 s LYS 626 Ca 0.22 1.70 -0.35 0.00 -0.36 0.00 0.00 55.97 57.18 3hi7 s LYS 626 Cb -0.05 -3.35 -0.15 0.00 -1.51 0.00 0.00 37.83 32.76 3hi7 s LYS 626 CO 0.10 -0.16 1.51 0.98 -0.36 0.00 0.00 175.35 177.42 3hi7 n TYR 627 N 3.64 1.98 -3.82 4.03 4.19 0.37 -4.87 117.16 122.68 3hi7 n TYR 627 Ca 0.07 0.40 -0.13 0.00 3.31 0.00 0.00 57.90 61.56 3hi7 n TYR 627 Cb 0.47 -2.47 -0.13 0.00 0.49 0.00 0.00 39.34 37.70 3hi7 n TYR 627 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 3hi7 s ARG 628 N 0.96 0.10 0.63 2.98 0.52 -1.26 -5.00 118.95 117.88 3hi7 s ARG 628 Ca 0.82 0.18 0.38 0.00 -0.52 0.00 0.00 55.73 56.59 3hi7 s ARG 628 Cb -0.79 -0.00 2.11 0.00 0.52 0.00 0.00 34.95 36.78 3hi7 s ARG 628 CO 0.43 -0.05 2.30 0.93 0.02 0.00 0.00 175.30 178.92 3hi7 h GLU 629 N 6.29 0.00 -0.03 3.54 4.39 -2.03 -1.65 114.58 125.09 3hi7 h GLU 629 Ca -0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.41 3hi7 h GLU 629 Cb 1.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.84 3hi7 h GLU 629 CO 0.45 0.01 0.00 -1.13 -1.16 0.00 0.00 179.01 177.17 3hi7 n SER 630 N -3.38 0.83 -2.56 1.42 3.41 -1.26 -4.07 113.62 108.00 3hi7 n SER 630 Ca -0.03 -1.36 -0.11 0.00 -0.26 0.00 0.00 58.87 57.11 3hi7 n SER 630 Cb 0.10 -0.02 0.03 0.00 -0.26 0.00 0.00 64.21 64.06 3hi7 n SER 630 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hi7 n GLU 631 N -0.32 2.23 0.17 4.33 1.02 -0.62 -4.87 120.64 122.59 3hi7 n GLU 631 Ca 0.19 -3.73 0.08 0.00 -0.02 0.00 0.00 57.16 53.69 3hi7 n GLU 631 Cb 0.23 -1.75 0.09 0.00 -0.02 0.00 0.00 31.44 29.99 3hi7 n GLU 631 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3hi7 h LEU 632 N 2.61 0.00 -8.13 -4.62 3.38 -1.71 -3.45 115.31 103.39 3hi7 h LEU 632 Ca 0.04 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.61 3hi7 h LEU 632 Cb 1.25 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.73 3hi7 h LEU 632 CO 0.48 0.19 -0.78 0.00 0.09 0.00 0.00 178.44 178.42 3hi7 n SER 634 N 2.49 0.62 -0.83 0.00 3.41 -1.26 -4.98 113.62 113.07 3hi7 n SER 634 Ca -0.15 -0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.18 3hi7 n SER 634 Cb 0.56 0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.98 3hi7 n SER 634 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3hi7 n SER 635 N -1.71 0.02 -3.69 4.04 2.88 -1.26 -4.60 113.62 109.28 3hi7 n SER 635 Ca 0.04 -0.82 -0.05 0.00 -1.33 0.00 0.00 58.87 56.70 3hi7 n SER 635 Cb 0.38 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.82 3hi7 n SER 635 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3hi7 s SER 636 N -0.65 -0.25 0.19 -3.46 1.04 -1.26 -4.92 113.70 104.39 3hi7 s SER 636 Ca 0.00 -0.32 0.18 0.00 0.48 0.00 0.00 55.95 56.29 3hi7 s SER 636 Cb 0.00 0.50 0.83 0.00 0.10 0.00 0.00 66.02 67.45 3hi7 s SER 636 CO 0.00 -0.90 1.55 2.30 0.98 0.00 0.00 173.24 177.17 3hi7 n ILE 637 N -0.42 1.07 0.61 -1.02 -5.35 -1.26 -2.47 119.36 110.52 3hi7 n ILE 637 Ca -0.07 0.40 0.11 0.00 -0.27 0.00 0.00 62.75 62.92 3hi7 n ILE 637 Cb 0.61 -1.32 0.08 0.00 -1.74 0.00 0.00 39.64 37.26 3hi7 n ILE 637 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 3hi7 n TYR 638 N -2.00 0.32 -0.25 4.28 4.02 -1.26 -4.23 117.16 118.04 3hi7 n TYR 638 Ca 0.01 0.09 -0.07 0.00 -0.01 0.00 0.00 57.90 57.93 3hi7 n TYR 638 Cb 0.14 -0.47 0.06 0.00 -0.02 0.00 0.00 39.34 39.05 3hi7 n TYR 638 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3hi7 h HIS 639 N 0.00 1.17 -0.50 -0.72 3.86 -1.76 -1.87 115.15 115.33 3hi7 h HIS 639 Ca 0.00 -0.13 0.09 0.00 -1.16 0.00 0.00 60.37 59.17 3hi7 h HIS 639 Cb 0.71 -0.33 -0.08 0.00 1.06 0.00 0.00 27.41 28.77 3hi7 h HIS 639 CO 0.00 0.94 0.04 0.37 0.86 0.00 0.00 177.93 180.15 3hi7 h GLN 640 N 1.07 0.16 -0.01 2.45 5.75 -1.79 -2.19 115.11 120.55 3hi7 h GLN 640 Ca 0.23 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.72 3hi7 h GLN 640 Cb 0.35 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.86 3hi7 h GLN 640 CO -0.00 0.11 -0.77 0.09 -2.65 0.00 0.00 178.83 175.61 3hi7 n ASN 641 N -5.18 1.31 -3.31 -0.69 3.02 -1.16 -4.17 115.26 105.08 3hi7 n ASN 641 Ca 0.05 -1.12 -0.25 0.00 -0.03 0.00 0.00 54.58 53.23 3hi7 n ASN 641 Cb 0.26 0.75 -0.08 0.00 -0.61 0.00 0.00 39.78 40.10 3hi7 n ASN 641 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3hi7 n ASP 642 N -0.98 1.02 0.07 6.41 -0.08 -0.71 -4.51 116.55 117.78 3hi7 n ASP 642 Ca 0.06 -2.84 0.11 0.00 -1.51 0.00 0.00 54.79 50.62 3hi7 n ASP 642 Cb 0.38 -0.64 0.45 0.00 2.34 0.00 0.00 41.12 43.64 3hi7 n ASP 642 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 3hi7 n PRO 643 N 1.54 0.13 0.09 -0.67 -0.04 -0.83 -2.91 135.00 132.31 3hi7 n PRO 643 Ca 0.24 0.27 -0.17 0.00 -0.04 0.00 0.00 63.50 63.81 3hi7 n PRO 643 Cb 0.49 -1.71 -0.10 0.00 -0.04 0.00 0.00 33.50 32.13 3hi7 n PRO 643 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3hi7 h TRP 644 N 0.00 0.68 -2.01 0.54 6.55 -1.86 -2.87 115.95 116.98 3hi7 h TRP 644 Ca 0.00 -0.43 -0.51 0.00 0.95 0.00 0.00 58.89 58.90 3hi7 h TRP 644 Cb 0.43 -0.05 -0.40 0.00 -0.86 0.00 0.00 29.16 28.28 3hi7 h TRP 644 CO 0.00 1.29 -1.15 -3.47 -1.05 0.00 0.00 178.44 174.06 3hi7 n ASP 645 N -3.68 0.81 -4.87 -3.49 2.03 -1.19 -4.88 116.55 101.29 3hi7 n ASP 645 Ca -0.09 -2.95 -0.31 0.00 0.52 0.00 0.00 54.79 51.96 3hi7 n ASP 645 Cb 0.95 -0.62 0.02 0.00 -0.72 0.00 0.00 41.12 40.75 3hi7 n ASP 645 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3hi7 s PRO 646 N -2.13 3.35 0.32 -0.67 0.04 -1.15 -4.97 135.00 129.79 3hi7 s PRO 646 Ca 0.39 0.66 0.26 0.00 0.04 0.00 0.00 61.00 62.35 3hi7 s PRO 646 Cb 0.30 -2.06 0.96 0.00 0.04 0.00 0.00 34.50 33.74 3hi7 s PRO 646 CO -0.09 -0.73 1.77 -1.00 0.04 0.00 0.00 177.00 176.99 3hi7 h PRO 647 N -0.43 0.00 -4.29 0.56 0.13 -1.93 -3.41 132.00 122.63 3hi7 h PRO 647 Ca -0.44 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.18 3hi7 h PRO 647 Cb 1.21 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.98 3hi7 h PRO 647 CO 0.62 0.00 -0.80 0.08 -0.23 0.00 0.00 178.00 177.67 3hi7 s VAL 648 N -3.32 1.00 -0.29 1.56 1.01 -1.26 -5.10 120.40 113.99 3hi7 s VAL 648 Ca 0.05 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.75 3hi7 s VAL 648 Cb 0.10 -0.99 0.08 0.00 0.00 0.00 0.00 36.38 35.56 3hi7 s VAL 648 CO 0.49 0.35 -0.05 -0.69 0.00 0.00 0.00 175.10 175.21 3hi7 s VAL 649 N 1.35 2.21 0.25 2.92 1.01 -1.26 -4.87 120.40 121.99 3hi7 s VAL 649 Ca -0.02 -1.92 -0.04 0.00 0.00 0.00 0.00 61.98 60.00 3hi7 s VAL 649 Cb -0.14 -2.44 0.22 0.00 0.00 0.00 0.00 36.38 34.02 3hi7 s VAL 649 CO -0.04 -0.26 1.73 0.15 0.00 0.00 0.00 175.10 176.68 3hi7 h PHE 650 N 7.71 0.54 -1.05 5.22 3.57 -1.87 -0.00 116.94 131.05 3hi7 h PHE 650 Ca -0.13 0.04 0.28 0.00 3.53 0.00 0.00 57.97 61.68 3hi7 h PHE 650 Cb 1.03 -0.12 -0.09 0.00 2.79 0.00 0.00 35.95 39.56 3hi7 h PHE 650 CO 0.57 0.07 0.69 1.49 -2.23 0.00 0.00 178.31 178.90 3hi7 h GLU 651 N 0.46 0.31 0.00 1.11 4.57 -1.95 0.59 114.58 119.67 3hi7 h GLU 651 Ca 0.42 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.55 3hi7 h GLU 651 Cb 0.63 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.15 3hi7 h GLU 651 CO -0.40 0.21 -0.14 1.96 -1.18 0.00 0.00 179.01 179.46 3hi7 h GLN 652 N 0.32 0.00 -0.02 1.92 4.20 -1.42 -1.59 115.11 118.52 3hi7 h GLN 652 Ca 0.58 0.00 0.01 0.00 0.06 0.00 0.00 58.65 59.30 3hi7 h GLN 652 Cb 1.62 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.40 3hi7 h GLN 652 CO -0.25 0.14 0.04 0.74 -0.67 0.00 0.00 178.83 178.83 3hi7 h PHE 653 N 0.00 0.00 -0.00 2.96 -1.00 -0.98 -1.81 116.94 116.11 3hi7 h PHE 653 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3hi7 h PHE 653 Cb 0.31 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.87 3hi7 h PHE 653 CO 0.00 0.00 -0.69 1.28 -1.61 0.00 0.00 178.31 177.29 3hi7 n LEU 654 N -3.65 1.08 -0.32 1.54 4.77 -0.60 -4.56 117.00 115.26 3hi7 n LEU 654 Ca -0.02 -0.40 -0.03 0.00 -0.03 0.00 0.00 56.01 55.52 3hi7 n LEU 654 Cb 0.12 -0.07 0.11 0.00 -2.33 0.00 0.00 43.42 41.24 3hi7 n LEU 654 CO 0.25 0.24 1.19 -0.74 -1.33 0.00 0.00 177.39 177.00 3hi7 h HIS 655 N 0.61 1.21 0.00 -1.77 2.76 -1.32 -1.42 115.15 115.23 3hi7 h HIS 655 Ca 0.00 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 3hi7 h HIS 655 Cb 0.55 -0.39 0.00 0.00 1.55 0.00 0.00 27.41 29.12 3hi7 h HIS 655 CO 0.00 0.83 0.00 0.27 -1.30 0.00 0.00 177.93 177.73 3hi7 n ASN 656 N -4.34 0.00 -3.98 3.26 0.23 -1.26 -4.94 115.26 104.23 3hi7 n ASN 656 Ca 0.10 -0.21 -0.41 0.00 -0.53 0.00 0.00 54.58 53.53 3hi7 n ASN 656 Cb 0.09 -0.25 0.02 0.00 -2.08 0.00 0.00 39.78 37.56 3hi7 n ASN 656 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3hi7 n ASN 657 N -1.25 -4.42 -4.87 0.53 5.15 -0.54 -4.87 115.26 104.99 3hi7 n ASN 657 Ca 0.14 -1.20 -0.31 0.00 -0.60 0.00 