#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hs5 n HIS 34 N 0.00 2.34 0.35 -1.40 -0.00 -1.26 -4.87 115.22 110.38 3hs5 n HIS 34 Ca 0.00 0.26 0.12 0.00 -0.00 0.00 0.00 57.72 58.10 3hs5 n HIS 34 Cb 0.00 -2.55 0.52 0.00 -0.00 0.00 0.00 29.99 27.96 3hs5 n HIS 34 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 3hs5 n PRO 35 N 3.31 0.19 0.00 1.57 -0.02 -1.26 -2.20 135.00 136.58 3hs5 n PRO 35 Ca 0.16 0.47 0.14 0.00 -2.02 0.00 0.00 63.50 62.25 3hs5 n PRO 35 Cb 0.30 -1.90 0.45 0.00 -0.02 0.00 0.00 33.50 32.33 3hs5 n PRO 35 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hs5 n SER 38 N -4.49 0.62 -3.72 0.00 3.41 -1.26 -4.02 113.62 104.16 3hs5 n SER 38 Ca 0.22 -1.50 -0.33 0.00 -0.26 0.00 0.00 58.87 57.01 3hs5 n SER 38 Cb 0.87 -0.04 0.04 0.00 -0.26 0.00 0.00 64.21 64.82 3hs5 n SER 38 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3hs5 n ASN 39 N -0.38 -5.24 0.17 4.04 3.02 -0.02 -4.90 115.26 111.94 3hs5 n ASN 39 Ca 0.15 -1.03 0.03 0.00 -0.03 0.00 0.00 54.58 53.71 3hs5 n ASN 39 Cb 0.17 -3.11 0.27 0.00 -0.61 0.00 0.00 39.78 36.50 3hs5 n ASN 39 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3hs5 h PRO 40 N -1.85 0.00 -6.13 3.52 0.13 -1.91 -3.44 132.00 122.32 3hs5 h PRO 40 Ca -0.65 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 63.91 3hs5 h PRO 40 Cb 1.36 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.44 3hs5 h PRO 40 CO 0.47 0.46 0.49 0.00 -0.23 0.00 0.00 178.00 179.20 3hs5 s GLN 42 N 2.06 2.91 -1.32 0.00 -1.52 -0.30 -4.62 119.66 116.86 3hs5 s GLN 42 Ca 0.44 -1.18 -0.04 0.00 -1.95 0.00 0.00 55.36 52.63 3hs5 s GLN 42 Cb -0.17 -2.69 0.02 0.00 -0.22 0.00 0.00 33.01 29.95 3hs5 s GLN 42 CO 0.15 -0.03 0.95 0.09 -0.25 0.00 0.00 175.29 176.20 3hs5 n ASN 43 N -1.61 -3.17 -0.19 5.90 3.02 -1.26 -2.03 115.26 115.92 3hs5 n ASN 43 Ca 0.02 -0.69 -0.02 0.00 -0.03 0.00 0.00 54.58 53.85 3hs5 n ASN 43 Cb 0.59 -4.57 -0.01 0.00 -0.61 0.00 0.00 39.78 35.18 3hs5 n ASN 43 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3hs5 n ARG 44 N -4.46 -0.97 -2.19 3.52 5.12 -1.26 -4.78 116.66 111.64 3hs5 n ARG 44 Ca -0.17 0.40 -0.37 0.00 -1.93 0.00 0.00 57.85 55.78 3hs5 n ARG 44 Cb 0.62 -4.22 0.00 0.00 -1.16 0.00 0.00 32.46 27.71 3hs5 n ARG 44 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 3hs5 s GLY 45 N -2.20 2.77 -0.18 -0.13 0.00 -0.86 -4.96 107.32 101.77 3hs5 s GLY 45 Ca 0.00 0.97 -0.09 0.00 0.00 0.00 0.00 44.72 45.60 3hs5 s GLY 45 CO 0.00 1.42 0.12 -0.54 0.00 0.00 0.00 173.10 174.10 3hs5 s GLU 46 N -2.83 3.97 -0.05 2.90 0.41 -0.66 -4.67 118.70 117.76 3hs5 s GLU 46 Ca 0.66 -0.21 -0.16 0.00 -0.41 0.00 0.00 54.97 54.86 3hs5 s GLU 46 Cb -0.29 -3.34 -0.05 0.00 -1.78 0.00 0.00 34.13 28.67 3hs5 s GLU 46 CO 0.35 0.42 0.42 0.00 -0.49 0.00 0.00 175.26 175.96 3hs5 s MET 48 N -0.43 0.42 0.40 0.00 0.00 -0.79 -5.01 119.30 113.90 3hs5 s MET 48 Ca 0.24 -0.13 -0.25 0.00 0.00 0.00 0.00 55.69 55.55 3hs5 s MET 48 Cb -0.16 -0.43 -0.09 0.00 0.00 0.00 0.00 34.83 34.16 3hs5 s MET 48 CO 0.11 0.06 1.11 -1.54 0.00 0.00 0.00 175.02 174.76 3hs5 s SER 49 N 0.13 6.62 -0.47 1.11 1.04 -1.26 -0.94 113.70 119.92 3hs5 s SER 49 Ca -0.01 2.20 0.07 0.00 0.48 0.00 0.00 55.95 58.69 3hs5 s SER 49 Cb -0.05 -2.60 0.23 0.00 0.10 0.00 0.00 66.02 63.70 3hs5 s SER 49 CO -0.00 -0.60 0.53 0.35 0.98 0.00 0.00 173.24 174.50 3hs5 n THR 50 N -0.00 0.01 0.00 2.02 -2.24 0.66 -4.82 114.28 109.91 3hs5 n THR 50 Ca 0.05 -4.22 0.00 0.00 -2.27 0.00 0.00 64.05 57.61 3hs5 n THR 50 Cb 0.48 -1.95 0.00 0.00 -2.10 0.00 0.00 70.33 66.76 3hs5 n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hs5 n GLY 51 N 1.60 1.29 0.27 3.38 0.00 -1.26 -4.38 105.19 106.09 3hs5 n GLY 51 Ca 0.24 -2.09 -0.06 0.00 0.00 0.00 0.00 46.02 44.11 3hs5 n GLY 51 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3hs5 h PHE 52 N 0.00 0.80 -0.25 1.61 0.04 -1.97 -3.31 116.94 113.86 3hs5 h PHE 52 Ca 0.00 -0.16 0.00 0.00 2.80 0.00 0.00 57.97 60.61 3hs5 h PHE 52 Cb 0.00 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 37.95 3hs5 h PHE 52 CO 0.00 0.83 0.00 -0.25 -0.60 0.00 0.00 178.31 178.29 3hs5 n ASP 53 N -4.15 2.61 -4.07 2.17 8.00 -1.26 -4.36 116.55 115.49 3hs5 n ASP 53 Ca 0.01 -1.85 -0.13 0.00 0.71 0.00 0.00 54.79 53.53 3hs5 n ASP 53 Cb 0.38 -0.16 -0.11 0.00 -0.02 0.00 0.00 41.12 41.21 3hs5 n ASP 53 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3hs5 s GLN 54 N -0.97 0.55 0.28 -1.24 -1.52 -1.25 -4.94 119.66 110.57 3hs5 s GLN 54 Ca 0.19 -0.81 0.06 0.00 -1.95 0.00 0.00 55.36 52.85 3hs5 s GLN 54 Cb 0.11 -0.27 -0.06 0.00 -0.22 0.00 0.00 33.01 32.57 3hs5 s GLN 54 CO 0.14 0.04 -0.04 1.52 -0.25 0.00 0.00 175.29 176.70 3hs5 s TYR 55 N -1.62 1.89 -0.01 0.91 -0.85 -1.26 -0.25 117.35 116.17 3hs5 s TYR 55 Ca -0.08 -0.76 0.01 0.00 -0.52 0.00 0.00 57.07 55.72 3hs5 s TYR 55 Cb -0.08 -1.10 0.00 0.00 0.38 0.00 0.00 41.96 41.15 3hs5 s TYR 55 CO -0.00 0.20 -0.04 0.21 -1.52 0.00 0.00 175.55 174.40 3hs5 s LYS 56 N -3.76 0.36 -0.17 -3.49 2.47 -0.12 -4.77 119.74 110.26 3hs5 s LYS 56 Ca 0.30 -0.13 -0.10 0.00 -1.56 0.00 0.00 55.97 54.49 3hs5 s LYS 56 Cb 0.05 -0.37 -0.05 0.00 -1.46 0.00 0.00 37.83 36.00 3hs5 s LYS 56 CO 0.12 0.06 0.16 0.00 0.16 0.00 0.00 175.35 175.84 3hs5 s ASP 58 N -0.10 6.25 -0.07 0.00 -1.08 0.14 -4.91 116.67 116.89 3hs5 s ASP 58 Ca 0.11 -0.59 0.18 0.00 -0.52 0.00 0.00 52.55 51.73 3hs5 s ASP 58 Cb -0.12 -2.27 0.63 0.00 -1.46 0.00 0.00 42.92 39.70 3hs5 s ASP 58 CO 0.01 -0.69 1.52 0.00 0.52 0.00 0.00 175.17 176.53 3hs5 n THR 60 N 1.14 0.30 -1.29 0.00 -1.04 -1.26 -2.02 114.28 110.10 3hs5 n THR 60 Ca 0.23 -0.05 -0.10 0.00 -2.04 0.00 0.00 64.05 62.08 3hs5 n THR 60 Cb 0.73 -1.40 -0.04 0.00 -1.82 0.00 0.00 70.33 67.79 3hs5 n THR 60 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3hs5 n ARG 61 N 5.02 -1.59 0.19 -2.82 1.74 -1.26 -4.84 116.66 113.10 3hs5 n ARG 61 Ca 0.23 0.83 0.11 0.00 -0.77 0.00 0.00 57.85 58.25 3hs5 n ARG 61 Cb 0.21 -5.18 0.12 0.00 -1.02 0.00 0.00 32.46 26.59 3hs5 n ARG 61 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 3hs5 h THR 62 N 0.00 0.04 0.00 0.55 1.35 -1.71 -3.47 112.91 109.67 3hs5 h THR 62 Ca -0.20 -1.06 0.00 0.00 -0.55 0.00 0.00 66.41 64.60 3hs5 h THR 62 Cb 1.10 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.41 3hs5 h THR 62 CO 0.30 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 176.20 3hs5 n GLY 63 N 1.13 0.72 3.29 5.82 0.00 -1.26 -5.00 105.19 109.89 3hs5 n GLY 63 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.89 3hs5 n GLY 63 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hs5 s PHE 64 N -2.41 1.43 0.15 1.61 0.08 -1.26 -1.71 117.98 115.87 3hs5 s PHE 64 Ca 0.00 -0.82 0.01 0.00 0.12 0.00 0.00 56.93 56.24 3hs5 s PHE 64 Cb 0.00 -0.77 -0.00 0.00 -0.57 0.00 0.00 43.02 41.67 3hs5 s PHE 64 CO 0.00 0.05 0.17 2.48 -0.10 0.00 0.00 175.22 177.82 3hs5 n TYR 65 N -0.31 -0.61 0.00 0.36 0.18 0.35 -4.83 117.16 112.29 3hs5 n TYR 65 Ca -0.08 -1.12 0.00 0.00 1.88 0.00 0.00 57.90 58.59 3hs5 n TYR 65 Cb 0.62 0.18 0.00 0.00 -0.38 0.00 0.00 39.34 39.76 3hs5 n TYR 65 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3hs5 n GLY 66 N -0.26 0.39 0.37 -7.48 0.00 -1.26 -1.49 105.19 95.46 3hs5 n GLY 66 Ca 0.02 -1.86 0.18 0.00 0.00 0.00 0.00 46.02 44.36 3hs5 n GLY 66 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hs5 h GLU 67 N 0.00 0.55 -0.10 1.61 4.81 -2.01 -2.05 114.58 117.38 3hs5 h GLU 67 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3hs5 h GLU 67 Cb 0.00 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.26 3hs5 h GLU 67 CO 0.00 0.36 0.00 0.09 -0.73 0.00 0.00 179.01 178.73 3hs5 n ASN 68 N -4.78 2.75 -3.78 1.04 3.02 -1.26 -4.10 115.26 108.15 3hs5 n ASN 68 Ca 0.26 -2.76 -0.24 0.00 -0.03 0.00 0.00 54.58 51.81 3hs5 n ASN 68 Cb 0.75 -0.36 0.02 0.00 -0.61 0.00 0.00 39.78 39.58 3hs5 n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hs5 n THR 70 N -4.38 0.00 -3.00 0.00 -2.24 -1.09 -4.46 114.28 99.11 3hs5 n THR 70 Ca -0.23 -0.32 -0.43 0.00 -2.27 0.00 0.00 64.05 60.81 3hs5 n THR 70 Cb 0.65 0.93 -0.06 0.00 -2.10 0.00 0.00 70.33 69.75 3hs5 n THR 70 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3hs5 s THR 71 N -1.74 4.72 0.37 4.28 2.01 -0.55 -4.93 115.64 119.80 3hs5 s THR 71 Ca 0.02 0.52 -0.26 0.00 0.31 0.00 0.00 61.69 62.28 3hs5 s THR 71 Cb 0.05 -4.25 -0.09 0.00 0.01 0.00 0.00 72.50 68.22 3hs5 s THR 71 CO 0.29 -0.58 1.09 -2.16 -0.69 0.00 0.00 174.62 172.57 3hs5 s PRO 72 N 3.11 4.26 0.74 4.92 0.04 -1.26 -0.50 135.00 146.31 3hs5 s PRO 72 Ca 0.29 1.67 -0.11 0.00 0.04 0.00 0.00 61.00 62.88 3hs5 s PRO 72 Cb -0.13 -2.75 0.03 0.00 0.04 0.00 0.00 34.50 31.70 3hs5 s PRO 72 CO 0.20 -0.09 1.08 -1.21 0.04 0.00 0.00 177.00 177.02 3hs5 s GLU 73 N -2.17 2.57 0.12 4.56 2.02 -0.70 -4.87 118.70 120.23 3hs5 s GLU 73 Ca 0.54 0.70 -0.23 0.00 0.02 0.00 0.00 54.97 56.00 3hs5 s GLU 73 Cb -0.27 -1.97 -0.05 0.00 0.10 0.00 0.00 34.13 31.95 3hs5 s GLU 73 CO 0.34 -1.29 1.68 0.35 0.02 0.00 0.00 175.26 176.35 3hs5 h PHE 74 N -0.85 -0.34 -0.59 1.61 3.57 -1.96 -2.01 116.94 116.36 3hs5 h PHE 74 Ca -0.46 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.07 3hs5 h PHE 74 Cb 1.24 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 40.12 3hs5 h PHE 74 CO 0.53 -0.20 0.39 -0.07 -2.23 0.00 0.00 178.31 176.73 3hs5 h LEU 75 N -0.19 0.66 -0.78 0.59 -0.00 -1.95 -1.80 115.31 111.84 3hs5 h LEU 75 Ca 0.07 -0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.93 3hs5 h LEU 75 Cb 0.29 -0.16 -0.04 0.00 -0.00 0.00 0.00 40.66 40.75 3hs5 h LEU 75 CO -0.19 0.47 0.44 0.74 -0.00 0.00 0.00 178.44 179.91 3hs5 h THR 76 N 0.78 1.23 -0.35 0.22 2.02 -1.68 -0.60 112.91 114.53 3hs5 h THR 76 Ca 0.22 -0.55 0.04 0.00 0.77 0.00 0.00 66.41 66.90 3hs5 h THR 76 Cb -0.05 0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 66.50 3hs5 h THR 76 CO -0.05 0.25 0.12 0.03 0.37 0.00 0.00 175.52 176.23 3hs5 h ARG 77 N 1.07 0.25 -0.64 6.66 3.08 -0.66 0.22 114.38 124.36 3hs5 h ARG 77 Ca 0.28 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.25 3hs5 h ARG 77 Cb 0.01 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 3hs5 h ARG 77 CO -0.05 0.17 0.14 0.82 -1.07 0.00 0.00 179.97 179.99 3hs5 h ILE 78 N 0.26 1.25 -0.10 2.04 2.04 -1.19 -0.65 117.51 121.16 3hs5 h ILE 78 Ca 0.16 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 3hs5 h ILE 78 Cb 0.14 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 3hs5 h ILE 78 CO -0.17 0.35 0.05 0.11 0.00 0.00 0.00 178.15 178.49 3hs5 h LYS 79 N 0.97 0.15 0.00 2.37 1.57 -0.64 -2.73 116.57 118.26 3hs5 h LYS 79 Ca 0.20 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3hs5 h LYS 79 Cb 0.36 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 3hs5 h LYS 79 CO 0.00 0.25 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.04 3hs5 h LEU 80 N 0.02 0.00 -0.13 2.94 3.38 -0.39 -1.62 115.31 119.52 3hs5 h LEU 80 Ca 0.04 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 3hs5 h LEU 80 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.90 3hs5 h LEU 80 CO -0.00 0.02 -0.53 0.25 0.09 0.00 0.00 178.44 178.26 3hs5 h LEU 81 N 0.00 0.69 0.10 1.67 5.85 -0.87 -3.37 115.31 119.39 3hs5 h LEU 81 Ca -0.00 -0.62 -0.32 0.00 0.84 0.00 0.00 57.88 57.78 3hs5 h LEU 81 Cb 0.35 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 3hs5 h LEU 81 CO 0.00 1.20 -1.70 -0.07 -0.34 0.00 0.00 178.44 177.53 3hs5 h LEU 82 N 0.23 0.34 -9.08 2.25 3.38 -1.23 -3.47 115.31 107.73 3hs5 h LEU 82 Ca -0.03 -0.58 -0.65 0.00 0.09 0.00 0.00 57.88 56.71 3hs5 h LEU 82 Cb 1.16 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.81 3hs5 h LEU 82 CO 0.11 1.50 1.15 1.17 0.09 0.00 0.00 178.44 182.46 3hs5 n LYS 83 N -3.40 1.72 -1.94 1.13 3.00 -0.63 -4.97 118.16 113.08 3hs5 n LYS 83 Ca -0.21 0.60 -0.32 0.00 -0.00 0.00 0.00 58.31 58.38 3hs5 n LYS 83 Cb 1.05 -2.52 0.02 0.00 0.00 0.00 0.00 35.03 33.57 3hs5 n LYS 83 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 3hs5 s PRO 84 N 4.55 3.34 0.68 1.64 0.04 -1.26 -4.99 135.00 138.99 3hs5 s PRO 84 Ca 0.98 1.03 -0.11 0.00 0.04 0.00 0.00 61.00 62.94 3hs5 s PRO 84 Cb -0.79 -2.04 -0.00 0.00 0.04 0.00 0.00 34.50 31.71 3hs5 s PRO 84 CO 0.53 -0.78 1.05 0.95 0.04 0.00 0.00 177.00 178.80 3hs5 s THR 85 N -2.75 4.16 0.46 1.26 -4.23 -1.26 -4.91 115.64 108.37 3hs5 s THR 85 Ca 0.60 0.70 0.14 0.00 -1.18 0.00 0.00 61.69 61.95 3hs5 s THR 85 Cb -0.14 -3.49 0.31 0.00 1.34 0.00 0.00 72.50 70.52 3hs5 s THR 85 CO 0.44 -0.92 2.03 -0.65 -0.54 0.00 0.00 174.62 174.98 3hs5 h PRO 86 N -0.64 0.31 -0.62 3.99 0.11 -1.97 -2.53 132.00 130.66 3hs5 h PRO 86 Ca -0.44 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 3hs5 h PRO 86 Cb 1.21 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 3hs5 h PRO 86 CO 0.58 0.21 0.13 -0.91 -0.21 0.00 0.00 178.00 177.79 3hs5 h ASN 87 N 0.32 0.97 0.09 -2.05 2.35 -1.99 -0.96 115.58 114.31 3hs5 h ASN 87 Ca 0.19 -0.25 -0.23 0.00 -0.55 0.00 0.00 56.30 55.46 3hs5 h ASN 87 Cb 0.34 -0.26 0.01 0.00 0.05 0.00 0.00 38.32 38.46 3hs5 h ASN 87 CO -0.04 0.96 -0.89 0.71 -1.65 0.00 0.00 177.43 176.52 3hs5 h THR 88 N 0.92 1.33 -0.92 2.81 1.35 -1.89 -2.05 112.91 114.46 3hs5 h THR 88 Ca 0.19 -2.21 -0.00 0.00 -0.55 0.00 0.00 66.41 63.84 3hs5 h THR 88 Cb 0.39 2.23 -0.04 0.00 -1.73 0.00 0.00 68.15 69.00 3hs5 h THR 88 CO 0.01 0.68 0.56 0.58 -0.25 0.00 0.00 175.52 177.10 3hs5 h VAL 89 N 0.37 1.25 -0.56 6.82 2.07 -1.43 -1.18 116.25 123.59 3hs5 h VAL 89 Ca -0.08 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 3hs5 h VAL 89 Cb 1.52 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 3hs5 h VAL 89 CO 0.17 0.26 0.27 -0.74 0.02 0.00 0.00 177.57 177.55 3hs5 h HIS 90 N 1.26 0.81 -0.11 1.57 6.17 -1.11 -2.04 115.15 121.71 3hs5 h HIS 90 Ca 0.33 -0.04 0.03 0.00 0.71 0.00 0.00 60.37 61.40 3hs5 h HIS 90 Cb -0.07 -0.25 -0.03 0.00 2.52 0.00 0.00 27.41 29.58 3hs5 h HIS 90 CO 0.00 0.62 -0.07 -0.92 0.71 0.00 0.00 177.93 178.28 3hs5 h TYR 91 N 0.76 -0.16 -0.57 5.26 3.20 -0.82 -0.84 116.97 123.81 3hs5 h TYR 91 Ca 0.19 0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.12 3hs5 h TYR 91 Cb 0.12 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.43 3hs5 h TYR 91 CO -0.00 -0.11 0.31 0.82 -1.64 0.00 0.00 178.16 177.54 3hs5 h ILE 92 N -0.07 0.98 0.00 1.81 2.04 -1.11 -0.77 117.51 120.39 3hs5 h ILE 92 Ca 0.07 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.69 3hs5 h ILE 92 Cb 0.16 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 3hs5 h ILE 92 CO -0.15 0.11 -0.14 -0.07 0.00 0.00 0.00 178.15 177.90 3hs5 h LEU 93 N 0.59 0.00 -2.43 1.44 3.38 -1.09 -3.08 115.31 114.12 3hs5 h LEU 93 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 3hs5 h LEU 93 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3hs5 h LEU 93 CO -0.16 0.14 0.00 0.35 0.09 0.00 0.00 178.44 178.86 3hs5 n THR 94 N -3.30 0.65 -4.57 0.22 -2.24 -0.34 -1.37 114.28 103.33 3hs5 n THR 94 Ca 0.00 -0.83 -0.28 0.00 -2.27 0.00 0.00 64.05 60.68 3hs5 n THR 94 Cb 0.38 0.80 -0.08 0.00 -2.10 0.00 0.00 70.33 69.34 3hs5 n THR 94 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3hs5 s HIS 95 N -1.17 1.78 -1.19 4.78 3.76 -0.36 -4.89 115.29 117.98 3hs5 s HIS 95 Ca 0.32 -1.29 -0.04 0.00 -0.15 0.00 0.00 55.06 53.89 3hs5 s HIS 95 Cb 0.18 -1.21 0.00 0.00 1.11 0.00 0.00 32.58 32.66 3hs5 s HIS 95 CO 0.25 -0.27 1.02 1.19 -0.85 0.00 0.00 174.74 176.07 3hs5 n PHE 96 N -1.01 -2.36 -0.24 1.40 3.01 -1.26 -4.86 117.46 112.13 3hs5 n PHE 96 Ca -0.09 0.91 0.21 0.00 1.01 0.00 0.00 57.45 59.49 3hs5 n PHE 96 Cb 0.65 -4.84 0.54 0.00 -0.01 0.00 0.00 39.48 35.82 3hs5 n PHE 96 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 3hs5 h LYS 97 N -2.14 0.34 -0.39 -1.08 3.64 -1.93 -0.65 116.57 114.37 3hs5 h LYS 97 Ca -0.54 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 58.77 3hs5 h LYS 97 Cb 1.33 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.06 3hs5 h LYS 97 CO 0.49 0.23 0.06 0.78 -2.27 0.00 0.00 179.45 178.74 3hs5 h GLY 98 N 0.35 0.69 0.93 5.01 0.00 -2.00 -1.42 103.07 106.65 3hs5 h GLY 98 Ca 0.48 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 3hs5 h GLY 98 CO -0.17 0.43 0.06 -2.08 0.00 0.00 0.00 176.54 174.78 3hs5 h VAL 99 N 0.49 1.24 -0.16 4.60 2.07 -1.53 -2.84 116.25 120.12 3hs5 h VAL 99 Ca 0.12 -0.88 -0.08 0.00 0.82 0.00 0.00 66.70 66.68 3hs5 h VAL 99 Cb 0.37 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3hs5 h VAL 99 CO 0.01 0.30 -0.24 -0.50 0.02 0.00 0.00 177.57 177.15 3hs5 h TRP 100 N 0.49 0.31 -0.75 1.57 4.06 -1.28 -0.43 115.95 119.93 3hs5 h TRP 100 Ca 0.12 -0.06 -0.04 0.00 2.06 0.00 0.00 58.89 60.97 3hs5 h TRP 100 Cb 0.38 -0.08 -0.03 0.00 -1.00 0.00 0.00 29.16 28.43 3hs5 h TRP 100 CO 0.03 0.51 0.31 -0.97 -3.56 0.00 0.00 178.44 174.76 3hs5 h ASN 101 N 0.26 1.01 0.08 -3.49 -1.24 -1.12 0.40 115.58 111.49 3hs5 h ASN 101 Ca 0.04 -0.14 -0.00 0.00 0.71 0.00 0.00 56.30 56.90 3hs5 h ASN 101 Cb 0.57 -0.26 0.00 0.00 0.73 0.00 0.00 38.32 39.36 3hs5 h ASN 101 CO 0.04 0.89 -0.04 0.40 -1.29 0.00 0.00 177.43 177.43 3hs5 h ILE 102 N 1.08 1.10 -0.35 2.57 2.04 -1.21 -3.13 117.51 119.61 3hs5 h ILE 102 Ca 0.25 -0.70 0.06 0.00 1.00 0.00 0.00 64.86 65.47 3hs5 h ILE 102 Cb 0.18 1.