#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hy1 s LYS 2 N 0.00 4.51 0.72 4.33 1.02 -1.26 -5.03 119.74 124.03 3hy1 s LYS 2 Ca 0.00 1.94 -0.11 0.00 0.02 0.00 0.00 55.97 57.82 3hy1 s LYS 2 Cb 0.00 -3.18 0.02 0.00 -0.52 0.00 0.00 37.83 34.15 3hy1 s LYS 2 CO 0.00 -0.01 1.07 0.45 -0.92 0.00 0.00 175.35 175.94 3hy1 s SER 3 N -0.36 5.15 0.19 2.83 0.15 -1.26 -4.71 113.70 115.69 3hy1 s SER 3 Ca 0.49 1.54 -0.10 0.00 0.70 0.00 0.00 55.95 58.58 3hy1 s SER 3 Cb -0.34 -2.38 0.12 0.00 -1.71 0.00 0.00 66.02 61.71 3hy1 s SER 3 CO 0.42 -1.58 1.78 0.74 1.20 0.00 0.00 173.24 175.79 3hy1 h THR 4 N -0.81 1.23 -0.41 6.45 2.02 -1.95 -1.21 112.91 118.23 3hy1 h THR 4 Ca -0.45 -0.68 -0.08 0.00 0.77 0.00 0.00 66.41 65.98 3hy1 h THR 4 Cb 1.23 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 3hy1 h THR 4 CO 0.57 0.28 -0.07 0.00 0.37 0.00 0.00 175.52 176.67 3hy1 h ALA 5 N 1.15 1.10 -0.41 6.16 0.00 -1.92 -2.33 119.26 123.03 3hy1 h ALA 5 Ca 0.24 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 3hy1 h ALA 5 Cb 0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3hy1 h ALA 5 CO -0.03 0.56 -0.27 0.93 0.00 0.00 0.00 179.25 180.44 3hy1 h GLU 6 N 0.65 0.91 -0.21 0.00 5.08 -1.86 -2.11 114.58 117.03 3hy1 h GLU 6 Ca 0.12 -0.43 -0.01 0.00 -1.00 0.00 0.00 59.36 58.04 3hy1 h GLU 6 Cb 0.51 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3hy1 h GLU 6 CO 0.03 1.08 0.10 0.82 -1.00 0.00 0.00 179.01 180.04 3hy1 h ILE 7 N 0.73 1.14 -0.92 3.13 2.04 -1.04 0.66 117.51 123.25 3hy1 h ILE 7 Ca 0.08 -0.41 0.06 0.00 1.00 0.00 0.00 64.86 65.59 3hy1 h ILE 7 Cb 0.85 1.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.90 3hy1 h ILE 7 CO 0.07 0.14 0.60 -0.09 0.00 0.00 0.00 178.15 178.87 3hy1 h ARG 8 N 0.20 1.04 -0.18 2.37 2.43 -1.43 0.95 114.38 119.76 3hy1 h ARG 8 Ca 0.07 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 3hy1 h ARG 8 Cb 0.13 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.44 3hy1 h ARG 8 CO -0.01 0.69 -0.18 0.37 -1.51 0.00 0.00 179.97 179.33 3hy1 h GLN 9 N 1.07 0.44 -0.57 0.20 5.75 -0.72 -2.81 115.11 118.47 3hy1 h GLN 9 Ca 0.39 -0.23 -0.01 0.00 -0.15 0.00 0.00 58.65 58.65 3hy1 h GLN 9 Cb 0.15 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 3hy1 h GLN 9 CO -0.14 0.80 0.32 0.00 -2.65 0.00 0.00 178.83 177.16 3hy1 h ALA 10 N 0.63 0.73 -0.24 3.38 0.00 0.83 -0.88 119.26 123.71 3hy1 h ALA 10 Ca 0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3hy1 h ALA 10 Cb 0.72 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3hy1 h ALA 10 CO 0.04 0.24 0.15 0.35 0.00 0.00 0.00 179.25 180.04 3hy1 h PHE 11 N 0.77 0.32 -0.17 0.00 3.57 -0.85 -0.02 116.94 120.55 3hy1 h PHE 11 Ca 0.20 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.57 3hy1 h PHE 11 Cb 0.04 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 3hy1 h PHE 11 CO -0.01 0.23 -0.45 -0.07 -2.23 0.00 0.00 178.31 175.78 3hy1 h LEU 12 N 0.31 0.46 0.00 0.59 3.38 -1.39 -2.86 115.31 115.80 3hy1 h LEU 12 Ca 0.09 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 3hy1 h LEU 12 Cb 0.01 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.63 3hy1 h LEU 12 CO -0.02 0.84 -0.00 0.44 0.09 0.00 0.00 178.44 179.80 3hy1 h ASP 13 N 0.35 -0.01 -0.41 -0.43 5.19 -0.94 -2.14 116.42 118.02 3hy1 h ASP 13 Ca 0.02 -0.34 0.08 0.00 -0.62 0.00 0.00 57.03 56.18 3hy1 h ASP 13 Cb 0.93 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 40.36 3hy1 h ASP 13 CO 0.08 0.34 -0.12 0.15 -3.12 0.00 0.00 179.24 176.56 3hy1 h PHE 14 N -0.35 -0.28 -0.02 4.55 3.57 -0.97 -1.40 116.94 122.04 3hy1 h PHE 14 Ca -0.00 0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.39 3hy1 h PHE 14 Cb 0.34 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 3hy1 h PHE 14 CO 0.04 -0.20 -0.68 0.74 -2.23 0.00 0.00 178.31 175.99 3hy1 h PHE 15 N -0.03 0.14 -0.39 0.41 0.04 -1.55 -2.67 116.94 112.89 3hy1 h PHE 15 Ca 0.20 -0.06 -0.02 0.00 2.80 0.00 0.00 57.97 60.89 3hy1 h PHE 15 Cb 0.33 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 3hy1 h PHE 15 CO -0.38 0.75 0.15 1.25 -0.60 0.00 0.00 178.31 179.48 3hy1 h HIS 16 N 0.07 0.54 0.00 -0.55 2.76 -0.82 -0.58 115.15 116.57 3hy1 h HIS 16 Ca -0.01 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.14 3hy1 h HIS 16 Cb 1.20 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 29.99 3hy1 h HIS 16 CO 0.01 0.43 0.00 -1.13 -1.30 0.00 0.00 177.93 175.94 3hy1 n SER 17 N -4.38 0.05 -1.55 3.26 3.41 -0.58 -1.92 113.62 111.91 3hy1 n SER 17 Ca 0.03 0.51 0.03 0.00 -0.26 0.00 0.00 58.87 59.18 3hy1 n SER 17 Cb 0.14 -0.52 0.32 0.00 -0.26 0.00 0.00 64.21 63.89 3hy1 n SER 17 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3hy1 n LYS 18 N -1.56 3.75 -1.02 4.33 4.76 -0.27 -4.91 118.16 123.24 3hy1 n LYS 18 Ca 0.04 -3.05 0.00 0.00 -2.87 0.00 0.00 58.31 52.43 3hy1 n LYS 18 Cb 0.18 -2.09 0.00 0.00 -1.84 0.00 0.00 35.03 31.28 3hy1 n LYS 18 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hy1 n GLY 19 N -0.07 0.40 3.76 0.72 0.00 -0.81 -5.04 105.19 104.15 3hy1 n GLY 19 Ca 0.30 -1.06 -0.39 0.00 0.00 0.00 0.00 46.02 44.87 3hy1 n GLY 19 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hy1 s HIS 20 N -2.00 3.66 -0.32 1.61 3.76 -0.91 -4.57 115.29 116.52 3hy1 s HIS 20 Ca 0.00 1.12 -0.29 0.00 -0.15 0.00 0.00 55.06 55.74 3hy1 s HIS 20 Cb 0.00 -2.56 0.01 0.00 1.11 0.00 0.00 32.58 31.13 3hy1 s HIS 20 CO 0.00 0.35 1.28 -1.14 -0.85 0.00 0.00 174.74 174.38 3hy1 s GLN 21 N -0.14 3.88 -0.39 1.40 2.00 -0.04 -4.23 119.66 122.14 3hy1 s GLN 21 Ca 0.29 1.16 -0.28 0.00 -2.00 0.00 0.00 55.36 54.53 3hy1 s GLN 21 Cb -0.17 -3.88 -0.01 0.00 0.80 0.00 0.00 33.01 29.74 3hy1 s GLN 21 CO 0.16 -1.16 1.72 0.08 -0.50 0.00 0.00 175.29 175.59 3hy1 s VAL 22 N 4.42 3.55 -0.10 1.34 1.01 -1.26 -1.59 120.40 127.77 3hy1 s VAL 22 Ca 0.55 0.53 -0.02 0.00 0.00 0.00 0.00 61.98 63.04 3hy1 s VAL 22 Cb -0.15 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 3hy1 s VAL 22 CO 0.24 -0.57 -0.01 -0.69 0.00 0.00 0.00 175.10 174.06 3hy1 s VAL 23 N 6.92 4.16 0.60 2.92 1.01 -0.66 -4.96 120.40 130.38 3hy1 s VAL 23 Ca 0.74 -0.29 -0.19 0.00 0.00 0.00 0.00 61.98 62.23 3hy1 s VAL 23 Cb -0.19 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 3hy1 s VAL 23 CO 0.31 0.57 1.16 0.00 0.00 0.00 0.00 175.10 177.14 3hy1 n ALA 24 N 2.56 0.79 -1.76 5.51 0.00 -1.26 -4.47 120.51 121.87 3hy1 n ALA 24 Ca -0.18 0.04 -0.41 0.00 0.00 0.00 0.00 53.44 52.89 3hy1 n ALA 24 Cb 0.53 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.76 3hy1 n ALA 24 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3hy1 n SER 25 N -1.14 3.57 -4.83 0.00 2.88 -1.26 -4.95 113.62 107.88 3hy1 n SER 25 Ca 0.14 1.20 -0.29 0.00 -1.33 0.00 0.00 58.87 58.58 3hy1 n SER 25 Cb 0.47 -1.60 0.10 0.00 -0.75 0.00 0.00 64.21 62.42 3hy1 n SER 25 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3hy1 s SER 26 N -0.24 4.40 0.85 -3.46 1.04 -1.26 -5.00 113.70 110.03 3hy1 s SER 26 Ca 0.56 0.71 -0.11 0.00 0.48 0.00 0.00 55.95 57.58 3hy1 s SER 26 Cb -0.48 -1.17 0.11 0.00 0.10 0.00 0.00 66.02 64.58 3hy1 s SER 26 CO 0.62 -1.96 1.14 -0.55 0.98 0.00 0.00 173.24 173.47 3hy1 s SER 27 N -4.60 3.53 0.45 7.02 0.15 -1.26 -4.71 113.70 114.29 3hy1 s SER 27 Ca 0.63 2.11 0.29 0.00 0.70 0.00 0.00 55.95 59.68 3hy1 s SER 27 Cb -0.10 -2.56 1.06 0.00 -1.71 0.00 0.00 66.02 62.71 3hy1 s SER 27 CO 0.49 -2.69 1.85 -0.07 1.20 0.00 0.00 173.24 174.01 3hy1 h LEU 28 N -1.45 0.00 -9.03 3.45 3.38 -1.90 -3.41 115.31 106.36 3hy1 h LEU 28 Ca -0.44 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 56.92 3hy1 h LEU 28 Cb 1.26 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.90 3hy1 h LEU 28 CO 0.45 0.00 0.05 -0.69 0.09 0.00 0.00 178.44 178.34 3hy1 s VAL 29 N -3.48 5.05 -0.47 1.22 1.01 -1.26 0.41 120.40 122.88 3hy1 s VAL 29 Ca 0.04 1.01 -0.23 0.00 0.00 0.00 0.00 61.98 62.79 3hy1 s VAL 29 Cb 0.08 -3.88 0.03 0.00 0.00 0.00 0.00 36.38 32.62 3hy1 s VAL 29 CO 0.54 0.09 0.78 -2.16 0.00 0.00 0.00 175.10 174.35 3hy1 s PRO 30 N 2.17 3.35 0.26 2.72 0.05 -1.26 -4.89 135.00 137.39 3hy1 s PRO 30 Ca 0.24 -0.24 0.02 0.00 0.05 0.00 0.00 61.00 61.07 3hy1 s PRO 30 Cb -0.16 -3.97 0.35 0.00 0.05 0.00 0.00 34.50 30.77 3hy1 s PRO 30 CO 0.09 -1.18 1.66 0.45 0.05 0.00 0.00 177.00 178.08 3hy1 h HIS 31 N 9.03 0.49 -0.49 0.56 3.86 -1.96 -3.18 115.15 123.47 3hy1 h HIS 31 Ca -0.25 -0.13 0.00 0.00 -1.16 0.00 0.00 60.37 58.83 3hy1 h HIS 31 Cb 1.09 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 29.45 3hy1 h HIS 31 CO 0.80 0.74 0.00 0.09 0.86 0.00 0.00 177.93 180.42 3hy1 n ASN 32 N -4.05 3.26 -3.81 2.45 3.02 -1.26 -4.77 115.26 110.10 3hy1 n ASN 32 Ca -0.01 -1.97 -0.22 0.00 -0.03 0.00 0.00 54.58 52.36 3hy1 n ASN 32 Cb 0.48 -0.32 -0.17 0.00 -0.61 0.00 0.00 39.78 39.16 3hy1 n ASN 32 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hy1 s ASP 33 N -1.27 1.30 0.00 6.41 -1.08 -1.20 -5.00 116.67 115.82 3hy1 s ASP 33 Ca 0.40 -0.09 0.22 0.00 -0.52 0.00 0.00 52.55 52.55 3hy1 s ASP 33 Cb 0.22 -0.43 -0.12 0.00 -1.46 0.00 0.00 42.92 41.13 3hy1 s ASP 33 CO 0.30 -0.14 0.99 -0.81 0.52 0.00 0.00 175.17 176.02 3hy1 n PRO 34 N 4.73 0.44 -0.66 4.34 -0.04 -1.26 -4.02 135.00 138.52 3hy1 n PRO 34 Ca -0.14 -0.36 0.03 0.00 -0.04 0.00 0.00 63.50 62.99 3hy1 n PRO 34 Cb 0.50 -1.49 0.27 0.00 -0.04 0.00 0.00 33.50 32.74 3hy1 n PRO 34 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3hy1 n THR 35 N -0.97 2.00 -4.26 0.52 -2.24 -1.26 -4.85 114.28 103.22 3hy1 n THR 35 Ca 0.06 -1.02 -0.20 0.00 -2.27 0.00 0.00 64.05 60.62 3hy1 n THR 35 Cb 0.38 -0.37 -0.16 0.00 -2.10 0.00 0.00 70.33 68.08 3hy1 n THR 35 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3hy1 s LEU 36 N -1.97 1.52 -0.02 3.22 2.96 -1.26 -5.07 118.68 118.06 3hy1 s LEU 36 Ca 0.38 -0.15 -0.15 0.00 -0.22 0.00 0.00 54.13 53.99 3hy1 s LEU 36 Cb 0.30 -0.49 -0.08 0.00 0.50 0.00 0.00 46.19 46.41 3hy1 s LEU 36 CO 0.11 -0.01 0.69 0.25 -1.32 0.00 0.00 176.35 176.07 3hy1 h LEU 37 N 6.89 -0.46 -8.31 -0.68 5.85 -1.91 -3.45 115.31 113.24 3hy1 h LEU 37 Ca -0.36 0.02 -0.22 0.00 0.84 0.00 0.00 57.88 58.16 3hy1 h LEU 37 Cb 1.16 0.12 -0.17 0.00 0.37 0.00 0.00 40.66 42.14 3hy1 h LEU 37 CO 0.48 -0.10 -0.71 -0.36 -0.34 0.00 0.00 178.44 177.42 3hy1 s PHE 38 N -3.36 0.74 0.04 1.25 0.08 -1.26 -4.70 117.98 110.76 3hy1 s PHE 38 Ca -0.08 -0.80 -0.34 0.00 0.12 0.00 0.00 56.93 55.84 3hy1 s PHE 38 Cb 0.01 -0.45 -0.13 0.00 -0.57 0.00 0.00 43.02 41.88 3hy1 s PHE 38 CO 0.24 -0.16 1.74 2.41 -0.10 0.00 0.00 175.22 179.35 3hy1 n THR 39 N 0.50 0.31 -0.28 0.64 -1.04 0.17 -4.82 114.28 109.76 3hy1 n THR 39 Ca -0.16 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.79 3hy1 n THR 39 Cb 0.59 -1.74 0.00 0.00 -1.82 0.00 0.00 70.33 67.35 3hy1 n THR 39 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 3hy1 n ASN 40 N 5.15 0.92 -3.66 8.00 2.04 -1.26 -0.92 115.26 125.53 3hy1 n ASN 40 Ca 0.20 -1.20 -0.10 0.00 -0.44 0.00 0.00 54.58 53.03 3hy1 n ASN 40 Cb 0.30 0.00 -0.05 0.00 -2.53 0.00 0.00 39.78 37.50 3hy1 n ASN 40 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3hy1 s ALA 41 N -0.20 -0.85 0.13 -2.53 0.00 -1.26 -4.85 121.76 112.20 3hy1 s ALA 41 Ca 0.00 -0.10 0.22 0.00 0.00 0.00 0.00 51.96 52.08 3hy1 s ALA 41 Cb 0.00 0.64 0.79 0.00 0.00 0.00 0.00 23.12 24.55 3hy1 s ALA 41 CO 0.00 -0.61 1.77 0.78 0.00 0.00 0.00 175.76 177.70 3hy1 h GLY 42 N 2.46 0.00 2.00 0.00 0.00 -1.90 -3.12 103.07 102.51 3hy1 h GLY 42 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.99 3hy1 h GLY 42 CO 0.48 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.02 3hy1 h MET 43 N 0.00 0.00 -0.78 4.80 -0.00 -1.97 -3.35 114.93 113.64 3hy1 h MET 43 Ca -0.00 0.00 0.18 0.00 -0.00 0.00 0.00 59.70 59.88 3hy1 h MET 43 Cb 0.83 0.00 -0.12 0.00 -0.00 0.00 0.00 31.60 32.30 3hy1 h MET 43 CO 0.04 0.00 0.14 -0.91 -0.00 0.00 0.00 176.91 176.17 3hy1 h ASN 44 N 0.00 -0.11 0.84 -0.10 -0.26 -1.98 0.58 115.58 114.56 3hy1 h ASN 44 Ca 0.00 0.17 0.00 0.00 -0.56 0.00 0.00 56.30 55.91 3hy1 h ASN 44 Cb 0.69 0.26 0.00 0.00 -1.06 0.00 0.00 38.32 38.22 3hy1 h ASN 44 CO 0.00 -0.11 0.00 0.00 -1.06 0.00 0.00 177.43 176.26 3hy1 n GLN 45 N -5.24 0.14 -0.28 0.81 10.64 -1.26 -2.67 117.38 119.52 3hy1 n GLN 45 Ca 0.16 0.29 0.08 0.00 -1.83 0.00 0.00 57.00 55.69 3hy1 n GLN 45 Cb 0.52 -1.72 0.20 0.00 -0.86 0.00 0.00 30.24 28.37 3hy1 n GLN 45 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 3hy1 n PHE 46 N -1.97 0.59 -0.13 2.61 3.72 0.19 -4.73 117.46 117.74 3hy1 n PHE 46 Ca 0.04 -0.79 -0.07 0.00 -0.05 0.00 0.00 57.45 56.57 3hy1 n PHE 46 Cb 0.27 -0.20 0.01 0.00 -0.94 0.00 0.00 39.48 38.62 3hy1 n PHE 46 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3hy1 h LYS 47 N 1.36 0.49 -0.15 -1.08 3.64 -0.93 -1.91 116.57 117.98 3hy1 h LYS 47 Ca 0.00 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.22 3hy1 h LYS 47 Cb 1.14 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 3hy1 h LYS 47 CO 0.12 0.32 -0.45 -0.44 -2.27 0.00 0.00 179.45 176.73 3hy1 h ASP 48 N 0.50 0.40 -0.84 4.20 3.32 -1.85 -1.90 116.42 120.25 3hy1 h ASP 48 Ca 0.17 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 3hy1 h ASP 48 Cb 0.01 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 3hy1 h ASP 48 CO -0.08 0.80 0.40 0.58 -1.72 0.00 0.00 179.24 179.22 3hy1 h VAL 49 N 0.30 1.26 0.00 -1.35 2.07 -1.41 -0.96 116.25 116.17 3hy1 h VAL 49 Ca 0.02 -0.74 -0.09 0.00 0.82 0.00 0.00 66.70 66.71 3hy1 h VAL 49 Cb 0.91 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 3hy1 h VAL 49 CO 0.08 0.31 -0.45 -0.26 0.02 0.00 0.00 177.57 177.27 3hy1 h PHE 50 N 1.20 0.00 0.03 1.57 0.04 -1.00 -3.15 116.94 115.62 3hy1 h PHE 50 Ca 0.29 0.00 -0.21 0.00 2.80 0.00 0.00 57.97 60.85 3hy1 h PHE 50 Cb 0.13 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.26 3hy1 h PHE 50 CO 0.02 0.45 -0.98 -0.07 -0.60 0.00 0.00 178.31 177.13 3hy1 h LEU 51 N 0.00 0.16 0.00 1.54 3.38 -0.63 -3.47 115.31 116.30 3hy1 h LEU 51 Ca -0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3hy1 h LEU 51 Cb 0.82 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.52 3hy1 h LEU 51 CO 0.06 1.04 0.00 0.61 0.09 0.00 0.00 178.44 180.24 3hy1 n GLY 52 N 1.15 3.29 0.36 0.83 0.00 -0.43 -5.01 105.19 105.38 3hy1 n GLY 52 Ca -0.03 -0.62 0.06 0.00 0.00 0.00 0.00 46.02 45.43 3hy1 n GLY 52 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hy1 h LEU 53 N 0.00 0.94 -8.71 0.99 3.38 -1.66 -3.39 115.31 106.86 3hy1 h LEU 53 Ca 0.00 0.04 -0.66 0.00 0.09 0.00 0.00 57.88 57.36 3hy1 h LEU 53 Cb 0.00 -0.15 -0.25 0.00 0.09 0.00 0.00 40.66 40.35 3hy1 h LEU 53 CO 0.00 0.52 -0.74 -1.81 0.09 0.00 0.00 178.44 