0.00 54.58 52.61 3hi7 n ASN 657 Cb 0.21 -1.83 0.02 0.00 -0.53 0.00 0.00 39.78 37.64 3hi7 n ASN 657 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3hi7 s GLU 658 N -6.78 3.50 0.15 1.20 2.02 -1.26 -4.47 118.70 113.05 3hi7 s GLU 658 Ca 0.39 0.72 -0.31 0.00 0.02 0.00 0.00 54.97 55.79 3hi7 s GLU 658 Cb -0.21 -2.07 -0.08 0.00 0.10 0.00 0.00 34.13 31.87 3hi7 s GLU 658 CO 0.95 -0.64 1.39 1.21 0.02 0.00 0.00 175.26 178.19 3hi7 s ASN 659 N -4.19 6.80 -0.17 -0.19 3.84 -1.26 -0.96 114.94 118.82 3hi7 s ASN 659 Ca 0.55 2.40 0.15 0.00 0.21 0.00 0.00 52.86 56.17 3hi7 s ASN 659 Cb -0.11 -2.60 0.36 0.00 -0.55 0.00 0.00 41.25 38.36 3hi7 s ASN 659 CO 0.54 -0.65 1.21 2.30 -2.79 0.00 0.00 177.10 177.71 3hi7 n ILE 660 N 3.54 2.06 -3.27 -5.21 -5.35 0.31 -4.89 119.36 106.54 3hi7 n ILE 660 Ca 0.10 -2.64 -0.39 0.00 -0.27 0.00 0.00 62.75 59.55 3hi7 n ILE 660 Cb 0.42 -0.24 -0.07 0.00 -1.74 0.00 0.00 39.64 38.00 3hi7 n ILE 660 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 3hi7 s GLU 661 N -3.03 4.11 -1.16 6.28 2.02 -1.26 -4.34 118.70 121.33 3hi7 s GLU 661 Ca 0.35 0.31 -0.12 0.00 0.02 0.00 0.00 54.97 55.53 3hi7 s GLU 661 Cb 0.32 -3.61 -0.02 0.00 0.10 0.00 0.00 34.13 30.92 3hi7 s GLU 661 CO -0.01 -0.24 0.80 -1.71 0.02 0.00 0.00 175.26 174.12 3hi7 n ASN 662 N 5.16 -4.66 -4.32 -0.19 5.15 -0.86 -4.99 115.26 110.55 3hi7 n ASN 662 Ca -0.05 -0.90 -0.17 0.00 -0.60 0.00 0.00 54.58 52.87 3hi7 n ASN 662 Cb 0.50 -3.99 -0.10 0.00 -0.53 0.00 0.00 39.78 35.66 3hi7 n ASN 662 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3hi7 s GLU 663 N -5.58 1.40 -0.46 1.20 0.41 -0.52 -4.72 118.70 110.43 3hi7 s GLU 663 Ca 0.36 -1.75 -0.29 0.00 -0.41 0.00 0.00 54.97 52.88 3hi7 s GLU 663 Cb -0.10 -0.30 0.02 0.00 -1.78 0.00 0.00 34.13 31.97 3hi7 s GLU 663 CO 0.82 -0.28 1.31 0.34 -0.49 0.00 0.00 175.26 176.97 3hi7 s ASP 664 N -3.31 6.41 0.04 -0.19 -1.08 -1.25 -0.43 116.67 116.86 3hi7 s ASP 664 Ca 0.37 0.61 0.01 0.00 -0.52 0.00 0.00 52.55 53.01 3hi7 s ASP 664 Cb 0.08 -2.54 -0.04 0.00 -1.46 0.00 0.00 42.92 38.95 3hi7 s ASP 664 CO 0.13 -1.41 0.13 -0.76 0.52 0.00 0.00 175.17 173.78 3hi7 s LEU 665 N 5.18 4.06 -0.11 -1.34 1.43 -1.26 -0.48 118.68 126.16 3hi7 s LEU 665 Ca 0.55 0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.82 3hi7 s LEU 665 Cb -0.11 -2.58 0.02 0.00 0.03 0.00 0.00 46.19 43.54 3hi7 s LEU 665 CO 0.31 0.21 -0.15 -0.69 0.23 0.00 0.00 176.35 176.26 3hi7 s VAL 666 N -1.37 1.50 0.06 -1.59 1.01 0.50 -4.14 120.40 116.37 3hi7 s VAL 666 Ca 0.29 -0.64 -0.15 0.00 0.00 0.00 0.00 61.98 61.48 3hi7 s VAL 666 Cb -0.12 -1.38 -0.06 0.00 0.00 0.00 0.00 36.38 34.82 3hi7 s VAL 666 CO 0.21 0.44 0.48 0.00 0.00 0.00 0.00 175.10 176.23 3hi7 s ALA 667 N 1.03 3.65 -0.07 5.51 0.00 -0.15 -0.93 121.76 130.80 3hi7 s ALA 667 Ca -0.06 -0.16 0.03 0.00 0.00 0.00 0.00 51.96 51.78 3hi7 s ALA 667 Cb -0.15 -2.46 0.01 0.00 0.00 0.00 0.00 23.12 20.52 3hi7 s ALA 667 CO -0.02 0.47 -0.16 -1.58 0.00 0.00 0.00 175.76 174.46 3hi7 s TRP 668 N -1.21 1.83 -0.11 0.00 0.52 0.45 0.05 118.94 120.47 3hi7 s TRP 668 Ca 0.29 -0.70 0.02 0.00 0.02 0.00 0.00 56.10 55.74 3hi7 s TRP 668 Cb -0.17 -1.28 0.01 0.00 -1.15 0.00 0.00 33.47 30.89 3hi7 s TRP 668 CO 0.17 -0.31 -0.17 0.08 0.02 0.00 0.00 176.95 176.74 3hi7 s VAL 669 N 0.51 1.58 -0.22 4.03 1.01 -0.34 -1.81 120.40 125.16 3hi7 s VAL 669 Ca -0.15 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 61.02 3hi7 s VAL 669 Cb -0.16 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 3hi7 s VAL 669 CO 0.05 0.46 0.15 -0.89 0.00 0.00 0.00 175.10 174.87 3hi7 s THR 670 N 0.88 5.38 0.14 3.92 2.01 -0.55 -0.91 115.64 126.52 3hi7 s THR 670 Ca -0.08 0.21 0.06 0.00 0.31 0.00 0.00 61.69 62.18 3hi7 s THR 670 Cb -0.15 -3.49 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 3hi7 s THR 670 CO -0.00 0.39 -0.14 0.68 -0.69 0.00 0.00 174.62 174.86 3hi7 s VAL 671 N 0.68 1.40 -1.65 3.82 -7.23 -0.38 -4.63 120.40 112.42 3hi7 s VAL 671 Ca 0.08 -1.84 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 3hi7 s VAL 671 Cb -0.12 -1.66 0.00 0.00 0.56 0.00 0.00 36.38 35.16 3hi7 s VAL 671 CO 0.01 -0.47 0.00 0.61 -0.31 0.00 0.00 175.10 174.94 3hi7 n GLY 672 N 0.31 -1.31 3.57 2.32 0.00 -1.26 -0.42 105.19 108.40 3hi7 n GLY 672 Ca -0.14 -0.95 -0.13 0.00 0.00 0.00 0.00 46.02 44.80 3hi7 n GLY 672 