#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ht4 h LYS 10 N 0.00 0.70 0.01 3.44 1.63 -2.07 -3.33 116.57 116.95 3ht4 h LYS 10 Ca 0.00 -0.71 -0.25 0.00 -0.85 0.00 0.00 60.65 58.84 3ht4 h LYS 10 Cb 0.00 0.19 0.01 0.00 -0.60 0.00 0.00 32.23 31.83 3ht4 h LYS 10 CO 0.00 1.30 -1.00 0.97 -3.45 0.00 0.00 179.45 177.27 3ht4 h ILE 11 N 0.41 1.35 -0.46 2.00 2.10 -2.02 -3.35 117.51 117.54 3ht4 h ILE 11 Ca -0.11 -2.38 0.09 0.00 1.08 0.00 0.00 64.86 63.54 3ht4 h ILE 11 Cb 1.63 2.42 -0.10 0.00 -1.09 0.00 0.00 36.82 39.68 3ht4 h ILE 11 CO 0.19 0.72 -0.25 0.00 -1.08 0.00 0.00 178.15 177.73 3ht4 h ALA 12 N 0.59 0.04 0.00 0.18 0.00 -2.01 -2.01 119.26 116.06 3ht4 h ALA 12 Ca -0.10 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3ht4 h ALA 12 Cb 1.64 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 20.03 3ht4 h ALA 12 CO 0.18 -0.61 -0.05 -1.35 0.00 0.00 0.00 179.25 177.43 3ht4 h PRO 13 N -0.15 0.00 0.13 0.00 0.11 -1.74 0.13 132.00 130.47 3ht4 h PRO 13 Ca 0.21 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.99 3ht4 h PRO 13 Cb 0.49 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.59 3ht4 h PRO 13 CO -0.56 0.05 -1.73 0.82 -0.21 0.00 0.00 178.00 176.37 3ht4 h ILE 14 N 0.00 0.82 -0.08 4.15 2.04 -1.57 -3.06 117.51 119.81 3ht4 h ILE 14 Ca -0.00 -2.38 -0.05 0.00 1.00 0.00 0.00 64.86 63.43 3ht4 h ILE 14 Cb 0.21 2.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.87 3ht4 h ILE 14 CO 0.01 0.79 -0.19 -0.37 0.00 0.00 0.00 178.15 178.38 3ht4 h VAL 15 N -0.12 1.18 -0.61 1.67 -1.51 -1.29 0.25 116.25 115.82 3ht4 h VAL 15 Ca -0.37 -0.82 0.14 0.00 -1.23 0.00 0.00 66.70 64.42 3ht4 h VAL 15 Cb 1.91 1.34 -0.03 0.00 -2.13 0.00 0.00 31.29 32.37 3ht4 h VAL 15 CO 0.07 0.24 0.42 0.50 -1.23 0.00 0.00 177.57 177.58 3ht4 h LYS 16 N 0.12 0.23 0.10 5.19 1.63 -0.83 -2.73 116.57 120.28 3ht4 h LYS 16 Ca 0.02 -0.01 -0.34 0.00 -0.85 0.00 0.00 60.65 59.47 3ht4 h LYS 16 Cb 0.41 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.97 3ht4 h LYS 16 CO 0.03 0.15 -1.87 -1.91 -3.45 0.00 0.00 179.45 172.40 3ht4 n GLU 17 N -4.44 0.72 -0.15 1.90 2.13 0.40 -3.45 120.64 117.75 3ht4 n GLU 17 Ca 0.11 0.32 -0.08 0.00 0.66 0.00 0.00 57.16 58.17 3ht4 n GLU 17 Cb 0.51 -1.71 0.00 0.00 0.27 0.00 0.00 31.44 30.52 3ht4 n GLU 17 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3ht4 h VAL 18 N -0.17 1.17 -0.50 6.31 2.07 -0.65 0.19 116.25 124.68 3ht4 h VAL 18 Ca -0.42 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 3ht4 h VAL 18 Cb 1.88 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 3ht4 h VAL 18 CO 0.01 0.18 0.16 -0.33 0.02 0.00 0.00 177.57 177.61 3ht4 h GLU 19 N 0.57 0.73 0.00 1.57 5.08 -1.66 0.04 114.58 120.92 3ht4 h GLU 19 Ca 0.15 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3ht4 h GLU 19 Cb 0.08 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.20 3ht4 h GLU 19 CO -0.02 0.64 0.00 1.03 -1.00 0.00 0.00 179.01 179.66 3ht4 h SER 20 N 0.72 0.00 0.16 1.42 0.87 -1.41 -2.79 113.55 112.52 3ht4 h SER 20 Ca 0.17 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.49 3ht4 h SER 20 Cb 0.21 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.19 3ht4 h SER 20 CO -0.01 0.00 -1.06 -0.61 -0.53 0.00 0.00 176.83 174.62 3ht4 h GLN 21 N 0.00 0.33 -0.01 2.24 4.15 0.11 -3.38 115.11 118.55 3ht4 h GLN 21 Ca 0.00 -0.57 0.00 0.00 0.77 0.00 0.00 58.65 58.85 3ht4 h GLN 21 Cb 0.59 0.21 0.00 0.00 0.21 0.00 0.00 27.48 28.49 3ht4 h GLN 21 CO 0.00 1.27 -0.30 0.44 -1.93 0.00 0.00 178.83 178.31 3ht4 n ILE 22 N -4.01 0.00 -0.28 2.39 -5.35 -0.21 -4.37 119.36 107.54 3ht4 n ILE 22 Ca -0.17 -0.20 0.15 0.00 -0.27 0.00 0.00 62.75 62.26 3ht4 n ILE 22 Cb 0.89 0.76 0.29 0.00 -1.74 0.00 0.00 39.64 39.83 3ht4 n ILE 22 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3ht4 n THR 23 N -0.26 -0.35 0.20 7.28 -1.04 -1.06 -1.04 114.28 118.01 3ht4 n THR 23 Ca 0.12 1.81 -0.17 0.00 -2.04 0.00 0.00 64.05 63.76 3ht4 n THR 23 Cb 0.40 -2.69 -0.10 0.00 -1.82 0.00 0.00 70.33 66.13 3ht4 n THR 23 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3ht4 h GLU 24 N 0.00 -0.85 0.00 -2.82 4.39 -1.90 0.18 114.58 113.58 3ht4 h GLU 24 Ca 0.54 0.06 -0.07 0.00 0.34 0.00 0.00 59.36 60.23 3ht4 h GLU 24 Cb 1.19 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 30.02 3ht4 h GLU 24 CO -0.76 -0.56 -0.35 -0.39 -1.16 0.00 0.00 179.01 175.79 3ht4 h VAL 25 N -0.88 0.74 0.56 3.13 -1.51 -1.45 -2.75 116.25 114.09 3ht4 h VAL 25 Ca -0.03 -1.55 -0.03 0.00 -1.23 0.00 0.00 66.70 63.86 3ht4 h VAL 25 Cb 0.82 2.00 0.01 0.00 -2.13 0.00 0.00 31.29 31.99 3ht4 h VAL 25 CO -0.18 0.34 -0.27 0.45 -1.23 0.00 0.00 177.57 176.68 3ht4 h HIS 26 N 0.00 -0.70 -1.19 5.19 3.86 -0.75 -1.77 115.15 119.79 3ht4 h HIS 26 Ca -0.00 -0.02 0.36 0.00 -1.16 0.00 0.00 60.37 59.55 3ht4 h HIS 26 Cb 0.97 0.23 -0.11 0.00 1.06 0.00 0.00 27.41 29.56 3ht4 h HIS 26 CO 0.00 -0.37 0.77 0.87 0.86 0.00 0.00 177.93 180.06 3ht4 h LYS 27 N -1.03 0.21 -0.11 2.45 1.79 -0.64 -2.04 116.57 117.20 3ht4 h LYS 27 Ca -0.08 -0.01 -0.12 0.00 -2.18 0.00 0.00 60.65 58.26 3ht4 h LYS 27 Cb 0.65 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 3ht4 h LYS 27 CO 0.13 0.14 -0.41 -0.09 -1.08 0.00 0.00 179.45 178.13 3ht4 h ARG 28 N 0.21 0.47 -0.86 3.15 2.43 -1.19 -2.95 114.38 115.64 3ht4 h ARG 28 Ca 0.72 -0.36 0.11 0.00 -0.81 0.00 0.00 59.98 59.64 3ht4 h ARG 28 Cb 2.11 0.07 -0.08 0.00 -0.42 0.00 0.00 29.97 31.65 3ht4 h ARG 28 CO -0.37 0.99 0.49 0.00 -1.51 0.00 0.00 179.97 179.58 3ht4 h ALA 29 N 0.49 1.26 -0.74 2.80 0.00 -0.61 0.49 119.26 122.94 3ht4 h ALA 29 Ca -0.02 0.04 0.21 0.00 0.00 0.00 0.00 54.91 55.14 3ht4 h ALA 29 Cb 1.05 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 3ht4 h ALA 29 CO 0.09 0.08 0.53 -0.44 0.00 0.00 0.00 179.25 179.51 3ht4 h ASP 30 N 0.80 0.03 0.36 0.00 3.32 -1.30 -0.95 116.42 118.68 3ht4 h ASP 30 Ca 0.43 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.46 3ht4 h ASP 30 Cb 0.45 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 3ht4 h ASP 30 CO -0.27 0.01 -0.17 -0.33 -1.72 0.00 0.00 179.24 176.76 3ht4 h GLU 31 N 0.03 -0.47 -0.30 3.56 5.08 -0.85 -1.01 114.58 120.63 3ht4 h GLU 31 Ca 0.35 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.83 3ht4 h GLU 31 Cb 1.37 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.71 3ht4 h GLU 31 CO -0.02 -0.31 0.41 -0.39 -1.00 0.00 0.00 179.01 177.70 3ht4 h VAL 32 N -0.87 0.28 0.35 3.13 -1.51 -1.35 0.44 116.25 116.73 3ht4 h VAL 32 Ca -0.05 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.40 3ht4 h VAL 32 Cb 0.37 0.66 0.00 0.00 -2.13 0.00 0.00 31.29 30.19 3ht4 h VAL 32 CO 0.08 0.00 -0.17 0.40 -1.23 0.00 0.00 177.57 176.65 3ht4 h ILE 33 N 0.00 0.49 0.03 7.19 2.04 -1.15 0.14 117.51 126.25 3ht4 h ILE 33 Ca 0.14 -0.69 0.02 0.00 1.00 0.00 0.00 64.86 65.33 3ht4 h ILE 33 Cb 0.95 0.76 -0.05 0.00 -0.74 0.00 0.00 36.82 37.74 3ht4 h ILE 33 CO -0.00 0.10 -0.53 -0.08 0.00 0.00 0.00 178.15 177.64 3ht4 h GLU 34 N -0.93 -0.66 -0.68 2.37 4.81 0.80 1.48 114.58 121.77 3ht4 h GLU 34 Ca -0.05 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.29 3ht4 h GLU 34 Cb 0.53 0.15 -0.10 0.00 0.63 0.00 0.00 28.75 29.96 3ht4 h GLU 34 CO 0.08 -0.44 -0.57 1.03 -0.73 0.00 0.00 179.01 178.38 3ht4 h SER 35 N -0.68 -2.00 -0.96 1.04 0.87 -0.41 0.63 113.55 112.03 3ht4 h SER 35 Ca 0.01 0.28 0.09 0.00 -1.23 0.00 0.00 61.79 60.94 3ht4 h SER 35 Cb 0.72 0.85 -0.07 0.00 -0.44 0.00 0.00 62.40 63.46 3ht4 h SER 35 CO -0.34 -0.32 0.61 0.78 -0.53 0.00 0.00 176.83 177.03 3ht4 h ASN 36 N -0.22 0.93 -0.06 6.23 2.35 0.00 -1.59 115.58 123.22 3ht4 h ASN 36 Ca 0.11 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.89 3ht4 h ASN 36 Cb 0.51 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.71 3ht4 h ASN 36 CO -0.75 0.55 0.03 -0.61 -1.65 0.00 0.00 177.43 175.00 3ht4 h GLN 37 N 1.04 0.09 0.13 0.81 5.75 0.38 -2.74 115.11 120.58 3ht4 h GLN 37 Ca 0.44 -0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.94 3ht4 h GLN 37 Cb 0.30 -0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.79 3ht4 h GLN 37 CO -0.21 0.18 -0.52 0.35 -2.65 0.00 0.00 178.83 175.98 3ht4 h PHE 38 N -0.02 -1.50 -0.60 3.99 -0.00 0.11 -0.21 116.94 118.71 3ht4 h PHE 38 Ca 0.02 0.04 0.12 0.00 -0.00 0.00 0.00 57.97 58.15 3ht4 h PHE 38 Cb 0.12 0.64 -0.11 0.00 -0.00 0.00 0.00 35.95 36.60 3ht4 h PHE 38 CO -0.03 -0.60 -0.15 -0.09 -0.00 0.00 0.00 178.31 177.45 3ht4 h ARG 39 N -0.76 0.00 -0.53 1.11 2.43 -1.43 0.54 114.38 115.75 3ht4 h ARG 39 Ca -0.00 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.26 3ht4 h ARG 39 Cb 0.76 -0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.23 3ht4 h ARG 39 CO -0.28 0.00 0.10 0.28 -1.51 0.00 0.00 179.97 178.57 3ht4 h VAL 40 N 0.00 0.69 -0.68 0.20 2.07 -1.06 -1.60 116.25 115.86 3ht4 h VAL 40 Ca 0.29 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.72 3ht4 h VAL 40 Cb 0.44 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 3ht4 h VAL 40 CO -0.61 0.04 0.41 0.25 0.02 0.00 0.00 177.57 177.68 3ht4 h LEU 41 N 0.24 0.81 -0.65 2.57 5.85 0.85 -2.26 115.31 122.73 3ht4 h LEU 41 Ca 0.27 -0.04 -0.15 0.00 0.84 0.00 0.00 57.88 58.80 3ht4 h LEU 41 Cb 0.38 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 3ht4 h LEU 41 CO -0.35 0.62 -0.59 -0.33 -0.34 0.00 0.00 178.44 177.45 3ht4 h GLU 42 N 0.94 0.28 -0.19 1.25 4.39 -0.27 -0.79 114.58 120.19 3ht4 h GLU 42 Ca 0.25 -0.18 -0.05 0.00 0.34 0.00 0.00 59.36 59.71 3ht4 h GLU 42 Cb -0.04 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 3ht4 h GLU 42 CO -0.05 0.78 -0.08 1.03 -1.16 0.00 0.00 179.01 179.53 3ht4 h SER 43 N 0.21 0.41 -0.50 1.42 0.87 -0.99 0.33 113.55 115.30 3ht4 h SER 43 Ca -0.00 -0.40 0.08 0.00 -1.23 0.00 0.00 61.79 60.24 3ht4 h SER 43 Cb 1.09 -0.11 -0.07 0.00 -0.44 0.00 0.00 62.40 62.87 3ht4 h SER 43 CO 0.09 0.72 0.12 -0.26 -0.53 0.00 0.00 176.83 176.97 3ht4 h PHE 44 N 0.09 0.19 -0.08 2.24 -1.00 -1.35 0.92 116.94 117.96 3ht4 h PHE 44 Ca 0.04 0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.88 3ht4 h PHE 44 Cb 0.56 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 40.09 3ht4 h PHE 44 CO 0.06 0.01 -0.05 0.78 -1.61 0.00 0.00 178.31 177.50 3ht4 h GLY 45 N 0.26 0.01 2.00 -1.45 0.00 -0.99 -0.33 103.07 102.58 3ht4 h GLY 45 Ca 0.25 0.07 -0.05 0.00 0.00 0.00 0.00 47.33 47.59 3ht4 h GLY 45 CO -0.31 -0.07 -0.24 1.70 0.00 0.00 0.00 176.54 177.62 3ht4 h LYS 46 N -0.06 0.00 -0.35 4.80 3.64 0.33 -1.65 116.57 123.28 3ht4 h LYS 46 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3ht4 h LYS 46 Cb 0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3ht4 h LYS 46 CO -0.12 0.24 0.00 0.72 -2.27 0.00 0.00 179.45 178.03 3ht4 n HIS 47 N -3.96 0.45 -4.11 1.91 8.25 0.26 -4.99 115.22 113.03 3ht4 n HIS 47 Ca -0.02 -0.24 -0.30 0.00 -0.26 0.00 0.00 57.72 56.91 3ht4 n HIS 47 Cb 0.32 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.38 3ht4 n HIS 47 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3ht4 n LYS 48 N 1.40 -1.91 -2.08 -0.41 5.02 -0.16 -4.83 118.16 115.20 3ht4 n LYS 48 Ca 0.18 0.24 -0.42 0.00 -2.02 0.00 0.00 58.31 56.29 3ht4 n LYS 48 Cb 0.58 -3.93 -0.03 0.00 -0.02 0.00 0.00 35.03 31.64 3ht4 n LYS 48 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3ht4 s ILE 49 N -4.08 3.24 0.28 -0.18 -0.00 -1.08 -5.01 121.20 114.36 3ht4 s ILE 49 Ca 0.07 0.78 0.10 0.00 -0.00 0.00 0.00 60.65 61.60 3ht4 s ILE 49 Cb -0.03 -3.50 -0.05 0.00 -0.00 0.00 0.00 42.46 38.88 3ht4 s ILE 49 CO 0.94 0.02 -0.16 -0.55 -0.00 0.00 0.00 174.94 175.20 3ht4 s SER 50 N 1.71 3.33 0.62 4.36 0.15 -1.26 -5.01 113.70 117.60 3ht4 s SER 50 Ca 0.68 -1.07 0.30 0.00 0.70 0.00 0.00 55.95 56.56 3ht4 s SER 50 Cb -0.37 -0.26 1.61 0.00 -1.71 0.00 0.00 66.02 65.29 3ht4 s SER 50 CO 0.30 -0.08 1.97 -2.24 1.20 0.00 0.00 173.24 174.39 3ht4 h ASP 51 N 2.29 0.00 -0.58 5.45 3.04 -2.01 0.89 116.42 125.50 3ht4 h ASP 51 Ca -0.40 0.00 0.17 0.00 -3.24 0.00 0.00 57.03 53.56 3ht4 h ASP 51 Cb 1.25 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.51 3ht4 h ASP 51 CO 0.63 0.00 0.74 0.77 -2.04 0.00 0.00 179.24 179.34 3ht4 h SER 52 N 0.00 0.00 1.79 4.15 4.64 -1.99 0.61 113.55 122.75 3ht4 h SER 52 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3ht4 h SER 52 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 3ht4 h SER 52 CO -0.00 0.00 -0.16 0.45 -0.87 0.00 0.00 176.83 176.25 3ht4 h HIS 53 N 0.00 0.00 0.00 4.77 3.86 0.43 -3.10 115.15 121.11 3ht4 h HIS 53 Ca 0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.49 3ht4 h HIS 53 Cb 1.76 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.23 3ht4 h HIS 53 CO 0.00 0.00 0.00 1.19 0.86 0.00 0.00 177.93 179.98 3ht4 n PHE 54 N -2.95 0.00 -2.40 2.45 3.72 0.21 -4.30 117.46 114.19 3ht4 n PHE 54 Ca 0.04 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.01 3ht4 n PHE 54 Cb 0.52 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.04 3ht4 n PHE 54 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3ht4 s ILE 55 N -2.00 4.11 0.54 4.37 -1.09 -1.17 -4.63 121.20 121.32 3ht4 s ILE 55 Ca 0.24 1.46 -0.18 0.00 -2.23 0.00 0.00 60.65 59.93 3ht4 s ILE 55 Cb 0.11 -3.94 -0.06 0.00 -1.58 0.00 0.00 42.46 36.99 3ht4 s ILE 55 CO 0.18 0.01 1.07 -2.84 -1.23 0.00 0.00 174.94 172.14 3ht4 s PRO 56 N 2.11 3.48 0.18 2.79 0.02 -1.26 -4.84 135.00 137.49 3ht4 s PRO 56 Ca 0.58 1.39 0.10 0.00 0.02 0.00 0.00 61.00 63.09 3ht4 s PRO 56 Cb -0.27 -2.04 -0.04 0.00 0.02 0.00 0.00 34.50 32.17 3ht4 s PRO 56 CO 0.24 -0.70 -0.21 0.95 -0.33 0.00 0.00 177.00 176.94 3ht4 s THR 57 N -2.07 2.11 0.41 0.99 -4.23 -1.26 -4.93 115.64 106.65 3ht4 s THR 57 Ca 0.68 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.23 3ht4 s THR 57 Cb -0.19 -2.00 -0.03 0.00 1.34 0.00 