#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hq2 h THR 5 N 0.00 1.23 -0.46 3.57 2.02 -2.06 -2.99 112.91 114.21 3hq2 h THR 5 Ca 0.00 -1.03 0.11 0.00 0.77 0.00 0.00 66.41 66.26 3hq2 h THR 5 Cb 0.00 1.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 3hq2 h THR 5 CO 0.00 0.25 0.32 1.88 0.37 0.00 0.00 175.52 178.35 3hq2 h TYR 6 N -0.54 0.15 0.45 3.16 -1.99 -1.99 -1.39 116.97 114.82 3hq2 h TYR 6 Ca -0.01 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.70 3hq2 h TYR 6 Cb 0.47 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.16 3hq2 h TYR 6 CO 0.08 0.07 -0.22 1.49 -0.00 0.00 0.00 178.16 179.58 3hq2 h GLU 7 N 0.14 -0.58 -0.86 4.88 4.81 -1.94 -1.79 114.58 119.24 3hq2 h GLU 7 Ca 0.22 0.04 0.12 0.00 -0.13 0.00 0.00 59.36 59.61 3hq2 h GLU 7 Cb 0.68 0.13 -0.06 0.00 0.63 0.00 0.00 28.75 30.13 3hq2 h GLU 7 CO -0.03 -0.28 0.56 -0.22 -0.73 0.00 0.00 179.01 178.31 3hq2 h LYS 8 N -0.90 0.73 0.00 1.92 1.63 -1.26 0.33 116.57 119.02 3hq2 h LYS 8 Ca -0.06 -0.04 -0.07 0.00 -0.85 0.00 0.00 60.65 59.62 3hq2 h LYS 8 Cb 0.57 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 32.03 3hq2 h LYS 8 CO 0.10 0.48 -0.34 1.49 -3.45 0.00 0.00 179.45 177.73 3hq2 h GLU 9 N 0.75 0.00 0.32 1.90 4.81 -1.16 0.40 114.58 121.60 3hq2 h GLU 9 Ca 0.42 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.63 3hq2 h GLU 9 Cb 0.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.95 3hq2 h GLU 9 CO -0.18 0.34 -0.15 0.35 -0.73 0.00 0.00 179.01 178.64 3hq2 h PHE 10 N 0.00 -0.40 -0.22 0.92 3.57 0.47 -2.98 116.94 118.31 3hq2 h PHE 10 Ca -0.00 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.50 3hq2 h PHE 10 Cb 0.64 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.50 3hq2 h PHE 10 CO 0.00 -0.15 0.14 0.74 -2.23 0.00 0.00 178.31 176.82 3hq2 h PHE 11 N -1.06 0.25 -0.37 0.41 0.05 -0.98 -1.66 116.94 113.59 3hq2 h PHE 11 Ca -0.04 0.01 0.03 0.00 3.82 0.00 0.00 57.97 61.78 3hq2 h PHE 11 Cb 0.43 -0.08 -0.03 0.00 2.00 0.00 0.00 35.95 38.26 3hq2 h PHE 11 CO 0.02 0.15 0.19 -0.44 -0.18 0.00 0.00 178.31 178.05 3hq2 h ASP 12 N 0.27 0.28 -0.57 2.17 5.19 -0.97 0.21 116.42 122.99 3hq2 h ASP 12 Ca 0.08 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.51 3hq2 h ASP 12 Cb 0.01 -0.04 -0.03 0.00 0.18 0.00 0.00 39.33 39.45 3hq2 h ASP 12 CO -0.02 0.20 0.35 -0.07 -3.12 0.00 0.00 179.24 176.59 3hq2 h LEU 13 N 0.38 0.68 -0.20 1.55 3.38 -1.15 -1.41 115.31 118.54 3hq2 h LEU 13 Ca 0.15 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3hq2 h LEU 13 Cb 0.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3hq2 h LEU 13 CO -0.10 0.53 0.10 -0.07 0.09 0.00 0.00 178.44 178.99 3hq2 h LEU 14 N 0.78 0.26 -2.65 1.67 3.38 -1.00 -0.21 115.31 117.53 3hq2 h LEU 14 Ca 0.21 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3hq2 h LEU 14 Cb -0.03 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 3hq2 h LEU 14 CO -0.04 0.29 0.01 0.50 0.09 0.00 0.00 178.44 179.29 3hq2 h LYS 15 N 0.21 0.00 0.04 1.13 3.64 -0.72 0.56 116.57 121.43 3hq2 h LYS 15 Ca 0.07 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.18 3hq2 h LYS 15 Cb 0.09 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 31.94 3hq2 h LYS 15 CO -0.01 0.00 -1.10 -0.09 -2.27 0.00 0.00 179.45 175.98 3hq2 h ARG 16 N 0.00 0.66 -0.48 1.90 2.43 -0.12 -2.72 114.38 116.06 3hq2 h ARG 16 Ca 0.00 -0.76 -0.07 0.00 -0.81 0.00 0.00 59.98 58.34 3hq2 h ARG 16 Cb 0.02 0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 3hq2 h ARG 16 CO -0.00 1.33 0.03 0.82 -1.51 0.00 0.00 179.97 180.64 3hq2 h ILE 17 N 0.35 1.26 -0.82 1.20 2.04 0.11 -2.71 117.51 118.95 3hq2 h ILE 17 Ca -0.14 -1.01 0.17 0.00 1.00 0.00 0.00 64.86 64.87 3hq2 h ILE 17 Cb 1.76 0.97 -0.11 0.00 -0.74 0.00 0.00 36.82 38.70 3hq2 h ILE 17 CO 0.21 0.36 0.33 -1.28 0.00 0.00 0.00 178.15 177.77 3hq2 h SER 18 N 0.69 0.29 0.01 1.72 0.87 0.03 0.36 113.55 117.53 3hq2 h SER 18 Ca 0.14 0.13 -0.17 0.00 -1.23 0.00 0.00 61.79 60.66 3hq2 h SER 18 Cb 0.47 0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 62.53 3hq2 h SER 18 CO 0.02 0.07 -0.59 0.45 -0.53 0.00 0.00 176.83 176.25 3hq2 h HIS 19 N 0.43 0.74 -0.46 2.24 3.86 -1.23 -2.53 115.15 118.21 3hq2 h HIS 19 Ca 0.47 -0.28 -0.06 0.00 -1.16 0.00 0.00 60.37 59.35 3hq2 h HIS 19 Cb 0.79 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 29.11 3hq2 h HIS 19 CO -0.16 1.03 0.03 1.88 0.86 0.00 0.00 177.93 181.57 3hq2 h TYR 20 N 0.44 0.77 -0.53 2.45 0.99 -0.85 -2.62 116.97 117.62 3hq2 h TYR 20 Ca 0.00 -0.09 0.02 0.00 2.00 0.00 0.00 58.73 60.66 3hq2 h TYR 20 Cb 1.15 -0.22 -0.03 0.00 1.00 0.00 0.00 36.73 38.63 3hq2 h TYR 20 CO 0.05 0.70 0.33 0.77 -0.00 0.00 0.00 178.16 180.01 3hq2 h SER 21 N 0.69 0.55 0.02 3.88 0.02 -0.73 0.16 113.55 118.15 3hq2 h SER 21 Ca 0.14 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3hq2 h SER 21 Cb 0.38 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.79 3hq2 h SER 21 CO 0.01 0.39 -0.03 -0.08 -1.14 0.00 0.00 176.83 175.98 3hq2 h GLU 22 N 0.66 -0.06 -0.68 3.45 4.81 -1.12 0.49 114.58 122.13 3hq2 h GLU 22 Ca 0.21 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.52 3hq2 h GLU 22 Cb -0.02 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.31 3hq2 h GLU 22 CO -0.07 -0.04 0.34 0.00 -0.73 0.00 0.00 179.01 178.51 3hq2 h ALA 23 N 0.91 0.92 0.15 2.92 0.00 -1.12 0.17 119.26 123.22 3hq2 h ALA 23 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3hq2 h ALA 23 Cb 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3hq2 h ALA 23 CO -0.01 -0.04 -0.07 0.28 0.00 0.00 0.00 179.25 179.40 3hq2 h VAL 24 N 0.60 0.93 -0.57 0.00 2.07 0.14 -1.89 116.25 117.53 3hq2 h VAL 24 Ca 0.33 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 3hq2 h VAL 24 Cb 0.31 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 3hq2 h VAL 24 CO -0.24 0.09 0.31 0.00 0.02 0.00 0.00 177.57 177.74 3hq2 h ALA 25 N 0.44 1.46 -0.13 1.67 0.00 0.37 -1.49 119.26 121.58 3hq2 h ALA 25 Ca -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3hq2 h ALA 25 Cb 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3hq2 h ALA 25 CO 0.03 0.44 0.04 1.25 0.00 0.00 0.00 179.25 181.01 3hq2 h LEU 26 N 0.80 0.19 -0.84 0.00 5.85 -0.55 0.30 115.31 121.07 3hq2 h LEU 26 Ca 0.20 -0.22 0.08 0.00 0.84 0.00 0.00 57.88 58.79 3hq2 h LEU 26 Cb 0.03 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 40.94 3hq2 h LEU 26 CO -0.03 0.36 0.50 0.24 -0.34 0.00 0.00 178.44 179.16 3hq2 h MET 27 N 0.02 0.83 -0.10 1.25 2.86 -0.91 1.10 114.93 119.98 3hq2 h MET 27 Ca 0.04 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 3hq2 h MET 27 Cb 0.24 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.70 3hq2 h MET 27 CO -0.00 0.55 0.03 1.25 1.06 0.00 0.00 176.91 179.80 3hq2 h HIS 28 N 0.86 0.17 -0.56 -0.22 -0.00 -1.03 -0.17 115.15 114.20 3hq2 h HIS 28 Ca 0.39 -0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.74 3hq2 h HIS 28 Cb 0.30 -0.05 -0.03 0.00 -0.00 0.00 0.00 27.41 27.63 3hq2 h HIS 28 CO -0.05 0.33 0.35 2.35 -0.00 0.00 0.00 177.93 180.92 3hq2 h TRP 29 N -0.03 0.72 -0.56 5.26 7.01 -0.01 -1.92 115.95 126.42 3hq2 h TRP 29 Ca 0.03 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.02 3hq2 h TRP 29 Cb 0.24 -0.24 -0.03 0.00 -2.10 0.00 0.00 29.16 27.04 3hq2 h TRP 29 CO 0.00 0.48 0.26 0.22 -2.79 0.00 0.00 178.44 176.61 3hq2 h ASP 30 N 0.76 0.71 0.83 2.65 1.82 0.14 -1.58 116.42 121.74 3hq2 h ASP 30 Ca 0.20 -0.07 -0.02 0.00 -0.39 0.00 0.00 57.03 56.75 3hq2 h ASP 30 Cb -0.05 -0.18 -0.00 0.00 0.68 0.00 0.00 39.33 39.78 3hq2 h ASP 30 CO -0.04 0.61 -0.08 0.28 -1.61 0.00 0.00 179.24 178.40 3hq2 h SER 31 N 0.78 0.00 -0.32 2.28 0.02 -0.27 -2.03 113.55 114.01 3hq2 h SER 31 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 3hq2 h SER 31 Cb 0.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.64 3hq2 h SER 31 CO -0.02 0.08 0.00 0.54 -1.14 0.00 0.00 176.83 176.29 3hq2 n ARG 32 N -3.26 2.39 -0.82 3.45 5.12 -0.64 -4.42 116.66 118.48 3hq2 n ARG 32 Ca -0.00 -2.09 0.04 0.00 -1.93 0.00 0.00 57.85 53.87 3hq2 n ARG 32 Cb 0.32 -1.49 0.07 0.00 -1.16 0.00 0.00 32.46 30.19 3hq2 n ARG 32 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 3hq2 n THR 33 N 1.32 0.71 0.00 0.55 -2.24 -0.95 -4.65 114.28 109.02 3hq2 n THR 33 Ca 0.18 -1.34 0.00 0.00 -2.27 0.00 0.00 64.05 60.63 3hq2 n THR 33 Cb 0.57 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 3hq2 n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hq2 n GLY 34 N -0.25 0.85 3.63 3.38 0.00 -1.20 -5.02 105.19 106.57 3hq2 n GLY 34 Ca 0.08 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.58 3hq2 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hq2 n ALA 35 N 0.00 -0.49 -1.74 4.61 0.00 -0.80 -4.84 120.51 117.25 3hq2 n ALA 35 Ca 0.00 0.47 -0.42 0.00 0.00 0.00 0.00 53.44 53.49 3hq2 n ALA 35 Cb 0.00 -2.15 -0.01 0.00 0.00 0.00 0.00 19.45 17.28 3hq2 n ALA 35 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3hq2 n PRO 36 N 3.45 2.61 0.11 0.00 -0.02 -1.26 -4.93 135.00 134.96 3hq2 n PRO 36 Ca 0.20 0.93 0.03 0.00 -2.02 0.00 0.00 63.50 62.64 3hq2 n PRO 36 Cb 0.19 -2.68 0.42 0.00 -0.02 0.00 0.00 33.50 31.41 3hq2 n PRO 36 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3hq2 h LYS 37 N 4.29 0.27 -0.04 -0.52 2.10 -2.01 -2.37 116.57 118.30 3hq2 h LYS 37 Ca -0.47 -0.05 0.01 0.00 -2.00 0.00 0.00 60.65 58.14 3hq2 h LYS 37 Cb 1.24 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 32.52 3hq2 h LYS 37 CO 0.75 0.34 0.03 -0.91 -2.00 0.00 0.00 179.45 177.66 3hq2 h ASN 38 N 0.26 0.00 0.25 7.07 4.21 -2.02 -0.85 115.58 124.51 3hq2 h ASN 38 Ca 0.06 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.57 3hq2 h ASN 38 Cb 0.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.46 3hq2 h ASN 38 CO 0.01 0.00 -0.11 0.61 -1.29 0.00 0.00 177.43 176.65 3hq2 n GLY 39 N -1.50 -0.74 0.31 2.83 0.00 -0.89 -4.43 105.19 100.78 3hq2 n GLY 39 Ca -0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 46.02 45.66 3hq2 n GLY 39 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3hq2 h SER 40 N 0.91 -0.95 -0.32 1.61 0.87 -1.19 0.59 113.55 115.08 3hq2 h SER 40 Ca 0.00 0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 3hq2 h SER 40 Cb 0.38 0.53 -0.02 0.00 -0.44 0.00 0.00 62.40 62.85 3hq2 h SER 40 CO 0.00 -0.27 0.19 -0.08 -0.53 0.00 0.00 176.83 176.14 3hq2 h GLU 41 N -0.08 0.43 0.00 2.24 4.81 -1.80 -0.31 114.58 119.87 3hq2 h GLU 41 Ca 0.29 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.36 3hq2 h GLU 41 Cb 0.54 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 3hq2 h GLU 41 CO -0.73 0.33 -0.58 -0.44 -0.73 0.00 0.00 179.01 176.86 3hq2 h ASP 42 N 0.41 0.00 -0.56 1.04 3.32 -1.80 -2.27 116.42 116.55 3hq2 h ASP 42 Ca 0.11 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 3hq2 h ASP 42 Cb 0.01 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 3hq2 h ASP 42 CO -0.02 0.58 -0.02 -0.09 -1.72 0.00 0.00 179.24 177.97 3hq2 h ARG 43 N 0.00 1.00 -0.17 3.56 9.65 -0.51 -1.21 114.38 126.71 3hq2 h ARG 43 Ca -0.01 -0.33 -0.10 0.00 -1.10 0.00 0.00 59.98 58.45 3hq2 h ARG 43 Cb 1.11 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.59 3hq2 h ARG 43 CO 0.08 1.01 -0.32 0.00 2.80 0.00 0.00 179.97 183.53 3hq2 h ALA 44 N 0.96 1.13 -0.19 2.80 0.00 -0.90 -2.08 119.26 120.98 3hq2 h ALA 44 Ca 0.16 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3hq2 h ALA 44 Cb 0.57 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3hq2 h ALA 44 CO 0.03 0.56 0.01 0.93 0.00 0.00 0.00 179.25 180.78 3hq2 h GLU 45 N 0.30 0.32 -0.62 0.00 4.39 -1.04 -2.14 114.58 115.80 3hq2 h GLU 45 Ca 0.04 -0.10 -0.10 0.00 0.34 0.00 0.00 59.36 59.55 3hq2 h GLU 45 Cb 0.72 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.32 3hq2 h GLU 45 CO 0.06 0.51 0.01 0.77 -1.16 0.00 0.00 179.01 179.20 3hq2 h SER 46 N 0.09 1.06 -0.48 1.42 0.02 -1.11 -0.16 113.55 114.38 3hq2 h SER 46 Ca 0.05 -0.30 -0.05 0.00 -0.84 0.00 0.00 61.79 60.66 3hq2 h SER 46 Cb 0.35 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.59 3hq2 h SER 46 CO 0.01 1.10 0.15 0.40 -1.14 0.00 0.00 176.83 177.34 3hq2 h ILE 47 N 0.98 1.22 -0.30 3.27 2.04 -1.39 -1.04 117.51 122.30 3hq2 h ILE 47 Ca 0.18 -0.77 -0.13 0.00 1.00 0.00 0.00 64.86 65.13 3hq2 h ILE 47 Cb 0.55 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 3hq2 h ILE 47 CO 0.03 0.29 -0.35 1.23 0.00 0.00 0.00 178.15 179.35 3hq2 h GLY 48 N 0.96 0.72 0.66 5.37 0.00 -0.85 -1.74 103.07 108.19 3hq2 h GLY 48 Ca 0.18 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 3hq2 h GLY 48 CO -0.00 0.62 -0.14 -1.61 0.00 0.00 0.00 176.54 175.41 3hq2 h GLN 49 N 0.56 -0.38 0.00 4.80 4.15 -0.49 -1.59 115.11 122.16 3hq2 h GLN 49 Ca 0.06 0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.49 3hq2 h GLN 49 Cb 0.86 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.64 3hq2 h GLN 49 CO 0.07 -0.06 -0.07 -0.07 -1.93 0.00 0.00 178.83 176.78 3hq2 h LEU 50 N -0.73 0.00 0.08 -2.39 4.07 -1.24 -0.40 115.31 114.69 3hq2 h LEU 50 Ca -0.04 0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.73 3hq2 h LEU 50 Cb 0.49 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.25 