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hi7 s PHE 673 N -2.94 -0.53 0.10 1.61 -0.12 -0.39 -0.42 117.98 115.29 3hi7 s PHE 673 Ca 0.00 1.03 -0.30 0.00 -0.05 0.00 0.00 56.93 57.60 3hi7 s PHE 673 Cb 0.00 0.40 -0.07 0.00 -0.63 0.00 0.00 43.02 42.73 3hi7 s PHE 673 CO 0.00 -0.43 1.23 -1.17 -0.05 0.00 0.00 175.22 174.80 3hi7 s LEU 674 N -0.78 4.39 -0.31 -1.99 2.96 -1.26 -1.02 118.68 120.68 3hi7 s LEU 674 Ca -0.04 2.12 0.03 0.00 -0.22 0.00 0.00 54.13 56.02 3hi7 s LEU 674 Cb -0.01 -3.59 0.09 0.00 0.50 0.00 0.00 46.19 43.18 3hi7 s LEU 674 CO 0.03 -0.47 0.01 -2.28 -1.32 0.00 0.00 176.35 172.33 3hi7 s HIS 675 N 0.75 3.24 -0.37 5.38 5.65 0.37 -4.96 115.29 125.35 3hi7 s HIS 675 Ca 0.58 -2.56 -0.18 0.00 0.25 0.00 0.00 55.06 53.15 3hi7 s HIS 675 Cb -0.31 -2.42 0.00 0.00 -1.18 0.00 0.00 32.58 28.67 3hi7 s HIS 675 CO 0.31 -0.91 0.50 0.42 -0.65 0.00 0.00 174.74 174.42 3hi7 s ILE 676 N 1.09 5.02 0.72 0.89 1.01 -1.26 -2.49 121.20 126.18 3hi7 s ILE 676 Ca 0.05 0.17 -0.14 0.00 0.00 0.00 0.00 60.65 60.73 3hi7 s ILE 676 Cb -0.19 -3.99 0.03 0.00 0.01 0.00 0.00 42.46 38.32 3hi7 s ILE 676 CO -0.09 -0.28 1.14 -2.84 0.00 0.00 0.00 174.94 172.86 3hi7 s PRO 677 N 2.37 2.37 0.14 2.79 0.02 -1.26 -5.03 135.00 136.39 3hi7 s PRO 677 Ca 0.17 1.48 -0.04 0.00 0.02 0.00 0.00 61.00 62.64 3hi7 s PRO 677 Cb -0.16 -1.89 -0.03 0.00 0.02 0.00 0.00 34.50 32.45 3hi7 s PRO 677 CO 0.14 -1.60 0.13 -3.38 -0.33 0.00 0.00 177.00 171.96 3hi7 s HIS 678 N -2.34 0.70 0.54 6.54 -3.43 -1.26 -4.53 115.29 111.51 3hi7 s HIS 678 Ca 0.68 -1.07 0.28 0.00 -0.80 0.00 0.00 55.06 54.15 3hi7 s HIS 678 Cb -0.23 -0.34 1.67 0.00 -1.43 0.00 0.00 32.58 32.25 3hi7 s HIS 678 CO 0.46 -0.58 2.20 0.66 -2.00 0.00 0.00 174.74 175.48 3hi7 h SER 679 N 2.77 0.00 0.54 7.38 4.64 -1.91 0.65 113.55 127.62 3hi7 h SER 679 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 3hi7 h SER 679 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3hi7 h SER 679 CO 0.56 0.03 0.00 -0.62 -0.87 0.00 0.00 176.83 175.93 3hi7 n GLU 680 N -3.88 0.04 0.00 4.77 4.71 -1.26 -2.19 120.64 122.84 3hi7 n GLU 680 Ca -0.03 0.29 0.11 0.00 -0.01 0.00 0.00 57.16 57.52 3hi7 n GLU 680 Cb 0.12 -1.58 0.61 0.00 -1.01 0.00 0.00 31.44 29.59 3hi7 n GLU 680 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3hi7 n ASP 681 N -1.66 0.00 -4.63 1.62 8.00 0.22 -4.74 116.55 115.36 3hi7 n ASP 681 Ca 0.03 -0.46 -0.35 0.00 0.71 0.00 0.00 54.79 54.72 3hi7 n ASP 681 Cb 0.18 -0.10 -0.10 0.00 -0.02 0.00 0.00 41.12 41.08 3hi7 n ASP 681 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hi7 s ILE 682 N -2.20 5.01 -0.11 0.53 -1.09 -0.93 -1.66 121.20 120.75 3hi7 s ILE 682 Ca 0.29 0.05 0.17 0.00 -2.23 0.00 0.00 60.65 58.93 3hi7 s ILE 682 Cb 0.15 -3.30 0.11 0.00 -1.58 0.00 0.00 42.46 37.84 3hi7 s ILE 682 CO 0.28 0.40 1.53 1.55 -1.23 0.00 0.00 174.94 177.47 3hi7 h PRO 683 N 7.16 0.00 -5.39 2.79 0.13 -1.84 -3.50 132.00 131.36 3hi7 h PRO 683 Ca -0.38 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.32 3hi7 h PRO 683 Cb 1.17 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.07 3hi7 h PRO 683 CO 0.68 0.42 -0.79 -0.80 -0.23 0.00 0.00 178.00 177.28 3hi7 s ASN 684 N -6.40 1.73 0.33 1.44 0.02 -0.66 -4.60 114.94 106.79 3hi7 s ASN 684 Ca 0.03 -0.55 -0.29 0.00 -1.02 0.00 0.00 52.86 51.03 3hi7 s ASN 684 Cb 0.08 -0.08 -0.10 0.00 0.02 0.00 0.00 41.25 41.17 3hi7 s ASN 684 CO 0.72 -0.02 1.31 0.42 0.02 0.00 0.00 177.10 179.55 3hi7 s THR 685 N -1.09 2.73 0.24 1.60 -4.23 0.17 -4.45 115.64 110.62 3hi7 s THR 685 Ca 0.00 0.73 0.07 0.00 -1.18 0.00 0.00 61.69 61.32 3hi7 s THR 685 Cb -0.09 -3.47 -0.04 0.00 1.34 0.00 0.00 72.50 70.25 3hi7 s THR 685 CO 0.02 0.17 0.14 0.00 -0.54 0.00 0.00 174.62 174.41 3hi7 s ALA 686 N -1.10 3.48 0.14 3.99 0.00 -1.26 -3.39 121.76 123.61 3hi7 s ALA 686 Ca 0.49 -1.45 0.10 0.00 0.00 0.00 0.00 51.96 51.10 3hi7 s ALA 686 Cb -0.40 -1.18 0.06 0.00 0.00 0.00 0.00 23.12 21.60 3hi7 s ALA 686 CO 0.52 0.29 1.43 1.79 0.00 0.00 0.00 175.76 179.79 3hi7 h THR 687 N 1.67 1.48 -2.43 0.00 1.35 -1.91 -3.41 112.91 109.67 3hi7 h THR 687 Ca -0.47 -2.76 -0.54 0.00 -0.55 0.00 0.00 66.41 62.08 3hi7 h THR 687 Cb 1.24 2.52 0.04 0.00 -1.73 0.00 0.00 68.15 70.22 3hi7 h THR 687 CO 0.61 0.77 1.07 -2.65 -0.25 0.00 0.00 175.52 175.06 3hi7 n PRO 688 N -3.49 2.66 -0.51 4.72 -0.02 -1.26 -0.92 135.00 136.18 