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 3hs5 h ILE 102 CO -0.02 0.17 0.03 0.58 0.00 0.00 0.00 178.15 178.91 3hs5 h VAL 103 N -0.43 0.78 0.00 1.67 2.07 -0.77 -1.01 116.25 118.55 3hs5 h VAL 103 Ca -0.01 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.46 3hs5 h VAL 103 Cb 0.37 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 3hs5 h VAL 103 CO 0.02 0.02 0.04 0.78 0.02 0.00 0.00 177.57 178.45 3hs5 h ASN 104 N 0.13 0.00 -0.04 0.57 2.35 -0.27 -2.10 115.58 116.23 3hs5 h ASN 104 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3hs5 h ASN 104 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 3hs5 h ASN 104 CO -0.26 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.11 3hs5 n ASN 105 N -2.73 2.83 -4.15 5.81 3.02 -0.40 -4.73 115.26 114.91 3hs5 n ASN 105 Ca -0.02 -1.91 -0.37 0.00 -0.03 0.00 0.00 54.58 52.25 3hs5 n ASN 105 Cb 0.09 -0.01 -0.12 0.00 -0.61 0.00 0.00 39.78 39.14 3hs5 n ASN 105 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hs5 s ILE 105 N -1.79 3.39 0.29 2.41 1.01 -0.79 -5.00 121.20 120.72 3hs5 s ILE 105 Ca 0.26 -1.85 0.04 0.00 0.00 0.00 0.00 60.65 59.09 3hs5 s ILE 105 Cb 0.18 -3.23 0.29 0.00 0.01 0.00 0.00 42.46 39.71 3hs5 s ILE 105 CO 0.27 -0.58 1.80 -0.65 0.00 0.00 0.00 174.94 175.78 3hs5 h PRO 106 N 8.10 0.82 -0.26 2.79 0.11 -1.85 -0.44 132.00 141.27 3hs5 h PRO 106 Ca -0.16 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.90 3hs5 h PRO 106 Cb 1.06 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.97 3hs5 h PRO 106 CO 0.68 0.54 0.14 0.35 -0.21 0.00 0.00 178.00 179.50 3hs5 h PHE 107 N 0.84 0.37 -0.50 0.65 3.57 -1.94 0.17 116.94 120.10 3hs5 h PHE 107 Ca 0.55 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.94 3hs5 h PHE 107 Cb 0.74 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 3hs5 h PHE 107 CO -0.01 0.32 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.26 3hs5 h LEU 108 N 0.31 0.92 -0.53 0.59 3.38 -1.62 -1.07 115.31 117.29 3hs5 h LEU 108 Ca 0.09 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.73 3hs5 h LEU 108 Cb 0.08 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 3hs5 h LEU 108 CO -0.01 1.04 0.35 -0.09 0.09 0.00 0.00 178.44 179.82 3hs5 h ARG 109 N 0.79 0.69 0.09 1.13 2.43 -1.02 -1.04 114.38 117.44 3hs5 h ARG 109 Ca 0.13 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 3hs5 h ARG 109 Cb 0.61 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 3hs5 h ARG 109 CO 0.04 0.46 -0.04 0.77 -1.51 0.00 0.00 179.97 179.68 3hs5 h SER 110 N 0.71 -0.10 -0.46 -3.80 0.02 -0.82 -0.61 113.55 108.49 3hs5 h SER 110 Ca 0.20 -0.01 0.06 0.00 -0.84 0.00 0.00 61.79 61.20 3hs5 h SER 110 Cb -0.07 0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.44 3hs5 h SER 110 CO -0.05 -0.06 0.15 0.25 -1.14 0.00 0.00 176.83 175.98 3hs5 h LEU 111 N -0.13 0.15 -0.25 5.07 6.46 -0.98 0.25 115.31 125.88 3hs5 h LEU 111 Ca -0.01 0.06 -0.04 0.00 -0.12 0.00 0.00 57.88 57.76 3hs5 h LEU 111 Cb 0.10 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.07 3hs5 h LEU 111 CO 0.02 0.11 -0.01 0.40 -0.62 0.00 0.00 178.44 178.35 3hs5 h ILE 112 N 0.32 1.26 -0.70 4.05 2.04 -1.13 -2.30 117.51 121.05 3hs5 h ILE 112 Ca 0.22 -0.93 0.01 0.00 1.00 0.00 0.00 64.86 65.16 3hs5 h ILE 112 Cb 0.23 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 3hs5 h ILE 112 CO -0.23 0.29 0.47 -0.03 0.00 0.00 0.00 178.15 178.65 3hs5 h MET 113 N 0.22 0.90 -0.58 2.37 4.05 -0.76 -1.13 114.93 119.99 3hs5 h MET 113 Ca 0.07 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.44 3hs5 h MET 113 Cb 0.43 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 31.00 3hs5 h MET 113 CO 0.01 0.59 0.36 -0.22 0.23 0.00 0.00 176.91 177.89 3hs5 h LYS 114 N 0.92 0.78 -0.03 0.39 3.64 -0.79 -1.27 116.57 120.23 3hs5 h LYS 114 Ca 0.26 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 3hs5 h LYS 114 Cb -0.06 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.58 3hs5 h LYS 114 CO -0.06 0.55 -0.05 -0.92 -2.27 0.00 0.00 179.45 176.70 3hs5 h TYR 115 N 0.79 -0.12 -0.52 1.91 3.20 -0.78 -0.43 116.97 121.02 3hs5 h TYR 115 Ca 0.21 0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.19 3hs5 h TYR 115 Cb -0.04 0.06 -0.09 0.00 1.54 0.00 0.00 36.73 38.20 3hs5 h TYR 115 CO -0.03 -0.08 -0.03 0.28 -1.64 0.00 0.00 178.16 176.67 3hs5 h VAL 116 N -0.07 0.56 -0.35 1.81 2.07 -1.04 -0.74 116.25 118.49 3hs5 h VAL 116 Ca 0.03 -0.03 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 3hs5 h VAL 116 Cb 0.11 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 3hs5 h VAL 116 CO -0.07 0.02 -0.08 -0.07 0.02 0.00 0.00 177.57 177.39 3hs5 h LEU 117 N 0.09 0.68 -0.13 2.57 3.38 -0.94 -3.16 115.31 117.79 3hs5 h LEU 117 Ca 0.26 -0.36 -0.23 0.00 0.09 0.00 0.00 57.88 57.64 3hs5 h LEU 117 Cb 0.40 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 3hs5 h LEU 117 CO -0.46 0.88 -0.99 0.71 0.09 0.00 0.00 178.44 178.67 3hs5 h THR 118 N 0.46 1.46 -0.22 0.22 1.35 -0.81 -3.11 112.91 112.27 3hs5 h THR 118 Ca 0.09 -2.67 -0.06 0.00 -0.55 0.00 0.00 66.41 63.22 3hs5 h THR 118 Cb 0.58 2.57 -0.01 0.00 -1.73 0.00 0.00 68.15 69.56 3hs5 h THR 118 CO 0.03 0.79 -0.12 0.77 -0.25 0.00 0.00 175.52 176.74 3hs5 h SER 119 N 0.15 0.34 0.10 5.36 4.64 -1.23 -2.64 113.55 120.27 3hs5 h SER 119 Ca -0.08 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 3hs5 h SER 119 Cb 1.65 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.65 3hs5 h SER 119 CO 0.16 0.50 -0.02 0.54 -0.87 0.00 0.00 176.83 177.14 3hs5 n ARG 120 N -4.24 1.06 -0.07 4.77 5.12 -1.19 -4.39 116.66 117.71 3hs5 n ARG 120 Ca 0.00 -0.26 -0.10 0.00 -1.93 0.00 0.00 57.85 55.56 3hs5 n ARG 120 Cb 0.29 -1.49 -0.07 0.00 -1.16 0.00 0.00 32.46 30.03 3hs5 n ARG 120 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 3hs5 h SER 121 N 0.63 0.00 0.01 0.55 4.64 -1.40 -3.37 113.55 114.62 3hs5 h SER 121 Ca 0.00 -0.42 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3hs5 h SER 121 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 3hs5 h SER 121 CO 0.00 0.94 0.00 0.00 -0.87 0.00 0.00 176.83 176.90 3hs5 n TYR 122 N -4.61 0.00 0.39 4.77 4.11 -1.26 -2.70 117.16 117.85 3hs5 n TYR 122 Ca -0.12 0.00 0.12 0.00 -0.00 0.00 0.00 57.90 57.90 3hs5 n TYR 122 Cb 0.36 -0.40 0.22 0.00 -0.00 0.00 0.00 39.34 39.53 3hs5 n TYR 122 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.86 176.79 3hs5 h LEU 123 N 0.00 0.00 -8.98 -3.48 3.38 -1.85 -3.45 115.31 100.94 3hs5 h LEU 123 Ca 0.00 -0.03 -0.63 0.00 0.09 0.00 0.00 57.88 57.31 3hs5 h LEU 123 Cb 0.01 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 40.57 3hs5 h LEU 123 CO 0.00 0.01 -0.61 -0.63 0.09 0.00 0.00 178.44 177.30 3hs5 s ILE 124 N -3.19 4.34 -0.22 1.22 -1.09 -1.10 -5.03 121.20 116.14 3hs5 s ILE 124 Ca 0.07 -0.20 -0.29 0.00 -2.23 0.00 0.00 60.65 58.01 3hs5 s ILE 124 Cb 0.09 -2.93 -0.03 0.00 -1.58 0.00 0.00 42.46 38.01 3hs5 s ILE 124 CO 0.67 0.48 1.71 -1.81 -1.23 0.00 0.00 174.94 174.76 3hs5 s ASP 125 N 0.35 6.24 -0.18 3.58 1.01 -1.26 -4.98 116.67 121.43 3hs5 s ASP 125 Ca -0.01 1.67 -0.04 0.00 0.71 0.00 0.00 52.55 54.88 3hs5 s ASP 125 Cb -0.13 -2.53 0.09 0.00 1.01 0.00 0.00 42.92 41.35 3hs5 s ASP 125 CO 0.02 -1.36 0.23 -0.55 0.21 0.00 0.00 175.17 173.71 3hs5 s SER 126 N 4.83 1.04 0.51 0.27 0.15 -1.26 -3.41 113.70 115.83 3hs5 s SER 126 Ca 0.76 0.03 -0.22 0.00 0.70 0.00 0.00 55.95 57.22 3hs5 s SER 126 Cb -0.26 0.48 -0.07 0.00 -1.71 0.00 0.00 66.02 64.45 3hs5 s SER 126 CO 0.31 -0.30 1.08 -2.65 1.20 0.00 0.00 173.24 172.89 3hs5 n PRO 127 N 5.33 1.31 -1.22 5.44 -0.02 -1.26 -4.92 135.00 139.66 3hs5 n PRO 127 Ca -0.05 0.48 -0.30 0.00 -2.02 0.00 0.00 63.50 61.61 3hs5 n PRO 127 Cb 0.50 -2.23 0.13 0.00 -0.02 0.00 0.00 33.50 31.88 3hs5 n PRO 127 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3hs5 s PRO 128 N -2.47 1.45 0.00 0.52 0.04 -1.22 -5.06 135.00 128.26 3hs5 s PRO 128 Ca 0.69 0.88 0.00 0.00 0.04 0.00 0.00 61.00 62.61 3hs5 s PRO 128 Cb -0.47 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.24 3hs5 s PRO 128 CO 0.52 -2.12 0.00 0.25 0.04 0.00 0.00 177.00 175.69 3hs5 n THR 129 N -3.81 0.00 -1.75 1.26 -2.24 -1.26 -4.73 114.28 101.75 3hs5 n THR 129 Ca 0.07 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.54 3hs5 n THR 129 Cb 0.55 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.80 3hs5 n THR 129 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3hs5 s TYR 130 N 0.25 3.42 0.10 4.78 2.02 -1.26 -4.44 117.35 122.23 3hs5 s TYR 130 Ca 0.00 1.34 0.01 0.00 -0.37 0.00 0.00 57.07 58.04 3hs5 s TYR 130 Cb 0.00 -2.79 -0.00 0.00 -0.40 0.00 0.00 41.96 38.77 3hs5 s TYR 130 CO 0.00 -0.91 0.12 0.27 -1.57 0.00 0.00 175.55 173.45 3hs5 n ASN 131 N -2.91 -0.31 0.07 2.29 0.23 -0.93 -0.35 115.26 113.35 3hs5 n ASN 131 Ca 0.07 -1.62 0.12 0.00 -0.53 0.00 0.00 54.58 52.62 3hs5 n ASN 131 Cb 0.54 0.63 0.60 0.00 -2.08 0.00 0.00 39.78 39.47 3hs5 n ASN 131 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 3hs5 h VAL 132 N 1.31 0.91 -0.00 3.53 3.04 -1.87 -1.83 116.25 121.34 3hs5 h VAL 132 Ca -0.08 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 3hs5 h VAL 132 Cb 0.36 0.74 0.00 0.00 -2.01 0.00 0.00 31.29 30.38 3hs5 h VAL 132 CO 0.11 0.03 -0.82 1.41 -1.01 0.00 0.00 177.57 177.28 3hs5 n HIS 133 N -4.47 0.00 -3.81 3.17 8.25 -1.26 -4.81 115.22 112.29 3hs5 n HIS 133 Ca 0.04 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.21 3hs5 n HIS 133 Cb 0.31 -0.07 -0.15 0.00 1.12 0.00 0.00 29.99 31.19 3hs5 n HIS 133 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3hs5 s TYR 134 N -2.97 1.99 -2.19 4.41 2.02 -0.69 -4.93 117.35 114.99 3hs5 s TYR 134 Ca 0.10 -1.77 0.23 0.00 -0.37 0.00 0.00 57.07 55.25 3hs5 s TYR 134 Cb 0.17 -1.74 1.06 0.00 -0.40 0.00 0.00 41.96 41.05 3hs5 s TYR 134 CO 0.80 -0.83 1.72 0.41 -1.57 0.00 0.00 175.55 176.08 3hs5 n GLY 135 N 4.77 -0.33 3.16 0.71 0.00 -1.26 -2.20 105.19 110.04 3hs5 n GLY 135 Ca -0.04 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.53 3hs5 n GLY 135 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hs5 s TYR 136 N -1.92 1.02 0.26 1.61 -0.85 -1.26 -4.90 117.35 111.31 3hs5 s TYR 136 Ca 0.34 -0.60 -0.30 0.00 -0.52 0.00 0.00 57.07 55.98 3hs5 s TYR 136 Cb 0.17 -0.57 -0.11 0.00 0.38 0.00 0.00 41.96 41.84 3hs5 s TYR 136 CO 0.27 -0.01 1.52 0.15 -1.52 0.00 0.00 175.55 175.97 3hs5 s LYS 137 N -2.45 4.20 0.08 -3.49 1.02 -1.26 -4.84 119.74 113.00 3hs5 s LYS 137 Ca 0.02 2.42 -0.14 0.00 0.02 0.00 0.00 55.97 58.29 3hs5 s LYS 137 Cb -0.05 -3.08 0.02 0.00 -0.52 0.00 0.00 37.83 34.20 3hs5 s LYS 137 CO 0.00 -0.53 0.33 -1.54 -0.92 0.00 0.00 175.35 172.69 3hs5 s SER 138 N 0.52 -0.14 0.37 2.83 1.04 -1.26 -5.04 113.70 112.02 3hs5 s SER 138 Ca 0.62 -0.29 0.09 0.00 0.48 0.00 0.00 55.95 56.86 3hs5 s SER 138 Cb -0.45 0.40 0.72 0.00 0.10 0.00 0.00 66.02 66.79 3hs5 s SER 138 CO 0.43 -0.72 1.86 -0.25 0.98 0.00 0.00 173.24 175.55 3hs5 h TRP 139 N 2.82 0.22 -0.20 5.02 2.91 -1.99 -1.35 115.95 123.38 3hs5 h TRP 139 Ca -0.33 -0.03 -0.01 0.00 1.13 0.00 0.00 58.89 59.65 3hs5 h TRP 139 Cb 1.22 -0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 29.80 3hs5 h TRP 139 CO 0.40 0.41 0.11 1.49 -1.03 0.00 0.00 178.44 179.82 3hs5 h GLU 140 N 0.19 0.29 -0.56 2.65 4.57 -1.97 0.71 114.58 120.45 3hs5 h GLU 140 Ca 0.03 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.13 3hs5 h GLU 140 Cb 0.50 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.01 3hs5 h GLU 140 CO 0.03 0.29 0.19 0.00 -1.18 0.00 0.00 179.01 178.34 3hs5 h ALA 141 N 0.99 0.73 -0.14 2.92 0.00 -1.81 -1.76 119.26 120.19 3hs5 h ALA 141 Ca 0.07 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3hs5 h ALA 141 Cb 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3hs5 h ALA 141 CO -0.01 0.38 0.04 0.35 0.00 0.00 0.00 179.25 180.01 3hs5 h PHE 142 N 0.78 0.23 0.00 0.00 3.57 -1.10 -3.35 116.94 117.08 3hs5 h PHE 142 Ca 0.18 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.66 3hs5 h PHE 142 Cb 0.26 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.93 3hs5 h PHE 142 CO 0.01 0.36 -0.73 0.66 -2.23 0.00 0.00 178.31 176.38 3hs5 h SER 143 N 0.04 0.00 -2.86 0.41 4.64 -0.80 -3.44 113.55 111.53 3hs5 h SER 143 Ca 0.04 -0.07 -0.66 0.00 -0.47 0.00 0.00 61.79 60.64 3hs5 h SER 143 Cb 0.24 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.17 3hs5 h SER 143 CO -0.00 0.04 0.35 0.21 -0.87 0.00 0.00 176.83 176.56 3hs5 s ASN 144 N -5.07 6.20 0.10 4.97 3.84 -0.67 -4.89 114.94 119.42 3hs5 s ASN 144 Ca 0.03 -1.05 0.19 0.00 0.21 0.00 0.00 52.86 52.24 3hs5 s ASN 144 Cb 0.10 -2.37 0.79 0.00 -0.55 0.00 0.00 41.25 39.23 3hs5 s ASN 144 CO 0.75 -1.25 1.60 0.18 -2.79 0.00 0.00 177.10 175.58 3hs5 n LEU 145 N 7.07 0.26 0.13 3.21 4.77 -1.26 -2.82 117.00 128.37 3hs5 n LEU 145 Ca -0.05 0.56 0.12 0.00 -0.03 0.00 0.00 56.01 56.61 3hs5 n LEU 145 Cb 0.45 -0.52 0.49 0.00 -2.33 0.00 0.00 43.42 41.51 3hs5 n LEU 145 CO 0.61 -0.33 0.86 -1.20 -1.33 0.00 0.00 177.39 176.00 3hs5 n SER 146 N -1.78 0.70 -4.83 -1.43 7.64 -1.26 -4.72 113.62 107.94 3hs5 n SER 146 Ca 0.03 0.67 -0.37 0.00 1.01 0.00 0.00 58.87 60.21 3hs5 n SER 146 Cb 0.21 -0.82 -0.06 0.00 -1.01 0.00 0.00 64.21 62.54 3hs5 n SER 146 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 3hs5 s TYR 147 N -3.32 3.71 0.40 1.43 2.02 -1.13 0.04 117.35 120.50 3hs5 s TYR 147 Ca 0.04 1.16 -0.26 0.00 -0.37 0.00 0.00 57.07 57.65 3hs5 s TYR 147 Cb 0.09 -2.43 -0.09 0.00 -0.40 0.00 0.00 41.96 39.14 3hs5 s TYR 147 CO 0.41 0.51 1.20 0.71 -1.57 0.00 0.00 175.55 176.82 3hs5 s TYR 148 N -1.28 3.02 0.83 2.71 2.02 -0.69 -4.73 117.35 119.22 3hs5 s TYR 148 Ca 0.33 1.52 -0.10 0.00 -0.37 0.00 0.00 57.07 58.44 3hs5 s TYR 148 Cb -0.17 -3.47 0.13 0.00 -0.40 0.00 0.00 41.96 38.05 3hs5 s TYR 148 CO 0.19 -1.50 1.16 -0.08 -1.57 0.00 0.00 175.55 173.75 3hs5 s THR 149 N -1.36 2.09 -0.07 -0.71 -1.32 -0.37 -4.48 115.64 109.43 3hs5 s THR 149 Ca 0.57 -0.16 0.01 0.00 -1.21 0.00 0.00 61.69 60.89 3hs5 s THR 149 Cb -0.33 -2.93 0.02 0.00 -1.51 0.00 0.00 72.50 67.75 3hs5 s THR 149 CO 0.41 0.00 -0.07 -0.13 -2.21 0.00 0.00 174.62 172.62 3hs5 s ARG 150 N -5.55 1.23 0.32 7.08 1.81 0.52 -0.49 118.95 123.88 3hs5 s ARG 150 Ca 0.67 -0.22 0.14 0.00 -1.72 0.00 0.00 55.73 54.59 3hs5 s ARG 150 Cb -0.07 -1.17 0.52 0.00 -0.45 0.00 0.00 34.95 33.78 3hs5 s ARG 150 CO 0.49 -0.09 1.69 0.00 -0.68 0.00 0.00 175.30 176.70 3hs5 h ALA 151 N 7.37 1.04 -4.18 2.13 0.00 -1.97 -3.34 119.26 120.31 3hs5 h ALA 151 Ca -0.32 -0.46 -0.48 0.00 0.00 0.00 0.00 54.91 53.65 3hs5 h ALA 151 Cb 1.16 -0.08 -0.29 0.00 0.00 0.00 0.00 17.79 18.58 3hs5 h ALA 151 CO 0.44 0.63 -0.81 -0.51 0.00 0.00 0.00 179.25 179.00 3hs5 s LEU 152 N -7.52 2.02 0.71 0.00 1.43 -1.26 -5.04 118.68 109.02 3hs5 s LEU 152 Ca -0.01 -0.25 -0.15 0.00 -1.03 0.00 0.00 54.13 52.69 3hs5 s LEU 152 Cb 0.12 -0.71 0.03 0.00 0.03 0.00 0.00 46.19 45.66 3hs5 s LEU 152 CO 0.73 0.17 1.18 -2.16 0.23 0.00 0.00 176.35 176.50 3hs5 s PRO 153 N -0.30 2.30 0.74 1.29 0.04 -1.26 -4.92 135.00 132.89 3hs5 s PRO 153 Ca 0.05 1.67 -0.14 0.00 0.04 0.00 0.00 61.00 62.62 3hs5 s PRO 153 Cb -0.05 -1.86 0.04 0.00 0.04 0.00 0.00 34.50 32.67 3hs5 s PRO 153 CO -0.00 -1.69 1.18 -1.25 0.04 0.00 0.00 177.00 175.28 3hs5 s PRO 154 N -3.94 2.14 0.29 0.56 0.04 -1.26 -4.64 135.00 128.18 3hs5 s PRO 154 Ca 0.73 1.66 -0.29 0.00 0.04 0.00 0.00 61.00 63.13 3hs5 s PRO 154 Cb -0.27 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.32 3hs5 s PRO 154 CO 0.44 -1.82 1.39 0.08 0.04 0.00 0.00 177.00 177.13 3hs5 s VAL 155 N -2.14 2.65 0.59 -0.36 1.01 -0.13 -4.87 120.40 117.16 3hs5 s VAL 155 Ca 0.72 0.60 -0.19 0.00 0.00 0.00 0.00 61.98 63.11 3hs5 s VAL 155 Cb -0.27 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 3hs5 s VAL 155 CO 0.46 0.12 1.21 0.00 0.00 0.00 0.00 175.10 176.89 3hs5 s ALA 156 N -0.54 2.56 0.47 5.51 0.00 -1.26 -4.90 121.76 123.60 3hs5 s ALA 156 Ca 0.55 1.02 0.24 0.00 0.00 0.00 0.00 51.96 53.76 3hs5 s ALA 156 Cb -0.41 -3.45 1.40 0.00 0.00 0.00 0.00 23.12 20.65 3hs5 s ALA 156 CO 0.48 -1.16 2.10 -0.44 0.00 0.00 0.00 175.76 176.74 3hs5 h ASP 157 N 0.92 0.00 -0.66 0.00 3.32 -2.01 -2.76 116.42 115.23 3hs5 h ASP 157 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 3hs5 h ASP 157 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 3hs5 h ASP 157 CO 0.55 0.10 0.00 -0.90 -1.72 0.00 0.00 179.24 177.28 3hs5 n ASP 158 N -3.93 4.62 -4.77 6.45 5.75 -1.26 -4.99 116.55 118.42 3hs5 n ASP 158 Ca -0.02 -2.37 -0.40 0.00 -0.01 0.00 0.00 54.79 51.99 3hs5 n ASP 158 Cb 0.20 -0.56 -0.01 0.00 -1.03 0.00 0.00 41.12 39.71 3hs5 n ASP 158 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hs5 h PRO 160 N 2.99 0.13 -5.78 0.00 0.13 -1.91 -3.43 132.00 124.13 3hs5 h PRO 160 Ca -0.49 -0.02 -0.50 0.00 -0.87 0.00 0.00 66.00 64.12 3hs5 h PRO 160 Cb 1.24 -0.02 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 3hs5 h PRO 160 CO 0.64 0.20 -0.74 0.95 -0.23 0.00 0.00 178.00 178.81 3hs5 s THR 161 N -4.91 1.97 0.33 1.56 -4.23 -0.84 -4.80 115.64 104.71 3hs5 s THR 161 Ca -0.05 -2.26 0.06 0.00 -1.18 0.00 0.00 61.69 58.26 3hs5 s THR 161 Cb 0.16 -2.11 0.31 0.00 1.34 0.00 0.00 72.50 72.20 3hs5 s THR 161 CO 0.70 -0.52 1.86 -0.65 -0.54 0.00 0.00 174.62 175.47 3hs5 h PRO 162 N 2.51 0.79 -0.01 3.99 0.11 -1.78 -1.53 132.00 136.07 3hs5 h PRO 162 Ca -0.39 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3hs5 h PRO 162 Cb 1.23 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3hs5 h PRO 162 CO 0.61 0.52 -0.06 -1.33 -0.21 0.00 0.00 178.00 177.53 3hs5 n MET 163 N -4.58 1.43 0.00 1.05 2.81 -1.26 -4.90 117.12 111.67 3hs5 n MET 163 Ca 0.18 -0.81 0.00 0.00 -1.81 0.00 0.00 57.70 55.25 3hs5 n MET 163 Cb 0.41 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.44 3hs5 n MET 163 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3hs5 n GLY 164 N 1.21 1.25 0.00 3.03 0.00 -0.58 -4.75 105.19 105.36 3hs5 n GLY 164 Ca 0.17 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.76 3hs5 n GLY 164 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hs5 n VAL 165 N 0.00 0.00 -2.09 1.61 0.24 -1.26 -1.99 118.33 114.84 3hs5 n VAL 165 Ca 0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.00 3hs5 n VAL 165 Cb 0.00 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3hs5 n VAL 165 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3hs5 s LYS 166 N -1.65 3.61 0.85 7.34 1.02 -1.26 -4.70 119.74 124.94 3hs5 s LYS 166 Ca 0.00 0.63 0.00 0.00 0.02 0.00 0.00 55.97 56.62 3hs5 s LYS 166 Cb 0.00 -2.16 0.00 0.00 -0.52 0.00 0.00 37.83 35.15 3hs5 s LYS 166 CO 0.00 -0.46 0.00 0.41 -0.92 0.00 0.00 175.35 174.38 3hs5 n GLY 167 N -2.55 -2.13 3.91 -3.33 0.00 -1.26 -4.58 105.19 95.24 3hs5 n GLY 167 Ca 0.05 -1.45 -0.28 0.00 0.00 0.00 0.00 46.02 44.34 3hs5 n GLY 167 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hs5 s ASN 168 N -3.70 4.93 0.40 1.61 0.02 -1.26 -4.96 114.94 111.98 3hs5 s ASN 168 Ca 0.00 0.77 0.10 0.00 -1.02 0.00 0.00 52.86 52.71 3hs5 s ASN 168 Cb 0.00 -1.43 0.90 0.00 0.02 0.00 0.00 41.25 40.75 3hs5 s ASN 168 CO 0.00 -1.60 1.96 0.50 0.02 0.00 0.00 177.10 177.98 3hs5 h LYS 169 N -0.74 0.54 -5.79 -0.60 3.11 -1.93 -3.41 116.57 107.76 3hs5 h LYS 169 Ca -0.45 -0.03 -0.53 0.00 -2.81 0.00 0.00 60.65 56.82 3hs5 h LYS 169 Cb 1.30 -0.12 -0.26 0.00 -1.00 0.00 0.00 32.23 32.15 3hs5 h LYS 169 CO 0.63 0.36 -0.82 -1.21 -2.81 0.00 0.00 179.45 175.60 3hs5 s GLU 170 N -5.52 1.24 0.67 1.90 8.01 -1.26 -4.40 118.70 119.34 3hs5 s GLU 170 Ca -0.09 -0.85 -0.14 0.00 0.01 0.00 0.00 54.97 53.90 3hs5 s GLU 170 Cb 0.20 -1.30 0.01 0.00 -4.31 0.00 0.00 34.13 28.72 3hs5 s GLU 170 CO 0.76 0.33 1.10 -0.51 0.01 0.00 0.00 175.26 176.95 3hs5 s LEU 171 N -1.09 3.33 0.54 1.80 1.43 -1.26 -4.99 118.68 118.44 3hs5 s LEU 171 Ca 0.05 1.95 -0.22 0.00 -1.03 0.00 0.00 54.13 54.88 3hs5 s LEU 171 Cb -0.08 -4.54 -0.05 0.00 0.03 0.00 0.00 46.19 41.54 3hs5 s LEU 171 CO 0.01 -1.66 1.32 -0.81 0.23 0.00 0.00 176.35 175.45 3hs5 n PRO 172 N -2.58 1.66 -1.65 1.29 -0.04 -1.26 -4.86 135.00 127.56 3hs5 n PRO 172 Ca 0.10 0.61 -0.59 0.00 -0.04 0.00 0.00 63.50 63.58 3hs5 n PRO 172 Cb 0.52 -2.52 -0.08 0.00 -0.04 0.00 0.00 33.50 31.38 3hs5 n PRO 172 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3hs5 n ASP 173 N -0.84 1.44 0.23 3.54 -0.08 -1.26 -4.84 116.55 114.73 3hs5 n ASP 173 Ca 0.10 1.13 0.06 0.00 -1.51 0.00 0.00 54.79 54.57 3hs5 n ASP 173 Cb 0.44 -1.04 0.53 0.00 2.34 0.00 0.00 41.12 43.38 3hs5 n ASP 173 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3hs5 h SER 174 N 5.19 0.00 -0.85 1.67 4.64 -1.97 -1.86 113.55 120.37 3hs5 h SER 174 Ca -0.47 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.82 3hs5 h SER 174 Cb 1.36 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.41 3hs5 h SER 174 CO 0.86 0.17 0.41 0.50 -0.87 0.00 0.00 176.83 177.90 3hs5 h LYS 175 N 0.00 1.22 -0.36 4.77 3.64 -1.95 -1.01 116.57 122.88 3hs5 h LYS 175 Ca -0.00 -0.18 -0.05 0.00 -1.27 0.00 0.00 60.65 59.15 3hs5 h LYS 175 Cb 0.31 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3hs5 