3hq2 h LEU 50 CO 0.07 0.07 -0.77 0.28 -1.08 0.00 0.00 178.44 177.00 3hq2 h SER 51 N 0.00 0.55 0.52 -0.43 0.02 -1.24 -2.89 113.55 110.07 3hq2 h SER 51 Ca -0.00 -0.85 -0.04 0.00 -0.84 0.00 0.00 61.79 60.06 3hq2 h SER 51 Cb 0.29 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 3hq2 h SER 51 CO 0.01 1.34 -0.19 0.74 -1.14 0.00 0.00 176.83 177.59 3hq2 h THR 52 N -0.17 0.67 0.08 -2.27 2.02 -0.78 -0.28 112.91 112.17 3hq2 h THR 52 Ca -0.12 -0.81 -0.00 0.00 0.77 0.00 0.00 66.41 66.25 3hq2 h THR 52 Cb 1.53 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 69.45 3hq2 h THR 52 CO 0.15 0.18 -0.04 0.44 0.37 0.00 0.00 175.52 176.62 3hq2 h ASP 53 N 0.00 -0.09 -0.38 4.18 5.19 -1.07 0.40 116.42 124.64 3hq2 h ASP 53 Ca -0.00 -0.20 0.05 0.00 -0.62 0.00 0.00 57.03 56.26 3hq2 h ASP 53 Cb 0.50 0.02 -0.05 0.00 0.18 0.00 0.00 39.33 39.98 3hq2 h ASP 53 CO 0.02 0.14 0.11 0.40 -3.12 0.00 0.00 179.24 176.80 3hq2 h ILE 54 N -0.34 0.85 -0.48 0.35 2.04 -1.16 -0.80 117.51 117.98 3hq2 h ILE 54 Ca -0.01 -0.09 0.09 0.00 1.00 0.00 0.00 64.86 65.85 3hq2 h ILE 54 Cb 0.29 0.58 -0.07 0.00 -0.74 0.00 0.00 36.82 36.87 3hq2 h ILE 54 CO 0.02 0.05 0.05 0.15 0.00 0.00 0.00 178.15 178.41 3hq2 h PHE 55 N 0.25 0.06 -0.41 1.37 3.57 -0.71 -2.02 116.94 119.04 3hq2 h PHE 55 Ca 0.18 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 3hq2 h PHE 55 Cb 0.18 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 3hq2 h PHE 55 CO -0.17 -0.06 0.16 -0.91 -2.23 0.00 0.00 178.31 175.10 3hq2 h ASN 56 N 0.17 0.58 0.26 0.41 -0.26 0.60 -0.48 115.58 116.86 3hq2 h ASN 56 Ca 0.24 -0.18 0.00 0.00 -0.56 0.00 0.00 56.30 55.80 3hq2 h ASN 56 Cb 0.34 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.45 3hq2 h ASN 56 CO -0.36 0.60 0.00 0.40 -1.06 0.00 0.00 177.43 177.01 3hq2 h ILE 57 N 0.52 0.00 0.00 2.81 2.04 -0.67 0.37 117.51 122.59 3hq2 h ILE 57 Ca 0.14 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.87 3hq2 h ILE 57 Cb 0.21 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 3hq2 h ILE 57 CO -0.01 0.00 -1.56 0.00 0.00 0.00 0.00 178.15 176.58 3hq2 n GLN 58 N -3.04 0.61 0.00 2.37 6.02 -0.81 -4.23 117.38 118.30 3hq2 n GLN 58 Ca -0.02 -0.07 0.07 0.00 -0.01 0.00 0.00 57.00 56.98 3hq2 n GLN 58 Cb 0.13 -1.64 0.01 0.00 1.02 0.00 0.00 30.24 29.76 3hq2 n GLN 58 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 3hq2 n THR 59 N -2.38 0.00 -1.77 5.09 -1.04 -0.25 -4.39 114.28 109.54 3hq2 n THR 59 Ca -0.02 -0.39 -0.39 0.00 -2.04 0.00 0.00 64.05 61.21 3hq2 n THR 59 Cb 0.55 1.20 0.03 0.00 -1.82 0.00 0.00 70.33 70.30 3hq2 n THR 59 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3hq2 s SER 60 N -1.60 5.49 0.30 8.00 1.04 0.12 -4.90 113.70 122.16 3hq2 s SER 60 Ca 0.13 2.85 -0.01 0.00 0.48 0.00 0.00 55.95 59.41 3hq2 s SER 60 Cb 0.12 -2.64 0.49 0.00 0.10 0.00 0.00 66.02 64.08 3hq2 s SER 60 CO 0.31 -1.43 1.94 0.44 0.98 0.00 0.00 173.24 175.49 3hq2 h ASP 61 N 1.81 0.92 -0.25 7.02 3.32 -1.95 -2.18 116.42 125.12 3hq2 h ASP 61 Ca -0.51 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.53 3hq2 h ASP 61 Cb 1.29 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.61 3hq2 h ASP 61 CO 0.59 0.64 0.16 -0.09 -1.72 0.00 0.00 179.24 178.82 3hq2 h ARG 62 N 1.07 0.32 -0.44 3.56 9.65 -1.96 0.13 114.38 126.72 3hq2 h ARG 62 Ca 0.34 -0.02 0.07 0.00 -1.10 0.00 0.00 59.98 59.28 3hq2 h ARG 62 Cb 0.02 -0.07 -0.06 0.00 -1.39 0.00 0.00 29.97 28.47 3hq2 h ARG 62 CO -0.10 0.22 0.06 1.98 2.80 0.00 0.00 179.97 184.93 3hq2 h MET 63 N 0.33 0.18 -0.96 0.20 4.05 -1.68 0.11 114.93 117.16 3hq2 h MET 63 Ca 0.09 -0.01 0.05 0.00 -0.28 0.00 0.00 59.70 59.55 3hq2 h MET 63 Cb -0.03 -0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 30.67 3hq2 h MET 63 CO -0.02 0.12 0.62 -0.22 0.23 0.00 0.00 176.91 177.64 3hq2 h LYS 64 N 0.18 1.12 -0.33 0.39 1.63 -0.89 -0.28 116.57 118.40 3hq2 h LYS 64 Ca 0.22 -0.07 -0.08 0.00 -0.85 0.00 0.00 60.65 59.87 3hq2 h LYS 64 Cb 0.29 -0.25 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 3hq2 h LYS 64 CO -0.31 0.74 -0.10 0.93 -3.45 0.00 0.00 179.45 177.26 3hq2 h GLU 65 N 1.16 0.65 -0.78 1.90 5.08 0.57 -2.04 114.58 121.12 3hq2 h GLU 65 Ca 0.40 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 3hq2 h GLU 65 Cb 0.09 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 3hq2 h GLU 65 CO -0.14 0.84 0.40 -0.07 -1.00 0.00 0.00 179.01 179.04 3hq2 h LEU 66 N 0.42 0.98 0.35 1.33 3.38 -0.23 -1.46 115.31 120.09 3hq2 h LEU 66 Ca 0.08 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3hq2 h LEU 66 Cb 0.61 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3hq2 h LEU 66 CO 0.04 0.81 -0.18 0.40 0.09 0.00 0.00 178.44 179.59 3hq2 h ILE 67 N 1.09 0.00 -0.94 1.22 1.08 -0.90 -2.13 117.51 116.93 3hq2 h ILE 67 Ca 0.27 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.83 3hq2 h ILE 67 Cb 0.06 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 33.69 3hq2 h ILE 67 CO -0.04 0.00 -0.53 0.47 -0.69 0.00 0.00 178.15 177.36 3hq2 n ASP 68 N -3.37 -0.94 -0.06 1.72 10.43 -0.78 -0.99 116.55 122.56 3hq2 n ASP 68 Ca -0.06 1.66 -0.08 0.00 2.57 0.00 0.00 54.79 58.88 3hq2 n ASP 68 Cb 0.20 -0.24 -0.02 0.00 1.84 0.00 0.00 41.12 42.90 3hq2 n ASP 68 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 3hq2 h VAL 69 N 0.00 0.32 0.00 2.53 2.07 -1.29 -1.17 116.25 118.71 3hq2 h VAL 69 Ca 0.17 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.69 3hq2 h VAL 69 Cb 0.41 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 3hq2 h VAL 69 CO -0.89 0.00 -0.01 -0.07 0.02 0.00 0.00 177.57 176.62 3hq2 h LEU 70 N -0.28 0.00 0.02 2.57 3.38 -0.36 -2.56 115.31 118.08 3hq2 h LEU 70 Ca 0.14 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.84 3hq2 h LEU 70 Cb 0.50 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.27 3hq2 h LEU 70 CO -0.43 0.01 -1.12 1.88 0.09 0.00 0.00 178.44 178.87 3hq2 h TYR 71 N 0.00 0.96 -0.15 1.13 -1.99 0.20 -2.38 116.97 114.74 3hq2 h TYR 71 Ca -0.00 -0.56 -0.07 0.00 2.00 0.00 0.00 58.73 60.10 3hq2 h TYR 71 Cb 0.18 -0.09 -0.01 0.00 2.00 0.00 0.00 36.73 38.81 3hq2 h TYR 71 CO 0.00 1.40 -0.23 0.93 -0.00 0.00 0.00 178.16 180.26 3hq2 h GLU 72 N 0.32 0.26 -0.59 4.88 5.08 -1.14 -1.55 114.58 121.84 3hq2 h GLU 72 Ca -0.15 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 3hq2 h GLU 72 Cb 1.78 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.00 3hq2 h GLU 72 CO 0.21 0.48 0.00 -2.13 -1.00 0.00 0.00 179.01 176.58 3hq2 n ARG 73 N -4.18 2.73 -0.29 2.33 3.00 -1.14 -4.64 116.66 114.46 3hq2 n ARG 73 Ca -0.01 -2.10 0.17 0.00 -0.00 0.00 0.00 57.85 55.91 3hq2 n ARG 73 Cb 0.35 -1.61 0.33 0.00 0.00 0.00 0.00 32.46 31.53 3hq2 n ARG 73 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 3hq2 n PHE 74 N 0.95 0.69 -0.05 -0.14 7.35 -0.58 -1.01 117.46 124.66 3hq2 n PHE 74 Ca 0.19 1.04 -0.03 0.00 -0.76 0.00 0.00 57.45 57.89 3hq2 n PHE 74 Cb 0.60 -1.23 0.20 0.00 0.35 0.00 0.00 39.48 39.39 3hq2 n PHE 74 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 3hq2 h ASP 75 N 0.00 0.63 0.00 -2.13 3.32 -1.84 -2.72 116.42 113.68 3hq2 h ASP 75 Ca 0.59 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.47 3hq2 h ASP 75 Cb 1.34 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.72 3hq2 h ASP 75 CO -0.77 0.75 0.00 0.47 -1.72 0.00 0.00 179.24 177.97 3hq2 n ASP 76 N -4.20 0.00 -4.95 6.45 8.00 -0.18 -4.83 116.55 116.84 3hq2 n ASP 76 Ca 0.01 -0.85 -0.25 0.00 0.71 0.00 0.00 54.79 54.42 3hq2 n ASP 76 Cb 0.32 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.39 3hq2 n ASP 76 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3hq2 s LEU 77 N -1.99 4.28 0.77 0.64 1.43 -1.03 -5.11 118.68 117.67 3hq2 s LEU 77 Ca 0.40 0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 53.60 3hq2 s LEU 77 Cb 0.18 -2.99 0.06 0.00 0.03 0.00 0.00 46.19 43.48 3hq2 s LEU 77 CO 0.31 -0.03 1.14 -0.94 0.23 0.00 0.00 176.35 177.06 3hq2 s SER 78 N -3.48 4.79 0.10 2.29 1.04 -1.26 -4.87 113.70 112.31 3hq2 s SER 78 Ca 0.36 0.86 -0.33 0.00 0.48 0.00 0.00 55.95 57.31 3hq2 s SER 78 Cb -0.10 -1.45 -0.13 0.00 0.10 0.00 0.00 66.02 64.44 3hq2 s SER 78 CO 0.29 -1.73 1.58 -0.33 0.98 0.00 0.00 173.24 174.03 3hq2 h GLU 79 N -0.91 -0.73 -0.84 4.02 4.39 -1.99 -1.79 114.58 116.74 3hq2 h GLU 79 Ca -0.46 0.05 0.14 0.00 0.34 0.00 0.00 59.36 59.43 3hq2 h GLU 79 Cb 1.31 0.17 -0.09 0.00 -0.10 0.00 0.00 28.75 30.03 3hq2 h GLU 79 CO 0.65 -0.48 0.44 -0.44 -1.16 0.00 0.00 179.01 178.01 3hq2 h ASP 80 N -0.75 0.55 -0.80 1.42 3.32 -1.99 -0.65 116.42 117.53 3hq2 h ASP 80 Ca -0.00 0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.08 3hq2 h ASP 80 Cb 0.74 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.25 3hq2 h ASP 80 CO -0.21 0.25 0.31 0.74 -1.72 0.00 0.00 179.24 178.61 3hq2 h THR 81 N 0.65 1.26 0.35 0.35 2.02 -1.88 0.25 112.91 115.92 3hq2 h THR 81 Ca 0.45 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.77 3hq2 h THR 81 Cb 0.59 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 3hq2 h THR 81 CO -0.34 0.34 -0.17 0.11 0.37 0.00 0.00 175.52 175.83 3hq2 h LYS 82 N 1.16 -0.45 -0.83 6.66 1.57 -0.31 -1.07 116.57 123.29 3hq2 h LYS 82 Ca 0.26 0.03 0.01 0.00 -1.87 0.00 0.00 60.65 59.09 3hq2 h LYS 82 Cb 0.23 0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.60 3hq2 h LYS 82 CO -0.02 -0.23 0.55 0.87 -0.57 0.00 0.00 179.45 180.05 3hq2 h LYS 83 N -0.59 1.09 -0.59 3.15 1.57 -1.00 -0.94 116.57 119.27 3hq2 h LYS 83 Ca -0.05 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 3hq2 h LYS 83 Cb 0.43 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 3hq2 h LYS 83 CO 0.08 0.72 0.32 0.00 -0.57 0.00 0.00 179.45 180.00 3hq2 h ALA 84 N 1.31 0.75 -0.13 3.86 0.00 -0.38 -0.02 119.26 124.65 3hq2 h ALA 84 Ca 0.31 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 3hq2 h ALA 84 Cb -0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 3hq2 h ALA 84 CO -0.07 0.27 -0.61 0.28 0.00 0.00 0.00 179.25 179.12 3hq2 h VAL 85 N 0.79 1.35 -0.31 0.00 2.07 -0.85 0.37 116.25 119.67 3hq2 h VAL 85 Ca 0.21 -1.92 -0.11 0.00 0.82 0.00 0.00 66.70 65.70 3hq2 h VAL 85 Cb 0.05 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 3hq2 h VAL 85 CO -0.03 0.59 -0.25 -0.33 0.02 0.00 0.00 177.57 177.56 3hq2 h GLU 86 N 0.34 0.61 -0.24 1.57 5.08 -0.97 0.24 114.58 121.21 3hq2 h GLU 86 Ca -0.01 -0.24 -0.10 0.00 -1.00 0.00 0.00 59.36 58.01 3hq2 h GLU 86 Cb 1.16 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.37 3hq2 h GLU 86 CO 0.11 0.81 -0.23 1.25 -1.00 0.00 0.00 179.01 179.95 3hq2 h LEU 87 N 0.53 0.62 -1.07 1.33 5.85 -0.77 -2.44 115.31 119.36 3hq2 h LEU 87 Ca 0.07 -0.47 -0.08 0.00 0.84 0.00 0.00 57.88 58.25 3hq2 h LEU 87 Cb 0.72 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 3hq2 h LEU 87 CO 0.06 0.96 -0.17 0.00 -0.34 0.00 0.00 178.44 178.95 3hq2 h ALA 88 N 0.68 1.23 -0.70 1.25 0.00 -0.68 -2.01 119.26 119.02 3hq2 h ALA 88 Ca 0.04 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 3hq2 h ALA 88 Cb 0.78 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 3hq2 h ALA 88 CO 0.06 0.50 0.33 -0.22 0.00 0.00 0.00 179.25 179.93 3hq2 h LYS 89 N 0.41 1.01 -0.30 0.00 3.64 -0.36 0.87 116.57 121.86 3hq2 h LYS 89 Ca 0.07 -0.15 -0.08 0.00 -1.27 0.00 0.00 60.65 59.22 3hq2 h LYS 89 Cb 0.54 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 3hq2 h LYS 89 CO 0.04 0.80 -0.14 -0.22 -2.27 0.00 0.00 179.45 177.65 3hq2 h LYS 90 N 0.98 0.63 0.00 1.90 3.64 -1.16 -1.69 116.57 120.87 3hq2 h LYS 90 Ca 0.24 -0.27 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 3hq2 h LYS 90 Cb 0.12 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 3hq2 h LYS 90 CO -0.03 0.85 -0.17 0.93 -2.27 0.00 0.00 179.45 178.76 3hq2 h GLU 91 N 0.38 0.00 0.49 1.90 5.08 -1.09 0.22 114.58 121.56 3hq2 h GLU 91 Ca 0.07 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3hq2 h GLU 91 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 3hq2 h GLU 91 CO 0.04 0.17 -0.24 -0.92 -1.00 0.00 0.00 179.01 177.07 3hq2 h TYR 92 N 0.00 -0.61 -0.75 4.33 3.20 -0.55 -1.55 116.97 121.04 3hq2 h TYR 92 Ca -0.00 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 61.96 3hq2 h TYR 92 Cb 0.32 0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.74 3hq2 h TYR 92 CO 0.00 -0.34 0.49 0.93 -1.64 0.00 0.00 178.16 177.60 3hq2 h GLU 93 N -1.14 0.61 0.26 1.82 5.08 -1.13 0.74 114.58 120.83 3hq2 h GLU 93 Ca -0.07 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 3hq2 h GLU 93 Cb 0.54 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3hq2 h GLU 93 CO 0.11 0.41 -0.12 1.49 -1.00 0.00 0.00 179.01 179.89 3hq2 h GLU 94 N 0.63 -0.34 -0.50 2.33 4.57 -0.57 -3.24 114.58 117.48 3hq2 h GLU 94 Ca 0.35 0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 58.47 3hq2 h GLU 94 Cb 0.50 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.15 3hq2 h GLU 94 CO -0.13 0.02 -0.01 -0.91 -1.18 0.00 0.00 179.01 176.80 3hq2 h ASN 95 N -0.87 0.81 -0.94 1.04 2.35 -1.14 -2.75 115.58 114.08 3hq2 h ASN 95 Ca -0.04 -0.21 0.27 0.00 -0.55 0.00 0.00 56.30 55.78 3hq2 h ASN 95 Cb 0.51 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.63 