176.50 3hy1 s ASP 54 N -5.72 4.21 0.04 -0.43 1.01 -0.91 -4.94 116.67 109.94 3hy1 s ASP 54 Ca -0.12 -0.26 0.03 0.00 0.71 0.00 0.00 52.55 52.91 3hy1 s ASP 54 Cb 0.22 -1.58 -0.02 0.00 1.01 0.00 0.00 42.92 42.55 3hy1 s ASP 54 CO 0.81 0.19 -0.09 -0.75 0.21 0.00 0.00 175.17 175.53 3hy1 s LYS 55 N 0.22 0.60 0.34 8.23 2.20 -1.26 -3.14 119.74 126.92 3hy1 s LYS 55 Ca -0.07 -0.76 0.03 0.00 -0.36 0.00 0.00 55.97 54.81 3hy1 s LYS 55 Cb -0.15 -0.44 -0.05 0.00 -1.51 0.00 0.00 37.83 35.68 3hy1 s LYS 55 CO 0.05 0.09 0.08 1.03 -0.36 0.00 0.00 175.35 176.24 3hy1 s ARG 56 N -1.50 1.69 0.41 4.03 0.52 -1.26 -5.03 118.95 117.82 3hy1 s ARG 56 Ca -0.07 -1.96 0.08 0.00 -0.52 0.00 0.00 55.73 53.26 3hy1 s ARG 56 Cb -0.09 -0.69 0.88 0.00 0.52 0.00 0.00 34.95 35.57 3hy1 s ARG 56 CO 0.01 -0.29 2.05 -0.91 0.02 0.00 0.00 175.30 176.18 3hy1 h ASN 57 N 2.07 0.45 -3.53 0.23 2.35 -2.02 -3.40 115.58 111.74 3hy1 h ASN 57 Ca -0.39 -0.01 -0.51 0.00 -0.55 0.00 0.00 56.30 54.85 3hy1 h ASN 57 Cb 1.25 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 39.51 3hy1 h ASN 57 CO 0.64 0.32 0.02 -0.72 -1.65 0.00 0.00 177.43 176.04 3hy1 s TYR 58 N -5.48 3.46 -0.88 1.19 -0.85 -1.26 -4.98 117.35 108.55 3hy1 s TYR 58 Ca -0.08 0.92 0.08 0.00 -0.52 0.00 0.00 57.07 57.47 3hy1 s TYR 58 Cb 0.18 -2.33 0.04 0.00 0.38 0.00 0.00 41.96 40.23 3hy1 s TYR 58 CO 0.73 0.03 0.68 -1.13 -1.52 0.00 0.00 175.55 174.34 3hy1 n SER 59 N -0.98 1.45 -3.99 -0.18 3.41 -1.26 -4.98 113.62 107.08 3hy1 n SER 59 Ca 0.01 -1.23 -0.16 0.00 -0.26 0.00 0.00 58.87 57.23 3hy1 n SER 59 Cb 0.54 0.15 -0.14 0.00 -0.26 0.00 0.00 64.21 64.50 3hy1 n SER 59 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3hy1 s ARG 60 N -0.80 0.53 0.06 4.33 0.52 -1.26 -1.75 118.95 120.57 3hy1 s ARG 60 Ca 0.08 -0.32 -0.05 0.00 -0.52 0.00 0.00 55.73 54.92 3hy1 s ARG 60 Cb 0.06 -0.48 -0.02 0.00 0.52 0.00 0.00 34.95 35.04 3hy1 s ARG 60 CO 0.13 0.13 0.09 0.00 0.02 0.00 0.00 175.30 175.67 3hy1 s ALA 61 N -0.35 0.05 -0.09 2.13 0.00 -0.84 -0.86 121.76 121.80 3hy1 s ALA 61 Ca 0.01 -0.79 -0.08 0.00 0.00 0.00 0.00 51.96 51.09 3hy1 s ALA 61 Cb -0.04 0.35 0.03 0.00 0.00 0.00 0.00 23.12 23.46 3hy1 s ALA 61 CO -0.00 -0.41 0.25 -0.08 0.00 0.00 0.00 175.76 175.51 3hy1 s THR 62 N -3.54 -0.01 0.05 0.00 -1.32 -0.62 -0.97 115.64 109.23 3hy1 s THR 62 Ca 0.03 0.02 -0.08 0.00 -1.21 0.00 0.00 61.69 60.45 3hy1 s THR 62 Cb 0.04 -0.35 -0.00 0.00 -1.51 0.00 0.00 72.50 70.68 3hy1 s THR 62 CO -0.09 0.01 0.15 0.42 -2.21 0.00 0.00 174.62 172.90 3hy1 s THR 63 N 0.28 0.13 -0.81 5.08 -4.23 -0.94 -1.66 115.64 113.49 3hy1 s THR 63 Ca -0.01 -1.06 -0.02 0.00 -1.18 0.00 0.00 61.69 59.42 3hy1 s THR 63 Cb -0.03 -1.03 0.20 0.00 1.34 0.00 0.00 72.50 72.98 3hy1 s THR 63 CO -0.01 -0.58 0.67 -0.55 -0.54 0.00 0.00 174.62 173.60 3hy1 s SER 64 N -2.31 5.73 -0.11 3.99 0.15 -1.26 -2.08 113.70 117.81 3hy1 s SER 64 Ca -0.02 -3.46 -0.30 0.00 0.70 0.00 0.00 55.95 52.87 3hy1 s SER 64 Cb 0.01 -1.89 -0.01 0.00 -1.71 0.00 0.00 66.02 62.42 3hy1 s SER 64 CO -0.06 -0.24 1.01 -1.58 1.20 0.00 0.00 173.24 173.57 3hy1 s GLN 65 N -0.95 4.42 0.03 5.44 2.00 -0.42 -4.54 119.66 125.63 3hy1 s GLN 65 Ca 0.24 1.39 -0.30 0.00 -2.00 0.00 0.00 55.36 54.69 3hy1 s GLN 65 Cb -0.11 -3.55 -0.04 0.00 0.80 0.00 0.00 33.01 30.11 3hy1 s GLN 65 CO -0.10 -0.32 1.05 -0.98 -0.50 0.00 0.00 175.29 174.44 3hy1 s ARG 66 N 2.05 4.53 0.16 1.67 1.70 -1.26 0.02 118.95 127.80 3hy1 s ARG 66 Ca 0.48 1.54 0.08 0.00 -0.47 0.00 0.00 55.73 57.37 3hy1 s ARG 66 Cb -0.18 -3.42 -0.04 0.00 -0.57 0.00 0.00 34.95 30.74 3hy1 s ARG 66 CO 0.18 -0.10 -0.18 0.00 -1.08 0.00 0.00 175.30 174.11 3hy1 s VAL 68 N -1.93 0.74 -0.50 0.00 1.01 -0.10 -0.97 120.40 118.66 3hy1 s VAL 68 Ca 0.14 -0.16 -0.10 0.00 0.00 0.00 0.00 61.98 61.87 3hy1 s VAL 68 Cb -0.06 -0.78 0.13 0.00 0.00 0.00 0.00 36.38 35.66 3hy1 s VAL 68 CO 0.06 0.30 0.38 -0.13 0.00 0.00 0.00 175.10 175.71 3hy1 s ARG 69 N 1.42 2.56 -0.03 2.72 0.52 -0.45 -4.46 118.95 121.22 3hy1 s ARG 69 Ca -0.02 -1.82 0.05 0.00 -0.52 0.00 0.00 55.73 53.42 3hy1 s ARG 69 Cb -0.13 -3.97 0.08 0.00 0.52 0.00 0.00 34.95 31.44 3hy1 s ARG 69 CO -0.04 -1.21 0.96 0.00 0.02 0.00 0.00 175.30 175.04 3hy1 n ALA 70 N 4.85 1.92 -3.00 2.13 0.00 -1.23 -2.16 120.51 123.02 3hy1 n ALA 70 Ca -0.07 -1.35 -0.14 0.00 0.00 0.00 0.00 53.44 51.88 3hy1 n ALA 70 Cb 0.41 -0.36 -0.15 0.00 0.00 0.00 0.00 19.45 19.36 3hy1 n ALA 70 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3hy1 s GLY 71 N -1.34 0.13 0.48 0.00 0.00 -1.24 -4.84 107.32 100.51 3hy1 s GLY 71 Ca 0.08 -0.04 -0.24 0.00 0.00 0.00 0.00 44.72 44.52 3hy1 s GLY 71 CO 0.01 0.05 1.37 -0.32 0.00 0.00 0.00 173.10 174.21 3hy1 s GLY 72 N 0.15 2.90 0.00 0.20 0.00 -1.26 -0.26 107.32 109.05 3hy1 s GLY 72 Ca -0.01 1.36 0.20 0.00 0.00 0.00 0.00 44.72 46.27 3hy1 s GLY 72 CO -0.00 1.93 1.44 0.58 0.00 0.00 0.00 173.10 177.05 3hy1 n LYS 73 N -0.47 2.12 -3.64 2.90 2.85 -1.26 -4.90 118.16 115.77 3hy1 n LYS 73 Ca 0.07 -1.71 -0.27 0.00 -1.05 0.00 0.00 58.31 55.35 3hy1 n LYS 73 Cb 0.43 -1.43 -0.11 0.00 -0.65 0.00 0.00 35.03 33.28 3hy1 n LYS 73 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 3hy1 n HIS 74 N 0.91 1.57 -4.20 5.58 8.25 0.63 -5.08 115.22 122.88 3hy1 n HIS 74 Ca 0.17 -3.89 -0.34 0.00 -0.26 0.00 0.00 57.72 53.40 3hy1 n HIS 74 Cb 0.45 -0.28 -0.14 0.00 1.12 0.00 0.00 29.99 31.13 3hy1 n HIS 74 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3hy1 s ASN 75 N -0.99 4.10 0.00 0.41 3.84 -1.23 -3.50 114.94 117.56 3hy1 s ASN 75 Ca 0.30 -0.39 0.01 0.00 0.21 0.00 0.00 52.86 52.99 3hy1 s ASN 75 Cb 0.02 -1.67 0.02 0.00 -0.55 0.00 0.00 41.25 39.06 3hy1 s ASN 75 CO -0.16 0.04 0.71 0.47 -2.79 0.00 0.00 177.10 175.37 3hy1 n ASP 76 N 4.36 1.46 -0.21 -4.21 8.00 -0.92 -4.75 116.55 120.28 3hy1 n ASP 76 Ca -0.18 -1.38 -0.02 0.00 0.71 0.00 0.00 54.79 53.92 3hy1 n ASP 76 Cb 0.51 -0.01 0.05 0.00 -0.02 0.00 0.00 41.12 41.66 3hy1 n ASP 76 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3hy1 h LEU 77 N 0.25 -0.70 -0.63 0.64 5.85 -1.85 0.14 115.31 119.02 3hy1 h LEU 77 Ca 0.00 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.92 3hy1 h LEU 77 Cb 0.22 0.43 0.00 0.00 0.37 0.00 0.00 40.66 41.67 3hy1 h LEU 77 CO 0.00 -0.23 0.00 -0.62 -0.34 0.00 0.00 178.44 177.25 3hy1 n GLU 78 N -5.43 0.17 0.04 1.25 -0.58 -1.26 -1.83 120.64 113.00 3hy1 n GLU 78 Ca 0.07 0.41 0.12 0.00 -0.42 0.00 0.00 57.16 57.33 3hy1 n GLU 78 Cb 0.33 -1.83 0.09 0.00 -0.57 0.00 0.00 31.44 29.46 3hy1 n GLU 78 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3hy1 n ASN 79 N -2.16 0.64 -4.66 1.62 4.13 -0.00 -4.87 115.26 109.96 3hy1 n ASN 79 Ca 0.02 -0.07 -0.42 0.00 1.68 0.00 0.00 54.58 55.79 3hy1 n ASN 79 Cb 0.22 0.53 -0.03 0.00 -1.54 0.00 0.00 39.78 38.96 3hy1 n ASN 79 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3hy1 s VAL 80 N -3.18 3.38 0.00 2.41 1.01 -0.76 -1.76 120.40 121.50 3hy1 s VAL 80 Ca 0.05 0.52 0.00 0.00 0.00 0.00 0.00 61.98 62.55 3hy1 s VAL 80 Cb 0.14 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 33.18 3hy1 s VAL 80 CO 0.77 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.44 3hy1 n GLY 81 N 4.20 2.09 0.00 4.51 0.00 -1.26 -4.85 105.19 109.88 3hy1 n GLY 81 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 3hy1 n GLY 81 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hy1 n TYR 82 N -1.86 0.00 -4.30 1.61 4.01 -0.72 -4.91 117.16 111.00 3hy1 n TYR 82 Ca 0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.58 3hy1 n TYR 82 Cb 0.00 -0.14 -0.10 0.00 -0.31 0.00 0.00 39.34 38.79 3hy1 n TYR 82 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3hy1 s THR 83 N -2.58 1.26 -1.14 -0.72 -4.23 -1.15 -5.04 115.64 102.03 3hy1 s THR 83 Ca 0.00 -2.08 0.29 0.00 -1.18 0.00 0.00 61.69 58.72 3hy1 s THR 83 Cb 0.10 -2.06 0.31 0.00 1.34 0.00 0.00 72.50 72.19 3hy1 s THR 83 CO 0.56 -0.57 1.94 0.00 -0.54 0.00 0.00 174.62 176.01 3hy1 n ALA 84 N -0.32 2.45 -0.31 3.99 0.00 -1.26 -4.18 120.51 120.88 3hy1 n ALA 84 Ca -0.08 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.23 3hy1 n ALA 84 Cb 0.62 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.61 3hy1 n ALA 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hy1 n ARG 85 N -1.42 0.09 -3.98 0.00 1.74 -1.26 -1.49 116.66 110.33 3hy1 n ARG 85 Ca 0.09 -0.28 -0.35 0.00 -0.77 0.00 0.00 57.85 56.55 3hy1 n ARG 85 Cb 0.31 -0.75 -0.10 0.00 -1.02 0.00 0.00 32.46 30.90 3hy1 n ARG 85 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3hy1 s HIS 86 N -0.09 3.26 0.20 -1.55 3.76 -1.26 -5.04 115.29 114.56 3hy1 s HIS 86 Ca 0.00 0.09 0.04 0.00 -0.15 0.00 0.00 55.06 55.04 3hy1 s HIS 86 Cb 0.00 -2.09 -0.05 0.00 1.11 0.00 0.00 32.58 31.56 3hy1 s HIS 86 CO 0.00 0.16 -0.05 -1.01 -0.85 0.00 0.00 174.74 172.99 3hy1 s HIS 87 N 0.38 1.45 -0.02 1.40 3.76 -1.26 -4.55 115.29 116.46 3hy1 s HIS 87 Ca 0.03 -0.84 -0.01 0.00 -0.15 0.00 0.00 55.06 54.09 3hy1 s HIS 87 Cb -0.12 -0.80 -0.00 0.00 1.11 0.00 0.00 32.58 32.77 3hy1 s HIS 87 CO 0.00 0.02 -0.01 1.79 -0.85 0.00 0.00 174.74 175.69 3hy1 h THR 88 N 2.59 0.00 -3.44 1.30 1.35 -1.87 -3.42 112.91 109.43 3hy1 h THR 88 Ca -0.38 -0.13 -0.54 0.00 -0.55 0.00 0.00 66.41 64.82 3hy1 h THR 88 Cb 1.21 0.00 -0.03 0.00 -1.73 0.00 0.00 68.15 67.60 3hy1 h THR 88 CO 0.64 0.00 0.26 0.12 -0.25 0.00 0.00 175.52 176.29 3hy1 s PHE 89 N -1.11 3.69 0.13 4.73 5.36 -1.26 -1.34 117.98 128.18 3hy1 s PHE 89 Ca -0.01 1.57 -0.21 0.00 -0.96 0.00 0.00 56.93 57.32 3hy1 s PHE 89 Cb 0.00 -2.97 0.06 0.00 -0.34 0.00 0.00 43.02 39.77 3hy1 s PHE 89 CO 0.01 0.13 0.54 -0.59 -1.46 0.00 0.00 175.22 173.85 3hy1 s PHE 90 N 0.48 -0.44 -0.15 10.12 -0.12 -0.14 -4.91 117.98 122.83 3hy1 s PHE 90 Ca 0.45 0.25 -0.10 0.00 -0.05 0.00 0.00 56.93 57.47 3hy1 s PHE 90 Cb -0.21 0.45 -0.05 0.00 -0.63 0.00 0.00 43.02 42.58 3hy1 s PHE 90 CO 0.25 -0.78 0.20 -1.21 -0.05 0.00 0.00 175.22 173.63 3hy1 s GLU 91 N -3.54 3.94 -0.24 1.99 2.02 -1.26 0.15 118.70 121.76 3hy1 s GLU 91 Ca 0.00 -0.06 -0.02 0.00 0.02 0.00 0.00 54.97 54.92 3hy1 s GLU 91 Cb -0.00 -3.33 0.02 0.00 0.10 0.00 0.00 34.13 30.92 3hy1 s GLU 91 CO -0.11 0.48 -0.05 1.41 0.02 0.00 0.00 175.26 177.01 3hy1 s MET 92 N -0.20 2.93 -0.16 1.61 -2.45 0.10 -1.68 119.30 119.45 3hy1 s MET 92 Ca 0.14 -0.92 -0.23 0.00 -1.25 0.00 0.00 55.69 53.43 3hy1 s MET 92 Cb -0.12 -3.00 -0.02 0.00 1.25 0.00 0.00 34.83 32.94 3hy1 s MET 92 CO 0.03 -0.37 0.73 -0.51 1.05 0.00 0.00 175.02 175.95 3hy1 s LEU 93 N 1.36 4.19 0.01 4.11 1.43 0.44 -1.30 118.68 128.92 3hy1 s LEU 93 Ca 0.01 1.05 -0.03 0.00 -1.03 0.00 0.00 54.13 54.14 3hy1 s LEU 93 Cb -0.16 -3.08 -0.01 0.00 0.03 0.00 0.00 46.19 42.97 3hy1 s LEU 93 CO -0.04 -0.29 0.05 -0.83 0.23 0.00 0.00 176.35 175.46 3hy1 s GLY 94 N 1.10 0.12 0.01 -3.19 0.00 -0.88 0.84 107.32 105.31 3hy1 s GLY 94 Ca 0.35 -0.30 0.08 0.00 0.00 0.00 0.00 44.72 44.84 3hy1 s GLY 94 CO 0.13 -0.39 -0.23 0.54 0.00 0.00 0.00 173.10 173.15 3hy1 s ASN 95 N -1.20 3.34 0.04 1.64 4.22 -1.26 -2.22 114.94 119.50 3hy1 s ASN 95 Ca -0.13 -0.46 0.04 0.00 -2.14 0.00 0.00 52.86 50.17 3hy1 s ASN 95 Cb -0.08 -0.44 -0.02 0.00 1.28 0.00 0.00 41.25 42.00 3hy1 s ASN 95 CO 0.00 0.29 -0.13 -0.36 -2.04 0.00 0.00 177.10 174.87 3hy1 s PHE 96 N -0.74 1.13 -0.07 1.54 0.08 -0.14 -2.33 117.98 117.46 3hy1 s PHE 96 Ca 0.11 -0.35 0.03 0.00 0.12 0.00 0.00 56.93 56.85 3hy1 s PHE 96 Cb -0.10 -0.68 0.01 0.00 -0.57 0.00 0.00 43.02 41.68 3hy1 s PHE 96 CO 0.01 0.02 -0.16 -1.54 -0.10 0.00 0.00 175.22 173.45 3hy1 s SER 97 N -1.11 2.16 -0.91 1.36 1.04 -0.86 -1.98 113.70 113.41 3hy1 s SER 97 Ca 0.01 -0.37 -0.13 0.00 0.48 0.00 0.00 55.95 55.93 3hy1 s SER 97 Cb -0.08 -0.93 0.23 0.00 0.10 0.00 0.00 66.02 65.34 3hy1 s SER 97 CO 0.01 0.09 0.88 -0.36 0.98 0.00 0.00 173.24 174.84 3hy1 s PHE 98 N 0.47 3.84 -1.70 5.02 0.40 -0.72 -1.67 117.98 123.61 3hy1 s PHE 98 Ca -0.14 -2.12 -0.01 0.00 -0.60 0.00 0.00 56.93 54.06 3hy1 s PHE 98 Cb -0.16 -3.86 0.00 0.00 0.51 0.00 0.00 43.02 39.51 3hy1 s PHE 98 CO 0.05 -1.02 0.18 0.41 0.70 0.00 0.00 175.22 175.54 3hy1 n GLY 99 N 3.78 -0.51 0.00 4.36 0.00 -1.13 -4.92 105.19 106.77 3hy1 n GLY 99 Ca 0.17 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.23 3hy1 n GLY 99 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hy1 n ASP 100 N -2.16 0.00 -4.56 1.61 -0.08 -1.25 -4.86 116.55 105.24 3hy1 n ASP 100 Ca -0.21 0.00 -0.29 0.00 -1.51 0.00 0.00 54.79 52.78 3hy1 n ASP 100 Cb 0.67 0.00 0.14 0.00 2.34 0.00 0.00 41.12 44.27 3hy1 n ASP 100 CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 3hy1 s TYR 101 N 1.80 2.25 0.00 -0.67 -0.85 -1.26 -4.92 117.35 113.70 3hy1 s TYR 101 Ca 0.00 0.62 0.00 0.00 -0.52 0.00 0.00 57.07 57.17 3hy1 s TYR 101 Cb 0.00 -3.67 0.00 0.00 0.38 0.00 0.00 41.96 38.67 3hy1 s TYR 101 CO 0.00 -2.34 0.00 0.34 -1.52 0.00 0.00 175.55 172.03 3hy1 n PHE 102 N -3.66 0.00 -0.31 -3.49 7.35 -1.26 -4.46 117.46 111.62 3hy1 n PHE 102 Ca 0.10 0.00 0.09 0.00 -0.76 0.00 0.00 57.45 56.88 3hy1 n PHE 102 Cb 0.60 0.00 0.25 0.00 0.35 0.00 0.00 39.48 40.68 3hy1 n PHE 102 CO 0.00 0.00 0.00 1.57 -0.76 0.00 0.00 176.76 177.57 3hy1 h LYS 103 N 0.00 0.63 0.19 -4.13 2.10 -1.98 -1.81 116.57 111.57 3hy1 h LYS 103 Ca 0.00 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.60 3hy1 h LYS 103 Cb 0.00 -0.14 0.00 0.00 -0.90 0.00 0.00 32.23 31.19 3hy1 h LYS 103 CO 0.00 0.42 -0.09 1.25 -2.00 0.00 0.00 179.45 179.03 3hy1 h LEU 104 N 0.65 -0.22 -0.43 7.07 5.85 -1.96 -2.88 115.31 123.39 3hy1 h LEU 104 Ca 0.49 -0.11 -0.16 0.00 0.84 0.00 0.00 57.88 58.93 3hy1 h LEU 104 Cb 0.72 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.80 3hy1 h LEU 104 CO -0.37 -0.02 -0.47 0.44 -0.34 0.00 0.00 178.44 177.68 3hy1 h ASP 105 N -0.41 0.86 -0.42 1.25 3.32 -1.87 -2.78 116.42 116.36 3hy1 h ASP 105 Ca -0.03 -0.42 0.08 0.00 0.02 0.00 0.00 57.03 56.68 3hy1 h ASP 105 Cb 0.32 -0.24 -0.08 0.00 0.22 0.00 0.00 39.33 39.55 3hy1 h ASP 105 CO 0.04 1.19 -0.10 0.00 -1.72 0.00 0.00 179.24 178.65 3hy1 h ALA 106 N 0.84 0.28 0.00 3.45 0.00 -1.30 0.27 119.26 122.80 3hy1 h ALA 106 Ca 0.03 0.16 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 3hy1 h ALA 106 Cb 1.05 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 3hy1 h ALA 106 CO 0.10 -0.45 -0.69 -0.84 0.00 0.00 0.00 179.25 177.38 3hy1 h ILE 107 N 0.00 0.63 -0.17 0.00 3.07 -1.57 -2.71 117.51 116.76 3hy1 h ILE 107 Ca 0.20 -1.96 -0.03 0.00 1.55 0.00 0.00 64.86 64.62 3hy1 h ILE 107 Cb 0.31 2.23 -0.01 0.00 -0.27 0.00 0.00 36.82 39.08 3hy1 h ILE 107 CO -0.43 0.36 -0.02 -0.07 -1.05 0.00 0.00 178.15 176.94 3hy1 h LEU 108 N 0.00 0.31 -0.72 0.16 3.38 -1.14 0.11 