h LYS 175 CO 0.02 0.94 0.04 0.93 -2.27 0.00 0.00 179.45 179.11 3hs5 h GLU 176 N 1.21 0.61 -0.07 1.90 4.39 -1.72 -0.86 114.58 120.03 3hs5 h GLU 176 Ca 0.29 -0.17 0.01 0.00 0.34 0.00 0.00 59.36 59.83 3hs5 h GLU 176 Cb 0.12 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 3hs5 h GLU 176 CO -0.04 0.69 0.00 0.28 -1.16 0.00 0.00 179.01 178.79 3hs5 h VAL 177 N 0.44 0.96 -0.15 3.13 2.07 -1.32 -1.17 116.25 120.20 3hs5 h VAL 177 Ca 0.11 -0.01 0.04 0.00 0.82 0.00 0.00 66.70 67.66 3hs5 h VAL 177 Cb 0.39 0.93 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 3hs5 h VAL 177 CO 0.01 0.00 -0.10 0.25 0.02 0.00 0.00 177.57 177.75 3hs5 h LEU 178 N 0.03 -0.34 -0.33 2.57 5.85 -1.12 -2.32 115.31 119.65 3hs5 h LEU 178 Ca 0.03 0.07 -0.18 0.00 0.84 0.00 0.00 57.88 58.65 3hs5 h LEU 178 Cb 0.03 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 3hs5 h LEU 178 CO -0.05 -0.14 -0.49 -0.33 -0.34 0.00 0.00 178.44 177.09 3hs5 h GLU 179 N -0.11 0.91 -0.14 1.25 5.08 -1.05 -1.09 114.58 119.43 3hs5 h GLU 179 Ca 0.09 -0.54 -0.11 0.00 -1.00 0.00 0.00 59.36 57.80 3hs5 h GLU 179 Cb 0.24 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3hs5 h GLU 179 CO -0.22 1.18 -0.35 0.87 -1.00 0.00 0.00 179.01 179.50 3hs5 h LYS 180 N 0.71 0.48 0.00 2.33 1.57 -1.18 -3.40 116.57 117.08 3hs5 h LYS 180 Ca 0.03 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 3hs5 h LYS 180 Cb 1.09 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.45 3hs5 h LYS 180 CO 0.11 0.95 -0.01 1.33 -0.57 0.00 0.00 179.45 181.26 3hs5 n VAL 181 N -4.35 0.00 -0.10 0.50 0.24 -0.88 -4.87 118.33 108.88 3hs5 n VAL 181 Ca -0.07 -0.39 -0.14 0.00 -2.04 0.00 0.00 64.34 61.70 3hs5 n VAL 181 Cb 0.51 0.99 -0.09 0.00 -1.47 0.00 0.00 33.84 33.78 3hs5 n VAL 181 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3hs5 n LEU 182 N -0.80 2.85 -4.73 1.34 4.77 -0.70 -0.48 117.00 119.25 3hs5 n LEU 182 Ca 0.00 -0.07 -0.41 0.00 -0.03 0.00 0.00 56.01 55.49 3hs5 n LEU 182 Cb 0.00 -0.67 -0.03 0.00 -2.33 0.00 0.00 43.42 40.40 3hs5 n LEU 182 CO 0.00 0.79 1.03 -0.76 -1.33 0.00 0.00 177.39 177.12 3hs5 s LEU 183 N -6.21 4.40 0.28 2.23 1.43 -0.50 -0.94 118.68 119.38 3hs5 s LEU 183 Ca -0.26 2.44 -0.30 0.00 -1.03 0.00 0.00 54.13 54.98 3hs5 s LEU 183 Cb 0.07 -3.61 -0.11 0.00 0.03 0.00 0.00 46.19 42.57 3hs5 s LEU 183 CO 0.44 -0.59 1.58 -0.60 0.23 0.00 0.00 176.35 177.40 3hs5 s ARG 184 N 0.11 4.14 0.00 1.70 3.52 0.55 -4.25 118.95 124.72 3hs5 s ARG 184 Ca 0.59 2.54 0.00 0.00 -0.13 0.00 0.00 55.73 58.73 3hs5 s ARG 184 Cb -0.38 -3.04 0.00 0.00 -1.56 0.00 0.00 34.95 29.97 3hs5 s ARG 184 CO 0.37 -0.61 0.00 0.54 -0.81 0.00 0.00 175.30 174.80 3hs5 n ARG 185 N 2.29 0.00 -2.70 5.12 3.00 -1.24 -4.81 116.66 118.31 3hs5 n ARG 185 Ca 0.08 0.00 -0.40 0.00 -0.01 0.00 0.00 57.85 57.52 3hs5 n ARG 185 Cb 0.38 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.78 3hs5 n ARG 185 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 3hs5 s GLU 186 N 0.00 4.80 0.20 5.56 8.01 -1.26 -5.03 118.70 130.98 3hs5 s GLU 186 Ca 0.00 1.54 -0.32 0.00 0.01 0.00 0.00 54.97 56.20 3hs5 s GLU 186 Cb 0.00 -3.24 -0.12 0.00 -4.31 0.00 0.00 34.13 26.46 3hs5 s GLU 186 CO 0.00 0.45 1.73 0.12 0.01 0.00 0.00 175.26 177.57 3hs5 s PHE 187 N -1.20 2.84 -0.38 1.61 5.36 -1.26 -4.94 117.98 120.01 3hs5 s PHE 187 Ca 0.42 0.32 -0.07 0.00 -0.96 0.00 0.00 56.93 56.63 3hs5 s PHE 187 Cb -0.27 -4.14 0.06 0.00 -0.34 0.00 0.00 43.02 38.34 3hs5 s PHE 187 CO 0.33 -4.35 0.18 0.42 -1.46 0.00 0.00 175.22 170.35 3hs5 s ILE 188 N 1.31 3.93 0.54 3.12 1.01 -1.26 -5.09 121.20 124.77 3hs5 s ILE 188 Ca 0.75 -1.35 -0.19 0.00 0.00 0.00 0.00 60.65 59.86 3hs5 s ILE 188 Cb -0.49 -3.36 -0.06 0.00 0.01 0.00 0.00 42.46 38.56 3hs5 s ILE 188 CO 0.32 -0.38 1.13 -2.16 0.00 0.00 0.00 174.94 173.85 3hs5 s PRO 189 N 1.38 3.37 -0.07 2.79 0.04 -1.26 -0.66 135.00 140.60 3hs5 s PRO 189 Ca 0.02 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 62.36 3hs5 s PRO 189 Cb -0.21 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 3hs5 s PRO 189 CO 0.02 -0.84 1.48 0.34 0.04 0.00 0.00 177.00 178.04 3hs5 s ASP 190 N -1.79 6.79 0.52 6.66 2.15 0.27 -4.15 116.67 127.13 3hs5 s ASP 190 Ca 0.73 2.07 0.34 0.00 0.43 0.00 0.00 52.55 56.11 3hs5 s ASP 190 Cb -0.24 -2.54 1.58 0.00 -0.30 0.00 0.00 42.92 41.43 3hs5 s ASP 190 CO 0.27 -0.83 2.02 1.55 -0.17 0.00 0.00 175.17 178.02 3hs5 h PRO 191 N 8.69 0.00 0.00 4.34 0.13 -1.87 -1.11 132.00 142.18 3hs5 h PRO 191 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 3hs5 h PRO 191 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3hs5 h PRO 191 CO 0.94 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.75 3hs5 n GLN 192 N -2.89 0.32 -1.56 0.86 6.02 -1.25 -4.93 117.38 113.94 3hs5 n GLN 192 Ca -0.00 0.01 -0.03 0.00 -0.01 0.00 0.00 57.00 56.97 3hs5 n GLN 192 Cb 0.21 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.96 3hs5 n GLN 192 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hs5 n GLY 193 N 1.23 0.44 3.75 1.08 0.00 -0.42 -4.81 105.19 106.45 3hs5 n GLY 193 Ca 0.12 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 3hs5 n GLY 193 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hs5 n SER 194 N 1.45 3.60 -2.67 1.61 7.64 -1.26 0.92 113.62 124.91 3hs5 n SER 194 Ca -0.03 1.19 -0.06 0.00 1.01 0.00 0.00 58.87 60.98 3hs5 n SER 194 Cb 0.31 -1.58 -0.00 0.00 -1.01 0.00 0.00 64.21 61.93 3hs5 n SER 194 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3hs5 n ASN 195 N 1.18 1.51 0.17 6.43 0.23 -0.75 0.30 115.26 124.33 3hs5 n ASN 195 Ca 0.05 -1.46 0.05 0.00 -0.53 0.00 0.00 54.58 52.69 3hs5 n ASN 195 Cb 0.37 0.00 0.22 0.00 -2.08 0.00 0.00 39.78 38.30 3hs5 n ASN 195 CO 0.00 0.00 0.00 0.24 -0.93 0.00 0.00 177.26 176.57 3hs5 h MET 196 N 0.00 0.00 -0.98 -3.83 2.86 -0.24 -2.09 114.93 110.64 3hs5 h MET 196 Ca -0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 3hs5 h MET 196 Cb 0.30 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.91 3hs5 h MET 196 CO 0.13 0.40 0.63 0.52 1.06 0.00 0.00 176.91 179.66 3hs5 h MET 197 N 0.00 1.31 -0.11 1.72 2.86 -1.83 -1.06 114.93 117.82 3hs5 h MET 197 Ca -0.00 -0.09 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 3hs5 h MET 197 Cb 1.08 -0.29 -0.00 0.00 0.06 0.00 0.00 31.60 32.45 3hs5 h MET 197 CO 0.05 0.88 -0.09 0.35 1.06 0.00 0.00 176.91 179.16 3hs5 h PHE 198 N 1.34 0.30 -0.54 -0.22 3.57 -1.74 -1.67 116.94 117.99 3hs5 h PHE 198 Ca 0.36 -0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.79 3hs5 h PHE 198 Cb -0.12 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.52 3hs5 h PHE 198 CO 0.00 0.66 0.33 0.00 -2.23 0.00 0.00 178.31 177.07 3hs5 h ALA 199 N 0.60 0.69 0.00 2.41 0.00 -1.23 -0.12 119.26 121.60 3hs5 h ALA 199 Ca 0.02 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 3hs5 h ALA 199 Cb 0.60 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3hs5 h ALA 199 CO 0.02 0.06 -0.58 0.74 0.00 0.00 0.00 179.25 179.49 3hs5 h PHE 200 N 0.66 0.00 -0.32 0.00 0.04 -1.26 -2.19 116.94 113.87 3hs5 h PHE 200 Ca 0.21 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.91 3hs5 h PHE 200 Cb -0.00 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 3hs5 h PHE 200 CO -0.06 0.58 -0.08 0.35 -0.60 0.00 0.00 178.31 178.50 3hs5 h PHE 201 N 0.00 0.69 -0.52 -0.55 3.57 -0.95 -0.15 116.94 119.03 3hs5 h PHE 201 Ca -0.01 -0.15 0.04 0.00 3.53 0.00 0.00 57.97 61.39 3hs5 h PHE 201 Cb 1.27 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.79 3hs5 h PHE 201 CO 0.00 0.79 0.27 0.00 -2.23 0.00 0.00 178.31 177.15 3hs5 h ALA 202 N 0.80 0.67 -0.07 2.41 0.00 -0.92 0.19 119.26 122.34 3hs5 h ALA 202 Ca 0.08 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3hs5 h ALA 202 Cb 0.57 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 3hs5 h ALA 202 CO 0.03 -0.06 -0.00 0.37 0.00 0.00 0.00 179.25 179.59 3hs5 h GLN 203 N 0.53 0.13 0.11 0.00 4.15 -1.29 -2.22 115.11 116.52 3hs5 h GLN 203 Ca 0.23 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.60 3hs5 h GLN 203 Cb 0.12 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.80 3hs5 h GLN 203 CO -0.15 0.40 -0.05 1.25 -1.93 0.00 0.00 178.83 178.35 3hs5 h HIS 204 N -0.17 -0.14 0.20 3.99 2.76 -0.76 -2.78 115.15 118.26 3hs5 h HIS 204 Ca 0.02 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 3hs5 h HIS 204 Cb 0.35 0.05 -0.00 0.00 1.55 0.00 0.00 27.41 29.35 3hs5 h HIS 204 CO 0.04 -0.00 -0.12 0.35 -1.30 0.00 0.00 177.93 176.89 3hs5 h PHE 205 N -0.24 -0.31 0.00 5.26 3.57 -0.67 -3.14 116.94 121.41 3hs5 h PHE 205 Ca -0.02 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 3hs5 h PHE 205 Cb 0.20 0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 3hs5 h PHE 205 CO -0.04 -0.19 -0.12 1.79 -2.23 0.00 0.00 178.31 177.52 3hs5 h THR 206 N -0.31 0.31 0.00 4.41 1.35 -1.46 -2.88 112.91 114.33 3hs5 h THR 206 Ca -0.02 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 3hs5 h THR 206 Cb 0.26 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 3hs5 h THR 206 CO 0.02 0.12 0.00 1.41 -0.25 0.00 0.00 175.52 176.83 3hs5 n HIS 207 N -3.27 0.00 0.10 4.73 8.25 -1.05 -0.38 115.22 123.60 3hs5 n HIS 207 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.45 3hs5 n HIS 207 Cb 0.37 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.45 3hs5 n HIS 207 CO 0.00 0.00 0.00 -0.56 0.64 0.00 0.00 176.34 176.42 3hs5 h GLN 208 N 0.00 0.00 0.00 -0.41 3.07 -1.62 -3.40 115.11 112.74 3hs5 h GLN 208 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3hs5 h GLN 208 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 3hs5 h GLN 208 CO 0.00 0.68 -0.58 1.97 0.09 0.00 0.00 178.83 180.98 3hs5 n PHE 209 N -3.25 0.00 -3.36 0.06 1.16 -0.74 -4.81 117.46 106.53 3hs5 n PHE 209 Ca 0.00 0.00 -0.45 0.00 -1.87 0.00 0.00 57.45 55.13 3hs5 n PHE 209 Cb 0.82 -0.03 -0.06 0.00 -1.61 0.00 0.00 39.48 38.60 3hs5 n PHE 209 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 3hs5 s PHE 210 N -1.69 3.27 -0.41 2.97 0.08 0.49 -4.79 117.98 117.90 3hs5 s PHE 210 Ca 0.00 -1.31 0.07 0.00 0.12 0.00 0.00 56.93 55.81 3hs5 s PHE 210 Cb 0.02 -3.65 0.22 0.00 -0.57 0.00 0.00 43.02 39.05 3hs5 s PHE 210 CO 0.12 -0.98 0.51 1.63 -0.10 0.00 0.00 175.22 176.41 3hs5 n LYS 211 N 5.20 0.56 -1.84 0.44 5.02 -1.26 -4.53 118.16 121.75 3hs5 n LYS 211 Ca -0.13 -3.01 -0.41 0.00 -2.02 0.00 0.00 58.31 52.73 3hs5 n LYS 211 Cb 0.41 -1.37 -0.02 0.00 -0.02 0.00 0.00 35.03 34.03 3hs5 n LYS 211 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3hs5 s THR 212 N -0.57 2.25 -1.01 -0.18 2.01 -1.26 -0.03 115.64 116.85 3hs5 s THR 212 Ca 0.34 0.20 -0.17 0.00 0.31 0.00 0.00 61.69 62.38 3hs5 s THR 212 Cb 0.13 -3.13 0.16 0.00 0.01 0.00 0.00 72.50 69.67 3hs5 s THR 212 CO -0.15 0.03 1.18 -0.62 -0.69 0.00 0.00 174.62 174.38 3hs5 s ASP 213 N 0.52 6.80 0.00 3.53 -1.08 -0.19 -4.72 116.67 121.53 3hs5 s ASP 213 Ca 0.63 -2.43 0.16 0.00 -0.52 0.00 0.00 52.55 50.39 3hs5 s ASP 213 Cb -0.46 -2.38 0.70 0.00 -1.46 0.00 0.00 42.92 39.32 3hs5 s ASP 213 CO 0.45 -0.90 1.50 1.41 0.52 0.00 0.00 175.17 178.15 3hs5 n HIS 214 N 5.92 0.00 -0.06 -5.34 8.25 -1.26 -1.00 115.22 121.72 3hs5 n HIS 214 Ca 0.27 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.68 3hs5 n HIS 214 Cb 0.47 -0.46 0.17 0.00 1.12 0.00 0.00 29.99 31.28 3hs5 n HIS 214 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 3hs5 h LYS 215 N 0.00 0.69 0.07 -0.41 6.56 -1.98 -3.31 116.57 118.19 3hs5 h LYS 215 Ca 0.00 -0.22 -0.37 0.00 -1.06 0.00 0.00 60.65 59.00 3hs5 h LYS 215 Cb 0.25 -0.06 -0.04 0.00 -0.57 0.00 0.00 32.23 31.81 3hs5 h LYS 215 CO 0.00 0.78 -2.18 0.54 -2.06 0.00 0.00 179.45 176.53 3hs5 n ARG 216 N -4.17 0.71 0.00 3.15 1.74 -0.29 -5.11 116.66 112.69 3hs5 n ARG 216 Ca 0.01 0.22 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 3hs5 n ARG 216 Cb 0.35 -1.63 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 3hs5 n ARG 216 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hs5 n GLY 217 N 2.08 2.58 0.31 -0.13 0.00 -0.17 -4.95 105.19 104.91 3hs5 n GLY 217 Ca -0.38 -1.67 0.18 0.00 0.00 0.00 0.00 46.02 44.14 3hs5 n GLY 217 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hs5 h PRO 218 N 0.00 0.00 -0.21 1.61 0.13 -1.90 -2.33 132.00 129.31 3hs5 h PRO 218 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3hs5 h PRO 218 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3hs5 h PRO 218 CO 0.00 0.01 0.00 0.41 -0.23 0.00 0.00 178.00 178.19 3hs5 n GLY 219 N -1.16 0.12 3.39 1.56 0.00 -1.26 -4.88 105.19 102.96 3hs5 n GLY 219 Ca -0.03 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 3hs5 n GLY 219 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hs5 s PHE 220 N -1.73 2.38 0.17 1.61 0.08 -0.87 -1.71 117.98 117.91 3hs5 s PHE 220 Ca 0.23 -0.36 0.09 0.00 0.12 0.00 0.00 56.93 57.01 3hs5 s PHE 220 Cb 0.12 -1.37 -0.04 0.00 -0.57 0.00 0.00 43.02 41.16 3hs5 s PHE 220 CO 0.17 0.22 -0.20 -0.08 -0.10 0.00 0.00 175.22 175.24 3hs5 s THR 221 N -0.92 1.95 -1.92 0.64 -1.32 0.11 -1.02 115.64 113.17 3hs5 s THR 221 Ca 0.13 -1.96 0.22 0.00 -1.21 0.00 0.00 61.69 58.88 3hs5 s THR 221 Cb -0.10 -1.92 -0.03 0.00 -1.51 0.00 0.00 72.50 68.94 3hs5 s THR 221 CO 0.04 -0.27 1.07 0.54 -2.21 0.00 0.00 174.62 173.79 3hs5 n ARG 222 N 0.26 1.07 -2.77 7.08 5.12 0.96 -4.66 116.66 123.71 3hs5 n ARG 222 Ca -0.13 -0.88 -0.44 0.00 -1.93 0.00 0.00 57.85 54.48 3hs5 n ARG 222 Cb 0.57 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.39 3hs5 n ARG 222 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3hs5 n GLY 223 N 1.43 3.67 0.05 -0.13 0.00 -1.26 -4.83 105.19 104.12 3hs5 n GLY 223 Ca 0.09 -2.00 0.11 0.00 0.00 0.00 0.00 46.02 44.21 3hs5 n GLY 223 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hs5 n LEU 224 N 5.36 0.30 0.21 0.99 4.77 -1.26 -1.56 117.00 125.81 3hs5 n LEU 224 Ca 0.38 0.55 0.14 0.00 -0.03 0.00 0.00 56.01 57.05 3hs5 n LEU 224 Cb 0.41 -0.49 0.37 0.00 -2.33 0.00 0.00 43.42 41.39 3hs5 n LEU 224 CO 0.68 -0.26 0.88 1.23 -1.33 0.00 0.00 177.39 178.59 3hs5 h GLY 225 N 3.38 0.00 -6.26 -0.72 0.00 -1.94 -3.48 103.07 94.05 3hs5 h GLY 225 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.87 3hs5 h GLY 225 CO 0.00 0.00 -0.83 1.42 0.00 0.00 0.00 176.54 177.13 3hs5 n HIS 226 N -2.89 -1.94 -0.95 5.60 8.25 -0.60 -4.82 115.22 117.86 3hs5 n HIS 226 Ca 0.03 0.83 0.00 0.00 -0.26 0.00 0.00 57.72 58.33 3hs5 n HIS 226 Cb 0.43 -4.09 0.00 0.00 1.12 0.00 0.00 29.99 27.45 3hs5 n HIS 226 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hs5 n GLY 227 N -1.68 -0.55 3.46 -1.41 0.00 -1.26 -4.38 105.19 99.36 3hs5 n GLY 227 Ca -0.20 -0.75 -0.44 0.00 0.00 0.00 0.00 46.02 44.62 3hs5 n GLY 227 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hs5 s VAL 228 N -3.75 5.06 -1.18 1.61 1.01 -1.26 -4.54 120.40 117.35 3hs5 s VAL 228 Ca 0.00 -2.58 0.13 0.00 0.00 0.00 0.00 61.98 59.52 3hs5 s VAL 228 Cb 0.00 -4.88 -0.00 0.00 0.00 0.00 0.00 36.38 31.49 3hs5 s VAL 228 CO 0.00 -1.59 0.74 -0.90 0.00 0.00 0.00 175.10 173.35 3hs5 n ASP 229 N 5.57 1.41 -2.55 3.32 5.68 -1.26 -4.96 116.55 123.75 3hs5 n ASP 229 Ca 0.35 -1.20 -0.21 0.00 -0.50 0.00 0.00 54.79 53.22 3hs5 n ASP 229 Cb 0.43 0.46 0.00 0.00 -1.14 0.00 0.00 41.12 40.88 3hs5 n ASP 229 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3hs5 n LEU 230 N -0.18 -2.13 0.30 -2.12 4.32 -1.26 -4.90 117.00 111.03 3hs5 n LEU 230 Ca 0.05 -0.08 0.18 0.00 -0.02 0.00 0.00 56.01 56.14 3hs5 n LEU 230 Cb 0.27 -2.95 1.00 0.00 -1.62 0.00 0.00 43.42 40.11 3hs5 n LEU 230 CO 0.16 -0.11 1.15 -0.55 -1.22 0.00 0.00 177.39 176.82 3hs5 h ASN 231 N -0.34 0.00 0.84 -1.43 7.08 -1.89 -0.62 115.58 119.22 3hs5 h ASN 231 Ca -0.50 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.72 3hs5 h ASN 231 Cb 1.37 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.61 3hs5 h ASN 231 CO 0.58 0.00 0.00 0.00 -2.08 0.00 0.00 177.43 175.93 3hs5 n HIS 232 N -3.55 0.71 -0.11 4.14 1.44 -1.26 0.30 115.22 116.88 3hs5 n HIS 232 Ca -0.02 0.26 -0.18 0.00 -2.01 0.00 0.00 57.72 55.76 3hs5 n HIS 232 Cb 0.13 -0.92 -0.09 0.00 0.12 0.00 0.00 29.99 29.23 3hs5 n HIS 232 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 3hs5 n ILE 233 N -2.13 1.23 0.77 0.61 5.41 -0.42 -1.57 119.36 123.27 3hs5 n ILE 233 Ca 0.03 -0.41 0.11 0.00 1.00 0.00 0.00 62.75 63.48 3hs5 n ILE 233 Cb 0.26 -1.47 -0.06 0.00 -0.71 0.00 0.00 39.64 37.66 3hs5 n ILE 233 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 3hs5 n TYR 234 N -3.47 0.05 0.00 1.39 4.01 -0.37 -3.18 117.16 115.59 3hs5 n TYR 234 Ca -0.40 0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.35 3hs5 n TYR 234 Cb 0.87 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.72 3hs5 n TYR 234 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hs5 n GLY 235 N 1.44 0.75 0.17 2.72 0.00 0.15 -3.40 105.19 107.02 3hs5 n GLY 235 Ca 0.03 -1.58 -0.12 0.00 0.00 0.00 0.00 46.02 44.35 3hs5 n GLY 235 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hs5 h GLU 236 N 0.00 0.44 -6.18 1.61 4.57 -1.78 -3.42 114.58 109.82 3hs5 h GLU 236 Ca 0.00 -0.40 -0.56 0.00 -1.18 0.00 0.00 59.36 57.23 3hs5 h GLU 236 Cb 0.00 0.09 -0.09 0.00 -0.16 0.00 0.00 28.75 28.59 3hs5 h GLU 236 CO 0.00 1.04 -0.63 0.95 -1.18 0.00 0.00 179.01 179.19 3hs5 s THR 237 N -3.52 3.34 0.26 0.32 -4.23 -1.26 -5.03 115.64 105.52 3hs5 s THR 237 Ca -0.06 -1.90 -0.01 0.00 -1.18 0.00 0.00 61.69 58.54 3hs5 s THR 237 Cb 0.10 -2.85 0.09 0.00 1.34 0.00 0.00 72.50 71.17 3hs5 s THR 237 CO 0.85 -0.34 1.73 0.25 -0.54 0.00 0.00 174.62 176.57 3hs5 h LEU 238 N 1.85 0.68 -0.18 4.79 5.85 -1.95 -1.77 115.31 124.58 3hs5 h LEU 238 Ca -0.44 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.13 3hs5 h LEU 238 Cb 1.25 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 3hs5 h LEU 238 CO 0.61 0.82 -0.08 0.44 -0.34 0.00 0.00 178.44 179.89 3hs5 h ASP 239 N 0.63 -0.27 -0.42 1.25 3.32 -1.98 -0.79 116.42 118.16 3hs5 h ASP 239 Ca 0.11 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.19 3hs5 h ASP 239 Cb 0.56 0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.25 3hs5 h ASP 239 CO 0.03 -0.11 0.12 -0.09 -1.72 0.00 0.00 179.24 177.47 3hs5 h ARG 240 N -0.06 0.66 -0.47 3.56 2.43 -1.85 -2.04 114.38 116.62 3hs5 h ARG 240 Ca 0.10 -0.15 0.06 0.00 -0.81 0.00 0.00 59.98 59.18 3hs5 h ARG 240 Cb 0.20 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.61 3hs5 h ARG 240 CO -0.22 0.66 0.17 0.37 -1.51 0.00 0.00 179.97 179.45 3hs5 h GLN 241 N 0.54 0.34 -0.30 0.20 4.15 -1.13 -1.53 115.11 117.37 3hs5 h GLN 241 Ca 0.13 -0.02 -0.06 0.00 0.77 0.00 0.00 58.65 59.47 3hs5 h GLN 241 Cb 0.29 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.89 3hs5 h GLN 241 CO -0.00 0.23 -0.07 0.45 -1.93 0.00 0.00 178.83 177.50 3hs5 h HIS 242 N 0.35 0.52 0.00 3.99 3.86 -0.92 -1.65 115.15 121.30 3hs5 h HIS 242 Ca 0.22 -0.06 -0.09 0.00 -1.16 0.00 0.00 60.37 59.27 3hs5 h HIS 242 Cb 0.21 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 3hs5 h HIS 242 CO -0.15 0.56 -0.45 0.87 0.86 0.00 0.00 177.93 179.62 3hs5 h LYS 243 N 0.46 0.00 0.00 2.45 1.57 -0.73 -3.04 116.57 117.28 3hs5 h LYS 243 Ca 