3hq2 h ASN 95 CO 0.06 0.88 0.70 0.50 -1.65 0.00 0.00 177.43 177.92 3hq2 h LYS 96 N 0.78 0.00 0.00 0.81 1.63 -0.92 0.54 116.57 119.40 3hq2 h LYS 96 Ca 0.15 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.95 3hq2 h LYS 96 Cb 0.49 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 3hq2 h LYS 96 CO 0.02 0.00 0.00 1.63 -3.45 0.00 0.00 179.45 177.65 3hq2 n LYS 97 N -4.17 0.76 -4.60 1.90 5.02 -1.04 -4.74 118.16 111.29 3hq2 n LYS 97 Ca 0.20 0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 56.18 3hq2 n LYS 97 Cb 1.03 -1.50 -0.17 0.00 -0.02 0.00 0.00 35.03 34.37 3hq2 n LYS 97 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hq2 s ILE 98 N -2.12 1.93 -0.11 -0.18 1.01 0.19 -4.72 121.20 117.20 3hq2 s ILE 98 Ca 0.38 -0.90 -0.35 0.00 0.00 0.00 0.00 60.65 59.78 3hq2 s ILE 98 Cb 0.19 -1.71 -0.12 0.00 0.01 0.00 0.00 42.46 40.82 3hq2 s ILE 98 CO 0.33 0.52 1.86 -2.65 0.00 0.00 0.00 174.94 175.01 3hq2 n PRO 99 N 4.13 2.06 -0.30 2.79 -0.02 -1.26 -4.83 135.00 137.56 3hq2 n PRO 99 Ca -0.20 0.75 0.21 0.00 -2.02 0.00 0.00 63.50 62.24 3hq2 n PRO 99 Cb 0.51 -2.58 0.49 0.00 -0.02 0.00 0.00 33.50 31.90 3hq2 n PRO 99 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3hq2 h GLU 100 N 8.91 0.43 0.00 -0.52 4.81 -1.95 0.35 114.58 126.60 3hq2 h GLU 100 Ca -0.48 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 58.68 3hq2 h GLU 100 Cb 1.28 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 3hq2 h GLU 100 CO 0.95 0.28 -0.19 0.00 -0.73 0.00 0.00 179.01 179.32 3hq2 h ALA 101 N 1.62 1.62 0.06 2.92 0.00 -2.00 -2.39 119.26 121.08 3hq2 h ALA 101 Ca 0.55 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 55.16 3hq2 h ALA 101 Cb 1.33 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.11 3hq2 h ALA 101 CO -0.27 0.24 -0.56 0.93 0.00 0.00 0.00 179.25 179.60 3hq2 h GLU 102 N 0.00 0.27 -0.59 0.00 5.08 -0.68 -3.05 114.58 115.60 3hq2 h GLU 102 Ca -0.00 -0.37 0.09 0.00 -1.00 0.00 0.00 59.36 58.08 3hq2 h GLU 102 Cb 0.35 0.13 -0.07 0.00 0.50 0.00 0.00 28.75 29.66 3hq2 h GLU 102 CO 0.03 1.12 0.21 -0.92 -1.00 0.00 0.00 179.01 178.45 3hq2 h TYR 103 N -0.41 0.37 0.12 4.33 3.20 -1.30 -0.27 116.97 123.01 3hq2 h TYR 103 Ca -0.09 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.82 3hq2 h TYR 103 Cb 1.37 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.54 3hq2 h TYR 103 CO 0.19 0.09 -0.15 -0.22 -1.64 0.00 0.00 178.16 176.43 3hq2 h LYS 104 N 0.39 -0.31 0.00 1.82 3.64 -1.51 0.02 116.57 120.62 3hq2 h LYS 104 Ca 0.30 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.63 3hq2 h LYS 104 Cb 0.36 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 3hq2 h LYS 104 CO -0.30 -0.21 -0.30 1.05 -2.27 0.00 0.00 179.45 177.42 3hq2 h GLU 105 N -0.32 0.00 0.18 1.90 4.11 -1.36 -1.99 114.58 117.11 3hq2 h GLU 105 Ca 0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.43 3hq2 h GLU 105 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3hq2 h GLU 105 CO -0.06 0.30 -0.09 -0.92 0.07 0.00 0.00 179.01 178.31 3hq2 h TYR 106 N 0.00 -0.23 -0.91 2.06 3.20 -0.47 0.15 116.97 120.77 3hq2 h TYR 106 Ca -0.00 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.00 3hq2 h TYR 106 Cb 0.70 0.08 -0.09 0.00 1.54 0.00 0.00 36.73 38.96 3hq2 h TYR 106 CO 0.00 0.05 0.52 0.28 -1.64 0.00 0.00 178.16 177.37 3hq2 h VAL 107 N -0.50 0.80 -0.63 1.81 2.07 -0.81 0.73 116.25 119.71 3hq2 h VAL 107 Ca -0.03 -0.26 -0.09 0.00 0.82 0.00 0.00 66.70 67.14 3hq2 h VAL 107 Cb 0.38 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 3hq2 h VAL 107 CO 0.04 0.14 0.04 0.40 0.02 0.00 0.00 177.57 178.21 3hq2 h ILE 108 N 0.76 1.27 -0.74 4.57 2.04 -1.14 -2.47 117.51 121.81 3hq2 h ILE 108 Ca 0.48 -1.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.18 3hq2 h ILE 108 Cb 0.60 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 3hq2 h ILE 108 CO -0.32 0.41 0.32 0.25 0.00 0.00 0.00 178.15 178.81 3hq2 h LEU 109 N 1.00 0.99 -0.49 1.44 5.85 0.11 -2.40 115.31 121.81 3hq2 h LEU 109 Ca 0.18 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 3hq2 h LEU 109 Cb 0.52 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 3hq2 h LEU 109 CO 0.02 0.86 0.17 0.00 -0.34 0.00 0.00 178.44 179.16 3hq2 h SER 111 N 0.66 0.88 0.02 0.00 0.87 -1.23 -1.02 113.55 113.74 3hq2 h SER 111 Ca 0.16 -0.07 -0.21 0.00 -1.23 0.00 0.00 61.79 60.44 3hq2 h SER 111 Cb 0.24 -0.22 0.02 0.00 -0.44 0.00 0.00 62.40 62.00 3hq2 h SER 111 CO -0.01 0.71 -0.84 0.11 -0.53 0.00 0.00 176.83 176.27 3hq2 h LYS 112 N 1.00 0.53 -0.90 2.24 1.57 -1.05 -3.11 116.57 116.85 3hq2 h LYS 112 Ca 0.26 -0.60 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 3hq2 h LYS 112 Cb 0.01 0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 3hq2 h LYS 112 CO -0.04 1.22 0.57 0.00 -0.57 0.00 0.00 179.45 180.63 3hq2 h ALA 113 N 0.32 1.14 -0.31 3.86 0.00 0.36 0.28 119.26 124.91 3hq2 h ALA 113 Ca -0.11 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 3hq2 h ALA 113 Cb 1.54 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3hq2 h ALA 113 CO 0.16 0.56 -0.28 1.49 0.00 0.00 0.00 179.25 181.19 3hq2 h GLU 114 N 1.22 0.64 -0.36 0.00 4.81 -1.23 0.81 114.58 120.47 3hq2 h GLU 114 Ca 0.33 -0.27 -0.16 0.00 -0.13 0.00 0.00 59.36 59.12 3hq2 h GLU 114 Cb -0.10 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.25 3hq2 h GLU 114 CO -0.07 0.85 -0.40 1.15 -0.73 0.00 0.00 179.01 179.81 3hq2 h THR 115 N 0.55 1.27 -0.17 0.32 2.02 -1.39 -0.42 112.91 115.09 3hq2 h THR 115 Ca 0.07 -1.58 0.01 0.00 0.77 0.00 0.00 66.41 65.68 3hq2 h THR 115 Cb 0.76 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 3hq2 h THR 115 CO 0.06 0.52 0.09 0.00 0.37 0.00 0.00 175.52 176.57 3hq2 h ALA 116 N 0.75 0.20 0.17 6.16 0.00 -0.53 -2.79 119.26 123.22 3hq2 h ALA 116 Ca 0.05 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3hq2 h ALA 116 Cb 1.00 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 3hq2 h ALA 116 CO 0.10 -0.33 -0.26 2.35 0.00 0.00 0.00 179.25 181.11 3hq2 h TRP 117 N 0.20 -0.69 -1.17 0.00 7.01 0.86 -0.41 115.95 121.75 3hq2 h TRP 117 Ca 0.07 0.01 0.34 0.00 2.11 0.00 0.00 58.89 61.41 3hq2 h TRP 117 Cb -0.00 0.28 -0.09 0.00 -2.10 0.00 0.00 29.16 27.25 3hq2 h TRP 117 CO -0.08 -0.37 0.78 0.93 -2.79 0.00 0.00 178.44 176.91 3hq2 h GLU 118 N -0.50 0.22 0.04 2.65 5.08 -0.89 0.19 114.58 121.37 3hq2 h GLU 118 Ca 0.02 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 3hq2 h GLU 118 Cb 0.50 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.71 3hq2 h GLU 118 CO -0.12 0.14 -0.59 1.49 -1.00 0.00 0.00 179.01 178.94 3hq2 h GLU 119 N 0.22 0.32 -0.18 2.33 4.81 -1.05 -2.73 114.58 118.31 3hq2 h GLU 119 Ca 0.66 -0.40 0.05 0.00 -0.13 0.00 0.00 59.36 59.53 3hq2 h GLU 119 Cb 2.01 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 31.47 3hq2 h GLU 119 CO -0.26 1.11 -0.12 0.00 -0.73 0.00 0.00 179.01 179.01 3hq2 h ALA 120 N 0.22 0.02 -0.18 2.92 0.00 0.91 -1.75 119.26 121.41 3hq2 h ALA 120 Ca -0.09 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hq2 h ALA 120 Cb 1.35 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 3hq2 h ALA 120 CO 0.11 -0.55 0.09 -0.22 0.00 0.00 0.00 179.25 178.69 3hq2 h LYS 121 N -0.12 0.25 -0.51 0.00 3.64 -1.18 0.93 116.57 119.58 3hq2 h LYS 121 Ca 0.11 -0.03 0.13 0.00 -1.27 0.00 0.00 60.65 59.58 3hq2 h LYS 121 Cb 0.27 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 3hq2 h LYS 121 CO -0.25 0.26 0.36 0.78 -2.27 0.00 0.00 179.45 178.33 3hq2 h GLY 122 N 0.18 0.17 0.28 5.01 0.00 -1.16 0.14 103.07 107.68 3hq2 h GLY 122 Ca 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.35 3hq2 h GLY 122 CO -0.01 0.02 -1.17 0.28 0.00 0.00 0.00 176.54 175.66 3hq2 n LYS 123 N -4.42 0.23 -2.94 4.80 5.02 -0.69 -4.97 118.16 115.20 3hq2 n LYS 123 Ca 0.09 -0.04 -0.12 0.00 -2.02 0.00 0.00 58.31 56.22 3hq2 n LYS 123 Cb 0.51 -1.54 0.06 0.00 -0.02 0.00 0.00 35.03 34.04 3hq2 n LYS 123 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3hq2 n SER 124 N -1.82 -3.12 -3.91 4.39 2.88 0.24 -4.99 113.62 107.30 3hq2 n SER 124 Ca 0.02 -0.47 -0.31 0.00 -1.33 0.00 0.00 58.87 56.79 3hq2 n SER 124 Cb 0.42 -3.85 -0.15 0.00 -0.75 0.00 0.00 64.21 59.88 3hq2 n SER 124 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3hq2 s ASP 125 N -3.75 4.49 0.15 -3.46 -1.08 0.25 -4.53 116.67 108.75 3hq2 s ASP 125 Ca 0.11 -1.97 -0.13 0.00 -0.52 0.00 0.00 52.55 50.04 3hq2 s ASP 125 Cb -0.01 -1.34 0.03 0.00 -1.46 0.00 0.00 42.92 40.14 3hq2 s ASP 125 CO 0.53 -0.39 1.65 0.15 0.52 0.00 0.00 175.17 177.62 3hq2 h PHE 126 N 7.78 0.90 -0.12 -5.34 3.57 -1.94 -2.97 116.94 118.82 3hq2 h PHE 126 Ca -0.08 -0.12 0.03 0.00 3.53 0.00 0.00 57.97 61.34 3hq2 h PHE 126 Cb 1.02 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.50 3hq2 h PHE 126 CO 0.42 0.81 0.16 0.66 -2.23 0.00 0.00 178.31 178.13 3hq2 h SER 127 N 0.73 0.00 0.12 0.41 4.64 -1.97 0.25 113.55 117.74 3hq2 h SER 127 Ca 0.16 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.27 3hq2 h SER 127 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3hq2 h SER 127 CO 0.01 0.00 -0.79 0.25 -0.87 0.00 0.00 176.83 175.43 3hq2 h LEU 128 N 0.00 0.66 0.14 5.97 6.46 -1.92 -3.32 115.31 123.30 3hq2 h LEU 128 Ca 0.06 -0.45 -0.33 0.00 -0.12 0.00 0.00 57.88 57.03 3hq2 h LEU 128 Cb 0.37 -0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 40.10 3hq2 h LEU 128 CO -0.00 1.22 -1.70 0.15 -0.62 0.00 0.00 178.44 177.49 3hq2 h PHE 129 N 0.36 0.53 -0.73 1.25 3.57 -1.32 -3.40 116.94 117.21 3hq2 h PHE 129 Ca -0.05 -0.39 0.13 0.00 3.53 0.00 0.00 57.97 61.19 3hq2 h PHE 129 Cb 1.39 -0.02 -0.13 0.00 2.79 0.00 0.00 35.95 39.98 3hq2 h PHE 129 CO 0.06 1.53 -0.24 0.45 -2.23 0.00 0.00 178.31 177.89 3hq2 n SER 130 N -3.48 -0.37 -0.25 0.41 2.88 0.77 -0.78 113.62 112.80 3hq2 n SER 130 Ca -0.22 1.26 0.02 0.00 -1.33 0.00 0.00 58.87 58.61 3hq2 n SER 130 Cb 1.06 -0.33 0.15 0.00 -0.75 0.00 0.00 64.21 64.34 3hq2 n SER 130 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3hq2 h PRO 131 N 0.00 0.53 -0.17 -1.46 0.11 -1.78 -1.43 132.00 127.81 3hq2 h PRO 131 Ca 0.30 -0.03 -0.22 0.00 0.11 0.00 0.00 66.00 66.15 3hq2 h PRO 131 Cb 0.48 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.48 3hq2 h PRO 131 CO -0.74 0.35 -0.77 1.88 -0.21 0.00 0.00 178.00 178.52 3hq2 h TYR 132 N 0.55 1.09 -0.89 0.65 -1.99 -1.23 -3.14 116.97 112.01 3hq2 h TYR 132 Ca 0.37 -0.47 0.10 0.00 2.00 0.00 0.00 58.73 60.72 3hq2 h TYR 132 Cb 0.44 -0.17 -0.06 0.00 2.00 0.00 0.00 36.73 38.94 3hq2 h TYR 132 CO -0.13 1.31 0.57 1.25 -0.00 0.00 0.00 178.16 181.17 3hq2 h LEU 133 N 0.56 0.80 -0.95 3.88 5.85 -0.57 0.19 115.31 125.06 3hq2 h LEU 133 Ca -0.05 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 3hq2 h LEU 133 Cb 1.39 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 3hq2 h LEU 133 CO 0.16 0.47 0.30 -0.08 -0.34 0.00 0.00 178.44 178.95 3hq2 h GLU 134 N 0.88 1.06 0.02 1.25 4.57 -1.24 -1.96 114.58 119.16 3hq2 h GLU 134 Ca 0.41 -0.17 -0.10 0.00 -1.18 0.00 0.00 59.36 58.32 3hq2 h GLU 134 Cb 0.41 -0.18 0.01 0.00 -0.16 0.00 0.00 28.75 28.83 3hq2 h GLU 134 CO -0.18 0.85 -0.38 1.96 -1.18 0.00 0.00 179.01 180.08 3hq2 h GLN 135 N 1.04 0.23 -1.01 1.92 4.20 -1.25 -0.73 115.11 119.50 3hq2 h GLN 135 Ca 0.24 -0.27 0.18 0.00 0.06 0.00 0.00 58.65 58.86 3hq2 h GLN 135 Cb 0.18 0.08 -0.10 0.00 0.30 0.00 0.00 27.48 27.94 3hq2 h GLN 135 CO -0.02 1.01 0.62 -0.07 -0.67 0.00 0.00 178.83 179.70 3hq2 h LEU 136 N -0.44 0.82 0.14 1.46 3.38 -0.59 0.19 115.31 120.28 3hq2 h LEU 136 Ca -0.05 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3hq2 h LEU 136 Cb 1.16 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3hq2 h LEU 136 CO 0.07 0.32 -0.07 0.40 0.09 0.00 0.00 178.44 179.26 3hq2 h ILE 137 N 0.81 0.75 -1.01 1.22 2.04 -1.39 -2.81 117.51 117.12 3hq2 h ILE 137 Ca 0.57 -1.22 0.32 0.00 1.00 0.00 0.00 64.86 65.53 3hq2 h ILE 137 Cb 0.82 1.31 -0.15 0.00 -0.74 0.00 0.00 36.82 38.06 3hq2 h ILE 137 CO -0.36 0.21 0.58 -0.08 0.00 0.00 0.00 178.15 178.51 3hq2 h GLU 138 N -0.93 0.32 -0.04 2.37 4.81 -0.45 0.35 114.58 121.01 3hq2 h GLU 138 Ca -0.02 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3hq2 h GLU 138 Cb 0.49 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 3hq2 h GLU 138 CO 0.03 0.21 0.01 0.74 -0.73 0.00 0.00 179.01 179.27 3hq2 h PHE 139 N 0.33 0.07 -0.55 0.92 -1.00 -0.67 -2.80 116.94 113.23 3hq2 h PHE 139 Ca 0.73 -0.01 -0.04 0.00 2.81 0.00 0.00 57.97 61.47 3hq2 h PHE 139 Cb 1.69 -0.02 -0.03 0.00 3.61 0.00 0.00 35.95 41.20 3hq2 h PHE 139 CO -0.01 0.29 0.20 -0.91 -1.61 0.00 0.00 178.31 176.27 3hq2 h ASN 140 N -0.17 0.74 -0.21 2.17 2.35 -0.14 0.21 115.58 120.54 3hq2 h ASN 140 Ca 0.01 -0.10 0.01 0.00 -0.55 0.00 0.00 56.30 55.66 3hq2 h ASN 140 Cb 0.26 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 3hq2 h ASN 140 CO 0.00 0.69 0.13 0.11 -1.65 0.00 0.00 177.43 176.71 3hq2 h LYS 141 N 0.80 0.26 -0.49 0.81 1.57 -0.94 0.15 116.57 118.73 3hq2 h LYS 141 Ca 0.19 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3hq2 h LYS 141 Cb 0.19 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 