3hi7 n PRO 688 Ca -0.00 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 3hi7 n PRO 688 Cb 0.79 -2.84 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 3hi7 n PRO 688 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hi7 n GLY 689 N 4.14 1.26 2.60 -1.23 0.00 -1.26 -4.88 105.19 105.81 3hi7 n GLY 689 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 3hi7 n GLY 689 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hi7 n ASN 690 N 0.00 5.98 -4.19 1.61 3.02 -0.10 -4.97 115.26 116.62 3hi7 n ASN 690 Ca 0.00 -3.77 -0.19 0.00 -0.03 0.00 0.00 54.58 50.59 3hi7 n ASN 690 Cb 0.00 -0.71 -0.12 0.00 -0.61 0.00 0.00 39.78 38.34 3hi7 n ASN 690 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3hi7 s SER 691 N -2.51 1.79 0.15 6.41 1.04 -1.26 -1.89 113.70 117.44 3hi7 s SER 691 Ca 0.51 -0.64 -0.01 0.00 0.48 0.00 0.00 55.95 56.29 3hi7 s SER 691 Cb 0.42 -0.06 -0.04 0.00 0.10 0.00 0.00 66.02 66.44 3hi7 s SER 691 CO -0.24 -0.07 0.08 0.68 0.98 0.00 0.00 173.24 174.67 3hi7 s VAL 692 N -1.32 0.07 -4.72 5.02 -7.23 -0.63 -4.94 120.40 106.66 3hi7 s VAL 692 Ca -0.00 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.22 3hi7 s VAL 692 Cb -0.10 -2.20 0.00 0.00 0.56 0.00 0.00 36.38 34.64 3hi7 s VAL 692 CO 0.03 -0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.12 3hi7 n GLY 693 N -0.16 -0.51 3.50 2.32 0.00 -0.41 -1.10 105.19 108.84 3hi7 n GLY 693 Ca -0.03 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 3hi7 n GLY 693 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hi7 s PHE 694 N -3.81 -0.31 0.11 1.61 -0.12 -0.62 -0.48 117.98 114.36 3hi7 s PHE 694 Ca 0.00 0.01 0.09 0.00 -0.05 0.00 0.00 56.93 56.98 3hi7 s PHE 694 Cb 0.00 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.84 3hi7 s PHE 694 CO 0.00 -0.90 -0.24 -0.51 -0.05 0.00 0.00 175.22 173.52 3hi7 s LEU 695 N -2.82 2.29 -0.22 -1.99 1.02 0.39 -0.84 118.68 116.51 3hi7 s LEU 695 Ca 0.05 -0.70 0.01 0.00 0.02 0.00 0.00 54.13 53.52 3hi7 s LEU 695 Cb -0.01 -1.05 0.03 0.00 0.02 0.00 0.00 46.19 45.18 3hi7 s LEU 695 CO -0.07 0.13 -0.13 -0.76 0.02 0.00 0.00 176.35 175.54 3hi7 s LEU 696 N -1.88 2.84 -0.06 1.79 1.43 0.63 -0.96 118.68 122.47 3hi7 s LEU 696 Ca 0.10 -0.95 0.05 0.00 -1.03 0.00 0.00 54.13 52.30 3hi7 s LEU 696 Cb -0.10 -1.55 -0.01 0.00 0.03 0.00 0.00 46.19 44.56 3hi7 s LEU 696 CO 0.05 -0.09 -0.22 -0.13 0.23 0.00 0.00 176.35 176.18 3hi7 s ARG 697 N 1.24 2.44 0.34 1.70 0.52 -0.17 -1.30 118.95 123.73 3hi7 s ARG 697 Ca -0.01 -0.81 -0.29 0.00 -0.52 0.00 0.00 55.73 54.11 3hi7 s ARG 697 Cb -0.16 -2.01 -0.11 0.00 0.52 0.00 0.00 34.95 33.19 3hi7 s ARG 697 CO -0.08 0.29 1.38 -1.25 0.02 0.00 0.00 175.30 175.65 3hi7 s PRO 698 N 0.04 4.26 -0.31 3.54 0.04 -1.26 -0.04 135.00 141.27 3hi7 s PRO 698 Ca -0.08 2.35 -0.03 0.00 0.04 0.00 0.00 61.00 63.28 3hi7 s PRO 698 Cb -0.14 -3.04 0.11 0.00 0.04 0.00 0.00 34.50 31.47 3hi7 s PRO 698 CO 0.05 -0.32 0.14 0.12 0.04 0.00 0.00 177.00 177.02 3hi7 s PHE 699 N -1.06 0.62 -1.73 0.56 5.36 -0.00 -4.79 117.98 116.95 3hi7 s PHE 699 Ca 0.51 -1.16 0.00 0.00 -0.96 0.00 0.00 56.93 55.32 3hi7 s PHE 699 Cb -0.42 -1.04 0.00 0.00 -0.34 0.00 0.00 43.02 41.21 3hi7 s PHE 699 CO 0.56 -0.84 0.00 0.09 -1.46 0.00 0.00 175.22 173.57 3hi7 n ASN 700 N 4.96 -5.01 0.03 6.13 3.02 -1.26 -1.97 115.26 121.16 3hi7 n ASN 700 Ca -0.02 0.35 -0.20 0.00 -0.03 0.00 0.00 54.58 54.68 3hi7 n ASN 700 Cb 0.41 -4.01 -0.14 0.00 -0.61 0.00 0.00 39.78 35.43 3hi7 n ASN 700 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 3hi7 h PHE 701 N 0.00 0.49 -3.11 3.10 3.04 -1.84 -3.34 116.94 115.29 3hi7 h PHE 701 Ca -0.35 -0.36 -0.65 0.00 3.98 0.00 0.00 57.97 60.60 3hi7 h PHE 701 Cb 1.13 -0.02 -0.09 0.00 2.56 0.00 0.00 35.95 39.53 3hi7 h PHE 701 CO 0.47 1.31 -0.58 -0.06 -2.02 0.00 0.00 178.31 177.43 3hi7 s PHE 702 N -2.41 3.28 0.43 0.41 0.40 -1.26 -4.90 117.98 113.93 3hi7 s PHE 702 Ca -0.15 0.18 0.21 0.00 -0.60 0.00 0.00 56.93 56.57 3hi7 s PHE 702 Cb 0.01 -1.71 1.24 0.00 0.51 0.00 0.00 43.02 43.07 3hi7 s PHE 702 CO 0.81 0.55 2.03 -1.35 0.70 0.00 0.00 175.22 177.96 3hi7 h PRO 703 N 3.80 0.00 -3.78 0.24 0.11 -2.00 -3.45 132.00 126.92 3hi7 h PRO 703 Ca -0.48 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.42 3hi7 h PRO 703 Cb 1.18 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 3hi7 h PRO 703 CO 