0.09 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 3hs5 h LYS 243 Cb 0.41 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 3hs5 h LYS 243 CO 0.02 0.45 -0.24 -0.07 -0.57 0.00 0.00 179.45 179.03 3hs5 h LEU 244 N 0.00 0.00 -9.87 2.94 3.38 -0.54 -3.45 115.31 107.77 3hs5 h LEU 244 Ca -0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3hs5 h LEU 244 Cb 0.86 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 3hs5 h LEU 244 CO 0.06 0.12 0.06 -0.13 0.09 0.00 0.00 178.44 178.64 3hs5 s ARG 245 N -3.16 4.16 0.28 1.13 0.52 -0.69 -0.58 118.95 120.60 3hs5 s ARG 245 Ca 0.05 0.75 0.14 0.00 -0.52 0.00 0.00 55.73 56.15 3hs5 s ARG 245 Cb 0.06 -2.84 0.26 0.00 0.52 0.00 0.00 34.95 32.94 3hs5 s ARG 245 CO 0.70 0.39 1.53 1.25 0.02 0.00 0.00 175.30 179.19 3hs5 h LEU 246 N 3.32 0.00 1.53 2.53 5.85 -1.22 -3.41 115.31 123.91 3hs5 h LEU 246 Ca -0.48 0.00 -0.38 0.00 0.84 0.00 0.00 57.88 57.86 3hs5 h LEU 246 Cb 1.19 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 42.12 3hs5 h LEU 246 CO 0.65 0.58 -0.40 0.49 -0.34 0.00 0.00 178.44 179.43 3hs5 n PHE 247 N -3.44 -0.32 -4.10 1.25 3.72 -1.25 -4.99 117.46 108.33 3hs5 n PHE 247 Ca 0.00 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.22 3hs5 n PHE 247 Cb 0.69 -3.38 -0.16 0.00 -0.94 0.00 0.00 39.48 35.69 3hs5 n PHE 247 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 3hs5 s LYS 248 N -4.07 0.59 -1.87 -1.08 2.20 -1.26 -4.87 119.74 109.38 3hs5 s LYS 248 Ca 0.00 -0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.54 3hs5 s LYS 248 Cb 0.00 -0.65 0.00 0.00 -1.51 0.00 0.00 37.83 35.67 3hs5 s LYS 248 CO 0.00 -0.06 0.00 -0.25 -0.36 0.00 0.00 175.35 174.68 3hs5 n ASP 249 N 3.87 -4.84 0.00 1.43 8.00 -1.26 -1.47 116.55 122.28 3hs5 n ASP 249 Ca -0.24 0.39 0.00 0.00 0.71 0.00 0.00 54.79 55.66 3hs5 n ASP 249 Cb 0.52 -4.30 0.00 0.00 -0.02 0.00 0.00 41.12 37.32 3hs5 n ASP 249 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hs5 n GLY 250 N -0.42 0.68 3.86 0.44 0.00 -1.22 -4.72 105.19 103.80 3hs5 n GLY 250 Ca -0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 3hs5 n GLY 250 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hs5 s LYS 251 N -0.22 3.12 0.12 1.61 1.02 -0.54 -3.98 119.74 120.86 3hs5 s LYS 251 Ca 0.00 0.72 -0.10 0.00 0.02 0.00 0.00 55.97 56.60 3hs5 s LYS 251 Cb 0.00 -2.03 -0.06 0.00 -0.52 0.00 0.00 37.83 35.22 3hs5 s LYS 251 CO 0.00 -0.91 0.45 -0.51 -0.92 0.00 0.00 175.35 173.46 3hs5 s LEU 252 N -5.37 4.31 0.62 3.17 1.43 -1.26 -0.84 118.68 120.75 3hs5 s LEU 252 Ca 0.57 0.85 -0.19 0.00 -1.03 0.00 0.00 54.13 54.33 3hs5 s LEU 252 Cb -0.12 -3.17 -0.02 0.00 0.03 0.00 0.00 46.19 42.91 3hs5 s LEU 252 CO 0.54 0.11 1.26 0.29 0.23 0.00 0.00 176.35 178.78 3hs5 n LYS 253 N 0.66 1.21 -3.95 1.70 5.02 0.25 -4.54 118.16 118.53 3hs5 n LYS 253 Ca -0.06 0.47 -0.09 0.00 -2.02 0.00 0.00 58.31 56.61 3hs5 n LYS 253 Cb 0.52 -2.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.01 3hs5 n LYS 253 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 3hs5 s TYR 254 N -1.38 0.20 0.24 2.13 -0.85 -1.26 -4.12 117.35 112.31 3hs5 s TYR 254 Ca 0.79 -0.61 0.07 0.00 -0.52 0.00 0.00 57.07 56.80 3hs5 s TYR 254 Cb -0.39 0.39 -0.05 0.00 0.38 0.00 0.00 41.96 42.28 3hs5 s TYR 254 CO 0.43 -1.12 -0.10 1.14 -1.52 0.00 0.00 175.55 174.39 3hs5 s GLN 255 N -3.83 1.44 -0.24 -3.49 -2.07 0.30 -4.64 119.66 107.13 3hs5 s GLN 255 Ca 0.19 -1.69 -0.02 0.00 -1.82 0.00 0.00 55.36 52.02 3hs5 s GLN 255 Cb -0.03 -1.12 0.02 0.00 -1.09 0.00 0.00 33.01 30.79 3hs5 s GLN 255 CO 0.09 0.10 -0.07 0.08 -1.32 0.00 0.00 175.29 174.17 3hs5 s VAL 256 N -3.01 2.89 -0.22 3.63 1.01 -1.26 -0.67 120.40 122.78 3hs5 s VAL 256 Ca 0.26 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.34 3hs5 s VAL 256 Cb 0.02 -2.41 0.03 0.00 0.00 0.00 0.00 36.38 34.01 3hs5 s VAL 256 CO 0.09 0.28 -0.13 -0.63 0.00 0.00 0.00 175.10 174.71 3hs5 s ILE 257 N 1.35 2.37 -1.46 2.22 1.01 0.38 -4.71 121.20 122.36 3hs5 s ILE 257 Ca 0.02 -1.12 -0.11 0.00 0.00 0.00 0.00 60.65 59.44 3hs5 s ILE 257 Cb -0.16 -2.16 0.06 0.00 0.01 0.00 0.00 42.46 40.21 3hs5 s ILE 257 CO -0.05 0.30 1.02 0.61 0.00 0.00 0.00 174.94 176.82 3hs5 n GLY 258 N 4.59 -0.49 2.93 6.18 0.00 -1.26 -1.33 105.19 115.81 3hs5 n GLY 258 Ca -0.18 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3hs5 n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hs5 n GLY 259 N -1.76 0.87 3.66 -0.02 0.00 -1.26 -5.02 105.19 101.65 3hs5 n GLY 259 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3hs5 n GLY 259 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hs5 s GLU 260 N -0.08 2.92 -0.16 1.61 0.41 -0.44 -5.08 118.70 117.88 3hs5 s GLU 260 Ca 0.00 -0.45 -0.25 0.00 -0.41 0.00 0.00 54.97 53.87 3hs5 s GLU 260 Cb 0.00 -2.74 -0.02 0.00 -1.78 0.00 0.00 34.13 29.59 3hs5 s GLU 260 CO 0.00 0.69 0.79 0.08 -0.49 0.00 0.00 175.26 176.34 3hs5 s VAL 261 N -0.87 4.91 0.28 2.63 1.01 -1.26 -0.47 120.40 126.63 3hs5 s VAL 261 Ca 0.13 1.56 0.05 0.00 0.00 0.00 0.00 61.98 63.72 3hs5 s VAL 261 Cb -0.11 -4.10 -0.06 0.00 0.00 0.00 0.00 36.38 32.11 3hs5 s VAL 261 CO 0.02 0.06 -0.02 -0.31 0.00 0.00 0.00 175.10 174.85 3hs5 s TYR 262 N 2.00 1.88 0.83 5.22 2.02 0.16 -4.98 117.35 124.47 3hs5 s TYR 262 Ca 0.37 -0.80 -0.12 0.00 -0.37 0.00 0.00 57.07 56.15 3hs5 s TYR 262 Cb -0.17 -1.12 0.10 0.00 -0.40 0.00 0.00 41.96 40.38 3hs5 s TYR 262 CO 0.13 0.16 1.19 -2.14 -1.57 0.00 0.00 175.55 173.31 3hs5 s PRO 263 N -3.79 1.52 1.05 -1.71 0.02 -1.26 -0.54 135.00 130.29 3hs5 s PRO 263 Ca 0.31 1.69 -0.16 0.00 0.02 0.00 0.00 61.00 62.85 3hs5 s PRO 263 Cb 0.05 -1.77 0.22 0.00 0.02 0.00 0.00 34.50 33.02 3hs5 s PRO 263 CO 0.12 -2.29 1.18 -1.25 -0.33 0.00 0.00 177.00 174.43 3hs5 s PRO 264 N -4.28 -0.00 0.52 5.54 0.04 -1.26 -4.10 135.00 131.45 3hs5 s PRO 264 Ca 0.71 -0.05 -0.03 0.00 0.04 0.00 0.00 61.00 61.68 3hs5 s PRO 264 Cb -0.27 -1.74 -0.00 0.00 0.04 0.00 0.00 34.50 32.54 3hs5 s PRO 264 CO 0.52 -2.91 0.78 0.95 0.04 0.00 0.00 177.00 176.39 3hs5 s THR 265 N -3.33 3.91 0.24 1.26 -4.23 -1.26 0.38 115.64 112.60 3hs5 s THR 265 Ca 0.70 -0.22 -0.07 0.00 -1.18 0.00 0.00 61.69 60.92 3hs5 s THR 265 Cb -0.10 -3.50 0.22 0.00 1.34 0.00 0.00 72.50 70.46 3hs5 s THR 265 CO 0.55 -0.43 1.89 0.58 -0.54 0.00 0.00 174.62 176.67 3hs5 h VAL 266 N 0.13 1.17 -0.57 2.29 2.07 -1.36 -1.85 116.25 118.14 3hs5 h VAL 266 Ca -0.46 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 66.67 3hs5 h VAL 266 Cb 1.25 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 3hs5 h VAL 266 CO 0.59 0.21 0.37 0.50 0.02 0.00 0.00 177.57 179.26 3hs5 h LYS 267 N 1.15 0.75 -0.39 1.57 1.63 -1.87 0.23 116.57 119.63 3hs5 h LYS 267 Ca 0.35 -0.05 -0.14 0.00 -0.85 0.00 0.00 60.65 59.95 3hs5 h LYS 267 Cb -0.04 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 31.42 3hs5 h LYS 267 CO -0.10 0.50 -0.32 0.22 -3.45 0.00 0.00 179.45 176.30 3hs5 h ASP 268 N 0.77 0.93 0.13 4.20 3.58 -1.90 -3.35 116.42 120.78 3hs5 h ASP 268 Ca 0.21 -0.39 -0.17 0.00 0.42 0.00 0.00 57.03 57.09 3hs5 h ASP 268 Cb -0.08 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 40.68 3hs5 h ASP 268 CO -0.04 1.17 -2.05 0.35 -2.88 0.00 0.00 179.24 175.79 3hs5 n THR 269 N -4.07 0.74 -1.42 2.25 -2.24 -0.71 -4.96 114.28 103.86 3hs5 n THR 269 Ca -0.01 -0.67 -0.14 0.00 -2.27 0.00 0.00 64.05 60.96 3hs5 n THR 269 Cb 0.51 -0.30 -0.06 0.00 -2.10 0.00 0.00 70.33 68.38 3hs5 n THR 269 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hs5 n GLN 270 N -2.56 -0.96 -2.95 -0.78 1.13 0.79 -4.84 117.38 107.21 3hs5 n GLN 270 Ca -0.16 0.98 -0.41 0.00 -1.94 0.00 0.00 57.00 55.47 3hs5 n GLN 270 Cb 0.84 -5.07 -0.04 0.00 0.11 0.00 0.00 30.24 26.08 3hs5 n GLN 270 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3hs5 s VAL 271 N -2.52 4.94 0.14 5.09 1.01 -1.24 -5.03 120.40 122.80 3hs5 s VAL 271 Ca 0.00 1.55 -0.30 0.00 0.00 0.00 0.00 61.98 63.23 3hs5 s VAL 271 Cb 0.00 -4.10 -0.07 0.00 0.00 0.00 0.00 36.38 32.21 3hs5 s VAL 271 CO 0.00 0.11 1.11 -1.61 0.00 0.00 0.00 175.10 174.71 3hs5 s GLU 272 N 1.69 4.56 0.11 2.72 2.02 -1.26 -4.64 118.70 123.89 3hs5 s GLU 272 Ca 0.38 1.71 0.03 0.00 0.02 0.00 0.00 54.97 57.11 3hs5 s GLU 272 Cb -0.17 -3.30 -0.04 0.00 0.10 0.00 0.00 34.13 30.72 3hs5 s GLU 272 CO 0.15 0.00 -0.09 -1.64 0.02 0.00 0.00 175.26 173.70 3hs5 s MET 273 N -0.01 0.87 -0.37 1.61 -1.94 -1.26 -4.74 119.30 113.45 3hs5 s MET 273 Ca 0.51 -1.26 -0.19 0.00 -1.71 0.00 0.00 55.69 53.04 3hs5 s MET 273 Cb -0.29 -0.44 0.00 0.00 2.01 0.00 0.00 34.83 36.12 3hs5 s MET 273 CO 0.33 0.05 0.57 0.42 -0.01 0.00 0.00 175.02 176.38 3hs5 s ILE 274 N -2.95 4.94 0.01 2.53 -1.09 -0.46 -5.05 121.20 119.14 3hs5 s ILE 274 Ca 0.09 0.34 -0.00 0.00 -2.23 0.00 0.00 60.65 58.85 3hs5 s ILE 274 Cb 0.01 -4.05 -0.01 0.00 -1.58 0.00 0.00 42.46 36.83 3hs5 s ILE 274 CO -0.01 -0.33 -0.01 -0.31 -1.23 0.00 0.00 174.94 173.05 3hs5 s TYR 275 N 2.56 0.13 0.60 3.97 2.02 -1.26 -4.59 117.35 120.77 3hs5 s TYR 275 Ca 0.21 -0.26 -0.20 0.00 -0.37 0.00 0.00 57.07 56.45 3hs5 s TYR 275 Cb -0.15 -0.09 -0.03 0.00 -0.40 0.00 0.00 41.96 41.29 3hs5 s TYR 275 CO 0.15 -0.11 1.32 -2.14 -1.57 0.00 0.00 175.55 173.20 3hs5 s PRO 276 N -0.78 2.83 0.58 -1.71 0.02 -1.26 -4.91 135.00 129.78 3hs5 s PRO 276 Ca -0.09 2.14 0.28 0.00 0.02 0.00 0.00 61.00 63.35 3hs5 s PRO 276 Cb -0.05 -2.03 1.57 0.00 0.02 0.00 0.00 34.50 34.01 3hs5 s PRO 276 CO -0.00 -1.41 2.04 -1.35 -0.33 0.00 0.00 177.00 175.95 3hs5 h PRO 277 N 0.97 0.00 0.00 5.54 0.11 -2.03 -2.21 132.00 134.38 3hs5 h PRO 277 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3hs5 h PRO 277 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3hs5 h PRO 277 CO 0.55 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 175.95 3hs5 n HIS 278 N -3.87 0.00 -2.20 0.65 1.44 -1.26 -4.82 115.22 105.16 3hs5 n HIS 278 Ca 0.04 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.32 3hs5 n HIS 278 Cb 0.43 -0.49 -0.02 0.00 0.12 0.00 0.00 29.99 30.03 3hs5 n HIS 278 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3hs5 s ILE 279 N -2.97 3.90 0.51 0.61 -1.09 -0.83 -4.98 121.20 116.35 3hs5 s ILE 279 Ca 0.14 1.09 -0.22 0.00 -2.23 0.00 0.00 60.65 59.44 3hs5 s ILE 279 Cb 0.18 -3.71 -0.06 0.00 -1.58 0.00 0.00 42.46 37.29 3hs5 s ILE 279 CO 0.50 -0.10 1.20 -2.84 -1.23 0.00 0.00 174.94 172.47 3hs5 s PRO 280 N 3.80 3.47 0.29 2.79 0.02 -1.26 -4.85 135.00 139.26 3hs5 s PRO 280 Ca 0.65 1.84 0.03 0.00 0.02 0.00 0.00 61.00 63.54 3hs5 s PRO 280 Cb -0.28 -2.25 0.73 0.00 0.02 0.00 0.00 34.50 32.72 3hs5 s PRO 280 CO 0.23 -0.81 1.67 0.93 -0.33 0.00 0.00 177.00 178.69 3hs5 h GLU 281 N 1.65 0.28 0.00 5.54 3.07 -1.96 0.21 114.58 123.37 3hs5 h GLU 281 Ca -0.50 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 58.34 3hs5 h GLU 281 Cb 1.27 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 29.11 3hs5 h GLU 281 CO 0.58 0.19 -0.01 -2.95 -1.40 0.00 0.00 179.01 175.42 3hs5 h ASN 282 N 0.29 0.00 -0.11 1.42 -1.07 -2.03 -2.37 115.58 111.71 3hs5 h ASN 282 Ca 0.56 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.93 3hs5 h ASN 282 Cb 1.11 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.36 3hs5 h ASN 282 CO -0.59 0.01 0.00 0.18 0.07 0.00 0.00 177.43 177.10 3hs5 n LEU 283 N -3.13 3.05 -4.38 6.14 4.77 0.73 -4.70 117.00 119.47 3hs5 n LEU 283 Ca -0.01 -1.09 -0.44 0.00 -0.03 0.00 0.00 56.01 54.44 3hs5 n LEU 283 Cb 0.21 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 3hs5 n LEU 283 CO 0.25 0.54 1.51 0.00 -1.33 0.00 0.00 177.39 178.36 3hs5 n GLN 284 N 1.34 3.39 -2.22 3.23 6.02 -0.89 -4.86 117.38 123.39 3hs5 n GLN 284 Ca 0.15 -3.77 -0.41 0.00 -0.01 0.00 0.00 57.00 52.96 3hs5 n GLN 284 Cb 0.59 -3.05 -0.03 0.00 1.02 0.00 0.00 30.24 28.78 3hs5 n GLN 284 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3hs5 s PHE 285 N 1.52 3.23 -0.26 1.08 0.08 -1.26 -1.05 117.98 121.32 3hs5 s PHE 285 Ca 0.43 1.38 -0.09 0.00 0.12 0.00 0.00 56.93 58.77 3hs5 s PHE 285 Cb -0.01 -3.58 -0.04 0.00 -0.57 0.00 0.00 43.02 38.83 3hs5 s PHE 285 CO 0.01 -1.64 0.12 0.00 -0.10 0.00 0.00 175.22 173.61 3hs5 s ALA 286 N -0.61 3.33 0.35 5.36 0.00 0.16 -4.72 121.76 125.63 3hs5 s ALA 286 Ca 0.51 -1.09 0.05 0.00 0.00 0.00 0.00 51.96 51.43 3hs5 s ALA 286 Cb -0.37 -2.23 -0.03 0.00 0.00 0.00 0.00 23.12 20.49 3hs5 s ALA 286 CO 0.45 -0.47 0.18 0.14 0.00 0.00 0.00 175.76 176.06 3hs5 s VAL 287 N 1.58 0.34 0.23 0.00 -7.23 -1.26 -4.17 120.40 109.89 3hs5 s VAL 287 Ca 0.06 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.16 3hs5 s VAL 287 Cb -0.15 -2.44 0.21 0.00 0.56 0.00 0.00 36.38 34.55 3hs5 s VAL 287 CO 0.06 0.00 1.86 1.23 -0.31 0.00 0.00 175.10 177.95 3hs5 h GLY 288 N 2.03 1.33 -7.44 2.32 0.00 -1.47 -3.40 103.07 96.43 3hs5 h GLY 288 Ca -0.32 -0.58 -0.63 0.00 0.00 0.00 0.00 47.33 45.80 3hs5 h GLY 288 CO 0.49 0.56 -0.37 1.62 0.00 0.00 0.00 176.54 178.85 3hs5 s GLN 289 N -5.89 4.01 0.38 4.80 -0.44 -0.61 -4.08 119.66 117.83 3hs5 s GLN 289 Ca -0.13 -0.12 0.27 0.00 -2.50 0.00 0.00 55.36 52.89 3hs5 s GLN 289 Cb 0.17 -3.64 1.31 0.00 -1.64 0.00 0.00 33.01 29.21 3hs5 s GLN 289 CO 0.82 -0.19 1.83 1.05 0.50 0.00 0.00 175.29 179.30 3hs5 h GLU 290 N 8.13 0.00 -0.05 1.67 4.11 -1.85 -2.68 114.58 123.91 3hs5 h GLU 290 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.09 3hs5 h GLU 290 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3hs5 h GLU 290 CO 0.61 0.00 0.00 1.33 0.07 0.00 0.00 179.01 181.02 3hs5 n VAL 291 N -2.49 0.03 0.35 -1.06 0.24 -1.26 -1.35 118.33 112.79 3hs5 n VAL 291 Ca -0.00 -0.47 0.14 0.00 -2.04 0.00 0.00 64.34 61.97 3hs5 n VAL 291 Cb 0.15 1.31 0.52 0.00 -1.47 0.00 0.00 33.84 34.34 3hs5 n VAL 291 CO 0.00 0.00 0.00 -0.26 -2.14 0.00 0.00 176.83 174.43 3hs5 h PHE 292 N 4.31 0.00 0.00 6.34 -1.00 -1.82 -2.55 116.94 122.21 3hs5 h PHE 292 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3hs5 h PHE 292 Cb 0.92 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.48 3hs5 h PHE 292 CO 0.01 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.12 3hs5 n GLY 293 N 0.32 -0.96 0.01 -1.45 0.00 -1.26 -3.54 105.19 98.31 3hs5 n GLY 293 Ca 0.02 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.07 3hs5 n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hs5 n LEU 294 N -1.29 0.45 -3.66 0.99 4.77 -0.96 -4.41 117.00 112.89 3hs5 n LEU 294 Ca 0.10 0.14 -0.20 0.00 -0.03 0.00 0.00 56.01 56.02 3hs5 n LEU 294 Cb 0.16 -0.28 -0.17 0.00 -2.33 0.00 0.00 43.42 40.80 3hs5 n LEU 294 CO 0.16 0.07 -0.32 -0.69 -1.33 0.00 0.00 177.39 175.28 3hs5 s VAL 295 N -3.03 -0.14 0.49 4.08 1.01 -1.23 -0.18 120.40 121.39 3hs5 s VAL 295 Ca 0.11 0.37 0.14 0.00 0.00 0.00 0.00 61.98 62.60 3hs5 s VAL 295 Cb 0.17 -0.21 0.25 0.00 0.00 0.00 0.00 36.38 36.59 3hs5 s VAL 295 CO 0.67 0.14 2.11 -0.65 0.00 0.00 0.00 175.10 177.37 3hs5 h PRO 296 N 8.42 0.07 -0.03 2.72 0.11 -1.84 -0.79 132.00 140.67 3hs5 h PRO 296 Ca -0.12 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.94 3hs5 h PRO 296 Cb 1.12 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3hs5 h PRO 296 CO 0.16 0.08 -0.16 0.78 -0.21 0.00 0.00 178.00 178.65 3hs5 h GLY 297 N 0.17 0.05 1.45 -0.55 0.00 -1.95 -0.91 103.07 101.33 3hs5 h GLY 297 Ca 0.02 -0.03 -0.22 0.00 0.00 0.00 0.00 47.33 47.11 3hs5 h GLY 297 CO 0.00 0.03 -0.85 1.41 0.00 0.00 0.00 176.54 177.13 3hs5 h LEU 298 N 0.04 0.64 -0.91 3.11 3.38 -1.42 -3.22 115.31 116.94 3hs5 h LEU 298 Ca 0.01 -0.46 -0.11 0.00 0.09 0.00 0.00 57.88 57.40 3hs5 h LEU 298 Cb 0.31 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3hs5 h LEU 298 CO 0.02 1.24 -0.52 -0.03 0.09 0.00 0.00 178.44 179.24 3hs5 h MET 299 N 0.33 0.00 0.34 1.13 4.05 -1.06 -1.43 114.93 118.29 3hs5 h MET 299 Ca -0.06 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.35 3hs5 h MET 299 Cb 1.46 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.25 3hs5 h MET 299 CO 0.15 0.52 -0.24 1.98 0.23 0.00 0.00 176.91 179.56 3hs5 h MET 300 N 0.00 -0.55 -0.38 0.39 1.85 -1.22 -1.04 114.93 113.99 3hs5 h MET 300 Ca -0.01 0.04 -0.08 0.00 -0.61 0.00 0.00 59.70 59.04 3hs5 h MET 300 Cb 0.96 0.13 -0.02 0.00 0.43 0.00 0.00 31.60 33.10 3hs5 h MET 300 CO 0.07 -0.37 -0.09 1.88 -0.40 0.00 0.00 176.91 178.00 3hs5 h TYR 301 N -0.57 0.70 -0.68 1.39 0.05 -1.54 -0.99 116.97 115.32 3hs5 h TYR 301 Ca -0.03 -0.11 0.02 0.00 0.05 0.00 0.00 58.73 58.65 3hs5 h TYR 301 Cb 0.49 -0.19 -0.04 0.00 1.01 0.00 0.00 36.73 38.01 3hs5 h TYR 301 CO -0.12 0.72 0.44 0.00 -1.05 0.00 0.00 178.16 178.15 3hs5 h ALA 302 N 1.31 0.87 -0.06 3.88 0.00 -1.12 -0.69 119.26 123.45 3hs5 h ALA 302 Ca 0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3hs5 h ALA 302 Cb 0.51 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3hs5 h ALA 302 CO 0.03 0.25 0.01 1.15 0.00 0.00 0.00 179.25 180.69 3hs5 h THR 303 N 0.88 1.20 -0.33 0.00 2.02 -0.93 -1.60 112.91 114.16 3hs5 h THR 303 Ca 0.26 -0.62 0.06 0.00 0.77 0.00 0.00 66.41 66.88 3hs5 h THR 303 Cb -0.06 1.50 -0.06 0.00 -1.74 0.00 0.00 68.15 67.80 3hs5 h THR 303 CO -0.07 0.17 -0.03 0.40 0.37 0.00 0.00 175.52 176.36 3hs5 h ILE 304 N -0.13 0.72 -0.19 3.11 2.04 -1.00 -1.14 117.51 120.92 3hs5 h ILE 304 Ca 0.02 -0.02 -0.13 0.00 1.00 0.00 0.00 64.86 65.73 3hs5 h ILE 304 Cb 0.26 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3hs5 h ILE 304 CO 0.00 0.01 -0.42 -0.50 0.00 0.00 0.00 178.15 177.24 3hs5 h TRP 305 N 0.05 0.55 -0.57 1.37 4.06 -1.13 0.04 115.95 120.33 3hs5 h TRP 305 Ca 0.16 -0.16 -0.02 0.00 2.06 0.00 0.00 58.89 60.93 3hs5 h TRP 305 Cb 0.23 -0.12 -0.03 0.00 -1.00 0.00 0.00 29.16 28.24 3hs5 h TRP 305 CO -0.26 0.81 0.29 1.25 -3.56 0.00 0.00 178.44 176.97 3hs5 h LEU 306 N 0.38 0.74 -0.84 -4.49 6.46 -1.06 -0.30 115.31 116.20 3hs5 h LEU 306 Ca 0.03 -0.12 -0.03 0.00 -0.12 0.00 0.00 57.88 57.64 3hs5 h LEU 306 Cb 0.90 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 40.60 3hs5 h LEU 306 CO 0.08 0.65 0.39 0.03 -0.62 0.00 0.00 178.44 178.97 3hs5 h ARG 307 N 0.78 1.21 -0.32 1.25 3.08 -0.89 -2.65 114.38 116.84 3hs5 h ARG 307 Ca 0.20 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3hs5 h ARG 307 Cb 0.09 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 3hs5 h ARG 307 CO -0.03 0.94 0.21 1.49 -1.07 0.00 0.00 179.97 181.51 3hs5 h GLU 308 N 1.20 0.42 -0.33 0.04 4.57 -0.50 -0.99 114.58 118.99 3hs5 h GLU 308 Ca 0.29 -0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.50 3hs5 h GLU 308 Cb 0.13 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.58 3hs5 h GLU 308 CO -0.03 0.28 0.02 1.25 -1.18 0.00 0.00 179.01 179.35 3hs5 h HIS 309 N 0.43 0.02 0.00 0.92 2.76 -0.92 -1.02 115.15 117.34 3hs5 h HIS 309 Ca 0.12 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.21 3hs5 h HIS 309 Cb -0.04 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 3hs5 h HIS 309 CO -0.05 -0.04 -0.49 -0.91 -1.30 0.00 0.00 177.93 175.14 3hs5 h ASN 310 N 0.12 0.00 -0.40 3.26 2.35 -1.31 -1.43 115.58 118.18 3hs5 h ASN 310 Ca 0.16 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.84 3hs5 h ASN 310 Cb 0.21 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 3hs5 h ASN 310 CO -0.25 0.49 -0.01 -0.09 -1.65 0.00 