0.00 72.50 71.63 3ht4 s THR 57 CO 0.28 -0.22 0.12 0.42 -0.54 0.00 0.00 174.62 174.67 3ht4 s THR 58 N -1.88 0.68 0.00 3.99 -4.23 -1.26 -2.36 115.64 110.58 3ht4 s THR 58 Ca 0.19 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.70 3ht4 s THR 58 Cb -0.07 -2.37 0.00 0.00 1.34 0.00 0.00 72.50 71.40 3ht4 s THR 58 CO 0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 3ht4 n GLY 59 N -0.92 4.00 0.22 3.99 0.00 -1.26 -0.79 105.19 110.42 3ht4 n GLY 59 Ca -0.07 0.16 0.02 0.00 0.00 0.00 0.00 46.02 46.14 3ht4 n GLY 59 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3ht4 h TYR 60 N 0.00 0.13 -5.07 1.61 0.05 -1.96 -3.37 116.97 108.36 3ht4 h TYR 60 Ca 0.00 -0.02 -0.25 0.00 0.05 0.00 0.00 58.73 58.51 3ht4 h TYR 60 Cb 0.00 -0.03 0.15 0.00 1.01 0.00 0.00 36.73 37.86 3ht4 h TYR 60 CO 0.00 0.37 -0.68 0.41 -1.05 0.00 0.00 178.16 177.21 3ht4 n GLY 61 N -0.69 -0.46 3.86 3.88 0.00 0.03 -0.05 105.19 111.75 3ht4 n GLY 61 Ca -0.02 0.18 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 3ht4 n GLY 61 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ht4 s TYR 62 N -3.31 3.65 -0.17 1.61 2.02 -1.26 -3.96 117.35 115.93 3ht4 s TYR 62 Ca 0.15 0.84 -0.01 0.00 -0.37 0.00 0.00 57.07 57.68 3ht4 s TYR 62 Cb -0.02 -2.19 0.00 0.00 -0.40 0.00 0.00 41.96 39.36 3ht4 s TYR 62 CO 0.62 0.61 0.15 -0.25 -1.57 0.00 0.00 175.55 175.10 3ht4 n ASP 63 N 1.46 -2.37 -4.36 2.29 8.00 -1.26 -5.00 116.55 115.31 3ht4 n ASP 63 Ca -0.12 -0.08 -0.45 0.00 0.71 0.00 0.00 54.79 54.85 3ht4 n ASP 63 Cb 0.53 -1.11 -0.01 0.00 -0.02 0.00 0.00 41.12 40.51 3ht4 n ASP 63 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3ht4 s ASP 64 N -3.09 7.07 0.49 -2.24 -1.08 -1.26 -4.87 116.67 111.68 3ht4 s ASP 64 Ca 0.05 -3.12 0.15 0.00 -0.52 0.00 0.00 52.55 49.11 3ht4 s ASP 64 Cb -0.02 -2.25 1.16 0.00 -1.46 0.00 0.00 42.92 40.35 3ht4 s ASP 64 CO 0.10 -0.50 2.09 0.40 0.52 0.00 0.00 175.17 177.78 3ht4 h ILE 65 N 4.31 0.98 0.10 4.11 1.08 -1.94 -1.18 117.51 124.97 3ht4 h ILE 65 Ca 0.17 -0.06 -0.00 0.00 -0.39 0.00 0.00 64.86 64.58 3ht4 h ILE 65 Cb 0.94 0.78 0.00 0.00 -3.07 0.00 0.00 36.82 35.47 3ht4 h ILE 65 CO 0.97 0.03 -0.05 1.23 -0.69 0.00 0.00 178.15 179.65 3ht4 h GLY 66 N 0.18 -0.14 0.96 5.37 0.00 -1.87 -1.30 103.07 106.27 3ht4 h GLY 66 Ca 0.10 0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.46 3ht4 h GLY 66 CO -0.02 -0.05 -0.23 -0.09 0.00 0.00 0.00 176.54 176.15 3ht4 h ARG 67 N -0.24 -0.63 -0.22 4.80 2.43 -1.56 -0.96 114.38 118.01 3ht4 h ARG 67 Ca -0.01 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 3ht4 h ARG 67 Cb 0.20 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 3ht4 h ARG 67 CO 0.02 -0.40 0.15 -0.44 -1.51 0.00 0.00 179.97 177.80 3ht4 h ASP 68 N -0.70 0.08 0.39 -3.80 5.19 -1.29 -1.82 116.42 114.47 3ht4 h ASP 68 Ca -0.07 -0.00 -0.31 0.00 -0.62 0.00 0.00 57.03 56.03 3ht4 h ASP 68 Cb 0.52 -0.02 -0.03 0.00 0.18 0.00 0.00 39.33 39.98 3ht4 h ASP 68 CO 0.11 0.05 -1.75 0.00 -3.12 0.00 0.00 179.24 174.53 3ht4 h THR 69 N 0.09 0.84 -0.40 0.35 1.03 -1.10 -2.69 112.91 111.03 3ht4 h THR 69 Ca 0.10 -2.63 -0.05 0.00 -0.01 0.00 0.00 66.41 63.83 3ht4 h THR 69 Cb 0.28 2.50 -0.02 0.00 -1.07 0.00 0.00 68.15 69.85 3ht4 h THR 69 CO -0.01 0.67 0.05 0.25 -0.01 0.00 0.00 175.52 176.47 3ht4 h LEU 70 N 0.03 0.57 -0.54 0.00 5.85 -0.98 -0.28 115.31 119.95 3ht4 h LEU 70 Ca -0.31 -0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.18 3ht4 h LEU 70 Cb 2.01 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.88 3ht4 h LEU 70 CO 0.09 0.60 -0.18 -0.33 -0.34 0.00 0.00 178.44 178.28 3ht4 h GLU 71 N 0.59 0.98 0.00 1.25 5.08 -1.35 -1.82 114.58 119.30 3ht4 h GLU 71 Ca 0.13 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 3ht4 h GLU 71 Cb 0.30 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3ht4 h GLU 71 CO 0.00 1.07 0.00 1.63 -1.00 0.00 0.00 179.01 180.72 3ht4 n LYS 72 N -4.12 0.17 -0.00 2.33 5.02 -1.02 -2.26 118.16 118.28 3ht4 n LYS 72 Ca 0.01 0.15 -0.01 0.00 -2.02 0.00 0.00 58.31 56.44 3ht4 n LYS 72 Cb 0.44 -1.70 -0.00 0.00 -0.02 0.00 0.00 35.03 33.75 3ht4 n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3ht4 h VAL 73 N 0.00 0.00 -0.97 -0.18 2.07 -0.66 -2.83 116.25 113.68 3ht4 h VAL 73 Ca 0.00 -0.44 0.14 0.00 0.82 0.00 0.00 66.70 67.21 3ht4 h VAL 73 Cb 0.63 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.25 3ht4 h VAL 73 CO 0.00 0.00 -0.41 -1.22 0.02 0.00 0.00 177.57 175.96 3ht4 n TYR 74 N -3.37 -0.05 -0.36 1.57 4.02 -0.72 -0.96 117.16 117.29 3ht4 n TYR 74 Ca -0.01 1.20 0.01 0.00 -0.01 0.00 0.00 57.90 59.09 3ht4 n TYR 74 Cb 0.02 -0.81 0.17 0.00 -0.02 0.00 0.00 39.34 38.70 3ht4 n TYR 74 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3ht4 h ALA 75 N 1.18 1.38 0.46 -0.72 0.00 -1.60 0.50 119.26 120.47 3ht4 h ALA 75 Ca 0.30 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3ht4 h ALA 75 Cb 0.55 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3ht4 h ALA 75 CO -0.95 0.51 -0.51 0.22 0.00 0.00 0.00 179.25 178.52 3ht4 h ASP 76 N 1.22 -1.40 -0.36 0.00 3.58 -0.78 1.68 116.42 120.35 3ht4 h ASP 76 Ca 0.40 0.12 -0.02 0.00 0.42 0.00 0.00 57.03 57.94 3ht4 h ASP 76 Cb 0.04 0.47 -0.02 0.00 1.72 0.00 0.00 39.33 41.55 3ht4 h ASP 76 CO -0.13 -0.66 0.14 0.58 -2.88 0.00 0.00 179.24 176.29 3ht4 h VAL 77 N -0.98 1.19 0.00 2.25 2.07 0.02 -0.99 116.25 119.82 3ht4 h VAL 77 Ca -0.06 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 66.86 3ht4 h VAL 77 Cb 0.86 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 3ht4 h VAL 77 CO -0.09 0.21 0.00 0.49 0.02 0.00 0.00 177.57 178.21 3ht4 n PHE 78 N -4.67 0.00 -0.74 1.57 3.72 0.16 -4.79 117.46 112.71 3ht4 n PHE 78 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3ht4 n PHE 78 Cb 0.15 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.69 3ht4 n PHE 78 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ht4 n GLY 79 N 0.11 0.59 3.79 1.37 0.00 -0.37 -4.11 105.19 106.57 3ht4 n GLY 79 Ca 0.08 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 3ht4 n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ht4 s ALA 80 N -2.00 3.58 0.02 4.61 0.00 0.57 -4.43 121.76 124.11 3ht4 s ALA 80 Ca 0.00 -1.61 0.01 0.00 0.00 0.00 0.00 51.96 50.36 3ht4 s ALA 80 Cb 0.00 -1.06 -0.26 0.00 0.00 0.00 0.00 23.12 21.80 3ht4 s ALA 80 CO 0.00 0.14 0.93 0.93 0.00 0.00 0.00 175.76 177.76 3ht4 h GLU 81 N 1.49 0.17 -4.91 0.00 5.08 -1.08 -3.31 114.58 112.03 3ht4 h GLU 81 Ca -0.46 -0.30 -0.36 0.00 -1.00 0.00 0.00 59.36 57.24 3ht4 h GLU 81 Cb 1.25 0.11 -0.23 0.00 0.50 0.00 0.00 28.75 30.37 3ht4 h GLU 81 CO 0.60 1.03 -0.76 0.00 -1.00 0.00 0.00 179.01 178.88 3ht4 s ALA 82 N -2.63 0.85 -0.02 3.43 0.00 -0.11 -4.79 121.76 118.49 3ht4 s ALA 82 Ca -0.06 -0.75 0.02 0.00 0.00 0.00 0.00 51.96 51.17 3ht4 s ALA 82 Cb 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.12 3ht4 s ALA 82 CO 0.85 0.11 -0.06 0.20 0.00 0.00 0.00 175.76 176.85 3ht4 s GLY 83 N -1.25 0.39 -0.51 0.00 0.00 -1.25 -1.07 107.32 103.63 3ht4 s GLY 83 Ca -0.03 -0.23 0.06 0.00 0.00 0.00 0.00 44.72 44.52 3ht4 s GLY 83 CO 0.01 -0.03 0.50 -0.10 0.00 0.00 0.00 173.10 173.47 3ht4 n LEU 84 N 3.27 1.27 -4.14 0.66 7.94 0.26 -4.65 117.00 121.62 3ht4 n LEU 84 Ca -0.17 -4.85 -0.38 0.00 -1.11 0.00 0.00 56.01 49.50 3ht4 n LEU 84 Cb 0.55 0.05 -0.09 0.00 0.53 0.00 0.00 43.42 44.47 3ht4 n LEU 84 CO 0.25 1.93 0.04 0.54 -1.11 0.00 0.00 177.39 179.04 3ht4 s VAL 85 N -1.09 3.94 0.18 1.96 0.11 -1.26 -2.06 120.40 122.18 3ht4 s VAL 85 Ca 0.33 -2.59 0.08 0.00 -2.93 0.00 0.00 61.98 56.88 3ht4 s VAL 85 Cb 0.08 -3.57 -0.04 0.00 -1.53 0.00 0.00 36.38 31.31 3ht4 s VAL 85 CO -0.13 -0.85 -0.17 0.00 -3.33 0.00 0.00 175.10 170.61 3ht4 s ARG 86 N 0.36 1.30 0.35 1.54 1.70 -1.26 -4.74 118.95 118.20 3ht4 s ARG 86 Ca 0.14 -1.46 0.02 0.00 -0.47 0.00 0.00 55.73 53.96 3ht4 s ARG 86 Cb -0.20 -1.29 0.63 0.00 -0.57 0.00 0.00 34.95 33.51 3ht4 s ARG 86 CO -0.04 0.25 2.00 -1.35 -1.08 0.00 0.00 175.30 175.08 3ht4 h PRO 87 N 3.04 0.85 -0.01 3.89 0.11 -1.92 -3.13 132.00 134.84 3ht4 h PRO 87 Ca -0.41 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3ht4 h PRO 87 Cb 1.21 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 3ht4 h PRO 87 CO 0.54 0.56 -0.01 1.96 -0.21 0.00 0.00 178.00 180.85 3ht4 h GLN 88 N 0.88 -0.00 -5.15 1.05 7.50 -1.96 -3.37 115.11 114.06 3ht4 h GLN 88 Ca 0.26 0.00 -0.64 0.00 0.50 0.00 0.00 58.65 58.77 3ht4 h GLN 88 Cb -0.04 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.45 3ht4 h GLN 88 CO -0.06 -0.00 1.23 -0.89 -1.50 0.00 0.00 178.83 177.61 3ht4 n ILE 89 N -2.95 0.00 0.11 2.54 5.41 -1.18 -4.79 119.36 118.50 3ht4 n ILE 89 Ca 0.00 0.00 -0.17 0.00 1.00 0.00 0.00 62.75 63.58 3ht4 n ILE 89 Cb 0.00 -0.44 -0.14 0.00 -0.71 0.00 0.00 39.64 38.35 3ht4 n ILE 89 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 176.55 176.71 3ht4 h ILE 90 N 6.33 1.48 -1.78 1.39 3.07 -1.86 -2.17 117.51 123.96 3ht4 h ILE 90 Ca -0.08 -3.03 0.00 0.00 1.55 0.00 0.00 64.86 63.30 3ht4 h ILE 90 Cb 1.24 2.96 0.00 0.00 -0.27 0.00 0.00 36.82 40.74 3ht4 h ILE 90 CO 1.01 0.89 0.00 -1.54 -1.05 0.00 0.00 178.15 177.45 3ht4 n SER 91 N -3.55 0.00 0.12 2.16 3.41 -1.25 -2.14 113.62 112.36 3ht4 n SER 91 Ca -0.09 -0.78 0.11 0.00 -0.26 0.00 0.00 58.87 57.85 3ht4 n SER 91 Cb 1.03 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 65.00 3ht4 n SER 91 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3ht4 h GLY 92 N 0.00 0.00 1.19 5.00 0.00 -1.77 -2.31 103.07 105.18 3ht4 h GLY 92 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.01 3ht4 h GLY 92 CO 0.00 0.00 -1.39 -0.84 0.00 0.00 0.00 176.54 174.31 3ht4 h THR 93 N 0.00 1.31 -0.75 4.70 2.02 -1.97 -2.75 112.91 115.46 3ht4 h THR 93 Ca -0.00 -2.65 0.06 0.00 0.77 0.00 0.00 66.41 64.58 3ht4 h THR 93 Cb 1.01 3.03 -0.06 0.00 -1.74 0.00 0.00 68.15 70.39 3ht4 h THR 93 CO 0.00 0.79 0.44 -0.74 0.37 0.00 0.00 175.52 176.39 3ht4 h HIS 94 N 0.10 0.82 -0.29 3.16 6.17 -1.96 -0.05 115.15 123.10 3ht4 h HIS 94 Ca -0.24 0.03 0.03 0.00 0.71 0.00 0.00 60.37 60.89 3ht4 h HIS 94 Cb 2.09 -0.26 -0.03 0.00 2.52 0.00 0.00 27.41 31.73 3ht4 h HIS 94 CO 0.14 0.40 0.11 0.00 0.71 0.00 0.00 177.93 179.29 3ht4 h ALA 95 N 1.37 0.33 -0.31 5.26 0.00 -1.46 0.26 119.26 124.72 3ht4 h ALA 95 Ca 0.33 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.14 3ht4 h ALA 95 Cb 0.18 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3ht4 h ALA 95 CO -0.18 -0.29 -0.30 0.82 0.00 0.00 0.00 179.25 179.30 3ht4 h ILE 96 N 0.24 1.30 -0.37 0.00 2.04 -1.14 0.49 117.51 120.07 3ht4 h ILE 96 Ca 0.12 -1.47 0.08 0.00 1.00 0.00 0.00 64.86 64.59 3ht4 h ILE 96 Cb 0.08 1.54 -0.09 0.00 -0.74 0.00 0.00 36.82 37.61 3ht4 h ILE 96 CO -0.12 0.47 -0.31 -1.28 0.00 0.00 0.00 178.15 176.92 3ht4 h SER 97 N 0.51 -1.03 0.36 1.72 0.87 -0.81 0.51 113.55 115.68 3ht4 h SER 97 Ca 0.05 0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.79 3ht4 h SER 97 Cb 0.87 0.48 -0.03 0.00 -0.44 0.00 0.00 62.40 63.29 3ht4 h SER 97 CO 0.08 -0.32 -0.49 0.74 -0.53 0.00 0.00 176.83 176.31 3ht4 h THR 98 N -0.26 0.04 -0.68 2.23 2.02 0.03 0.38 112.91 116.67 3ht4 h THR 98 Ca 0.17 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.49 3ht4 h THR 98 Cb 0.53 0.04 -0.12 0.00 -1.74 0.00 0.00 68.15 66.86 3ht4 h THR 98 CO -0.51 0.00 -0.06 0.00 0.37 0.00 0.00 175.52 175.32 3ht4 h ALA 99 N -0.68 0.61 0.73 6.16 0.00 0.22 1.29 119.26 127.59 3ht4 h ALA 99 Ca -0.04 0.23 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 3ht4 h ALA 99 Cb 0.82 0.42 0.01 0.00 0.00 0.00 0.00 17.79 19.04 3ht4 h ALA 99 CO -0.14 -0.42 -0.35 -0.07 0.00 0.00 0.00 179.25 178.28 3ht4 h LEU 100 N 0.07 -0.83 -1.40 0.00 3.38 0.79 -3.05 115.31 114.26 3ht4 h LEU 100 Ca 0.35 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.29 3ht4 h LEU 100 Cb 0.58 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 3ht4 h LEU 100 CO -0.63 -0.47 -0.05 -0.26 0.09 0.00 0.00 178.44 177.12 3ht4 h PHE 101 N -1.21 0.34 0.00 1.13 0.04 -0.11 -1.06 116.94 116.08 3ht4 h PHE 101 Ca -0.10 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.64 3ht4 h PHE 101 Cb 0.77 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.82 3ht4 h PHE 101 CO 0.00 0.39 0.00 0.41 -0.60 0.00 0.00 178.31 178.51 3ht4 n GLY 102 N -0.97 -0.47 0.00 -1.45 0.00 0.44 -3.23 105.19 99.51 3ht4 n GLY 102 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3ht4 n GLY 102 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3ht4 n ILE 103 N -1.35 0.00 -3.25 -0.61 5.41 -0.95 -4.19 119.36 114.43 3ht4 n ILE 103 Ca 0.01 0.00 -0.38 0.00 1.00 0.00 0.00 62.75 63.38 3ht4 n ILE 103 Cb 0.03 -0.04 -0.06 0.00 -0.71 0.00 0.00 39.64 38.87 3ht4 n ILE 103 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3ht4 s LEU 104 N -1.00 4.33 0.13 1.39 1.43 -0.44 -5.08 118.68 119.45 3ht4 s LEU 104 Ca 0.00 0.98 0.04 0.00 -1.03 0.00 0.00 54.13 54.13 3ht4 s LEU 104 Cb 0.00 -2.82 -0.04 0.00 0.03 0.00 0.00 46.19 43.36 3ht4 s LEU 104 CO 0.00 0.02 -0.10 -0.13 0.23 0.00 0.00 176.35 176.37 3ht4 s ARG 105 N 0.34 1.01 -0.09 1.70 1.81 -1.26 -4.84 118.95 117.62 3ht4 s ARG 105 Ca 0.29 -1.38 -0.39 0.00 -1.72 0.00 0.00 55.73 52.53 3ht4 s ARG 105 Cb -0.16 -0.61 -0.17 0.00 -0.45 0.00 0.00 34.95 33.55 3ht4 s ARG 105 CO 0.14 0.08 1.49 -2.30 -0.68 0.00 0.00 175.30 174.02 3ht4 n PRO 106 N -0.01 1.00 0.00 3.54 -0.02 -1.26 -1.47 135.00 136.79 3ht4 n PRO 106 Ca -0.12 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 3ht4 n PRO 106 Cb 0.60 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 3ht4 n PRO 106 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ht4 n GLY 107 N 3.15 0.60 1.94 -1.23 0.00 -1.05 -5.03 105.19 103.58 3ht4 n GLY 107 Ca 0.22 