115.31 117.41 3hy1 h LEU 108 Ca -0.04 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.65 3hy1 h LEU 108 Cb 1.36 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.98 3hy1 h LEU 108 CO 0.05 0.57 0.43 -0.26 0.09 0.00 0.00 178.44 179.32 3hy1 h PHE 109 N 0.05 0.80 -0.38 1.13 0.05 -1.01 -0.84 116.94 116.74 3hy1 h PHE 109 Ca 0.05 0.02 -0.02 0.00 3.82 0.00 0.00 57.97 61.84 3hy1 h PHE 109 Cb 0.42 -0.25 -0.02 0.00 2.00 0.00 0.00 35.95 38.10 3hy1 h PHE 109 CO 0.04 0.42 0.17 0.00 -0.18 0.00 0.00 178.31 178.75 3hy1 h ALA 110 N 1.34 0.49 -0.40 2.45 0.00 -1.29 -2.01 119.26 119.84 3hy1 h ALA 110 Ca 0.31 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3hy1 h ALA 110 Cb 0.12 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3hy1 h ALA 110 CO -0.15 0.08 0.14 2.35 0.00 0.00 0.00 179.25 181.67 3hy1 h TRP 111 N 0.47 0.63 -0.07 0.00 2.91 -0.68 -2.15 115.95 117.07 3hy1 h TRP 111 Ca 0.13 -0.06 0.02 0.00 1.13 0.00 0.00 58.89 60.11 3hy1 h TRP 111 Cb 0.16 -0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 28.60 3hy1 h TRP 111 CO -0.01 0.57 -0.05 1.25 -1.03 0.00 0.00 178.44 179.17 3hy1 h LEU 112 N 0.50 -0.16 -0.87 0.65 5.85 -1.00 -1.33 115.31 118.94 3hy1 h LEU 112 Ca 0.13 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 3hy1 h LEU 112 Cb 0.22 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 3hy1 h LEU 112 CO -0.01 -0.07 0.09 0.25 -0.34 0.00 0.00 178.44 178.36 3hy1 h LEU 113 N -0.06 0.88 -0.59 2.25 5.85 -1.31 -0.65 115.31 121.68 3hy1 h LEU 113 Ca 0.05 -0.19 -0.15 0.00 0.84 0.00 0.00 57.88 58.42 3hy1 h LEU 113 Cb 0.13 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 3hy1 h LEU 113 CO -0.10 0.89 -0.68 -0.07 -0.34 0.00 0.00 178.44 178.14 3hy1 h LEU 114 N 0.88 0.18 0.00 2.25 3.38 -1.16 -2.47 115.31 118.36 3hy1 h LEU 114 Ca 0.18 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 3hy1 h LEU 114 Cb 0.39 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3hy1 h LEU 114 CO 0.01 0.80 -1.35 1.07 0.09 0.00 0.00 178.44 179.06 3hy1 n THR 115 N -3.79 0.20 -1.90 0.22 5.66 -0.52 -1.29 114.28 112.86 3hy1 n THR 115 Ca -0.02 -0.20 -0.33 0.00 -3.05 0.00 0.00 64.05 60.45 3hy1 n THR 115 Cb 0.67 -0.24 0.03 0.00 -1.55 0.00 0.00 70.33 69.24 3hy1 n THR 115 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 3hy1 s SER 116 N -3.23 5.33 0.38 1.09 0.15 -0.26 -4.43 113.70 112.73 3hy1 s SER 116 Ca -0.03 2.01 0.20 0.00 0.70 0.00 0.00 55.95 58.84 3hy1 s SER 116 Cb 0.03 -2.55 0.48 0.00 -1.71 0.00 0.00 66.02 62.26 3hy1 s SER 116 CO 0.25 -1.48 1.64 -0.33 1.20 0.00 0.00 173.24 174.52 3hy1 h GLU 117 N 0.33 0.00 -0.12 5.44 4.39 -1.88 -3.00 114.58 119.75 3hy1 h GLU 117 Ca -0.47 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.17 3hy1 h GLU 117 Cb 1.25 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.88 3hy1 h GLU 117 CO 0.55 0.30 -0.19 -0.22 -1.16 0.00 0.00 179.01 178.29 3hy1 h LYS 118 N 0.00 0.19 0.00 2.33 3.11 -1.93 -3.45 116.57 116.82 3hy1 h LYS 118 Ca -0.00 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.79 3hy1 h LYS 118 Cb 1.05 -0.02 0.00 0.00 -1.00 0.00 0.00 32.23 32.26 3hy1 h LYS 118 CO 0.04 0.38 0.00 0.91 -2.81 0.00 0.00 179.45 177.97 3hy1 n TRP 119 N -4.24 0.00 -1.41 1.91 7.02 -1.13 -5.06 117.44 114.54 3hy1 n TRP 119 Ca -0.01 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.13 3hy1 n TRP 119 Cb 0.30 0.00 0.09 0.00 -2.42 0.00 0.00 31.31 29.28 3hy1 n TRP 119 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 3hy1 s PHE 120 N 4.21 2.14 -0.51 -5.99 0.08 -0.93 -4.89 117.98 112.09 3hy1 s PHE 120 Ca 0.00 1.61 0.07 0.00 0.12 0.00 0.00 56.93 58.73 3hy1 s PHE 120 Cb 0.00 -3.38 0.35 0.00 -0.57 0.00 0.00 43.02 39.42 3hy1 s PHE 120 CO 0.00 -2.41 0.90 0.00 -0.10 0.00 0.00 175.22 173.61 3hy1 n ALA 121 N -2.87 3.95 -2.07 5.36 0.00 -1.25 -3.33 120.51 120.30 3hy1 n ALA 121 Ca 0.12 -4.31 -0.42 0.00 0.00 0.00 0.00 53.44 48.84 3hy1 n ALA 121 Cb 0.51 -0.78 -0.03 0.00 0.00 0.00 0.00 19.45 19.15 3hy1 n ALA 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hy1 s LEU 122 N -3.19 4.41 0.13 0.00 1.43 -0.41 -4.94 118.68 116.11 3hy1 s LEU 122 Ca 0.46 2.34 -0.35 0.00 -1.03 0.00 0.00 54.13 55.55 3hy1 s LEU 122 Cb 0.31 -3.60 -0.15 0.00 0.03 0.00 0.00 46.19 42.77 3hy1 s LEU 122 CO -0.12 -0.53 1.45 -2.65 0.23 0.00 0.00 176.35 174.73 3hy1 n PRO 123 N 2.96 1.66 -0.28 1.29 -0.02 -1.26 -4.59 135.00 134.76 3hy1 n PRO 123 Ca 0.07 0.60 -0.02 0.00 -2.02 0.00 0.00 63.50 62.13 3hy1 n PRO 123 Cb 0.43 -2.30 0.10 0.00 -0.02 0.00 0.00 33.50 31.72 3hy1 n PRO 123 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3hy1 h LYS 124 N 5.14 0.92 -0.01 -0.52 1.57 -1.93 -2.75 116.57 118.99 3hy1 h LYS 124 Ca -0.46 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 3hy1 h LYS 124 Cb 1.29 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 33.40 3hy1 h LYS 124 CO 0.83 0.61 0.04 0.93 -0.57 0.00 0.00 179.45 181.28 3hy1 h GLU 125 N 0.95 0.00 0.00 3.15 5.08 -2.03 -1.11 114.58 120.61 3hy1 h GLU 125 Ca 0.32 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.48 3hy1 h GLU 125 Cb 0.05 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 3hy1 h GLU 125 CO -0.13 0.00 -1.09 0.00 -1.00 0.00 0.00 179.01 176.80 3hy1 h ARG 126 N 0.00 0.00 -6.84 2.33 3.08 -1.85 -3.48 114.38 107.62 3hy1 h ARG 126 Ca 0.01 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.55 3hy1 h ARG 126 Cb 0.08 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.16 3hy1 h ARG 126 CO -0.00 0.70 0.50 -0.51 -1.07 0.00 0.00 179.97 179.59 3hy1 s LEU 127 N -6.42 4.48 0.00 3.04 1.43 -0.42 -2.67 118.68 118.14 3hy1 s LEU 127 Ca 0.00 2.33 0.06 0.00 -1.03 0.00 0.00 54.13 55.50 3hy1 s LEU 127 Cb 0.09 -3.69 -0.02 0.00 0.03 0.00 0.00 46.19 42.60 3hy1 s LEU 127 CO 0.80 -0.26 -0.20 0.26 0.23 0.00 0.00 176.35 177.18 3hy1 s TRP 128 N -1.20 1.75 -0.04 0.29 0.52 0.34 -4.96 118.94 115.64 3hy1 s TRP 128 Ca 0.47 -0.34 0.07 0.00 0.02 0.00 0.00 56.10 56.31 3hy1 s TRP 128 Cb -0.33 -1.10 -0.01 0.00 -1.15 0.00 0.00 33.47 30.88 3hy1 s TRP 128 CO 0.42 0.01 -0.25 0.08 0.02 0.00 0.00 176.95 177.23 3hy1 s VAL 129 N -0.57 1.99 -0.09 4.03 1.01 -0.91 0.32 120.40 126.17 3hy1 s VAL 129 Ca 0.07 -1.05 0.04 0.00 0.00 0.00 0.00 61.98 61.04 3hy1 s VAL 129 Cb -0.08 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 3hy1 s VAL 129 CO 0.00 0.56 -0.20 0.42 0.00 0.00 0.00 175.10 175.88 3hy1 s THR 130 N -0.32 2.45 0.25 3.92 -4.23 -0.58 -0.46 115.64 116.66 3hy1 s THR 130 Ca 0.02 -0.90 0.09 0.00 -1.18 0.00 0.00 61.69 59.71 3hy1 s THR 130 Cb -0.12 -1.95 -0.05 0.00 1.34 0.00 0.00 72.50 71.72 3hy1 s THR 130 CO 0.02 0.56 -0.13 0.68 -0.54 0.00 0.00 174.62 175.20 3hy1 s VAL 131 N 0.03 1.91 0.29 2.29 -7.23 -0.62 -2.00 120.40 115.07 3hy1 s VAL 131 Ca -0.08 -2.24 -0.29 0.00 -1.81 0.00 0.00 61.98 57.57 3hy1 s VAL 131 Cb -0.15 -2.22 -0.10 0.00 0.56 0.00 0.00 36.38 34.47 3hy1 s VAL 131 CO 0.05 -0.47 1.22 -0.47 -0.31 0.00 0.00 175.10 175.13 3hy1 s TYR 132 N -2.86 3.30 0.32 2.82 5.04 -1.22 -0.26 117.35 124.49 3hy1 s TYR 132 Ca 0.26 1.51 0.07 0.00 -2.44 0.00 0.00 57.07 56.47 3hy1 s TYR 132 Cb -0.01 -3.50 0.74 0.00 0.35 0.00 0.00 41.96 39.54 3hy1 s TYR 132 CO 0.10 -1.31 1.83 0.93 -1.34 0.00 0.00 175.55 175.76 3hy1 h GLU 133 N 3.83 0.76 0.00 4.97 5.08 0.10 0.33 114.58 129.65 3hy1 h GLU 133 Ca -0.47 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 3hy1 h GLU 133 Cb 1.22 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3hy1 h GLU 133 CO 0.68 0.50 -0.26 -1.13 -1.00 0.00 0.00 179.01 177.80 3hy1 n SER 134 N -4.64 0.27 -4.14 1.42 3.41 -1.26 -4.52 113.62 104.16 3hy1 n SER 134 Ca 0.20 0.12 -0.43 0.00 -0.26 0.00 0.00 58.87 58.50 3hy1 n SER 134 Cb 0.49 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 3hy1 n SER 134 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3hy1 n ASP 135 N -1.53 5.02 0.10 4.04 -0.08 0.10 -4.70 116.55 119.51 3hy1 n ASP 135 Ca 0.06 -3.02 0.13 0.00 -1.51 0.00 0.00 54.79 50.45 3hy1 n ASP 135 Cb 0.34 -1.55 0.44 0.00 2.34 0.00 0.00 41.12 42.69 3hy1 n ASP 135 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 3hy1 n ASP 136 N 5.14 0.71 -0.04 1.67 10.43 -1.26 -2.38 116.55 130.83 3hy1 n ASP 136 Ca 0.41 0.59 -0.12 0.00 2.57 0.00 0.00 54.79 58.24 3hy1 n ASP 136 Cb 0.40 -0.78 -0.06 0.00 1.84 0.00 0.00 41.12 42.52 3hy1 n ASP 136 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 3hy1 h GLU 137 N 0.00 0.23 -0.40 -1.24 5.08 -1.96 0.12 114.58 116.41 3hy1 h GLU 137 Ca 0.00 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.18 3hy1 h GLU 137 Cb 0.62 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3hy1 h GLU 137 CO 0.00 0.43 -0.22 0.00 -1.00 0.00 0.00 179.01 178.22 3hy1 h ALA 138 N 0.79 0.56 -0.75 3.43 0.00 -1.95 -2.10 119.26 119.24 3hy1 h ALA 138 Ca 0.04 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.61 3hy1 h ALA 138 Cb 0.32 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 3hy1 h ALA 138 CO 0.00 0.54 0.46 -0.92 0.00 0.00 0.00 179.25 179.34 3hy1 h TYR 139 N 0.66 0.86 -0.17 0.00 3.20 -1.42 -2.10 116.97 118.00 3hy1 h TYR 139 Ca 0.09 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 3hy1 h TYR 139 Cb 0.79 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 3hy1 h TYR 139 CO 0.06 0.47 0.02 1.49 -1.64 0.00 0.00 178.16 178.56 3hy1 h GLU 140 N 0.88 0.28 -0.37 1.82 4.81 -0.85 -1.91 114.58 119.25 3hy1 h GLU 140 Ca 0.31 -0.08 0.07 0.00 -0.13 0.00 0.00 59.36 59.54 3hy1 h GLU 140 Cb 0.08 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.36 3hy1 h GLU 140 CO -0.14 0.46 -0.08 0.82 -0.73 0.00 0.00 179.01 179.34 3hy1 h ILE 141 N 0.07 0.64 -0.88 2.32 1.08 -1.00 0.35 117.51 120.09 3hy1 h ILE 141 Ca 0.05 -0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.55 3hy1 h ILE 141 Cb 0.32 0.63 -0.05 0.00 -3.07 0.00 0.00 36.82 34.65 3hy1 h ILE 141 CO 0.00 0.00 0.58 -0.50 -0.69 0.00 0.00 178.15 177.55 3hy1 h TRP 142 N 0.01 1.07 -0.01 1.37 4.06 -1.24 0.15 115.95 121.36 3hy1 h TRP 142 Ca 0.18 0.03 -0.25 0.00 2.06 0.00 0.00 58.89 60.91 3hy1 h TRP 142 Cb 0.27 -0.36 0.01 0.00 -1.00 0.00 0.00 29.16 28.08 3hy1 h TRP 142 CO -0.33 0.63 -0.98 1.49 -3.56 0.00 0.00 178.44 175.70 3hy1 h GLU 143 N 1.12 0.59 0.00 0.49 4.81 -0.38 -1.70 114.58 119.51 3hy1 h GLU 143 Ca 0.35 -0.62 -0.26 0.00 -0.13 0.00 0.00 59.36 58.70 3hy1 h GLU 143 Cb -0.01 0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 3hy1 h GLU 143 CO -0.10 1.23 -1.88 1.17 -0.73 0.00 0.00 179.01 178.70 3hy1 n LYS 144 N -3.82 0.35 -0.03 1.92 4.81 0.11 -3.39 118.16 118.11 3hy1 n LYS 144 Ca -0.09 0.13 -0.16 0.00 -0.87 0.00 0.00 58.31 57.32 3hy1 n LYS 144 Cb 0.85 -1.14 -0.13 0.00 0.02 0.00 0.00 35.03 34.63 3hy1 n LYS 144 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 3hy1 h GLU 145 N -0.40 0.10 0.06 1.64 4.39 -1.15 -3.36 114.58 115.86 3hy1 h GLU 145 Ca -0.39 -0.17 -0.24 0.00 0.34 0.00 0.00 59.36 58.90 3hy1 h GLU 145 Cb 1.40 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 30.11 3hy1 h GLU 145 CO -0.19 1.08 -1.08 0.28 -1.16 0.00 0.00 179.01 177.94 3hy1 h VAL 146 N -0.78 1.51 -3.76 3.13 2.07 -1.33 -3.49 116.25 113.61 3hy1 h VAL 146 Ca -0.07 -2.92 0.00 0.00 0.82 0.00 0.00 66.70 64.53 3hy1 h VAL 146 Cb 1.24 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 33.75 3hy1 h VAL 146 CO 0.04 0.85 -0.02 0.61 0.02 0.00 0.00 177.57 179.08 3hy1 n GLY 147 N 1.27 -0.63 3.21 2.17 0.00 -0.86 -5.01 105.19 105.34 3hy1 n GLY 147 Ca -0.06 0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 3hy1 n GLY 147 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3hy1 s ILE 148 N -2.85 1.53 0.32 -0.61 2.07 -0.70 -5.00 121.20 115.96 3hy1 s ILE 148 Ca 0.01 -0.97 -0.29 0.00 -1.41 0.00 0.00 60.65 57.99 3hy1 s ILE 148 Cb -0.00 -1.30 -0.12 0.00 0.13 0.00 0.00 42.46 41.17 3hy1 s ILE 148 CO 0.24 0.31 1.44 -0.81 -1.91 0.00 0.00 174.94 174.21 3hy1 n PRO 149 N 2.28 2.38 -0.12 3.50 -0.04 -1.26 -4.48 135.00 137.26 3hy1 n PRO 149 Ca -0.16 0.84 0.04 0.00 -0.04 0.00 0.00 63.50 64.18 3hy1 n PRO 149 Cb 0.53 -2.52 0.36 0.00 -0.04 0.00 0.00 33.50 31.84 3hy1 n PRO 149 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hy1 h ARG 150 N 3.54 0.71 -0.19 0.54 3.08 -1.96 -1.73 114.38 118.38 3hy1 h ARG 150 Ca -0.47 -0.04 0.06 0.00 0.07 0.00 0.00 59.98 59.59 3hy1 h ARG 150 Cb 1.26 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 3hy1 h ARG 150 CO 0.70 0.47 0.17 1.05 -1.07 0.00 0.00 179.97 181.29 3hy1 h GLU 151 N 0.73 0.00 -0.36 0.04 9.09 -2.03 -1.09 114.58 120.96 3hy1 h GLU 151 Ca 0.24 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.65 3hy1 h GLU 151 Cb 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.16 3hy1 h GLU 151 CO -0.06 0.00 0.00 0.54 0.05 0.00 0.00 179.01 179.54 3hy1 n ARG 152 N -4.05 3.15 -3.66 1.06 1.74 -0.66 -4.84 116.66 109.40 3hy1 n ARG 152 Ca 0.02 -2.63 -0.38 0.00 -0.77 0.00 0.00 57.85 54.08 3hy1 n ARG 152 Cb 0.30 -1.71 -0.12 0.00 -1.02 0.00 0.00 32.46 29.92 3hy1 n ARG 152 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3hy1 s ILE 153 N -2.14 4.63 -0.27 0.55 1.01 -0.41 -2.14 121.20 122.43 3hy1 s ILE 153 Ca 0.39 -0.31 -0.07 0.00 0.00 0.00 0.00 60.65 60.65 3hy1 s ILE 153 Cb 0.28 -3.31 -0.01 0.00 0.01 0.00 0.00 42.46 39.43 3hy1 s ILE 153 CO 0.14 0.14 0.07 -0.63 0.00 0.00 0.00 174.94 174.65 3hy1 s ILE 154 N 1.63 4.17 0.16 2.92 1.01 0.39 -4.97 121.20 126.51 3hy1 s ILE 154 Ca 0.05 -0.37 -0.30 0.00 0.00 0.00 0.00 60.65 60.03 3hy1 s ILE 154 Cb -0.17 -3.02 -0.07 0.00 0.01 0.00 0.00 42.46 39.21 3hy1 s ILE 154 CO 0.06 0.24 1.19 -0.13 0.00 0.00 0.00 174.94 176.30 3hy1 s ARG 155 N 1.57 4.49 0.12 2.79 0.52 -1.26 -1.58 118.95 125.60 3hy1 s ARG 155 Ca 0.05 1.84 0.04 0.00 -0.52 0.00 0.00 55.73 57.14 3hy1 s ARG 155 Cb -0.16 -3.27 -0.04 0.00 0.52 0.00 0.00 34.95 32.01 3hy1 s ARG 155 CO 0.03 -0.11 -0.10 0.42 0.02 0.00 0.00 175.30 175.57 3hy1 s ILE 156 N 0.16 1.03 0.34 1.52 -1.09 0.64 -4.86 121.20 118.95 3hy1 s ILE 156 Ca 0.54 -1.87 0.01 0.00 -2.23 0.00 0.00 60.65 57.09 3hy1 s ILE 156 Cb -0.32 -1.63 -0.00 0.00 -1.58 0.00 0.00 42.46 38.93 3hy1 s ILE 156 CO 0.35 -0.68 0.43 0.61 -1.23 0.00 0.00 174.94 174.42 3hy1 n GLY 157 N 0.14 2.33 2.79 6.18 0.00 -1.26 0.15 105.19 115.52 3hy1 n GLY 157 Ca -0.13 -1.68 -0.30 0.00 0.00 0.00 0.00 46.02 43.91 3hy1 n GLY 157 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hy1 n ASP 158 N -1.65 3.97 0.13 1.61 9.92 -1.26 -4.49 116.55 124.77 3hy1 n ASP 158 Ca 0.02 -2.45 0.01 0.00 -0.53 0.00 0.00 54.79 51.84 3hy1 n ASP 158 Cb 0.58 -1.10 0.32 0.00 -0.64 0.00 0.00 41.12 40.29 3hy1 n ASP 158 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 3hy1 h ASN 159 N 6.90 0.17 