3hq2 h LYS 141 CO -0.01 0.17 0.32 -0.09 -0.57 0.00 0.00 179.45 179.27 3hq2 h ARG 142 N 0.27 0.64 -0.75 3.15 2.43 -1.13 -2.39 114.38 116.60 3hq2 h ARG 142 Ca 0.08 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 3hq2 h ARG 142 Cb -0.02 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.35 3hq2 h ARG 142 CO -0.03 0.43 0.43 0.74 -1.51 0.00 0.00 179.97 180.03 3hq2 h PHE 143 N 0.66 1.02 -0.81 2.20 0.05 -0.02 -1.20 116.94 118.84 3hq2 h PHE 143 Ca 0.18 -0.02 0.16 0.00 3.82 0.00 0.00 57.97 62.11 3hq2 h PHE 143 Cb -0.07 -0.33 -0.06 0.00 2.00 0.00 0.00 35.95 37.50 3hq2 h PHE 143 CO -0.04 0.70 0.53 0.82 -0.18 0.00 0.00 178.31 180.15 3hq2 h ILE 144 N 1.03 0.78 0.22 -0.55 2.04 -0.24 -0.32 117.51 120.48 3hq2 h ILE 144 Ca 0.27 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.96 3hq2 h ILE 144 Cb 0.01 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 3hq2 h ILE 144 CO -0.05 0.09 -0.10 0.74 0.00 0.00 0.00 178.15 178.83 3hq2 h THR 145 N 0.47 0.86 -0.68 -0.27 2.02 -0.85 -0.80 112.91 113.66 3hq2 h THR 145 Ca 0.40 -0.67 0.09 0.00 0.77 0.00 0.00 66.41 67.00 3hq2 h THR 145 Cb 0.87 1.24 -0.07 0.00 -1.74 0.00 0.00 68.15 68.46 3hq2 h THR 145 CO -0.14 0.14 0.33 1.88 0.37 0.00 0.00 175.52 178.10 3hq2 h TYR 146 N -0.64 0.59 -0.03 3.16 0.99 -0.61 -2.77 116.97 117.66 3hq2 h TYR 146 Ca -0.03 0.03 -0.20 0.00 2.00 0.00 0.00 58.73 60.53 3hq2 h TYR 146 Cb 0.46 -0.16 0.01 0.00 1.00 0.00 0.00 36.73 38.04 3hq2 h TYR 146 CO 0.03 0.22 -0.77 -1.49 -0.00 0.00 0.00 178.16 176.14 3hq2 h TRP 147 N 0.57 0.84 0.00 4.88 6.55 -1.16 -3.46 115.95 124.17 3hq2 h TRP 147 Ca 0.33 -0.44 0.00 0.00 0.95 0.00 0.00 58.89 59.74 3hq2 h TRP 147 Cb 0.35 -0.10 0.00 0.00 -0.86 0.00 0.00 29.16 28.54 3hq2 h TRP 147 CO -0.11 1.26 0.00 0.41 -1.05 0.00 0.00 178.44 178.94 3hq2 n GLY 148 N 0.98 -0.41 3.74 1.49 0.00 -0.31 -5.10 105.19 105.58 3hq2 n GLY 148 Ca -0.10 -1.73 -0.10 0.00 0.00 0.00 0.00 46.02 44.09 3hq2 n GLY 148 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hq2 s TYR 149 N -1.99 0.27 -0.08 1.61 -0.85 -1.26 -4.69 117.35 110.36 3hq2 s TYR 149 Ca 0.00 -0.82 0.04 0.00 -0.52 0.00 0.00 57.07 55.77 3hq2 s TYR 149 Cb 0.00 0.61 -0.08 0.00 0.38 0.00 0.00 41.96 42.87 3hq2 s TYR 149 CO 0.00 -1.41 -0.02 1.04 -1.52 0.00 0.00 175.55 173.64 3hq2 n GLN 150 N -0.52 1.73 0.00 -3.49 1.13 -1.26 -5.02 117.38 109.94 3hq2 n GLN 150 Ca -0.06 0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.02 3hq2 n GLN 150 Cb 0.60 -1.18 0.00 0.00 0.11 0.00 0.00 30.24 29.77 3hq2 n GLN 150 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3hq2 n GLU 151 N -2.48 0.00 -3.32 -1.09 1.02 -1.26 -5.07 120.64 108.44 3hq2 n GLU 151 Ca -0.14 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.62 3hq2 n GLU 151 Cb 0.71 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 32.07 3hq2 n GLU 151 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3hq2 s HIS 152 N 0.00 3.69 0.53 -0.32 2.46 -1.26 -4.96 115.29 115.43 3hq2 s HIS 152 Ca 0.00 1.10 0.42 0.00 0.47 0.00 0.00 55.06 57.04 3hq2 s HIS 152 Cb 0.00 -2.49 2.24 0.00 -0.13 0.00 0.00 32.58 32.20 3hq2 s HIS 152 CO 0.00 0.44 2.27 -1.00 -2.47 0.00 0.00 174.74 173.98 3hq2 h PRO 153 N 5.38 0.00 0.00 2.88 0.13 -1.98 -0.23 132.00 138.18 3hq2 h PRO 153 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3hq2 h PRO 153 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 3hq2 h PRO 153 CO 0.67 0.00 -0.02 -0.92 -0.23 0.00 0.00 178.00 177.51 3hq2 h TYR 154 N 0.00 0.00 -0.07 1.56 5.03 -1.93 -2.80 116.97 118.76 3hq2 h TYR 154 Ca 0.00 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.27 3hq2 h TYR 154 Cb 0.02 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.30 3hq2 h TYR 154 CO 0.00 0.02 -0.16 -0.44 -1.32 0.00 0.00 178.16 176.25 3hq2 h ASP 155 N 0.00 0.11 -0.70 -2.11 3.32 -1.39 -0.89 116.42 114.75 3hq2 h ASP 155 Ca -0.00 -0.02 0.08 0.00 0.02 0.00 0.00 57.03 57.11 3hq2 h ASP 155 Cb 0.72 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.19 3hq2 h ASP 155 CO 0.00 0.29 0.46 0.00 -1.72 0.00 0.00 179.24 178.27 3hq2 h ALA 156 N 1.73 1.80 0.06 3.45 0.00 -1.63 0.13 119.26 124.80 3hq2 h ALA 156 Ca 0.02 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.63 3hq2 h ALA 156 Cb 0.36 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3hq2 h ALA 156 CO 0.02 0.07 -1.56 -0.07 0.00 0.00 0.00 179.25 177.71 3hq2 h LEU 157 N 0.65 0.19 -0.91 0.00 3.38 -1.46 -3.33 115.31 113.84 3hq2 h LEU 157 Ca 0.31 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3hq2 h LEU 157 Cb 0.38 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3hq2 h LEU 157 CO -0.11 1.26 0.33 -0.07 0.09 0.00 0.00 178.44 179.95 3hq2 h LEU 158 N 0.03 1.03 -2.55 1.67 3.38 -0.46 -2.05 115.31 116.36 3hq2 h LEU 158 Ca -0.24 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3hq2 h LEU 158 Cb 1.98 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.46 3hq2 h LEU 158 CO 0.12 0.90 0.00 -0.78 0.09 0.00 0.00 178.44 178.76 3hq2 h ASP 159 N 1.10 0.00 0.62 -0.43 1.82 -0.87 -1.72 116.42 116.95 3hq2 h ASP 159 Ca 0.26 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.90 3hq2 h ASP 159 Cb 0.17 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.18 3hq2 h ASP 159 CO -0.03 0.00 0.00 0.18 -1.61 0.00 0.00 179.24 177.78 3hq2 n LEU 160 N -3.06 0.00 0.00 2.28 4.77 -0.77 -3.73 117.00 116.49 3hq2 n LEU 160 Ca -0.02 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 3hq2 n LEU 160 Cb 0.13 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 3hq2 n LEU 160 CO 0.22 -0.18 -0.24 0.49 -1.33 0.00 0.00 177.39 176.34 3hq2 n PHE 161 N -1.50 0.00 -3.55 -1.77 3.01 -0.72 -4.95 117.46 107.98 3hq2 n PHE 161 Ca 0.04 0.00 -0.27 0.00 1.01 0.00 0.00 57.45 58.23 3hq2 n PHE 161 Cb 0.21 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.58 3hq2 n PHE 161 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3hq2 s GLU 162 N -1.48 1.38 -0.28 -1.08 0.41 -0.73 -3.14 118.70 113.78 3hq2 s GLU 162 Ca 0.00 -2.48 -0.38 0.00 -0.41 0.00 0.00 54.97 51.70 3hq2 s GLU 162 Cb 0.00 -2.03 -0.14 0.00 -1.78 0.00 0.00 34.13 30.18 3hq2 s GLU 162 CO 0.00 -1.35 1.94 -2.30 -0.49 0.00 0.00 175.26 173.06 3hq2 n PRO 163 N 2.59 1.27 0.00 0.39 -0.02 -1.24 -0.97 135.00 137.01 3hq2 n PRO 163 Ca 0.26 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 3hq2 n PRO 163 Cb 0.44 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 3hq2 n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hq2 n GLY 164 N 5.18 1.83 3.67 -1.23 0.00 -1.26 -5.04 105.19 108.34 3hq2 n GLY 164 Ca 0.32 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 3hq2 n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hq2 s VAL 165 N -0.73 3.76 0.40 1.61 1.01 -0.14 -4.99 120.40 121.31 3hq2 s VAL 165 Ca 0.00 1.04 0.05 0.00 0.00 0.00 0.00 61.98 63.08 3hq2 s VAL 165 Cb 0.00 -3.67 -0.07 0.00 0.00 0.00 0.00 36.38 32.64 3hq2 s VAL 165 CO 0.00 -0.05 0.03 0.42 0.00 0.00 0.00 175.10 175.50 3hq2 s THR 166 N 3.11 1.63 0.31 3.92 -4.23 -1.26 -4.36 115.64 114.76 3hq2 s THR 166 Ca 0.65 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.17 3hq2 s THR 166 Cb -0.30 -2.82 0.17 0.00 1.34 0.00 0.00 72.50 70.89 3hq2 s THR 166 CO 0.25 0.00 1.86 0.58 -0.54 0.00 0.00 174.62 176.77 3hq2 h VAL 167 N 1.81 1.21 -0.21 2.29 2.07 -1.93 -1.30 116.25 120.19 3hq2 h VAL 167 Ca -0.43 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 3hq2 h VAL 167 Cb 1.25 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 3hq2 h VAL 167 CO 0.76 0.28 0.05 0.50 0.02 0.00 0.00 177.57 179.18 3hq2 h LYS 168 N 0.70 0.34 -0.68 1.57 3.64 -1.99 -1.75 116.57 118.40 3hq2 h LYS 168 Ca 0.16 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 3hq2 h LYS 168 Cb 0.27 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 3hq2 h LYS 168 CO -0.00 0.47 0.24 0.28 -2.27 0.00 0.00 179.45 178.16 3hq2 h VAL 169 N 0.15 1.24 -0.23 2.00 2.07 -1.87 -3.13 116.25 116.49 3hq2 h VAL 169 Ca 0.07 -0.81 -0.16 0.00 0.82 0.00 0.00 66.70 66.62 3hq2 h VAL 169 Cb 0.28 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 3hq2 h VAL 169 CO 0.00 0.32 -0.48 -0.07 0.02 0.00 0.00 177.57 177.36 3hq2 h LEU 170 N 0.99 0.81 -0.22 2.57 3.38 -1.16 -3.12 115.31 118.57 3hq2 h LEU 170 Ca 0.22 -0.55 0.06 0.00 0.09 0.00 0.00 57.88 57.70 3hq2 h LEU 170 Cb 0.24 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.70 3hq2 h LEU 170 CO -0.01 1.22 -0.16 0.44 0.09 0.00 0.00 178.44 180.01 3hq2 h ASP 171 N 0.45 -0.53 0.00 -0.43 3.32 -1.27 0.19 116.42 118.15 3hq2 h ASP 171 Ca 0.00 0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 3hq2 h ASP 171 Cb 1.09 0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.90 3hq2 h ASP 171 CO 0.11 -0.20 -0.00 -0.61 -1.72 0.00 0.00 179.24 176.81 3hq2 h GLN 172 N -0.16 0.01 0.08 3.56 5.75 -1.63 -1.82 115.11 120.91 3hq2 h GLN 172 Ca 0.13 -0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 58.30 3hq2 h GLN 172 Cb 0.35 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 3hq2 h GLN 172 CO -0.32 0.02 -1.75 1.25 -2.65 0.00 0.00 178.83 175.38 3hq2 h LEU 173 N 0.01 0.28 -0.32 -2.39 5.85 -1.24 -3.25 115.31 114.26 3hq2 h LEU 173 Ca 0.00 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.20 3hq2 h LEU 173 Cb 0.02 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.96 3hq2 h LEU 173 CO 0.00 1.46 0.00 -0.26 -0.34 0.00 0.00 178.44 179.30 3hq2 h PHE 174 N 0.05 0.00 0.50 1.25 0.05 -0.59 -2.65 116.94 115.55 3hq2 h PHE 174 Ca -0.32 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.44 3hq2 h PHE 174 Cb 2.02 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.98 3hq2 h PHE 174 CO 0.05 0.00 -0.24 0.00 -0.18 0.00 0.00 178.31 177.94 3hq2 h ALA 175 N 2.14 -0.67 -0.89 2.45 0.00 -1.44 -1.24 119.26 119.61 3hq2 h ALA 175 Ca 0.00 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 54.81 3hq2 h ALA 175 Cb 0.81 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 3hq2 h ALA 175 CO 0.00 -0.69 0.58 0.93 0.00 0.00 0.00 179.25 180.07 3hq2 h GLU 176 N -1.04 0.90 -0.38 0.00 5.08 -1.56 -0.01 114.58 117.56 3hq2 h GLU 176 Ca -0.07 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 3hq2 h GLU 176 Cb 0.60 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 3hq2 h GLU 176 CO 0.11 0.59 0.16 -0.07 -1.00 0.00 0.00 179.01 178.80 3hq2 h LEU 177 N 0.92 0.53 0.76 1.33 3.38 -1.40 -0.91 115.31 119.92 3hq2 h LEU 177 Ca 0.40 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 3hq2 h LEU 177 Cb 0.34 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3hq2 h LEU 177 CO -0.17 0.54 -0.48 0.11 0.09 0.00 0.00 178.44 178.53 3hq2 h LYS 178 N 0.48 -1.13 -1.52 1.13 1.57 -0.21 0.63 116.57 117.51 3hq2 h LYS 178 Ca 0.13 0.08 0.44 0.00 -1.87 0.00 0.00 60.65 59.43 3hq2 h LYS 178 Cb 0.18 0.26 -0.06 0.00 0.08 0.00 0.00 32.23 32.68 3hq2 h LYS 178 CO -0.01 -0.75 1.12 0.93 -0.57 0.00 0.00 179.45 180.16 3hq2 h GLU 179 N -1.17 0.00 0.00 3.15 5.08 -0.85 -1.27 114.58 119.52 3hq2 h GLU 179 Ca -0.10 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 57.91 3hq2 h GLU 179 Cb 0.95 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.13 3hq2 h GLU 179 CO 0.09 0.00 -2.31 0.00 -1.00 0.00 0.00 179.01 175.79 3hq2 n ALA 180 N -2.81 1.51 -0.01 3.43 0.00 -0.36 -4.59 120.51 117.68 3hq2 n ALA 180 Ca 0.34 -1.04 -0.06 0.00 0.00 0.00 0.00 53.44 52.67 3hq2 n ALA 180 Cb 1.59 -0.06 -0.05 0.00 0.00 0.00 0.00 19.45 20.93 3hq2 n ALA 180 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3hq2 h ILE 181 N 0.00 0.62 -0.55 0.00 1.08 0.94 -3.24 117.51 116.35 3hq2 h ILE 181 Ca -0.51 -1.32 0.11 0.00 -0.39 0.00 0.00 64.86 62.74 3hq2 h ILE 181 Cb 1.87 1.13 -0.11 0.00 -3.07 0.00 0.00 36.82 36.64 3hq2 h ILE 181 CO -0.06 0.20 -0.20 0.40 -0.69 0.00 0.00 178.15 177.79 3hq2 h ILE 182 N -0.99 0.34 -0.37 -0.67 2.04 -1.43 0.62 117.51 117.05 3hq2 h ILE 182 Ca -0.01 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 3hq2 h ILE 182 Cb 0.39 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 3hq2 h ILE 182 CO 0.02 0.00 -0.08 1.55 0.00 0.00 0.00 178.15 179.63 3hq2 h PRO 183 N -0.07 0.63 -0.73 2.37 0.13 -1.75 -0.81 132.00 131.76 3hq2 h PRO 183 Ca 0.26 -0.18 -0.06 0.00 -0.87 0.00 0.00 66.00 65.15 3hq2 h PRO 183 Cb 0.47 -0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.50 3hq2 h PRO 183 CO -0.61 0.71 0.23 1.25 -0.23 0.00 0.00 178.00 179.35 3hq2 h LEU 184 N 0.58 1.07 -0.99 1.56 7.12 -1.04 -2.04 115.31 121.57 3hq2 h LEU 184 Ca 0.11 -0.21 -0.07 0.00 0.13 0.00 0.00 57.88 57.84 3hq2 h LEU 184 Cb 0.49 -0.28 -0.01 0.00 -0.53 0.00 0.00 40.66 40.33 3hq2 h LEU 184 CO 0.03 0.99 -0.33 0.58 -0.13 0.00 0.00 178.44 179.58 3hq2 h VAL 185 N 1.09 0.78 -0.14 1.05 2.07 0.77 -2.36 116.25 119.52 3hq2 h VAL 185 Ca 0.24 -1.39 -0.04 0.00 0.82 0.00 0.00 66.70 66.33 3hq2 h VAL 185 Cb 0.30 1.87 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 3hq2 h VAL 185 CO -0.01 0.32 -0.06 0.11 0.02 0.00 0.00 177.57 177.95 3hq2 h LYS 186 N 0.00 0.28 -0.84 1.57 1.79 -0.53 -1.73 116.57 117.12 3hq2 h LYS 186 Ca -0.00 -0.12 0.05 0.00 -2.18 0.00 0.00 60.65 58.39 3hq2 h LYS 186 Cb 0.85 -0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 