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.12 3ht4 n GLY 107 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ht4 n ASP 108 N 0.00 0.61 -3.69 1.61 8.00 -0.54 -4.85 116.55 117.69 3ht4 n ASP 108 Ca 0.00 -1.54 -0.11 0.00 0.71 0.00 0.00 54.79 53.86 3ht4 n ASP 108 Cb 0.00 -0.34 -0.10 0.00 -0.02 0.00 0.00 41.12 40.66 3ht4 n ASP 108 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3ht4 s GLU 109 N -3.81 0.47 -0.17 -1.24 2.02 -0.50 -1.69 118.70 113.79 3ht4 s GLU 109 Ca 0.33 0.81 -0.16 0.00 0.02 0.00 0.00 54.97 55.98 3ht4 s GLU 109 Cb -0.02 0.07 -0.04 0.00 0.10 0.00 0.00 34.13 34.24 3ht4 s GLU 109 CO 0.22 -0.14 0.39 -1.17 0.02 0.00 0.00 175.26 174.58 3ht4 s LEU 110 N 1.16 4.22 -0.41 1.80 2.96 -1.09 -1.70 118.68 125.61 3ht4 s LEU 110 Ca -0.07 0.59 -0.05 0.00 -0.22 0.00 0.00 54.13 54.38 3ht4 s LEU 110 Cb -0.07 -2.52 0.10 0.00 0.50 0.00 0.00 46.19 44.21 3ht4 s LEU 110 CO -0.11 0.00 0.22 -0.22 -1.32 0.00 0.00 176.35 174.92 3ht4 s LEU 111 N 0.85 5.21 -0.44 -0.68 2.96 -1.26 -1.29 118.68 124.02 3ht4 s LEU 111 Ca 0.20 -1.89 -0.29 0.00 -0.22 0.00 0.00 54.13 51.93 3ht4 s LEU 111 Cb -0.14 -1.87 0.03 0.00 0.50 0.00 0.00 46.19 44.71 3ht4 s LEU 111 CO 0.07 -0.55 1.10 -0.31 -1.32 0.00 0.00 176.35 175.35 3ht4 s TYR 112 N 1.22 2.90 -0.88 5.38 1.51 0.10 -0.24 117.35 127.34 3ht4 s TYR 112 Ca 0.06 0.78 0.16 0.00 -1.01 0.00 0.00 57.07 57.07 3ht4 s TYR 112 Cb -0.23 -4.23 0.74 0.00 -0.11 0.00 0.00 41.96 38.13 3ht4 s TYR 112 CO -0.03 -1.15 1.64 0.44 -1.11 0.00 0.00 175.55 175.35 3ht4 n ILE 113 N 6.59 2.07 0.17 2.71 -5.35 -0.92 -1.36 119.36 123.26 3ht4 n ILE 113 Ca 0.11 -1.21 0.02 0.00 -0.27 0.00 0.00 62.75 61.40 3ht4 n ILE 113 Cb 0.49 -0.02 0.02 0.00 -1.74 0.00 0.00 39.64 38.39 3ht4 n ILE 113 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3ht4 n THR 114 N 0.95 0.08 0.00 7.28 -2.24 -1.25 -4.67 114.28 114.42 3ht4 n THR 114 Ca 0.26 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3ht4 n THR 114 Cb 0.97 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 70.25 3ht4 n THR 114 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ht4 n GLY 115 N 0.23 -0.09 3.50 3.38 0.00 0.14 -4.56 105.19 107.78 3ht4 n GLY 115 Ca 0.03 -1.86 -0.64 0.00 0.00 0.00 0.00 46.02 43.54 3ht4 n GLY 115 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3ht4 n LYS 116 N -0.10 0.00 -1.64 1.61 4.81 -1.26 -4.86 118.16 116.72 3ht4 n LYS 116 Ca 0.00 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.15 3ht4 n LYS 116 Cb 0.00 -1.50 0.16 0.00 0.02 0.00 0.00 35.03 33.71 3ht4 n LYS 116 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 3ht4 s PRO 117 N 4.50 0.73 0.81 1.64 0.04 -1.26 -5.01 135.00 136.45 3ht4 s PRO 117 Ca 1.12 -0.01 -0.15 0.00 0.04 0.00 0.00 61.00 62.00 3ht4 s PRO 117 Cb -1.50 -1.82 -0.01 0.00 0.04 0.00 0.00 34.50 31.21 3ht4 s PRO 117 CO 0.74 -2.42 0.47 2.48 0.04 0.00 0.00 177.00 178.31 3ht4 n TYR 118 N -3.86 -1.09 -0.25 0.56 4.11 -1.26 -4.85 117.16 110.52 3ht4 n TYR 118 Ca 0.10 0.30 -0.09 0.00 -0.00 0.00 0.00 57.90 58.22 3ht4 n TYR 118 Cb 0.60 -1.86 -0.07 0.00 -0.00 0.00 0.00 39.34 38.00 3ht4 n TYR 118 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.86 176.42 3ht4 h ASP 119 N -0.79 -1.53 -0.97 9.48 5.19 -2.02 -2.80 116.42 122.98 3ht4 h ASP 119 Ca -0.45 0.22 0.28 0.00 -0.62 0.00 0.00 57.03 56.46 3ht4 h ASP 119 Cb 1.32 0.66 -0.04 0.00 0.18 0.00 0.00 39.33 41.46 3ht4 h ASP 119 CO 0.39 -0.20 0.69 0.74 -3.12 0.00 0.00 179.24 177.75 3ht4 h THR 120 N -0.07 0.52 -0.60 0.35 2.02 -2.03 0.54 112.91 113.64 3ht4 h THR 120 Ca 0.10 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 3ht4 h THR 120 Cb 0.33 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.20 3ht4 h THR 120 CO -0.62 0.01 0.32 -0.07 0.37 0.00 0.00 175.52 175.52 3ht4 h LEU 121 N 0.03 0.75 -0.92 2.58 3.38 -1.83 -1.36 115.31 117.94 3ht4 h LEU 121 Ca 0.47 -0.06 0.17 0.00 0.09 0.00 0.00 57.88 58.54 3ht4 h LEU 121 Cb 1.81 -0.19 -0.16 0.00 0.09 0.00 0.00 40.66 42.21 3ht4 h LEU 121 CO -0.02 0.61 -0.29 -0.62 0.09 0.00 0.00 178.44 178.21 3ht4 n GLU 122 N -4.38 -0.15 -0.05 1.13 1.02 0.19 -0.66 120.64 117.75 3ht4 n GLU 122 Ca 0.06 1.43 -0.14 0.00 -0.02 0.00 0.00 57.16 58.49 3ht4 n GLU 122 Cb 0.11 -2.13 -0.08 0.00 -0.02 0.00 0.00 31.44 29.32 3ht4 n GLU 122 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3ht4 h GLU 123 N 0.00 0.40 -0.52 3.49 5.08 -1.39 -1.15 114.58 120.50 3ht4 h GLU 123 Ca 0.39 -0.26 0.10 0.00 -1.00 0.00 0.00 59.36 58.59 3ht4 h GLU 123 Cb 0.62 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.81 3ht4 h GLU 123 CO -0.94 0.86 -0.09 0.82 -1.00 0.00 0.00 179.01 178.67 3ht4 h ILE 124 N -0.01 0.51 -0.06 3.13 2.04 -1.30 0.12 117.51 121.94 3ht4 h ILE 124 Ca 0.00 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.85 3ht4 h ILE 124 Cb 0.85 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 3ht4 h ILE 124 CO 0.06 0.01 0.00 1.33 0.00 0.00 0.00 178.15 179.54 3ht4 n VAL 125 N -5.33 0.17 -1.49 1.67 0.24 0.17 -3.11 118.33 110.65 3ht4 n VAL 125 Ca 0.05 -0.11 -0.17 0.00 -2.04 0.00 0.00 64.34 62.08 3ht4 n VAL 125 Cb 0.28 -0.22 -0.07 0.00 -1.47 0.00 0.00 33.84 32.36 3ht4 n VAL 125 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ht4 n GLY 126 N 0.33 1.62 0.01 7.63 0.00 0.03 -4.56 105.19 110.26 3ht4 n GLY 126 Ca 0.02 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.09 3ht4 n GLY 126 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3ht4 n VAL 127 N -2.39 0.07 0.00 1.61 3.14 -0.68 -4.29 118.33 115.80 3ht4 n VAL 127 Ca -0.17 -0.06 0.00 0.00 -2.96 0.00 0.00 64.34 61.15 3ht4 n VAL 127 Cb 0.61 0.17 0.00 0.00 -1.06 0.00 0.00 33.84 33.57 3ht4 n VAL 127 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 3ht4 n ARG 128 N -1.64 0.00 -1.51 1.45 3.00 -1.23 -4.98 116.66 111.75 3ht4 n ARG 128 Ca 0.05 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.52 3ht4 n ARG 128 Cb 0.36 0.00 0.05 0.00 0.00 0.00 0.00 32.46 32.87 3ht4 n ARG 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3ht4 n GLY 129 N 3.68 -0.87 1.63 5.14 0.00 -1.26 -4.79 105.19 108.71 3ht4 n GLY 129 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 3ht4 n GLY 129 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3ht4 n LYS 130 N -0.74 0.90 -1.61 1.61 0.00 -1.26 -4.65 118.16 112.41 3ht4 n LYS 130 Ca 0.13 -0.07 -0.01 0.00 -0.00 0.00 0.00 58.31 58.36 3ht4 n LYS 130 Cb 0.48 -1.16 -0.01 0.00 -0.00 0.00 0.00 35.03 34.35 3ht4 n LYS 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3ht4 n GLY 131 N 1.67 -3.25 1.21 2.58 0.00 -1.26 -4.97 105.19 101.16 3ht4 n GLY 131 Ca 0.03 -0.12 -0.00 0.00 0.00 0.00 0.00 46.02 45.93 3ht4 n GLY 131 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3ht4 n VAL 132 N 0.22 2.53 0.00 1.61 0.24 -1.26 -4.75 118.33 116.92 3ht4 n VAL 132 Ca -0.05 -2.20 0.00 0.00 -2.04 0.00 0.00 64.34 60.05 3ht4 n VAL 132 Cb 0.08 -0.31 0.00 0.00 -1.47 0.00 0.00 33.84 32.14 3ht4 n VAL 132 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ht4 n GLY 133 N -0.76 1.85 3.18 7.63 0.00 -1.26 -5.16 105.19 110.68 3ht4 n GLY 133 Ca 0.31 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.15 3ht4 n GLY 133 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ht4 n SER 134 N 0.00 1.28 -0.31 1.61 3.41 -1.26 -4.97 113.62 113.38 3ht4 n SER 134 Ca 0.00 -2.02 0.09 0.00 -0.26 0.00 0.00 58.87 56.68 3ht4 n SER 134 Cb 0.00 -0.48 0.31 0.00 -0.26 0.00 0.00 64.21 63.78 3ht4 n SER 134 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 3ht4 h PHE 135 N -0.38 0.97 -0.89 7.33 -1.00 -1.81 -2.79 116.94 118.38 3ht4 h PHE 135 Ca -0.26 0.03 0.23 0.00 2.81 0.00 0.00 57.97 60.78 3ht4 h PHE 135 Cb 1.01 -0.31 -0.05 0.00 3.61 0.00 0.00 35.95 40.20 3ht4 h PHE 135 CO 0.00 0.39 0.61 -0.22 -1.61 0.00 0.00 178.31 177.48 3ht4 h LYS 136 N 0.85 0.20 0.00 1.51 1.63 -1.80 0.87 116.57 119.83 3ht4 h LYS 136 Ca 0.46 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.25 3ht4 h LYS 136 Cb 0.57 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.15 3ht4 h LYS 136 CO -0.22 0.13 -0.90 0.39 -3.45 0.00 0.00 179.45 175.40 3ht4 n GLU 137 N -4.40 0.04 -0.46 1.90 1.02 -1.06 -3.71 120.64 113.96 3ht4 n GLU 137 Ca 0.19 -0.01 0.08 0.00 -0.02 0.00 0.00 57.16 57.40 3ht4 n GLU 137 Cb 0.82 -1.51 0.27 0.00 -0.02 0.00 0.00 31.44 31.00 3ht4 n GLU 137 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3ht4 n TYR 138 N -1.55 1.07 -3.92 -0.32 4.01 0.14 -4.97 117.16 111.62 3ht4 n TYR 138 Ca 0.04 -0.68 -0.31 0.00 -0.16 0.00 0.00 57.90 56.79 3ht4 n TYR 138 Cb 0.34 -0.23 0.01 0.00 -0.31 0.00 0.00 39.34 39.16 3ht4 n TYR 138 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3ht4 n ASN 139 N 0.38 -4.37 -4.36 7.72 5.03 -0.28 -3.99 115.26 115.40 3ht4 n ASN 139 Ca 0.21 -0.78 -0.41 0.00 0.87 0.00 0.00 54.58 54.46 3ht4 n ASN 139 Cb 0.79 -3.52 -0.10 0.00 -1.02 0.00 0.00 39.78 35.93 3ht4 n ASN 139 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3ht4 s ILE 140 N -3.25 4.64 1.05 2.41 1.01 -0.77 -2.51 121.20 123.79 3ht4 s ILE 140 Ca 0.65 -1.00 -0.15 0.00 0.00 0.00 0.00 60.65 60.16 3ht4 s ILE 140 Cb -0.34 -3.67 0.11 0.00 0.01 0.00 0.00 42.46 38.58 3ht4 s ILE 140 CO 0.81 -0.35 0.41 0.61 0.00 0.00 0.00 174.94 176.42 3ht4 n GLY 141 N 5.02 -2.05 3.56 6.18 0.00 -0.68 -4.53 105.19 112.68 3ht4 n GLY 141 Ca -0.11 -0.83 -0.11 0.00 0.00 0.00 0.00 46.02 44.97 3ht4 n GLY 141 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3ht4 s TYR 142 N -2.36 -0.85 -0.01 1.61 5.04 -1.26 -2.65 117.35 116.87 3ht4 s TYR 142 Ca 0.59 1.87 0.02 0.00 -2.44 0.00 0.00 57.07 57.11 3ht4 s TYR 142 Cb -0.18 0.41 -0.00 0.00 0.35 0.00 0.00 41.96 42.54 3ht4 s TYR 142 CO 0.66 -0.42 -0.07 1.21 -1.34 0.00 0.00 175.55 175.59 3ht4 s ASN 143 N 1.01 0.83 -0.61 4.32 3.84 -0.41 -4.96 114.94 118.95 3ht4 s ASN 143 Ca -0.05 -0.13 0.04 0.00 0.21 0.00 0.00 52.86 52.93 3ht4 s ASN 143 Cb -0.05 -0.14 0.15 0.00 -0.55 0.00 0.00 41.25 40.66 3ht4 s ASN 143 CO -0.09 0.07 0.38 0.00 -2.79 0.00 0.00 177.10 174.66 3ht4 s ALA 144 N -0.01 3.56 -0.00 1.71 0.00 -1.26 -0.72 121.76 125.04 3ht4 s ALA 144 Ca 0.01 -3.51 -0.32 0.00 0.00 0.00 0.00 51.96 48.13 3ht4 s ALA 144 Cb -0.04 -2.23 -0.10 0.00 0.00 0.00 0.00 23.12 20.74 3ht4 s ALA 144 CO -0.00 -2.06 1.91 0.28 0.00 0.00 0.00 175.76 175.89 3ht4 n VAL 145 N 2.67 0.63 -1.04 0.00 0.31 -0.47 -4.58 118.33 115.85 3ht4 n VAL 145 Ca 0.11 -0.11 -0.28 0.00 -0.01 0.00 0.00 64.34 64.05 3ht4 n VAL 145 Cb 0.34 -2.09 0.20 0.00 -0.91 0.00 0.00 33.84 31.37 3ht4 n VAL 145 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 3ht4 s PRO 146 N 4.04 0.07 0.11 5.55 0.02 -1.26 0.25 135.00 143.77 3ht4 s PRO 146 Ca 0.90 0.55 -0.04 0.00 0.02 0.00 0.00 61.00 62.43 3ht4 s PRO 146 Cb -0.55 -1.69 -0.05 0.00 0.02 0.00 0.00 34.50 32.22 3ht4 s PRO 146 CO 0.46 -2.99 0.33 -0.51 -0.33 0.00 0.00 177.00 173.96 3ht4 s LEU 147 N -6.64 4.30 0.31 -5.54 1.43 -1.26 -3.94 118.68 107.34 3ht4 s LEU 147 Ca 0.66 0.52 -0.20 0.00 -1.03 0.00 0.00 54.13 54.08 3ht4 s LEU 147 Cb -0.20 -3.19 -0.14 0.00 0.03 0.00 0.00 46.19 42.69 3ht4 s LEU 147 CO 0.59 0.09 0.17 0.41 0.23 0.00 0.00 176.35 177.84 3ht4 n THR 148 N 0.21 0.85 0.33 5.49 -1.04 0.13 -4.75 114.28 115.51 3ht4 n THR 148 Ca -0.04 -0.44 0.14 0.00 -2.04 0.00 0.00 64.05 61.67 3ht4 n THR 148 Cb 0.52 0.00 0.75 0.00 -1.82 0.00 0.00 70.33 69.78 3ht4 n THR 148 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3ht4 h GLU 149 N 0.43 0.00 -0.00 -2.82 3.07 -1.97 0.20 114.58 113.48 3ht4 h GLU 149 Ca -0.31 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 3ht4 h GLU 149 Cb 1.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.18 3ht4 h GLU 149 CO 0.43 0.00 -0.47 0.41 -1.40 0.00 0.00 179.01 177.98 3ht4 n GLY 150 N -1.24 -1.12 0.11 -3.84 0.00 -1.26 -4.95 105.19 92.90 3ht4 n GLY 150 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.63 3ht4 n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ht4 n GLY 151 N 1.47 0.28 3.85 -0.02 0.00 0.71 -5.01 105.19 106.47 3ht4 n GLY 151 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 3ht4 n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ht4 s LEU 152 N 0.00 2.26 0.19 0.99 2.01 -1.26 -4.80 118.68 118.07 3ht4 s LEU 152 Ca 0.00 0.59 -0.24 0.00 0.01 0.00 0.00 54.13 54.48 3ht4 s LEU 152 Cb 0.00 -2.76 -0.08 0.00 0.01 0.00 0.00 46.19 43.36 3ht4 s LEU 152 CO 0.00 -2.67 0.78 0.54 1.01 0.00 0.00 176.35 176.01 3ht4 s VAL 153 N -3.57 4.38 -1.35 -1.59 0.11 -1.26 -0.69 120.40 116.44 3ht4 s VAL 153 Ca 0.68 1.64 -0.16 0.00 -2.93 0.00 0.00 61.98 61.22 3ht4 s VAL 153 Cb -0.09 -4.08 0.02 0.00 -1.53 0.00 0.00 36.38 30.71 3ht4 s VAL 153 CO 0.52 0.43 2.09 -0.67 -3.33 0.00 0.00 175.10 174.14 3ht4 n ASP 154 N 1.33 3.93 -0.14 3.54 -0.08 -1.25 -4.65 116.55 119.22 3ht4 n ASP 154 Ca -0.04 -2.84 0.22 0.00 -1.51 0.00 0.00 54.79 50.62 3ht4 n ASP 154 Cb 0.49 -1.62 0.63 0.00 2.34 0.00 0.00 41.12 42.96 3ht4 n ASP 154 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 3ht4 h PHE 155 N 6.64 0.21 0.36 -0.67 0.04 -1.94 0.37 116.94 121.97 3ht4 h PHE 155 Ca 0.52 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 61.28 3ht4 h PHE 155 Cb 0.70 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.79 3ht4 h PHE 155 CO 1.42 0.07 -0.17 0.93 -0.60 0.00 0.00 178.31 179.95 3ht4 h GLU 156 N 0.17 -0.47 -0.61 1.51 3.07 -2.00 -1.09 114.58 115.16 3ht4 h GLU 156 Ca 0.38 0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 59.21 3ht4 h GLU 156 Cb 1.24 0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 29.23 3ht4 h GLU 156 CO -0.07 -0.25 0.15 0.00 -1.40 0.00 0.00 179.01 177.44 3ht4 h ALA 157 N 0.03 1.11 0.45 3.43 0.00 -0.86 -2.30 119.26 121.12 3ht4 h ALA 157 Ca -0.05 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3ht4 h ALA 157 Cb 0.43 