0.14 -2.24 -1.07 -1.83 -1.80 115.58 115.86 3hy1 h ASN 159 Ca 0.46 -0.05 0.00 0.00 0.07 0.00 0.00 56.30 56.78 3hy1 h ASN 159 Cb 0.35 -0.05 0.00 0.00 -2.07 0.00 0.00 38.32 36.55 3hy1 h ASN 159 CO 1.63 0.47 0.00 0.11 0.07 0.00 0.00 177.43 179.71 3hy1 h LYS 160 N 0.15 0.00 0.00 4.14 1.57 -1.15 -3.46 116.57 117.82 3hy1 h LYS 160 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3hy1 h LYS 160 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 3hy1 h LYS 160 CO 0.04 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.33 3hy1 n GLY 161 N -1.05 2.06 3.66 3.86 0.00 -0.68 -4.99 105.19 108.05 3hy1 n GLY 161 Ca -0.01 -0.48 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 3hy1 n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hy1 s ALA 162 N -0.24 0.96 0.19 4.61 0.00 -1.26 -4.93 121.76 121.09 3hy1 s ALA 162 Ca 0.00 -0.11 -0.31 0.00 0.00 0.00 0.00 51.96 51.54 3hy1 s ALA 162 Cb 0.00 -3.20 -0.10 0.00 0.00 0.00 0.00 23.12 19.81 3hy1 s ALA 162 CO 0.00 -2.83 1.58 -1.25 0.00 0.00 0.00 175.76 173.26 3hy1 s PRO 163 N -4.82 4.20 -0.06 0.00 0.04 -1.26 -2.15 135.00 130.94 3hy1 s PRO 163 Ca 0.65 2.42 0.00 0.00 0.04 0.00 0.00 61.00 64.11 3hy1 s PRO 163 Cb -0.20 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.22 3hy1 s PRO 163 CO 0.59 -0.62 0.00 0.66 0.04 0.00 0.00 177.00 177.67 3hy1 n TYR 164 N 3.66 0.00 -3.19 0.56 4.01 -1.26 -4.96 117.16 115.97 3hy1 n TYR 164 Ca 0.13 0.00 -0.46 0.00 -0.16 0.00 0.00 57.90 57.41 3hy1 n TYR 164 Cb 0.38 -1.01 -0.03 0.00 -0.31 0.00 0.00 39.34 38.37 3hy1 n TYR 164 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hy1 s ALA 165 N -1.57 3.72 0.08 -0.72 0.00 -0.91 -4.77 121.76 117.58 3hy1 s ALA 165 Ca 0.00 -2.83 -0.08 0.00 0.00 0.00 0.00 51.96 49.05 3hy1 s ALA 165 Cb 0.00 -3.59 -0.00 0.00 0.00 0.00 0.00 23.12 19.53 3hy1 s ALA 165 CO 0.00 -2.40 0.18 0.45 0.00 0.00 0.00 175.76 173.99 3hy1 s SER 166 N 3.02 0.14 0.49 0.00 0.15 -1.26 -0.72 113.70 115.51 3hy1 s SER 166 Ca 0.17 -0.66 0.27 0.00 0.70 0.00 0.00 55.95 56.43 3hy1 s SER 166 Cb -0.15 0.33 1.14 0.00 -1.71 0.00 0.00 66.02 65.62 3hy1 s SER 166 CO -0.04 -0.72 1.91 0.44 1.20 0.00 0.00 173.24 176.04 3hy1 h ASP 167 N 2.80 0.00 -0.31 5.45 3.32 -1.95 -3.19 116.42 122.54 3hy1 h ASP 167 Ca -0.34 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.57 3hy1 h ASP 167 Cb 1.20 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.66 3hy1 h ASP 167 CO 0.57 0.15 -0.11 0.59 -1.72 0.00 0.00 179.24 178.71 3hy1 n ASN 168 N -3.34 2.52 -3.84 6.45 4.13 -1.26 -4.89 115.26 115.03 3hy1 n ASN 168 Ca -0.00 -3.71 -0.12 0.00 1.68 0.00 0.00 54.58 52.43 3hy1 n ASN 168 Cb 0.36 -0.61 -0.13 0.00 -1.54 0.00 0.00 39.78 37.86 3hy1 n ASN 168 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3hy1 s PHE 169 N -3.20 -0.11 0.04 3.10 5.36 -1.21 -0.28 117.98 121.68 3hy1 s PHE 169 Ca 0.44 0.26 0.05 0.00 -0.96 0.00 0.00 56.93 56.71 3hy1 s PHE 169 Cb 0.39 0.04 -0.02 0.00 -0.34 0.00 0.00 43.02 43.09 3hy1 s PHE 169 CO -0.00 -0.05 -0.14 -0.46 -1.46 0.00 0.00 175.22 173.11 3hy1 s TRP 170 N 0.05 1.19 -0.02 10.12 -0.00 -0.16 -4.43 118.94 125.69 3hy1 s TRP 170 Ca -0.00 -0.36 -0.01 0.00 -0.00 0.00 0.00 56.10 55.74 3hy1 s TRP 170 Cb -0.01 -0.70 0.02 0.00 -0.00 0.00 0.00 33.47 32.78 3hy1 s TRP 170 CO 0.00 0.03 0.04 -0.65 -0.00 0.00 0.00 176.95 176.37 3hy1 s GLN 171 N -1.16 0.00 0.20 5.86 -0.21 -1.26 -1.75 119.66 121.35 3hy1 s GLN 171 Ca 0.01 0.13 0.01 0.00 0.02 0.00 0.00 55.36 55.53 3hy1 s GLN 171 Cb -0.08 -0.11 0.15 0.00 1.00 0.00 0.00 33.01 33.96 3hy1 s GLN 171 CO 0.01 -0.09 1.50 1.98 -2.12 0.00 0.00 175.29 176.57 3hy1 h MET 172 N 6.71 0.34 0.00 2.91 1.85 -1.81 -3.48 114.93 121.45 3hy1 h MET 172 Ca -0.35 -0.25 0.00 0.00 -0.61 0.00 0.00 59.70 58.49 3hy1 h MET 172 Cb 1.17 0.04 0.00 0.00 0.43 0.00 0.00 31.60 33.24 3hy1 h MET 172 CO 0.48 0.88 0.00 0.41 -0.40 0.00 0.00 176.91 178.28 3hy1 n GLY 173 N 0.40 3.31 0.14 1.39 0.00 -1.26 -5.01 105.19 104.16 3hy1 n GLY 173 Ca -0.03 -0.61 -0.03 0.00 0.00 0.00 0.00 46.02 45.34 3hy1 n GLY 173 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hy1 h ASP 174 N 0.00 0.10 -4.57 1.61 3.45 -1.98 -3.45 116.42 111.58 3hy1 h ASP 174 Ca 0.00 -0.06 -0.32 0.00 0.43 0.00 0.00 57.03 57.08 3hy1 h ASP 174 Cb 0.00 -0.03 -0.20 0.00 -0.56 0.00 0.00 39.33 38.54 3hy1 h ASP 174 CO 0.00 0.73 -0.74 0.42 -1.57 0.00 0.00 179.24 178.08 3hy1 s THR 175 N -3.56 0.80 0.00 0.35 -4.23 -1.26 -4.90 115.64 102.84 3hy1 s THR 175 Ca -0.02 -1.36 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 3hy1 s THR 175 Cb 0.12 -1.01 0.00 0.00 1.34 0.00 0.00 72.50 72.95 3hy1 s THR 175 CO 0.78 -0.43 0.00 0.61 -0.54 0.00 0.00 174.62 175.04 3hy1 n GLY 176 N 1.05 -0.14 3.57 3.99 0.00 -0.54 -4.85 105.19 108.27 3hy1 n GLY 176 Ca -0.20 -2.24 -0.49 0.00 0.00 0.00 0.00 46.02 43.10 3hy1 n GLY 176 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hy1 n PRO 177 N 0.00 1.12 -3.81 1.61 -0.02 -1.25 -1.74 135.00 130.91 3hy1 n PRO 177 Ca 0.00 0.40 -0.05 0.00 -2.02 0.00 0.00 63.50 61.83 3hy1 n PRO 177 Cb 0.00 -1.87 -0.01 0.00 -0.02 0.00 0.00 33.50 31.61 3hy1 n PRO 177 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hy1 n GLY 179 N -0.50 0.12 3.79 0.00 0.00 -0.72 -0.84 105.19 107.04 3hy1 n GLY 179 Ca -0.05 -1.30 -0.31 0.00 0.00 0.00 0.00 46.02 44.36 3hy1 n GLY 179 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hy1 s PRO 180 N -1.95 2.47 0.18 1.61 0.04 -1.24 -0.99 135.00 135.11 3hy1 s PRO 180 Ca 0.00 1.04 0.07 0.00 0.04 0.00 0.00 61.00 62.15 3hy1 s PRO 180 Cb 0.00 -1.93 -0.05 0.00 0.04 0.00 0.00 34.50 32.56 3hy1 s PRO 180 CO 0.00 -1.46 -0.13 0.00 0.04 0.00 0.00 177.00 175.45 3hy1 s THR 182 N -3.09 0.70 0.07 0.00 -1.32 -0.70 -3.46 115.64 107.84 3hy1 s THR 182 Ca 0.20 -0.23 0.07 0.00 -1.21 0.00 0.00 61.69 60.52 3hy1 s THR 182 Cb 0.00 -0.68 -0.04 0.00 -1.51 0.00 0.00 72.50 70.28 3hy1 s THR 182 CO 0.04 0.25 -0.14 -1.61 -2.21 0.00 0.00 174.62 170.96 3hy1 s GLU 183 N 0.76 2.12 -0.17 7.08 2.02 -0.85 -0.99 118.70 128.67 3hy1 s GLU 183 Ca -0.12 -0.98 -0.02 0.00 0.02 0.00 0.00 54.97 53.87 3hy1 s GLU 183 Cb -0.14 -2.26 -0.01 0.00 0.10 0.00 0.00 34.13 31.81 3hy1 s GLU 183 CO 0.01 0.53 -0.08 0.42 0.02 0.00 0.00 175.26 176.16 3hy1 s ILE 184 N -1.06 3.33 0.07 -1.63 1.01 0.13 -1.53 121.20 121.51 3hy1 s ILE 184 Ca 0.18 -0.54 0.05 0.00 0.00 0.00 0.00 60.65 60.33 3hy1 s ILE 184 Cb -0.11 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 3hy1 s ILE 184 CO 0.09 0.48 -0.03 -0.36 0.00 0.00 0.00 174.94 175.11 3hy1 s PHE 185 N 0.82 2.93 -0.10 3.97 0.40 0.15 -0.36 117.98 125.78 3hy1 s PHE 185 Ca -0.03 -0.04 0.02 0.00 -0.60 0.00 0.00 56.93 56.28 3hy1 s PHE 185 Cb -0.15 -1.54 -0.01 0.00 0.51 0.00 0.00 43.02 41.82 3hy1 s PHE 185 CO 0.01 0.45 -0.16 -0.47 0.70 0.00 0.00 175.22 175.75 3hy1 s TYR 186 N -1.20 2.72 -0.21 0.36 5.04 -0.71 -0.50 117.35 122.85 3hy1 s TYR 186 Ca 0.22 -0.62 -0.22 0.00 -2.44 0.00 0.00 57.07 54.02 3hy1 s TYR 186 Cb -0.11 -1.76 -0.02 0.00 0.35 0.00 0.00 41.96 40.41 3hy1 s TYR 186 CO 0.14 -0.17 0.67 0.34 -1.34 0.00 0.00 175.55 175.20 3hy1 s ASP 187 N 0.10 6.72 0.00 4.32 -1.08 -1.09 -1.97 116.67 123.67 3hy1 s ASP 187 Ca -0.07 0.88 0.00 0.00 -0.52 0.00 0.00 52.55 52.83 3hy1 s ASP 187 Cb -0.15 -2.37 0.00 0.00 -1.46 0.00 0.00 42.92 38.94 3hy1 s ASP 187 CO 0.05 -0.32 0.35 1.41 0.52 0.00 0.00 175.17 177.18 3hy1 n HIS 188 N 5.25 0.00 0.03 -5.34 8.25 -1.26 -4.95 115.22 117.20 3hy1 n HIS 188 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.45 3hy1 n HIS 188 Cb 0.49 -0.04 -0.00 0.00 1.12 0.00 0.00 29.99 31.56 3hy1 n HIS 188 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 3hy1 n ARG 206 N -0.63 0.03 -2.74 -0.41 0.63 -1.26 -5.20 116.66 107.08 3hy1 n ARG 206 Ca 0.00 0.01 -0.43 0.00 -0.92 0.00 0.00 57.85 56.51 3hy1 n ARG 206 Cb 0.00 -0.44 -0.03 0.00 0.45 0.00 0.00 32.46 32.44 3hy1 n ARG 206 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 3hy1 s TYR 207 N -1.79 2.92 -0.04 -0.14 2.02 -1.26 -4.88 117.35 114.19 3hy1 s TYR 207 Ca -0.02 0.58 0.03 0.00 -0.37 0.00 0.00 57.07 57.29 3hy1 s TYR 207 Cb 0.00 -4.05 -0.03 0.00 -0.40 0.00 0.00 41.96 37.48 3hy1 s TYR 207 CO 0.03 -1.09 -0.12 0.96 -1.57 0.00 0.00 175.55 173.76 3hy1 s ILE 208 N 3.92 3.28 0.17 2.71 -4.36 -0.83 -4.88 121.20 121.21 3hy1 s ILE 208 Ca 0.41 -0.72 -0.32 0.00 -0.26 0.00 0.00 60.65 59.76 3hy1 s ILE 208 Cb -0.10 -2.33 -0.11 0.00 1.25 0.00 0.00 42.46 41.18 3hy1 s ILE 208 CO 0.26 0.54 1.65 -1.61 0.24 0.00 0.00 174.94 176.02 3hy1 s GLU 209 N -0.93 4.17 -0.07 0.37 2.02 -1.26 -1.75 118.70 121.25 3hy1 s GLU 209 Ca 0.13 2.47 0.01 0.00 0.02 0.00 0.00 54.97 57.59 3hy1 s GLU 209 Cb -0.11 -3.19 -0.05 0.00 0.10 0.00 0.00 34.13 30.88 3hy1 s GLU 209 CO 0.02 -0.69 -0.06 -0.89 0.02 0.00 0.00 175.26 173.66 3hy1 n ILE 210 N 4.10 0.41 -3.67 -1.63 2.08 0.51 -4.94 119.36 116.22 3hy1 n ILE 210 Ca 0.15 -0.16 -0.11 0.00 0.56 0.00 0.00 62.75 63.19 3hy1 n ILE 210 Cb 0.37 -0.76 -0.12 0.00 -0.75 0.00 0.00 39.64 38.39 3hy1 n ILE 210 CO 0.00 0.00 0.00 0.86 0.56 0.00 0.00 176.55 177.97 3hy1 s TRP 211 N -2.14 -0.58 -0.17 1.39 -0.11 -1.15 -4.02 118.94 112.15 3hy1 s TRP 211 Ca -0.10 1.21 -0.06 0.00 1.22 0.00 0.00 56.10 58.37 3hy1 s TRP 211 Cb 0.02 0.13 -0.04 0.00 -1.50 0.00 0.00 33.47 32.09 3hy1 s TRP 211 CO 0.17 -0.39 0.05 1.21 -4.62 0.00 0.00 176.95 173.36 3hy1 s ASN 212 N 2.31 5.50 -0.27 5.86 2.47 0.17 -0.70 114.94 130.30 3hy1 s ASN 212 Ca -0.02 0.07 0.02 0.00 0.42 0.00 0.00 52.86 53.35 3hy1 s ASN 212 Cb -0.12 -1.91 0.07 0.00 -1.45 0.00 0.00 41.25 37.85 3hy1 s ASN 212 CO -0.11 0.20 -0.02 -0.63 -3.72 0.00 0.00 177.10 172.82 3hy1 s ILE 213 N 0.22 1.68 -0.18 -5.21 1.01 -0.16 0.34 121.20 118.90 3hy1 s ILE 213 Ca 0.03 -1.54 -0.20 0.00 0.00 0.00 0.00 60.65 58.94 3hy1 s ILE 213 Cb -0.13 -2.03 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 3hy1 s ILE 213 CO 0.01 -0.27 0.60 -0.69 0.00 0.00 0.00 174.94 174.59 3hy1 s VAL 214 N 1.28 5.05 -0.27 2.92 1.01 0.28 -1.72 120.40 128.96 3hy1 s VAL 214 Ca -0.01 1.14 -0.10 0.00 0.00 0.00 0.00 61.98 63.02 3hy1 s VAL 214 Cb -0.19 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 3hy1 s VAL 214 CO -0.09 0.15 0.15 -0.36 0.00 0.00 0.00 175.10 174.95 3hy1 s PHE 215 N 1.69 3.18 -1.04 5.22 0.08 -0.83 -1.03 117.98 125.24 3hy1 s PHE 215 Ca 0.28 -0.05 -0.15 0.00 0.12 0.00 0.00 56.93 57.14 3hy1 s PHE 215 Cb -0.16 -2.34 0.19 0.00 -0.57 0.00 0.00 43.02 40.14 3hy1 s PHE 215 CO 0.11 -0.22 1.17 -1.64 -0.10 0.00 0.00 175.22 174.54 3hy1 s MET 216 N 1.72 3.88 -0.04 0.44 -1.94 -0.68 -3.45 119.30 119.23 3hy1 s MET 216 Ca 0.07 -2.42 -0.09 0.00 -1.71 0.00 0.00 55.69 51.54 3hy1 s MET 216 Cb -0.16 -4.82 -0.30 0.00 2.01 0.00 0.00 34.83 31.56 3hy1 s MET 216 CO 0.09 -1.60 0.72 1.96 -0.01 0.00 0.00 175.02 176.18 3hy1 h GLN 217 N 7.69 0.36 -6.21 2.03 4.20 -1.28 -3.03 115.11 118.88 3hy1 h GLN 217 Ca 0.21 -0.61 -0.60 0.00 0.06 0.00 0.00 58.65 57.70 3hy1 h GLN 217 Cb 0.95 0.23 -0.14 0.00 0.30 0.00 0.00 27.48 28.81 3hy1 h GLN 217 CO 1.08 1.26 -0.76 -0.06 -0.67 0.00 0.00 178.83 179.68 3hy1 s PHE 218 N -2.59 2.26 -0.48 2.96 0.08 -0.18 0.15 117.98 120.18 3hy1 s PHE 218 Ca -0.14 -0.35 0.01 0.00 0.12 0.00 0.00 56.93 56.57 3hy1 s PHE 218 Cb 0.06 -0.99 0.13 0.00 -0.57 0.00 0.00 43.02 41.64 3hy1 s PHE 218 CO 0.86 0.68 0.24 1.21 -0.10 0.00 0.00 175.22 178.11 3hy1 s ASN 219 N -3.42 4.84 0.00 1.36 2.47 0.19 -0.94 114.94 119.43 3hy1 s ASN 219 Ca 0.29 -2.58 -0.30 0.00 0.42 0.00 0.00 52.86 50.69 3hy1 s ASN 219 Cb -0.05 -1.73 -0.07 0.00 -1.45 0.00 0.00 41.25 37.95 3hy1 s ASN 219 CO 0.14 -0.36 1.79 -0.60 -3.72 0.00 0.00 177.10 174.35 3hy1 s ARG 220 N 0.33 4.17 0.83 0.43 3.52 -0.71 -2.74 118.95 124.77 3hy1 s ARG 220 Ca 0.14 2.39 -0.12 0.00 -0.13 0.00 0.00 55.73 58.01 3hy1 s ARG 220 Cb -0.22 -4.01 0.09 0.00 -1.56 0.00 0.00 34.95 29.24 3hy1 s ARG 220 CO -0.04 -0.88 1.15 -0.65 -0.81 0.00 0.00 175.30 174.08 3hy1 s GLN 221 N 4.05 1.84 0.59 5.12 -1.52 0.13 -1.47 119.66 128.41 3hy1 s GLN 221 Ca 0.80 0.23 0.29 0.00 -1.95 0.00 0.00 55.36 54.73 3hy1 s GLN 221 Cb -0.38 -1.93 1.72 0.00 -0.22 0.00 0.00 33.01 32.20 3hy1 s GLN 221 CO 0.35 -1.70 2.16 0.00 -0.25 0.00 0.00 175.29 175.84 3hy1 h ALA 222 N -1.14 1.70 -0.01 6.09 0.00 -1.92 -0.30 119.26 123.68 3hy1 h ALA 222 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3hy1 h ALA 222 Cb 1.32 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3hy1 h ALA 222 CO 0.64 -0.19 -0.38 -0.40 0.00 0.00 0.00 179.25 178.92 3hy1 n ASP 223 N -3.81 1.27 0.00 0.00 3.85 -1.26 -4.94 116.55 111.66 3hy1 n ASP 223 Ca -0.00 -1.03 0.00 0.00 -0.71 0.00 0.00 54.79 53.05 3hy1 n ASP 223 Cb 0.23 0.29 0.00 0.00 -1.35 0.00 0.00 41.12 40.30 3hy1 n ASP 223 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3hy1 n GLY 224 N 1.39 0.51 3.73 6.12 0.00 -0.12 -5.07 105.19 111.74 3hy1 n GLY 224 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 3hy1 n GLY 224 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hy1 s THR 225 N -2.00 2.90 -0.97 2.61 2.01 -1.26 -4.67 115.64 114.26 3hy1 s THR 225 Ca 0.00 0.71 -0.14 0.00 0.31 0.00 0.00 61.69 62.58 3hy1 s THR 225 Cb 0.00 -3.46 0.21 0.00 0.01 0.00 0.00 72.50 69.26 3hy1 s THR 225 CO 0.00 0.09 1.01 -0.04 -0.69 0.00 0.00 174.62 174.99 3hy1 s MET 226 N 0.15 3.81 -0.36 4.92 -1.94 -1.26 0.21 119.30 124.83 3hy1 s MET 226 Ca 0.61 -2.51 -0.29 0.00 -1.71 0.00 0.00 55.69 51.79 3hy1 s MET 226 Cb -0.40 -4.64 0.00 0.00 2.01 0.00 0.00 34.83 31.80 3hy1 s MET 226 CO 0.38 -1.44 1.45 -1.21 -0.01 0.00 0.00 175.02 174.19 3hy1 s GLU 227 N 0.54 3.64 0.19 2.03 2.02 -1.11 -4.82 118.70 121.20 3hy1 s GLU 227 Ca 0.27 1.13 -0.33 0.00 0.02 0.00 0.00 54.97 56.07 3hy1 s GLU 227 Cb -0.08 -4.01 -0.13 0.00 0.10 0.00 0.00 34.13 30.01 3hy1 s GLU 227 CO -0.08 -1.48 1.64 -2.30 0.02 0.00 0.00 175.26 173.06 3hy1 n PRO 228 N 7.91 2.45 -2.02 0.39 -0.02 -1.26 0.52 135.00 142.97 3hy1 n PRO 228 Ca 0.17 0.88 -0.42 0.00 -2.02 0.00 0.00 63.50 62.11 3hy1 n PRO 228 Cb 0.47 -2.68 -0.03 0.00 -0.02 0.00 0.00 33.50 31.24 3hy1 n PRO 228 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3hy1 s LEU 229 N 0.95 4.36 0.43 2.45 1.43 0.40 -4.81 118.68 123.89 3hy1 s LEU 229 Ca 0.76 2.44 0.18 0.00 -1.03 0.00 0.00 54.13 56.47 3hy1 s LEU 229 Cb -0.59 -3.58 1.09 0.00 0.03 0.00 0.00 46.19 43.14 3hy1 s LEU 229 CO 0.36 -0.79 1.88 1.55 0.23 0.00 0.00 176.35 179.58 3hy1 h PRO 230 N 7.47 0.38 -1.19 1.29 0.13 -1.91 -3.35 132.00 134.82 3hy1 h PRO 230 Ca -0.42 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3hy1 h PRO 230 Cb 1.20 -0.09 -0.23 0.00 0.13 0.00 0.00 31.00 32.02 3hy1 h PRO 230 CO 