0.00 177.43 175.92 3hs5 h ARG 311 N 0.00 0.71 -0.51 0.81 2.43 -0.83 -2.32 114.38 114.66 3hs5 h ARG 311 Ca -0.00 -0.23 -0.10 0.00 -0.81 0.00 0.00 59.98 58.83 3hs5 h ARG 311 Cb 0.89 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.36 3hs5 h ARG 311 CO 0.06 0.80 -0.08 0.28 -1.51 0.00 0.00 179.97 179.52 3hs5 h VAL 312 N 0.53 1.26 -0.66 0.20 2.07 -0.90 -2.20 116.25 116.55 3hs5 h VAL 312 Ca 0.11 -1.20 0.10 0.00 0.82 0.00 0.00 66.70 66.53 3hs5 h VAL 312 Cb 0.49 0.95 -0.08 0.00 -1.52 0.00 0.00 31.29 31.13 3hs5 h VAL 312 CO 0.02 0.42 0.27 0.00 0.02 0.00 0.00 177.57 178.30 3hs5 h ASP 314 N 0.47 0.41 -0.19 0.00 3.32 -0.91 -0.96 116.42 118.55 3hs5 h ASP 314 Ca 0.33 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 3hs5 h ASP 314 Cb 0.41 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 3hs5 h ASP 314 CO -0.31 0.31 0.08 0.40 -1.72 0.00 0.00 179.24 178.00 3hs5 h ILE 315 N 0.47 1.16 -0.67 0.35 2.04 -0.90 -2.60 117.51 117.37 3hs5 h ILE 315 Ca 0.13 -0.48 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 3hs5 h ILE 315 Cb -0.04 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 3hs5 h ILE 315 CO -0.03 0.15 0.28 -0.07 0.00 0.00 0.00 178.15 178.49 3hs5 h LEU 316 N 0.16 0.88 -1.05 1.44 3.38 -0.91 -1.83 115.31 117.38 3hs5 h LEU 316 Ca 0.06 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3hs5 h LEU 316 Cb 0.17 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 3hs5 h LEU 316 CO -0.01 0.78 0.31 0.50 0.09 0.00 0.00 178.44 180.11 3hs5 h LYS 317 N 0.96 0.98 0.00 1.13 3.64 -0.99 0.69 116.57 122.98 3hs5 h LYS 317 Ca 0.23 -0.14 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 3hs5 h LYS 317 Cb 0.16 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 3hs5 h LYS 317 CO -0.02 0.77 -0.24 -0.56 -2.27 0.00 0.00 179.45 177.13 3hs5 h GLN 318 N 0.97 0.00 -0.06 1.90 3.07 -1.22 -2.27 115.11 117.50 3hs5 h GLN 318 Ca 0.23 0.00 -0.20 0.00 0.09 0.00 0.00 58.65 58.78 3hs5 h GLN 318 Cb 0.13 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.69 3hs5 h GLN 318 CO -0.03 0.24 -0.78 0.93 0.09 0.00 0.00 178.83 179.28 3hs5 h GLU 319 N 0.00 0.43 -2.48 0.06 4.39 -0.61 -3.41 114.58 112.97 3hs5 h GLU 319 Ca -0.00 -0.38 -0.59 0.00 0.34 0.00 0.00 59.36 58.73 3hs5 h GLU 319 Cb 1.10 0.09 -0.39 0.00 -0.10 0.00 0.00 28.75 29.44 3hs5 h GLU 319 CO 0.03 1.02 -0.87 0.72 -1.16 0.00 0.00 179.01 178.75 3hs5 n HIS 320 N -3.82 0.47 0.28 4.33 8.25 0.23 -4.94 115.22 120.03 3hs5 n HIS 320 Ca -0.05 -3.64 0.13 0.00 -0.26 0.00 0.00 57.72 53.90 3hs5 n HIS 320 Cb 0.74 -0.09 0.61 0.00 1.12 0.00 0.00 29.99 32.37 3hs5 n HIS 320 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3hs5 h PRO 321 N 5.24 0.00 0.00 -0.41 0.13 -1.65 -2.47 132.00 132.84 3hs5 h PRO 321 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 3hs5 h PRO 321 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3hs5 h PRO 321 CO 0.50 0.00 -0.25 1.05 -0.23 0.00 0.00 178.00 179.07 3hs5 h GLU 322 N 0.00 0.00 -6.98 0.86 9.09 -1.92 -3.47 114.58 112.16 3hs5 h GLU 322 Ca 0.00 0.00 -0.47 0.00 0.05 0.00 0.00 59.36 58.94 3hs5 h GLU 322 Cb 0.19 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.30 3hs5 h GLU 322 CO 0.00 0.00 0.39 -1.58 0.05 0.00 0.00 179.01 177.87 3hs5 s TRP 323 N -3.13 3.31 0.66 2.06 0.52 -0.93 -5.07 118.94 116.36 3hs5 s TRP 323 Ca 0.09 1.65 -0.02 0.00 0.02 0.00 0.00 56.10 57.84 3hs5 s TRP 323 Cb 0.12 -3.05 0.08 0.00 -1.15 0.00 0.00 33.47 29.48 3hs5 s TRP 323 CO 0.65 -0.44 0.92 0.20 0.02 0.00 0.00 176.95 178.30 3hs5 s GLY 324 N -1.71 1.77 0.24 0.98 0.00 -1.26 -4.93 107.32 102.41 3hs5 s GLY 324 Ca 0.58 -1.36 -0.05 0.00 0.00 0.00 0.00 44.72 43.90 3hs5 s GLY 324 CO 0.24 -0.93 1.76 -1.80 0.00 0.00 0.00 173.10 172.36 3hs5 h ASP 325 N -0.35 0.41 -0.18 1.64 3.58 -1.93 -2.23 116.42 117.36 3hs5 h ASP 325 Ca -0.41 0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.12 3hs5 h ASP 325 Cb 1.29 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 42.36 3hs5 h ASP 325 CO 0.50 0.19 0.06 -0.08 -2.88 0.00 0.00 179.24 177.03 3hs5 h GLU 326 N 0.55 0.27 -0.44 0.28 4.57 -1.95 -0.44 114.58 117.41 3hs5 h GLU 326 Ca 0.40 -0.05 -0.12 0.00 -1.18 0.00 0.00 59.36 58.41 3hs5 h GLU 326 Cb 0.53 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.07 3hs5 h GLU 326 CO -0.34 0.36 -0.18 0.37 -1.18 0.00 0.00 179.01 178.04 3hs5 h GLN 327 N 0.12 0.91 -0.50 1.92 4.15 -1.91 -1.07 115.11 118.72 3hs5 h GLN 327 Ca 0.06 -0.38 0.08 0.00 0.77 0.00 0.00 58.65 59.17 3hs5 h GLN 327 Cb 0.20 -0.03 -0.06 0.00 0.21 0.00 0.00 27.48 27.79 3hs5 h GLN 327 CO -0.00 1.03 0.14 -0.07 -1.93 0.00 0.00 178.83 178.00 3hs5 h LEU 328 N 0.74 0.09 -0.03 -2.39 3.38 -1.29 0.01 115.31 115.82 3hs5 h LEU 328 Ca 0.10 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 3hs5 h LEU 328 Cb 0.74 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 3hs5 h LEU 328 CO 0.06 0.08 0.02 0.15 0.09 0.00 0.00 178.44 178.83 3hs5 h PHE 329 N 0.30 0.05 -0.56 1.13 3.57 -0.83 -1.72 116.94 118.88 3hs5 h PHE 329 Ca 0.25 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.64 3hs5 h PHE 329 Cb 0.30 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 3hs5 h PHE 329 CO -0.19 0.14 -0.08 1.96 -2.23 0.00 0.00 178.31 177.91 3hs5 h GLN 330 N -0.06 1.04 -0.41 1.11 1.08 -0.99 -1.51 115.11 115.37 3hs5 h GLN 330 Ca 0.01 -0.37 -0.13 0.00 -1.45 0.00 0.00 58.65 56.72 3hs5 h GLN 330 Cb 0.11 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 3hs5 h GLN 330 CO -0.00 1.06 -0.24 1.15 -0.95 0.00 0.00 178.83 179.85 3hs5 h THR 331 N 0.93 1.28 -0.26 -0.54 2.02 -0.99 -2.39 112.91 112.95 3hs5 h THR 331 Ca 0.15 -1.39 0.02 0.00 0.77 0.00 0.00 66.41 65.96 3hs5 h THR 331 Cb 0.64 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.31 3hs5 h THR 331 CO 0.04 0.47 0.12 0.28 0.37 0.00 0.00 175.52 176.80 3hs5 h SER 332 N 0.71 0.16 -0.63 4.18 0.02 -1.12 -1.16 113.55 115.70 3hs5 h SER 332 Ca 0.09 0.02 0.12 0.00 -0.84 0.00 0.00 61.79 61.18 3hs5 h SER 332 Cb 0.81 -0.01 -0.09 0.00 0.14 0.00 0.00 62.40 63.24 3hs5 h SER 332 CO 0.07 0.13 0.14 -0.09 -1.14 0.00 0.00 176.83 175.94 3hs5 h ARG 333 N 0.25 0.26 -0.58 3.45 2.43 -1.11 0.84 114.38 119.93 3hs5 h ARG 333 Ca 0.11 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 3hs5 h ARG 333 Cb 0.05 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 3hs5 h ARG 333 CO -0.09 0.17 0.24 -0.07 -1.51 0.00 0.00 179.97 178.72 3hs5 h LEU 334 N 0.27 0.80 -0.40 3.80 3.38 -1.01 -0.47 115.31 121.66 3hs5 h LEU 334 Ca 0.34 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3hs5 h LEU 334 Cb 0.52 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3hs5 h LEU 334 CO -0.42 0.74 0.27 0.40 0.09 0.00 0.00 178.44 179.51 3hs5 h ILE 335 N 0.80 1.11 -0.56 1.22 2.04 -0.63 -1.84 117.51 119.65 3hs5 h ILE 335 Ca 0.20 -0.20 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 3hs5 h ILE 335 Cb 0.19 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 3hs5 h ILE 335 CO -0.02 0.10 0.10 -0.07 0.00 0.00 0.00 178.15 178.26 3hs5 h LEU 336 N 0.55 0.83 -0.43 1.44 4.07 -0.54 0.15 115.31 121.37 3hs5 h LEU 336 Ca 0.15 -0.17 0.02 0.00 0.08 0.00 0.00 57.88 57.95 3hs5 h LEU 336 Cb -0.06 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 41.44 3hs5 h LEU 336 CO -0.03 0.84 0.25 0.40 -1.08 0.00 0.00 178.44 178.82 3hs5 h ILE 337 N 0.84 1.05 -0.45 1.22 2.04 -0.95 -0.20 117.51 121.06 3hs5 h ILE 337 Ca 0.18 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 3hs5 h ILE 337 Cb 0.36 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 3hs5 h ILE 337 CO 0.01 0.09 0.22 1.23 0.00 0.00 0.00 178.15 179.70 3hs5 h GLY 338 N 0.51 0.68 0.60 5.37 0.00 -0.73 -2.11 103.07 107.39 3hs5 h GLY 338 Ca 0.17 -0.33 0.08 0.00 0.00 0.00 0.00 47.33 47.25 3hs5 h GLY 338 CO -0.08 0.32 0.46 0.83 0.00 0.00 0.00 176.54 178.07 3hs5 h GLU 339 N 0.58 0.77 -0.20 4.80 5.08 -0.51 -1.21 114.58 123.89 3hs5 h GLU 339 Ca 0.15 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 3hs5 h GLU 339 Cb 0.11 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3hs5 h GLU 339 CO -0.02 0.51 0.10 1.15 -1.00 0.00 0.00 179.01 179.75 3hs5 h THR 340 N 0.80 1.14 -0.63 1.13 2.02 -0.72 -0.81 112.91 115.83 3hs5 h THR 340 Ca 0.37 -0.40 -0.08 0.00 0.77 0.00 0.00 66.41 67.07 3hs5 h THR 340 Cb 0.28 1.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 3hs5 h THR 340 CO -0.22 0.13 0.09 0.40 0.37 0.00 0.00 175.52 176.29 3hs5 h ILE 341 N 0.19 1.26 0.19 3.11 2.04 -1.23 -0.48 117.51 122.60 3hs5 h ILE 341 Ca 0.07 -1.04 0.00 0.00 1.00 0.00 0.00 64.86 64.89 3hs5 h ILE 341 Cb 0.13 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3hs5 h ILE 341 CO -0.01 0.39 -0.17 0.50 0.00 0.00 0.00 178.15 178.86 3hs5 h LYS 342 N 0.97 -0.37 -0.58 2.37 1.63 -1.06 -1.77 116.57 117.76 3hs5 h LYS 342 Ca 0.19 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.02 3hs5 h LYS 342 Cb 0.45 0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.14 3hs5 h LYS 342 CO 0.02 -0.25 0.38 0.82 -3.45 0.00 0.00 179.45 176.96 3hs5 h ILE 343 N -0.39 1.16 -0.60 2.00 2.04 -1.04 -0.70 117.51 119.97 3hs5 h ILE 343 Ca -0.00 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 3hs5 h ILE 343 Cb 0.36 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 3hs5 h ILE 343 CO -0.03 0.15 0.37 0.58 0.00 0.00 0.00 178.15 179.22 3hs5 h VAL 344 N 0.79 1.17 0.04 1.67 2.07 -0.91 -0.19 116.25 120.89 3hs5 h VAL 344 Ca 0.21 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 3hs5 h VAL 344 Cb -0.07 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 3hs5 h VAL 344 CO -0.04 0.18 -0.02 0.40 0.02 0.00 0.00 177.57 178.10 3hs5 h ILE 345 N 0.81 1.34 0.00 4.57 2.04 -1.21 0.65 117.51 125.71 3hs5 h ILE 345 Ca 0.22 -1.35 0.00 0.00 1.00 0.00 0.00 64.86 64.72 3hs5 h ILE 345 Cb -0.03 2.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 3hs5 h ILE 345 CO -0.04 0.33 -0.84 -0.33 0.00 0.00 0.00 178.15 177.28 3hs5 h GLU 346 N -0.66 0.00 0.00 2.37 5.08 -1.08 -2.63 114.58 117.66 3hs5 h GLU 346 Ca -0.01 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 3hs5 h GLU 346 Cb 0.59 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 3hs5 h GLU 346 CO 0.01 0.00 -1.21 -0.25 -1.00 0.00 0.00 179.01 176.56 3hs5 n ASP 347 N -2.40 0.81 0.13 1.42 8.00 -0.17 -4.58 116.55 119.76 3hs5 n ASP 347 Ca 0.02 0.13 -0.06 0.00 0.71 0.00 0.00 54.79 55.59 3hs5 n ASP 347 Cb 0.50 -0.31 -0.03 0.00 -0.02 0.00 0.00 41.12 41.26 3hs5 n ASP 347 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3hs5 h TYR 348 N -0.32 -0.35 -0.86 1.24 3.20 -1.21 -1.07 116.97 117.60 3hs5 h TYR 348 Ca -0.17 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.68 3hs5 h TYR 348 Cb 0.98 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 39.33 3hs5 h TYR 348 CO -0.05 -0.22 0.49 0.28 -1.64 0.00 0.00 178.16 177.02 3hs5 h VAL 349 N -0.76 1.25 -0.42 1.81 2.07 0.21 -1.62 116.25 118.79 3hs5 h VAL 349 Ca -0.04 -0.59 0.09 0.00 0.82 0.00 0.00 66.70 66.98 3hs5 h VAL 349 Cb 0.29 0.08 -0.09 0.00 -1.52 0.00 0.00 31.29 30.04 3hs5 h VAL 349 CO 0.06 0.27 -0.21 -0.61 0.02 0.00 0.00 177.57 177.11 3hs5 h GLN 350 N 1.19 -0.12 -0.23 1.57 5.75 -1.55 0.10 115.11 121.82 3hs5 h GLN 350 Ca 0.30 0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.80 3hs5 h GLN 350 Cb 0.01 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.57 3hs5 h GLN 350 CO -0.05 -0.08 0.11 1.25 -2.65 0.00 0.00 178.83 177.41 3hs5 h HIS 351 N -0.13 0.33 -0.55 3.99 2.76 -0.84 -3.05 115.15 117.68 3hs5 h HIS 351 Ca 0.20 -0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.43 3hs5 h HIS 351 Cb 0.44 -0.10 -0.06 0.00 1.55 0.00 0.00 27.41 29.24 3hs5 h HIS 351 CO -0.45 0.32 0.22 -0.07 -1.30 0.00 0.00 177.93 176.65 3hs5 h LEU 352 N 0.25 0.25 -0.92 0.26 4.07 -0.86 -3.12 115.31 115.23 3hs5 h LEU 352 Ca 0.08 0.06 -0.05 0.00 0.08 0.00 0.00 57.88 58.05 3hs5 h LEU 352 Cb 0.11 0.03 -0.03 0.00 1.08 0.00 0.00 40.66 41.85 3hs5 h LEU 352 CO -0.01 0.16 0.20 0.77 -1.08 0.00 0.00 178.44 178.48 3hs5 h SER 353 N 0.42 0.92 -0.11 -0.43 4.64 -0.71 -3.47 113.55 114.81 3hs5 h SER 353 Ca 0.26 -0.16 -0.05 0.00 -0.47 0.00 0.00 61.79 61.37 3hs5 h SER 353 Cb 0.27 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.10 3hs5 h SER 353 CO -0.25 0.87 -0.04 0.61 -0.87 0.00 0.00 176.83 177.15 3hs5 n GLY 354 N -0.85 0.50 3.77 -0.77 0.00 -1.17 -5.00 105.19 101.67 3hs5 n GLY 354 Ca 0.05 -0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 3hs5 n GLY 354 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hs5 s TYR 355 N -1.79 2.91 -0.05 1.61 2.02 -1.26 -4.69 117.35 116.10 3hs5 s TYR 355 Ca 0.00 1.52 0.12 0.00 -0.37 0.00 0.00 57.07 58.34 3hs5 s TYR 355 Cb 0.00 -3.44 -0.01 0.00 -0.40 0.00 0.00 41.96 38.12 3hs5 s TYR 355 CO 0.00 -1.58 1.40 0.45 -1.57 0.00 0.00 175.55 174.25 3hs5 h HIS 356 N 2.29 0.00 -3.33 2.71 3.86 -1.57 -3.45 115.15 115.66 3hs5 h HIS 356 Ca -0.49 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.19 3hs5 h HIS 356 Cb 1.25 0.00 0.05 0.00 1.06 0.00 0.00 27.41 29.77 3hs5 h HIS 356 CO 0.53 0.67 0.76 0.12 0.86 0.00 0.00 177.93 180.87 3hs5 s PHE 357 N -2.90 3.05 -0.54 2.45 5.36 -1.26 -4.78 117.98 119.37 3hs5 s PHE 357 Ca 0.03 1.02 -0.23 0.00 -0.96 0.00 0.00 56.93 56.78 3hs5 s PHE 357 Cb 0.09 -3.80 0.04 0.00 -0.34 0.00 0.00 43.02 39.01 3hs5 s PHE 357 CO 0.77 -2.63 0.89 0.15 -1.46 0.00 0.00 175.22 172.94 3hs5 s LYS 358 N -0.20 3.31 0.71 10.12 3.01 -1.26 -5.04 119.74 130.40 3hs5 s LYS 358 Ca 0.60 -0.32 -0.16 0.00 -1.01 0.00 0.00 55.97 55.08 3hs5 s LYS 358 Cb -0.41 -4.05 0.02 0.00 -1.01 0.00 0.00 37.83 32.38 3hs5 s LYS 358 CO 0.42 -1.42 1.15 1.28 0.51 0.00 0.00 175.35 177.28 3hs5 n LEU 359 N 7.25 4.66 -3.94 3.17 4.77 -1.26 -5.00 117.00 126.66 3hs5 n LEU 359 Ca 0.01 0.71 -0.19 0.00 -0.03 0.00 0.00 56.01 56.51 3hs5 n LEU 359 Cb 0.47 -1.49 -0.16 0.00 -2.33 0.00 0.00 43.42 39.92 3hs5 n LEU 359 CO 0.62 -1.57 -0.41 -0.75 -1.33 0.00 0.00 177.39 173.95 3hs5 s LYS 360 N -3.53 0.75 -0.53 3.23 2.20 -1.26 -4.77 119.74 115.82 3hs5 s LYS 360 Ca 0.77 -0.17 -0.21 0.00 -0.36 0.00 0.00 55.97 55.99 3hs5 s LYS 360 Cb -0.35 -0.74 0.05 0.00 -1.51 0.00 0.00 37.83 35.29 3hs5 s LYS 360 CO 0.47 0.02 0.78 0.12 -0.36 0.00 0.00 175.35 176.38 3hs5 s PHE 361 N 0.47 2.92 -0.36 4.03 5.36 -1.26 -4.97 117.98 124.17 3hs5 s PHE 361 Ca -0.06 -0.32 0.03 0.00 -0.96 0.00 0.00 56.93 55.62 3hs5 s PHE 361 Cb -0.10 -3.82 0.15 0.00 -0.34 0.00 0.00 43.02 38.92 3hs5 s PHE 361 CO 0.00 -1.21 0.37 0.34 -1.46 0.00 0.00 175.22 173.26 3hs5 s ASP 362 N 2.82 1.21 0.52 6.13 2.15 -1.26 -5.02 116.67 123.22 3hs5 s ASP 362 Ca 0.22 -1.45 0.29 0.00 0.43 0.00 0.00 52.55 52.04 3hs5 s ASP 362 Cb -0.16 0.57 1.41 0.00 -0.30 0.00 0.00 42.92 44.44 3hs5 s ASP 362 CO 0.15 -0.28 1.90 -0.65 -0.17 0.00 0.00 175.17 176.12 3hs5 h PRO 363 N 7.24 0.06 0.00 4.34 0.11 -1.93 -1.53 132.00 140.29 3hs5 h PRO 363 Ca 0.02 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 3hs5 h PRO 363 Cb 1.06 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 3hs5 h PRO 363 CO 0.22 0.04 -0.03 0.93 -0.21 0.00 0.00 178.00 178.95 3hs5 h GLU 364 N 0.06 0.00 -0.04 1.05 5.08 -1.95 -2.47 114.58 116.30 3hs5 h GLU 364 Ca 0.41 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.78 3hs5 h GLU 364 Cb 1.53 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.78 3hs5 h GLU 364 CO -0.03 0.03 0.07 -0.07 -1.00 0.00 0.00 179.01 178.01 3hs5 h LEU 365 N 0.00 0.00 -1.53 1.33 3.38 -1.70 -1.71 115.31 115.08 3hs5 h LEU 365 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hs5 h LEU 365 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3hs5 h LEU 365 CO 0.00 0.00 -0.18 0.18 0.09 0.00 0.00 178.44 178.54 3hs5 n LEU 366 N -3.53 2.54 0.27 1.67 4.77 -0.93 -4.60 117.00 117.19 3hs5 n LEU 366 Ca -0.02 -0.91 0.15 0.00 -0.03 0.00 0.00 56.01 55.20 3hs5 n LEU 366 Cb 0.15 0.00 0.71 0.00 -2.33 0.00 0.00 43.42 41.96 3hs5 n LEU 366 CO 0.24 0.44 0.97 -0.26 -1.33 0.00 0.00 177.39 177.45 3hs5 h PHE 367 N 3.64 0.00 -0.58 -1.77 0.04 -1.43 -0.62 116.94 116.23 3hs5 h PHE 367 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3hs5 h PHE 367 Cb 0.86 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.01 3hs5 h PHE 367 CO 0.00 0.10 0.00 0.27 -0.60 0.00 0.00 178.31 178.08 3hs5 n ASN 368 N -3.35 4.59 -4.54 2.17 6.94 -1.26 -5.00 115.26 114.82 3hs5 n ASN 368 Ca -0.01 -2.50 -0.24 0.00 -0.02 0.00 0.00 54.58 51.80 3hs5 n ASN 368 Cb 0.28 -0.55 -0.09 0.00 -2.36 0.00 0.00 39.78 37.06 3hs5 n ASN 368 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 3hs5 s GLN 369 N -1.94 1.92 -0.38 -3.83 -1.52 -0.24 -5.09 119.66 108.57 3hs5 s GLN 369 Ca 0.48 -1.56 -0.28 0.00 -1.95 0.00 0.00 55.36 52.05 3hs5 s GLN 369 Cb 0.32 -1.96 0.02 0.00 -0.22 0.00 0.00 33.01 31.17 3hs5 s GLN 369 CO 0.22 0.36 1.04 -0.65 -0.25 0.00 0.00 175.29 176.01 3hs5 s GLN 370 N -3.40 3.89 -0.21 2.91 -0.21 -1.26 -5.00 119.66 116.38 3hs5 s GLN 370 Ca 0.29 0.76 -0.16 0.00 0.02 0.00 0.00 55.36 56.26 3hs5 s GLN 370 Cb -0.06 -3.81 0.06 0.00 1.00 0.00 0.00 33.01 30.20 3hs5 s GLN 370 CO 0.16 -1.06 0.54 0.12 -2.12 0.00 0.00 175.29 172.93 3hs5 s PHE 371 N 3.82 -0.69 -0.31 0.91 5.36 -1.26 -5.06 117.98 120.75 3hs5 s PHE 371 Ca 0.44 1.54 -0.18 0.00 -0.96 0.00 0.00 56.93 57.77 3hs5 s PHE 371 Cb -0.11 0.30 -0.01 0.00 -0.34 0.00 0.00 43.02 42.86 3hs5 s PHE 371 CO 0.21 -0.35 0.50 -0.65 -1.46 0.00 0.00 175.22 173.47 3hs5 s GLN 372 N 0.81 3.81 -1.42 10.12 -1.52 -1.26 -4.99 119.66 125.21 3hs5 s GLN 372 Ca -0.04 0.01 -0.13 0.00 -1.95 0.00 0.00 55.36 53.25 3hs5 s GLN 372 Cb -0.05 -3.74 0.07 0.00 -0.22 0.00 0.00 33.01 29.06 3hs5 s GLN 372 CO -0.06 -0.51 2.16 0.66 -0.25 0.00 0.00 175.29 177.28 3hs5 n TYR 373 N 5.64 3.38 -3.45 0.91 4.01 -1.26 -4.70 117.16 121.69 3hs5 n TYR 373 Ca -0.05 -2.94 -0.13 0.00 -0.16 0.00 0.00 57.90 54.63 3hs5 n TYR 373 Cb 0.49 -2.42 -0.03 0.00 -0.31 0.00 0.00 39.34 37.08 3hs5 n TYR 373 CO 0.00 0.00 0.00 1.14 -0.46 0.00 0.00 176.86 177.54 3hs5 s GLN 374 N 2.53 1.19 -0.03 -0.72 -2.07 -1.09 -4.73 119.66 114.74 3hs5 s GLN 374 Ca 0.46 -0.33 -0.15 0.00 -1.82 0.00 0.00 55.36 53.51 3hs5 s GLN 374 Cb 0.13 0.55 0.03 0.00 -1.09 0.00 0.00 33.01 32.63 3hs5 s GLN 374 CO -0.07 -0.50 0.34 1.21 -1.32 0.00 0.00 175.29 174.95 3hs5 s ASN 375 N -2.46 -0.24 -0.06 12.60 2.47 -1.26 -4.77 114.94 121.22 3hs5 s ASN 375 Ca -0.01 0.20 0.01 0.00 0.42 0.00 0.00 52.86 53.48 3hs5 s ASN 375 Cb -0.01 0.38 0.02 0.00 -1.45 0.00 0.00 41.25 40.19 3hs5 s ASN 375 CO -0.09 -0.42 -0.07 -0.60 -3.72 0.00 0.00 177.10 172.20 3hs5 s ARG 376 N -1.13 1.23 0.02 0.43 6.06 -1.26 -4.83 118.95 119.46 3hs5 s ARG 376 Ca -0.12 -0.22 -0.30 0.00 -2.50 0.00 0.00 55.73 52.59 3hs5 s ARG 376 Cb -0.05 -1.17 -0.07 0.00 0.06 0.00 0.00 34.95 33.73 3hs5 s ARG 376 CO 0.04 -0.09 1.58 0.42 -2.50 0.00 0.00 175.30 174.74 3hs5 s ILE 377 N 1.04 3.37 0.17 4.11 -1.09 -1.26 -4.76 121.20 122.79 3hs5 s ILE 377 Ca -0.08 0.72 -0.26 0.00 -2.23 0.00 0.00 60.65 58.80 3hs5 s ILE 377 Cb -0.14 -3.47 -0.08 0.00 -1.58 0.00 0.00 42.46 37.19 3hs5 s ILE 377 CO -0.00 -0.02 0.81 0.00 -1.23 0.00 0.00 174.94 174.49 3hs5 s ALA 378 N 2.91 3.43 0.34 9.38 0.00 -1.26 -1.23 121.76 