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3ht4 h ALA 157 CO 0.08 0.60 -0.21 0.28 0.00 0.00 0.00 179.25 179.99 3ht4 h VAL 158 N 0.91 0.56 -0.90 0.00 2.07 -0.47 0.43 116.25 118.85 3ht4 h VAL 158 Ca 0.20 -0.01 0.19 0.00 0.82 0.00 0.00 66.70 67.90 3ht4 h VAL 158 Cb 0.32 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 30.59 3ht4 h VAL 158 CO -0.00 0.00 0.59 0.00 0.02 0.00 0.00 177.57 178.18 3ht4 h ALA 159 N -0.05 2.09 0.06 1.67 0.00 -1.07 -1.54 119.26 120.42 3ht4 h ALA 159 Ca -0.06 0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.64 3ht4 h ALA 159 Cb 0.46 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3ht4 h ALA 159 CO 0.10 -0.37 -1.08 0.00 0.00 0.00 0.00 179.25 177.90 3ht4 h ALA 160 N 1.61 0.28 -0.05 0.00 0.00 -0.92 -3.27 119.26 116.91 3ht4 h ALA 160 Ca 0.47 -0.86 -0.15 0.00 0.00 0.00 0.00 54.91 54.38 3ht4 h ALA 160 Cb 1.05 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3ht4 h ALA 160 CO -0.20 1.05 -0.63 0.00 0.00 0.00 0.00 179.25 179.47 3ht4 h ALA 161 N 0.81 0.83 -2.87 0.00 0.00 0.06 -3.45 119.26 114.64 3ht4 h ALA 161 Ca -0.07 -0.56 -0.52 0.00 0.00 0.00 0.00 54.91 53.75 3ht4 h ALA 161 Cb 1.80 -0.09 0.07 0.00 0.00 0.00 0.00 17.79 19.57 3ht4 h ALA 161 CO 0.16 0.75 0.65 0.42 0.00 0.00 0.00 179.25 181.24 3ht4 s ILE 162 N -3.68 2.68 0.00 0.00 1.01 -0.84 -4.94 121.20 115.43 3ht4 s ILE 162 Ca -0.03 0.68 0.00 0.00 0.00 0.00 0.00 60.65 61.29 3ht4 s ILE 162 Cb 0.12 -3.43 0.00 0.00 0.01 0.00 0.00 42.46 39.16 3ht4 s ILE 162 CO 0.80 0.16 0.00 0.00 0.00 0.00 0.00 174.94 175.89 3ht4 n HIS 163 N 0.89 -0.11 0.07 3.97 1.44 -1.26 -5.02 115.22 115.20 3ht4 n HIS 163 Ca 0.01 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.73 3ht4 n HIS 163 Cb 0.42 0.00 0.37 0.00 0.12 0.00 0.00 29.99 30.90 3ht4 n HIS 163 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 3ht4 h SER 164 N 0.00 0.34 1.01 4.39 4.64 -2.01 -2.43 113.55 119.48 3ht4 h SER 164 Ca 0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3ht4 h SER 164 Cb 0.00 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 3ht4 h SER 164 CO 0.00 0.43 -0.43 0.59 -0.87 0.00 0.00 176.83 176.55 3ht4 n ASN 165 N -4.31 0.69 -4.56 4.97 3.02 -1.26 -4.69 115.26 109.13 3ht4 n ASN 165 Ca 0.00 0.23 -0.24 0.00 -0.03 0.00 0.00 54.58 54.55 3ht4 n ASN 165 Cb 0.23 -0.11 -0.05 0.00 -0.61 0.00 0.00 39.78 39.23 3ht4 n ASN 165 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3ht4 s THR 166 N -3.13 3.20 -1.63 3.41 2.01 -0.92 -1.40 115.64 117.18 3ht4 s THR 166 Ca 0.08 -0.11 0.29 0.00 0.31 0.00 0.00 61.69 62.26 3ht4 s THR 166 Cb 0.14 -3.47 0.48 0.00 0.01 0.00 0.00 72.50 69.65 3ht4 s THR 166 CO 0.68 -0.45 1.90 1.17 -0.69 0.00 0.00 174.62 177.23 3ht4 n LYS 167 N 8.90 0.67 -3.63 4.92 3.00 -0.69 -4.67 118.16 126.65 3ht4 n LYS 167 Ca 0.40 -0.19 -0.13 0.00 -0.00 0.00 0.00 58.31 58.38 3ht4 n LYS 167 Cb 0.47 -1.50 -0.07 0.00 0.00 0.00 0.00 35.03 33.93 3ht4 n LYS 167 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 3ht4 s ILE 169 N -2.47 -0.00 0.05 3.15 -1.09 -0.20 -1.86 121.20 118.79 3ht4 s ILE 169 Ca 0.30 0.00 0.06 0.00 -2.23 0.00 0.00 60.65 58.78 3ht4 s ILE 169 Cb 0.20 -0.99 -0.03 0.00 -1.58 0.00 0.00 42.46 40.06 3ht4 s ILE 169 CO 0.47 0.00 -0.13 -0.83 -1.23 0.00 0.00 174.94 173.22 3ht4 s GLY 170 N 0.52 1.68 -0.11 6.18 0.00 0.67 -0.29 107.32 115.97 3ht4 s GLY 170 Ca -0.01 -1.17 -0.04 0.00 0.00 0.00 0.00 44.72 43.49 3ht4 s GLY 170 CO -0.01 -1.08 0.23 -0.42 0.00 0.00 0.00 173.10 171.81 3ht4 s ILE 171 N -1.03 -0.36 -0.23 0.90 1.01 -0.60 -2.18 121.20 118.72 3ht4 s ILE 171 Ca 0.17 0.31 -0.09 0.00 0.00 0.00 0.00 60.65 61.04 3ht4 s ILE 171 Cb -0.11 -0.39 -0.04 0.00 0.01 0.00 0.00 42.46 41.93 3ht4 s ILE 171 CO 0.08 0.13 0.11 -1.58 0.00 0.00 0.00 174.94 173.68 3ht4 s GLN 172 N 2.37 3.94 -0.05 2.79 0.74 -1.26 -0.18 119.66 128.00 3ht4 s GLN 172 Ca 0.02 -0.34 -0.03 0.00 0.05 0.00 0.00 55.36 55.05 3ht4 s GLN 172 Cb -0.12 -3.40 -0.02 0.00 1.10 0.00 0.00 33.01 30.57 3ht4 s GLN 172 CO -0.08 0.05 0.18 -0.09 -0.55 0.00 0.00 175.29 174.81 3ht4 h ARG 173 N 7.50 -0.12 -7.10 1.67 2.43 -1.82 -3.43 114.38 113.51 3ht4 h ARG 173 Ca -0.37 0.01 -0.47 0.00 -0.81 0.00 0.00 59.98 58.34 3ht4 h ARG 173 Cb 1.17 0.03 0.02 0.00 -0.42 0.00 0.00 29.97 30.77 3ht4 h ARG 173 CO 0.64 -0.08 0.37 -1.54 -1.51 0.00 0.00 179.97 177.85 3ht4 s SER 174 N -4.56 6.44 0.13 -3.80 1.04 -1.26 0.59 113.70 112.28 3ht4 s SER 174 Ca -0.02 1.81 -0.01 0.00 0.48 0.00 0.00 55.95 58.22 3ht4 s SER 174 Cb 0.00 -2.55 -0.10 0.00 0.10 0.00 0.00 66.02 63.48 3ht4 s SER 174 CO 0.05 -0.71 1.30 0.07 0.98 0.00 0.00 173.24 174.94 3ht4 h LYS 175 N 1.41 0.26 0.00 4.02 2.10 -1.86 -3.47 116.57 119.04 3ht4 h LYS 175 Ca -0.49 -0.32 0.00 0.00 -2.00 0.00 0.00 60.65 57.84 3ht4 h LYS 175 Cb 1.21 0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.64 3ht4 h LYS 175 CO 0.60 1.05 0.00 0.41 -2.00 0.00 0.00 179.45 179.51 3ht4 n GLY 176 N 1.05 3.31 0.17 0.07 0.00 -1.26 -2.01 105.19 106.51 3ht4 n GLY 176 Ca -0.05 -0.18 0.15 0.00 0.00 0.00 0.00 46.02 45.94 3ht4 n GLY 176 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3ht4 n TYR 177 N 13.87 0.00 -2.47 1.61 4.01 -1.26 -4.89 117.16 128.03 3ht4 n TYR 177 Ca 0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.40 3ht4 n TYR 177 Cb 0.00 -0.03 -0.03 0.00 -0.31 0.00 0.00 39.34 38.97 3ht4 n TYR 177 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ht4 s ALA 178 N -2.07 2.85 -1.21 -0.72 0.00 -0.85 -4.95 121.76 114.80 3ht4 s ALA 178 Ca 0.42 0.60 -0.09 0.00 0.00 0.00 0.00 51.96 52.88 3ht4 s ALA 178 Cb 0.21 -3.26 0.21 0.00 0.00 0.00 0.00 23.12 20.28 3ht4 s ALA 178 CO 0.37 -0.40 1.63 -2.37 0.00 0.00 0.00 175.76 175.00 3ht4 n THR 179 N -1.11 4.54 -3.59 0.00 5.66 -1.26 -4.90 114.28 113.62 3ht4 n THR 179 Ca 0.09 -4.86 -0.07 0.00 -3.05 0.00 0.00 64.05 56.16 3ht4 n THR 179 Cb 0.52 -2.35 -0.04 0.00 -1.55 0.00 0.00 70.33 66.92 3ht4 n THR 179 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3ht4 s ARG 180 N -0.11 0.43 0.28 1.09 1.04 -1.26 -4.98 118.95 115.44 3ht4 s ARG 180 Ca 0.38 0.01 -0.30 0.00 -1.04 0.00 0.00 55.73 54.78 3ht4 s ARG 180 Cb 0.04 0.20 -0.12 0.00 -2.04 0.00 0.00 34.95 33.03 3ht4 s ARG 180 CO 0.02 -0.15 1.48 -2.30 -0.04 0.00 0.00 175.30 174.31 3ht4 n PRO 181 N 0.40 2.36 -1.91 3.89 -0.02 -1.26 -4.65 135.00 133.80 3ht4 n PRO 181 Ca -0.05 0.84 -0.42 0.00 -2.02 0.00 0.00 63.50 61.84 3ht4 n PRO 181 Cb 0.59 -2.55 -0.03 0.00 -0.02 0.00 0.00 33.50 31.49 3ht4 n PRO 181 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3ht4 s SER 182 N 0.32 6.57 0.20 2.55 0.01 -1.26 -4.77 113.70 117.31 3ht4 s SER 182 Ca 0.65 2.63 -0.30 0.00 1.31 0.00 0.00 55.95 60.24 3ht4 s SER 182 Cb -0.57 -2.59 -0.08 0.00 0.21 0.00 0.00 66.02 62.99 3ht4 s SER 182 CO 0.51 -0.84 1.12 -0.36 0.41 0.00 0.00 173.24 174.07 3ht4 s PHE 183 N 1.26 3.55 0.64 2.43 0.08 0.20 -4.77 117.98 121.37 3ht4 s PHE 183 Ca 0.71 1.58 -0.11 0.00 0.12 0.00 0.00 56.93 59.23 3ht4 s PHE 183 Cb -0.44 -3.31 -0.02 0.00 -0.57 0.00 0.00 43.02 38.68 3ht4 s PHE 183 CO 0.31 -0.73 1.03 0.95 -0.10 0.00 0.00 175.22 176.69 3ht4 s THR 184 N -0.38 4.33 0.24 0.64 -4.23 -1.26 -4.77 115.64 110.22 3ht4 s THR 184 Ca 0.49 0.70 -0.05 0.00 -1.18 0.00 0.00 61.69 61.65 3ht4 s THR 184 Cb -0.31 -3.74 0.21 0.00 1.34 0.00 0.00 72.50 70.00 3ht4 s THR 184 CO 0.36 -0.96 1.81 0.40 -0.54 0.00 0.00 174.62 175.69 3ht4 h ILE 185 N -0.38 0.91 -0.22 2.99 1.08 -1.94 0.22 117.51 120.16 3ht4 h ILE 185 Ca -0.44 -0.26 -0.00 0.00 -0.39 0.00 0.00 64.86 63.76 3ht4 h ILE 185 Cb 1.21 0.07 -0.01 0.00 -3.07 0.00 0.00 36.82 35.02 3ht4 h ILE 185 CO 0.62 0.14 0.13 -1.28 -0.69 0.00 0.00 178.15 177.07 3ht4 h SER 186 N 0.77 0.28 0.04 1.72 0.87 -1.98 0.64 113.55 115.89 3ht4 h SER 186 Ca 0.39 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.86 3ht4 h SER 186 Cb 0.35 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.24 3ht4 h SER 186 CO -0.24 0.27 -0.03 1.56 -0.53 0.00 0.00 176.83 177.85 3ht4 h GLN 187 N 0.26 0.00 0.07 2.24 4.20 -1.81 -1.75 115.11 118.32 3ht4 h GLN 187 Ca 0.08 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.54 3ht4 h GLN 187 Cb 0.05 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 3ht4 h GLN 187 CO -0.01 0.03 -1.12 0.82 -0.67 0.00 0.00 178.83 177.88 3ht4 h ILE 188 N 0.00 1.54 0.18 2.54 2.04 0.12 -3.32 117.51 120.61 3ht4 h ILE 188 Ca -0.00 -3.03 -0.01 0.00 1.00 0.00 0.00 64.86 62.82 3ht4 h ILE 188 Cb 0.06 2.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.96 3ht4 h ILE 188 CO 0.00 0.88 -0.09 0.50 0.00 0.00 0.00 178.15 179.45 3ht4 h LYS 189 N 0.08 -0.23 0.00 2.37 3.64 0.81 -2.65 116.57 120.58 3ht4 h LYS 189 Ca -0.09 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 3ht4 h LYS 189 Cb 1.83 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.70 3ht4 h LYS 189 CO 0.18 0.06 0.00 -1.91 -2.27 0.00 0.00 179.45 175.51 3ht4 n GLU 190 N -5.07 0.00 0.00 1.90 2.13 -0.71 -2.56 120.64 116.33 3ht4 n GLU 190 Ca -0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.73 3ht4 n GLU 190 Cb 0.22 -0.65 0.00 0.00 0.27 0.00 0.00 31.44 31.28 3ht4 n GLU 190 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 3ht4 n ILE 192 N 0.14 0.00 -0.12 6.31 -0.00 -1.00 -1.85 119.36 122.84 3ht4 n ILE 192 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 62.75 62.75 3ht4 n ILE 192 Cb 0.00 0.00 0.26 0.00 -0.00 0.00 0.00 39.64 39.90 3ht4 n ILE 192 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3ht4 h ALA 193 N 0.00 1.39 0.50 -1.28 0.00 -1.78 0.72 119.26 118.81 3ht4 h ALA 193 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3ht4 h ALA 193 Cb 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3ht4 h ALA 193 CO 0.00 0.47 -0.24 0.35 0.00 0.00 0.00 179.25 179.84 3ht4 h PHE 194 N 0.79 -0.62 -0.81 0.00 3.57 -1.64 -2.49 116.94 115.75 3ht4 h PHE 194 Ca 0.19 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.65 3ht4 h PHE 194 Cb 0.11 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.02 3ht4 h PHE 194 CO 0.01 -0.38 0.38 -0.39 -2.23 0.00 0.00 178.31 175.70 3ht4 h VAL 195 N -0.71 1.25 -0.17 1.41 -1.51 -1.82 -1.58 116.25 113.12 3ht4 h VAL 195 Ca -0.07 -0.72 -0.06 0.00 -1.23 0.00 0.00 66.70 64.63 3ht4 h VAL 195 Cb 0.51 0.22 -0.01 0.00 -2.13 0.00 0.00 31.29 29.88 3ht4 h VAL 195 CO 0.11 0.30 -0.15 0.11 -1.23 0.00 0.00 177.57 176.72 3ht4 h LYS 196 N 1.15 0.27 -0.68 5.19 1.79 -0.95 -1.16 116.57 122.19 3ht4 h LYS 196 Ca 0.28 -0.07 0.03 0.00 -2.18 0.00 0.00 60.65 58.71 3ht4 h LYS 196 Cb 0.12 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 30.69 3ht4 h LYS 196 CO -0.03 0.43 0.42 1.49 -1.08 0.00 0.00 179.45 180.67 3ht4 h GLU 197 N 0.26 0.79 0.00 3.15 4.57 -0.80 -1.15 114.58 121.40 3ht4 h GLU 197 Ca 0.05 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.10 3ht4 h GLU 197 Cb 0.42 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 3ht4 h GLU 197 CO 0.03 0.52 -0.38 0.82 -1.18 0.00 0.00 179.01 178.82 3ht4 h ILE 198 N 0.82 0.79 -0.67 2.32 2.04 -1.14 -3.42 117.51 118.25 3ht4 h ILE 198 Ca 0.28 -1.66 0.05 0.00 1.00 0.00 0.00 64.86 64.52 3ht4 h ILE 198 Cb 0.04 2.06 -0.19 0.00 -0.74 0.00 0.00 36.82 37.99 3ht4 h ILE 198 CO -0.12 0.37 -0.28 -0.75 0.00 0.00 0.00 178.15 177.38 3ht4 s LYS 199 N -3.39 0.50 0.61 2.37 2.20 -0.53 -5.01 119.74 116.50 3ht4 s LYS 199 Ca 0.02 -0.02 0.39 0.00 -0.36 0.00 0.00 55.97 56.00 3ht4 s LYS 199 Cb 0.10 0.10 2.14 0.00 -1.51 0.00 0.00 37.83 38.65 3ht4 s LYS 199 CO 0.69 -0.77 2.20 -1.00 -0.36 0.00 0.00 175.35 176.12 3ht4 h PRO 200 N 6.72 0.00 0.09 4.03 0.13 -1.47 -2.49 132.00 139.01 3ht4 h PRO 200 Ca -0.00 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.14 3ht4 h PRO 200 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 3ht4 h PRO 200 CO 0.03 0.00 -0.13 0.22 -0.23 0.00 0.00 178.00 177.89 3ht4 h ASP 201 N 0.00 -0.36 -2.18 1.44 3.58 -1.95 -3.45 116.42 113.49 3ht4 h ASP 201 Ca 0.00 0.04 -0.62 0.00 0.42 0.00 0.00 57.03 56.87 3ht4 h ASP 201 Cb 0.09 0.13 0.12 0.00 1.72 0.00 0.00 39.33 41.39 3ht4 h ASP 201 CO 0.00 -0.20 -0.12 1.33 -2.88 0.00 0.00 179.24 177.38 3ht4 n VAL 202 N -5.26 1.98 -3.10 2.25 0.24 -0.94 -4.95 118.33 108.56 3ht4 n VAL 202 Ca -0.07 -0.50 -0.40 0.00 -2.04 0.00 0.00 64.34 61.34 3ht4 n VAL 202 Cb 0.18 -0.71 -0.05 0.00 -1.47 0.00 0.00 33.84 31.79 3ht4 n VAL 202 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 3ht4 s VAL 203 N -1.15 5.05 -0.31 3.34 -7.23 -0.78 -4.97 120.40 114.36 3ht4 s VAL 203 Ca 0.61 1.31 -0.14 0.00 -1.81 0.00 0.00 61.98 61.95 3ht4 s VAL 203 Cb -0.72 -3.98 -0.03 0.00 0.56 0.00 0.00 36.38 32.21 3ht4 s VAL 203 CO 0.59 0.21 0.30 -0.69 -0.31 0.00 0.00 175.10 175.19 3ht4 s VAL 204 N 1.17 5.23 -0.09 1.32 1.01 -1.26 -1.03 120.40 126.74 3ht4 s VAL 204 Ca 0.33 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.48 3ht4 s VAL 204 Cb -0.17 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 3ht4 s VAL 204 CO 0.14 0.08 -0.08 0.12 0.00 0.00 0.00 175.10 175.36 3ht4 s PHE 205 N 1.91 2.91 -0.08 5.22 5.36 0.61 -1.13 117.98 132.78 3ht4 s PHE 205 Ca 0.10 -0.16 0.03 0.00 -0.96 0.00 0.00 56.93 55.95 3ht4 s PHE 205 Cb -0.16 -1.77 0.01 0.00 -0.34 0.00 0.00 43.02 40.76 3ht4 s PHE 205 CO 0.11 0.17 -0.17 0.08 -1.46 0.00 0.00 175.22 173.94 3ht4 s VAL 206 N -0.41 1.51 -0.51 3.12 1.01 -0.74 -1.55 120.40 122.82 3ht4 s VAL 206 Ca 0.06 -0.70 -0.23 0.00 0.00 0.00 0.00 61.98 61.10 3ht4 s VAL 206 Cb -0.12 -1.34 0.04 0.00 0.00 0.00 0.00 36.38 34.96 3ht4 s VAL 206 CO 0.02 0.44 0.86 -0.62 0.00 0.00 0.00 175.10 175.80 3ht4 s ASP 207 N 0.50 6.36 -0.24 3.32 2.15 0.74 -3.16 116.67 126.35 3ht4 s ASP 207 Ca -0.16 -0.32 0.14 0.00 0.43 0.00 0.00 52.55 52.64 3ht4 s ASP 207 Cb -0.16 -2.41 0.68 0.00 -0.30 0.00 0.00 42.92 