0.91 0.25 -0.37 -1.59 -0.23 0.00 0.00 178.00 176.96 3hy1 s LYS 231 N -5.40 0.52 0.44 0.86 -2.85 -1.26 -5.18 119.74 106.88 3hy1 s LYS 231 Ca -0.08 0.66 -0.05 0.00 -1.00 0.00 0.00 55.97 55.50 3hy1 s LYS 231 Cb 0.22 0.21 0.10 0.00 -2.06 0.00 0.00 37.83 36.30 3hy1 s LYS 231 CO 0.78 -0.85 0.61 -0.35 0.10 0.00 0.00 175.35 175.63 3hy1 n PRO 232 N 5.41 -0.26 -4.46 1.78 -0.04 -1.26 -4.42 135.00 131.76 3hy1 n PRO 232 Ca 0.01 -1.20 -0.23 0.00 -0.04 0.00 0.00 63.50 62.04 3hy1 n PRO 232 Cb 0.52 -0.54 -0.09 0.00 -0.04 0.00 0.00 33.50 33.35 3hy1 n PRO 232 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 3hy1 s SER 233 N -3.31 2.36 -0.01 3.54 0.01 -1.14 -2.85 113.70 112.31 3hy1 s SER 233 Ca 0.36 -1.53 0.02 0.00 1.31 0.00 0.00 55.95 56.11 3hy1 s SER 233 Cb -0.01 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.47 3hy1 s SER 233 CO 0.25 -0.79 -0.05 -0.69 0.41 0.00 0.00 173.24 172.37 3hy1 s VAL 234 N -3.33 0.41 -0.04 3.43 1.01 -0.67 -1.69 120.40 119.51 3hy1 s VAL 234 Ca 0.31 -0.20 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 3hy1 s VAL 234 Cb 0.06 -0.37 0.03 0.00 0.00 0.00 0.00 36.38 36.10 3hy1 s VAL 234 CO 0.15 0.13 0.04 -0.62 0.00 0.00 0.00 175.10 174.80 3hy1 s ASP 235 N 0.04 0.98 0.26 3.32 2.15 -0.20 -2.03 116.67 121.20 3hy1 s ASP 235 Ca -0.00 0.03 0.12 0.00 0.43 0.00 0.00 52.55 53.13 3hy1 s ASP 235 Cb -0.04 -0.20 -0.05 0.00 -0.30 0.00 0.00 42.92 42.34 3hy1 s ASP 235 CO -0.00 -0.20 -0.20 0.42 -0.17 0.00 0.00 175.17 175.01 3hy1 s THR 236 N 1.83 2.41 -0.10 1.71 -4.23 -0.98 0.10 115.64 116.38 3hy1 s THR 236 Ca 0.01 -2.33 -0.04 0.00 -1.18 0.00 0.00 61.69 58.15 3hy1 s THR 236 Cb -0.12 -2.25 0.05 0.00 1.34 0.00 0.00 72.50 71.52 3hy1 s THR 236 CO -0.03 -0.36 0.20 0.00 -0.54 0.00 0.00 174.62 173.88 3hy1 s ALA 237 N -2.39 -0.30 -0.09 3.99 0.00 0.15 -3.99 121.76 119.13 3hy1 s ALA 237 Ca 0.28 0.70 0.01 0.00 0.00 0.00 0.00 51.96 52.95 3hy1 s ALA 237 Cb -0.05 -0.88 0.02 0.00 0.00 0.00 0.00 23.12 22.21 3hy1 s ALA 237 CO 0.14 -0.58 -0.12 1.41 0.00 0.00 0.00 175.76 176.61 3hy1 s MET 238 N 2.30 1.83 0.05 0.00 -2.45 0.25 -0.65 119.30 120.62 3hy1 s MET 238 Ca 0.02 -0.42 -0.31 0.00 -1.25 0.00 0.00 55.69 53.73 3hy1 s MET 238 Cb -0.12 -1.60 -0.06 0.00 1.25 0.00 0.00 34.83 34.30 3hy1 s MET 238 CO -0.07 -0.07 1.23 0.20 1.05 0.00 0.00 175.02 177.36 3hy1 s GLY 239 N 1.01 2.30 0.12 2.11 0.00 -1.26 0.17 107.32 111.77 3hy1 s GLY 239 Ca -0.07 0.85 -0.13 0.00 0.00 0.00 0.00 44.72 45.37 3hy1 s GLY 239 CO -0.01 2.12 1.46 -2.00 0.00 0.00 0.00 173.10 174.66 3hy1 h LEU 240 N 7.06 0.89 -0.54 0.66 5.85 -1.70 -2.83 115.31 124.70 3hy1 h LEU 240 Ca -0.41 -0.46 -0.13 0.00 0.84 0.00 0.00 57.88 57.73 3hy1 h LEU 240 Cb 1.21 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 3hy1 h LEU 240 CO 0.83 1.16 -0.22 -0.33 -0.34 0.00 0.00 178.44 179.55 3hy1 h GLU 241 N 0.62 0.95 0.13 1.25 3.07 -1.92 -1.55 114.58 117.13 3hy1 h GLU 241 Ca 0.06 -0.40 0.00 0.00 -0.50 0.00 0.00 59.36 58.52 3hy1 h GLU 241 Cb 0.90 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.77 3hy1 h GLU 241 CO 0.08 1.07 -0.11 0.00 -1.40 0.00 0.00 179.01 178.65 3hy1 h ARG 242 N 0.82 -0.25 0.00 2.33 2.47 -1.94 -1.15 114.38 116.67 3hy1 h ARG 242 Ca 0.11 0.02 -0.12 0.00 -1.26 0.00 0.00 59.98 58.73 3hy1 h ARG 242 Cb 0.78 0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 29.14 3hy1 h ARG 242 CO 0.06 -0.17 -0.55 0.97 0.56 0.00 0.00 179.97 180.85 3hy1 h ILE 243 N -0.26 1.34 -0.42 2.04 6.09 -1.50 -2.69 117.51 122.11 3hy1 h ILE 243 Ca 0.00 -1.93 -0.09 0.00 -1.37 0.00 0.00 64.86 61.46 3hy1 h ILE 243 Cb 0.24 2.06 -0.02 0.00 0.47 0.00 0.00 36.82 39.57 3hy1 h ILE 243 CO -0.02 0.54 -0.12 0.00 -3.07 0.00 0.00 178.15 175.48 3hy1 h ALA 244 N 1.45 0.99 -0.17 0.18 0.00 -1.08 0.55 119.26 121.18 3hy1 h ALA 244 Ca -0.01 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 3hy1 h ALA 244 Cb 1.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3hy1 h ALA 244 CO 0.07 0.60 -0.24 0.00 0.00 0.00 0.00 179.25 179.68 3hy1 h ALA 245 N 1.17 1.28 -0.00 0.00 0.00 -0.90 -0.39 119.26 120.42 3hy1 h ALA 245 Ca 0.11 -0.30 -0.20 0.00 0.00 0.00 0.00 54.91 54.53 3hy1 h ALA 245 Cb 0.60 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.31 3hy1 h ALA 245 CO 0.04 0.48 -0.76 0.28 0.00 0.00 0.00 179.25 179.29 3hy1 h VAL 246 N 0.27 1.37 0.00 0.00 2.07 -1.15 -0.97 116.25 117.84 3hy1 h VAL 246 Ca 0.04 -2.14 0.00 0.00 0.82 0.00 0.00 66.70 65.43 3hy1 h VAL 246 Cb 0.58 2.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 3hy1 h VAL 246 CO 0.04 0.64 0.00 -0.07 0.02 0.00 0.00 177.57 178.20 3hy1 h LEU 247 N 0.09 0.00 -2.20 2.57 3.38 -0.75 -2.90 115.31 115.50 3hy1 h LEU 247 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3hy1 h LEU 247 Cb 1.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.20 3hy1 h LEU 247 CO 0.15 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.68 3hy1 n GLN 248 N -2.94 2.17 -2.33 1.13 6.02 -0.17 -4.30 117.38 116.97 3hy1 n GLN 248 Ca 0.03 -2.01 -0.15 0.00 -0.01 0.00 0.00 57.00 54.86 3hy1 n GLN 248 Cb 0.41 -1.42 -0.00 0.00 1.02 0.00 0.00 30.24 30.25 3hy1 n GLN 248 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3hy1 n HIS 249 N 1.18 -0.77 -4.13 1.08 8.25 -1.02 -5.02 115.22 114.79 3hy1 n HIS 249 Ca 0.15 0.03 -0.23 0.00 -0.26 0.00 0.00 57.72 57.41 3hy1 n HIS 249 Cb 0.52 -3.18 -0.06 0.00 1.12 0.00 0.00 29.99 28.39 3hy1 n HIS 249 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3hy1 s VAL 250 N -2.77 3.07 -0.12 1.59 -7.23 -0.40 -5.04 120.40 109.50 3hy1 s VAL 250 Ca 0.02 -1.73 -0.13 0.00 -1.81 0.00 0.00 61.98 58.33 3hy1 s VAL 250 Cb -0.01 -2.96 -0.26 0.00 0.56 0.00 0.00 36.38 33.71 3hy1 s VAL 250 CO 0.02 -0.21 0.44 0.78 -0.31 0.00 0.00 175.10 175.83 3hy1 h ASN 251 N 1.60 0.35 -2.98 4.85 -0.26 -1.95 -3.40 115.58 113.79 3hy1 h ASN 251 Ca -0.44 -0.84 -0.61 0.00 -0.56 0.00 0.00 56.30 53.85 3hy1 h ASN 251 Cb 1.25 -0.11 -0.04 0.00 -1.06 0.00 0.00 38.32 38.35 3hy1 h ASN 251 CO 0.63 1.70 -0.41 -0.55 -1.06 0.00 0.00 177.43 177.74 3hy1 s SER 252 N -7.03 6.44 0.56 5.81 0.15 -1.26 -4.97 113.70 113.40 3hy1 s SER 252 Ca -0.22 0.45 0.33 0.00 0.70 0.00 0.00 55.95 57.21 3hy1 s SER 252 Cb 0.05 -2.04 1.65 0.00 -1.71 0.00 0.00 66.02 63.97 3hy1 s SER 252 CO 0.75 0.16 2.12 0.78 1.20 0.00 0.00 173.24 178.25 3hy1 h ASN 253 N 3.30 0.00 -0.07 5.45 2.35 -1.57 -2.05 115.58 123.00 3hy1 h ASN 253 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 3hy1 h ASN 253 Cb 1.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.54 3hy1 h ASN 253 CO 0.72 0.07 0.00 -1.22 -1.65 0.00 0.00 177.43 175.34 3hy1 n TYR 254 N -3.38 0.09 -0.60 1.19 4.01 -1.26 -3.18 117.16 114.03 3hy1 n TYR 254 Ca -0.01 -0.04 0.08 0.00 -0.16 0.00 0.00 57.90 57.76 3hy1 n TYR 254 Cb 0.22 0.00 0.25 0.00 -0.31 0.00 0.00 39.34 39.50 3hy1 n TYR 254 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3hy1 n ASP 255 N -0.36 3.79 -4.89 7.72 8.00 -0.77 -3.90 116.55 126.14 3hy1 n ASP 255 Ca 0.14 -2.49 -0.29 0.00 0.71 0.00 0.00 54.79 52.85 3hy1 n ASP 255 Cb 0.15 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.78 3hy1 n ASP 255 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 3hy1 s ILE 256 N -1.90 4.94 0.29 0.53 -4.36 -1.19 -4.82 121.20 114.69 3hy1 s ILE 256 Ca 0.38 0.26 -0.02 0.00 -0.26 0.00 0.00 60.65 61.00 3hy1 s ILE 256 Cb 0.26 -3.73 0.38 0.00 1.25 0.00 0.00 42.46 40.61 3hy1 s ILE 256 CO 0.16 -0.39 1.59 -2.24 0.24 0.00 0.00 174.94 174.30 3hy1 h ASP 257 N 1.55 -0.47 -0.22 4.36 2.03 -1.94 0.38 116.42 122.11 3hy1 h ASP 257 Ca -0.47 0.25 0.06 0.00 -0.73 0.00 0.00 57.03 56.14 3hy1 h ASP 257 Cb 1.19 0.45 -0.07 0.00 -0.83 0.00 0.00 39.33 40.07 3hy1 h ASP 257 CO 0.65 -0.29 -0.28 0.25 -1.03 0.00 0.00 179.24 178.54 3hy1 h LEU 258 N 0.04 -0.91 0.12 0.15 6.46 -1.93 -2.30 115.31 116.95 3hy1 h LEU 258 Ca 0.53 0.15 -0.26 0.00 -0.12 0.00 0.00 57.88 58.18 3hy1 h LEU 258 Cb 1.03 0.41 0.03 0.00 -0.73 0.00 0.00 40.66 41.39 3hy1 h LEU 258 CO -0.85 -0.32 -1.09 -0.26 -0.62 0.00 0.00 178.44 175.31 3hy1 h PHE 259 N -0.30 0.86 -0.63 1.25 -1.00 -1.30 -2.47 116.94 113.35 3hy1 h PHE 259 Ca 0.13 -0.56 0.12 0.00 2.81 0.00 0.00 57.97 60.47 3hy1 h PHE 259 Cb 0.50 -0.06 -0.09 0.00 3.61 0.00 0.00 35.95 39.91 3hy1 h PHE 259 CO -0.42 1.41 0.15 0.00 -1.61 0.00 0.00 178.31 177.84 3hy1 h ARG 260 N 0.08 0.27 -0.45 1.51 3.08 -1.00 1.43 114.38 119.31 3hy1 h ARG 260 Ca -0.17 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 59.80 3hy1 h ARG 260 Cb 1.80 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.77 3hy1 h ARG 260 CO 0.21 0.18 0.02 1.15 -1.07 0.00 0.00 179.97 180.46 3hy1 h THR 261 N 0.28 1.26 -0.28 2.04 2.02 -1.48 -2.37 112.91 114.37 3hy1 h THR 261 Ca 0.34 -1.01 -0.12 0.00 0.77 0.00 0.00 66.41 66.39 3hy1 h THR 261 Cb 0.51 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 3hy1 h THR 261 CO -0.42 0.35 -0.32 0.25 0.37 0.00 0.00 175.52 175.76 3hy1 h LEU 262 N 0.62 0.62 -0.47 2.58 5.85 -0.53 -2.20 115.31 121.78 3hy1 h LEU 262 Ca 0.13 -0.24 -0.09 0.00 0.84 0.00 0.00 57.88 58.52 3hy1 h LEU 262 Cb 0.47 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 3hy1 h LEU 262 CO 0.02 0.90 -0.04 0.40 -0.34 0.00 0.00 178.44 179.38 3hy1 h ILE 263 N 0.51 1.27 -0.39 4.05 2.04 0.19 -2.16 117.51 123.03 3hy1 h ILE 263 Ca 0.06 -1.13 -0.02 0.00 1.00 0.00 0.00 64.86 64.77 3hy1 h ILE 263 Cb 0.80 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 3hy1 h ILE 263 CO 0.07 0.39 0.14 1.56 0.00 0.00 0.00 178.15 180.31 3hy1 h GLN 264 N 0.71 0.55 -0.06 2.37 4.20 -1.26 -1.28 115.11 120.35 3hy1 h GLN 264 Ca 0.13 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.67 3hy1 h GLN 264 Cb 0.56 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 3hy1 h GLN 264 CO 0.03 0.47 -0.40 0.00 -0.67 0.00 0.00 178.83 178.25 3hy1 h ALA 265 N 1.62 1.22 -0.24 3.87 0.00 -1.09 -2.41 119.26 122.23 3hy1 h ALA 265 Ca 0.13 -0.39 -0.17 0.00 0.00 0.00 0.00 54.91 54.49 3hy1 h ALA 265 Cb 0.13 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3hy1 h ALA 265 CO -0.01 0.55 -0.53 0.28 0.00 0.00 0.00 179.25 179.53 3hy1 h VAL 266 N 0.10 1.30 0.00 0.00 2.07 -0.64 -3.02 116.25 116.06 3hy1 h VAL 266 Ca 0.01 -1.75 -0.06 0.00 0.82 0.00 0.00 66.70 65.72 3hy1 h VAL 266 Cb 0.76 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 3hy1 h VAL 266 CO 0.06 0.56 -0.28 0.00 0.02 0.00 0.00 177.57 177.92 3hy1 h ALA 267 N 0.86 1.47 -0.05 1.67 0.00 -0.97 -2.43 119.26 119.81 3hy1 h ALA 267 Ca 0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 3hy1 h ALA 267 Cb 1.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3hy1 h ALA 267 CO 0.11 0.35 -0.10 0.87 0.00 0.00 0.00 179.25 180.48 3hy1 h LYS 268 N 0.00 0.15 0.00 0.00 1.57 -1.35 -0.89 116.57 116.05 3hy1 h LYS 268 Ca -0.00 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 3hy1 h LYS 268 Cb 0.52 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3hy1 h LYS 268 CO 0.04 0.68 0.00 -0.39 -0.57 0.00 0.00 179.45 179.21 3hy1 h VAL 269 N -0.37 0.00 0.00 0.50 -1.51 -1.46 -3.20 116.25 110.22 3hy1 h VAL 269 Ca 0.00 -0.66 -0.12 0.00 -1.23 0.00 0.00 66.70 64.69 3hy1 h VAL 269 Cb 0.68 1.63 -0.02 0.00 -2.13 0.00 0.00 31.29 31.45 3hy1 h VAL 269 CO 0.02 0.00 -2.04 0.35 -1.23 0.00 0.00 177.57 174.67 3hy1 n THR 270 N -2.74 0.44 -2.62 7.19 -2.24 -0.92 -4.75 114.28 108.64 3hy1 n THR 270 Ca 0.04 -0.57 -0.06 0.00 -2.27 0.00 0.00 64.05 61.19 3hy1 n THR 270 Cb 0.43 -0.15 0.02 0.00 -2.10 0.00 0.00 70.33 68.54 3hy1 n THR 270 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hy1 n GLY 271 N 1.53 0.38 3.96 3.38 0.00 -0.42 -2.56 105.19 111.46 3hy1 n GLY 271 Ca -0.13 -0.37 -0.22 0.00 0.00 0.00 0.00 46.02 45.30 3hy1 n GLY 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hy1 s ALA 272 N -3.10 3.83 0.00 4.61 0.00 -0.75 -4.84 121.76 121.51 3hy1 s ALA 272 Ca 0.09 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 50.92 3hy1 s ALA 272 Cb -0.04 -2.07 0.00 0.00 0.00 0.00 0.00 23.12 21.01 3hy1 s ALA 272 CO 0.21 -0.34 0.00 0.25 0.00 0.00 0.00 175.76 175.88 3hy1 n THR 273 N -2.02 0.00 -2.81 0.00 -2.24 -1.26 -4.86 114.28 101.09 3hy1 n THR 273 Ca 0.01 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.36 3hy1 n THR 273 Cb 0.58 -0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 68.24 3hy1 n THR 273 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hy1 s ASP 274 N -3.78 6.44 0.23 3.42 2.15 -1.26 -4.80 116.67 119.07 3hy1 s ASP 274 Ca 0.00 -1.53 0.16 0.00 0.43 0.00 0.00 52.55 51.61 3hy1 s ASP 274 Cb 0.00 -2.45 0.85 0.00 -0.30 0.00 0.00 42.92 41.03 3hy1 s ASP 274 CO 0.00 -1.31 1.49 0.18 -0.17 0.00 0.00 175.17 175.36 3hy1 n LEU 275 N 7.50 0.41 0.12 -1.34 7.99 -1.26 0.77 117.00 131.19 3hy1 n LEU 275 Ca 0.16 0.69 -0.02 0.00 -0.01 0.00 0.00 56.01 56.83 3hy1 n LEU 275 Cb 0.48 -0.73 0.09 0.00 -0.11 0.00 0.00 43.42 43.15 3hy1 n LEU 275 CO 0.59 -0.81 0.41 0.77 -1.51 0.00 0.00 177.39 176.83 3hy1 h SER 276 N 0.00 0.00 -2.97 -1.43 4.64 -2.02 -3.48 113.55 108.28 3hy1 h SER 276 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 3hy1 h SER 276 Cb 0.02 0.00 0.10 0.00 -0.31 0.00 0.00 62.40 62.20 3hy1 h SER 276 CO 0.00 0.69 0.51 -3.20 -0.87 0.00 0.00 176.83 173.96 3hy1 n ASN 277 N -3.56 2.60 0.08 4.97 2.85 0.23 -4.90 115.26 117.52 3hy1 n ASN 277 Ca -0.00 1.18 -0.01 0.00 -0.11 0.00 0.00 54.58 55.64 3hy1 n ASN 277 Cb 0.72 -1.44 0.29 0.00 1.24 0.00 0.00 39.78 40.58 3hy1 n ASN 277 CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 3hy1 h LYS 278 N 3.13 0.32 -0.58 1.20 2.10 -1.90 -2.72 116.57 118.11 3hy1 h LYS 278 Ca -0.45 -0.11 0.11 0.00 -2.00 0.00 0.00 60.65 58.20 3hy1 h LYS 278 Cb 1.29 -0.03 -0.03 0.00 -0.90 0.00 0.00 32.23 32.56 3hy1 h LYS 278 CO 0.67 0.54 0.39 0.77 -2.00 0.00 0.00 179.45 179.83 3hy1 h SER 279 N 0.29 0.30 -0.46 7.07 0.02 -1.94 -0.64 113.55 118.19 3hy1 h SER 279 Ca 0.05 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 3hy1 h SER 279 Cb 0.58 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 3hy1 h SER 279 CO 0.04 0.18 0.20 -0.07 -1.14 0.00 0.00 176.83 176.04 3hy1 h LEU 280 N 0.34 0.62 -0.66 5.07 3.38 -1.85 -1.56 115.31 120.65 3hy1 h LEU 280 Ca 0.27 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 3hy1 h LEU 280 Cb 0.62 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 3hy1 h LEU 280 CO -0.07 0.60 -0.30 0.03 0.09 0.00 0.00 178.44 178.79 3hy1 h ARG 281 N 0.60 0.72 0.08 1.13 3.08 -1.28 -0.12 114.38 118.59 3hy1 h ARG 281 Ca 0.15 -0.32 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 3hy1 h ARG 281 Cb 0.16 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 3hy1 h ARG 281 CO -0.02 0.93 -0.05 