0.64 0.16 -0.03 -1.83 -0.21 0.00 0.00 178.00 176.73 3hi7 s GLU 704 N -4.40 2.06 -0.32 1.05 -1.05 -1.26 -4.97 118.70 109.81 3hi7 s GLU 704 Ca -0.03 -1.69 -0.39 0.00 -0.15 0.00 0.00 54.97 52.70 3hi7 s GLU 704 Cb 0.14 0.51 -0.15 0.00 -0.44 0.00 0.00 34.13 34.19 3hi7 s GLU 704 CO 0.64 -0.90 1.92 -3.47 0.95 0.00 0.00 175.26 174.40 3hi7 n ASP 705 N -1.51 2.15 0.04 0.83 2.03 -1.26 -4.84 116.55 114.00 3hi7 n ASP 705 Ca -0.02 0.84 0.10 0.00 0.52 0.00 0.00 54.79 56.23 3hi7 n ASP 705 Cb 0.61 -1.15 0.41 0.00 -0.72 0.00 0.00 41.12 40.27 3hi7 n ASP 705 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3hi7 n PRO 706 N 6.43 0.07 0.00 -0.67 -0.04 -1.26 -2.12 135.00 137.42 3hi7 n PRO 706 Ca 0.34 0.26 0.11 0.00 -0.04 0.00 0.00 63.50 64.17 3hi7 n PRO 706 Cb 0.14 -1.63 0.55 0.00 -0.04 0.00 0.00 33.50 32.52 3hi7 n PRO 706 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3hi7 n SER 707 N -1.77 0.00 0.30 3.54 3.41 -1.26 -3.68 113.62 114.17 3hi7 n SER 707 Ca 0.04 -0.06 0.18 0.00 -0.26 0.00 0.00 58.87 58.77 3hi7 n SER 707 Cb 0.23 -0.27 0.94 0.00 -0.26 0.00 0.00 64.21 64.85 3hi7 n SER 707 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3hi7 h LEU 708 N 0.00 0.00 -0.82 1.04 3.38 -1.78 0.05 115.31 117.17 3hi7 h LEU 708 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hi7 h LEU 708 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3hi7 h LEU 708 CO 0.00 0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.56 3hi7 n ALA 709 N -2.17 1.46 -2.12 1.53 0.00 -1.24 -4.79 120.51 113.17 3hi7 n ALA 709 Ca -0.02 0.10 -0.42 0.00 0.00 0.00 0.00 53.44 53.10 3hi7 n ALA 709 Cb 0.16 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.24 3hi7 n ALA 709 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3hi7 s SER 710 N -4.04 6.81 0.00 0.00 0.15 -0.00 -4.90 113.70 111.72 3hi7 s SER 710 Ca 0.02 2.37 0.16 0.00 0.70 0.00 0.00 55.95 59.20 3hi7 s SER 710 Cb 0.08 -2.59 0.49 0.00 -1.71 0.00 0.00 66.02 62.29 3hi7 s SER 710 CO 0.31 -0.65 1.39 0.54 1.20 0.00 0.00 173.24 176.03 3hi7 n ARG 711 N 3.75 1.93 0.09 5.44 5.12 -1.26 -3.90 116.66 127.82 3hi7 n ARG 711 Ca 0.11 -1.42 0.13 0.00 -1.93 0.00 0.00 57.85 54.73 3hi7 n ARG 711 Cb 0.42 -1.36 0.39 0.00 -1.16 0.00 0.00 32.46 30.76 3hi7 n ARG 711 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 3hi7 n ASP 712 N 0.65 0.72 -4.70 0.55 8.00 -1.26 -3.64 116.55 116.86 3hi7 n ASP 712 Ca 0.15 0.50 -0.43 0.00 0.71 0.00 0.00 54.79 55.72 3hi7 n ASP 712 Cb 0.36 -0.63 -0.01 0.00 -0.02 0.00 0.00 41.12 40.82 3hi7 n ASP 712 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3hi7 n THR 713 N -2.16 1.66 -5.10 -3.53 -1.04 -1.25 -4.67 114.28 98.19 3hi7 n THR 713 Ca 0.05 -0.42 -0.30 0.00 -2.04 0.00 0.00 64.05 61.35 3hi7 n THR 713 Cb 0.42 -1.61 -0.17 0.00 -1.82 0.00 0.00 70.33 67.16 3hi7 n THR 713 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3hi7 s VAL 714 N -0.75 1.85 -0.09 12.58 1.01 -0.39 -4.30 120.40 130.31 3hi7 s VAL 714 Ca 0.59 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.68 3hi7 s VAL 714 Cb -0.58 -1.60 0.01 0.00 0.00 0.00 0.00 36.38 34.21 3hi7 s VAL 714 CO 0.58 0.52 -0.17 -0.63 0.00 0.00 0.00 175.10 175.40 3hi7 s ILE 715 N 0.21 1.54 -0.22 2.22 1.01 -0.82 -1.24 121.20 123.91 3hi7 s ILE 715 Ca -0.12 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 59.75 3hi7 s ILE 715 Cb -0.16 -1.37 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 3hi7 s ILE 715 CO 0.06 0.45 0.06 -0.69 0.00 0.00 0.00 174.94 174.82 3hi7 s VAL 716 N 0.63 4.46 -0.04 2.92 1.01 0.60 0.14 120.40 130.12 3hi7 s VAL 716 Ca -0.14 -0.13 0.06 0.00 0.00 0.00 0.00 61.98 61.76 3hi7 s VAL 716 Cb -0.16 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.15 3hi7 s VAL 716 CO 0.04 0.39 -0.21 0.26 0.00 0.00 0.00 175.10 175.58 3hi7 s TRP 717 N 1.09 2.50 0.62 5.22 0.52 -0.18 -1.72 118.94 126.99 3hi7 s TRP 717 Ca 0.04 -0.39 -0.14 0.00 0.02 0.00 0.00 56.10 55.63 3hi7 s TRP 717 Cb -0.14 -1.58 -0.02 0.00 -1.15 0.00 0.00 33.47 30.58 3hi7 s TRP 717 CO 0.03 0.01 1.06 -1.25 0.02 0.00 0.00 176.95 176.81 3hi7 s PRO 718 N -0.54 3.21 0.02 4.98 0.04 -1.26 -0.73 135.00 140.72 3hi7 s PRO 718 Ca 0.08 1.11 0.04 0.00 0.04 0.00 0.00 61.00 62.27 3hi7 s PRO 718 Cb -0.11 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.39 3hi7 s PRO 718 CO 0.01 -0.89 -0.11 1.03 0.04 0.00 0.00 