135.31 3hs5 s ALA 378 Ca 0.71 0.40 0.03 0.00 0.00 0.00 0.00 51.96 53.11 3hs5 s ALA 378 Cb -0.36 -3.00 0.65 0.00 0.00 0.00 0.00 23.12 20.41 3hs5 s ALA 378 CO 0.30 0.27 1.94 1.03 0.00 0.00 0.00 175.76 179.29 3hs5 h SER 379 N 4.36 0.77 0.20 0.00 0.87 -1.06 -2.16 113.55 116.53 3hs5 h SER 379 Ca -0.47 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 59.98 3hs5 h SER 379 Cb 1.21 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.99 3hs5 h SER 379 CO 0.67 0.50 -0.44 -0.33 -0.53 0.00 0.00 176.83 176.70 3hs5 h GLU 380 N 0.88 0.30 -0.22 2.24 3.07 -1.93 -0.64 114.58 118.27 3hs5 h GLU 380 Ca 0.34 -0.15 0.01 0.00 -0.50 0.00 0.00 59.36 59.06 3hs5 h GLU 380 Cb 0.22 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.12 3hs5 h GLU 380 CO -0.12 0.69 0.13 0.35 -1.40 0.00 0.00 179.01 178.66 3hs5 h PHE 381 N 0.25 0.25 -0.21 4.33 3.57 -1.79 0.13 116.94 123.47 3hs5 h PHE 381 Ca 0.02 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.58 3hs5 h PHE 381 Cb 0.87 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 39.47 3hs5 h PHE 381 CO 0.02 0.15 -0.20 -0.97 -2.23 0.00 0.00 178.31 175.08 3hs5 h ASN 382 N 0.28 -0.64 -0.28 0.41 -0.73 -1.14 -2.63 115.58 110.84 3hs5 h ASN 382 Ca 0.09 0.12 0.02 0.00 1.87 0.00 0.00 56.30 58.39 3hs5 h ASN 382 Cb -0.01 0.31 -0.02 0.00 0.27 0.00 0.00 38.32 38.86 3hs5 h ASN 382 CO -0.03 -0.24 0.14 0.74 -0.37 0.00 0.00 177.43 177.66 3hs5 h THR 383 N -0.21 0.98 0.00 -3.57 2.02 -0.78 -2.16 112.91 109.20 3hs5 h THR 383 Ca 0.13 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.21 3hs5 h THR 383 Cb 0.40 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 3hs5 h THR 383 CO -0.34 0.05 0.00 0.17 0.37 0.00 0.00 175.52 175.78 3hs5 h LEU 384 N 0.29 0.00 -1.13 2.58 8.10 -0.93 -2.71 115.31 121.51 3hs5 h LEU 384 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.11 3hs5 h LEU 384 Cb 0.04 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.26 3hs5 h LEU 384 CO -0.09 0.00 0.00 0.00 -4.11 0.00 0.00 178.44 174.24 3hs5 n TYR 385 N -2.85 0.39 -1.78 0.17 9.36 -0.81 -4.59 117.16 117.05 3hs5 n TYR 385 Ca 0.00 -0.20 -0.42 0.00 3.32 0.00 0.00 57.90 60.61 3hs5 n TYR 385 Cb 0.24 0.00 -0.00 0.00 -0.63 0.00 0.00 39.34 38.95 3hs5 n TYR 385 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 3hs5 n HIS 386 N 0.39 3.41 -1.23 2.98 8.25 -1.02 -4.80 115.22 123.19 3hs5 n HIS 386 Ca 0.11 -2.96 -0.20 0.00 -0.26 0.00 0.00 57.72 54.41 3hs5 n HIS 386 Cb 0.27 -2.48 -0.10 0.00 1.12 0.00 0.00 29.99 28.80 3hs5 n HIS 386 CO 0.00 0.00 0.00 0.91 0.64 0.00 0.00 176.34 177.89 3hs5 n TRP 387 N 5.70 0.89 -0.29 4.41 8.01 -1.26 -4.69 117.44 130.22 3hs5 n TRP 387 Ca 0.52 -1.73 0.04 0.00 -1.31 0.00 0.00 57.50 55.01 3hs5 n TRP 387 Cb 0.38 -1.43 0.12 0.00 -2.01 0.00 0.00 31.31 28.37 3hs5 n TRP 387 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 3hs5 h HIS 388 N 2.88 -0.36 -0.03 -5.99 3.86 -1.97 -1.72 115.15 111.81 3hs5 h HIS 388 Ca 0.29 0.07 0.01 0.00 -1.16 0.00 0.00 60.37 59.58 3hs5 h HIS 388 Cb 1.07 0.29 -0.00 0.00 1.06 0.00 0.00 27.41 29.82 3hs5 h HIS 388 CO 1.54 -0.34 0.28 -1.35 0.86 0.00 0.00 177.93 178.91 3hs5 h PRO 389 N 0.01 0.00 -0.55 2.45 0.11 -1.84 0.82 132.00 133.00 3hs5 h PRO 389 Ca 0.41 0.00 0.10 0.00 0.11 0.00 0.00 66.00 66.62 3hs5 h PRO 389 Cb 0.65 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.73 3hs5 h PRO 389 CO -0.82 0.00 0.38 1.25 -0.21 0.00 0.00 178.00 178.59 3hs5 h LEU 390 N 0.00 0.27 -9.66 2.35 5.85 -1.46 -3.27 115.31 109.39 3hs5 h LEU 390 Ca 0.01 0.01 -0.52 0.00 0.84 0.00 0.00 57.88 58.22 3hs5 h LEU 390 Cb 0.58 -0.05 0.03 0.00 0.37 0.00 0.00 40.66 41.59 3hs5 h LEU 390 CO -0.00 0.16 0.66 -0.76 -0.34 0.00 0.00 178.44 178.16 3hs5 s LEU 391 N -9.21 4.41 0.97 2.25 1.43 0.28 -1.26 118.68 117.55 3hs5 s LEU 391 Ca -0.07 2.39 -0.15 0.00 -1.03 0.00 0.00 54.13 55.28 3hs5 s LEU 391 Cb 0.19 -3.61 0.18 0.00 0.03 0.00 0.00 46.19 42.99 3hs5 s LEU 391 CO 0.74 -0.54 1.18 -2.16 0.23 0.00 0.00 176.35 175.80 3hs5 s PRO 392 N 0.04 0.61 0.14 1.29 0.04 -1.26 -4.61 135.00 131.25 3hs5 s PRO 392 Ca 0.58 0.04 -0.03 0.00 0.04 0.00 0.00 61.00 61.62 3hs5 s PRO 392 Cb -0.36 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.32 3hs5 s PRO 392 CO 0.37 -2.51 1.34 -0.44 0.04 0.00 0.00 177.00 175.81 3hs5 h ASP 393 N -1.72 0.50 -5.08 6.66 3.32 -1.96 -3.46 116.42 114.68 3hs5 h ASP 393 Ca -0.48 -0.38 -0.15 0.00 0.02 0.00 0.00 57.03 56.04 3hs5 h ASP 393 Cb 1.30 -0.15 -0.15 0.00 0.22 0.00 0.00 39.33 40.55 3hs5 h ASP 393 CO 0.51 1.17 -0.68 0.42 -1.72 0.00 0.00 179.24 178.93 3hs5 s THR 394 N -3.35 0.34 -0.32 0.35 -4.23 -1.26 -4.54 115.64 102.63 3hs5 s THR 394 Ca -0.06 -1.84 -0.09 0.00 -1.18 0.00 0.00 61.69 58.52 3hs5 s THR 394 Cb 0.09 -1.58 0.00 0.00 1.34 0.00 0.00 72.50 72.36 3hs5 s THR 394 CO 0.86 -0.95 0.15 -0.36 -0.54 0.00 0.00 174.62 173.77 3hs5 s PHE 395 N -3.85 3.19 -0.50 3.99 0.08 0.13 -4.88 117.98 116.15 3hs5 s PHE 395 Ca 0.09 -0.71 -0.15 0.00 0.12 0.00 0.00 56.93 56.28 3hs5 s PHE 395 Cb 0.07 -2.35 0.10 0.00 -0.57 0.00 0.00 43.02 40.27 3hs5 s PHE 395 CO -0.08 -0.51 0.43 -0.80 -0.10 0.00 0.00 175.22 174.16 3hs5 s ASN 396 N 1.58 6.12 -0.16 1.36 0.01 -1.26 -1.00 114.94 121.59 3hs5 s ASN 396 Ca 0.04 -1.54 0.00 0.00 -0.71 0.00 0.00 52.86 50.65 3hs5 s ASN 396 Cb -0.17 -2.18 0.00 0.00 0.41 0.00 0.00 41.25 39.31 3hs5 s ASN 396 CO 0.06 -0.73 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.13 3hs5 s ILE 397 N 1.60 2.55 0.00 0.60 1.01 -0.84 -4.58 121.20 121.54 3hs5 s ILE 397 Ca 0.04 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 59.89 3hs5 s ILE 397 Cb -0.27 -2.08 0.00 0.00 0.01 0.00 0.00 42.46 40.13 3hs5 s ILE 397 CO 0.05 0.52 0.00 1.21 0.00 0.00 0.00 174.94 176.71 3hs5 n GLU 398 N 4.20 0.00 0.00 2.79 2.13 -1.26 -0.78 120.64 127.72 3hs5 n GLU 398 Ca -0.19 0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.74 3hs5 n GLU 398 Cb 0.51 0.00 0.04 0.00 0.27 0.00 0.00 31.44 32.26 3hs5 n GLU 398 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3hs5 n ASP 399 N 9.55 1.87 -4.90 4.31 8.00 -1.26 -4.99 116.55 129.12 3hs5 n ASP 399 Ca 0.00 -1.42 -0.30 0.00 0.71 0.00 0.00 54.79 53.78 3hs5 n ASP 399 Cb 0.00 0.46 -0.04 0.00 -0.02 0.00 0.00 41.12 41.52 3hs5 n ASP 399 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3hs5 s GLN 400 N -2.51 3.65 -0.31 -1.24 1.11 0.04 -5.08 119.66 115.32 3hs5 s GLN 400 Ca 0.19 -0.03 0.00 0.00 0.01 0.00 0.00 55.36 55.53 3hs5 s GLN 400 Cb 0.18 -2.75 0.10 0.00 -1.01 0.00 0.00 33.01 29.53 3hs5 s GLN 400 CO 0.58 0.36 0.08 -1.21 0.01 0.00 0.00 175.29 175.11 3hs5 s GLU 401 N -3.01 0.92 -0.08 2.91 2.02 -1.26 -1.99 118.70 118.21 3hs5 s GLU 401 Ca 0.43 -1.26 -0.22 0.00 0.02 0.00 0.00 54.97 53.95 3hs5 s GLU 401 Cb -0.11 -2.30 -0.04 0.00 0.10 0.00 0.00 34.13 31.77 3hs5 s GLU 401 CO 0.26 -0.96 0.62 0.71 0.02 0.00 0.00 175.26 175.91 3hs5 s TYR 402 N 1.44 3.57 1.02 1.61 2.02 -0.17 -4.82 117.35 122.01 3hs5 s TYR 402 Ca 0.09 1.14 -0.12 0.00 -0.37 0.00 0.00 57.07 57.81 3hs5 s TYR 402 Cb -0.18 -2.71 0.20 0.00 -0.40 0.00 0.00 41.96 38.87 3hs5 s TYR 402 CO -0.20 0.13 1.08 -1.54 -1.57 0.00 0.00 175.55 173.45 3hs5 s SER 403 N 0.66 2.41 0.22 2.29 1.04 -1.26 -0.69 113.70 118.37 3hs5 s SER 403 Ca 0.33 1.27 -0.08 0.00 0.48 0.00 0.00 55.95 57.95 3hs5 s SER 403 Cb -0.17 -1.95 0.29 0.00 0.10 0.00 0.00 66.02 64.28 3hs5 s SER 403 CO 0.16 -3.28 1.80 -0.26 0.98 0.00 0.00 173.24 172.64 3hs5 h PHE 404 N -1.99 0.69 -0.85 5.02 -1.00 -1.96 -0.73 116.94 116.12 3hs5 h PHE 404 Ca -0.55 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.27 3hs5 h PHE 404 Cb 1.33 -0.21 -0.04 0.00 3.61 0.00 0.00 35.95 40.63 3hs5 h PHE 404 CO 0.30 0.30 0.56 -0.22 -1.61 0.00 0.00 178.31 177.64 3hs5 h LYS 405 N 0.68 1.10 -0.04 1.51 3.64 -1.94 -1.34 116.57 120.17 3hs5 h LYS 405 Ca 0.33 -0.07 -0.18 0.00 -1.27 0.00 0.00 60.65 59.46 3hs5 h LYS 405 Cb 0.26 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 3hs5 h LYS 405 CO -0.21 0.73 -0.76 1.96 -2.27 0.00 0.00 179.45 178.89 3hs5 h GLN 406 N 1.13 0.29 -0.02 1.90 4.20 -1.86 -3.34 115.11 117.42 3hs5 h GLN 406 Ca 0.32 -0.26 -0.13 0.00 0.06 0.00 0.00 58.65 58.64 3hs5 h GLN 406 Cb -0.10 0.06 0.01 0.00 0.30 0.00 0.00 27.48 27.75 3hs5 h GLN 406 CO -0.08 0.92 -0.50 0.35 -0.67 0.00 0.00 178.83 178.86 3hs5 h PHE 407 N 0.19 0.54 -3.22 2.96 3.57 -0.71 -3.42 116.94 116.84 3hs5 h PHE 407 Ca -0.03 -0.28 -0.55 0.00 3.53 0.00 0.00 57.97 60.64 3hs5 h PHE 407 Cb 1.34 -0.07 0.09 0.00 2.79 0.00 0.00 35.95 40.10 3hs5 h PHE 407 CO 0.03 1.08 0.80 1.28 -2.23 0.00 0.00 178.31 179.28 3hs5 n LEU 408 N -4.29 4.13 -0.63 0.59 4.77 -0.54 -2.51 117.00 118.51 3hs5 n LEU 408 Ca -0.10 1.16 -0.08 0.00 -0.03 0.00 0.00 56.01 56.96 3hs5 n LEU 408 Cb 0.61 -1.56 -0.03 0.00 -2.33 0.00 0.00 43.42 40.11 3hs5 n LEU 408 CO 0.45 0.00 -0.07 -1.22 -1.33 0.00 0.00 177.39 175.22 3hs5 n TYR 409 N 1.86 -0.05 -3.48 -1.77 4.01 0.74 -4.90 117.16 113.56 3hs5 n TYR 409 Ca 0.08 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.45 3hs5 n TYR 409 Cb 0.36 -2.37 -0.04 0.00 -0.31 0.00 0.00 39.34 36.97 3hs5 n TYR 409 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3hs5 n ASN 410 N -0.73 4.69 0.00 7.72 2.85 -1.04 -4.85 115.26 123.89 3hs5 n ASN 410 Ca -0.08 -3.19 0.11 0.00 -0.11 0.00 0.00 54.58 51.32 3hs5 n ASN 410 Cb 0.50 -1.10 0.53 0.00 1.24 0.00 0.00 39.78 40.95 3hs5 n ASN 410 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 3hs5 n ASN 411 N 2.08 0.00 0.25 1.20 3.02 -1.26 -2.81 115.26 117.74 3hs5 n ASN 411 Ca 0.24 0.23 0.12 0.00 -0.03 0.00 0.00 54.58 55.14 3hs5 n ASN 411 Cb 0.37 -0.39 0.60 0.00 -0.61 0.00 0.00 39.78 39.74 3hs5 n ASN 411 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3hs5 h SER 412 N 0.00 0.00 -0.71 6.41 4.64 -1.94 -2.16 113.55 119.78 3hs5 h SER 412 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 3hs5 h SER 412 Cb 0.30 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.36 3hs5 h SER 412 CO 0.00 0.16 0.23 0.40 -0.87 0.00 0.00 176.83 176.75 3hs5 h ILE 413 N 0.00 1.26 -0.52 0.95 2.04 -1.93 0.12 117.51 119.43 3hs5 h ILE 413 Ca -0.00 -0.88 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 3hs5 h ILE 413 Cb 0.57 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 3hs5 h ILE 413 CO 0.02 0.34 0.25 0.25 0.00 0.00 0.00 178.15 179.01 3hs5 h LEU 414 N 1.05 0.68 -0.50 1.44 5.85 -1.59 -2.14 115.31 120.10 3hs5 h LEU 414 Ca 0.23 -0.13 -0.15 0.00 0.84 0.00 0.00 57.88 58.67 3hs5 h LEU 414 Cb 0.29 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 3hs5 h LEU 414 CO -0.01 0.62 -0.35 -0.07 -0.34 0.00 0.00 178.44 178.29 3hs5 h LEU 415 N 0.69 0.89 -0.27 2.25 3.38 -1.15 0.82 115.31 121.92 3hs5 h LEU 415 Ca 0.18 -0.39 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 3hs5 h LEU 415 Cb 0.12 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3hs5 h LEU 415 CO -0.02 1.15 -0.15 -0.08 0.09 0.00 0.00 178.44 179.42 3hs5 h GLU 416 N 0.70 0.58 0.16 1.13 4.81 -0.71 -3.31 114.58 117.93 3hs5 h GLU 416 Ca 0.07 -0.26 -0.34 0.00 -0.13 0.00 0.00 59.36 58.69 3hs5 h GLU 416 Cb 0.92 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.29 3hs5 h GLU 416 CO 0.08 0.84 -1.73 0.45 -0.73 0.00 0.00 179.01 177.92 3hs5 h HIS 417 N 0.31 0.60 0.00 0.92 3.86 -1.41 -3.51 115.15 115.91 3hs5 h HIS 417 Ca 0.06 -0.44 0.00 0.00 -1.16 0.00 0.00 60.37 58.83 3hs5 h HIS 417 Cb 0.68 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.12 3hs5 h HIS 417 CO 0.06 1.59 0.00 0.41 0.86 0.00 0.00 177.93 180.86 3hs5 n GLY 418 N 1.82 -0.22 0.28 2.45 0.00 0.28 -4.35 105.19 105.44 3hs5 n GLY 418 Ca -0.23 -1.69 -0.09 0.00 0.00 0.00 0.00 46.02 44.01 3hs5 n GLY 418 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hs5 h LEU 419 N 0.00 0.90 -0.28 0.99 -0.00 -1.94 -2.16 115.31 112.81 3hs5 h LEU 419 Ca 0.00 -0.26 0.03 0.00 -0.00 0.00 0.00 57.88 57.65 3hs5 h LEU 419 Cb 0.00 -0.24 -0.03 0.00 -0.00 0.00 0.00 40.66 40.39 3hs5 h LEU 419 CO 0.00 0.93 0.11 0.74 -0.00 0.00 0.00 178.44 180.22 3hs5 h THR 420 N 0.84 0.94 -0.64 0.22 2.02 -1.86 0.10 112.91 114.52 3hs5 h THR 420 Ca 0.17 -0.08 -0.05 0.00 0.77 0.00 0.00 66.41 67.22 3hs5 h THR 420 Cb 0.41 0.68 -0.03 0.00 -1.74 0.00 0.00 68.15 67.47 3hs5 h THR 420 CO 0.01 0.04 0.19 1.56 0.37 0.00 0.00 175.52 177.69 3hs5 h GLN 421 N 0.24 1.01 -0.20 6.66 1.08 -1.74 -1.03 115.11 121.13 3hs5 h GLN 421 Ca 0.12 -0.23 0.05 0.00 -1.45 0.00 0.00 58.65 57.14 3hs5 h GLN 421 Cb 0.08 -0.14 -0.05 0.00 -0.05 0.00 0.00 27.48 27.32 3hs5 h GLN 421 CO -0.12 0.89 -0.10 0.74 -0.95 0.00 0.00 178.83 179.30 3hs5 h PHE 422 N 0.94 -0.24 0.10 2.96 -1.00 -0.95 -0.33 116.94 118.42 3hs5 h PHE 422 Ca 0.21 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 61.00 3hs5 h PHE 422 Cb 0.31 0.14 0.00 0.00 3.61 0.00 0.00 35.95 40.01 3hs5 h PHE 422 CO 0.02 -0.15 -0.05 0.28 -1.61 0.00 0.00 178.31 176.80 3hs5 h VAL 423 N -0.08 0.91 -0.61 -0.55 2.07 -0.81 0.10 116.25 117.28 3hs5 h VAL 423 Ca 0.11 -0.01 0.04 0.00 0.82 0.00 0.00 66.70 67.66 3hs5 h VAL 423 Cb 0.24 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 3hs5 h VAL 423 CO -0.25 0.00 0.35 -0.33 0.02 0.00 0.00 177.57 177.36 3hs5 h GLU 424 N -0.13 0.66 -0.03 1.57 5.08 -1.04 -0.25 114.58 120.43 3hs5 h GLU 424 Ca -0.01 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3hs5 h GLU 424 Cb 0.10 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 3hs5 h GLU 424 CO 0.02 0.44 -0.04 0.77 -1.00 0.00 0.00 179.01 179.20 3hs5 h SER 425 N 0.68 0.10 0.34 1.42 0.02 -0.94 -3.06 113.55 112.11 3hs5 h SER 425 Ca 0.26 -0.51 -0.05 0.00 -0.84 0.00 0.00 61.79 60.64 3hs5 h SER 425 Cb 0.09 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 3hs5 h SER 425 CO -0.14 0.59 -0.25 -0.26 -1.14 0.00 0.00 176.83 175.63 3hs5 h PHE 426 N -0.39 0.00 -0.41 3.45 0.04 -0.88 -1.97 116.94 116.77 3hs5 h PHE 426 Ca 0.00 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.69 3hs5 h PHE 426 Cb 0.57 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.70 3hs5 h PHE 426 CO 0.10 0.25 -0.10 1.15 -0.60 0.00 0.00 178.31 179.11 3hs5 h THR 427 N 0.00 1.25 0.00 -1.55 2.02 -1.05 -1.65 112.91 111.93 3hs5 h THR 427 Ca -0.00 -1.12 0.00 0.00 0.77 0.00 0.00 66.41 66.05 3hs5 h THR 427 Cb 0.49 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.95 3hs5 h THR 427 CO 0.03 0.38 -0.70 -2.11 0.37 0.00 0.00 175.52 173.50 3hs5 n ARG 428 N -4.18 0.23 -3.10 6.66 1.85 -0.96 -4.40 116.66 112.76 3hs5 n ARG 428 Ca 0.01 0.05 -0.40 0.00 -1.00 0.00 0.00 57.85 56.51 3hs5 n ARG 428 Cb 0.35 -1.63 -0.06 0.00 -1.05 0.00 0.00 32.46 30.08 3hs5 n ARG 428 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 3hs5 s GLN 429 N -3.14 4.20 0.34 2.89 0.74 -0.78 -4.96 119.66 118.95 3hs5 s GLN 429 Ca 0.07 0.64 -0.26 0.00 0.05 0.00 0.00 55.36 55.85 3hs5 s GLN 429 Cb 0.14 -3.59 -0.09 0.00 1.10 0.00 0.00 33.01 30.57 3hs5 s GLN 429 CO 0.74 -0.27 1.03 -1.50 -0.55 0.00 0.00 175.29 174.74 3hs5 s ILE 430 N 2.02 3.79 0.56 -2.34 2.07 -1.25 -1.41 121.20 124.63 3hs5 s ILE 430 Ca 0.29 1.54 -0.01 0.00 -1.41 0.00 0.00 60.65 61.06 3hs5 s ILE 430 Cb -0.16 -3.88 0.03 0.00 0.13 0.00 0.00 42.46 38.58 3hs5 s ILE 430 CO 0.10 0.17 0.80 0.00 -1.91 0.00 0.00 174.94 174.10 3hs5 s ALA 431 N -1.48 3.71 0.51 1.50 0.00 0.15 -4.81 121.76 121.34 3hs5 s ALA 431 Ca 0.51 -1.16 -0.13 0.00 0.00 0.00 0.00 51.96 51.18 3hs5 s ALA 431 Cb -0.24 -2.21 -0.06 0.00 0.00 0.00 0.00 23.12 20.60 3hs5 s ALA 431 CO 0.31 -0.76 0.94 0.20 0.00 0.00 0.00 175.76 176.44 3hs5 s GLY 432 N -4.39 1.90 0.17 0.00 0.00 -0.39 -0.56 107.32 104.05 3hs5 s GLY 432 Ca 0.56 -0.01 -0.30 0.00 0.00 0.00 0.00 44.72 44.96 3hs5 s GLY 432 CO 0.40 0.24 1.20 -1.60 0.00 0.00 0.00 173.10 173.34 3hs5 s ARG 433 N -4.33 4.48 -0.17 2.90 3.52 0.17 -4.09 118.95 121.42 3hs5 s ARG 433 Ca 0.56 1.87 -0.22 0.00 -0.13 0.00 0.00 55.73 57.81 3hs5 s ARG 433 Cb -0.10 -3.25 -0.19 0.00 -1.56 0.00 0.00 34.95 29.85 3hs5 s ARG 433 CO 0.38 -0.11 0.37 0.28 -0.81 0.00 0.00 175.30 175.41 3hs5 h VAL 434 N 3.82 1.11 -4.11 7.11 2.07 -1.85 -3.42 116.25 120.97 3hs5 h VAL 434 Ca -0.44 -2.08 -0.46 0.00 0.82 0.00 0.00 66.70 64.53 3hs5 h VAL 434 Cb 1.21 2.35 0.11 0.00 -1.52 0.00 0.00 31.29 33.44 3hs5 h VAL 434 CO 0.75 0.38 0.35 0.00 0.02 0.00 0.00 177.57 179.07 3hs5 s ALA 435 N -2.35 2.74 0.00 1.67 0.00 -0.19 -4.52 121.76 119.12 3hs5 s ALA 435 Ca -0.23 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3hs5 s ALA 435 Cb 0.02 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 20.37 3hs5 s ALA 435 CO 0.56 -1.75 0.00 0.41 0.00 0.00 0.00 175.76 174.98 3hs5 n GLY 436 N -3.30 0.41 0.00 0.00 0.00 -0.57 -4.89 105.19 96.84 3hs5 n GLY 436 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3hs5 n GLY 436 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hs5 n GLY 437 N -2.00 -2.30 3.96 -0.02 0.00 0.16 -4.88 105.19 100.10 3hs5 n GLY 437 Ca 0.00 -1.48 -0.26 0.00 0.00 0.00 0.00 46.02 44.28 3hs5 n GLY 437 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hs5 n ARG 438 N -2.00 -3.37 -0.33 1.61 1.74 0.37 -4.88 116.66 109.81 3hs5 n ARG 438 Ca 0.00 0.41 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 3hs5 n ARG 438 Cb 0.00 -4.59 0.01 0.00 -1.02 0.00 0.00 32.46 26.86 3hs5 n ARG 438 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3hs5 n ASN 439 N -2.97 0.15 -4.65 0.55 5.15 -0.45 -3.71 115.26 109.32 3hs5 n ASN 439 Ca -0.29 -1.77 -0.43 0.00 -0.60 0.00 0.00 54.58 51.50 3hs5 n ASN 439 Cb 0.67 -0.15 -0.03 0.00 -0.53 0.00 0.00 39.78 39.75 3hs5 n ASN 439 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hs5 s VAL 440 N -0.16 4.71 0.43 3.44 1.01 -0.11 -4.20 120.40 125.52 3hs5 s VAL 440 Ca 0.02 1.89 -0.26 0.00 0.00 0.00 0.00 61.98 63.63 3hs5 s VAL 440 Cb 0.01 -4.26 -0.08 0.00 0.00 0.00 0.00 36.38 32.04 3hs5 s VAL 440 CO 0.00 -0.17 1.36 -2.16 0.00 0.00 0.00 175.10 174.13 3hs5 s PRO 441 N 3.13 3.83 0.38 2.72 0.04 -1.26 -0.33 135.00 143.51 3hs5 s PRO 441 Ca 0.42 2.27 0.10 0.00 0.04 0.00 0.00 61.00 63.83 3hs5 s PRO 441 Cb -0.15 -2.70 0.88 0.00 0.04 0.00 0.00 34.50 32.56 3hs5 s PRO 441 CO 0.07 -0.64 1.92 0.82 0.04 0.00 0.00 177.00 179.20 3hs5 h ILE 442 N 2.38 0.88 -0.36 0.56 1.08 -1.95 -2.19 117.51 117.91 3hs5 h ILE 442 Ca -0.50 -0.21 0.10 0.00 -0.39 0.00 0.00 64.86 63.86 3hs5 h ILE 442 Cb 1.26 0.22 -0.01 0.00 -3.07 0.00 0.00 36.82 35.21 3hs5 h ILE 442 CO 0.62 0.11 0.27 0.00 -0.69 0.00 0.00 178.15 178.46 3hs5 h ALA 443 N 1.62 2.31 -0.42 1.87 0.00 -1.99 -1.77 119.26 120.89 3hs5 h ALA 443 Ca 0.37 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 55.07 3hs5 h ALA 443 Cb 0.60 0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.30 3hs5 h ALA 443 CO -0.14 -0.45 0.01 1.33 0.00 0.00 0.00 179.25 180.00 3hs5 n VAL 444 N -4.37 2.60 0.13 0.00 0.24 -0.83 -4.75 118.33 111.35 3hs5 n VAL 444 Ca 0.06 -2.55 0.05 0.00 -2.04 0.00 0.00 64.34 59.85 3hs5 n VAL 444 Cb 0.45 -0.33 0.50 0.00 -1.47 0.00 0.00 33.84 32.99 3hs5 n VAL 444 CO 0.00 0.00 0.00 0.06 -2.14 0.00 0.00 176.83 174.75 3hs5 h GLN 445 N 1.11 0.26 -0.02 7.34 3.07 -1.37 -2.10 115.11 123.40 3hs5 h GLN 445 Ca 0.24 -0.02 -0.10 0.00 0.09 0.00 0.00 58.65 58.86 3hs5 h GLN 