0.28 -1.07 0.00 0.00 179.97 180.04 3hy1 h VAL 282 N 0.61 0.90 -0.37 2.04 2.07 -0.99 -0.14 116.25 120.38 3hy1 h VAL 282 Ca 0.07 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.53 3hy1 h VAL 282 Cb 0.81 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 3hy1 h VAL 282 CO 0.07 0.00 -0.04 0.40 0.02 0.00 0.00 177.57 178.02 3hy1 h ILE 283 N -0.12 1.22 -0.78 4.57 2.04 -1.22 0.11 117.51 123.33 3hy1 h ILE 283 Ca -0.01 -0.94 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 3hy1 h ILE 283 Cb 0.10 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 3hy1 h ILE 283 CO 0.01 0.32 0.39 0.00 0.00 0.00 0.00 178.15 178.88 3hy1 h ALA 284 N 1.39 1.00 -0.19 1.87 0.00 -0.65 -1.89 119.26 120.79 3hy1 h ALA 284 Ca 0.11 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 3hy1 h ALA 284 Cb 0.43 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3hy1 h ALA 284 CO 0.02 0.54 -0.47 0.22 0.00 0.00 0.00 179.25 179.56 3hy1 h ASP 285 N 1.09 0.73 0.80 0.00 3.58 -0.65 -3.32 116.42 118.65 3hy1 h ASP 285 Ca 0.27 -0.57 -0.05 0.00 0.42 0.00 0.00 57.03 57.10 3hy1 h ASP 285 Cb 0.09 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 3hy1 h ASP 285 CO -0.04 1.17 -0.24 0.45 -2.88 0.00 0.00 179.24 177.71 3hy1 h HIS 286 N 0.32 0.00 0.00 0.28 3.86 -0.78 -2.54 115.15 116.29 3hy1 h HIS 286 Ca -0.01 0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.07 3hy1 h HIS 286 Cb 1.08 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.53 3hy1 h HIS 286 CO 0.09 0.24 -0.64 0.97 0.86 0.00 0.00 177.93 179.45 3hy1 h ILE 287 N 0.00 1.42 0.12 2.45 6.09 -1.44 -2.00 117.51 124.15 3hy1 h ILE 287 Ca -0.00 -2.21 -0.01 0.00 -1.37 0.00 0.00 64.86 61.27 3hy1 h ILE 287 Cb 0.71 2.20 0.00 0.00 0.47 0.00 0.00 36.82 40.20 3hy1 h ILE 287 CO 0.03 0.63 -0.06 0.03 -3.07 0.00 0.00 178.15 175.71 3hy1 h ARG 288 N 0.00 -0.15 0.43 2.19 3.08 -1.57 -1.32 114.38 117.04 3hy1 h ARG 288 Ca -0.01 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3hy1 h ARG 288 Cb 1.15 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.22 3hy1 h ARG 288 CO 0.08 0.23 -0.36 0.77 -1.07 0.00 0.00 179.97 179.63 3hy1 h SER 289 N -0.57 -0.96 -0.40 7.04 0.02 -1.56 -1.93 113.55 115.19 3hy1 h SER 289 Ca -0.02 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 3hy1 h SER 289 Cb 0.45 0.31 -0.02 0.00 0.14 0.00 0.00 62.40 63.28 3hy1 h SER 289 CO 0.03 -0.52 0.20 0.00 -1.14 0.00 0.00 176.83 175.40 3hy1 h ALA 291 N 1.05 0.23 -0.19 0.00 0.00 -1.24 -2.13 119.26 116.98 3hy1 h ALA 291 Ca 0.14 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 3hy1 h ALA 291 Cb 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3hy1 h ALA 291 CO -0.02 -0.12 -0.50 0.74 0.00 0.00 0.00 179.25 179.35 3hy1 h PHE 292 N 0.10 0.65 -0.08 0.00 0.04 -1.30 -1.72 116.94 114.62 3hy1 h PHE 292 Ca 0.06 -0.22 0.00 0.00 2.80 0.00 0.00 57.97 60.61 3hy1 h PHE 292 Cb 0.27 -0.13 -0.00 0.00 2.20 0.00 0.00 35.95 38.29 3hy1 h PHE 292 CO 0.01 0.92 0.05 -0.07 -0.60 0.00 0.00 178.31 178.62 3hy1 h LEU 293 N 0.42 0.10 -0.56 1.54 3.38 -0.86 -0.08 115.31 119.25 3hy1 h LEU 293 Ca 0.02 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3hy1 h LEU 293 Cb 1.02 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 3hy1 h LEU 293 CO 0.09 0.09 0.22 0.40 0.09 0.00 0.00 178.44 179.34 3hy1 h ILE 294 N 0.09 1.22 -0.37 1.22 2.04 -1.38 -1.22 117.51 119.12 3hy1 h ILE 294 Ca 0.03 -0.70 0.11 0.00 1.00 0.00 0.00 64.86 65.30 3hy1 h ILE 294 Cb 0.01 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 3hy1 h ILE 294 CO -0.01 0.27 0.27 0.00 0.00 0.00 0.00 178.15 178.68 3hy1 h ALA 295 N 1.07 2.34 -0.04 1.87 0.00 -1.04 -0.48 119.26 122.97 3hy1 h ALA 295 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3hy1 h ALA 295 Cb 0.20 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3hy1 h ALA 295 CO -0.01 -0.45 0.00 -0.25 0.00 0.00 0.00 179.25 178.53 3hy1 n ASP 296 N -4.41 1.50 0.00 0.00 8.00 -0.07 -4.92 116.55 116.66 3hy1 n ASP 296 Ca 0.06 -1.53 0.00 0.00 0.71 0.00 0.00 54.79 54.03 3hy1 n ASP 296 Cb 0.45 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 3hy1 n ASP 296 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hy1 n GLY 297 N 1.16 0.82 3.63 0.44 0.00 -0.19 -4.79 105.19 106.26 3hy1 n GLY 297 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3hy1 n GLY 297 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hy1 s VAL 298 N -2.00 4.68 -0.12 1.61 1.01 -0.70 -4.99 120.40 119.89 3hy1 s VAL 298 Ca 0.00 1.44 -0.05 0.00 0.00 0.00 0.00 61.98 63.37 3hy1 s VAL 298 Cb 0.00 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 3hy1 s VAL 298 CO 0.00 -0.33 0.07 -0.04 0.00 0.00 0.00 175.10 174.79 3hy1 s MET 299 N 3.23 3.40 0.16 2.72 -1.94 -1.26 -3.85 119.30 121.76 3hy1 s MET 299 Ca 0.38 -0.29 -0.34 0.00 -1.71 0.00 0.00 55.69 53.73 3hy1 s MET 299 Cb -0.13 -3.04 -0.14 0.00 2.01 0.00 0.00 34.83 33.52 3hy1 s MET 299 CO 0.13 0.62 1.58 -2.30 -0.01 0.00 0.00 175.02 175.05 3hy1 n PRO 300 N 2.44 2.17 -2.93 2.03 -0.02 -1.26 -4.27 135.00 133.15 3hy1 n PRO 300 Ca -0.19 0.78 -0.08 0.00 -2.02 0.00 0.00 63.50 62.00 3hy1 n PRO 300 Cb 0.54 -2.55 -0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3hy1 n PRO 300 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3hy1 n SER 301 N 3.46 -1.14 -1.24 2.55 3.41 -0.36 -4.96 113.62 115.35 3hy1 n SER 301 Ca 0.17 -2.11 0.11 0.00 -0.26 0.00 0.00 58.87 56.78 3hy1 n SER 301 Cb 0.29 2.00 0.28 0.00 -0.26 0.00 0.00 64.21 66.52 3hy1 n SER 301 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3hy1 n ASN 302 N -1.58 3.74 -4.40 4.04 3.02 -1.26 -2.61 115.26 116.22 3hy1 n ASN 302 Ca -0.02 -1.99 -0.33 0.00 -0.03 0.00 0.00 54.58 52.20 3hy1 n ASN 302 Cb 0.37 -0.41 -0.14 0.00 -0.61 0.00 0.00 39.78 38.99 3hy1 n ASN 302 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3hy1 s GLU 303 N -1.10 3.31 7.15 3.52 8.01 -1.26 -4.82 118.70 133.52 3hy1 s GLU 303 Ca 0.44 -0.67 0.00 0.00 0.01 0.00 0.00 54.97 54.75 3hy1 s GLU 303 Cb 0.23 -2.63 0.00 0.00 -4.31 0.00 0.00 34.13 27.42 3hy1 s GLU 303 CO 0.31 0.27 0.00 -1.71 0.01 0.00 0.00 175.26 174.14 3hy1 n ASN 304 N 3.37 0.00 -0.29 -0.19 5.15 -1.26 -1.66 115.26 120.38 3hy1 n ASN 304 Ca -0.18 0.00 -0.06 0.00 -0.60 0.00 0.00 54.58 53.75 3hy1 n ASN 304 Cb 0.53 0.00 0.07 0.00 -0.53 0.00 0.00 39.78 39.84 3hy1 n ASN 304 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 3hy1 h ARG 305 N 0.00 1.18 0.00 1.20 3.08 -1.96 -2.27 114.38 115.61 3hy1 h ARG 305 Ca 0.00 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 59.85 3hy1 h ARG 305 Cb 0.00 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.85 3hy1 h ARG 305 CO 0.00 0.93 -0.00 0.78 -1.07 0.00 0.00 179.97 180.61 3hy1 h GLY 306 N 1.15 0.00 0.78 0.04 0.00 -1.50 -2.02 103.07 101.53 3hy1 h GLY 306 Ca 0.27 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.40 3hy1 h GLY 306 CO -0.03 0.00 -0.86 -1.82 0.00 0.00 0.00 176.54 173.83 3hy1 h TYR 307 N 0.00 0.61 -0.87 5.60 3.20 -0.91 -0.73 116.97 123.87 3hy1 h TYR 307 Ca -0.00 -0.43 0.13 0.00 3.14 0.00 0.00 58.73 61.57 3hy1 h TYR 307 Cb 0.01 -0.03 -0.09 0.00 1.54 0.00 0.00 36.73 38.16 3hy1 h TYR 307 CO 0.00 1.32 0.48 0.28 -1.64 0.00 0.00 178.16 178.59 3hy1 h VAL 308 N -0.26 0.80 0.14 1.81 2.07 -1.26 0.41 116.25 119.97 3hy1 h VAL 308 Ca -0.14 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 3hy1 h VAL 308 Cb 1.65 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3hy1 h VAL 308 CO 0.16 0.13 -0.07 0.25 0.02 0.00 0.00 177.57 178.06 3hy1 h LEU 309 N 0.72 -0.16 -0.94 2.57 5.85 -1.39 -1.70 115.31 120.26 3hy1 h LEU 309 Ca 0.45 -0.05 0.09 0.00 0.84 0.00 0.00 57.88 59.22 3hy1 h LEU 309 Cb 0.57 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 3hy1 h LEU 309 CO -0.32 -0.06 0.58 -0.09 -0.34 0.00 0.00 178.44 178.21 3hy1 h ARG 310 N -0.26 0.96 -0.31 1.25 2.43 -0.47 -0.73 114.38 117.25 3hy1 h ARG 310 Ca -0.02 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 3hy1 h ARG 310 Cb 0.20 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 3hy1 h ARG 310 CO 0.03 0.63 0.20 0.00 -1.51 0.00 0.00 179.97 179.32 3hy1 h ARG 311 N 0.98 0.42 -0.44 0.20 3.08 0.07 -0.72 114.38 117.97 3hy1 h ARG 311 Ca 0.44 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 60.31 3hy1 h ARG 311 Cb 0.33 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 3hy1 h ARG 311 CO -0.22 0.30 -0.29 0.82 -1.07 0.00 0.00 179.97 179.51 3hy1 h ILE 312 N 0.41 1.27 0.51 2.04 2.04 -0.79 -1.07 117.51 121.91 3hy1 h ILE 312 Ca 0.11 -1.46 -0.02 0.00 1.00 0.00 0.00 64.86 64.50 3hy1 h ILE 312 Cb -0.01 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 3hy1 h ILE 312 CO -0.02 0.50 -0.32 0.40 0.00 0.00 0.00 178.15 178.70 3hy1 h ILE 313 N 0.81 0.34 -0.58 -0.67 2.04 -1.02 -1.96 117.51 116.47 3hy1 h ILE 313 Ca 0.09 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.90 3hy1 h ILE 313 Cb 0.88 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 3hy1 h ILE 313 CO 0.08 0.00 0.15 0.03 0.00 0.00 0.00 178.15 178.41 3hy1 h ARG 314 N -0.79 0.89 -0.34 2.37 3.08 -1.10 -0.58 114.38 117.92 3hy1 h ARG 314 Ca -0.06 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 59.77 3hy1 h ARG 314 Cb 0.65 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 3hy1 h ARG 314 CO 0.05 0.79 0.06 0.00 -1.07 0.00 0.00 179.97 179.80 3hy1 h ARG 315 N 0.86 0.51 -0.18 0.04 3.08 -1.16 -1.02 114.38 116.50 3hy1 h ARG 315 Ca 0.19 -0.09 -0.20 0.00 0.07 0.00 0.00 59.98 59.95 3hy1 h ARG 315 Cb 0.30 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.27 3hy1 h ARG 315 CO -0.00 0.49 -0.70 0.00 -1.07 0.00 0.00 179.97 178.69 3hy1 h ALA 316 N 1.58 0.43 -0.44 0.04 0.00 -0.49 -2.78 119.26 117.59 3hy1 h ALA 316 Ca 0.11 -0.57 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 3hy1 h ALA 316 Cb 0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3hy1 h ALA 316 CO 0.00 0.70 -0.02 0.28 0.00 0.00 0.00 179.25 180.21 3hy1 h VAL 317 N 0.52 1.24 -0.67 0.00 2.07 -0.76 -1.07 116.25 117.59 3hy1 h VAL 317 Ca -0.03 -0.99 -0.04 0.00 0.82 0.00 0.00 66.70 66.46 3hy1 h VAL 317 Cb 1.30 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 3hy1 h VAL 317 CO 0.14 0.35 0.27 -0.09 0.02 0.00 0.00 177.57 178.26 3hy1 h ARG 318 N 0.69 0.99 -0.66 1.57 1.12 -1.16 -0.28 114.38 116.64 3hy1 h ARG 318 Ca 0.13 -0.18 -0.06 0.00 -1.11 0.00 0.00 59.98 58.77 3hy1 h ARG 318 Cb 0.45 -0.16 -0.03 0.00 -0.01 0.00 0.00 29.97 30.22 3hy1 h ARG 318 CO 0.02 0.82 0.19 0.45 -3.11 0.00 0.00 179.97 178.34 3hy1 h HIS 319 N 0.94 1.09 -0.43 2.20 3.86 -1.16 -1.72 115.15 119.93 3hy1 h HIS 319 Ca 0.22 -0.12 -0.00 0.00 -1.16 0.00 0.00 60.37 59.31 3hy1 h HIS 319 Cb 0.20 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 3hy1 h HIS 319 CO 0.01 0.89 0.26 0.78 0.86 0.00 0.00 177.93 180.73 3hy1 h GLY 320 N 0.97 0.63 0.36 2.45 0.00 -0.90 -2.33 103.07 104.26 3hy1 h GLY 320 Ca 0.21 -0.26 0.10 0.00 0.00 0.00 0.00 47.33 47.37 3hy1 h GLY 320 CO -0.00 0.25 0.21 -0.57 0.00 0.00 0.00 176.54 176.44 3hy1 h ASN 321 N 0.57 0.20 -0.94 0.19 -0.73 -0.80 -1.43 115.58 112.63 3hy1 h ASN 321 Ca 0.15 0.08 0.07 0.00 1.87 0.00 0.00 56.30 58.47 3hy1 h ASN 321 Cb 0.00 0.07 -0.06 0.00 0.27 0.00 0.00 38.32 38.60 3hy1 h ASN 321 CO -0.03 0.12 0.61 0.24 -0.37 0.00 0.00 177.43 178.00 3hy1 h MET 322 N 0.39 1.05 0.00 6.67 2.86 -0.96 -2.36 114.93 122.58 3hy1 h MET 322 Ca 0.31 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 3hy1 h MET 322 Cb 0.39 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.81 3hy1 h MET 322 CO -0.32 0.70 0.00 -0.07 1.06 0.00 0.00 176.91 178.28 3hy1 h LEU 323 N 1.08 0.00 0.00 1.22 3.38 -0.75 -3.46 115.31 116.78 3hy1 h LEU 323 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3hy1 h LEU 323 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3hy1 h LEU 323 CO -0.16 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.98 3hy1 n GLY 324 N 0.40 1.20 3.68 0.83 0.00 -0.89 -4.47 105.19 105.94 3hy1 n GLY 324 Ca 0.02 0.00 -0.65 0.00 0.00 0.00 0.00 46.02 45.39 3hy1 n GLY 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hy1 n ALA 325 N -0.03 -1.92 -0.07 4.61 0.00 -0.78 -4.84 120.51 117.48 3hy1 n ALA 325 Ca 0.00 0.52 -0.05 0.00 0.00 0.00 0.00 53.44 53.91 3hy1 n ALA 325 Cb 0.00 -1.89 -0.13 0.00 0.00 0.00 0.00 19.45 17.44 3hy1 n ALA 325 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3hy1 n LYS 326 N 3.37 1.27 -4.34 0.00 3.00 -1.26 -4.68 118.16 115.52 3hy1 n LYS 326 Ca 0.28 -0.03 -0.18 0.00 -0.00 0.00 0.00 58.31 58.37 3hy1 n LYS 326 Cb -0.02 -1.40 -0.10 0.00 0.00 0.00 0.00 35.03 33.51 3hy1 n LYS 326 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 3hy1 s GLU 327 N -2.52 1.31 -0.31 1.64 -1.05 -1.26 -5.08 118.70 111.43 3hy1 s GLU 327 Ca -0.08 -1.59 -0.43 0.00 -0.15 0.00 0.00 54.97 52.73 3hy1 s GLU 327 Cb 0.06 -1.06 -0.18 0.00 -0.44 0.00 0.00 34.13 32.51 3hy1 s GLU 327 CO 0.66 0.16 1.58 2.41 0.95 0.00 0.00 175.26 181.01 3hy1 n THR 328 N -0.37 0.12 0.00 1.83 -1.04 -1.26 -4.82 114.28 108.73 3hy1 n THR 328 Ca -0.08 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.91 3hy1 n THR 328 Cb 0.61 -0.76 0.00 0.00 -1.82 0.00 0.00 70.33 68.36 3hy1 n THR 328 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 3hy1 n PHE 329 N 4.14 0.00 -0.32 -1.42 1.16 -1.26 -4.87 117.46 114.88 3hy1 n PHE 329 Ca 0.27 0.00 0.03 0.00 -1.87 0.00 0.00 57.45 55.88 3hy1 n PHE 329 Cb 0.05 0.00 0.21 0.00 -1.61 0.00 0.00 39.48 38.13 3hy1 n PHE 329 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 3hy1 h PHE 330 N 0.00 1.11 0.00 2.97 3.57 -1.93 -0.75 116.94 121.91 3hy1 h PHE 330 Ca 0.00 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 3hy1 h PHE 330 Cb 0.68 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 3hy1 h PHE 330 CO 0.00 0.60 -0.19 0.10 -2.23 0.00 0.00 178.31 176.59 3hy1 h TYR 331 N 1.10 0.00 0.00 0.41 -0.00 -1.87 -2.72 116.97 113.89 3hy1 h TYR 331 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.12 3hy1 h TYR 331 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.86 3hy1 h TYR 331 CO -0.00 0.19 0.00 1.63 -0.00 0.00 0.00 178.16 179.98 3hy1 n LYS 332 N -3.49 0.27 0.00 0.10 5.02 -0.29 -2.26 118.16 117.52 3hy1 n LYS 332 Ca -0.01 0.08 0.10 0.00 -2.02 0.00 0.00 58.31 56.47 3hy1 n LYS 332 Cb 0.36 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.85 3hy1 n LYS 332 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3hy1 n LEU 333 N -1.13 1.91 0.09 -0.35 4.77 -1.03 -4.47 117.00 116.79 3hy1 n LEU 333 Ca 0.07 -0.74 -0.13 0.00 -0.03 0.00 0.00 56.01 55.18 3hy1 n LEU 333 Cb 0.06 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.07 3hy1 n LEU 333 CO 0.07 0.36 0.60 0.58 -1.33 