31.43 3hq2 h LYS 186 CO 0.04 0.61 0.52 1.96 -1.08 0.00 0.00 179.45 181.51 3hq2 h GLN 187 N -0.05 0.95 -0.53 3.15 4.20 -1.23 0.42 115.11 122.02 3hq2 h GLN 187 Ca 0.03 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 3hq2 h GLN 187 Cb 0.52 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 28.06 3hq2 h GLN 187 CO 0.02 0.63 0.19 0.28 -0.67 0.00 0.00 178.83 179.28 3hq2 h VAL 188 N 0.98 1.20 -0.09 -0.54 2.07 -1.30 -2.60 116.25 115.96 3hq2 h VAL 188 Ca 0.35 -0.65 -0.22 0.00 0.82 0.00 0.00 66.70 67.00 3hq2 h VAL 188 Cb 0.11 0.59 0.01 0.00 -1.52 0.00 0.00 31.29 30.48 3hq2 h VAL 188 CO -0.15 0.25 -0.82 0.74 0.02 0.00 0.00 177.57 177.61 3hq2 h THR 189 N 0.76 1.32 -0.64 2.57 2.02 -0.14 -3.35 112.91 115.45 3hq2 h THR 189 Ca 0.18 -2.11 -0.71 0.00 0.77 0.00 0.00 66.41 64.54 3hq2 h THR 189 Cb 0.18 2.12 -0.06 0.00 -1.74 0.00 0.00 68.15 68.65 3hq2 h THR 189 CO -0.01 0.65 3.04 0.00 0.37 0.00 0.00 175.52 179.57 3hq2 n ALA 190 N -2.58 7.05 -3.45 6.16 0.00 0.13 -4.88 120.51 122.95 3hq2 n ALA 190 Ca -0.07 -3.85 -0.17 0.00 0.00 0.00 0.00 53.44 49.35 3hq2 n ALA 190 Cb 0.76 -3.06 -0.06 0.00 0.00 0.00 0.00 19.45 17.09 3hq2 n ALA 190 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3hq2 s SER 191 N 1.24 -0.55 -0.11 0.00 1.04 -1.25 -4.92 113.70 109.15 3hq2 s SER 191 Ca 0.60 0.56 0.14 0.00 0.48 0.00 0.00 55.95 57.72 3hq2 s SER 191 Cb 0.18 0.49 0.58 0.00 0.10 0.00 0.00 66.02 67.37 3hq2 s SER 191 CO -0.08 -0.58 1.44 0.61 0.98 0.00 0.00 173.24 175.61 3hq2 n GLY 192 N 0.95 2.23 0.12 7.32 0.00 -1.26 -4.17 105.19 110.39 3hq2 n GLY 192 Ca -0.20 -0.67 0.02 0.00 0.00 0.00 0.00 46.02 45.17 3hq2 n GLY 192 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hq2 n ASN 193 N 0.77 0.35 -4.56 1.61 3.02 -1.26 -4.87 115.26 110.32 3hq2 n ASN 193 Ca 0.20 -1.95 -0.48 0.00 -0.03 0.00 0.00 54.58 52.33 3hq2 n ASN 193 Cb 0.77 -0.04 -0.05 0.00 -0.61 0.00 0.00 39.78 39.85 3hq2 n ASN 193 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3hq2 n LYS 194 N -0.33 1.67 -2.48 3.52 4.01 -1.26 -4.92 118.16 118.36 3hq2 n LYS 194 Ca 0.03 0.52 -0.36 0.00 -0.51 0.00 0.00 58.31 57.99 3hq2 n LYS 194 Cb 0.06 -2.74 -0.03 0.00 -0.51 0.00 0.00 35.03 31.81 3hq2 n LYS 194 CO 0.00 0.00 0.00 -2.14 -1.11 0.00 0.00 177.40 174.15 3hq2 s PRO 195 N 5.59 4.05 0.21 1.97 0.02 -1.26 -4.97 135.00 140.62 3hq2 s PRO 195 Ca 1.02 1.56 -0.32 0.00 0.02 0.00 0.00 61.00 63.28 3hq2 s PRO 195 Cb -0.66 -2.48 -0.12 0.00 0.02 0.00 0.00 34.50 31.26 3hq2 s PRO 195 CO 0.46 -0.25 1.71 0.34 -0.33 0.00 0.00 177.00 178.94 3hq2 s ASP 196 N -1.55 6.39 -0.01 2.53 2.15 -1.26 -4.86 116.67 120.06 3hq2 s ASP 196 Ca 0.60 2.86 0.01 0.00 0.43 0.00 0.00 52.55 56.45 3hq2 s ASP 196 Cb -0.23 -2.60 0.02 0.00 -0.30 0.00 0.00 42.92 39.81 3hq2 s ASP 196 CO 0.29 -0.96 0.84 0.35 -0.17 0.00 0.00 175.17 175.52 3hq2 n THR 197 N 3.94 0.69 -0.32 1.71 -2.24 -1.26 -4.64 114.28 112.17 3hq2 n THR 197 Ca 0.16 -0.72 0.12 0.00 -2.27 0.00 0.00 64.05 61.34 3hq2 n THR 197 Cb 0.35 0.61 0.35 0.00 -2.10 0.00 0.00 70.33 69.55 3hq2 n THR 197 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3hq2 h SER 198 N 0.00 0.73 1.11 3.42 4.64 -2.01 -1.58 113.55 119.85 3hq2 h SER 198 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3hq2 h SER 198 Cb 0.74 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 3hq2 h SER 198 CO 0.00 0.32 0.00 2.22 -0.87 0.00 0.00 176.83 178.50 3hq2 n PHE 199 N -4.64 0.79 -0.06 4.77 -1.74 -1.26 -3.59 117.46 111.72 3hq2 n PHE 199 Ca 0.20 0.26 -0.14 0.00 -0.56 0.00 0.00 57.45 57.22 3hq2 n PHE 199 Cb 0.52 -0.92 -0.07 0.00 1.52 0.00 0.00 39.48 40.53 3hq2 n PHE 199 CO 0.00 0.00 0.00 0.82 -0.56 0.00 0.00 176.76 177.02 3hq2 h ILE 200 N 0.00 1.34 -0.09 1.97 1.08 -1.64 -3.27 117.51 116.91 3hq2 h ILE 200 Ca 0.00 -1.44 0.00 0.00 -0.39 0.00 0.00 64.86 63.03 3hq2 h ILE 200 Cb 0.55 1.87 0.00 0.00 -3.07 0.00 0.00 36.82 36.18 3hq2 h ILE 200 CO 0.00 0.43 0.00 0.35 -0.69 0.00 0.00 178.15 178.24 3hq2 n THR 201 N -4.43 0.39 -2.05 -0.27 -2.24 -1.24 -4.43 114.28 100.01 3hq2 n THR 201 Ca -0.06 -0.20 -0.26 0.00 -2.27 0.00 0.00 64.05 61.26 3hq2 n THR 201 Cb 0.43 -0.43 0.17 0.00 -2.10 0.00 0.00 70.33 68.40 3hq2 n THR 201 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3hq2 n LYS 202 N 0.07 -0.89 -2.76 -0.78 4.76 -1.24 -4.79 118.16 112.53 3hq2 n LYS 202 Ca 0.04 -2.08 -0.42 0.00 -2.87 0.00 0.00 58.31 52.99 3hq2 n LYS 202 Cb 0.37 -1.09 -0.03 0.00 -1.84 0.00 0.00 35.03 32.44 3hq2 n LYS 202 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3hq2 s ALA 203 N -3.75 3.28 -0.32 7.82 0.00 -1.25 -4.14 121.76 123.40 3hq2 s ALA 203 Ca 0.68 0.40 0.01 0.00 0.00 0.00 0.00 51.96 53.05 3hq2 s ALA 203 Cb -0.02 -3.31 0.10 0.00 0.00 0.00 0.00 23.12 19.89 3hq2 s ALA 203 CO 0.47 -0.35 0.08 0.12 0.00 0.00 0.00 175.76 176.08 3hq2 s PHE 204 N 1.35 2.32 -0.24 0.00 5.99 0.39 -4.87 117.98 122.92 3hq2 s PHE 204 Ca 0.48 -2.11 -0.41 0.00 0.00 0.00 0.00 56.93 54.89 3hq2 s PHE 204 Cb -0.19 -2.07 -0.19 0.00 0.00 0.00 0.00 43.02 40.56 3hq2 s PHE 204 CO 0.23 -0.90 1.27 -0.35 -0.00 0.00 0.00 175.22 175.47 3hq2 n PRO 205 N 4.67 0.00 -0.11 10.12 -0.04 -1.26 -4.45 135.00 143.93 3hq2 n PRO 205 Ca -0.00 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.40 3hq2 n PRO 205 Cb 0.42 -1.42 0.01 0.00 -0.04 0.00 0.00 33.50 32.46 3hq2 n PRO 205 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3hq2 h LYS 206 N 3.80 -0.14 -0.88 0.54 3.64 -1.95 -0.15 116.57 121.44 3hq2 h LYS 206 Ca -0.45 0.01 0.22 0.00 -1.27 0.00 0.00 60.65 59.16 3hq2 h LYS 206 Cb 1.33 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 33.13 3hq2 h LYS 206 CO 0.77 -0.09 0.60 1.49 -2.27 0.00 0.00 179.45 179.95 3hq2 h GLU 207 N -0.15 0.21 0.06 1.90 4.57 -2.00 0.15 114.58 119.33 3hq2 h GLU 207 Ca 0.19 -0.01 -0.24 0.00 -1.18 0.00 0.00 59.36 58.12 3hq2 h GLU 207 Cb 0.44 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 3hq2 h GLU 207 CO -0.47 0.14 -1.09 0.87 -1.18 0.00 0.00 179.01 177.28 3hq2 h LYS 208 N 0.22 0.19 -0.26 1.92 1.79 -1.40 -2.94 116.57 116.09 3hq2 h LYS 208 Ca 0.44 -0.28 -0.09 0.00 -2.18 0.00 0.00 60.65 58.54 3hq2 h LYS 208 Cb 1.38 0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 32.12 3hq2 h LYS 208 CO -0.10 1.10 -0.23 1.96 -1.08 0.00 0.00 179.45 181.10 3hq2 h GLN 209 N 0.07 0.49 -0.55 3.15 4.20 -0.01 -2.20 115.11 120.26 3hq2 h GLN 209 Ca -0.08 -0.18 -0.04 0.00 0.06 0.00 0.00 58.65 58.42 3hq2 h GLN 209 Cb 1.80 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 29.52 3hq2 h GLN 209 CO 0.17 0.69 0.20 -0.22 -0.67 0.00 0.00 178.83 179.00 3hq2 h LYS 210 N 0.44 0.83 -0.73 1.46 3.64 -1.11 -1.42 116.57 119.68 3hq2 h LYS 210 Ca 0.07 -0.16 0.02 0.00 -1.27 0.00 0.00 60.65 59.31 3hq2 h LYS 210 Cb 0.64 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.29 3hq2 h LYS 210 CO 0.05 0.74 0.47 0.93 -2.27 0.00 0.00 179.45 179.37 3hq2 h GLU 211 N 0.75 0.92 -0.02 1.90 5.08 -1.26 -2.31 114.58 119.65 3hq2 h GLU 211 Ca 0.18 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3hq2 h GLU 211 Cb 0.23 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 3hq2 h GLU 211 CO -0.01 0.61 0.00 -0.07 -1.00 0.00 0.00 179.01 178.54 3hq2 h LEU 212 N 0.94 0.03 -0.62 1.33 3.38 -1.07 -0.99 115.31 118.31 3hq2 h LEU 212 Ca 0.28 -0.28 0.09 0.00 0.09 0.00 0.00 57.88 58.06 3hq2 h LEU 212 Cb -0.05 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.62 3hq2 h LEU 212 CO -0.08 0.31 0.25 0.28 0.09 0.00 0.00 178.44 179.28 3hq2 h SER 213 N -0.25 0.27 -0.51 -0.43 0.02 -1.15 0.63 113.55 112.14 3hq2 h SER 213 Ca 0.01 0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.99 3hq2 h SER 213 Cb 0.29 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 3hq2 h SER 213 CO 0.00 0.16 0.18 -0.07 -1.14 0.00 0.00 176.83 175.96 3hq2 h LEU 214 N 0.44 0.73 0.47 5.07 3.38 -1.39 -1.52 115.31 122.49 3hq2 h LEU 214 Ca 0.31 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 3hq2 h LEU 214 Cb 0.36 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 3hq2 h LEU 214 CO -0.29 0.72 -0.27 0.22 0.09 0.00 0.00 178.44 178.91 3hq2 h TYR 215 N 0.69 -0.70 -0.63 1.13 3.20 0.28 -1.87 116.97 119.08 3hq2 h TYR 215 Ca 0.17 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.11 3hq2 h TYR 215 Cb 0.24 0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.71 3hq2 h TYR 215 CO 0.01 -0.42 0.42 0.74 -1.64 0.00 0.00 178.16 177.27 3hq2 h PHE 216 N -0.69 0.55 0.11 -3.82 0.05 0.28 -0.07 116.94 113.34 3hq2 h PHE 216 Ca -0.06 0.01 -0.01 0.00 3.82 0.00 0.00 57.97 61.74 3hq2 h PHE 216 Cb 0.55 -0.18 0.00 0.00 2.00 0.00 0.00 35.95 38.33 3hq2 h PHE 216 CO -0.08 0.28 -0.05 -0.07 -0.18 0.00 0.00 178.31 178.21 3hq2 h LEU 217 N 0.53 -0.12 -0.27 1.54 3.38 -0.89 0.12 115.31 119.60 3hq2 h LEU 217 Ca 0.28 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.22 3hq2 h LEU 217 Cb 0.41 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 3hq2 h LEU 217 CO -0.09 -0.01 0.05 -0.61 0.09 0.00 0.00 178.44 177.88 3hq2 h GLN 218 N -0.23 0.15 -0.48 1.13 5.75 -0.43 -1.67 115.11 119.33 3hq2 h GLN 218 Ca -0.01 -0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.52 3hq2 h GLN 218 Cb 0.18 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.66 3hq2 h GLN 218 CO 0.02 0.10 0.24 0.93 -2.65 0.00 0.00 178.83 177.47 3hq2 h GLU 219 N 0.15 0.46 0.00 1.69 4.39 -0.86 -2.72 114.58 117.69 3hq2 h GLU 219 Ca 0.12 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.80 3hq2 h GLU 219 Cb 0.13 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 3hq2 h GLU 219 CO -0.17 0.30 0.00 1.28 -1.16 0.00 0.00 179.01 179.27 3hq2 n LEU 220 N -4.90 0.36 0.00 1.33 4.77 0.40 -4.73 117.00 114.23 3hq2 n LEU 220 Ca 0.04 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 3hq2 n LEU 220 Cb 0.13 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 3hq2 n LEU 220 CO 0.29 -0.22 0.00 0.61 -1.33 0.00 0.00 177.39 176.74 3hq2 n GLY 221 N 0.82 1.07 3.67 -0.72 0.00 -0.85 -4.96 105.19 104.23 3hq2 n GLY 221 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3hq2 n GLY 221 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3hq2 s TYR 222 N -2.00 2.55 -0.53 1.61 5.04 -0.69 -4.95 117.35 118.38 3hq2 s TYR 222 Ca 0.00 0.63 -0.28 0.00 -2.44 0.00 0.00 57.07 54.97 3hq2 s TYR 222 Cb 0.00 -3.73 0.03 0.00 0.35 0.00 0.00 41.96 38.61 3hq2 s TYR 222 CO 0.00 -2.83 1.23 0.34 -1.34 0.00 0.00 175.55 172.96 3hq2 s ASP 223 N 2.39 6.44 0.05 4.32 -1.08 -1.26 -4.54 116.67 122.99 3hq2 s ASP 223 Ca 0.66 0.30 0.20 0.00 -0.52 0.00 0.00 52.55 53.18 3hq2 s ASP 223 Cb -0.31 -2.55 0.82 0.00 -1.46 0.00 0.00 42.92 39.43 3hq2 s ASP 223 CO 0.25 -1.45 1.62 0.49 0.52 0.00 0.00 175.17 176.60 3hq2 n PHE 224 N 8.50 0.18 0.22 -5.34 3.01 -1.26 -1.98 117.46 120.80 3hq2 n PHE 224 Ca 0.11 0.07 0.12 0.00 1.01 0.00 0.00 57.45 58.75 3hq2 n PHE 224 Cb 0.49 -0.61 0.25 0.00 -0.01 0.00 0.00 39.48 39.60 3hq2 n PHE 224 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 3hq2 h ASP 225 N 0.00 0.00 -0.06 4.37 3.32 -1.96 -3.19 116.42 118.90 3hq2 h ASP 225 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 3hq2 h ASP 225 Cb 0.35 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 3hq2 h ASP 225 CO 0.00 0.05 -0.13 0.61 -1.72 0.00 0.00 179.24 178.05 3hq2 n GLY 226 N 0.91 4.85 0.00 2.75 0.00 -0.84 -4.96 105.19 107.91 3hq2 n GLY 226 Ca 0.03 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.87 3hq2 n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq2 n GLY 227 N -1.22 1.42 3.55 -0.02 0.00 -1.01 -0.18 105.19 107.73 3hq2 n GLY 227 Ca 0.19 -0.91 -0.06 0.00 0.00 0.00 0.00 46.02 45.23 3hq2 n GLY 227 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hq2 s ARG 228 N -1.81 0.56 -0.06 1.61 1.70 -1.26 -4.73 118.95 114.96 3hq2 s ARG 228 Ca 0.00 -0.19 0.03 0.00 -0.47 0.00 0.00 55.73 55.10 3hq2 s ARG 228 Cb 0.00 0.26 -0.02 0.00 -0.57 0.00 0.00 34.95 34.61 3hq2 s ARG 228 CO 0.00 -0.24 -0.16 -1.17 -1.08 0.00 0.00 175.30 172.65 3hq2 s LEU 229 N -2.28 2.64 0.14 -1.89 2.96 -1.26 -1.91 118.68 117.09 3hq2 s LEU 229 Ca 0.07 -0.26 -0.08 0.00 -0.22 0.00 0.00 54.13 53.64 3hq2 s LEU 229 Cb -0.01 -1.54 -0.01 0.00 0.50 0.00 0.00 46.19 45.13 3hq2 s LEU 229 CO -0.07 0.30 0.24 -1.81 -1.32 0.00 0.00 176.35 173.70 3hq2 s ASP 230 N -0.49 0.09 0.23 3.68 1.11 -1.07 -5.01 116.67 115.20 3hq2 s ASP 230 Ca 0.06 -0.86 -0.16 0.00 0.18 0.00 0.00 52.55 51.77 3hq2 s ASP 230 Cb -0.12 0.40 -0.08 0.00 1.07 0.00 0.00 42.92 44.19 3hq2 s ASP 230 CO 0.02 -0.84 0.67 -1.61 1.18 0.00 0.00 175.17 174.58 3hq2 s GLU 231 N -3.95 4.08 0.11 8.23 2.02 -1.26 -1.59 118.70 126.34 3hq2 s GLU 231 Ca 0.15 0.67 -0.18 0.00 0.02 0.00 0.00 54.97 55.63 3hq2 s GLU 231 Cb 0.04 -2.77 0.04 0.00 0.10 0.00 0.00 34.13 31.54 3hq2 s GLU 231 CO -0.02 0.36 0.45 0.99 0.02 0.00 0.00 175.26 177.06 3hq2 s THR 232 N -1.64 0.05 0.05 3.63 2.01 -0.66 -4.73 115.64 114.36 3hq2 s THR 232 Ca 0.44 -0.41 -0.23 0.00 0.31 0.00 0.00 61.69 61.80 3hq2 s THR 232 Cb -0.14 -1.08 -0.15 0.00 0.01 0.00 0.00 72.50 71.14 3hq2 s THR 232 CO 0.20 -0.23 1.54 0.58 -0.69 0.00 0.00 174.62 176.02 3hq2 h VAL 233 N 2.47 1.18 -3.65 3.82 