177.00 177.07 3hi7 s ARG 719 N -4.40 0.82 -0.14 4.56 1.81 -1.26 -4.76 118.95 115.58 3hi7 s ARG 719 Ca 0.62 -0.59 -0.29 0.00 -1.72 0.00 0.00 55.73 53.74 3hi7 s ARG 719 Cb -0.15 -0.78 -0.05 0.00 -0.45 0.00 0.00 34.95 33.52 3hi7 s ARG 719 CO 0.43 0.20 1.88 -0.51 -0.68 0.00 0.00 175.30 176.62 3hi7 s ASP 720 N -0.83 6.16 -1.44 0.23 1.01 -1.26 -3.53 116.67 117.00 3hi7 s ASP 720 Ca 0.01 2.01 0.00 0.00 0.71 0.00 0.00 52.55 55.28 3hi7 s ASP 720 Cb -0.06 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.34 3hi7 s ASP 720 CO 0.00 -1.38 0.00 -0.46 0.21 0.00 0.00 175.17 173.54 3hi7 n ASN 721 N 9.03 -4.73 -1.48 0.27 0.23 -1.26 -4.97 115.26 112.35 3hi7 n ASN 721 Ca 0.22 0.34 -0.04 0.00 -0.53 0.00 0.00 54.58 54.56 3hi7 n ASN 721 Cb 0.44 -3.42 -0.01 0.00 -2.08 0.00 0.00 39.78 34.70 3hi7 n ASN 721 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3hi7 n GLY 722 N -1.19 3.59 3.78 4.83 0.00 -1.23 -5.16 105.19 109.82 3hi7 n GLY 722 Ca -0.14 -1.65 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 3hi7 n GLY 722 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hi7 s PRO 723 N -2.27 2.53 0.75 1.61 0.02 -1.26 -4.63 135.00 131.75 3hi7 s PRO 723 Ca 0.08 1.17 -0.14 0.00 0.02 0.00 0.00 61.00 62.14 3hi7 s PRO 723 Cb 0.00 -1.93 0.05 0.00 0.02 0.00 0.00 34.50 32.64 3hi7 s PRO 723 CO 0.06 -1.43 1.17 -0.80 -0.33 0.00 0.00 177.00 175.67 3hi7 s ASN 724 N -3.28 4.22 -0.36 2.53 0.01 -1.26 -4.42 114.94 112.38 3hi7 s ASN 724 Ca 0.62 2.21 -0.19 0.00 -0.71 0.00 0.00 52.86 54.79 3hi7 s ASN 724 Cb -0.17 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 38.92 3hi7 s ASN 724 CO 0.52 -2.24 0.55 -0.47 -1.51 0.00 0.00 177.10 173.96 3hi7 s TYR 725 N -2.24 3.16 -0.57 2.20 5.04 0.09 -4.93 117.35 120.11 3hi7 s TYR 725 Ca 0.70 0.17 -0.20 0.00 -2.44 0.00 0.00 57.07 55.30 3hi7 s TYR 725 Cb -0.25 -3.02 0.07 0.00 0.35 0.00 0.00 41.96 39.11 3hi7 s TYR 725 CO 0.47 -0.60 0.75 0.08 -1.34 0.00 0.00 175.55 174.91 3hi7 s VAL 726 N 2.50 4.69 -0.18 3.14 1.01 -1.26 -1.01 120.40 129.29 3hi7 s VAL 726 Ca 0.20 -0.53 -0.24 0.00 0.00 0.00 0.00 61.98 61.41 3hi7 s VAL 726 Cb -0.15 -4.46 -0.02 0.00 0.00 0.00 0.00 36.38 31.75 3hi7 s VAL 726 CO 0.14 -1.07 0.79 -1.58 0.00 0.00 0.00 175.10 173.38 3hi7 s GLN 727 N 3.08 4.26 0.10 2.72 0.74 0.12 -4.97 119.66 125.71 3hi7 s GLN 727 Ca 0.17 0.92 0.04 0.00 0.05 0.00 0.00 55.36 56.54 3hi7 s GLN 727 Cb -0.20 -3.58 -0.04 0.00 1.10 0.00 0.00 33.01 30.29 3hi7 s GLN 727 CO 0.11 -0.33 -0.10 1.03 -0.55 0.00 0.00 175.29 175.44 3hi7 s ARG 728 N 2.19 0.84 0.00 1.67 0.52 -1.26 -1.94 118.95 120.97 3hi7 s ARG 728 Ca 0.36 -1.16 0.05 0.00 -0.52 0.00 0.00 55.73 54.46 3hi7 s ARG 728 Cb -0.16 -0.51 0.07 0.00 0.52 0.00 0.00 34.95 34.87 3hi7 s ARG 728 CO 0.11 0.08 0.80 0.91 0.02 0.00 0.00 175.30 177.21 3hi7 n TRP 729 N 0.55 0.06 -3.77 -0.53 8.01 -1.25 -4.97 117.44 115.54 3hi7 n TRP 729 Ca -0.16 -0.16 -0.13 0.00 -1.31 0.00 0.00 57.50 55.75 3hi7 n TRP 729 Cb 0.58 -0.01 -0.10 0.00 -2.01 0.00 0.00 31.31 29.76 3hi7 n TRP 729 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.69 175.18 3hi7 s ILE 730 N -0.59 0.01 0.59 -0.99 2.07 -1.24 -4.94 121.20 116.11 3hi7 s ILE 730 Ca 0.07 -0.11 -0.18 0.00 -1.41 0.00 0.00 60.65 59.02 3hi7 s ILE 730 Cb 0.04 -0.48 -0.04 0.00 0.13 0.00 0.00 42.46 42.12 3hi7 s ILE 730 CO 0.06 -0.06 1.16 -2.84 -1.91 0.00 0.00 174.94 171.35 3hi7 s PRO 731 N -0.17 3.06 0.32 3.50 0.02 -1.26 -4.95 135.00 135.52 3hi7 s PRO 731 Ca -0.03 1.66 -0.29 0.00 0.02 0.00 0.00 61.00 62.36 3hi7 s PRO 731 Cb -0.03 -1.96 -0.12 0.00 0.02 0.00 0.00 34.50 32.41 3hi7 s PRO 731 CO 0.01 -1.10 1.43 -1.91 -0.33 0.00 0.00 177.00 175.10 3hi7 n GLU 732 N -1.67 2.38 -4.74 5.54 2.13 -1.26 -5.01 120.64 118.01 3hi7 n GLU 732 Ca 0.12 0.84 -0.26 0.00 0.66 0.00 0.00 57.16 58.52 3hi7 n GLU 732 Cb 0.51 -2.52 -0.17 0.00 0.27 0.00 0.00 31.44 29.53 3hi7 n GLU 732 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3hi7 s ASP 733 N 0.03 2.06 -0.07 4.31 2.15 -1.26 -5.00 116.67 118.88 3hi7 s ASP 733 Ca 0.59 -0.35 0.11 0.00 0.43 0.00 0.00 52.55 53.33 3hi7 s ASP 733 Cb -0.54 -0.89 0.19 0.00 -0.30 0.00 0.00 42.92 41.37 3hi7 s ASP 733 CO 0.57 0.08 1.09 0.54 -0.17 0.00 0.00 175.17 177.28 3hi7 n ARG 734 N 3.65 0.71 -2.17 4.34 1.74 -1.26 -5.09 116.66 118.57 3hi7 n ARG 734 Ca -0.21 -1.95 -0.36 0.00 -0.77 0.00 0.00 