0.00 0.00 177.39 177.68 3hy1 h VAL 334 N 2.19 0.92 -0.01 4.08 2.07 -1.65 -1.55 116.25 122.30 3hy1 h VAL 334 Ca 0.00 -0.69 0.03 0.00 0.82 0.00 0.00 66.70 66.86 3hy1 h VAL 334 Cb 0.71 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 3hy1 h VAL 334 CO 0.00 0.15 -0.32 1.23 0.02 0.00 0.00 177.57 178.65 3hy1 h GLY 335 N -0.60 -0.52 0.50 2.17 0.00 -1.79 0.17 103.07 103.00 3hy1 h GLY 335 Ca -0.03 0.39 0.15 0.00 0.00 0.00 0.00 47.33 47.84 3hy1 h GLY 335 CO 0.04 -0.23 0.58 -2.55 0.00 0.00 0.00 176.54 174.38 3hy1 h PRO 336 N -0.46 0.67 -0.56 4.80 0.11 -1.79 -1.41 132.00 133.37 3hy1 h PRO 336 Ca 0.06 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.04 3hy1 h PRO 336 Cb 0.56 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 3hy1 h PRO 336 CO -0.27 0.44 -0.02 1.25 -0.21 0.00 0.00 178.00 179.18 3hy1 h LEU 337 N 0.69 0.98 -0.87 2.35 5.85 -0.23 -2.89 115.31 121.19 3hy1 h LEU 337 Ca 0.46 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 3hy1 h LEU 337 Cb 0.74 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 3hy1 h LEU 337 CO -0.21 1.06 0.33 0.40 -0.34 0.00 0.00 178.44 179.68 3hy1 h ILE 338 N 0.88 1.25 -0.38 4.05 2.04 -0.05 -2.46 117.51 122.84 3hy1 h ILE 338 Ca 0.15 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.22 3hy1 h ILE 338 Cb 0.57 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 3hy1 h ILE 338 CO 0.03 0.32 0.15 0.44 0.00 0.00 0.00 178.15 179.09 3hy1 h ASP 339 N 1.13 0.48 0.41 1.72 3.32 -1.10 -3.06 116.42 119.33 3hy1 h ASP 339 Ca 0.27 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3hy1 h ASP 339 Cb 0.18 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3hy1 h ASP 339 CO -0.03 0.44 -1.02 1.33 -1.72 0.00 0.00 179.24 178.24 3hy1 n VAL 340 N -4.38 0.16 0.28 -1.35 0.24 -1.10 -4.21 118.33 107.97 3hy1 n VAL 340 Ca 0.02 -0.23 0.12 0.00 -2.04 0.00 0.00 64.34 62.21 3hy1 n VAL 340 Cb 0.14 0.23 0.17 0.00 -1.47 0.00 0.00 33.84 32.92 3hy1 n VAL 340 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 3hy1 h MET 341 N 0.00 0.00 0.00 7.34 2.86 -1.34 -3.47 114.93 120.33 3hy1 h MET 341 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3hy1 h MET 341 Cb 0.72 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.38 3hy1 h MET 341 CO 0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 3hy1 n GLY 342 N 1.17 1.89 0.22 8.32 0.00 -1.24 -3.01 105.19 112.53 3hy1 n GLY 342 Ca 0.03 -0.50 0.09 0.00 0.00 0.00 0.00 46.02 45.64 3hy1 n GLY 342 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hy1 h SER 343 N 4.35 0.00 0.00 1.61 4.64 -1.95 -2.81 113.55 119.39 3hy1 h SER 343 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hy1 h SER 343 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3hy1 h SER 343 CO 0.00 0.25 0.00 0.00 -0.87 0.00 0.00 176.83 176.21 3hy1 n ALA 344 N -2.25 2.47 -0.08 5.18 0.00 -1.16 -2.53 120.51 122.14 3hy1 n ALA 344 Ca -0.00 -0.14 0.07 0.00 0.00 0.00 0.00 53.44 53.36 3hy1 n ALA 344 Cb 0.42 -1.38 0.16 0.00 0.00 0.00 0.00 19.45 18.66 3hy1 n ALA 344 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hy1 n GLY 345 N 0.63 2.24 0.23 0.00 0.00 -1.06 -4.65 105.19 102.58 3hy1 n GLY 345 Ca 0.17 -0.44 -0.03 0.00 0.00 0.00 0.00 46.02 45.72 3hy1 n GLY 345 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hy1 h GLU 346 N 2.48 0.59 0.00 1.61 4.57 -1.65 0.65 114.58 122.83 3hy1 h GLU 346 Ca 0.00 -0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 58.07 3hy1 h GLU 346 Cb 0.74 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 3hy1 h GLU 346 CO 0.00 0.39 -0.34 -0.44 -1.18 0.00 0.00 179.01 177.44 3hy1 h ASP 347 N 0.61 0.00 -0.00 1.04 5.19 -1.85 -1.21 116.42 120.21 3hy1 h ASP 347 Ca 0.26 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.65 3hy1 h ASP 347 Cb 0.14 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.65 3hy1 h ASP 347 CO -0.16 0.34 -0.06 0.25 -3.12 0.00 0.00 179.24 176.49 3hy1 h LEU 348 N 0.00 0.06 -1.48 1.55 5.85 -1.56 -3.27 115.31 116.46 3hy1 h LEU 348 Ca -0.00 -0.75 0.01 0.00 0.84 0.00 0.00 57.88 57.97 3hy1 h LEU 348 Cb 0.71 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 3hy1 h LEU 348 CO 0.04 0.80 0.36 0.50 -0.34 0.00 0.00 178.44 179.80 3hy1 h LYS 349 N -0.68 0.70 -0.96 1.25 3.64 -0.84 -1.51 116.57 118.17 3hy1 h LYS 349 Ca -0.01 -0.04 0.26 0.00 -1.27 0.00 0.00 60.65 59.59 3hy1 h LYS 349 Cb 0.81 -0.16 -0.13 0.00 -0.41 0.00 0.00 32.23 32.34 3hy1 h LYS 349 CO 0.01 0.46 0.51 0.00 -2.27 0.00 0.00 179.45 178.16 3hy1 h ARG 350 N 0.72 0.43 -0.40 1.90 3.08 -1.27 -2.12 114.38 116.72 3hy1 h ARG 350 Ca 0.20 -0.03 -0.30 0.00 0.07 0.00 0.00 59.98 59.92 3hy1 h ARG 350 Cb -0.07 -0.10 -0.24 0.00 0.08 0.00 0.00 29.97 29.64 3hy1 h ARG 350 CO -0.04 0.28 -0.69 1.04 -1.07 0.00 0.00 179.97 179.49 3hy1 n GLN 351 N -4.99 2.62 -0.35 0.04 6.02 -0.62 -4.83 117.38 115.28 3hy1 n GLN 351 Ca 0.26 -3.74 0.11 0.00 -0.01 0.00 0.00 57.00 53.63 3hy1 n GLN 351 Cb 0.77 -1.93 0.30 0.00 1.02 0.00 0.00 30.24 30.40 3hy1 n GLN 351 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 3hy1 h GLN 352 N 1.66 0.74 0.35 -1.09 4.15 -0.80 -1.54 115.11 118.58 3hy1 h GLN 352 Ca 0.19 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.54 3hy1 h GLN 352 Cb 1.31 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.83 3hy1 h GLN 352 CO 0.40 0.49 -0.17 0.00 -1.93 0.00 0.00 178.83 177.63 3hy1 h ALA 353 N 1.62 -0.46 -0.10 3.38 0.00 -1.88 -2.27 119.26 119.55 3hy1 h ALA 353 Ca 0.55 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 55.16 3hy1 h ALA 353 Cb 0.82 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3hy1 h ALA 353 CO -0.37 -0.63 -0.53 -0.56 0.00 0.00 0.00 179.25 177.16 3hy1 h GLN 354 N -0.72 0.28 -0.25 0.00 -0.00 -1.92 -1.95 115.11 110.55 3hy1 h GLN 354 Ca -0.05 -0.17 -0.07 0.00 -0.00 0.00 0.00 58.65 58.36 3hy1 h GLN 354 Cb 0.49 0.02 -0.01 0.00 -0.00 0.00 0.00 27.48 27.98 3hy1 h GLN 354 CO 0.08 0.74 -0.14 0.28 -0.00 0.00 0.00 178.83 179.79 3hy1 h VAL 355 N 0.22 1.22 -0.12 1.86 2.07 -1.33 -2.02 116.25 118.16 3hy1 h VAL 355 Ca 0.01 -1.00 -0.23 0.00 0.82 0.00 0.00 66.70 66.30 3hy1 h VAL 355 Cb 1.01 1.19 0.01 0.00 -1.52 0.00 0.00 31.29 31.98 3hy1 h VAL 355 CO 0.08 0.32 -0.81 -0.33 0.02 0.00 0.00 177.57 176.86 3hy1 h GLU 356 N 0.40 0.77 -0.46 1.57 5.08 -1.15 -3.10 114.58 117.68 3hy1 h GLU 356 Ca 0.07 -0.66 -0.09 0.00 -1.00 0.00 0.00 59.36 57.68 3hy1 h GLU 356 Cb 0.49 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 3hy1 h GLU 356 CO 0.03 1.26 -0.07 0.37 -1.00 0.00 0.00 179.01 179.60 3hy1 h GLN 357 N 0.49 0.85 -0.67 2.33 5.75 -1.21 -0.40 115.11 122.25 3hy1 h GLN 357 Ca -0.07 -0.31 -0.02 0.00 -0.15 0.00 0.00 58.65 58.11 3hy1 h GLN 357 Cb 1.45 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 29.91 3hy1 h GLN 357 CO 0.17 0.94 0.35 0.28 -2.65 0.00 0.00 178.83 177.91 3hy1 h VAL 358 N 0.69 1.22 -0.48 2.39 2.07 -1.46 -0.30 116.25 120.38 3hy1 h VAL 358 Ca 0.12 -0.59 -0.12 0.00 0.82 0.00 0.00 66.70 66.93 3hy1 h VAL 358 Cb 0.60 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3hy1 h VAL 358 CO 0.04 0.25 -0.19 -0.07 0.02 0.00 0.00 177.57 177.62 3hy1 h LEU 359 N 0.93 0.96 -0.29 2.57 3.38 -1.45 -1.93 115.31 119.49 3hy1 h LEU 359 Ca 0.23 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3hy1 h LEU 359 Cb 0.08 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3hy1 h LEU 359 CO -0.03 1.12 0.12 0.50 0.09 0.00 0.00 178.44 180.24 3hy1 h LYS 360 N 0.83 0.43 -0.29 1.13 3.64 -0.67 -1.72 116.57 119.91 3hy1 h LYS 360 Ca 0.12 -0.07 -0.11 0.00 -1.27 0.00 0.00 60.65 59.31 3hy1 h LYS 360 Cb 0.74 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 3hy1 h LYS 360 CO 0.06 0.44 -0.28 1.15 -2.27 0.00 0.00 179.45 178.55 3hy1 h THR 361 N 0.32 1.28 -0.25 1.00 2.02 -1.04 -1.46 112.91 114.77 3hy1 h THR 361 Ca 0.10 -1.36 -0.13 0.00 0.77 0.00 0.00 66.41 65.79 3hy1 h THR 361 Cb 0.17 1.36 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 3hy1 h THR 361 CO -0.01 0.44 -0.34 -0.08 0.37 0.00 0.00 175.52 175.90 3hy1 h GLU 362 N 0.51 0.66 -0.07 6.66 4.22 -1.20 -2.16 114.58 123.21 3hy1 h GLU 362 Ca 0.07 -0.38 -0.13 0.00 0.08 0.00 0.00 59.36 58.99 3hy1 h GLU 362 Cb 0.74 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 3hy1 h GLU 362 CO 0.06 1.00 -0.53 1.49 -2.18 0.00 0.00 179.01 178.84 3hy1 h GLU 363 N 0.38 0.19 -0.16 1.92 4.81 -1.30 -2.95 114.58 117.47 3hy1 h GLU 363 Ca 0.03 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 3hy1 h GLU 363 Cb 0.92 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 3hy1 h GLU 363 CO 0.08 0.68 -0.03 1.49 -0.73 0.00 0.00 179.01 180.49 3hy1 h GLU 364 N 0.14 0.31 -0.00 1.92 4.81 -1.13 -1.85 114.58 118.78 3hy1 h GLU 364 Ca 0.00 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 3hy1 h GLU 364 Cb 0.99 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.35 3hy1 h GLU 364 CO 0.08 0.58 -0.05 1.04 -0.73 0.00 0.00 179.01 179.93 3hy1 n GLN 365 N -4.69 0.48 -0.05 1.92 6.02 -0.82 -2.84 117.38 117.40 3hy1 n GLN 365 Ca -0.05 -0.07 -0.09 0.00 -0.01 0.00 0.00 57.00 56.77 3hy1 n GLN 365 Cb 0.26 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 29.87 3hy1 n GLN 365 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3hy1 n PHE 366 N -1.20 0.62 0.32 1.08 7.35 -1.12 -4.11 117.46 120.41 3hy1 n PHE 366 Ca 0.14 0.22 0.20 0.00 -0.76 0.00 0.00 57.45 57.25 3hy1 n PHE 366 Cb 0.26 -1.11 1.06 0.00 0.35 0.00 0.00 39.48 40.03 3hy1 n PHE 366 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3hy1 h ALA 367 N 1.00 1.10 -0.82 3.13 0.00 -1.18 -0.71 119.26 121.77 3hy1 h ALA 367 Ca -0.39 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 3hy1 h ALA 367 Cb 2.10 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.85 3hy1 h ALA 367 CO 0.06 0.01 0.43 0.00 0.00 0.00 0.00 179.25 179.76 3hy1 h ARG 368 N 0.00 1.15 -0.01 0.00 3.08 -1.71 -3.22 114.38 113.67 3hy1 h ARG 368 Ca -0.00 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.91 3hy1 h ARG 368 Cb 0.11 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.94 3hy1 h ARG 368 CO 0.00 0.86 -0.07 0.25 -1.07 0.00 0.00 179.97 179.93 3hy1 n THR 369 N -4.33 0.00 0.07 2.04 -2.24 -0.68 -4.73 114.28 104.41 3hy1 n THR 369 Ca 0.08 -0.46 -0.13 0.00 -2.27 0.00 0.00 64.05 61.27 3hy1 n THR 369 Cb 0.11 1.17 -0.08 0.00 -2.10 0.00 0.00 70.33 69.43 3hy1 n THR 369 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3hy1 h LEU 370 N 1.62 -0.14 -0.03 3.22 5.85 -1.17 -1.94 115.31 122.73 3hy1 h LEU 370 Ca 0.00 -0.24 -0.19 0.00 0.84 0.00 0.00 57.88 58.28 3hy1 h LEU 370 Cb 0.38 0.03 0.01 0.00 0.37 0.00 0.00 40.66 41.46 3hy1 h LEU 370 CO 0.00 0.17 -0.74 -0.33 -0.34 0.00 0.00 178.44 177.20 3hy1 h GLU 371 N -0.46 0.55 0.00 1.25 5.08 -1.85 0.40 114.58 119.55 3hy1 h GLU 371 Ca -0.02 -0.55 -0.02 0.00 -1.00 0.00 0.00 59.36 57.76 3hy1 h GLU 371 Cb 0.37 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 3hy1 h GLU 371 CO 0.03 1.18 -0.12 0.00 -1.00 0.00 0.00 179.01 179.10 3hy1 h ARG 372 N 0.13 0.00 -0.01 2.33 3.08 -1.86 -0.75 114.38 117.30 3hy1 h ARG 372 Ca -0.09 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 3hy1 h ARG 372 Cb 1.42 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.48 3hy1 h ARG 372 CO 0.15 0.12 -0.40 0.78 -1.07 0.00 0.00 179.97 179.55 3hy1 h GLY 373 N 0.40 0.33 2.00 0.04 0.00 -1.15 -1.62 103.07 103.06 3hy1 h GLY 373 Ca -0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 46.75 3hy1 h GLY 373 CO 0.02 0.48 -0.16 1.41 0.00 0.00 0.00 176.54 178.29 3hy1 h LEU 374 N -0.28 0.00 -0.09 3.11 3.38 -0.67 0.31 115.31 121.06 3hy1 h LEU 374 Ca -0.05 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 3hy1 h LEU 374 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3hy1 h LEU 374 CO 0.08 0.16 -0.28 0.00 0.09 0.00 0.00 178.44 178.49 3hy1 h ALA 375 N 1.84 0.15 -0.67 1.53 0.00 -1.16 -2.48 119.26 118.48 3hy1 h ALA 375 Ca -0.00 -0.42 0.08 0.00 0.00 0.00 0.00 54.91 54.57 3hy1 h ALA 375 Cb 0.33 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 3hy1 h ALA 375 CO 0.02 0.17 0.34 1.25 0.00 0.00 0.00 179.25 181.03 3hy1 h LEU 376 N -0.12 0.45 -1.18 0.00 7.12 -0.47 -0.84 115.31 120.27 3hy1 h LEU 376 Ca -0.01 0.05 -0.06 0.00 0.13 0.00 0.00 57.88 58.00 3hy1 h LEU 376 Cb 0.90 -0.03 -0.02 0.00 -0.53 0.00 0.00 40.66 40.99 3hy1 h LEU 376 CO 0.06 0.27 -0.03 0.25 -0.13 0.00 0.00 178.44 178.86 3hy1 h LEU 377 N 0.60 0.50 -0.34 2.25 5.85 -0.98 -2.29 115.31 120.88 3hy1 h LEU 377 Ca 0.32 -0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.81 3hy1 h LEU 377 Cb 0.30 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 3hy1 h LEU 377 CO -0.24 0.59 -0.28 0.44 -0.34 0.00 0.00 178.44 178.61 3hy1 h ASP 378 N 0.50 0.83 -0.57 1.25 3.32 -0.76 -1.29 116.42 119.70 3hy1 h ASP 378 Ca 0.10 -0.45 0.05 0.00 0.02 0.00 0.00 57.03 56.75 3hy1 h ASP 378 Cb 0.38 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.65 3hy1 h ASP 378 CO 0.02 1.11 0.30 -0.33 -1.72 0.00 0.00 179.24 178.62 3hy1 h GLU 379 N 0.57 0.56 0.00 3.56 5.08 -0.99 -3.05 114.58 120.32 3hy1 h GLU 379 Ca 0.06 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 3hy1 h GLU 379 Cb 0.85 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3hy1 h GLU 379 CO 0.07 0.37 -0.29 0.93 -1.00 0.00 0.00 179.01 179.10 3hy1 h GLU 380 N 0.58 0.00 0.00 2.33 4.39 -1.32 -2.97 114.58 117.59 3hy1 h GLU 380 Ca 0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.95 3hy1 h GLU 380 Cb 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 3hy1 h GLU 380 CO -0.16 0.29 0.00 -0.07 -1.16 0.00 0.00 179.01 177.91 3hy1 h LEU 381 N 0.00 0.00 0.11 1.33 3.38 -1.13 -3.15 115.31 115.85 3hy1 h LEU 381 Ca -0.00 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.67 3hy1 h LEU 381 Cb 1.