445 Cb 1.78 -0.06 -0.01 0.00 0.08 0.00 0.00 27.48 29.27 3hs5 h GLN 445 CO 0.45 0.22 -0.45 0.00 0.09 0.00 0.00 178.83 179.14 3hs5 h ALA 446 N 1.83 1.23 -0.01 0.06 0.00 -1.85 -1.83 119.26 118.69 3hs5 h ALA 446 Ca 0.07 -0.41 -0.19 0.00 0.00 0.00 0.00 54.91 54.38 3hs5 h ALA 446 Cb 0.05 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.77 3hs5 h ALA 446 CO -0.01 0.57 -0.72 0.28 0.00 0.00 0.00 179.25 179.37 3hs5 h VAL 447 N 0.03 1.38 -0.58 0.00 2.07 -1.77 -1.47 116.25 115.93 3hs5 h VAL 447 Ca -0.00 -2.11 0.02 0.00 0.82 0.00 0.00 66.70 65.42 3hs5 h VAL 447 Cb 0.80 2.52 -0.03 0.00 -1.52 0.00 0.00 31.29 33.06 3hs5 h VAL 447 CO 0.06 0.63 0.37 0.00 0.02 0.00 0.00 177.57 178.65 3hs5 h ALA 448 N 0.35 0.74 -0.64 1.67 0.00 -1.40 -1.37 119.26 118.60 3hs5 h ALA 448 Ca -0.09 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3hs5 h ALA 448 Cb 1.41 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 3hs5 h ALA 448 CO 0.14 0.13 0.27 -0.22 0.00 0.00 0.00 179.25 179.57 3hs5 h LYS 449 N 0.74 0.95 -0.89 0.00 3.64 -1.35 -2.51 116.57 117.16 3hs5 h LYS 449 Ca 0.22 -0.16 0.09 0.00 -1.27 0.00 0.00 60.65 59.53 3hs5 h LYS 449 Cb -0.03 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 31.57 3hs5 h LYS 449 CO -0.07 0.79 0.58 0.00 -2.27 0.00 0.00 179.45 178.48 3hs5 h ALA 450 N 1.11 1.60 -0.74 5.00 0.00 -0.96 -0.53 119.26 124.74 3hs5 h ALA 450 Ca 0.22 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3hs5 h ALA 450 Cb 0.18 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3hs5 h ALA 450 CO -0.02 0.23 0.40 0.77 0.00 0.00 0.00 179.25 180.63 3hs5 h SER 451 N 0.92 0.93 0.11 0.00 0.02 -0.81 0.17 113.55 114.90 3hs5 h SER 451 Ca 0.41 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 61.25 3hs5 h SER 451 Cb 0.35 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.65 3hs5 h SER 451 CO -0.17 0.76 -0.05 0.40 -1.14 0.00 0.00 176.83 176.63 3hs5 h ILE 452 N 1.03 1.08 -0.84 3.27 2.04 -1.31 -2.48 117.51 120.30 3hs5 h ILE 452 Ca 0.26 -0.85 0.04 0.00 1.00 0.00 0.00 64.86 65.31 3hs5 h ILE 452 Cb 0.04 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.68 3hs5 h ILE 452 CO -0.04 0.20 0.53 0.44 0.00 0.00 0.00 178.15 179.28 3hs5 h ASP 453 N -0.55 0.86 0.64 1.72 3.32 -0.93 -2.34 116.42 119.13 3hs5 h ASP 453 Ca -0.02 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.87 3hs5 h ASP 453 Cb 0.44 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 3hs5 h ASP 453 CO 0.02 0.57 -0.79 1.56 -1.72 0.00 0.00 179.24 178.89 3hs5 h GLN 454 N 1.00 0.11 -0.81 3.56 4.20 -0.73 -0.63 115.11 121.81 3hs5 h GLN 454 Ca 0.35 -0.11 0.02 0.00 0.06 0.00 0.00 58.65 58.98 3hs5 h GLN 454 Cb 0.08 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.84 3hs5 h GLN 454 CO -0.14 0.84 0.52 0.77 -0.67 0.00 0.00 178.83 180.15 3hs5 h SER 455 N 0.06 0.88 -0.32 1.46 0.02 -1.10 -0.77 113.55 113.78 3hs5 h SER 455 Ca -0.02 -0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 60.79 3hs5 h SER 455 Cb 1.38 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 3hs5 h SER 455 CO 0.11 0.62 -0.31 0.03 -1.14 0.00 0.00 176.83 176.14 3hs5 h ARG 456 N 1.04 0.77 -1.00 3.45 3.08 -1.17 -1.61 114.38 118.94 3hs5 h ARG 456 Ca 0.31 -0.40 0.06 0.00 0.07 0.00 0.00 59.98 60.02 3hs5 h ARG 456 Cb -0.04 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 29.96 3hs5 h ARG 456 CO -0.09 1.03 0.65 1.49 -1.07 0.00 0.00 179.97 181.97 3hs5 h GLU 457 N 0.54 1.16 -0.00 0.04 4.81 -0.92 -0.92 114.58 119.27 3hs5 h GLU 457 Ca 0.05 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3hs5 h GLU 457 Cb 0.88 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.00 3hs5 h GLU 457 CO 0.08 0.77 0.00 -1.33 -0.73 0.00 0.00 179.01 177.79 3hs5 n MET 458 N -4.48 1.05 -3.61 1.92 2.81 -0.31 -4.92 117.12 109.57 3hs5 n MET 458 Ca 0.15 -0.07 -0.22 0.00 -1.81 0.00 0.00 57.70 55.75 3hs5 n MET 458 Cb 0.16 -1.47 0.06 0.00 -0.71 0.00 0.00 33.22 31.27 3hs5 n MET 458 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3hs5 n LYS 459 N -0.88 -6.41 -1.75 0.03 4.76 -0.35 -4.75 118.16 108.82 3hs5 n LYS 459 Ca 0.22 0.75 -0.42 0.00 -2.87 0.00 0.00 58.31 56.00 3hs5 n LYS 459 Cb 0.12 -5.65 -0.01 0.00 -1.84 0.00 0.00 35.03 27.65 3hs5 n LYS 459 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 3hs5 n TYR 460 N -4.48 2.77 -1.22 2.13 4.02 -0.64 -0.96 117.16 118.79 3hs5 n TYR 460 Ca -0.17 0.43 -0.29 0.00 -0.01 0.00 0.00 57.90 57.86 3hs5 n TYR 460 Cb 0.62 -2.52 0.19 0.00 -0.02 0.00 0.00 39.34 37.62 3hs5 n TYR 460 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 3hs5 s GLN 461 N -1.65 -0.01 0.83 -0.72 -0.21 -1.26 -4.77 119.66 111.87 3hs5 s GLN 461 Ca 0.57 0.27 -0.12 0.00 0.02 0.00 0.00 55.36 56.10 3hs5 s GLN 461 Cb -0.51 -1.71 0.09 0.00 1.00 0.00 0.00 33.01 31.88 3hs5 s GLN 461 CO 0.60 -2.97 1.10 -1.54 -2.12 0.00 0.00 175.29 170.35 3hs5 s SER 462 N -3.71 4.17 0.19 5.90 1.04 -1.26 -4.59 113.70 115.44 3hs5 s SER 462 Ca 0.67 1.34 -0.16 0.00 0.48 0.00 0.00 55.95 58.28 3hs5 s SER 462 Cb -0.15 -2.06 0.18 0.00 0.10 0.00 0.00 66.02 64.09 3hs5 s SER 462 CO 0.56 -2.18 1.63 0.25 0.98 0.00 0.00 173.24 174.48 3hs5 h LEU 463 N -1.23 -0.67 -1.24 2.42 5.85 -0.92 -1.82 115.31 117.70 3hs5 h LEU 463 Ca -0.48 0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.36 3hs5 h LEU 463 Cb 1.27 0.40 -0.01 0.00 0.37 0.00 0.00 40.66 42.69 3hs5 h LEU 463 CO 0.58 -0.22 -0.21 0.78 -0.34 0.00 0.00 178.44 179.03 3hs5 h ASN 464 N -0.05 0.25 -0.31 1.25 2.35 -1.85 0.82 115.58 118.04 3hs5 h ASN 464 Ca 0.26 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.92 3hs5 h ASN 464 Cb 0.45 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 3hs5 h ASN 464 CO -0.59 0.48 0.10 -0.33 -1.65 0.00 0.00 177.43 175.44 3hs5 h GLU 465 N 0.24 0.47 -0.64 0.81 4.39 -1.77 -1.68 114.58 116.41 3hs5 h GLU 465 Ca 0.04 -0.10 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 3hs5 h GLU 465 Cb 0.51 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.06 3hs5 h GLU 465 CO 0.03 0.51 0.20 1.88 -1.16 0.00 0.00 179.01 180.47 3hs5 h TYR 466 N 0.34 0.99 -0.07 4.33 -1.99 -0.86 -1.12 116.97 118.59 3hs5 h TYR 466 Ca 0.10 -0.09 0.00 0.00 2.00 0.00 0.00 58.73 60.75 3hs5 h TYR 466 Cb 0.23 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 38.66 3hs5 h TYR 466 CO 0.00 0.79 0.04 0.00 -0.00 0.00 0.00 178.16 178.99 3hs5 h ARG 467 N 0.94 0.08 -0.84 4.88 3.08 -0.68 -2.47 114.38 119.37 3hs5 h ARG 467 Ca 0.21 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.22 3hs5 h ARG 467 Cb 0.27 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 3hs5 h ARG 467 CO -0.01 0.05 0.40 0.87 -1.07 0.00 0.00 179.97 180.22 3hs5 h LYS 468 N 0.08 1.20 -0.55 0.04 1.57 -1.18 0.53 116.57 118.26 3hs5 h LYS 468 Ca 0.03 -0.18 0.13 0.00 -1.87 0.00 0.00 60.65 58.76 3hs5 h LYS 468 Cb 0.00 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.06 3hs5 h LYS 468 CO -0.02 0.92 0.38 -0.09 -0.57 0.00 0.00 179.45 180.08 3hs5 h ARG 469 N 1.19 0.18 -0.60 3.15 9.65 -0.94 -1.99 114.38 125.02 3hs5 h ARG 469 Ca 0.29 -0.01 -0.31 0.00 -1.10 0.00 0.00 59.98 58.85 3hs5 h ARG 469 Cb 0.12 -0.04 -0.18 0.00 -1.39 0.00 0.00 29.97 28.47 3hs5 h ARG 469 CO -0.04 0.12 0.20 1.19 2.80 0.00 0.00 179.97 184.25 3hs5 n PHE 470 N -4.43 1.87 -3.38 2.20 3.01 -0.84 -4.95 117.46 110.94 3hs5 n PHE 470 Ca 0.10 -1.69 -0.24 0.00 1.01 0.00 0.00 57.45 56.63 3hs5 n PHE 470 Cb 0.49 -0.67 0.06 0.00 -0.01 0.00 0.00 39.48 39.35 3hs5 n PHE 470 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3hs5 n SER 471 N -1.11 -6.16 -4.51 4.37 7.64 -0.75 -4.98 113.62 108.12 3hs5 n SER 471 Ca 0.44 -0.45 -0.30 0.00 1.01 0.00 0.00 58.87 59.57 3hs5 n SER 471 Cb 1.29 -4.90 -0.11 0.00 -1.01 0.00 0.00 64.21 59.47 3hs5 n SER 471 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3hs5 s LEU 472 N -7.05 2.80 0.24 -3.43 1.43 0.12 -4.96 118.68 107.84 3hs5 s LEU 472 Ca 0.47 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.83 3hs5 s LEU 472 Cb -0.21 -1.64 -0.09 0.00 0.03 0.00 0.00 46.19 44.27 3hs5 s LEU 472 CO 0.59 0.21 1.35 -0.75 0.23 0.00 0.00 176.35 177.98 3hs5 s LYS 473 N -1.90 4.35 0.61 1.70 2.36 -1.26 -3.27 119.74 122.32 3hs5 s LYS 473 Ca 0.18 2.16 -0.19 0.00 -2.55 0.00 0.00 55.97 55.57 3hs5 s LYS 473 Cb -0.11 -3.15 -0.03 0.00 -1.05 0.00 0.00 37.83 33.50 3hs5 s LYS 473 CO 0.09 -0.29 1.29 -2.14 1.55 0.00 0.00 175.35 175.85 3hs5 s PRO 474 N -0.47 2.80 0.21 4.03 0.02 -1.26 -4.87 135.00 135.47 3hs5 s PRO 474 Ca 0.56 2.04 -0.30 0.00 0.02 0.00 0.00 61.00 63.33 3hs5 s PRO 474 Cb -0.39 -1.97 -0.08 0.00 0.02 0.00 0.00 34.50 32.08 3hs5 s PRO 474 CO 0.42 -1.39 1.10 0.71 -0.33 0.00 0.00 177.00 177.50 3hs5 s TYR 475 N -1.42 3.60 -1.27 6.54 2.02 -1.26 -4.95 117.35 120.60 3hs5 s TYR 475 Ca 0.79 1.63 0.23 0.00 -0.37 0.00 0.00 57.07 59.35 3hs5 s TYR 475 Cb -0.36 -3.27 0.13 0.00 -0.40 0.00 0.00 41.96 38.05 3hs5 s TYR 475 CO 0.40 -0.57 1.15 0.25 -1.57 0.00 0.00 175.55 175.21 3hs5 n THR 476 N 2.01 0.00 -3.52 -0.71 -2.24 -1.26 -4.81 114.28 103.75 3hs5 n THR 476 Ca 0.02 -0.06 -0.09 0.00 -2.27 0.00 0.00 64.05 61.64 3hs5 n THR 476 Cb 0.46 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.44 3hs5 n THR 476 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3hs5 s SER 477 N -2.85 -0.43 0.23 3.42 1.04 -1.26 -4.94 113.70 108.92 3hs5 s SER 477 Ca 0.13 -0.10 -0.04 0.00 0.48 0.00 0.00 55.95 56.42 3hs5 s SER 477 Cb 0.17 0.53 0.25 0.00 0.10 0.00 0.00 66.02 67.07 3hs5 s SER 477 CO 0.73 -0.88 1.72 -0.26 0.98 0.00 0.00 173.24 175.53 3hs5 h PHE 478 N 2.00 0.94 -0.80 5.02 0.04 -1.93 -2.69 116.94 119.51 3hs5 h PHE 478 Ca -0.27 -0.15 0.03 0.00 2.80 0.00 0.00 57.97 60.38 3hs5 h PHE 478 Cb 1.27 -0.25 -0.04 0.00 2.20 0.00 0.00 35.95 39.13 3hs5 h PHE 478 CO 0.27 0.86 0.53 0.93 -0.60 0.00 0.00 178.31 180.30 3hs5 h GLU 479 N 0.80 0.97 -0.45 1.51 5.08 -1.87 -1.47 114.58 119.16 3hs5 h GLU 479 Ca 0.15 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.35 3hs5 h GLU 479 Cb 0.51 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 3hs5 h GLU 479 CO 0.03 0.64 -0.14 1.49 -1.00 0.00 0.00 179.01 180.03 3hs5 h GLU 480 N 1.00 0.84 0.13 2.33 4.81 -1.82 0.10 114.58 121.98 3hs5 h GLU 480 Ca 0.31 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3hs5 h GLU 480 Cb 0.01 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.33 3hs5 h GLU 480 CO -0.09 0.93 -0.06 1.25 -0.73 0.00 0.00 179.01 180.31 3hs5 h LEU 481 N 0.75 -0.15 0.00 1.64 5.85 -1.08 -3.33 115.31 118.99 3hs5 h LEU 481 Ca 0.12 -0.05 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 3hs5 h LEU 481 Cb 0.66 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 3hs5 h LEU 481 CO 0.05 -0.05 -1.20 0.71 -0.34 0.00 0.00 178.44 177.61 3hs5 h THR 482 N -0.24 0.45 -0.21 1.05 1.35 -1.27 0.13 112.91 114.17 3hs5 h THR 482 Ca -0.02 -1.83 -0.09 0.00 -0.55 0.00 0.00 66.41 63.92 3hs5 h THR 482 Cb 0.19 1.99 -0.04 0.00 -1.73 0.00 0.00 68.15 68.56 3hs5 h THR 482 CO 0.03 0.25 -0.08 0.61 -0.25 0.00 0.00 175.52 176.08 3hs5 n GLY 483 N 1.33 0.68 1.27 5.82 0.00 0.35 -3.67 105.19 110.98 3hs5 n GLY 483 Ca -0.06 -0.33 -0.07 0.00 0.00 0.00 0.00 46.02 45.56 3hs5 n GLY 483 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3hs5 n GLU 484 N -2.05 0.21 -0.07 1.61 -0.00 -1.25 -5.07 120.64 114.02 3hs5 n GLU 484 Ca -0.05 -1.21 -0.09 0.00 -0.00 0.00 0.00 57.16 55.81 3hs5 n GLU 484 Cb 0.25 1.06 -0.07 0.00 -0.00 0.00 0.00 31.44 32.67 3hs5 n GLU 484 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3hs5 n LYS 485 N -0.24 0.74 0.03 3.44 5.02 -1.26 -4.51 118.16 121.38 3hs5 n LYS 485 Ca 0.02 0.07 -0.12 0.00 -2.02 0.00 0.00 58.31 56.25 3hs5 n LYS 485 Cb 0.23 -1.30 -0.09 0.00 -0.02 0.00 0.00 35.03 33.85 3hs5 n LYS 485 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 3hs5 h GLU 486 N 0.00 -0.13 -0.58 1.97 4.81 -1.99 -1.77 114.58 116.89 3hs5 h GLU 486 Ca -0.33 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 58.81 3hs5 h GLU 486 Cb 1.57 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.95 3hs5 h GLU 486 CO -0.04 0.34 -0.00 0.52 -0.73 0.00 0.00 179.01 179.10 3hs5 h MET 487 N -0.70 1.00 -0.48 1.92 2.86 -1.96 -2.67 114.93 114.90 3hs5 h MET 487 Ca -0.01 -0.31 0.06 0.00 -2.06 0.00 0.00 59.70 57.37 3hs5 h MET 487 Cb 0.54 -0.10 -0.05 0.00 0.06 0.00 0.00 31.60 32.05 3hs5 h MET 487 CO 0.02 0.99 0.19 0.00 1.06 0.00 0.00 176.91 179.18 3hs5 h ALA 488 N 1.06 0.60 -0.84 6.32 0.00 -1.78 -0.71 119.26 123.90 3hs5 h ALA 488 Ca 0.17 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 3hs5 h ALA 488 Cb 0.54 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3hs5 h ALA 488 CO 0.03 -0.19 0.46 0.00 0.00 0.00 0.00 179.25 179.55 3hs5 h ALA 489 N 1.30 1.22 -0.55 0.00 0.00 -1.17 0.28 119.26 120.34 3hs5 h ALA 489 Ca 0.23 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3hs5 h ALA 489 Cb 0.21 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3hs5 h ALA 489 CO -0.21 0.63 0.31 0.93 0.00 0.00 0.00 179.25 180.91 3hs5 h GLU 490 N 1.18 0.77 -0.21 0.00 4.39 -1.04 -2.28 114.58 117.39 3hs5 h GLU 490 Ca 0.30 -0.09 -0.15 0.00 0.34 0.00 0.00 59.36 59.76 3hs5 h GLU 490 Cb 0.03 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 3hs5 h GLU 490 CO -0.05 0.58 -0.50 -0.07 -1.16 0.00 0.00 179.01 177.81 3hs5 h LEU 491 N 0.74 0.63 -0.72 1.33 3.38 -0.64 -1.67 115.31 118.37 3hs5 h LEU 491 Ca 0.20 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3hs5 h LEU 491 Cb 0.03 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3hs5 h LEU 491 CO -0.03 1.02 0.40 0.50 0.09 0.00 0.00 178.44 180.42 3hs5 h LYS 492 N 0.45 0.99 -0.20 1.13 1.63 -0.90 0.35 116.57 120.02 3hs5 h LYS 492 Ca 0.02 -0.11 -0.09 0.00 -0.85 0.00 0.00 60.65 59.62 3hs5 h LYS 492 Cb 1.04 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 32.45 3hs5 h LYS 492 CO 0.10 0.73 -0.25 0.00 -3.45 0.00 0.00 179.45 176.57 3hs5 h ALA 493 N 1.21 1.19 0.20 5.00 0.00 -1.21 -0.15 119.26 125.49 3hs5 h ALA 493 Ca 0.25 -0.33 -0.30 0.00 0.00 0.00 0.00 54.91 54.54 3hs5 h ALA 493 Cb 0.02 -0.11 0.03 0.00 0.00 0.00 0.00 17.79 17.72 3hs5 h ALA 493 CO -0.04 0.52 -1.35 -0.07 0.00 0.00 0.00 179.25 178.32 3hs5 h LEU 494 N 0.34 0.67 0.00 0.00 3.38 -0.74 -3.41 115.31 115.56 3hs5 h LEU 494 Ca 0.05 -0.93 -0.02 0.00 0.09 0.00 0.00 57.88 57.07 3hs5 h LEU 494 Cb 0.63 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3hs5 h LEU 494 CO 0.05 1.64 -1.73 -1.22 0.09 0.00 0.00 178.44 177.26 3hs5 n TYR 495 N -3.83 0.00 0.00 1.13 4.01 0.12 -4.26 117.16 114.33 3hs5 n TYR 495 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 3hs5 n TYR 495 Cb 1.01 -0.38 0.00 0.00 -0.31 0.00 0.00 39.34 39.66 3hs5 n TYR 495 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3hs5 n SER 496 N -2.08 0.00 -4.25 7.72 7.64 -0.07 -4.74 113.62 117.85 3hs5 n SER 496 Ca -0.04 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.51 3hs5 n SER 496 Cb 0.45 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.49 3hs5 n SER 496 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3hs5 s ASP 497 N 0.00 3.34 0.56 6.43 -1.08 -1.26 -4.96 116.67 119.70 3hs5 s ASP 497 Ca 0.00 -0.51 0.26 0.00 -0.52 0.00 0.00 52.55 51.78 3hs5 s ASP 497 Cb 0.00 -1.47 1.52 0.00 -1.46 0.00 0.00 42.92 41.51 3hs5 s ASP 497 CO 0.00 0.14 2.06 -0.29 0.52 0.00 0.00 175.17 177.60 3hs5 h ILE 498 N 5.66 0.60 0.00 4.11 6.09 -1.92 -2.02 117.51 130.03 3hs5 h ILE 498 Ca -0.24 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.25 3hs5 h ILE 498 Cb 1.22 0.81 0.00 0.00 0.47 0.00 0.00 36.82 39.33 3hs5 h ILE 498 CO 0.51 0.00 0.00 0.47 -3.07 0.00 0.00 178.15 176.06 3hs5 n ASP 499 N -4.05 0.00 -0.39 2.19 8.00 -1.26 -2.48 116.55 118.56 3hs5 n ASP 499 Ca 0.04 -0.13 0.04 0.00 0.71 0.00 0.00 54.79 55.44 3hs5 n ASP 499 Cb 0.40 -0.26 0.10 0.00 -0.02 0.00 0.00 41.12 41.33 3hs5 n ASP 499 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3hs5 n VAL 500 N -1.26 1.04 -1.88 2.53 0.24 -0.76 -4.75 118.33 113.49 3hs5 n VAL 500 Ca 0.13 -1.04 -0.41 0.00 -2.04 0.00 0.00 64.34 60.97 3hs5 n VAL 500 Cb 0.19 0.47 -0.02 0.00 -1.47 0.00 0.00 33.84 33.02 3hs5 n VAL 500 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 3hs5 s MET 501 N -1.07 4.18 0.44 7.34 0.00 -1.03 -4.87 119.30 124.29 3hs5 s MET 501 Ca 0.15 2.46 -0.16 0.00 0.00 0.00 0.00 55.69 58.13 3hs5 s MET 501 Cb 0.08 -3.05 -0.09 0.00 0.00 0.00 0.00 34.83 31.77 3hs5 s MET 501 CO 0.09 -0.52 0.90 -1.21 0.00 0.00 0.00 175.02 174.28 3hs5 s GLU 502 N -0.68 4.00 0.04 4.11 2.02 -1.26 -0.33 118.70 126.61 3hs5 s GLU 502 Ca 0.60 0.87 -0.25 0.00 0.02 0.00 0.00 54.97 56.20 3hs5 s GLU 502 Cb -0.45 -2.24 -0.17 0.00 0.10 0.00 0.00 34.13 31.37 3hs5 s GLU 502 CO 0.48 -0.09 1.50 1.25 0.02 0.00 0.00 175.26 178.42 3hs5 h LEU 503 N 1.47 -0.18 0.33 1.80 5.85 -1.86 -2.89 115.31 119.84 3hs5 h LEU 503 Ca -0.48 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.08 3hs5 h LEU 503 Cb 1.18 0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.26 3hs5 h LEU 503 CO 0.62 0.05 -0.16 0.22 -0.34 0.00 0.00 178.44 178.83 3hs5 h TYR 504 N -0.40 -0.41 -0.26 1.25 3.20 -1.94 -1.79 116.97 116.61 3hs5 h TYR 504 Ca -0.02 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.82 3hs5 h TYR 504 Cb 0.32 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 3hs5 h TYR 504 CO -0.01 -0.13 0.10 -1.00 -1.64 0.00 0.00 178.16 175.48 3hs5 h PRO 505 N -0.66 0.36 -0.89 1.82 0.13 -1.97 -2.46 132.00 128.32 3hs5 h PRO 505 Ca -0.05 -0.04 0.02 0.00 -0.87 0.00 0.00 66.00 65.06 3hs5 h PRO 505 Cb 0.47 -0.07 -0.05 0.00 0.13 0.00 0.00 31.00 31.48 3hs5 h PRO 505 CO 0.08 0.31 0.58 0.00 -0.23 0.00 0.00 178.00 178.73 3hs5 h ALA 506 N 1.75 1.15 -0.28 -0.56 0.00 -1.26 -2.33 119.26 117.73 3hs5 h ALA 506 Ca 0.09 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3hs5 h ALA 506 Cb 0.08 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3hs5 h ALA 506 CO -0.01 0.49 0.08 -0.07 0.00 0.00 0.00 179.25 179.73 3hs5 h LEU 507 N 1.17 0.36 0.00 0.00 3.38 -0.84 0.07 115.31 119.45 3hs5 h LEU 507 Ca 0.34 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.27 3hs5 h LEU 507 Cb -0.08 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.58 3hs5 h LEU 507 CO -0.09 0.37 -0.42 -0.07 0.09 0.00 0.00 178.44 178.32 3hs5 h LEU 508 N 0.40 0.00 -0.52 1.67 3.38 -1.35 -3.32 115.31 115.56 3hs5 h LEU 508 Ca 0.10 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3hs5 h LEU 508 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3hs5 h LEU 508 CO -0.00 0.04 -0.33 1.33 0.09 0.00 0.00 178.44 179.57 3hs5 n VAL 509 N -2.40 0.00 -1.84 1.22 0.24 -0.92 0.35 118.33 114.98 3hs5 n VAL 509 Ca 0.03 -0.34 -0.40 0.00 -2.04 0.00 0.00 64.34 61.59 3hs5 n VAL 509 Cb 0.47 1.09 0.01 0.00 -1.47 0.00 0.00 33.84 33.93 3hs5 n VAL 509 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3hs5 s GLU 510 N -1.65 3.91 -0.19 7.34 2.12 -0.01 -4.20 118.70 126.01 3hs5 s GLU 510 Ca 0.08 2.44 -0.34 0.00 0.36 0.00 0.00 54.97 57.51 3hs5 s GLU 510 Cb 0.09 -2.81 -0.11 0.00 0.26 0.00 0.00 34.13 31.56 3hs5 s GLU 510 CO 0.34 -0.64 2.00 1.17 -0.54 0.00 0.00 175.26 177.58 3hs5 n LYS 511 N 0.14 1.76 -1.88 4.30 4.81 0.46 -1.52 118.16 126.23 3hs5 n