40.73 3ht4 s ASP 207 CO 0.06 -1.09 1.62 -3.20 -0.17 0.00 0.00 175.17 172.39 3ht4 n ASN 208 N 7.08 4.66 -4.75 -0.34 5.15 -0.78 -2.57 115.26 123.71 3ht4 n ASN 208 Ca 0.01 -3.08 -0.41 0.00 -0.60 0.00 0.00 54.58 50.49 3ht4 n ASN 208 Cb 0.47 -0.64 -0.01 0.00 -0.53 0.00 0.00 39.78 39.07 3ht4 n ASN 208 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3ht4 n TYR 210 N 1.98 0.00 0.65 0.00 4.01 -1.26 -4.24 117.16 118.30 3ht4 n TYR 210 Ca 0.07 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.89 3ht4 n TYR 210 Cb 0.38 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.46 3ht4 n TYR 210 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ht4 n GLY 211 N -2.00 0.08 3.68 2.72 0.00 -1.10 -1.94 105.19 106.64 3ht4 n GLY 211 Ca 0.00 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 3ht4 n GLY 211 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ht4 s GLU 212 N -1.39 4.33 -1.10 1.61 8.01 -1.25 -3.47 118.70 125.43 3ht4 s GLU 212 Ca 0.17 1.69 0.00 0.00 0.01 0.00 0.00 54.97 56.84 3ht4 s GLU 212 Cb 0.13 -3.58 0.00 0.00 -4.31 0.00 0.00 34.13 26.36 3ht4 s GLU 212 CO 0.23 -0.49 0.00 1.19 0.01 0.00 0.00 175.26 176.20 3ht4 n PHE 213 N 5.38 0.00 0.29 1.61 3.72 -1.26 -4.80 117.46 122.40 3ht4 n PHE 213 Ca 0.11 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.60 3ht4 n PHE 213 Cb 0.46 -2.09 -0.12 0.00 -0.94 0.00 0.00 39.48 36.78 3ht4 n PHE 213 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 176.76 178.22 3ht4 n ILE 214 N -2.61 0.00 -4.23 4.37 0.13 -1.23 -4.76 119.36 111.04 3ht4 n ILE 214 Ca -0.10 -0.29 -0.27 0.00 -1.10 0.00 0.00 62.75 60.98 3ht4 n ILE 214 Cb 0.39 0.42 -0.05 0.00 -0.84 0.00 0.00 39.64 39.55 3ht4 n ILE 214 CO 0.00 0.00 0.00 -1.61 2.80 0.00 0.00 176.55 177.74 3ht4 s GLU 215 N -3.02 2.22 -0.07 9.51 2.02 -1.26 -4.75 118.70 123.35 3ht4 s GLU 215 Ca -0.02 -2.05 0.14 0.00 0.02 0.00 0.00 54.97 53.06 3ht4 s GLU 215 Cb 0.12 -1.89 0.51 0.00 0.10 0.00 0.00 34.13 32.97 3ht4 s GLU 215 CO 0.73 -0.33 1.39 0.39 0.02 0.00 0.00 175.26 177.46 3ht4 n GLU 216 N -1.40 2.86 -3.67 1.61 1.02 -1.26 -4.83 120.64 114.97 3ht4 n GLU 216 Ca -0.06 -2.04 -0.15 0.00 -0.02 0.00 0.00 57.16 54.89 3ht4 n GLU 216 Cb 0.65 -1.67 -0.08 0.00 -0.02 0.00 0.00 31.44 30.32 3ht4 n GLU 216 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3ht4 s GLN 217 N -1.69 0.81 0.40 3.49 -0.21 -1.26 -5.01 119.66 116.19 3ht4 s GLN 217 Ca 0.37 0.04 0.08 0.00 0.02 0.00 0.00 55.36 55.86 3ht4 s GLN 217 Cb 0.23 0.37 -0.04 0.00 1.00 0.00 0.00 33.01 34.58 3ht4 s GLN 217 CO 0.19 -0.23 0.26 -1.21 -2.12 0.00 0.00 175.29 172.18 3ht4 s GLU 218 N -1.17 2.41 0.55 2.91 0.41 -1.26 -4.90 118.70 117.65 3ht4 s GLU 218 Ca -0.12 -1.63 0.24 0.00 -0.41 0.00 0.00 54.97 53.05 3ht4 s GLU 218 Cb -0.03 -2.21 1.49 0.00 -1.78 0.00 0.00 34.13 31.60 3ht4 s GLU 218 CO 0.06 -0.09 2.10 -1.35 -0.49 0.00 0.00 175.26 175.49 3ht4 h PRO 219 N 1.28 0.00 -0.03 0.39 0.11 -1.97 -0.47 132.00 131.31 3ht4 h PRO 219 Ca -0.43 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.64 3ht4 h PRO 219 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 3ht4 h PRO 219 CO 0.63 0.00 -0.18 0.00 -0.21 0.00 0.00 178.00 178.24 3ht4 n HIS 221 N -4.30 0.50 -2.45 0.00 8.25 -0.19 -2.89 115.22 114.15 3ht4 n HIS 221 Ca -0.02 0.26 -0.01 0.00 -0.26 0.00 0.00 57.72 57.69 3ht4 n HIS 221 Cb 0.26 -0.91 0.06 0.00 1.12 0.00 0.00 29.99 30.51 3ht4 n HIS 221 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 3ht4 n VAL 222 N -2.02 1.11 0.00 1.59 0.24 -0.69 -4.99 118.33 113.58 3ht4 n VAL 222 Ca -0.01 -2.46 0.00 0.00 -2.04 0.00 0.00 64.34 59.83 3ht4 n VAL 222 Cb 0.03 0.66 0.00 0.00 -1.47 0.00 0.00 33.84 33.07 3ht4 n VAL 222 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ht4 n GLY 223 N -0.29 0.96 3.77 7.63 0.00 -1.14 -4.74 105.19 111.37 3ht4 n GLY 223 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3ht4 n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ht4 s ALA 224 N -2.00 3.23 -0.13 4.61 0.00 -1.17 -4.86 121.76 121.45 3ht4 s ALA 224 Ca 0.00 0.96 0.18 0.00 0.00 0.00 0.00 51.96 53.10 3ht4 s ALA 224 Cb 0.00 -3.37 -0.23 0.00 0.00 0.00 0.00 23.12 19.52 3ht4 s ALA 224 CO 0.00 -0.43 0.46 -0.25 0.00 0.00 0.00 175.76 175.54 3ht4 n ASP 225 N 0.36 0.36 -3.30 0.00 8.00 -0.28 -4.67 116.55 117.02 3ht4 n ASP 225 Ca 0.03 0.16 -0.14 0.00 0.71 0.00 0.00 54.79 55.54 3ht4 n ASP 225 Cb 0.46 0.85 -0.04 0.00 -0.02 0.00 0.00 41.12 42.37 3ht4 n ASP 225 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3ht4 s LEU 226 N -5.42 0.97 0.00 0.64 2.96 -0.94 -0.55 118.68 116.34 3ht4 s LEU 226 Ca -0.07 -1.45 -0.28 0.00 -0.22 0.00 0.00 54.13 52.11 3ht4 s LEU 226 Cb 0.09 1.47 0.09 0.00 0.50 0.00 0.00 46.19 48.34 3ht4 s LEU 226 CO 0.84 -1.29 1.26 0.00 -1.32 0.00 0.00 176.35 175.84 3ht4 n ALA 228 N -0.55 -3.54 -3.00 5.97 0.00 -1.19 -1.79 120.51 116.41 3ht4 n ALA 228 Ca 0.01 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.64 3ht4 n ALA 228 Cb 0.62 0.17 0.00 0.00 0.00 0.00 0.00 19.45 20.23 3ht4 n ALA 228 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ht4 n GLY 229 N -0.90 1.17 3.27 0.00 0.00 -1.18 -1.86 105.19 105.69 3ht4 n GLY 229 Ca 0.04 -0.69 -0.27 0.00 0.00 0.00 0.00 46.02 45.10 3ht4 n GLY 229 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ht4 s SER 230 N 1.22 2.68 0.25 1.61 1.04 -1.26 -3.33 113.70 115.90 3ht4 s SER 230 Ca 0.00 -0.52 0.10 0.00 0.48 0.00 0.00 55.95 56.02 3ht4 s SER 230 Cb 0.00 -0.24 0.25 0.00 0.10 0.00 0.00 66.02 66.12 3ht4 s SER 230 CO 0.00 0.21 1.55 -0.07 0.98 0.00 0.00 173.24 175.90 3ht4 h LEU 231 N 4.99 0.00 0.00 2.42 3.38 -1.74 -2.47 115.31 121.89 3ht4 h LEU 231 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3ht4 h LEU 231 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3ht4 h LEU 231 CO 0.44 0.69 0.00 2.30 0.09 0.00 0.00 178.44 181.96 3ht4 n ILE 232 N -3.69 0.00 -0.21 1.22 -5.35 -1.26 -3.39 119.36 106.69 3ht4 n ILE 232 Ca -0.01 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.47 3ht4 n ILE 232 Cb 0.68 -0.51 0.00 0.00 -1.74 0.00 0.00 39.64 38.07 3ht4 n ILE 232 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3ht4 n LYS 233 N -0.72 3.13 0.34 6.28 5.02 -0.93 -2.97 118.16 128.32 3ht4 n LYS 233 Ca 0.04 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.14 3ht4 n LYS 233 Cb 0.02 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.93 3ht4 n LYS 233 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 3ht4 h ASN 234 N 0.00 -1.37 0.00 4.39 4.21 -1.80 -2.59 115.58 118.43 3ht4 h ASN 234 Ca 0.00 0.10 0.00 0.00 1.21 0.00 0.00 56.30 57.61 3ht4 h ASN 234 Cb 0.00 0.44 0.00 0.00 -1.12 0.00 0.00 38.32 37.64 3ht4 h ASN 234 CO 0.00 -0.70 0.00 -0.81 -1.29 0.00 0.00 177.43 174.63 3ht4 n PRO 235 N -5.59 0.00 -0.01 0.81 -0.04 -1.26 -2.19 135.00 126.73 3ht4 n PRO 235 Ca -0.13 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.42 3ht4 n PRO 235 Cb 0.48 -1.08 -0.12 0.00 -0.04 0.00 0.00 33.50 32.73 3ht4 n PRO 235 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ht4 n GLY 236 N -0.58 -0.75 2.87 0.55 0.00 -0.97 -3.85 105.19 102.46 3ht4 n GLY 236 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 3ht4 n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ht4 n GLY 237 N 1.46 0.29 2.07 -0.02 0.00 -0.93 -2.07 105.19 106.00 3ht4 n GLY 237 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 3ht4 n GLY 237 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ht4 n GLY 238 N -1.16 0.57 0.00 -0.02 0.00 -1.26 -4.91 105.19 98.41 3ht4 n GLY 238 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.07 3ht4 n GLY 238 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3ht4 n ILE 239 N -2.93 0.00 -3.29 -0.61 5.41 -0.88 -4.97 119.36 112.10 3ht4 n ILE 239 Ca -0.02 -0.11 -0.40 0.00 1.00 0.00 0.00 62.75 63.21 3ht4 n ILE 239 Cb 0.08 0.60 -0.08 0.00 -0.71 0.00 0.00 39.64 39.53 3ht4 n ILE 239 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 3ht4 s VAL 240 N -1.65 5.09 -0.81 1.39 -7.23 -1.23 -4.94 120.40 111.01 3ht4 s VAL 240 Ca 0.00 0.60 0.21 0.00 -1.81 0.00 0.00 61.98 60.98 3ht4 s VAL 240 Cb 0.00 -3.83 0.20 0.00 0.56 0.00 0.00 36.38 33.30 3ht4 s VAL 240 CO 0.00 0.01 1.65 0.29 -0.31 0.00 0.00 175.10 176.74 3ht4 n LYS 241 N 5.54 0.09 -0.54 4.82 5.02 -1.26 -4.31 118.16 127.52 3ht4 n LYS 241 Ca -0.06 0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 3ht4 n LYS 241 Cb 0.50 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 3ht4 n LYS 241 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 3ht4 n THR 242 N -1.81 0.00 0.00 -0.18 5.66 -1.26 -4.94 114.28 111.74 3ht4 n THR 242 Ca 0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.04 3ht4 n THR 242 Cb 0.24 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.02 3ht4 n THR 242 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3ht4 n GLY 243 N 0.00 0.18 0.00 1.09 0.00 -0.91 -4.18 105.19 101.37 3ht4 n GLY 243 Ca 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.12 3ht4 n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ht4 n GLY 244 N 0.24 5.40 3.58 -0.02 0.00 -0.82 -2.83 105.19 110.75 3ht4 n GLY 244 Ca 0.00 -1.24 -0.11 0.00 0.00 0.00 0.00 46.02 44.67 3ht4 n GLY 244 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ht4 s TYR 245 N 1.06 -0.39 -0.16 1.61 1.13 -1.21 -4.37 117.35 115.02 3ht4 s TYR 245 Ca 0.00 0.70 -0.04 0.00 -1.41 0.00 0.00 57.07 56.32 3ht4 s TYR 245 Cb 0.00 0.44 0.06 0.00 -1.10 0.00 0.00 41.96 41.36 3ht4 s TYR 245 CO 0.00 -0.34 0.08 0.42 -2.51 0.00 0.00 175.55 173.20 3ht4 s ILE 246 N -0.96 -0.01 0.07 -3.49 1.01 -0.87 -3.11 121.20 113.83 3ht4 s ILE 246 Ca -0.02 -0.17 0.06 0.00 0.00 0.00 0.00 60.65 60.53 3ht4 s ILE 246 Cb -0.01 -0.60 -0.03 0.00 0.01 0.00 0.00 42.46 41.83 3ht4 s ILE 246 CO 0.01 -0.23 -0.18 0.68 0.00 0.00 0.00 174.94 175.22 3ht4 s VAL 247 N 2.11 1.41 -1.32 2.92 -7.23 -1.26 0.93 120.40 117.95 3ht4 s VAL 247 Ca 0.02 -1.30 0.00 0.00 -1.81 0.00 0.00 61.98 58.89 3ht4 s VAL 247 Cb -0.16 -1.28 0.00 0.00 0.56 0.00 0.00 36.38 35.50 3ht4 s VAL 247 CO -0.08 -0.04 0.00 0.61 -0.31 0.00 0.00 175.10 175.27 3ht4 n GLY 248 N 1.46 -0.71 3.78 2.32 0.00 -0.23 -4.50 105.19 107.32 3ht4 n GLY 248 Ca -0.19 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 3ht4 n GLY 248 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ht4 s LYS 249 N -1.08 4.31 0.37 1.61 2.20 0.29 -0.63 119.74 126.81 3ht4 s LYS 249 Ca 0.00 0.81 0.18 0.00 -0.36 0.00 0.00 55.97 56.60 3ht4 s LYS 249 Cb 0.00 -3.29 1.11 0.00 -1.51 0.00 0.00 37.83 34.14 3ht4 s LYS 249 CO 0.00 0.51 1.71 1.49 -0.36 0.00 0.00 175.35 178.70 3ht4 h GLU 250 N 4.98 0.35 0.00 4.03 4.57 -1.90 0.09 114.58 126.70 3ht4 h GLU 250 Ca -0.47 -0.02 -0.21 0.00 -1.18 0.00 0.00 59.36 57.47 3ht4 h GLU 250 Cb 1.21 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.69 3ht4 h GLU 250 CO 0.66 0.23 -1.05 -0.56 -1.18 0.00 0.00 179.01 177.12 3ht4 h GLN 251 N 0.36 0.00 0.00 1.92 3.07 -1.97 -2.29 115.11 116.21 3ht4 h GLN 251 Ca 0.68 0.00 -0.17 0.00 0.09 0.00 0.00 58.65 59.26 3ht4 h GLN 251 Cb 1.68 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 29.21 3ht4 h GLN 251 CO -0.44 0.94 -0.86 1.88 0.09 0.00 0.00 178.83 180.44 3ht4 h TYR 252 N 0.00 0.00 -0.44 0.06 0.05 -1.34 -3.18 116.97 112.12 3ht4 h TYR 252 Ca -0.03 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.66 3ht4 h TYR 252 Cb 1.78 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.50 3ht4 h TYR 252 CO 0.00 0.75 -0.06 0.28 -1.05 0.00 0.00 178.16 178.08 3ht4 h VAL 253 N 0.00 1.27 -0.87 -2.88 2.07 -1.40 -2.59 116.25 111.85 3ht4 h VAL 253 Ca -0.04 -1.15 0.17 0.00 0.82 0.00 0.00 66.70 66.51 3ht4 h VAL 253 Cb 1.61 1.12 -0.16 0.00 -1.52 0.00 0.00 31.29 32.34 3ht4 h VAL 253 CO 0.09 0.39 -0.25 -0.33 0.02 0.00 0.00 177.57 177.49 3ht4 h GLU 254 N 0.65 -0.01 -0.07 1.57 4.39 -1.39 0.19 114.58 119.90 3ht4 h GLU 254 Ca 0.12 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.67 3ht4 h GLU 254 Cb 0.58 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 3ht4 h GLU 254 CO 0.03 -0.01 -0.62 0.00 -1.16 0.00 0.00 179.01 177.26 3ht4 h ALA 255 N 1.74 0.82 0.00 3.43 0.00 -1.53 0.12 119.26 123.84 3ht4 h ALA 255 Ca 0.40 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3ht4 h ALA 255 Cb 0.63 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3ht4 h ALA 255 CO -0.90 0.73 -0.11 0.00 0.00 0.00 0.00 179.25 178.97 3ht4 h ALA 257 N 1.89 -0.36 -0.80 0.00 0.00 0.19 -1.94 119.26 118.24 3ht4 h ALA 257 Ca -0.00 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.81 3ht4 h ALA 257 Cb 0.22 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 3ht4 h ALA 257 CO 0.01 -0.37 0.49 1.88 0.00 0.00 0.00 179.25 181.26 3ht4 h TYR 258 N -1.02 0.90 -0.03 0.00 0.05 -1.27 -2.65 116.97 112.95 3ht4 h TYR 258 Ca -0.04 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.78 3ht4 h TYR 258 Cb 0.42 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 3ht4 h TYR 258 CO 0.03 0.47 -0.04 -0.09 -1.05 0.00 0.00 178.16 177.48 3ht4 h ARG 259 N 0.90 -0.06 0.21 4.88 9.65 -1.21 -1.60 114.38 127.16 3ht4 h ARG 259 Ca 0.34 0.00 0.01 0.00 -1.10 0.00 0.00 59.98 59.24 3ht4 h ARG 259 Cb 0.14 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.70 3ht4 h ARG 259 CO -0.16 -0.04 -0.35 1.25 2.80 0.00 0.00 179.97 183.46 3ht4 h LEU 260 N -0.06 -1.00 0.00 3.80 5.85 -1.08 -3.41 115.31 119.40 3ht4 h LEU 260 Ca 0.03 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3ht4 h LEU 260 Cb 0.10 0.36 0.00 0.00 0.37 0.00 0.00 40.66 41.50 3ht4 h LEU 260 CO -0.07 -0.46 0.00 0.41 -0.34 0.00 0.00 178.44 177.98 3ht4 n THR 261 N -5.45 0.00 -3.59 1.05 -1.04 -1.02 -5.12 114.28 99.12 3ht4 n THR 261 Ca -0.08 0.00 -0.07 0.00 -2.04 0.00 0.00 64.05 61.86 3ht4 n THR 261 Cb 