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 3hy1 h LEU 381 CO 0.04 0.00 -1.46 0.00 0.09 0.00 0.00 178.44 177.11 3hy1 h ALA 382 N 2.09 0.27 0.00 1.53 0.00 -1.45 -3.24 119.26 118.45 3hy1 h ALA 382 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.83 3hy1 h ALA 382 Cb 0.71 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3hy1 h ALA 382 CO 0.00 1.14 0.00 1.63 0.00 0.00 0.00 179.25 182.02 3hy1 n LYS 383 N -3.44 0.62 -3.74 0.00 5.02 -1.19 -4.78 118.16 110.64 3hy1 n LYS 383 Ca -0.14 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.78 3hy1 n LYS 383 Cb 1.03 -1.07 -0.12 0.00 -0.02 0.00 0.00 35.03 34.85 3hy1 n LYS 383 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3hy1 s LEU 384 N -0.76 3.55 0.07 -0.35 2.96 -1.23 -5.07 118.68 117.86 3hy1 s LEU 384 Ca 0.00 -0.16 -0.25 0.00 -0.22 0.00 0.00 54.13 53.50 3hy1 s LEU 384 Cb 0.00 -1.96 -0.06 0.00 0.50 0.00 0.00 46.19 44.67 3hy1 s LEU 384 CO 0.00 -0.03 0.77 -0.55 -1.32 0.00 0.00 176.35 175.23 3hy1 s SER 385 N 1.57 7.26 0.52 3.68 0.15 -1.26 -4.93 113.70 120.69 3hy1 s SER 385 Ca 0.06 1.50 0.00 0.00 0.70 0.00 0.00 55.95 58.21 3hy1 s SER 385 Cb -0.15 -2.48 0.00 0.00 -1.71 0.00 0.00 66.02 61.68 3hy1 s SER 385 CO 0.05 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.15 3hy1 n GLY 386 N 2.22 -0.08 0.57 9.45 0.00 -1.26 -4.46 105.19 111.63 3hy1 n GLY 386 Ca -0.03 -1.01 0.06 0.00 0.00 0.00 0.00 46.02 45.04 3hy1 n GLY 386 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hy1 n ASP 387 N -1.43 3.03 -4.15 1.61 5.75 -1.26 -4.96 116.55 115.14 3hy1 n ASP 387 Ca 0.00 -2.41 -0.33 0.00 -0.01 0.00 0.00 54.79 52.04 3hy1 n ASP 387 Cb 0.00 -0.31 -0.16 0.00 -1.03 0.00 0.00 41.12 39.63 3hy1 n ASP 387 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3hy1 s THR 388 N -1.72 2.32 0.23 2.12 2.01 -1.26 -0.89 115.64 118.45 3hy1 s THR 388 Ca 0.26 -0.91 -0.30 0.00 0.31 0.00 0.00 61.69 61.05 3hy1 s THR 388 Cb 0.18 -2.03 -0.09 0.00 0.01 0.00 0.00 72.50 70.58 3hy1 s THR 388 CO 0.10 0.47 1.14 -0.22 -0.69 0.00 0.00 174.62 175.42 3hy1 s LEU 389 N 1.31 4.50 0.63 4.42 2.96 0.23 -4.89 118.68 127.85 3hy1 s LEU 389 Ca 0.04 2.24 -0.17 0.00 -0.22 0.00 0.00 54.13 56.02 3hy1 s LEU 389 Cb -0.14 -3.62 -0.02 0.00 0.50 0.00 0.00 46.19 42.92 3hy1 s LEU 389 CO -0.11 -0.24 1.15 1.51 -1.32 0.00 0.00 176.35 177.35 3hy1 s ASP 390 N -0.42 5.11 0.39 3.68 -4.77 -1.26 -1.19 116.67 118.21 3hy1 s ASP 390 Ca 0.48 2.20 0.20 0.00 -3.30 0.00 0.00 52.55 52.12 3hy1 s ASP 390 Cb -0.32 -2.58 0.71 0.00 -1.09 0.00 0.00 42.92 39.64 3hy1 s ASP 390 CO 0.39 -1.64 1.75 1.23 0.70 0.00 0.00 175.17 177.60 3hy1 h GLY 391 N 0.46 0.00 1.64 2.12 0.00 -1.79 -2.96 103.07 102.54 3hy1 h GLY 391 Ca -0.49 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.73 3hy1 h GLY 391 CO 0.54 0.00 -0.37 1.05 0.00 0.00 0.00 176.54 177.76 3hy1 h GLU 392 N 0.00 0.40 -0.26 4.80 9.09 -1.91 0.16 114.58 126.87 3hy1 h GLU 392 Ca -0.00 -0.19 -0.08 0.00 0.05 0.00 0.00 59.36 59.14 3hy1 h GLU 392 Cb 0.88 -0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 27.96 3hy1 h GLU 392 CO 0.05 0.72 -0.16 1.15 0.05 0.00 0.00 179.01 180.82 3hy1 h THR 393 N 0.34 1.30 -0.84 -1.06 2.02 -1.93 -1.84 112.91 110.91 3hy1 h THR 393 Ca 0.04 -1.26 0.04 0.00 0.77 0.00 0.00 66.41 66.00 3hy1 h THR 393 Cb 0.81 1.56 -0.05 0.00 -1.74 0.00 0.00 68.15 68.73 3hy1 h THR 393 CO 0.07 0.40 0.53 0.00 0.37 0.00 0.00 175.52 176.88 3hy1 h ALA 394 N 0.72 1.12 -0.32 6.16 0.00 -1.33 -1.60 119.26 124.02 3hy1 h ALA 394 Ca 0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3hy1 h ALA 394 Cb 0.68 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3hy1 h ALA 394 CO 0.04 0.33 0.09 0.35 0.00 0.00 0.00 179.25 180.06 3hy1 h PHE 395 N 1.01 0.53 -0.57 0.00 3.57 -0.58 -2.01 116.94 118.89 3hy1 h PHE 395 Ca 0.35 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.76 3hy1 h PHE 395 Cb 0.07 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 3hy1 h PHE 395 CO -0.03 0.55 0.23 0.00 -2.23 0.00 0.00 178.31 176.84 3hy1 h ARG 396 N 0.36 0.86 -0.32 1.11 3.08 -1.03 0.74 114.38 119.18 3hy1 h ARG 396 Ca 0.10 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 3hy1 h ARG 396 Cb 0.28 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3hy1 h ARG 396 CO -0.00 0.73 0.18 -0.07 -1.07 0.00 0.00 179.97 179.74 3hy1 h LEU 397 N 0.79 0.38 0.04 3.04 3.38 -1.26 -0.32 115.31 121.37 3hy1 h LEU 397 Ca 0.19 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 3hy1 h LEU 397 Cb 0.19 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3hy1 h LEU 397 CO -0.02 0.31 -0.02 0.22 0.09 0.00 0.00 178.44 179.03 3hy1 h TYR 398 N 0.44 -0.05 -0.26 1.13 3.20 -0.55 0.17 116.97 121.05 3hy1 h TYR 398 Ca 0.12 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.85 3hy1 h TYR 398 Cb 0.01 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 3hy1 h TYR 398 CO 0.00 0.58 -0.38 0.22 -1.64 0.00 0.00 178.16 176.95 3hy1 h ASP 399 N -0.93 0.62 0.00 -2.11 3.58 0.55 -2.69 116.42 115.44 3hy1 h ASP 399 Ca -0.01 -0.27 -0.39 0.00 0.42 0.00 0.00 57.03 56.79 3hy1 h ASP 399 Cb 0.65 -0.17 -0.07 0.00 1.72 0.00 0.00 39.33 41.46 3hy1 h ASP 399 CO 0.01 0.94 -2.41 0.41 -2.88 0.00 0.00 179.24 175.31 3hy1 n THR 400 N -4.04 1.40 0.43 2.25 -1.04 -0.14 -4.63 114.28 108.52 3hy1 n THR 400 Ca -0.01 -0.47 0.11 0.00 -2.04 0.00 0.00 64.05 61.63 3hy1 n THR 400 Cb 0.50 -1.54 0.17 0.00 -1.82 0.00 0.00 70.33 67.65 3hy1 n THR 400 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3hy1 n TYR 401 N -3.55 0.35 -2.66 -1.42 4.01 -1.03 -4.96 117.16 107.90 3hy1 n TYR 401 Ca -0.46 -0.19 -0.18 0.00 -0.16 0.00 0.00 57.90 56.91 3hy1 n TYR 401 Cb 0.92 -0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.97 3hy1 n TYR 401 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hy1 n GLY 402 N 1.33 -0.34 3.47 2.72 0.00 -0.96 -4.74 105.19 106.69 3hy1 n GLY 402 Ca 0.17 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 3hy1 n GLY 402 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hy1 s PHE 403 N -2.99 2.92 0.24 1.61 0.40 0.55 -4.94 117.98 115.76 3hy1 s PHE 403 Ca 0.15 -0.34 -0.31 0.00 -0.60 0.00 0.00 56.93 55.82 3hy1 s PHE 403 Cb -0.06 -3.82 -0.12 0.00 0.51 0.00 0.00 43.02 39.53 3hy1 s PHE 403 CO 0.18 -1.21 1.63 -0.35 0.70 0.00 0.00 175.22 176.18 3hy1 n PRO 404 N 6.79 2.64 0.17 0.24 -0.04 -1.26 -3.37 135.00 140.17 3hy1 n PRO 404 Ca -0.03 0.95 0.16 0.00 -0.04 0.00 0.00 63.50 64.53 3hy1 n PRO 404 Cb 0.46 -2.74 0.76 0.00 -0.04 0.00 0.00 33.50 31.93 3hy1 n PRO 404 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 3hy1 h VAL 405 N 3.53 0.66 0.00 0.52 3.04 -1.96 0.43 116.25 122.47 3hy1 h VAL 405 Ca -0.45 0.00 -0.09 0.00 -1.01 0.00 0.00 66.70 65.15 3hy1 h VAL 405 Cb 1.22 0.85 -0.01 0.00 -2.01 0.00 0.00 31.29 31.34 3hy1 h VAL 405 CO 0.87 0.00 -0.44 -2.24 -1.01 0.00 0.00 177.57 174.74 3hy1 h ASP 406 N 0.00 0.00 -0.09 3.17 3.04 -1.98 0.17 116.42 120.73 3hy1 h ASP 406 Ca 0.11 0.00 -0.03 0.00 -3.24 0.00 0.00 57.03 53.87 3hy1 h ASP 406 Cb 0.49 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.78 3hy1 h ASP 406 CO -0.00 0.44 -0.05 0.25 -2.04 0.00 0.00 179.24 177.85 3hy1 h LEU 407 N 0.00 0.20 -0.41 0.15 5.85 -0.51 -0.06 115.31 120.53 3hy1 h LEU 407 Ca -0.00 -0.41 0.06 0.00 0.84 0.00 0.00 57.88 58.36 3hy1 h LEU 407 Cb 0.83 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.75 3hy1 h LEU 407 CO 0.06 0.57 0.09 0.74 -0.34 0.00 0.00 178.44 179.56 3hy1 h THR 408 N -0.17 0.80 -0.44 1.05 2.02 -1.21 -1.51 112.91 113.46 3hy1 h THR 408 Ca 0.02 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.12 3hy1 h THR 408 Cb 0.49 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 3hy1 h THR 408 CO 0.01 0.04 0.28 0.00 0.37 0.00 0.00 175.52 176.23 3hy1 h ALA 409 N 1.30 1.68 -0.02 6.16 0.00 -0.57 -1.58 119.26 126.23 3hy1 h ALA 409 Ca 0.20 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 3hy1 h ALA 409 Cb 0.23 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3hy1 h ALA 409 CO -0.25 0.30 -0.38 0.22 0.00 0.00 0.00 179.25 179.14 3hy1 h ASP 410 N 0.59 0.03 -0.02 0.00 3.58 -0.00 0.13 116.42 120.73 3hy1 h ASP 410 Ca 0.16 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.55 3hy1 h ASP 410 Cb -0.06 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 40.99 3hy1 h ASP 410 CO -0.03 0.41 -0.15 0.58 -2.88 0.00 0.00 179.24 177.17 3hy1 h VAL 411 N 0.03 1.50 -0.83 2.25 2.07 -0.67 -3.15 116.25 117.45 3hy1 h VAL 411 Ca 0.00 -1.70 0.02 0.00 0.82 0.00 0.00 66.70 65.84 3hy1 h VAL 411 Cb 0.69 2.55 -0.04 0.00 -1.52 0.00 0.00 31.29 32.97 3hy1 h VAL 411 CO 0.05 0.46 0.55 0.00 0.02 0.00 0.00 177.57 178.65 3hy1 h ARG 413 N 1.09 -0.06 0.00 0.00 9.65 -0.76 0.82 114.38 125.12 3hy1 h ARG 413 Ca 0.32 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 59.16 3hy1 h ARG 413 Cb -0.06 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.53 3hy1 h ARG 413 CO -0.08 -0.04 -0.18 0.93 2.80 0.00 0.00 179.97 183.40 3hy1 h GLU 414 N -0.06 0.00 -0.40 0.20 5.08 -1.36 0.23 114.58 118.27 3hy1 h GLU 414 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3hy1 h GLU 414 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3hy1 h GLU 414 CO -0.72 0.18 0.00 0.54 -1.00 0.00 0.00 179.01 178.01 3hy1 n ARG 415 N -3.80 2.52 -2.79 2.33 1.74 -0.18 -4.97 116.66 111.51 3hy1 n ARG 415 Ca -0.02 -2.31 -0.08 0.00 -0.77 0.00 0.00 57.85 54.68 3hy1 n ARG 415 Cb 0.28 -1.52 0.02 0.00 -1.02 0.00 0.00 32.46 30.23 3hy1 n ARG 415 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3hy1 n ASN 416 N 1.50 -3.39 -4.17 0.55 4.05 0.24 -5.04 115.26 109.01 3hy1 n ASN 416 Ca 0.19 -0.16 -0.29 0.00 0.45 0.00 0.00 54.58 54.77 3hy1 n ASN 416 Cb 0.61 -2.01 -0.17 0.00 1.23 0.00 0.00 39.78 39.44 3hy1 n ASN 416 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3hy1 s ILE 417 N -3.03 1.74 0.53 -1.44 1.01 0.14 -4.94 121.20 115.21 3hy1 s ILE 417 Ca 0.18 -0.86 -0.07 0.00 0.00 0.00 0.00 60.65 59.90 3hy1 s ILE 417 Cb -0.08 -1.50 -0.04 0.00 0.01 0.00 0.00 42.46 40.85 3hy1 s ILE 417 CO 0.22 0.49 0.87 -0.54 0.00 0.00 0.00 174.94 175.98 3hy1 s LYS 418 N 0.23 3.55 -0.13 2.79 1.02 -0.07 -3.49 119.74 123.63 3hy1 s LYS 418 Ca -0.11 0.38 -0.03 0.00 0.02 0.00 0.00 55.97 56.23 3hy1 s LYS 418 Cb -0.15 -2.28 -0.03 0.00 -0.52 0.00 0.00 37.83 34.85 3hy1 s LYS 418 CO 0.05 -0.33 -0.04 0.08 -0.92 0.00 0.00 175.35 174.19 3hy1 s VAL 419 N -2.89 3.88 -0.89 3.17 1.01 -1.26 -0.60 120.40 122.82 3hy1 s VAL 419 Ca 0.50 -0.37 -0.25 0.00 0.00 0.00 0.00 61.98 61.86 3hy1 s VAL 419 Cb -0.11 -2.67 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 3hy1 s VAL 419 CO 0.48 0.52 1.87 -0.62 0.00 0.00 0.00 175.10 177.35 3hy1 s ASP 420 N 0.07 5.32 0.07 3.32 2.15 -0.34 -4.83 116.67 122.44 3hy1 s ASP 420 Ca -0.00 -0.67 -0.24 0.00 0.43 0.00 0.00 52.55 52.06 3hy1 s ASP 420 Cb -0.13 -2.56 -0.16 0.00 -0.30 0.00 0.00 42.92 39.77 3hy1 s ASP 420 CO 0.03 -2.56 1.64 -0.08 -0.17 0.00 0.00 175.17 174.03 3hy1 h GLU 421 N 11.43 -0.10 -0.81 4.34 4.22 -1.96 -1.31 114.58 130.38 3hy1 h GLU 421 Ca 0.07 0.01 0.07 0.00 0.08 0.00 0.00 59.36 59.59 3hy1 h GLU 421 Cb 1.02 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.24 3hy1 h GLU 421 CO 1.24 0.01 0.53 0.00 -2.18 0.00 0.00 179.01 178.60 3hy1 h ALA 422 N 0.72 1.65 -0.68 2.92 0.00 -1.99 -1.19 119.26 120.69 3hy1 h ALA 422 Ca -0.01 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3hy1 h ALA 422 Cb 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3hy1 h ALA 422 CO 0.02 0.22 0.13 0.78 0.00 0.00 0.00 179.25 180.40 3hy1 h GLY 423 N 0.85 1.19 0.95 0.00 0.00 -1.83 0.27 103.07 104.50 3hy1 h GLY 423 Ca 0.36 -0.77 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 3hy1 h GLY 423 CO -0.13 0.72 0.16 -2.75 0.00 0.00 0.00 176.54 174.54 3hy1 h PHE 424 N 1.03 0.64 -0.61 5.60 3.04 -0.33 0.19 116.94 126.50 3hy1 h PHE 424 Ca 0.21 -0.05 -0.08 0.00 3.98 0.00 0.00 57.97 62.03 3hy1 h PHE 424 Cb 0.41 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 38.70 3hy1 h PHE 424 CO 0.03 0.57 0.06 0.93 -2.02 0.00 0.00 178.31 177.88 3hy1 h GLU 425 N 0.53 1.02 -0.64 1.11 4.39 -1.04 0.36 114.58 120.32 3hy1 h GLU 425 Ca 0.14 -0.28 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 3hy1 h GLU 425 Cb 0.20 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 3hy1 h GLU 425 CO -0.01 0.96 0.31 0.00 -1.16 0.00 0.00 179.01 179.11 3hy1 h ALA 426 N 1.11 0.82 -0.47 3.43 0.00 -0.17 0.34 119.26 124.31 3hy1 h ALA 426 Ca 0.18 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3hy1 h ALA 426 Cb 0.46 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3hy1 h ALA 426 CO 0.02 0.38 0.14 0.00 0.00 0.00 0.00 179.25 179.79 3hy1 h ALA 427 N 1.14 0.62 -0.14 0.00 0.00 -0.09 0.10 119.26 120.89 3hy1 h ALA 427 Ca 0.22 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3hy1 h ALA 427 Cb 0.12 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3hy1 h ALA 427 CO -0.03 0.28 0.03 0.52 0.00 0.00 0.00 179.25 180.05 3hy1 h MET 428 N 0.63 0.08 0.55 0.00 2.07 0.02 0.64 114.93 118.91 3hy1 h MET 428 Ca 0.15 -0.01 -0.03 0.00 -2.07 0.00 0.00 59.70 57.75 3hy1 h MET 428 Cb 0.29 -0.02 0.01 0.00 -1.87 0.00 0.00 31.60 30.00 3hy1 h MET 428 CO -0.00 0.06 -0.26 1.49 1.07 0.00 0.00 176.91 179.26 3hy1 h GLU 429 N 0.09 -0.71 0.10 1.72 4.57 -0.67 -1.36 114.58 118.32 3hy1 h GLU 429 Ca 0.06 0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.31 3hy1 h GLU 429 Cb 0.05 0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 28.76 3hy1 h GLU 429 CO -0.08 -0.47 -0.31 0.93 -1.18 0.00 0.00 179.01 177.89 3hy1 h GLU 430 N -0.97 -0.51 0.22 1.92 3.07 -0.89 -2.53 114.58 114.88 3hy1 h GLU 430 Ca -0.08 0.03 0.01 0.00 -0.50 0.00 0.00 59.36 58.82 3hy1 h GLU 430 Cb 0.57 0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.57 3hy1 h GLU 430 CO 0.12 -0.34 -0.24 0.37 -1.40 0.00 0.00 179.01 177.53 3hy1 h GLN 431 N -0.53 -0.48 0.00 2.33 5.75 -0.84 -2.68 115.11 118.66 3hy1 h GLN 431 Ca 0.03 0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.55 3hy1 h GLN 431 Cb 0.56 0.11 -0.00 0.00 1.07 0.00 0.00 27.48 29.22 3hy1 h GLN 431 CO -0.19 -0.32 -1.81 -2.13 -2.65 0.00 0.00 178.83 171.72 3hy1 n ARG 432 N -5.36 0.57 0.03 1.69 0.00 -0.52 -3.46 116.66 109.60 3hy1 n ARG 432 Ca -0.08 -0.15 -0.09 0.00 -0.00 0.00 0.00 57.85 57.52 3hy1 n ARG 432 Cb 0.27 -1.42 -0.13 0.00 0.00 0.00 0.00 32.46 31.18 3hy1 n ARG 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3hy1 h ARG 433 N 0.00 0.04 -2.80 -0.14 3.08 -1.35 -3.32 114.38 109.90 3hy1 h ARG 433 Ca -0.02 -0.07 -0.77 0.00 0.07 0.00 0.00 59.98 59.18 3hy1 h ARG 433 Cb 0.85 0.03 -0.19 0.00 0.08 0.00 0.00 29.97 30.74 3hy1 h ARG 433 CO 0.00 0.82 1.75 0.54 -1.07 0.00 0.00 179.97 182.01 3hy1 n ARG 434 N -3.25 4.54 -2.19 0.04 1.74 -1.02 -4.77 116.66 111.75 3hy1 n ARG 434 Ca -0.10 -3.93 -0.42 0.00 -0.77 0.00 0.00 57.85 52.64 3hy1 n ARG 434 Cb 1.00 -2.65 -0.03 0.00 -1.02 0.00 0.00 32.46 29.77 3hy1 n ARG 434 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hy1 s ALA 435 N -1.77 3.58 -0.23 7.54 0.00 -1.25 -4.97 121.76 124.65 3hy1 s ALA 435 Ca 0.43 1.08 -0.09 0.00 0.00 0.00 0.00 51.96 53.39 3hy1 s ALA 435 Cb 0.14 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 3hy1 s ALA 435 CO -0.04 -0.63 0.11 1.03 0.00 0.00 0.00 175.76 176.22 3hy1 s ARG 436 N 1.23 3.92 0.00 0.00 0.52 -1.26 -5.14 118.95 118.22 3hy1 s ARG 436 Ca 0.64 -0.35 0.00 0.00 -0.52 0.00 0.00 55.73 55.50 3hy1 s ARG 436 Cb -0.36 -3.40 0.00 0.00 0.52 0.00 0.00 34.95 31.71 3hy1 s ARG 436 CO 0.30 0.03 0.00 -0.85 0.02 0.00 0.00 175.30 174.80