2.07 -1.87 -3.39 116.25 116.89 3hq2 h VAL 233 Ca -0.33 -0.55 -0.63 0.00 0.82 0.00 0.00 66.70 66.01 3hq2 h VAL 233 Cb 1.25 1.45 -0.38 0.00 -1.52 0.00 0.00 31.29 32.08 3hq2 h VAL 233 CO 0.44 0.15 -0.77 -2.28 0.02 0.00 0.00 177.57 175.13 3hq2 s HIS 234 N -5.32 2.82 0.49 1.57 2.46 -1.26 -4.91 115.29 111.14 3hq2 s HIS 234 Ca -0.14 -2.15 -0.21 0.00 0.47 0.00 0.00 55.06 53.03 3hq2 s HIS 234 Cb 0.05 -1.96 -0.10 0.00 -0.13 0.00 0.00 32.58 30.44 3hq2 s HIS 234 CO 0.68 -0.85 0.67 -2.30 -2.47 0.00 0.00 174.74 170.48 3hq2 n PRO 235 N 4.54 0.74 -3.69 2.88 -0.02 -1.26 -5.00 135.00 133.19 3hq2 n PRO 235 Ca -0.08 0.28 -0.05 0.00 -2.02 0.00 0.00 63.50 61.62 3hq2 n PRO 235 Cb 0.43 -1.75 -0.02 0.00 -0.02 0.00 0.00 33.50 32.14 3hq2 n PRO 235 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3hq2 s PHE 236 N -1.53 -0.20 -0.05 6.00 -0.12 -1.23 -5.01 117.98 115.83 3hq2 s PHE 236 Ca 0.67 -0.07 0.02 0.00 -0.05 0.00 0.00 56.93 57.49 3hq2 s PHE 236 Cb -0.52 0.62 0.01 0.00 -0.63 0.00 0.00 43.02 42.51 3hq2 s PHE 236 CO 0.55 -0.80 -0.10 0.00 -0.05 0.00 0.00 175.22 174.82 3hq2 s ALA 237 N -3.33 1.07 0.03 1.99 0.00 -1.26 -1.96 121.76 118.31 3hq2 s ALA 237 Ca 0.10 -0.33 0.04 0.00 0.00 0.00 0.00 51.96 51.77 3hq2 s ALA 237 Cb -0.02 -0.49 -0.02 0.00 0.00 0.00 0.00 23.12 22.59 3hq2 s ALA 237 CO -0.01 0.10 -0.12 -0.08 0.00 0.00 0.00 175.76 175.65 3hq2 s THR 238 N 0.62 0.95 -0.35 0.00 -1.32 0.07 -5.00 115.64 110.61 3hq2 s THR 238 Ca -0.12 -0.90 -0.10 0.00 -1.21 0.00 0.00 61.69 59.36 3hq2 s THR 238 Cb -0.14 -0.87 0.02 0.00 -1.51 0.00 0.00 72.50 70.00 3hq2 s THR 238 CO 0.02 -0.02 0.17 -0.89 -2.21 0.00 0.00 174.62 171.70 3hq2 s THR 239 N -0.82 4.46 -0.11 5.08 2.01 -1.26 -0.52 115.64 124.48 3hq2 s THR 239 Ca 0.00 -0.77 -0.26 0.00 0.31 0.00 0.00 61.69 60.97 3hq2 s THR 239 Cb -0.07 -3.43 -0.28 0.00 0.01 0.00 0.00 72.50 68.73 3hq2 s THR 239 CO 0.01 -0.14 0.80 -0.07 -0.69 0.00 0.00 174.62 174.53 3hq2 h LEU 240 N 8.38 0.18 -7.08 4.42 3.38 -1.26 -3.47 115.31 119.85 3hq2 h LEU 240 Ca -0.27 -0.97 -0.04 0.00 0.09 0.00 0.00 57.88 56.69 3hq2 h LEU 240 Cb 1.11 -0.06 -0.14 0.00 0.09 0.00 0.00 40.66 41.66 3hq2 h LEU 240 CO 0.64 1.17 0.14 0.54 0.09 0.00 0.00 178.44 181.02 3hq2 s ASN 241 N -6.52 -0.52 0.51 -0.43 6.03 -1.14 -3.59 114.94 109.27 3hq2 s ASN 241 Ca -0.17 0.13 0.42 0.00 -1.03 0.00 0.00 52.86 52.21 3hq2 s ASN 241 Cb -0.01 0.55 1.63 0.00 -3.03 0.00 0.00 41.25 40.39 3hq2 s ASN 241 CO 0.74 -0.84 1.58 -0.09 -2.03 0.00 0.00 177.10 176.46 3hq2 h ARG 242 N 2.37 0.01 -0.51 3.55 9.65 -1.94 1.51 114.38 129.02 3hq2 h ARG 242 Ca -0.32 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.56 3hq2 h ARG 242 Cb 1.26 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.83 3hq2 h ARG 242 CO 0.40 0.01 0.00 0.41 2.80 0.00 0.00 179.97 183.58 3hq2 n GLY 243 N -1.74 1.56 2.59 2.80 0.00 -1.26 -4.66 105.19 104.47 3hq2 n GLY 243 Ca 0.42 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 3hq2 n GLY 243 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hq2 s ASP 244 N -1.12 2.27 -0.30 1.61 -1.08 0.52 -4.32 116.67 114.25 3hq2 s ASP 244 Ca 0.38 -1.88 0.01 0.00 -0.52 0.00 0.00 52.55 50.54 3hq2 s ASP 244 Cb 0.20 -0.01 0.07 0.00 -1.46 0.00 0.00 42.92 41.72 3hq2 s ASP 244 CO 0.27 -0.30 -0.03 -0.69 0.52 0.00 0.00 175.17 174.94 3hq2 s VAL 245 N 1.29 2.54 0.05 1.11 1.01 0.74 -0.70 120.40 126.44 3hq2 s VAL 245 Ca 0.17 -1.69 -0.02 0.00 0.00 0.00 0.00 61.98 60.44 3hq2 s VAL 245 Cb -0.20 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 3hq2 s VAL 245 CO -0.03 -0.19 0.24 -0.13 0.00 0.00 0.00 175.10 174.99 3hq2 s ARG 246 N 1.12 3.48 0.14 2.72 0.52 0.32 -4.10 118.95 123.15 3hq2 s ARG 246 Ca -0.04 -0.33 0.08 0.00 -0.52 0.00 0.00 55.73 54.93 3hq2 s ARG 246 Cb -0.20 -3.03 -0.04 0.00 0.52 0.00 0.00 34.95 32.21 3hq2 s ARG 246 CO -0.04 0.60 -0.18 0.14 0.02 0.00 0.00 175.30 175.85 3hq2 s VAL 247 N -1.47 1.68 0.02 3.52 -7.23 -0.80 -0.75 120.40 115.36 3hq2 s VAL 247 Ca 0.34 -1.78 -0.01 0.00 -1.81 0.00 0.00 61.98 58.72 3hq2 s VAL 247 Cb -0.13 -1.70 -0.02 0.00 0.56 0.00 0.00 36.38 35.09 3hq2 s VAL 247 CO 0.24 -0.28 -0.02 0.42 -0.31 0.00 0.00 175.10 175.16 3hq2 s THR 248 N -1.85 0.12 0.32 5.32 -4.23 -0.83 -2.61 115.64 111.89 3hq2 s THR 248 Ca 0.12 -0.99 0.07 0.00 -1.18 0.00 0.00 61.69 59.71 3hq2 s THR 248 Cb -0.07 -0.40 -0.03 0.00 1.34 0.00 0.00 72.50 73.35 3hq2 s THR 248 CO 0.05 -0.54 0.24 1.07 -0.54 0.00 0.00 174.62 174.90 3hq2 n THR 249 N 1.44 0.00 -4.27 3.99 5.66 -0.62 -3.56 114.28 116.92 3hq2 n THR 249 Ca -0.23 -2.27 -0.19 0.00 -3.05 0.00 0.00 64.05 58.31 3hq2 n THR 249 Cb 0.56 1.08 -0.15 0.00 -1.55 0.00 0.00 70.33 70.27 3hq2 n THR 249 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 3hq2 s ARG 250 N -3.30 0.73 0.07 1.09 3.52 -1.26 -1.66 118.95 118.14 3hq2 s ARG 250 Ca 0.34 -0.22 0.03 0.00 -0.13 0.00 0.00 55.73 55.75 3hq2 s ARG 250 Cb 0.02 -0.71 -0.04 0.00 -1.56 0.00 0.00 34.95 32.66 3hq2 s ARG 250 CO 0.24 0.08 0.04 0.71 -0.81 0.00 0.00 175.30 175.57 3hq2 s TYR 251 N 0.21 3.11 -0.19 5.12 1.51 -1.26 -3.33 117.35 122.51 3hq2 s TYR 251 Ca -0.03 0.05 -0.04 0.00 -1.01 0.00 0.00 57.07 56.04 3hq2 s TYR 251 Cb -0.07 -1.60 0.09 0.00 -0.11 0.00 0.00 41.96 40.26 3hq2 s TYR 251 CO 0.00 0.50 0.20 0.34 -1.11 0.00 0.00 175.55 175.48 3hq2 s ASP 252 N -2.25 1.52 0.06 2.29 2.15 -1.26 -5.01 116.67 114.17 3hq2 s ASP 252 Ca 0.27 -0.27 0.11 0.00 0.43 0.00 0.00 52.55 53.10 3hq2 s ASP 252 Cb -0.12 0.27 0.51 0.00 -0.30 0.00 0.00 42.92 43.28 3hq2 s ASP 252 CO 0.19 -0.33 1.36 -0.62 -0.17 0.00 0.00 175.17 175.60 3hq2 n GLU 253 N 5.31 0.04 -0.49 4.34 1.02 -1.26 -1.63 120.64 127.97 3hq2 n GLU 253 Ca -0.06 0.39 0.08 0.00 -0.02 0.00 0.00 57.16 57.55 3hq2 n GLU 253 Cb 0.49 -1.58 0.29 0.00 -0.02 0.00 0.00 31.44 30.62 3hq2 n GLU 253 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3hq2 n LYS 254 N -1.66 3.39 -2.71 3.49 4.76 -1.26 -0.46 118.16 123.72 3hq2 n LYS 254 Ca 0.02 -2.70 -0.02 0.00 -2.87 0.00 0.00 58.31 52.73 3hq2 n LYS 254 Cb 0.11 -1.76 0.03 0.00 -1.84 0.00 0.00 35.03 31.57 3hq2 n LYS 254 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3hq2 s ASP 255 N -1.21 -0.44 0.65 4.39 -1.08 -0.65 -4.35 116.67 113.98 3hq2 s ASP 255 Ca 0.43 -0.47 0.32 0.00 -0.52 0.00 0.00 52.55 52.31 3hq2 s ASP 255 Cb 0.29 0.58 1.77 0.00 -1.46 0.00 0.00 42.92 44.10 3hq2 s ASP 255 CO 0.18 -0.02 2.02 2.19 0.52 0.00 0.00 175.17 180.06 3hq2 h PHE 256 N 4.55 0.00 -0.18 -5.34 -5.15 -1.79 -2.29 116.94 106.74 3hq2 h PHE 256 Ca -0.00 0.00 0.02 0.00 -0.20 0.00 0.00 57.97 57.79 3hq2 h PHE 256 Cb 1.17 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.32 3hq2 h PHE 256 CO -0.06 0.00 0.05 0.00 -2.00 0.00 0.00 178.31 176.30 3hq2 h ARG 257 N 0.00 0.13 -0.71 6.09 3.08 -1.91 -2.70 114.38 118.36 3hq2 h ARG 257 Ca 0.03 -0.01 0.15 0.00 0.07 0.00 0.00 59.98 60.22 3hq2 h ARG 257 Cb 0.57 -0.03 -0.13 0.00 0.08 0.00 0.00 29.97 30.46 3hq2 h ARG 257 CO -0.00 0.08 -0.10 1.15 -1.07 0.00 0.00 179.97 180.04 3hq2 h THR 258 N 0.13 0.33 -0.03 2.04 2.02 -1.75 -0.69 112.91 114.96 3hq2 h THR 258 Ca 0.08 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.24 3hq2 h THR 258 Cb 0.06 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 66.75 3hq2 h THR 258 CO -0.09 0.01 -0.01 0.00 0.37 0.00 0.00 175.52 175.80 3hq2 h ALA 259 N 1.69 0.05 -0.00 6.16 0.00 -1.53 -1.73 119.26 123.89 3hq2 h ALA 259 Ca 0.36 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3hq2 h ALA 259 Cb 0.58 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3hq2 h ALA 259 CO -0.68 -0.25 -0.24 0.82 0.00 0.00 0.00 179.25 178.90 3hq2 h ILE 260 N -0.30 0.00 0.00 0.00 1.08 -0.98 0.41 117.51 117.72 3hq2 h ILE 260 Ca 0.01 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.44 3hq2 h ILE 260 Cb 0.40 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.14 3hq2 h ILE 260 CO 0.00 0.00 -0.17 -0.26 -0.69 0.00 0.00 178.15 177.04 3hq2 h PHE 261 N -0.30 0.00 -0.01 1.37 -1.00 -1.28 0.12 116.94 115.85 3hq2 h PHE 261 Ca 0.01 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.78 3hq2 h PHE 261 Cb 0.32 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.88 3hq2 h PHE 261 CO -0.43 0.17 -0.02 0.78 -1.61 0.00 0.00 178.31 177.19 3hq2 h GLY 262 N 1.26 0.03 0.78 -1.45 0.00 -0.94 0.90 103.07 103.66 3hq2 h GLY 262 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.29 3hq2 h GLY 262 CO 0.02 0.03 -0.20 -0.84 0.00 0.00 0.00 176.54 175.56 3hq2 h THR 263 N -0.59 0.57 -0.88 4.70 2.02 0.13 -0.30 112.91 118.55 3hq2 h THR 263 Ca -0.00 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.23 3hq2 h THR 263 Cb 0.65 0.57 -0.05 0.00 -1.74 0.00 0.00 68.15 67.57 3hq2 h THR 263 CO 0.00 0.00 0.57 0.40 0.37 0.00 0.00 175.52 176.87 3hq2 h ILE 264 N -0.44 1.10 0.19 3.11 2.04 -0.81 0.41 117.51 123.11 3hq2 h ILE 264 Ca -0.00 -0.36 0.01 0.00 1.00 0.00 0.00 64.86 65.51 3hq2 h ILE 264 Cb 0.41 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 3hq2 h ILE 264 CO -0.04 0.19 -0.21 -0.74 0.00 0.00 0.00 178.15 177.35 3hq2 h HIS 265 N 1.04 -0.56 -0.53 1.37 2.76 -0.07 -1.24 115.15 117.92 3hq2 h HIS 265 Ca 0.36 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.51 3hq2 h HIS 265 Cb 0.12 0.22 -0.03 0.00 1.55 0.00 0.00 27.41 29.27 3hq2 h HIS 265 CO -0.00 -0.31 0.21 0.93 -1.30 0.00 0.00 177.93 177.46 3hq2 h GLU 266 N -0.44 0.76 -0.21 5.26 4.39 -0.35 -0.15 114.58 123.83 3hq2 h GLU 266 Ca 0.00 -0.11 0.04 0.00 0.34 0.00 0.00 59.36 59.63 3hq2 h GLU 266 Cb 0.42 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 3hq2 h GLU 266 CO -0.06 0.63 0.15 0.00 -1.16 0.00 0.00 179.01 178.56 3hq2 h GLY 268 N 0.12 -1.24 0.08 0.00 0.00 0.16 -0.93 103.07 101.26 3hq2 h GLY 268 Ca 0.10 0.46 0.11 0.00 0.00 0.00 0.00 47.33 48.00 3hq2 h GLY 268 CO -0.01 -0.45 0.01 0.45 0.00 0.00 0.00 176.54 176.53 3hq2 h HIS 269 N -1.22 -0.02 0.02 5.60 -0.00 -1.37 -2.36 115.15 115.79 3hq2 h HIS 269 Ca -0.12 0.04 0.03 0.00 -0.00 0.00 0.00 60.37 60.32 3hq2 h HIS 269 Cb 0.91 0.10 -0.04 0.00 -0.00 0.00 0.00 27.41 28.38 3hq2 h HIS 269 CO 0.02 -0.13 -0.26 0.00 -0.00 0.00 0.00 177.93 177.57 3hq2 h ALA 270 N 1.49 -0.36 -0.74 2.45 0.00 -1.17 -0.71 119.26 120.22 3hq2 h ALA 270 Ca 0.28 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.33 3hq2 h ALA 270 Cb 0.44 0.45 -0.10 0.00 0.00 0.00 0.00 17.79 18.57 3hq2 h ALA 270 CO -0.46 -0.76 0.25 0.82 0.00 0.00 0.00 179.25 179.09 3hq2 h ILE 271 N -0.41 0.60 0.50 0.00 1.08 -0.67 0.66 117.51 119.28 3hq2 h ILE 271 Ca 0.06 -0.13 -0.01 0.00 -0.39 0.00 0.00 64.86 64.39 3hq2 h ILE 271 Cb 0.48 0.20 -0.02 0.00 -3.07 0.00 0.00 36.82 34.42 3hq2 h ILE 271 CO -0.21 0.07 -0.43 0.22 -0.69 0.00 0.00 178.15 177.11 3hq2 h TYR 272 N 0.37 -1.16 -0.83 1.37 5.03 -0.94 -2.74 116.97 118.07 3hq2 h TYR 272 Ca 0.41 0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.75 3hq2 h TYR 272 Cb 0.65 0.44 -0.05 0.00 1.55 0.00 0.00 36.73 39.33 3hq2 h TYR 272 CO -0.20 -0.60 0.54 0.93 -1.32 0.00 0.00 178.16 177.51 3hq2 h GLU 273 N -0.92 1.01 -0.23 1.82 4.39 0.07 -1.73 114.58 118.99 3hq2 h GLU 273 Ca -0.05 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.58 3hq2 h GLU 273 Cb 0.79 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 3hq2 h GLU 273 CO -0.02 0.67 0.00 1.04 -1.16 0.00 0.00 179.01 179.54 3hq2 n GLN 274 N -4.44 0.95 0.00 2.33 6.02 0.22 -3.40 117.38 119.06 3hq2 n GLN 274 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.09 3hq2 n GLN 274 Cb 0.09 -1.12 0.00 0.00 1.02 0.00 0.00 30.24 30.24 3hq2 n GLN 274 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3hq2 n ASN 275 N -0.37 0.00 -4.76 1.08 3.02 -0.68 -5.01 115.26 108.54 3hq2 n ASN 275 Ca 0.00 -1.00 -0.41 0.00 -0.03 0.00 0.00 54.58 53.14 3hq2 n ASN 275 Cb 0.06 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.20 3hq2 n ASN 275 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hq2 s ILE 276 N 0.00 3.09 -0.14 2.41 1.01 -1.04 -2.77 121.20 123.77 3hq2 s ILE 276 Ca 0.00 1.04 -0.42 0.00 0.00 0.00 0.00 60.65 61.27 3hq2 s ILE 276 Cb 0.00 -3.66 -0.20 0.00 0.01 0.00 0.00 42.46 38.61 3hq2 s ILE 276 CO 0.00 0.22 1.25 -0.67 0.00 0.00 0.00 174.94 175.74 3hq2 n ASP 277 N 1.43 0.48 0.30 3.58 -0.08 -0.70 -4.81 116.55 116.75 3hq2 n ASP 277 Ca 0.01 1.16 0.19 0.00 -1.51 0.00 0.00 54.79 54.65 3hq2 n ASP 277 Cb 0.43 -0.93 0.91 0.00 2.34 0.00 0.00 41.12 43.87 3hq2 n ASP 277 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 3hq2 h GLU 278 N 3.75 0.00 -0.29 -0.67 5.08 -1.91 -1.82 114.58 118.71 3hq2 h GLU 278 Ca -0.49 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.79 3hq2 h GLU 278 Cb 1.41 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.64 3hq2 h GLU 278 CO 0.75 0.00 -0.17 0.00 -1.00 0.00 0.00 179.01 178.59 3hq2 h ALA 279 N 2.01 1.15 0.00 3.43 0.00 -1.98 -2.24 119.26 121.63 3hq2 h ALA 279 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3hq2 h ALA 279 Cb 0.28 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3hq2 h ALA 279 CO 0.00 0.53 0.00 1.28 0.00 0.00 0.00 179.25 181.06 3hq2 n LEU 280 N -4.17 0.62 -4.44 0.00 4.77 -0.69 -4.88 117.00 108.22 3hq2 n LEU 280 Ca 0.00 