0.35 -0.37 -0.04 0.00 -1.82 0.00 0.00 70.33 68.45 3ht4 n THR 261 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3ht4 s SER 262 N -1.00 -0.23 0.37 8.00 0.15 -0.61 -5.04 113.70 115.34 3ht4 s SER 262 Ca 0.00 0.17 -0.28 0.00 0.70 0.00 0.00 55.95 56.55 3ht4 s SER 262 Cb 0.00 0.21 -0.11 0.00 -1.71 0.00 0.00 66.02 64.41 3ht4 s SER 262 CO 0.00 -0.28 1.36 -2.65 1.20 0.00 0.00 173.24 172.88 3ht4 n PRO 263 N 0.36 2.30 -0.22 5.44 -0.02 -1.26 -1.60 135.00 140.01 3ht4 n PRO 263 Ca -0.05 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3ht4 n PRO 263 Cb 0.59 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3ht4 n PRO 263 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ht4 n GLY 264 N 0.65 1.33 0.75 -1.23 0.00 -1.26 -4.78 105.19 100.65 3ht4 n GLY 264 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3ht4 n GLY 264 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3ht4 n ILE 265 N -2.00 0.00 0.00 -0.61 5.41 -0.64 -5.07 119.36 116.44 3ht4 n ILE 265 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 3ht4 n ILE 265 Cb 0.00 -1.17 0.00 0.00 -0.71 0.00 0.00 39.64 37.76 3ht4 n ILE 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3ht4 n GLY 266 N 3.06 2.52 0.97 7.39 0.00 -0.62 -2.29 105.19 116.22 3ht4 n GLY 266 Ca 0.00 0.35 0.01 0.00 0.00 0.00 0.00 46.02 46.39 3ht4 n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ht4 n ALA 267 N 10.57 3.67 0.13 4.61 0.00 -1.26 -4.23 120.51 134.00 3ht4 n ALA 267 Ca 0.00 -3.24 0.06 0.00 0.00 0.00 0.00 53.44 50.26 3ht4 n ALA 267 Cb 0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 19.45 18.95 3ht4 n ALA 267 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3ht4 n GLU 268 N -0.84 1.00 -1.97 0.00 4.71 -0.97 -5.03 120.64 117.54 3ht4 n GLU 268 Ca 0.21 -0.09 0.00 0.00 -0.01 0.00 0.00 57.16 57.27 3ht4 n GLU 268 Cb 0.79 -1.25 0.00 0.00 -1.01 0.00 0.00 31.44 29.97 3ht4 n GLU 268 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3ht4 n ALA 269 N -1.78 0.00 -0.73 0.62 0.00 -1.26 -4.33 120.51 113.03 3ht4 n ALA 269 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3ht4 n ALA 269 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.75 3ht4 n ALA 269 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ht4 n GLY 270 N 4.51 -1.79 3.72 0.00 0.00 0.93 -4.96 105.19 107.60 3ht4 n GLY 270 Ca 0.00 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 45.00 3ht4 n GLY 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ht4 s ALA 271 N 0.00 1.94 -0.00 4.61 0.00 -1.24 -4.64 121.76 122.42 3ht4 s ALA 271 Ca 0.00 0.59 -0.12 0.00 0.00 0.00 0.00 51.96 52.43 3ht4 s ALA 271 Cb 0.00 -3.40 -0.33 0.00 0.00 0.00 0.00 23.12 19.39 3ht4 s ALA 271 CO 0.00 -2.13 0.85 0.66 0.00 0.00 0.00 175.76 175.13 3ht4 h SER 272 N -1.07 0.69 0.00 0.00 4.64 -1.90 -3.47 113.55 112.43 3ht4 h SER 272 Ca -0.45 -0.87 0.00 0.00 -0.47 0.00 0.00 61.79 60.01 3ht4 h SER 272 Cb 1.26 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 3ht4 h SER 272 CO 0.47 1.71 0.00 0.18 -0.87 0.00 0.00 176.83 178.32 3ht4 n LEU 273 N -3.63 0.00 -2.32 5.97 4.77 -0.99 -3.86 117.00 116.94 3ht4 n LEU 273 Ca -0.20 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.45 3ht4 n LEU 273 Cb 1.08 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 42.25 3ht4 n LEU 273 CO 0.55 0.00 1.44 -1.22 -1.33 0.00 0.00 177.39 176.84 3ht4 n TYR 274 N 7.43 3.04 0.37 -1.77 4.01 -1.26 -4.19 117.16 124.80 3ht4 n TYR 274 Ca 0.00 -2.88 0.04 0.00 -0.16 0.00 0.00 57.90 54.90 3ht4 n TYR 274 Cb 0.00 -1.39 -0.02 0.00 -0.31 0.00 0.00 39.34 37.61 3ht4 n TYR 274 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3ht4 n SER 275 N -0.76 0.72 0.07 7.72 2.88 -1.25 -4.74 113.62 118.27 3ht4 n SER 275 Ca 0.59 -0.86 -0.10 0.00 -1.33 0.00 0.00 58.87 57.17 3ht4 n SER 275 Cb 0.63 0.75 -0.13 0.00 -0.75 0.00 0.00 64.21 64.71 3ht4 n SER 275 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 3ht4 h LEU 276 N 0.44 0.15 0.10 2.46 3.38 -1.85 -3.30 115.31 116.70 3ht4 h LEU 276 Ca 0.00 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 3ht4 h LEU 276 Cb 0.23 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3ht4 h LEU 276 CO 0.00 1.13 -0.05 -0.61 0.09 0.00 0.00 178.44 179.00 3ht4 h GLN 277 N 0.03 -0.13 -1.99 1.13 4.15 -1.85 -3.06 115.11 113.39 3ht4 h GLN 277 Ca -0.06 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.36 3ht4 h GLN 277 Cb 1.85 0.03 0.00 0.00 0.21 0.00 0.00 27.48 29.57 3ht4 h GLN 277 CO 0.15 0.34 0.00 -0.85 -1.93 0.00 0.00 178.83 176.54 3ht4 n GLU 278 N -4.91 0.00 0.00 1.69 0.28 -1.24 -1.21 120.64 115.25 3ht4 n GLU 278 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.92 3ht4 n GLU 278 Cb 0.27 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.65 3ht4 n GLU 278 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3ht4 n TYR 280 N 1.06 0.00 0.21 -1.84 4.01 -1.16 -2.02 117.16 117.43 3ht4 n TYR 280 Ca 0.00 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.80 3ht4 n TYR 280 Cb 0.00 0.00 0.46 0.00 -0.31 0.00 0.00 39.34 39.49 3ht4 n TYR 280 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 3ht4 h GLN 281 N 0.00 0.00 -0.31 -0.72 4.15 -1.46 0.13 115.11 116.90 3ht4 h GLN 281 Ca 0.00 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.30 3ht4 h GLN 281 Cb 0.00 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 3ht4 h GLN 281 CO 0.00 0.30 -0.31 0.78 -1.93 0.00 0.00 178.83 177.66 3ht4 h GLY 282 N 1.20 0.73 1.56 2.39 0.00 -1.59 -2.54 103.07 104.81 3ht4 h GLY 282 Ca -0.00 -0.67 -0.18 0.00 0.00 0.00 0.00 47.33 46.48 3ht4 h GLY 282 CO 0.04 0.60 -0.69 -2.75 0.00 0.00 0.00 176.54 173.74 3ht4 h PHE 283 N 0.57 0.59 -0.38 5.60 3.57 -0.90 0.99 116.94 126.97 3ht4 h PHE 283 Ca 0.07 -0.25 -0.07 0.00 3.53 0.00 0.00 57.97 61.25 3ht4 h PHE 283 Cb 0.81 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.44 3ht4 h PHE 283 CO 0.04 1.00 -0.04 0.35 -2.23 0.00 0.00 178.31 177.42 3ht4 h PHE 284 N 0.31 0.67 0.00 0.41 3.57 -1.18 -2.89 116.94 117.84 3ht4 h PHE 284 Ca -0.02 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.39 3ht4 h PHE 284 Cb 1.26 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.81 3ht4 h PHE 284 CO 0.05 0.67 -0.57 1.28 -2.23 0.00 0.00 178.31 177.50 3ht4 n LEU 285 N -4.22 0.57 0.24 0.59 4.77 -0.96 -4.55 117.00 113.43 3ht4 n LEU 285 Ca 0.02 0.12 -0.18 0.00 -0.03 0.00 0.00 56.01 55.94 3ht4 n LEU 285 Cb 0.30 -0.22 -0.10 0.00 -2.33 0.00 0.00 43.42 41.07 3ht4 n LEU 285 CO 0.41 0.04 0.53 0.00 -1.33 0.00 0.00 177.39 177.04 3ht4 h ALA 286 N 2.76 -1.07 -0.98 -1.18 0.00 -0.58 0.47 119.26 118.68 3ht4 h ALA 286 Ca 0.00 -0.16 0.24 0.00 0.00 0.00 0.00 54.91 54.98 3ht4 h ALA 286 Cb 0.62 0.76 -0.08 0.00 0.00 0.00 0.00 17.79 19.09 3ht4 h ALA 286 CO 0.00 -1.15 0.64 -1.35 0.00 0.00 0.00 179.25 177.39 3ht4 h PRO 287 N -0.93 0.37 0.26 0.00 0.11 -1.80 0.15 132.00 130.16 3ht4 h PRO 287 Ca -0.04 -0.02 -0.34 0.00 0.11 0.00 0.00 66.00 65.71 3ht4 h PRO 287 Cb 0.83 -0.08 0.04 0.00 0.11 0.00 0.00 31.00 31.90 3ht4 h PRO 287 CO -0.12 0.24 -1.49 1.25 -0.21 0.00 0.00 178.00 177.67 3ht4 h HIS 288 N 0.38 0.99 -0.23 0.65 -0.00 -1.64 -0.87 115.15 114.43 3ht4 h HIS 288 Ca 0.53 -0.72 -0.03 0.00 -0.00 0.00 0.00 60.37 60.14 3ht4 h HIS 288 Cb 1.37 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 28.74 3ht4 h HIS 288 CO -0.00 1.56 0.02 0.28 -0.00 0.00 0.00 177.93 179.79 3ht4 h VAL 289 N 0.15 1.24 -0.98 5.26 2.07 0.02 -1.15 116.25 122.85 3ht4 h VAL 289 Ca -0.26 -0.83 0.04 0.00 0.82 0.00 0.00 66.70 66.48 3ht4 h VAL 289 Cb 2.18 1.34 -0.06 0.00 -1.52 0.00 0.00 31.29 33.22 3ht4 h VAL 289 CO 0.28 0.26 0.64 0.00 0.02 0.00 0.00 177.57 178.77 3ht4 h ALA 290 N 0.82 1.38 -0.70 1.67 0.00 -0.83 -1.16 119.26 120.45 3ht4 h ALA 290 Ca 0.07 -0.04 0.15 0.00 0.00 0.00 0.00 54.91 55.09 3ht4 h ALA 290 Cb 0.36 -0.34 -0.11 0.00 0.00 0.00 0.00 17.79 17.71 3ht4 h ALA 290 CO 0.01 0.51 0.12 0.78 0.00 0.00 0.00 179.25 180.67 3ht4 h GLY 291 N 1.22 0.91 1.04 0.00 0.00 -0.63 -1.69 103.07 103.91 3ht4 h GLY 291 Ca 0.40 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.67 3ht4 h GLY 291 CO -0.13 -0.20 0.16 1.46 0.00 0.00 0.00 176.54 177.82 3ht4 h GLN 292 N 0.22 1.04 -0.27 4.80 1.08 0.03 -0.76 115.11 121.24 3ht4 h GLN 292 Ca 0.39 -0.25 -0.08 0.00 -1.45 0.00 0.00 58.65 57.25 3ht4 h GLN 292 Cb 0.65 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 3ht4 h GLN 292 CO -0.52 0.94 -0.19 0.00 -0.95 0.00 0.00 178.83 178.11 3ht4 h ALA 293 N 1.06 1.17 0.01 3.87 0.00 -1.12 -1.59 119.26 122.66 3ht4 h ALA 293 Ca 0.20 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3ht4 h ALA 293 Cb 0.36 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3ht4 h ALA 293 CO 0.00 0.53 -0.01 1.25 0.00 0.00 0.00 179.25 181.02 3ht4 h LEU 294 N 0.44 -0.02 -2.70 0.00 5.85 -0.63 0.34 115.31 118.60 3ht4 h LEU 294 Ca 0.07 -0.56 -0.00 0.00 0.84 0.00 0.00 57.88 58.23 3ht4 h LEU 294 Cb 0.58 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 3ht4 h LEU 294 CO 0.04 0.56 -0.00 0.11 -0.34 0.00 0.00 178.44 178.81 3ht4 h LYS 295 N -0.60 0.00 0.12 1.25 1.57 -1.16 -0.24 116.57 117.51 3ht4 h LYS 295 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3ht4 h LYS 295 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 3ht4 h LYS 295 CO 0.00 0.00 -0.06 0.78 -0.57 0.00 0.00 179.45 179.61 3ht4 h GLY 296 N 0.03 -0.17 -0.71 3.86 0.00 -1.04 -2.96 103.07 102.06 3ht4 h GLY 296 Ca -0.00 0.06 0.17 0.00 0.00 0.00 0.00 47.33 47.56 3ht4 h GLY 296 CO 0.00 -0.06 -0.22 0.00 0.00 0.00 0.00 176.54 176.26 3ht4 h ALA 297 N -0.41 0.54 -0.27 3.60 0.00 0.62 0.20 119.26 123.53 3ht4 h ALA 297 Ca -0.02 0.33 -0.15 0.00 0.00 0.00 0.00 54.91 55.07 3ht4 h ALA 297 Cb 0.51 0.67 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3ht4 h ALA 297 CO 0.03 -0.41 -0.45 0.97 0.00 0.00 0.00 179.25 179.39 3ht4 h ILE 298 N -0.00 1.29 -0.43 0.00 2.10 -1.19 -1.65 117.51 117.62 3ht4 h ILE 298 Ca 0.40 -1.64 -0.06 0.00 1.08 0.00 0.00 64.86 64.65 3ht4 h ILE 298 Cb 0.62 1.56 -0.02 0.00 -1.09 0.00 0.00 36.82 37.90 3ht4 h ILE 298 CO -0.88 0.52 0.05 0.15 -1.08 0.00 0.00 178.15 176.91 3ht4 h PHE 299 N 0.56 0.79 -0.76 2.19 3.57 -1.09 0.15 116.94 122.35 3ht4 h PHE 299 Ca 0.04 -0.12 0.17 0.00 3.53 0.00 0.00 57.97 61.59 3ht4 h PHE 299 Cb 1.00 -0.21 -0.12 0.00 2.79 0.00 0.00 35.95 39.41 3ht4 h PHE 299 CO 0.05 0.76 0.18 1.15 -2.23 0.00 0.00 178.31 178.22 3ht4 h THR 300 N 0.58 0.48 -0.24 4.41 2.02 -0.32 0.47 112.91 120.32 3ht4 h THR 300 Ca 0.13 -0.09 -0.12 0.00 0.77 0.00 0.00 66.41 67.10 3ht4 h THR 300 Cb 0.41 0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 3ht4 h THR 300 CO 0.01 0.05 -0.32 0.00 0.37 0.00 0.00 175.52 175.63 3ht4 h ALA 301 N 1.64 0.36 0.00 6.16 0.00 -0.77 -1.65 119.26 125.00 3ht4 h ALA 301 Ca 0.44 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 3ht4 h ALA 301 Cb 0.77 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3ht4 h ALA 301 CO -0.54 0.40 -0.32 0.00 0.00 0.00 0.00 179.25 178.79 3ht4 h ALA 302 N 0.65 1.26 0.08 0.00 0.00 -0.19 -2.34 119.26 118.73 3ht4 h ALA 302 Ca 0.03 -0.29 -0.18 0.00 0.00 0.00 0.00 54.91 54.47 3ht4 h ALA 302 Cb 0.90 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3ht4 h ALA 302 CO 0.08 0.40 -0.90 0.35 0.00 0.00 0.00 179.25 179.17 3ht4 h PHE 303 N 0.00 0.31 0.00 0.00 -0.00 0.06 -3.26 116.94 114.05 3ht4 h PHE 303 Ca -0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 57.97 57.74 3ht4 h PHE 303 Cb 0.65 -0.01 0.00 0.00 -0.00 0.00 0.00 35.95 36.59 3ht4 h PHE 303 CO 0.00 1.35 -0.02 -0.07 -0.00 0.00 0.00 178.31 179.57 3ht4 h LEU 304 N -0.58 0.00 0.05 0.59 -0.00 -1.35 -2.44 115.31 111.57 3ht4 h LEU 304 Ca -0.20 -0.01 -0.00 0.00 -0.00 0.00 0.00 57.88 57.68 3ht4 h LEU 304 Cb 1.49 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 42.15 3ht4 h LEU 304 CO 0.03 0.00 -0.04 -0.08 -0.00 0.00 0.00 178.44 178.35 3ht4 h GLU 305 N 0.00 -0.09 -0.69 1.13 4.57 -1.54 -2.24 114.58 115.72 3ht4 h GLU 305 Ca 0.00 0.01 0.15 0.00 -1.18 0.00 0.00 59.36 58.33 3ht4 h GLU 305 Cb 0.80 0.02 -0.12 0.00 -0.16 0.00 0.00 28.75 29.29 3ht4 h GLU 305 CO 0.00 -0.06 -0.05 0.87 -1.18 0.00 0.00 179.01 178.59 3ht4 h LYS 306 N -0.09 0.07 0.00 1.92 6.56 -1.56 0.62 116.57 124.09 3ht4 h LYS 306 Ca -0.01 -0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.57 3ht4 h LYS 306 Cb 0.08 -0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 31.72 3ht4 h LYS 306 CO 0.00 0.05 -0.03 -0.07 -2.06 0.00 0.00 179.45 177.34 3ht4 h LEU 307 N 0.07 0.00 0.00 2.94 3.38 -1.52 -3.52 115.31 116.66 3ht4 h LEU 307 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 3ht4 h LEU 307 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3ht4 h LEU 307 CO -0.64 0.03 0.00 0.61 0.09 0.00 0.00 178.44 178.53 3ht4 n GLY 308 N -0.53 0.98 3.43 0.83 0.00 0.22 -5.08 105.19 105.03 3ht4 n GLY 308 Ca -0.01 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 3ht4 n GLY 308 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ht4 s ASN 310 N 0.00 5.92 0.12 1.61 -0.87 -1.26 -5.01 114.94 115.46 3ht4 s ASN 310 Ca 0.00 -0.89 0.03 0.00 -1.57 0.00 0.00 52.86 50.44 3ht4 s ASN 310 Cb 0.00 -2.09 -0.04 0.00 -0.02 0.00 0.00 41.25 39.10 3ht4 s ASN 310 CO 0.00 -0.40 0.14 0.42 -2.57 0.00 0.00 177.10 174.69 3ht4 s THR 311 N 1.63 4.68 -0.17 1.60 -4.23 -1.26 0.09 115.64 117.98 3ht4 s THR 311 Ca 0.04 -0.85 -0.12 0.00 -1.18 0.00 0.00 61.69 59.58 3ht4 s THR 311 Cb -0.19 -3.33 0.05 0.00 1.34 0.00 0.00 72.50 70.38 3ht4 s THR 311 CO 0.08 0.01 0.43 -0.55 -0.54 0.00 0.00 174.62 174.06 3ht4 s SER 312 N -2.77 -0.51 0.97 3.99 0.15 0.18 -4.01 113.70 111.70 3ht4 s SER 312 Ca 0.31 0.91 -0.12 0.00 0.70 0.00 0.00 55.95 57.75 3ht4 s SER 312 Cb -0.11 0.85 0.11 0.00 -1.71 0.00 0.00 66.02 65.15 