57.85 54.56 3hi7 n ARG 734 Cb 0.52 -1.02 0.01 0.00 -1.02 0.00 0.00 32.46 30.95 3hi7 n ARG 734 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hi7 s ASP 735 N -2.09 5.69 0.06 0.55 1.01 -1.26 -5.05 116.67 115.58 3hi7 s ASP 735 Ca 0.19 2.30 0.07 0.00 0.71 0.00 0.00 52.55 55.82 3hi7 s ASP 735 Cb 0.18 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.48 3hi7 s ASP 735 CO 0.00 -1.25 -0.19 0.00 0.21 0.00 0.00 175.17 173.94 3hi7 s SER 737 N -1.39 0.18 -0.10 0.00 1.04 -1.26 -4.96 113.70 107.22 3hi7 s SER 737 Ca 0.05 -1.24 -0.08 0.00 0.48 0.00 0.00 55.95 55.17 3hi7 s SER 737 Cb -0.09 0.37 -0.04 0.00 0.10 0.00 0.00 66.02 66.36 3hi7 s SER 737 CO 0.02 -0.82 0.18 -0.04 0.98 0.00 0.00 173.24 173.56 3hi7 s MET 738 N -4.09 3.50 0.88 4.02 -1.94 -1.26 -4.83 119.30 115.58 3hi7 s MET 738 Ca 0.30 -0.08 -0.13 0.00 -1.71 0.00 0.00 55.69 54.07 3hi7 s MET 738 Cb 0.06 -3.18 0.13 0.00 2.01 0.00 0.00 34.83 33.85 3hi7 s MET 738 CO 0.07 0.76 1.22 -1.25 -0.01 0.00 0.00 175.02 175.81 3hi7 s PRO 739 N -1.11 1.40 0.58 2.03 0.04 -1.26 -5.03 135.00 131.65 3hi7 s PRO 739 Ca 0.17 -0.05 -0.19 0.00 0.04 0.00 0.00 61.00 60.97 3hi7 s PRO 739 Cb -0.13 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 3hi7 s PRO 739 CO 0.06 -1.96 1.07 -2.30 0.04 0.00 0.00 177.00 173.92 3hi7 n PRO 740 N -3.53 1.09 -1.37 0.56 -0.02 -1.26 -4.97 135.00 125.51 3hi7 n PRO 740 Ca 0.10 0.41 -0.35 0.00 -2.02 0.00 0.00 63.50 61.65 3hi7 n PRO 740 Cb 0.60 -2.27 0.10 0.00 -0.02 0.00 0.00 33.50 31.92 3hi7 n PRO 740 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3hi7 s PRO 741 N -2.79 1.99 0.31 0.52 0.02 -1.26 -4.92 135.00 128.87 3hi7 s PRO 741 Ca 0.75 1.90 -0.29 0.00 0.02 0.00 0.00 61.00 63.38 3hi7 s PRO 741 Cb -0.42 -1.80 -0.11 0.00 0.02 0.00 0.00 34.50 32.19 3hi7 s PRO 741 CO 0.47 -1.98 1.47 0.12 -0.33 0.00 0.00 177.00 176.75 3hi7 s PHE 742 N -1.82 2.84 0.07 6.54 5.36 -1.26 -5.03 117.98 124.68 3hi7 s PHE 742 Ca 0.77 1.07 -0.05 0.00 -0.96 0.00 0.00 56.93 57.77 3hi7 s PHE 742 Cb -0.33 -3.91 -0.02 0.00 -0.34 0.00 0.00 43.02 38.42 3hi7 s PHE 742 CO 0.46 -2.84 0.08 -1.54 -1.46 0.00 0.00 175.22 169.92 3hi7 s SER 743 N 0.10 0.30 -0.18 6.13 1.04 -1.26 -5.16 113.70 114.67 3hi7 s SER 743 Ca 0.57 -0.83 -0.12 0.00 0.48 0.00 0.00 55.95 56.05 3hi7 s SER 743 Cb -0.44 0.27 0.06 0.00 0.10 0.00 0.00 66.02 66.01 3hi7 s SER 743 CO 0.52 -0.67 0.45 -0.47 0.98 0.00 0.00 173.24 174.05 3hi7 s TYR 744 N -3.89 -0.63 -0.19 5.02 5.04 -1.26 -4.64 117.35 116.80 3hi7 s TYR 744 Ca 0.07 1.37 -0.15 0.00 -2.44 0.00 0.00 57.07 55.91 3hi7 s TYR 744 Cb 0.06 0.29 -0.08 0.00 0.35 0.00 0.00 41.96 42.58 3hi7 s TYR 744 CO -0.10 -0.34 -0.22 -1.71 -1.34 0.00 0.00 175.55 171.84 3hi7 n ASN 745 N 3.94 1.89 0.00 4.32 2.85 -1.26 -5.01 115.26 121.98 3hi7 n ASN 745 Ca -0.21 0.44 0.00 0.00 -0.11 0.00 0.00 54.58 54.71 3hi7 n ASN 745 Cb 0.56 -0.83 0.00 0.00 1.24 0.00 0.00 39.78 40.75 3hi7 n ASN 745 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3hi7 n GLY 746 N 1.47 1.44 3.78 8.20 0.00 -1.26 -5.03 105.19 113.80 3hi7 n GLY 746 Ca -0.21 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 3hi7 n GLY 746 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hi7 s THR 747 N -2.68 4.42 -0.23 2.61 -4.23 -1.26 -5.04 115.64 109.24 3hi7 s THR 747 Ca 0.00 -1.08 -0.03 0.00 -1.18 0.00 0.00 61.69 59.39 3hi7 s THR 747 Cb 0.00 -3.25 0.10 0.00 1.34 0.00 0.00 72.50 70.69 3hi7 s THR 747 CO 0.00 -0.09 0.22 -0.72 -0.54 0.00 0.00 174.62 173.49 3hi7 s TYR 748 N -1.72 -0.24 0.06 3.99 -0.85 -1.26 -4.62 117.35 112.71 3hi7 s TYR 748 Ca 0.30 0.03 -0.00 0.00 -0.52 0.00 0.00 57.07 56.88 3hi7 s TYR 748 Cb -0.10 -0.44 -0.04 0.00 0.38 0.00 0.00 41.96 41.76 3hi7 s TYR 748 CO 0.23 -0.68 -0.04 1.03 -1.52 0.00 0.00 175.55 174.57 3hi7 s ARG 749 N 2.30 0.63 0.76 -3.49 1.81 -1.14 -4.81 118.95 115.01 3hi7 s ARG 749 Ca 0.07 -1.19 -0.14 0.00 -1.72 0.00 0.00 55.73 52.75 3hi7 s ARG 749 Cb -0.15 0.10 0.06 0.00 -0.45 0.00 0.00 34.95 34.50 3hi7 s ARG 749 CO -0.18 -0.08 1.21 -2.14 -0.68 0.00 0.00 175.30 173.43 3hi7 s PRO 750 N -3.66 1.95 0.00 3.54 0.02 -1.25 -1.18 135.00 134.42 3hi7 s PRO 750 Ca 0.06 1.76 0.00 0.00 0.02 0.00 0.00 61.00 62.84 3hi7 s PRO 750 Cb 0.06 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.77 3hi7 s PRO 750 CO -0.08 -1.98 0.21 0.28 -0.33 0.00 0.00 177.00 175.10