0.59 -0.37 0.00 -0.03 0.00 0.00 56.01 56.20 3hq2 n LEU 280 Cb 0.36 -0.44 0.05 0.00 -2.33 0.00 0.00 43.42 41.06 3hq2 n LEU 280 CO 0.41 -0.29 -0.01 -0.24 -1.33 0.00 0.00 177.39 175.93 3hq2 n SER 281 N -2.12 -1.38 0.00 -1.43 2.88 -0.85 -1.25 113.62 109.47 3hq2 n SER 281 Ca 0.04 0.66 0.00 0.00 -1.33 0.00 0.00 58.87 58.24 3hq2 n SER 281 Cb 0.34 -1.16 0.00 0.00 -0.75 0.00 0.00 64.21 62.64 3hq2 n SER 281 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hq2 n GLY 282 N 1.82 0.36 1.57 0.46 0.00 -1.26 -4.94 105.19 103.19 3hq2 n GLY 282 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 3hq2 n GLY 282 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hq2 n THR 283 N -2.00 0.00 0.23 2.61 -2.24 -0.38 -3.22 114.28 109.27 3hq2 n THR 283 Ca 0.00 -1.00 0.09 0.00 -2.27 0.00 0.00 64.05 60.87 3hq2 n THR 283 Cb 0.00 0.08 0.55 0.00 -2.10 0.00 0.00 70.33 68.86 3hq2 n THR 283 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 3hq2 h ASN 284 N 0.46 0.00 -0.62 3.42 -1.24 -1.92 -3.15 115.58 112.53 3hq2 h ASN 284 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.84 3hq2 h ASN 284 Cb 0.54 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.59 3hq2 h ASN 284 CO 0.28 0.23 0.00 0.18 -1.29 0.00 0.00 177.43 176.83 3hq2 n LEU 285 N -3.76 3.78 -4.28 0.34 4.77 -1.26 -4.70 117.00 111.90 3hq2 n LEU 285 Ca -0.01 -1.86 -0.44 0.00 -0.03 0.00 0.00 56.01 53.67 3hq2 n LEU 285 Cb 0.33 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3hq2 n LEU 285 CO 0.34 0.91 1.45 -0.24 -1.33 0.00 0.00 177.39 178.52 3hq2 n SER 286 N 1.56 5.30 -3.63 -1.43 2.88 -1.19 -1.56 113.62 115.55 3hq2 n SER 286 Ca 0.23 -3.04 -0.06 0.00 -1.33 0.00 0.00 58.87 54.66 3hq2 n SER 286 Cb 0.61 -1.51 -0.02 0.00 -0.75 0.00 0.00 64.21 62.54 3hq2 n SER 286 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3hq2 s ASP 287 N 1.90 -0.28 0.46 -3.46 2.15 -1.26 -4.96 116.67 111.21 3hq2 s ASP 287 Ca 0.40 -0.21 -0.24 0.00 0.43 0.00 0.00 52.55 52.94 3hq2 s ASP 287 Cb -0.00 0.45 -0.07 0.00 -0.30 0.00 0.00 42.92 43.00 3hq2 s ASP 287 CO -0.00 -0.78 1.24 -0.83 -0.17 0.00 0.00 175.17 174.62 3hq2 s GLY 288 N -2.73 2.84 0.55 2.66 0.00 -1.26 -3.26 107.32 106.13 3hq2 s GLY 288 Ca 0.08 1.09 0.28 0.00 0.00 0.00 0.00 44.72 46.18 3hq2 s GLY 288 CO -0.03 1.60 1.94 0.00 0.00 0.00 0.00 173.10 176.60 3hq2 h ALA 289 N 2.11 2.49 0.00 3.20 0.00 -1.88 -3.45 119.26 121.73 3hq2 h ALA 289 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3hq2 h ALA 289 Cb 1.26 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3hq2 h ALA 289 CO 0.60 -0.80 0.00 -1.13 0.00 0.00 0.00 179.25 177.93 3hq2 n SER 290 N -4.14 0.00 -0.21 0.00 3.41 -1.26 -4.59 113.62 106.83 3hq2 n SER 290 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 3hq2 n SER 290 Cb 0.72 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.79 3hq2 n SER 290 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 3hq2 h MET 291 N 0.00 0.43 -0.30 4.33 0.00 -1.85 0.14 114.93 117.68 3hq2 h MET 291 Ca 0.00 -0.03 0.07 0.00 0.00 0.00 0.00 59.70 59.74 3hq2 h MET 291 Cb 0.00 -0.10 -0.08 0.00 0.00 0.00 0.00 31.60 31.43 3hq2 h MET 291 CO 0.00 0.29 -0.24 0.78 0.00 0.00 0.00 176.91 177.74 3hq2 h GLY 292 N 0.45 -0.11 2.00 8.32 0.00 -1.78 0.94 103.07 112.88 3hq2 h GLY 292 Ca 0.31 0.30 -0.09 0.00 0.00 0.00 0.00 47.33 47.86 3hq2 h GLY 292 CO -0.30 -0.20 -0.40 -2.22 0.00 0.00 0.00 176.54 173.42 3hq2 h ILE 293 N -0.22 1.22 -0.31 2.60 1.08 -1.66 -1.54 117.51 118.67 3hq2 h ILE 293 Ca 0.15 -1.42 -0.09 0.00 -0.39 0.00 0.00 64.86 63.11 3hq2 h ILE 293 Cb 0.46 1.78 -0.01 0.00 -3.07 0.00 0.00 36.82 35.98 3hq2 h ILE 293 CO -0.42 0.40 -0.16 -0.74 -0.69 0.00 0.00 178.15 176.53 3hq2 h HIS 294 N 0.00 0.76 0.00 1.37 2.76 0.12 -2.55 115.15 117.60 3hq2 h HIS 294 Ca -0.00 -0.19 -0.00 0.00 -2.20 0.00 0.00 60.37 57.97 3hq2 h HIS 294 Cb 0.75 -0.17 -0.00 0.00 1.55 0.00 0.00 27.41 29.53 3hq2 h HIS 294 CO 0.00 0.88 -0.02 0.93 -1.30 0.00 0.00 177.93 178.43 3hq2 h GLU 295 N 0.41 0.00 0.00 5.26 4.39 0.11 -1.70 114.58 123.06 3hq2 h GLU 295 Ca 0.07 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.75 3hq2 h GLU 295 Cb 0.69 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.34 3hq2 h GLU 295 CO 0.05 0.02 -0.10 0.66 -1.16 0.00 0.00 179.01 178.48 3hq2 h SER 296 N 0.00 0.00 0.13 1.42 4.64 -0.85 -0.48 113.55 118.41 3hq2 h SER 296 Ca -0.00 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.03 3hq2 h SER 296 Cb 0.44 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3hq2 h SER 296 CO 0.00 0.10 -1.49 1.56 -0.87 0.00 0.00 176.83 176.13 3hq2 h GLN 297 N 0.00 0.27 -0.21 4.77 1.08 -1.26 -1.88 115.11 117.89 3hq2 h GLN 297 Ca -0.00 -0.47 -0.03 0.00 -1.45 0.00 0.00 58.65 56.70 3hq2 h GLN 297 Cb 0.63 0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 28.23 3hq2 h GLN 297 CO 0.01 1.22 0.01 0.66 -0.95 0.00 0.00 178.83 179.79 3hq2 h SER 298 N -0.21 0.35 0.48 1.46 4.64 -1.43 -2.24 113.55 116.60 3hq2 h SER 298 Ca -0.31 -0.30 -0.07 0.00 -0.47 0.00 0.00 61.79 60.64 3hq2 h SER 298 Cb 1.83 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.82 3hq2 h SER 298 CO 0.08 0.56 -0.34 -0.07 -0.87 0.00 0.00 176.83 176.20 3hq2 h LEU 299 N 0.13 0.00 -0.46 5.97 3.38 -1.23 -0.13 115.31 122.99 3hq2 h LEU 299 Ca 0.06 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 3hq2 h LEU 299 Cb 0.38 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3hq2 h LEU 299 CO 0.01 0.34 0.09 0.15 0.09 0.00 0.00 178.44 179.12 3hq2 h PHE 300 N 0.00 0.79 0.15 1.13 3.57 -1.06 -0.20 116.94 121.32 3hq2 h PHE 300 Ca -0.00 -0.10 -0.01 0.00 3.53 0.00 0.00 57.97 61.39 3hq2 h PHE 300 Cb 0.67 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.20 3hq2 h PHE 300 CO 0.00 0.73 -0.07 1.88 -2.23 0.00 0.00 178.31 178.62 3hq2 h TYR 301 N 0.61 -0.19 0.47 0.41 -1.99 -1.01 -1.42 116.97 113.85 3hq2 h TYR 301 Ca 0.14 -0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.85 3hq2 h TYR 301 Cb 0.36 0.06 -0.02 0.00 2.00 0.00 0.00 36.73 39.14 3hq2 h TYR 301 CO 0.02 0.25 -0.39 1.49 -0.00 0.00 0.00 178.16 179.54 3hq2 h GLU 302 N -0.77 -0.82 0.00 4.88 4.81 -1.07 -0.94 114.58 120.67 3hq2 h GLU 302 Ca -0.02 0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3hq2 h GLU 302 Cb 0.53 0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.09 3hq2 h GLU 302 CO 0.03 -0.55 -0.04 -0.91 -0.73 0.00 0.00 179.01 176.82 3hq2 h ASN 303 N -0.85 0.00 0.00 1.04 2.35 -1.16 -1.97 115.58 114.99 3hq2 h ASN 303 Ca -0.05 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 3hq2 h ASN 303 Cb 0.73 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.10 3hq2 h ASN 303 CO -0.02 0.63 0.00 0.49 -1.65 0.00 0.00 177.43 176.89 3hq2 n PHE 304 N -4.73 0.00 0.13 1.19 3.01 -0.54 -2.37 117.46 114.15 3hq2 n PHE 304 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 3hq2 n PHE 304 Cb 0.12 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 3hq2 n PHE 304 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 3hq2 n ILE 305 N -0.26 0.00 -0.06 4.37 5.41 -1.19 -4.76 119.36 122.87 3hq2 n ILE 305 Ca 0.00 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.86 3hq2 n ILE 305 Cb 0.08 -0.33 0.50 0.00 -0.71 0.00 0.00 39.64 39.18 3hq2 n ILE 305 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 3hq2 h GLY 306 N 0.00 0.54 -3.28 7.39 0.00 -0.46 -1.05 103.07 106.20 3hq2 h GLY 306 Ca 0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 47.33 47.07 3hq2 h GLY 306 CO 0.00 0.11 0.11 0.54 0.00 0.00 0.00 176.54 177.29 3hq2 n ARG 307 N -4.47 4.06 -3.72 4.80 1.74 -0.81 -4.86 116.66 113.39 3hq2 n ARG 307 Ca 0.09 -3.10 -0.37 0.00 -0.77 0.00 0.00 57.85 53.70 3hq2 n ARG 307 Cb 0.34 -2.18 -0.11 0.00 -1.02 0.00 0.00 32.46 29.49 3hq2 n ARG 307 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3hq2 s ASN 308 N -1.11 5.68 0.60 0.55 3.84 -0.40 -4.95 114.94 119.14 3hq2 s ASN 308 Ca 0.53 -0.04 0.29 0.00 0.21 0.00 0.00 52.86 53.85 3hq2 s ASN 308 Cb 0.42 -2.03 1.55 0.00 -0.55 0.00 0.00 41.25 40.64 3hq2 s ASN 308 CO 0.13 0.01 1.95 0.07 -2.79 0.00 0.00 177.10 176.47 3hq2 h LYS 309 N 7.92 0.00 0.00 0.43 2.10 -1.89 0.17 116.57 125.30 3hq2 h LYS 309 Ca -0.37 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.24 3hq2 h LYS 309 Cb 1.18 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.50 3hq2 h LYS 309 CO 0.60 0.00 -0.19 0.45 -2.00 0.00 0.00 179.45 178.31 3hq2 h HIS 310 N 0.00 0.00 0.00 0.07 3.86 -1.91 -2.73 115.15 114.44 3hq2 h HIS 310 Ca 0.15 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.33 3hq2 h HIS 310 Cb 0.93 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.39 3hq2 h HIS 310 CO 0.00 0.19 -0.14 0.35 0.86 0.00 0.00 177.93 179.19 3hq2 h PHE 311 N 0.00 0.00 0.00 2.45 3.57 -0.89 -2.76 116.94 119.31 3hq2 h PHE 311 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3hq2 h PHE 311 Cb 0.95 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.69 3hq2 h PHE 311 CO 0.00 0.14 -0.61 0.91 -2.23 0.00 0.00 178.31 176.52 3hq2 n TRP 312 N -4.11 0.19 0.08 0.41 7.02 -1.03 -4.22 117.44 115.78 3hq2 n TRP 312 Ca -0.02 0.06 -0.12 0.00 -1.02 0.00 0.00 57.50 56.39 3hq2 n TRP 312 Cb 0.22 -0.39 -0.05 0.00 -2.42 0.00 0.00 31.31 28.67 3hq2 n TRP 312 CO 0.00 0.00 0.00 1.15 -2.02 0.00 0.00 177.69 176.82 3hq2 h THR 313 N 0.00 0.44 0.00 -0.99 2.02 -1.51 0.14 112.91 113.01 3hq2 h THR 313 Ca 0.00 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.05 3hq2 h THR 313 Cb 0.60 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 3hq2 h THR 313 CO 0.00 0.00 -0.61 1.55 0.37 0.00 0.00 175.52 176.83 3hq2 h PRO 314 N -0.42 0.00 0.00 6.66 0.13 -1.76 -3.34 132.00 133.27 3hq2 h PRO 314 Ca 0.05 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.08 3hq2 h PRO 314 Cb 0.47 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.58 3hq2 h PRO 314 CO -0.18 0.61 -1.26 0.66 -0.23 0.00 0.00 178.00 177.60 3hq2 n TYR 315 N -3.59 0.96 -0.04 1.56 4.02 -1.08 -4.21 117.16 114.78 3hq2 n TYR 315 Ca -0.00 0.30 0.20 0.00 -0.01 0.00 0.00 57.90 58.38 3hq2 n TYR 315 Cb 0.66 -1.02 0.66 0.00 -0.02 0.00 0.00 39.34 39.61 3hq2 n TYR 315 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 3hq2 h TYR 316 N 0.00 0.08 -0.63 -0.72 3.20 -0.85 0.09 116.97 118.14 3hq2 h TYR 316 Ca -0.09 0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.81 3hq2 h TYR 316 Cb 1.33 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 39.53 3hq2 h TYR 316 CO 0.00 0.03 0.38 -0.22 -1.64 0.00 0.00 178.16 176.71 3hq2 h LYS 317 N 0.07 0.72 0.28 1.82 1.63 -1.80 -0.89 116.57 118.40 3hq2 h LYS 317 Ca 0.28 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 60.02 3hq2 h LYS 317 Cb 1.01 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.48 3hq2 h LYS 317 CO -0.02 0.48 -0.13 0.87 -3.45 0.00 0.00 179.45 177.19 3hq2 h LYS 318 N 0.74 -0.36 -0.72 1.90 1.57 -1.24 -2.56 116.57 115.90 3hq2 h LYS 318 Ca 0.26 0.02 0.15 0.00 -1.87 0.00 0.00 60.65 59.21 3hq2 h LYS 318 Cb 0.05 0.08 -0.10 0.00 0.08 0.00 0.00 32.23 32.34 3hq2 h LYS 318 CO -0.12 -0.11 0.20 0.82 -0.57 0.00 0.00 179.45 179.68 3hq2 h ILE 319 N -0.57 0.56 -0.68 1.86 5.03 -1.17 0.76 117.51 123.29 3hq2 h ILE 319 Ca -0.04 -0.11 -0.01 0.00 -0.12 0.00 0.00 64.86 64.59 3hq2 h ILE 319 Cb 0.42 0.23 -0.03 0.00 -3.03 0.00 0.00 36.82 34.40 3hq2 h ILE 319 CO 0.06 0.06 0.40 1.56 -0.68 0.00 0.00 178.15 179.55 3hq2 h GLN 320 N 0.31 0.93 0.00 2.37 4.20 -1.08 -2.62 115.11 119.21 3hq2 h GLN 320 Ca 0.40 -0.08 -0.15 0.00 0.06 0.00 0.00 58.65 58.88 3hq2 h GLN 320 Cb 0.66 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 3hq2 h GLN 320 CO -0.47 0.66 -0.73 0.93 -0.67 0.00 0.00 178.83 178.54 3hq2 h GLU 321 N 0.94 0.00 -0.31 1.46 5.08 -0.51 -2.03 114.58 119.21 3hq2 h GLU 321 Ca 0.25 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.55 3hq2 h GLU 321 Cb -0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3hq2 h GLU 321 CO -0.05 0.73 -0.04 0.00 -1.00 0.00 0.00 179.01 178.66 3hq2 h ALA 322 N 1.27 0.42 -2.27 3.43 0.00 -0.73 -3.35 119.26 118.03 3hq2 h ALA 322 Ca -0.01 -0.26 -0.59 0.00 0.00 0.00 0.00 54.91 54.05 3hq2 h ALA 322 Cb 1.37 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 18.64 3hq2 h ALA 322 CO 0.10 0.22 -0.86 0.45 0.00 0.00 0.00 179.25 179.15 3hq2 n SER 323 N -4.51 1.47 -0.03 0.00 2.88 -1.10 -4.88 113.62 107.46 3hq2 n SER 323 Ca -0.03 -2.92 -0.03 0.00 -1.33 0.00 0.00 58.87 54.57 3hq2 n SER 323 Cb 0.30 -0.65 -0.02 0.00 -0.75 0.00 0.00 64.21 63.09 3hq2 n SER 323 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3hq2 h PRO 324 N 4.55 -0.08 -0.69 -1.46 0.13 -1.50 -2.82 132.00 130.12 3hq2 h PRO 324 Ca 0.16 0.01 0.20 0.00 -0.87 0.00 0.00 66.00 65.49 3hq2 h PRO 324 Cb 0.81 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.93 3hq2 h PRO 324 CO 0.59 -0.06 0.74 0.28 -0.23 0.00 0.00 178.00 179.33 3hq2 h VAL 325 N -0.09 0.24 0.05 1.56 2.07 -1.96 -0.31 116.25 117.81 3hq2 h VAL 325 Ca 0.01 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.45 3hq2 h VAL 325 Cb 0.13 0.41 0.01 0.00 -1.52 0.00 0.00 31.29 30.31 3hq2 h VAL 325 CO -0.12 0.00 -0.35 -0.61 0.02 0.00 0.00 177.57 176.51 3hq2 h GLN 326 N 0.00 