LYS 511 Ca 0.03 0.59 -0.33 0.00 -0.87 0.00 0.00 58.31 57.74 3hs5 n LYS 511 Cb 0.41 -2.62 0.03 0.00 0.02 0.00 0.00 35.03 32.87 3hs5 n LYS 511 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 3hs5 s PRO 512 N 4.91 3.06 0.93 1.64 0.02 -1.26 -4.27 135.00 140.02 3hs5 s PRO 512 Ca 0.99 1.27 -0.10 0.00 0.02 0.00 0.00 61.00 63.17 3hs5 s PRO 512 Cb -0.73 -1.99 0.14 0.00 0.02 0.00 0.00 34.50 31.94 3hs5 s PRO 512 CO 0.50 -1.03 1.06 0.54 -0.33 0.00 0.00 177.00 177.75 3hs5 n ARG 513 N -2.28 -0.47 -1.65 5.54 3.00 -0.66 -4.81 116.66 115.32 3hs5 n ARG 513 Ca 0.09 -0.07 -0.46 0.00 -0.01 0.00 0.00 57.85 57.40 3hs5 n ARG 513 Cb 0.52 -2.32 -0.04 0.00 0.00 0.00 0.00 32.46 30.63 3hs5 n ARG 513 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 3hs5 n PRO 514 N -3.97 2.35 -2.00 5.56 -0.02 -1.26 -0.92 135.00 134.73 3hs5 n PRO 514 Ca 0.11 0.84 -0.19 0.00 -2.02 0.00 0.00 63.50 62.24 3hs5 n PRO 514 Cb 0.52 -2.83 -0.04 0.00 -0.02 0.00 0.00 33.50 31.13 3hs5 n PRO 514 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3hs5 n ASP 515 N 7.67 -5.30 -4.84 2.55 8.00 -1.26 -4.98 116.55 118.39 3hs5 n ASP 515 Ca 0.23 0.24 -0.22 0.00 0.71 0.00 0.00 54.79 55.76 3hs5 n ASP 515 Cb 0.35 -4.56 -0.04 0.00 -0.02 0.00 0.00 41.12 36.85 3hs5 n ASP 515 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hs5 s ALA 516 N -2.80 3.67 0.13 2.24 0.00 -0.10 -3.78 121.76 121.12 3hs5 s ALA 516 Ca 0.00 -1.45 0.11 0.00 0.00 0.00 0.00 51.96 50.62 3hs5 s ALA 516 Cb 0.00 -1.31 0.13 0.00 0.00 0.00 0.00 23.12 21.93 3hs5 s ALA 516 CO 0.00 0.20 1.47 0.97 0.00 0.00 0.00 175.76 178.40 3hs5 h ILE 517 N 1.42 1.39 -3.02 0.00 2.10 -1.90 -3.42 117.51 114.06 3hs5 h ILE 517 Ca -0.48 -2.58 -0.55 0.00 1.08 0.00 0.00 64.86 62.33 3hs5 h ILE 517 Cb 1.24 2.44 -0.17 0.00 -1.09 0.00 0.00 36.82 39.25 3hs5 h ILE 517 CO 0.60 0.71 -0.78 -0.36 -1.08 0.00 0.00 178.15 177.24 3hs5 s PHE 518 N -3.14 1.96 0.78 2.19 2.99 -1.26 -1.02 117.98 120.47 3hs5 s PHE 518 Ca 0.01 -0.45 -0.03 0.00 0.00 0.00 0.00 56.93 56.47 3hs5 s PHE 518 Cb 0.11 -0.94 0.15 0.00 0.00 0.00 0.00 43.02 42.34 3hs5 s PHE 518 CO 0.77 0.43 1.06 0.20 -0.00 0.00 0.00 175.22 177.69 3hs5 s GLY 519 N -2.92 1.76 0.20 4.36 0.00 -1.26 -1.66 107.32 107.80 3hs5 s GLY 519 Ca 0.20 -1.77 -0.10 0.00 0.00 0.00 0.00 44.72 43.05 3hs5 s GLY 519 CO 0.09 -1.13 1.80 -2.09 0.00 0.00 0.00 173.10 171.77 3hs5 h GLU 520 N -0.75 0.61 -0.64 2.90 4.81 -1.94 -3.02 114.58 116.56 3hs5 h GLU 520 Ca -0.36 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 58.80 3hs5 h GLU 520 Cb 1.26 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.47 3hs5 h GLU 520 CO 0.37 0.41 0.26 1.15 -0.73 0.00 0.00 179.01 180.47 3hs5 h THR 521 N 0.63 1.23 -0.17 0.32 2.02 -1.96 -0.44 112.91 114.54 3hs5 h THR 521 Ca 0.28 -0.72 0.02 0.00 0.77 0.00 0.00 66.41 66.76 3hs5 h THR 521 Cb 0.17 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 3hs5 h THR 521 CO -0.18 0.28 0.06 -0.03 0.37 0.00 0.00 175.52 176.03 3hs5 h MET 522 N 0.89 0.14 -0.18 6.66 1.85 -1.90 -1.82 114.93 120.56 3hs5 h MET 522 Ca 0.21 -0.01 -0.04 0.00 -0.61 0.00 0.00 59.70 59.25 3hs5 h MET 522 Cb 0.19 -0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.19 3hs5 h MET 522 CO -0.02 0.09 -0.04 0.28 -0.40 0.00 0.00 176.91 176.82 3hs5 h VAL 523 N 0.14 1.28 0.00 -5.77 2.07 -1.46 0.11 116.25 112.62 3hs5 h VAL 523 Ca 0.07 -1.00 -0.05 0.00 0.82 0.00 0.00 66.70 66.54 3hs5 h VAL 523 Cb 0.05 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 3hs5 h VAL 523 CO -0.08 0.30 -0.22 -0.33 0.02 0.00 0.00 177.57 177.26 3hs5 h GLU 524 N 0.07 0.00 0.10 1.57 4.39 -1.01 -0.64 114.58 119.06 3hs5 h GLU 524 Ca 0.05 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.42 3hs5 h GLU 524 Cb 0.48 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.11 3hs5 h GLU 524 CO 0.02 0.22 -1.75 -0.07 -1.16 0.00 0.00 179.01 176.27 3hs5 h LEU 525 N 0.00 0.32 -0.46 1.33 4.07 -1.35 -3.41 115.31 115.81 3hs5 h LEU 525 Ca -0.00 -0.84 -0.05 0.00 0.08 0.00 0.00 57.88 57.07 3hs5 h LEU 525 Cb 0.76 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 42.37 3hs5 h LEU 525 CO 0.03 1.75 0.08 1.23 -1.08 0.00 0.00 178.44 180.44 3hs5 h GLY 526 N 0.46 0.82 0.98 0.83 0.00 -0.61 -3.29 103.07 102.26 3hs5 h GLY 526 Ca -0.39 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 46.36 3hs5 h GLY 526 CO 0.02 0.51 0.22 0.00 0.00 0.00 0.00 176.54 177.28 3hs5 h ALA 527 N 0.96 0.72 -0.57 3.60 0.00 -1.33 -1.50 119.26 121.14 3hs5 h ALA 527 Ca 0.14 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3hs5 h ALA 527 Cb 0.38 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3hs5 h ALA 527 CO 0.01 0.33 0.03 -1.35 0.00 0.00 0.00 179.25 178.27 3hs5 h PRO 528 N 0.75 0.95 -0.65 0.00 0.11 -1.79 -1.41 132.00 129.97 3hs5 h PRO 528 Ca 0.18 -0.27 -0.07 0.00 0.11 0.00 0.00 66.00 65.95 3hs5 h PRO 528 Cb 0.21 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.19 3hs5 h PRO 528 CO -0.01 0.93 0.14 0.74 -0.21 0.00 0.00 178.00 179.58 3hs5 h PHE 529 N 0.88 1.09 0.49 0.65 0.04 -1.60 -2.87 116.94 115.64 3hs5 h PHE 529 Ca 0.17 -0.13 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 3hs5 h PHE 529 Cb 0.48 -0.31 0.00 0.00 2.20 0.00 0.00 35.95 38.33 3hs5 h PHE 529 CO 0.03 0.90 -0.24 0.77 -0.60 0.00 0.00 178.31 179.18 3hs5 h SER 530 N 0.99 -0.56 0.34 2.17 0.02 -1.03 -2.29 113.55 113.19 3hs5 h SER 530 Ca 0.20 -0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 61.02 3hs5 h SER 530 Cb 0.38 0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 3hs5 h SER 530 CO 0.00 -0.23 -0.30 -0.07 -1.14 0.00 0.00 176.83 175.09 3hs5 h LEU 531 N -0.91 0.00 -0.36 5.07 3.38 -1.34 -1.08 115.31 120.07 3hs5 h LEU 531 Ca -0.07 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3hs5 h LEU 531 Cb 0.60 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3hs5 h LEU 531 CO 0.11 0.30 0.10 0.50 0.09 0.00 0.00 178.44 179.55 3hs5 h LYS 532 N 0.00 0.56 0.00 1.13 1.63 -1.52 0.88 116.57 119.25 3hs5 h LYS 532 Ca -0.00 -0.13 -0.08 0.00 -0.85 0.00 0.00 60.65 59.59 3hs5 h LYS 532 Cb 0.55 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.09 3hs5 h LYS 532 CO 0.04 0.59 -0.38 0.78 -3.45 0.00 0.00 179.45 177.03 3hs5 h GLY 533 N 0.43 0.00 0.00 5.01 0.00 -0.76 -0.23 103.07 107.51 3hs5 h GLY 533 Ca 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.40 3hs5 h GLY 533 CO -0.00 0.00 -0.32 1.41 0.00 0.00 0.00 176.54 177.63 3hs5 h LEU 534 N 0.00 0.00 -0.14 3.11 3.38 -1.05 -3.35 115.31 117.25 3hs5 h LEU 534 Ca -0.00 -0.42 -0.08 0.00 0.09 0.00 0.00 57.88 57.47 3hs5 h LEU 534 Cb 0.70 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 3hs5 h LEU 534 CO 0.05 0.89 -0.36 0.24 0.09 0.00 0.00 178.44 179.35 3hs5 h MET 535 N -1.00 0.00 0.00 1.13 2.86 -0.94 -3.20 114.93 113.78 3hs5 h MET 535 Ca -0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 3hs5 h MET 535 Cb 0.66 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.32 3hs5 h MET 535 CO -0.04 0.36 0.00 0.78 1.06 0.00 0.00 176.91 179.07 3hs5 h GLY 536 N 3.42 0.00 -4.15 8.32 0.00 -1.15 -3.43 103.07 106.08 3hs5 h GLY 536 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.77 3hs5 h GLY 536 CO 0.05 0.00 0.69 -2.01 0.00 0.00 0.00 176.54 175.27 3hs5 n ASN 537 N -2.45 3.38 0.17 0.19 2.85 -1.21 -2.66 115.26 115.53 3hs5 n ASN 537 Ca 0.01 1.20 0.16 0.00 -0.11 0.00 0.00 54.58 55.84 3hs5 n ASN 537 Cb 0.23 -1.56 0.76 0.00 1.24 0.00 0.00 39.78 40.45 3hs5 n ASN 537 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3hs5 h PRO 538 N 3.23 0.00 0.00 1.20 0.13 -1.88 -1.14 132.00 133.54 3hs5 h PRO 538 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3hs5 h PRO 538 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3hs5 h PRO 538 CO 0.67 0.00 0.00 -0.84 -0.23 0.00 0.00 178.00 177.60 3hs5 h ILE 539 N 0.00 0.00 0.00 -3.56 3.07 -1.94 -1.96 117.51 113.12 3hs5 h ILE 539 Ca 0.11 -0.23 0.00 0.00 1.55 0.00 0.00 64.86 66.28 3hs5 h ILE 539 Cb 0.50 1.06 0.00 0.00 -0.27 0.00 0.00 36.82 38.11 3hs5 h ILE 539 CO -0.00 0.00 -0.39 0.00 -1.05 0.00 0.00 178.15 176.71 3hs5 s SER 541 N -3.94 5.33 0.41 0.00 1.04 -0.74 -4.76 113.70 111.05 3hs5 s SER 541 Ca 0.09 2.11 0.12 0.00 0.48 0.00 0.00 55.95 58.75 3hs5 s SER 541 Cb 0.15 -2.57 0.95 0.00 0.10 0.00 0.00 66.02 64.65 3hs5 s SER 541 CO 0.67 -1.48 1.98 1.55 0.98 0.00 0.00 173.24 176.93 3hs5 h PRO 542 N 0.56 0.49 0.00 4.02 0.13 -1.91 -0.32 132.00 134.96 3hs5 h PRO 542 Ca -0.48 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3hs5 h PRO 542 Cb 1.26 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3hs5 h PRO 542 CO 0.55 0.32 0.00 1.96 -0.23 0.00 0.00 178.00 180.60 3hs5 h GLN 543 N 0.50 0.00 0.01 0.86 1.08 -1.92 -3.22 115.11 112.42 3hs5 h GLN 543 Ca 0.28 0.00 -0.36 0.00 -1.45 0.00 0.00 58.65 57.12 3hs5 h GLN 543 Cb 0.45 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.82 3hs5 h GLN 543 CO -0.09 0.00 -2.29 0.66 -0.95 0.00 0.00 178.83 176.17 3hs5 n TYR 544 N -2.57 0.21 -2.17 2.96 4.02 -0.69 -4.77 117.16 114.15 3hs5 n TYR 544 Ca 0.04 0.07 -0.43 0.00 -0.01 0.00 0.00 57.90 57.57 3hs5 n TYR 544 Cb 0.39 -1.04 0.00 0.00 -0.02 0.00 0.00 39.34 38.68 3hs5 n TYR 544 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 176.86 177.72 3hs5 n TRP 545 N -2.93 4.08 -3.77 -0.72 -0.00 -0.22 -4.61 117.44 109.27 3hs5 n TRP 545 Ca -0.33 -2.92 -0.13 0.00 -0.00 0.00 0.00 57.50 54.12 3hs5 n TRP 545 Cb 1.11 -2.57 -0.09 0.00 -0.00 0.00 0.00 31.31 29.75 3hs5 n TRP 545 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 3hs5 s LYS 546 N 3.56 0.56 0.36 5.87 1.02 -1.26 -4.96 119.74 124.90 3hs5 s LYS 546 Ca 0.50 -0.01 0.08 0.00 0.02 0.00 0.00 55.97 56.56 3hs5 s LYS 546 Cb 0.09 0.25 0.79 0.00 -0.52 0.00 0.00 37.83 38.44 3hs5 s LYS 546 CO -0.01 -0.14 1.91 -1.35 -0.92 0.00 0.00 175.35 174.85 3hs5 h PRO 547 N 4.45 0.69 0.00 -1.68 0.11 -1.87 -2.51 132.00 131.19 3hs5 h PRO 547 Ca -0.29 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 3hs5 h PRO 547 Cb 1.18 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 3hs5 h PRO 547 CO 0.37 0.46 -0.25 0.66 -0.21 0.00 0.00 178.00 179.03 3hs5 h SER 548 N 0.71 0.00 -0.28 -2.05 4.64 -1.93 0.74 113.55 115.39 3hs5 h SER 548 Ca 0.38 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.78 3hs5 h SER 548 Cb 0.51 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 3hs5 h SER 548 CO -0.15 0.25 0.21 0.74 -0.87 0.00 0.00 176.83 177.01 3hs5 h THR 549 N 0.00 0.81 -0.17 2.95 2.02 -1.70 -2.83 112.91 113.98 3hs5 h THR 549 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3hs5 h THR 549 Cb 0.53 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 67.79 3hs5 h THR 549 CO 0.03 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.41 3hs5 n PHE 550 N -4.37 0.60 -0.74 3.16 3.72 -0.77 -4.91 117.46 114.14 3hs5 n PHE 550 Ca 0.04 -0.89 0.00 0.00 -0.05 0.00 0.00 57.45 56.54 3hs5 n PHE 550 Cb 0.37 -0.24 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 3hs5 n PHE 550 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hs5 n GLY 551 N -0.77 0.56 0.00 1.37 0.00 -1.07 -4.00 105.19 101.28 3hs5 n GLY 551 Ca 0.19 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.56 3hs5 n GLY 551 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hs5 n GLY 552 N -2.74 -1.22 0.24 -0.02 0.00 0.18 -4.68 105.19 96.95 3hs5 n GLY 552 Ca 0.00 -2.18 0.04 0.00 0.00 0.00 0.00 46.02 43.88 3hs5 n GLY 552 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hs5 h GLU 553 N 3.91 0.15 -0.04 1.61 4.57 -1.91 -2.22 114.58 120.65 3hs5 h GLU 553 Ca 0.00 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 3hs5 h GLU 553 Cb 0.00 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.57 3hs5 h GLU 553 CO 0.00 0.27 -0.01 0.28 -1.18 0.00 0.00 179.01 178.37 3hs5 h VAL 554 N 0.15 1.31 -0.87 0.32 2.07 -1.91 -0.99 116.25 116.33 3hs5 h VAL 554 Ca 0.03 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 3hs5 h VAL 554 Cb 0.30 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.89 3hs5 h VAL 554 CO 0.02 0.25 0.48 1.23 0.02 0.00 0.00 177.57 179.56 3hs5 h GLY 555 N -0.30 1.30 1.01 2.17 0.00 -1.65 -2.25 103.07 103.35 3hs5 h GLY 555 Ca 0.01 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 46.73 3hs5 h GLY 555 CO 0.00 0.57 0.39 -2.75 0.00 0.00 0.00 176.54 174.75 3hs5 h PHE 556 N 1.22 1.01 0.00 5.60 3.57 -1.38 -2.91 116.94 124.03 3hs5 h PHE 556 Ca 0.31 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.70 3hs5 h PHE 556 Cb 0.03 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 3hs5 h PHE 556 CO 0.01 0.72 -0.35 -0.22 -2.23 0.00 0.00 178.31 176.24 3hs5 h LYS 557 N 1.00 0.00 -0.32 1.11 3.64 -0.71 -2.68 116.57 118.61 3hs5 h LYS 557 Ca 0.25 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.66 3hs5 h LYS 557 Cb 0.06 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 3hs5 h LYS 557 CO -0.04 0.35 0.13 0.82 -2.27 0.00 0.00 179.45 178.44 3hs5 h ILE 558 N 0.00 0.94 -0.02 2.00 2.04 -1.22 -1.75 117.51 119.50 3hs5 h ILE 558 Ca -0.00 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 65.77 3hs5 h ILE 558 Cb 0.62 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 3hs5 h ILE 558 CO 0.05 0.05 -0.06 0.40 0.00 0.00 0.00 178.15 178.59 3hs5 h ILE 559 N 0.28 0.85 0.00 -0.67 2.04 -1.51 -2.75 117.51 115.76 3hs5 h ILE 559 Ca 0.14 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.00 3hs5 h ILE 559 Cb 0.09 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 3hs5 h ILE 559 CO -0.13 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.61 3hs5 n ASN 560 N -5.17 0.00 0.00 1.72 5.03 -1.03 -2.62 115.26 113.19 3hs5 n ASN 560 Ca -0.06 -0.48 0.00 0.00 0.87 0.00 0.00 54.58 54.92 3hs5 n ASN 560 Cb 0.10 -0.14 0.00 0.00 -1.02 0.00 0.00 39.78 38.72 3hs5 n ASN 560 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 3hs5 n THR 561 N -1.14 0.68 -2.32 3.41 -2.24 -0.69 -5.07 114.28 106.92 3hs5 n THR 561 Ca 0.17 -0.69 -0.38 0.00 -2.27 0.00 0.00 64.05 60.88 3hs5 n THR 561 Cb 0.15 0.68 -0.02 0.00 -2.10 0.00 0.00 70.33 69.04 3hs5 n THR 561 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hs5 s ALA 562 N -0.68 3.08 0.14 6.98 0.00 -1.04 -4.95 121.76 125.29 3hs5 s ALA 562 Ca 0.00 0.92 -0.14 0.00 0.00 0.00 0.00 51.96 52.74 3hs5 s ALA 562 Cb 0.00 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.77 3hs5 s ALA 562 CO 0.00 -0.53 0.38 -1.54 0.00 0.00 0.00 175.76 174.06 3hs5 s SER 563 N -1.28 -0.14 0.33 0.00 1.04 -1.26 -4.55 113.70 107.84 3hs5 s SER 563 Ca 0.59 -0.49 0.04 0.00 0.48 0.00 0.00 55.95 56.57 3hs5 s SER 563 Cb -0.29 0.47 0.65 0.00 0.10 0.00 0.00 66.02 66.95 3hs5 s SER 563 CO 0.36 -0.88 1.90 -0.29 0.98 0.00 0.00 173.24 175.31 3hs5 h ILE 564 N 2.42 0.98 -0.28 -1.02 6.09 -1.96 -1.16 117.51 122.57 3hs5 h ILE 564 Ca -0.32 -0.30 -0.07 0.00 -1.37 0.00 0.00 64.86 62.79 3hs5 h ILE 564 Cb 1.24 0.03 -0.01 0.00 0.47 0.00 0.00 36.82 38.55 3hs5 h ILE 564 CO 0.46 0.16 -0.10 -0.61 -3.07 0.00 0.00 178.15 174.99 3hs5 h GLN 565 N 0.88 0.57 -0.59 2.19 5.75 -1.96 -2.78 115.11 119.16 3hs5 h GLN 565 Ca 0.40 -0.23 -0.06 0.00 -0.15 0.00 0.00 58.65 58.61 3hs5 h GLN 565 Cb 0.37 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 3hs5 h GLN 565 CO -0.16 0.79 0.15 0.66 -2.65 0.00 0.00 178.83 177.62 3hs5 h SER 566 N 0.31 0.89 -0.67 -0.69 4.64 -1.86 0.15 113.55 116.32 3hs5 h SER 566 Ca 0.07 -0.23 0.13 0.00 -0.47 0.00 0.00 61.79 61.29 3hs5 h SER 566 Cb 0.60 -0.23 -0.09 0.00 -0.31 0.00 0.00 62.40 62.36 3hs5 h SER 566 CO 0.03 0.89 0.17 0.25 -0.87 0.00 0.00 176.83 177.30 3hs5 h LEU 567 N 0.85 0.05 -0.05 5.97 5.85 -1.19 -0.16 115.31 126.63 3hs5 h LEU 567 Ca 0.19 0.12 -0.14 0.00 0.84 0.00 0.00 57.88 58.88 3hs5 h LEU 567 Cb 0.34 0.15 0.01 0.00 0.37 0.00 0.00 40.66 41.53 3hs5 h LEU 567 CO 0.00 0.01 -0.53 0.40 -0.34 0.00 0.00 178.44 177.98 3hs5 h ILE 568 N 0.30 1.40 -0.67 4.05 5.03 -1.20 -3.15 117.51 123.26 3hs5 h ILE 568 Ca 0.36 -1.93 -0.01 0.00 -0.12 0.00 0.00 64.86 63.17 3hs5 h ILE 568 Cb 0.56 2.38 -0.03 0.00 -3.03 0.00 0.00 36.82 36.70 3hs5 h ILE 568 CO -0.43 0.57 0.39 0.00 -0.68 0.00 0.00 178.15 177.99 3hs5 h ASN 570 N 0.91 0.00 0.00 0.00 2.35 -1.13 -3.36 115.58 114.35 3hs5 h ASN 570 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3hs5 h ASN 570 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 3hs5 h ASN 570 CO -0.04 0.26 0.00 0.59 -1.65 0.00 0.00 177.43 176.58 3hs5 n ASN 571 N -3.37 0.53 -4.07 5.81 3.02 -1.04 -5.01 115.26 111.12 3hs5 n ASN 571 Ca 0.00 -0.78 -0.29 0.00 -0.03 0.00 0.00 54.58 53.49 3hs5 n ASN 571 Cb 0.47 0.34 -0.17 0.00 -0.61 0.00 0.00 39.78 39.82 3hs5 n ASN 571 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3hs5 s VAL 572 N -0.34 1.56 0.06 2.41 1.01 0.13 -4.95 120.40 120.28 3hs5 s VAL 572 Ca 0.00 -0.68 -0.37 0.00 0.00 0.00 0.00 61.98 60.93 3hs5 s VAL 572 Cb 0.00 -1.41 -0.16 0.00 0.00 0.00 0.00 36.38 34.80 3hs5 s VAL 572 CO 0.00 0.45 1.39 1.17 0.00 0.00 0.00 175.10 178.12 3hs5 n LYS 573 N 4.14 1.24 0.00 2.72 4.81 -1.26 -1.47 118.16 128.33 3hs5 n LYS 573 Ca -0.19 0.45 0.00 0.00 -0.87 0.00 0.00 58.31 57.69 3hs5 n LYS 573 Cb 0.51 -2.10 0.00 0.00 0.02 0.00 0.00 35.03 33.46 3hs5 n LYS 573 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hs5 n GLY 574 N 2.73 1.76 3.61 3.14 0.00 -1.26 -4.43 105.19 110.74 3hs5 n GLY 574 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 3hs5 n GLY 574 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hs5 s PRO 576 N -5.00 2.95 0.37 0.00 0.04 -1.26 -4.92 135.00 127.17 3hs5 s PRO 576 Ca 0.18 1.71 -0.26 0.00 0.04 0.00 0.00 61.00 62.67 3hs5 s PRO 576 Cb -0.07 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.44 3hs5 s PRO 576 CO 0.86 -1.20 1.15 -0.06 0.04 0.00 0.00 177.00 177.79 3hs5 s PHE 577 N -1.79 3.20 0.19 0.56 0.08 -1.26 -4.67 117.98 114.28 3hs5 s PHE 577 Ca 0.74 1.59 -0.14 0.00 0.12 0.00 0.00 56.93 59.24 3hs5 s PHE 577 Cb -0.27 -3.35 0.01 0.00 -0.57 0.00 0.00 43.02 38.84 3hs5 s PHE 577 CO 0.34 -1.10 0.43 -0.08 -0.10 0.00 0.00 175.22 174.71 3hs5 s THR 578 N -1.38 0.04 0.04 0.64 -1.32 -1.26 -4.81 115.64 107.59 3hs5 s THR 578 Ca 0.54 -1.02 -0.22 0.00 -1.21 0.00 0.00 61.69 59.77 3hs5 s THR 578 Cb -0.30 -1.69 0.07 0.00 -1.51 0.00 0.00 72.50 69.07 3hs5 s THR 578 CO 0.39 -0.18 1.03 -1.54 -2.21 0.00 0.00 174.62 172.10 3hs5 n SER 579 N -0.29 -1.17 -0.54 8.08 3.41 -1.26 -4.65 113.62 117.20 3hs5 n SER 579 Ca -0.09 -1.39 0.14 0.00 -0.26 0.00 0.00 58.87 57.27 3hs5 n SER 579 Cb 0.63 1.85 0.46 0.00 -0.26 0.00 0.00 64.21 66.88 3hs5 n SER 579 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3hs5 n PHE 580 N -0.73 0.00 -4.39 7.33 3.72 -1.26 -4.69 117.46 117.44 3hs5 n PHE 580 Ca 0.02 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.15 3hs5 n PHE 580 Cb 0.50 -0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.92 3hs5 n PHE 580 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3hs5 s ASN 581 N -2.01 3.60 0.00 4.37 4.22 -1.26 -1.81 114.94 122.04 3hs5 s ASN 581 Ca 0.36 -0.79 0.00 0.00 -2.14 0.00 0.00 52.86 50.29 3hs5 s ASN 581 Cb 0.21 -0.35 0.00 0.00 1.28 0.00 0.00 41.25 42.39 3hs5 s ASN 581 CO 0.33 0.13 0.00 0.52 -2.04 0.00 0.00 177.10 176.04