3ht4 s SER 312 CO 0.24 -0.18 0.73 -2.65 1.20 0.00 0.00 173.24 172.58 3ht4 n PRO 313 N 3.70 -0.64 -2.30 5.44 -0.02 -1.26 0.15 135.00 140.08 3ht4 n PRO 313 Ca -0.19 -0.14 -0.35 0.00 -2.02 0.00 0.00 63.50 60.80 3ht4 n PRO 313 Cb 0.56 -2.08 -0.00 0.00 -0.02 0.00 0.00 33.50 31.95 3ht4 n PRO 313 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ht4 s ALA 314 N -2.49 2.76 0.32 3.55 0.00 -1.26 -4.81 121.76 119.83 3ht4 s ALA 314 Ca 0.62 0.82 -0.00 0.00 0.00 0.00 0.00 51.96 53.39 3ht4 s ALA 314 Cb -0.22 -3.35 0.52 0.00 0.00 0.00 0.00 23.12 20.07 3ht4 s ALA 314 CO 0.63 -0.69 1.96 0.11 0.00 0.00 0.00 175.76 177.77 3ht4 h TRP 315 N 1.38 0.90 -0.04 0.00 5.08 -1.84 -0.88 115.95 120.56 3ht4 h TRP 315 Ca -0.50 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.47 3ht4 h TRP 315 Cb 1.25 -0.30 0.00 0.00 -3.00 0.00 0.00 29.16 27.12 3ht4 h TRP 315 CO 0.52 0.60 0.00 0.27 -1.28 0.00 0.00 178.44 178.55 3ht4 n ASN 316 N -4.40 1.04 -4.78 0.11 6.94 -1.26 -4.84 115.26 108.08 3ht4 n ASN 316 Ca 0.07 -1.41 -0.37 0.00 -0.02 0.00 0.00 54.58 52.85 3ht4 n ASN 316 Cb 0.07 -0.02 -0.03 0.00 -2.36 0.00 0.00 39.78 37.44 3ht4 n ASN 316 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3ht4 s ALA 317 N -1.96 3.06 0.98 -2.53 0.00 -0.34 -5.03 121.76 115.94 3ht4 s ALA 317 Ca 0.38 0.82 -0.14 0.00 0.00 0.00 0.00 51.96 53.03 3ht4 s ALA 317 Cb 0.20 -3.33 0.04 0.00 0.00 0.00 0.00 23.12 20.03 3ht4 s ALA 317 CO 0.32 -0.42 0.28 -2.30 0.00 0.00 0.00 175.76 173.64 3ht4 n PRO 318 N -0.18 -0.48 -3.91 0.00 -0.02 -1.26 -4.94 135.00 124.20 3ht4 n PRO 318 Ca 0.06 -0.10 -0.17 0.00 -2.02 0.00 0.00 63.50 61.26 3ht4 n PRO 318 Cb 0.49 -1.79 -0.16 0.00 -0.02 0.00 0.00 33.50 32.01 3ht4 n PRO 318 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3ht4 s ARG 319 N -3.53 0.28 0.00 -0.52 1.81 -1.26 -5.00 118.95 110.74 3ht4 s ARG 319 Ca 0.56 0.08 0.11 0.00 -1.72 0.00 0.00 55.73 54.76 3ht4 s ARG 319 Cb -0.19 -0.48 0.00 0.00 -0.45 0.00 0.00 34.95 33.83 3ht4 s ARG 319 CO 0.68 -0.14 0.69 -2.37 -0.68 0.00 0.00 175.30 173.47 3ht4 n THR 320 N 4.16 0.00 -3.37 0.02 5.66 -1.26 -4.53 114.28 114.96 3ht4 n THR 320 Ca -0.26 -0.39 -0.02 0.00 -3.05 0.00 0.00 64.05 60.33 3ht4 n THR 320 Cb 0.50 1.14 0.01 0.00 -1.55 0.00 0.00 70.33 70.43 3ht4 n THR 320 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 3ht4 n ASP 321 N -0.18 -0.60 -1.79 1.09 5.68 -1.26 -4.23 116.55 115.26 3ht4 n ASP 321 Ca 0.05 -1.38 0.08 0.00 -0.50 0.00 0.00 54.79 53.04 3ht4 n ASP 321 Cb 0.24 0.99 0.39 0.00 -1.14 0.00 0.00 41.12 41.60 3ht4 n ASP 321 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3ht4 n LEU 322 N 0.00 5.39 -4.72 -2.12 4.77 -0.82 -4.93 117.00 114.57 3ht4 n LEU 322 Ca -0.02 -2.73 -0.41 0.00 -0.03 0.00 0.00 56.01 52.81 3ht4 n LEU 322 Cb 0.17 -0.65 -0.04 0.00 -2.33 0.00 0.00 43.42 40.58 3ht4 n LEU 322 CO 0.07 0.71 0.70 -0.63 -1.33 0.00 0.00 177.39 176.91 3ht4 s ILE 323 N -2.39 4.56 -0.12 -0.08 -1.09 -1.26 -4.48 121.20 116.33 3ht4 s ILE 323 Ca 0.54 1.99 -0.21 0.00 -2.23 0.00 0.00 60.65 60.74 3ht4 s ILE 323 Cb 0.38 -4.27 0.05 0.00 -1.58 0.00 0.00 42.46 37.04 3ht4 s ILE 323 CO 0.20 0.24 0.52 -1.58 -1.23 0.00 0.00 174.94 173.09 3ht4 s GLN 324 N 0.41 0.75 -0.01 2.79 2.00 -1.26 -4.42 119.66 119.92 3ht4 s GLN 324 Ca 0.50 0.40 -0.18 0.00 -2.00 0.00 0.00 55.36 54.08 3ht4 s GLN 324 Cb -0.23 0.35 0.03 0.00 0.80 0.00 0.00 33.01 33.96 3ht4 s GLN 324 CO 0.30 -0.17 0.38 -1.54 -0.50 0.00 0.00 175.29 173.76 3ht4 s SER 325 N -0.48 -0.28 0.05 6.67 1.04 0.41 -2.40 113.70 118.71 3ht4 s SER 325 Ca -0.06 0.18 0.04 0.00 0.48 0.00 0.00 55.95 56.59 3ht4 s SER 325 Cb -0.03 0.36 -0.02 0.00 0.10 0.00 0.00 66.02 66.43 3ht4 s SER 325 CO 0.04 -0.50 -0.13 0.68 0.98 0.00 0.00 173.24 174.31 3ht4 s VAL 326 N -1.46 1.01 -0.37 5.02 -7.23 -1.20 0.48 120.40 116.64 3ht4 s VAL 326 Ca -0.12 -1.08 -0.14 0.00 -1.81 0.00 0.00 61.98 58.84 3ht4 s VAL 326 Cb -0.04 -0.95 0.00 0.00 0.56 0.00 0.00 36.38 35.96 3ht4 s VAL 326 CO 0.04 -0.12 0.26 -1.10 -0.31 0.00 0.00 175.10 173.88 3ht4 s GLN 327 N -1.35 3.24 0.23 4.82 -0.21 0.11 -2.60 119.66 123.89 3ht4 s GLN 327 Ca -0.01 -0.83 0.19 0.00 0.02 0.00 0.00 55.36 54.74 3ht4 s GLN 327 Cb -0.09 -3.87 0.04 0.00 1.00 0.00 0.00 33.01 30.09 3ht4 s GLN 327 CO 0.01 -0.59 1.18 0.74 -2.12 0.00 0.00 175.29 174.52 3ht4 h PHE 328 N 8.54 0.00 0.00 0.91 0.04 -1.62 -3.34 116.94 121.47 3ht4 h PHE 328 Ca -0.29 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.48 3ht4 h PHE 328 Cb 1.14 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.29 3ht4 h PHE 328 CO 0.61 0.26 0.00 -0.25 -0.60 0.00 0.00 178.31 178.33 3ht4 n ASP 329 N -2.93 0.00 -3.75 2.17 8.00 -1.19 -4.92 116.55 113.94 3ht4 n ASP 329 Ca -0.01 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.32 3ht4 n ASP 329 Cb 0.66 -0.59 -0.17 0.00 -0.02 0.00 0.00 41.12 41.01 3ht4 n ASP 329 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3ht4 s ASP 330 N -3.14 0.49 0.15 -2.24 3.68 -1.26 -4.90 116.67 109.45 3ht4 s ASP 330 Ca 0.00 0.04 -0.19 0.00 2.13 0.00 0.00 52.55 54.52 3ht4 s ASP 330 Cb 0.00 -0.13 0.04 0.00 -1.45 0.00 0.00 42.92 41.38 3ht4 s ASP 330 CO 0.00 -0.16 1.67 0.50 0.13 0.00 0.00 175.17 177.31 3ht4 h LYS 331 N 7.66 -0.07 0.00 4.34 3.64 -1.96 -0.66 116.57 129.53 3ht4 h LYS 331 Ca -0.35 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.01 3ht4 h LYS 331 Cb 1.12 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3ht4 h LYS 331 CO 0.37 -0.04 -0.11 -0.44 -2.27 0.00 0.00 179.45 176.96 3ht4 h ASP 332 N -0.07 0.00 0.00 4.20 5.19 -1.99 -2.01 116.42 121.74 3ht4 h ASP 332 Ca 0.15 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 3ht4 h ASP 332 Cb 0.29 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.80 3ht4 h ASP 332 CO -0.34 0.11 0.00 -1.14 -3.12 0.00 0.00 179.24 174.76 3ht4 n ARG 333 N -3.64 0.94 0.00 3.56 0.63 -0.26 -2.79 116.66 115.10 3ht4 n ARG 333 Ca -0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 3ht4 n ARG 333 Cb 0.23 -1.23 0.00 0.00 0.45 0.00 0.00 32.46 31.91 3ht4 n ARG 333 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 3ht4 n ILE 335 N 0.30 0.00 -0.19 5.15 5.41 -0.76 -2.19 119.36 127.09 3ht4 n ILE 335 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 3ht4 n ILE 335 Cb 0.36 0.00 0.09 0.00 -0.71 0.00 0.00 39.64 39.38 3ht4 n ILE 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ht4 h ALA 336 N 0.00 0.58 0.36 -1.39 0.00 -1.78 -0.55 119.26 116.48 3ht4 h ALA 336 Ca 0.00 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 3ht4 h ALA 336 Cb 0.00 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3ht4 h ALA 336 CO 0.00 -0.38 -0.41 0.35 0.00 0.00 0.00 179.25 178.81 3ht4 h PHE 337 N 0.14 -1.12 0.00 0.00 3.04 -1.71 0.23 116.94 117.52 3ht4 h PHE 337 Ca 0.30 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.26 3ht4 h PHE 337 Cb 0.48 0.44 -0.00 0.00 2.56 0.00 0.00 35.95 39.43 3ht4 h PHE 337 CO -0.34 -0.55 -0.03 0.00 -2.02 0.00 0.00 178.31 175.37 3ht4 h GLN 339 N 0.00 0.35 -1.00 0.00 4.20 -0.54 -2.97 115.11 115.16 3ht4 h GLN 339 Ca -0.00 -0.43 0.28 0.00 0.06 0.00 0.00 58.65 58.56 3ht4 h GLN 339 Cb 0.11 0.13 -0.14 0.00 0.30 0.00 0.00 27.48 27.89 3ht4 h GLN 339 CO 0.00 1.12 0.57 0.00 -0.67 0.00 0.00 178.83 179.86 3ht4 h ALA 340 N 0.24 1.85 0.10 3.87 0.00 0.16 -0.91 119.26 124.57 3ht4 h ALA 340 Ca -0.09 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3ht4 h ALA 340 Cb 1.37 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.26 3ht4 h ALA 340 CO 0.12 -0.42 -0.05 0.82 0.00 0.00 0.00 179.25 179.72 3ht4 h ILE 341 N 0.45 1.12 -0.02 0.00 1.08 -1.32 -1.53 117.51 117.29 3ht4 h ILE 341 Ca 0.68 -0.91 0.01 0.00 -0.39 0.00 0.00 64.86 64.25 3ht4 h ILE 341 Cb 1.44 1.69 -0.00 0.00 -3.07 0.00 0.00 36.82 36.87 3ht4 h ILE 341 CO -0.54 0.22 0.04 -0.61 -0.69 0.00 0.00 178.15 176.57 3ht4 h GLN 342 N -0.56 0.00 0.00 2.37 5.75 -1.11 0.29 115.11 121.85 3ht4 h GLN 342 Ca -0.01 0.00 -0.15 0.00 -0.15 0.00 0.00 58.65 58.33 3ht4 h GLN 342 Cb 0.46 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.98 3ht4 h GLN 342 CO 0.02 0.00 -1.18 -0.92 -2.65 0.00 0.00 178.83 174.10 3ht4 h TYR 343 N 0.00 0.00 -0.00 3.99 5.03 -1.11 -3.32 116.97 121.56 3ht4 h TYR 343 Ca 0.01 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.32 3ht4 h TYR 343 Cb 0.10 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.38 3ht4 h TYR 343 CO 0.00 0.57 -0.27 0.00 -1.32 0.00 0.00 178.16 177.15 3ht4 n ALA 344 N -2.35 3.08 -1.61 1.82 0.00 0.75 -4.82 120.51 117.38 3ht4 n ALA 344 Ca -0.06 -0.35 -0.32 0.00 0.00 0.00 0.00 53.44 52.70 3ht4 n ALA 344 Cb 0.82 -1.19 0.03 0.00 0.00 0.00 0.00 19.45 19.10 3ht4 n ALA 344 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3ht4 s SER 345 N -2.63 5.57 -0.06 0.00 0.01 0.29 -4.86 113.70 112.02 3ht4 s SER 345 Ca 0.22 1.79 -0.20 0.00 1.31 0.00 0.00 55.95 59.06 3ht4 s SER 345 Cb 0.19 -2.53 -0.15 0.00 0.21 0.00 0.00 66.02 63.74 3ht4 s SER 345 CO 0.55 -1.31 0.82 1.55 0.41 0.00 0.00 173.24 175.26 3ht4 h PRO 346 N 0.06 -0.19 -5.64 12.44 0.13 -1.91 -3.40 132.00 133.49 3ht4 h PRO 346 Ca -0.46 0.01 -0.66 0.00 -0.87 0.00 0.00 66.00 64.03 3ht4 h PRO 346 Cb 1.22 0.04 -0.11 0.00 0.13 0.00 0.00 31.00 32.28 3ht4 h PRO 346 CO 0.57 0.25 -0.54 0.96 -0.23 0.00 0.00 178.00 179.01 3ht4 s ILE 347 N -3.26 5.02 -0.51 -3.56 -5.25 -1.26 -4.49 121.20 107.88 3ht4 s ILE 347 Ca -0.12 0.03 -0.03 0.00 -0.99 0.00 0.00 60.65 59.54 3ht4 s ILE 347 Cb 0.00 -3.19 0.00 0.00 2.95 0.00 0.00 42.46 42.23 3ht4 s ILE 347 CO 0.46 0.57 0.44 0.59 -1.79 0.00 0.00 174.94 175.22 3ht4 n ASN 348 N 2.42 -3.27 0.22 4.36 3.02 -1.26 -4.23 115.26 116.52 3ht4 n ASN 348 Ca -0.19 -0.22 0.13 0.00 -0.03 0.00 0.00 54.58 54.28 3ht4 n ASN 348 Cb 0.54 -2.27 0.75 0.00 -0.61 0.00 0.00 39.78 38.19 3ht4 n ASN 348 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3ht4 h SER 349 N -0.97 0.00 0.29 6.41 0.02 -1.77 -3.11 113.55 114.41 3ht4 h SER 349 Ca -0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 3ht4 h SER 349 Cb 1.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.68 3ht4 h SER 349 CO 0.21 0.00 -0.86 0.00 -1.14 0.00 0.00 176.83 175.04 3ht4 n HIS 350 N -4.22 0.07 -2.62 3.45 1.44 -1.26 -4.12 115.22 107.97 3ht4 n HIS 350 Ca -0.00 0.02 -0.43 0.00 -2.01 0.00 0.00 57.72 55.30 3ht4 n HIS 350 Cb 0.20 -0.22 0.00 0.00 0.12 0.00 0.00 29.99 30.10 3ht4 n HIS 350 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 3ht4 n PHE 351 N -1.65 4.03 -2.42 -1.40 7.35 -1.18 -5.01 117.46 117.18 3ht4 n PHE 351 Ca 0.04 -3.07 -0.40 0.00 -0.76 0.00 0.00 57.45 53.25 3ht4 n PHE 351 Cb 0.37 -2.13 -0.04 0.00 0.35 0.00 0.00 39.48 38.03 3ht4 n PHE 351 CO 0.00 0.00 0.00 -0.08 -0.76 0.00 0.00 176.76 175.92 3ht4 s THR 352 N 1.27 3.39 0.04 -2.13 -1.32 -1.26 -4.98 115.64 110.65 3ht4 s THR 352 Ca 0.42 1.38 -0.26 0.00 -1.21 0.00 0.00 61.69 62.02 3ht4 s THR 352 Cb 0.04 -3.88 -0.05 0.00 -1.51 0.00 0.00 72.50 67.09 3ht4 s THR 352 CO 0.00 0.32 0.83 -2.16 -2.21 0.00 0.00 174.62 171.40 3ht4 s PRO 353 N -1.40 4.54 0.32 7.08 0.04 -1.26 -5.07 135.00 139.24 3ht4 s PRO 353 Ca 0.46 1.17 0.06 0.00 0.04 0.00 0.00 61.00 62.73 3ht4 s PRO 353 Cb -0.33 -3.38 -0.06 0.00 0.04 0.00 0.00 34.50 30.76 3ht4 s PRO 353 CO 0.42 0.21 -0.03 0.71 0.04 0.00 0.00 177.00 178.36 3ht4 s TYR 354 N 0.15 2.11 0.10 0.56 2.02 -1.26 -4.78 117.35 116.24 3ht4 s TYR 354 Ca 0.42 -0.72 -0.31 0.00 -0.37 0.00 0.00 57.07 56.09 3ht4 s TYR 354 Cb -0.21 -1.30 -0.10 0.00 -0.40 0.00 0.00 41.96 39.95 3ht4 s TYR 354 CO 0.25 0.29 1.86 0.00 -1.57 0.00 0.00 175.55 176.37 3ht4 s ALA 355 N -2.97 3.72 -0.08 3.71 0.00 -1.26 -4.71 121.76 120.17 3ht4 s ALA 355 Ca 0.32 1.41 0.01 0.00 0.00 0.00 0.00 51.96 53.70 3ht4 s ALA 355 Cb 0.06 -3.78 -0.03 0.00 0.00 0.00 0.00 23.12 19.37 3ht4 s ALA 355 CO 0.14 -1.30 -0.09 -0.80 0.00 0.00 0.00 175.76 173.71 3ht4 s ASN 356 N 3.11 4.48 0.15 0.00 -0.87 0.34 -4.94 114.94 117.20 3ht4 s ASN 356 Ca 0.82 -0.10 0.00 0.00 -1.57 0.00 0.00 52.86 52.01 3ht4 s ASN 356 Cb -0.45 -1.24 0.00 0.00 -0.02 0.00 0.00 41.25 39.54 3ht4 s ASN 356 CO 0.37 0.31 0.00 0.00 -2.57 0.00 0.00 177.10 175.22 3ht4 n TYR 357 N 2.55 -1.03 -5.25 2.20 9.36 -1.26 -1.22 117.16 122.52 3ht4 n TYR 357 Ca -0.18 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 60.74 3ht4 n TYR 357 Cb 0.53 0.00 -0.16 0.00 -0.63 0.00 0.00 39.34 39.08 3ht4 n TYR 357 CO 0.00 0.00 0.00 -2.14 0.22 0.00 0.00 176.86 174.94 3ht4 s PRO 359 N -0.45 2.06 0.00 2.98 0.02 -1.26 -4.87 135.00 133.48 3ht4 s PRO 359 Ca 0.00 -0.89 0.00 0.00 0.02 0.00 0.00 61.00 60.13 3ht4 s PRO 359 Cb 0.00 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.55 3ht4 s PRO 359 CO 0.00 0.52 0.00 0.41 -0.33 0.00 0.00 177.00 177.60 3ht4 n GLY 360 N 2.52 1.65 3.66 0.52 0.00 -1.26 -4.93 105.19 107.34 3ht4 n GLY 360 Ca -0.16 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 3ht4 n GLY 360 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ht4 s TYR 361 N -0.01 3.36 -1.20 1.61 2.02 -1.26 -4.92 117.35 116.96 3ht4 s TYR 361 Ca 0.00 1.05 0.00 0.00 -0.37 0.00 0.00 57.07 57.75 3ht4 s TYR 361 Cb 0.00 -2.91 0.00 0.00 -0.40 0.00 0.00 41.96 38.65 3ht4 s TYR 361 CO 0.00 -0.26 0.37 -1.91 -1.57 0.00 0.00 175.55 172.18 3ht4 n GLU 362 N 5.37 0.61 -4.42 -0.62 2.13 -1.26 -4.65 120.64 117.79 3ht4 n GLU 362 Ca 0.02 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.62 3ht4 n GLU 362 Cb 0.49 -1.24 -0.10 0.00 0.27 0.00 0.00 31.44 30.85 3ht4 n GLU 362 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3ht4 s ASP 363 N -0.59 2.92 0.26 4.31 1.01 -1.26 -5.15 116.67 118.17 3ht4 s ASP 363 Ca 0.00 -1.12 -0.13 0.00 0.71 0.00 0.00 52.55 52.01 3ht4 s ASP 363 Cb 0.00 -0.19 -0.08 0.00 1.01 0.00 0.00 42.92 43.66 3ht4 s ASP 363 CO 0.00 -0.23 0.63 -1.81 0.21 0.00 0.00 175.17 173.98 3ht4 s ASP 364 N -3.43 6.73 0.27 0.27 1.01 -1.26 -4.83 116.67 115.42 3ht4 s ASP 364 Ca 0.28 1.10 0.08 0.00 0.71 0.00 0.00 52.55 54.72 3ht4 s ASP 364 Cb 0.01 -2.30 -0.05 0.00 1.01 0.00 0.00 42.92 41.59 3ht4 s ASP 364 CO 0.11 -0.10 -0.10 0.68 0.21 0.00 0.00 175.17 175.98 3ht4 s VAL 365 N -1.83 1.80 0.03 -1.27 -7.23 -0.36 0.99 120.40 112.53 3ht4 s VAL 365 Ca 0.49 -2.18 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 3ht4 s VAL 365 Cb -0.11 -2.36 0.00 0.00 0.56 0.00 0.00 36.38 34.47 3ht4 s VAL 365 CO 0.19 -0.37 0.00 0.00 -0.31 0.00 0.00 175.10 174.62 3ht4 n ILE 366 N -0.56 0.00 0.00 -0.62 3.06 -0.96 -0.51 119.36 119.77 3ht4 n ILE 366 Ca -0.06 -0.13 0.00 0.00 -2.50 0.00 0.00 62.75 60.06 3ht4 n ILE 366 Cb 0.62 -0.02 0.00 0.00 0.54 0.00 0.00 39.64 40.79 3ht4 n ILE 366 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3ht4 n ALA 368 N -2.92 0.00 -3.14 1.51 0.00 0.19 -2.42 120.51 113.74 3ht4 n ALA 368 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.47 3ht4 n ALA 368 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.48 3ht4 n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ht4 s ALA 369 N 0.00 -2.98 -0.83 0.00 0.00 -1.26 -1.33 121.76 115.36 3ht4 s ALA 369 Ca 0.00 1.11 -0.06 0.00 0.00 0.00 0.00 51.96 53.01 3ht4 s ALA 369 Cb 0.00 -2.66 0.21 0.00 0.00 0.00 0.00 23.12 20.67 3ht4 s ALA 369 CO 0.00 -1.96 0.72 0.20 0.00 0.00 0.00 175.76 174.72 3ht4 s GLY 370 N 2.78 2.84 0.16 0.00 0.00 -1.26 -5.03 107.32 106.80 3ht4 s GLY 370 Ca 0.16 -3.56 0.11 0.00 0.00 0.00 0.00 44.72 41.43 3ht4 s GLY 370 CO -0.23 1.20 -0.24 -0.51 0.00 0.00 0.00 173.10 173.31 3ht4 s THR 371 N -0.64 2.38 0.39 0.90 -4.23 -1.26 -3.87 115.64 109.31 3ht4 s THR 371 Ca 0.23 -1.84 0.10 0.00 -1.18 0.00 0.00 61.69 59.00 3ht4 s THR 371 Cb -0.12 -2.10 0.16 0.00 1.34 0.00 0.00 72.50 71.78 3ht4 s THR 371 CO -0.08 0.00 1.92 -0.26 -0.54 0.00 0.00 174.62 175.66 3ht4 h PHE 372 N 3.56 0.20 -4.10 3.99 0.04 -1.94 -3.42 116.94 115.28 3ht4 h PHE 372 Ca -0.49 -0.02 -0.69 0.00 2.80 0.00 0.00 57.97 59.57 3ht4 h PHE 372 Cb 1.19 -0.06 -0.24 0.00 2.20 0.00 0.00 35.95 39.04 3ht4 h PHE 372 CO 0.64 0.34 -0.81 0.42 -0.60 0.00 0.00 178.31 178.30 3ht4 s ILE 373 N -4.68 2.77 -0.34 -0.55 -1.09 -1.26 -5.07 121.20 110.98 3ht4 s ILE 373 Ca -0.05 -1.01 -0.27 0.00 -2.23 0.00 0.00 60.65 57.09 3ht4 s ILE 373 Cb 0.15 -2.11 -0.06 0.00 -1.58 0.00 0.00 42.46 38.87 3ht4 s ILE 373 CO 0.73 0.47 2.31 -1.58 -1.23 0.00 0.00 174.94 175.64 3ht4 s GLN 374 N -1.05 2.67 0.00 2.79 0.74 -1.26 -2.77 119.66 120.78 3ht4 s GLN 374 Ca 0.13 1.76 0.00 0.00 0.05 0.00 0.00 55.36 57.30 3ht4 s GLN 374 Cb -0.10 -4.47 0.00 0.00 1.10 0.00 0.00 33.01 29.54 3ht4 s GLN 374 CO 0.03 -2.63 0.00 0.41 -0.55 0.00 0.00 175.29 172.54 3ht4 n GLY 375 N 5.88 0.51 3.56 2.59 0.00 -1.26 -4.97 105.19 111.50 3ht4 n GLY 375 Ca 0.33 -0.29 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3ht4 n GLY 375 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ht4 s ALA 376 N -2.00 1.88 -1.50 4.61 0.00 -1.11 -4.82 121.76 118.81 3ht4 s ALA 376 Ca 0.00 -1.19 0.03 0.00 0.00 0.00 0.00 51.96 50.80 3ht4 s ALA 376 Cb 0.00 -4.46 0.12 0.00 0.00 0.00 0.00 23.12 18.78 3ht4 s ALA 376 CO 0.00 -4.44 0.92 -1.13 0.00 0.00 0.00 175.76 171.10 3ht4 n SER 377 N 13.41 1.15 0.14 0.00 3.41 -1.16 -1.22 113.62 129.36 3ht4 n SER 377 Ca 0.32 -2.07 0.13 0.00 -0.26 0.00 0.00 58.87 56.99 3ht4 n SER 377 Cb 0.49 -0.28 0.37 0.00 -0.26 0.00 0.00 64.21 64.53 3ht4 n SER 377 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 3ht4 h ILE 378 N 0.68 0.00 -3.07 -1.33 6.09 -1.85 -3.40 117.51 114.63 3ht4 h ILE 378 Ca 0.00 -0.57 -0.54 0.00 -1.37 0.00 0.00 64.86 62.39 3ht4 h ILE 378 Cb 0.42 1.54 -0.02 0.00 0.47 0.00 0.00 36.82 39.23 3ht4 h ILE 378 CO 0.04 0.00 -0.24 -1.61 -3.07 0.00 0.00 178.15 173.26 3ht4 s GLU 379 N -3.17 3.60 -0.03 2.19 2.02 -0.35 -0.83 118.70 122.13 3ht4 s GLU 379 Ca 0.09 -0.13 -0.35 0.00 0.02 0.00 0.00 54.97 54.60 3ht4 s GLU 379 Cb 0.10 -2.76 -0.13 0.00 0.10 0.00 0.00 34.13 31.44 3ht4 s GLU 379 CO 0.59 0.34 1.72 -0.11 0.02 0.00 0.00 175.26 177.81 3ht4 n LEU 380 N -0.60 2.99 -3.69 1.80 7.94 -1.26 -4.21 117.00 119.98 3ht4 n LEU 380 Ca -0.03 1.04 -0.10 0.00 -1.11 0.00 0.00 56.01 55.81 3ht4 n LEU 380 Cb 0.53 -1.33 -0.10 0.00 0.53 0.00 0.00 43.42 43.05 3ht4 n LEU 380 CO 0.48 -0.29 0.07 -0.94 -1.11 0.00 0.00 177.39 175.60 3ht4 s SER 381 N 2.70 -0.51 0.09 1.96 1.04 -0.35 -4.23 113.70 114.41 3ht4 s SER 381 Ca 0.89 0.94 0.04 0.00 0.48 0.00 0.00 55.95 58.30 3ht4 s SER 381 Cb -0.77 0.87 -0.04 0.00 0.10 0.00 0.00 66.02 66.18 3ht4 s SER 381 CO 0.49 -0.20 0.03 0.00 0.98 0.00 0.00 173.24 174.54 3ht4 s ALA 382 N 1.56 3.38 0.00 5.32 0.00 -0.45 -2.58 121.76 128.99 3ht4 s ALA 382 Ca -0.09 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.78 3ht4 s ALA 382 Cb -0.09 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.77 3ht4 s ALA 382 CO -0.13 0.71 0.00 -0.40 0.00 0.00 0.00 175.76 175.93 3ht4 n ASP 383 N 0.49 0.00 0.00 0.00 5.75 -0.24 0.56 116.55 123.11 3ht4 n ASP 383 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.68 3ht4 n ASP 383 Cb 0.52 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.61 3ht4 n ASP 383 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ht4 n GLY 384 N -0.17 1.39 3.71 6.12 0.00 -1.01 0.75 105.19 115.97 3ht4 n GLY 384 Ca 0.00 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 3ht4 n GLY 384 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ht4 s PRO 385 N -2.00 4.39 -0.85 1.61 0.04 -1.26 -2.28 135.00 134.66 3ht4 s PRO 385 Ca 0.00 1.86 -0.25 0.00 0.04 0.00 0.00 61.00 62.65 3ht4 s PRO 385 Cb 0.00 -3.33 -0.02 0.00 0.04 0.00 0.00 34.50 31.19 3ht4 s PRO 385 CO 0.00 -0.32 1.78 0.42 0.04 0.00 0.00 177.00 178.92 3ht4 s ILE 386 N 1.14 3.54 -0.24 0.56 1.01 0.28 -4.64 121.20 122.85 3ht4 s ILE 386 Ca 0.60 -0.26 -0.29 0.00 0.00 0.00 0.00 60.65 60.70 3ht4 s ILE 386 Cb -0.32 -4.27 0.16 0.00 0.01 0.00 0.00 42.46 38.05 3ht4 s ILE 386 CO 0.29 -1.20 1.21 0.00 0.00 0.00 0.00 174.94 175.24 3ht4 s ARG 387 N 6.52 0.29 0.72 2.79 1.70 -1.26 -4.55 118.95 125.16 3ht4 s ARG 387 Ca 0.62 0.12 -0.16 0.00 -0.47 0.00 0.00 55.73 55.85 3ht4 s ARG 387 Cb -0.07 0.14 0.03 0.00 -0.57 0.00 0.00 34.95 34.48 3ht4 s ARG 387 CO 0.03 -0.08 1.23 -2.14 -1.08 0.00 0.00 175.30 173.27 3ht4 s PRO 388 N -0.79 2.16 -0.45 3.89 0.02 -1.26 -0.99 135.00 137.57 3ht4 s PRO 388 Ca 0.04 1.86 -0.03 0.00 0.02 0.00 0.00 61.00 62.89 3ht4 s PRO 388 Cb -0.02 -1.82 0.14 0.00 0.02 0.00 0.00 34.50 32.81 3ht4 s PRO 388 CO -0.05 -1.84 2.51 -0.35 -0.33 0.00 0.00 177.00 176.93 3ht4 n PRO 389 N -2.58 2.29 -3.13 5.54 -0.04 -1.26 -4.88 135.00 130.94 3ht4 n PRO 389 Ca 0.14 -2.27 -0.10 0.00 -0.04 0.00 0.00 63.50 61.23 3ht4 n PRO 389 Cb 0.50 -2.03 0.05 0.00 -0.04 0.00 0.00 33.50 31.98 3ht4 n PRO 389 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3ht4 n TYR 390 N 0.57 -2.51 -3.30 0.54 4.01 -0.16 -3.14 117.16 113.18 3ht4 n TYR 390 Ca 0.45 0.90 -0.40 0.00 -0.16 0.00 0.00 57.90 58.69 3ht4 n TYR 390 Cb 0.55 -4.05 -0.08 0.00 -0.31 0.00 0.00 39.34 35.44 3ht4 n TYR 390 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3ht4 s VAL 391 N -3.27 5.09 -0.19 -0.72 1.01 -1.26 -2.55 120.40 118.51 3ht4 s VAL 391 Ca 0.32 0.48 -0.01 0.00 0.00 0.00 0.00 61.98 62.77 3ht4 s VAL 391 Cb -0.04 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.49 3ht4 s VAL 391 CO 0.71 -0.04 -0.12 0.00 0.00 0.00 0.00 175.10 175.65 3ht4 s ALA 392 N 2.25 2.58 -0.10 5.51 0.00 -1.07 -4.27 121.76 126.66 3ht4 s ALA 392 Ca 0.17 -1.13 -0.30 0.00 0.00 0.00 0.00 51.96 50.70 3ht4 s ALA 392 Cb -0.16 -1.40 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 3ht4 s ALA 392 CO 0.11 -0.26 1.43 0.71 0.00 0.00 0.00 175.76 177.75 3ht4 s TYR 393 N 1.18 2.52 -0.40 0.00 1.51 0.23 -3.22 117.35 119.18 3ht4 s TYR 393 Ca 0.02 0.68 0.03 0.00 -1.01 0.00 0.00 57.07 56.78 3ht4 s TYR 393 Cb -0.14 -3.68 0.12 0.00 -0.11 0.00 0.00 41.96 38.14 3ht4 s TYR 393 CO -0.05 -2.61 0.15 0.08 -1.11 0.00 0.00 175.55 172.01 3ht4 s VAL 394 N 3.53 1.86 0.26 0.71 1.01 -1.01 -1.08 120.40 125.68 3ht4 s VAL 394 Ca 0.63 -2.43 0.01 0.00 0.00 0.00 0.00 61.98 60.19 3ht4 s VAL 394 Cb -0.27 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 3ht4 s VAL 394 CO 0.22 -0.73 0.22 0.00 0.00 0.00 0.00 175.10 174.81 3ht4 s GLN 395 N 0.64 1.46 0.00 2.72 -2.07 -1.07 -4.67 119.66 116.68 3ht4 s GLN 395 Ca 0.14 -1.75 0.00 0.00 -1.82 0.00 0.00 55.36 51.93 3ht4 s GLN 395 Cb -0.22 0.31 0.00 0.00 -1.09 0.00 0.00 33.01 32.02 3ht4 s GLN 395 CO -0.08 -0.52 0.00 0.41 -1.32 0.00 0.00 175.29 173.78 3ht4 n GLY 396 N -0.42 -0.29 0.00 2.60 0.00 -1.26 -1.21 105.19 104.61 3ht4 n GLY 396 Ca 0.04 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.33 3ht4 n GLY 396 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ht4 n GLY 397 N -0.21 2.08 0.13 -0.02 0.00 -0.01 -4.09 105.19 103.07 3ht4 n GLY 397 Ca 0.00 0.10 -0.07 0.00 0.00 0.00 0.00 46.02 46.06 3ht4 n GLY 397 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ht4 h LEU 398 N 0.00 0.20 -8.18 0.99 3.38 -1.86 -2.82 115.31 107.03 3ht4 h LEU 398 Ca 0.00 -0.15 -0.42 0.00 0.09 0.00 0.00 57.88 57.40 3ht4 h LEU 398 Cb 0.00 -0.06 -0.27 0.00 0.09 0.00 0.00 40.66 40.42 3ht4 h LEU 398 CO 0.00 0.92 -0.79 0.42 0.09 0.00 0.00 178.44 179.09 3ht4 s THR 399 N -3.32 0.90 0.29 0.22 -4.23 -1.26 -4.78 115.64 103.45 3ht4 s THR 399 Ca -0.03 -0.70 0.04 0.00 -1.18 0.00 0.00 61.69 59.83 3ht4 s THR 399 Cb 0.11 -0.80 0.28 0.00 1.34 0.00 0.00 72.50 73.43 3ht4 s THR 399 CO 0.81 0.10 1.76 0.22 -0.54 0.00 0.00 174.62 176.97 3ht4 h TYR 400 N 5.42 0.92 -0.95 3.99 3.20 -1.85 -1.01 116.97 126.69 3ht4 h TYR 400 Ca -0.34 0.04 0.12 0.00 3.14 0.00 0.00 58.73 61.69 3ht4 h TYR 400 Cb 1.18 -0.26 -0.09 0.00 1.54 0.00 0.00 36.73 39.10 3ht4 h TYR 400 CO 0.47 0.16 0.58 1.03 -1.64 0.00 0.00 178.16 178.76 3ht4 h SER 401 N 0.65 0.82 0.42 -2.11 0.87 -1.95 -0.50 113.55 111.75 3ht4 h SER 401 Ca 0.55 0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 61.15 3ht4 h SER 401 Cb 0.88 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.74 3ht4 h SER 401 CO -0.41 0.42 -0.20 -0.74 -0.53 0.00 0.00 176.83 175.37 3ht4 h HIS 402 N 0.89 -0.52 -0.97 2.24 -0.00 -1.60 0.11 115.15 115.30 3ht4 h HIS 402 Ca 0.48 -0.01 0.28 0.00 -0.00 0.00 0.00 60.37 61.12 3ht4 h HIS 402 Cb 0.52 0.17 -0.14 0.00 -0.00 0.00 0.00 27.41 27.97 3ht4 h HIS 402 CO -0.02 -0.32 0.51 0.28 -0.00 0.00 0.00 177.93 178.37 3ht4 h VAL 403 N -0.57 0.39 -0.13 5.26 2.07 -1.35 0.65 116.25 122.57 3ht4 h VAL 403 Ca -0.06 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 3ht4 h VAL 403 Cb 0.43 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 3ht4 h VAL 403 CO 0.09 0.07 -0.03 0.50 0.02 0.00 0.00 177.57 178.23 3ht4 h LYS 404 N 0.39 0.25 -0.39 1.57 3.11 -0.97 -2.34 116.57 118.19 3ht4 h LYS 404 Ca 0.66 -0.09 -0.09 0.00 -2.81 0.00 0.00 60.65 58.32 3ht4 h LYS 404 Cb 1.40 -0.02 -0.02 0.00 -1.00 0.00 0.00 32.23 32.60 3ht4 h LYS 404 CO -0.57 0.53 -0.14 0.82 -2.81 0.00 0.00 179.45 177.29 3ht4 h ILE 405 N -0.06 1.26 0.80 2.00 2.04 0.85 -2.58 117.51 121.81 3ht4 h ILE 405 Ca 0.03 -1.17 -0.04 0.00 1.00 0.00 0.00 64.86 64.68 3ht4 h ILE 405 Cb 0.44 1.11 0.01 0.00 -0.74 0.00 0.00 36.82 37.64 3ht4 h ILE 405 CO 0.01 0.39 -0.38 0.00 0.00 0.00 0.00 178.15 178.17 3ht4 h ALA 406 N 1.21 -1.20 0.00 1.87 0.00 0.34 -1.20 119.26 120.28 3ht4 h ALA 406 Ca 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3ht4 h ALA 406 Cb 0.60 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 3ht4 h ALA 406 CO 0.04 -1.13 -0.04 -0.84 0.00 0.00 0.00 179.25 177.29 3ht4 h ILE 407 N -1.14 0.08 -0.78 0.00 3.07 -1.51 0.16 117.51 117.38 3ht4 h ILE 407 Ca -0.11 -0.85 -0.02 0.00 1.55 0.00 0.00 64.86 65.43 3ht4 h ILE 407 Cb 0.82 1.80 -0.04 0.00 -0.27 0.00 0.00 36.82 39.13 3ht4 h ILE 407 CO 0.18 0.04 0.42 0.00 -1.05 0.00 0.00 178.15 177.74 3ht4 h SER 409 N 1.09 0.00 0.76 0.00 0.87 0.35 -2.48 113.55 114.14 3ht4 h SER 409 Ca 0.27 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.68 3ht4 h SER 409 Cb 0.05 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 3ht4 h SER 409 CO -0.04 0.37 -0.73 0.00 -0.53 0.00 0.00 176.83 175.89 3ht4 h ALA 410 N 1.63 0.77 0.16 6.23 0.00 -0.56 -2.61 119.26 124.89 3ht4 h ALA 410 Ca -0.00 -0.66 -0.32 0.00 0.00 0.00 0.00 54.91 53.92 3ht4 h ALA 410 Cb 1.02 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.70 3ht4 h ALA 410 CO 0.05 0.91 -1.56 0.82 0.00 0.00 0.00 179.25 179.47 3ht4 h ILE 411 N 0.00 1.14 -0.41 0.00 5.03 -1.40 -3.17 117.51 118.71 3ht4 h ILE 411 Ca -0.01 -2.72 0.09 0.00 -0.12 0.00 0.00 64.86 62.10 3ht4 h ILE 411 Cb 1.31 2.83 -0.09 0.00 -3.03 0.00 0.00 36.82 37.84 3ht4 h ILE 411 CO 0.09 0.83 -0.22 -0.78 -0.68 0.00 0.00 178.15 177.40 3ht4 h ASP 412 N 0.09 -0.76 -0.37 1.72 3.58 -1.44 0.14 116.42 119.37 3ht4 h ASP 412 Ca -0.27 0.16 -0.03 0.00 0.42 0.00 0.00 57.03 57.32 3ht4 h ASP 412 Cb 2.06 0.40 -0.02 0.00 1.72 0.00 0.00 39.33 43.50 3ht4 h ASP 412 CO 0.19 -0.25 0.11 -0.33 -2.88 0.00 0.00 179.24 176.08 3ht4 h GLU 413 N -0.15 0.59 -0.02 0.28 5.08 -1.56 -3.21 114.58 115.59 3ht4 h GLU 413 Ca 0.20 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3ht4 h GLU 413 Cb 0.46 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3ht4 h GLU 413 CO -0.50 0.61 -0.19 1.47 -1.00 0.00 0.00 179.01 179.40 3ht4 n LEU 414 N -4.61 2.62 -0.04 1.33 -0.00 -1.12 -5.11 117.00 110.07 3ht4 n LEU 414 Ca -0.01 -0.91 0.16 0.00 -0.00 0.00 0.00 56.01 55.25 3ht4 n LEU 414 Cb 0.19 0.00 0.91 0.00 -0.00 0.00 0.00 43.42 44.52 3ht4 n LEU 414 CO 0.38 0.45 1.09 0.00 -0.00 0.00 0.00 177.39 179.31