0.15 -0.67 1.57 4.15 -1.84 -3.35 115.11 115.13 3hq2 h GLN 326 Ca 0.33 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.52 3hq2 h GLN 326 Cb 1.81 0.08 0.00 0.00 0.21 0.00 0.00 27.48 29.58 3hq2 h GLN 326 CO -0.00 1.07 0.00 1.19 -1.93 0.00 0.00 178.83 179.16 3hq2 n PHE 327 N -4.41 1.18 -1.68 3.99 3.01 -0.90 -4.81 117.46 113.84 3hq2 n PHE 327 Ca -0.11 -0.56 -0.43 0.00 1.01 0.00 0.00 57.45 57.37 3hq2 n PHE 327 Cb 0.61 -0.12 -0.03 0.00 -0.01 0.00 0.00 39.48 39.93 3hq2 n PHE 327 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 3hq2 n LYS 328 N 1.32 2.79 -2.16 -1.08 4.81 -0.18 -1.66 118.16 122.01 3hq2 n LYS 328 Ca 0.24 1.02 -0.17 0.00 -0.87 0.00 0.00 58.31 58.53 3hq2 n LYS 328 Cb 0.74 -2.94 -0.02 0.00 0.02 0.00 0.00 35.03 32.83 3hq2 n LYS 328 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3hq2 n ASP 329 N 6.53 -5.08 -4.71 3.14 9.92 -1.26 -4.99 116.55 120.09 3hq2 n ASP 329 Ca 0.19 0.07 -0.36 0.00 -0.53 0.00 0.00 54.79 54.17 3hq2 n ASP 329 Cb 0.38 -4.15 -0.08 0.00 -0.64 0.00 0.00 41.12 36.63 3hq2 n ASP 329 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3hq2 s ILE 330 N -2.82 5.37 0.31 0.53 1.09 -0.66 -5.06 121.20 119.96 3hq2 s ILE 330 Ca 0.00 0.28 -0.29 0.00 -1.10 0.00 0.00 60.65 59.54 3hq2 s ILE 330 Cb 0.00 -3.52 -0.10 0.00 -1.06 0.00 0.00 42.46 37.78 3hq2 s ILE 330 CO 0.00 0.40 1.26 -0.55 -0.10 0.00 0.00 174.94 175.95 3hq2 s SER 331 N 0.55 6.91 0.28 3.58 0.15 -1.26 -4.85 113.70 119.06 3hq2 s SER 331 Ca 0.10 2.56 0.03 0.00 0.70 0.00 0.00 55.95 59.34 3hq2 s SER 331 Cb -0.12 -2.64 0.68 0.00 -1.71 0.00 0.00 66.02 62.23 3hq2 s SER 331 CO 0.01 -0.43 1.72 0.25 1.20 0.00 0.00 173.24 175.98 3hq2 h LEU 332 N 3.63 0.43 -0.43 3.45 5.85 -1.98 0.30 115.31 126.55 3hq2 h LEU 332 Ca -0.48 0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.38 3hq2 h LEU 332 Cb 1.22 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.31 3hq2 h LEU 332 CO 0.67 0.08 0.28 -0.78 -0.34 0.00 0.00 178.44 178.35 3hq2 h ASP 333 N 0.49 0.49 -0.58 1.25 -0.00 -2.01 -1.93 116.42 114.13 3hq2 h ASP 333 Ca 0.54 -0.01 -0.05 0.00 -0.00 0.00 0.00 57.03 57.51 3hq2 h ASP 333 Cb 0.95 -0.12 -0.02 0.00 -0.00 0.00 0.00 39.33 40.13 3hq2 h ASP 333 CO -0.47 0.35 0.18 0.44 -0.00 0.00 0.00 179.24 179.74 3hq2 h ASP 334 N 0.58 0.85 0.11 2.28 3.32 -1.00 -2.43 116.42 120.13 3hq2 h ASP 334 Ca 0.16 -0.21 0.01 0.00 0.02 0.00 0.00 57.03 57.02 3hq2 h ASP 334 Cb -0.06 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 39.22 3hq2 h ASP 334 CO -0.04 0.83 -0.52 0.15 -1.72 0.00 0.00 179.24 177.94 3hq2 h PHE 335 N 0.82 -1.52 -0.99 4.55 3.57 -0.03 0.19 116.94 123.53 3hq2 h PHE 335 Ca 0.19 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.75 3hq2 h PHE 335 Cb 0.29 0.65 -0.05 0.00 2.79 0.00 0.00 35.95 39.62 3hq2 h PHE 335 CO 0.02 -0.59 0.65 -0.39 -2.23 0.00 0.00 178.31 175.77 3hq2 h VAL 336 N -0.74 1.21 -0.47 1.41 -1.51 -1.36 0.18 116.25 114.97 3hq2 h VAL 336 Ca -0.01 -0.44 -0.01 0.00 -1.23 0.00 0.00 66.70 65.01 3hq2 h VAL 336 Cb 0.75 -0.20 -0.02 0.00 -2.13 0.00 0.00 31.29 29.68 3hq2 h VAL 336 CO -0.29 0.24 0.23 0.03 -1.23 0.00 0.00 177.57 176.55 3hq2 h ARG 337 N 1.29 0.64 -0.14 5.19 3.08 -0.89 -0.96 114.38 122.59 3hq2 h ARG 337 Ca 0.38 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.33 3hq2 h ARG 337 Cb -0.06 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.86 3hq2 h ARG 337 CO -0.11 0.49 -0.06 0.00 -1.07 0.00 0.00 179.97 179.23 3hq2 h ALA 338 N 1.61 0.20 0.31 0.04 0.00 0.10 -3.07 119.26 118.45 3hq2 h ALA 338 Ca 0.16 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3hq2 h ALA 338 Cb 0.05 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3hq2 h ALA 338 CO -0.02 -0.02 -0.44 0.82 0.00 0.00 0.00 179.25 179.59 3hq2 h ILE 339 N -0.03 0.13 0.00 0.00 1.08 -0.39 -2.60 117.51 115.71 3hq2 h ILE 339 Ca 0.03 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.50 3hq2 h ILE 339 Cb 0.51 0.13 0.00 0.00 -3.07 0.00 0.00 36.82 34.39 3hq2 h ILE 339 CO 0.02 0.00 0.00 0.59 -0.69 0.00 0.00 178.15 178.07 3hq2 n ASN 340 N -5.50 2.69 -4.69 1.72 5.03 -0.42 -4.87 115.26 109.22 3hq2 n ASN 340 Ca -0.10 -1.94 -0.42 0.00 0.87 0.00 0.00 54.58 52.99 3hq2 n ASN 340 Cb 0.41 -0.48 -0.03 0.00 -1.02 0.00 0.00 39.78 38.65 3hq2 n ASN 340 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 3hq2 s GLU 341 N -0.09 4.24 -0.19 3.52 2.12 -0.98 -4.96 118.70 122.36 3hq2 s GLU 341 Ca 0.00 2.12 -0.08 0.00 0.36 0.00 0.00 54.97 57.36 3hq2 s GLU 341 Cb 0.00 -3.60 -0.04 0.00 0.26 0.00 0.00 34.13 30.75 3hq2 s GLU 341 CO 0.00 -0.65 0.08 0.45 -0.54 0.00 0.00 175.26 174.60 3hq2 s SER 342 N 2.14 5.78 -0.27 -1.70 0.15 -1.26 -4.70 113.70 113.85 3hq2 s SER 342 Ca 0.68 0.11 -0.26 0.00 0.70 0.00 0.00 55.95 57.18 3hq2 s SER 342 Cb -0.35 -2.00 0.13 0.00 -1.71 0.00 0.00 66.02 62.09 3hq2 s SER 342 CO 0.29 0.16 1.08 -1.59 1.20 0.00 0.00 173.24 174.38 3hq2 s LYS 343 N 0.45 0.46 0.22 5.44 -2.85 -1.26 -4.93 119.74 117.28 3hq2 s LYS 343 Ca 0.05 0.47 -0.31 0.00 -1.00 0.00 0.00 55.97 55.17 3hq2 s LYS 343 Cb -0.12 0.23 -0.11 0.00 -2.06 0.00 0.00 37.83 35.76 3hq2 s LYS 343 CO 0.00 -0.07 1.62 -1.25 0.10 0.00 0.00 175.35 175.74 3hq2 s PRO 344 N -0.00 4.16 0.13 1.78 0.04 -1.26 -4.70 135.00 135.15 3hq2 s PRO 344 Ca 0.03 2.50 -0.01 0.00 0.04 0.00 0.00 61.00 63.56 3hq2 s PRO 344 Cb -0.04 -3.08 -0.04 0.00 0.04 0.00 0.00 34.50 31.37 3hq2 s PRO 344 CO -0.06 -0.65 0.05 -1.54 0.04 0.00 0.00 177.00 174.84 3hq2 s SER 345 N 0.89 0.36 0.19 6.66 1.04 -1.26 -5.04 113.70 116.53 3hq2 s SER 345 Ca 0.69 -1.20 0.08 0.00 0.48 0.00 0.00 55.95 56.00 3hq2 s SER 345 Cb -0.47 0.28 0.04 0.00 0.10 0.00 0.00 66.02 65.97 3hq2 s SER 345 CO 0.37 -0.72 1.42 -0.26 0.98 0.00 0.00 173.24 175.04 3hq2 h PHE 346 N 2.87 0.02 -3.78 5.02 0.04 -1.94 -3.45 116.94 115.72 3hq2 h PHE 346 Ca -0.35 -0.01 -0.66 0.00 2.80 0.00 0.00 57.97 59.75 3hq2 h PHE 346 Cb 1.20 -0.00 -0.18 0.00 2.20 0.00 0.00 35.95 39.17 3hq2 h PHE 346 CO 0.44 0.84 -0.45 0.42 -0.60 0.00 0.00 178.31 178.96 3hq2 s ILE 347 N -3.12 5.27 0.11 -0.55 -1.09 -1.26 -4.87 121.20 115.69 3hq2 s ILE 347 Ca -0.00 0.01 -0.31 0.00 -2.23 0.00 0.00 60.65 58.12 3hq2 s ILE 347 Cb 0.11 -3.66 -0.11 0.00 -1.58 0.00 0.00 42.46 37.22 3hq2 s ILE 347 CO 0.80 0.09 1.59 -0.09 -1.23 0.00 0.00 174.94 176.10 3hq2 h ARG 348 N 8.42 -0.66 -0.62 2.79 2.43 -1.95 -0.20 114.38 124.58 3hq2 h ARG 348 Ca -0.33 0.05 0.18 0.00 -0.81 0.00 0.00 59.98 59.07 3hq2 h ARG 348 Cb 1.17 0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.84 3hq2 h ARG 348 CO 0.61 -0.44 0.62 0.28 -1.51 0.00 0.00 179.97 179.52 3hq2 h VAL 349 N -0.69 0.34 -0.10 0.20 2.07 -1.98 -1.21 116.25 114.88 3hq2 h VAL 349 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.53 3hq2 h VAL 349 Cb 0.69 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 3hq2 h VAL 349 CO -0.19 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 176.78 3hq2 n GLU 350 N -3.74 1.12 -1.09 1.57 1.02 -0.75 -4.91 120.64 113.86 3hq2 n GLU 350 Ca 0.12 -1.38 -0.31 0.00 -0.02 0.00 0.00 57.16 55.58 3hq2 n GLU 350 Cb 0.85 -1.22 0.13 0.00 -0.02 0.00 0.00 31.44 31.17 3hq2 n GLU 350 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hq2 s ALA 351 N -0.92 1.75 0.84 0.62 0.00 -0.16 -5.00 121.76 118.89 3hq2 s ALA 351 Ca 0.15 0.22 -0.12 0.00 0.00 0.00 0.00 51.96 52.21 3hq2 s ALA 351 Cb 0.10 -3.29 0.10 0.00 0.00 0.00 0.00 23.12 20.03 3hq2 s ALA 351 CO 0.14 -2.25 1.17 0.16 0.00 0.00 0.00 175.76 174.98 3hq2 s ASP 352 N -3.20 4.16 0.33 0.00 -4.77 -1.26 -4.84 116.67 107.08 3hq2 s ASP 352 Ca 0.63 0.82 0.03 0.00 -3.30 0.00 0.00 52.55 50.73 3hq2 s ASP 352 Cb -0.19 -1.33 0.58 0.00 -1.09 0.00 0.00 42.92 40.89 3hq2 s ASP 352 CO 0.57 -2.13 1.91 -0.33 0.70 0.00 0.00 175.17 175.90 3hq2 h GLU 353 N -1.21 0.68 -0.03 2.11 5.08 -1.93 -1.58 114.58 117.71 3hq2 h GLU 353 Ca -0.47 -0.11 -0.12 0.00 -1.00 0.00 0.00 59.36 57.66 3hq2 h GLU 353 Cb 1.33 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 30.47 3hq2 h GLU 353 CO 0.64 0.59 -0.46 1.25 -1.00 0.00 0.00 179.01 180.03 3hq2 h LEU 354 N 0.67 0.45 0.00 1.33 5.85 -1.96 -3.31 115.31 118.35 3hq2 h LEU 354 Ca 0.16 -0.72 0.00 0.00 0.84 0.00 0.00 57.88 58.16 3hq2 h LEU 354 Cb 0.18 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.07 3hq2 h LEU 354 CO -0.01 1.11 -0.08 0.71 -0.34 0.00 0.00 178.44 179.83 3hq2 h THR 355 N -0.17 0.00 -0.38 1.05 1.35 -1.90 -3.38 112.91 109.47 3hq2 h THR 355 Ca -0.05 -0.70 0.07 0.00 -0.55 0.00 0.00 66.41 65.19 3hq2 h THR 355 Cb 1.16 1.65 -0.09 0.00 -1.73 0.00 0.00 68.15 69.14 3hq2 h THR 355 CO 0.09 0.00 -0.36 0.22 -0.25 0.00 0.00 175.52 175.23 3hq2 h TYR 356 N 0.00 -1.00 -1.01 4.73 3.20 -1.37 -2.57 116.97 118.95 3hq2 h TYR 356 Ca 0.00 0.06 0.23 0.00 3.14 0.00 0.00 58.73 62.16 3hq2 h TYR 356 Cb 0.85 0.49 -0.12 0.00 1.54 0.00 0.00 36.73 39.50 3hq2 h TYR 356 CO 0.00 -0.40 0.60 -1.35 -1.64 0.00 0.00 178.16 175.37 3hq2 h PRO 357 N -0.29 0.60 -0.95 1.82 0.11 -1.79 -0.74 132.00 130.76 3hq2 h PRO 357 Ca 0.16 -0.04 0.11 0.00 0.11 0.00 0.00 66.00 66.34 3hq2 h PRO 357 Cb 0.56 -0.14 -0.07 0.00 0.11 0.00 0.00 31.00 31.46 3hq2 h PRO 357 CO -0.54 0.40 0.61 -0.07 -0.21 0.00 0.00 178.00 178.19 3hq2 h LEU 358 N 0.62 0.86 -0.45 2.35 3.38 -1.74 -0.89 115.31 119.44 3hq2 h LEU 358 Ca 0.63 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.64 3hq2 h LEU 358 Cb 1.16 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 3hq2 h LEU 358 CO -0.45 0.48 0.29 0.45 0.09 0.00 0.00 178.44 179.30 3hq2 h HIS 359 N 0.93 0.55 -0.15 1.13 3.86 -1.20 0.75 115.15 121.03 3hq2 h HIS 359 Ca 0.46 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.68 3hq2 h HIS 359 Cb 0.47 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 3hq2 h HIS 359 CO -0.00 0.34 0.08 0.82 0.86 0.00 0.00 177.93 180.03 3hq2 h ILE 360 N 0.59 1.09 -0.62 2.45 1.08 -1.24 -1.87 117.51 118.98 3hq2 h ILE 360 Ca 0.17 -0.23 0.09 0.00 -0.39 0.00 0.00 64.86 64.51 3hq2 h ILE 360 Cb -0.05 0.97 -0.07 0.00 -3.07 0.00 0.00 36.82 34.60 3hq2 h ILE 360 CO -0.05 0.08 0.24 0.40 -0.69 0.00 0.00 178.15 178.13 3hq2 h ILE 361 N 0.15 0.78 -0.12 -0.67 2.04 -0.62 0.20 117.51 119.27 3hq2 h ILE 361 Ca 0.05 -0.15 0.03 0.00 1.00 0.00 0.00 64.86 65.80 3hq2 h ILE 361 Cb 0.05 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.41 3hq2 h ILE 361 CO -0.01 0.08 -0.08 0.40 0.00 0.00 0.00 178.15 178.54 3hq2 h ILE 362 N 0.43 0.76 -0.69 -0.67 2.04 -0.49 -1.04 117.51 117.86 3hq2 h ILE 362 Ca 0.31 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.13 3hq2 h ILE 362 Cb 0.38 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 3hq2 h ILE 362 CO -0.30 0.00 0.26 0.03 0.00 0.00 0.00 178.15 178.14 3hq2 h ARG 363 N -0.08 1.04 -0.29 2.37 3.08 -0.59 -1.65 114.38 118.26 3hq2 h ARG 363 Ca 0.07 -0.20 0.05 0.00 0.07 0.00 0.00 59.98 59.98 3hq2 h ARG 363 Cb 0.19 -0.16 -0.05 0.00 0.08 0.00 0.00 29.97 30.03 3hq2 h ARG 363 CO -0.17 0.87 -0.01 -0.92 -1.07 0.00 0.00 179.97 178.66 3hq2 h TYR 364 N 0.98 -0.04 -0.41 3.04 3.20 -0.14 -0.80 116.97 122.81 3hq2 h TYR 364 Ca 0.23 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 62.02 3hq2 h TYR 364 Cb 0.23 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 3hq2 h TYR 364 CO 0.02 -0.06 -0.14 0.93 -1.64 0.00 0.00 178.16 177.27 3hq2 h GLU 365 N 0.07 0.81 -0.49 1.82 5.08 -1.03 0.72 114.58 121.56 3hq2 h GLU 365 Ca 0.14 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 3hq2 h GLU 365 Cb 0.19 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 3hq2 h GLU 365 CO -0.24 0.95 0.32 0.82 -1.00 0.00 0.00 179.01 179.86 3hq2 h ILE 366 N 0.63 1.13 -0.67 3.13 2.04 -1.08 -0.99 117.51 121.70 3hq2 h ILE 366 Ca 0.10 -0.25 -0.08 0.00 1.00 0.00 0.00 64.86 65.63 3hq2 h ILE 366 Cb 0.68 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 3hq2 h ILE 366 CO 0.05 0.13 0.10 -0.33 0.00 0.00 0.00 178.15 178.10 3hq2 h GLU 367 N 0.66 1.11 -0.59 2.37 5.08 -1.01 -0.03 114.58 122.17 3hq2 h GLU 367 Ca 0.18 -0.30 0.10 0.00 -1.00 0.00 0.00 59.36 58.34 3hq2 h GLU 367 Cb -0.06 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.02 3hq2 h GLU 367 CO -0.04 1.02 0.40 -0.22 -1.00 0.00 0.00 179.01 179.17 3hq2 h LYS 368 N 1.04 0.36 0.20 2.33 3.64 -0.19 -2.03 116.57 121.92 3hq2 h LYS 368 Ca 0.20 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 3hq2 h LYS 368 Cb 0.45 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 3hq2 h LYS 368 CO 0.01 0.24 -0.10 0.00 -2.27 0.00 0.00 179.45 177.34 3hq2 h ALA 369 N 1.70 -0.27 -1.34 5.00 0.00 -0.23 -3.18 119.26 120.95 3hq2 h ALA 369 Ca 0.28 -0.16 0.39 0.00 0.00 0.00 0.00 54.91 55.42 3hq2 h ALA 369 Cb 0.59 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 3hq2 h ALA 369 CO -0.07 -0.28 0.94 0.82 0.00 0.00 0.00 179.25 180.65 3hq2 h ILE 370 N -1.00 0.30 -0.29 0.00 2.04 -0.58 0.64 117.51 118.62 3hq2 h ILE 370 Ca -0.03 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.81 3hq2 h ILE 370 Cb 0.41 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 3hq2 h ILE 370 CO 0.04 0.01 0.00 0.49 0.00 0.00 0.00 178.15 178.70 3hq2 n PHE 371 N -4.28 0.36 -1.47 1.37 3.01 -0.80 -3.76 117.46 111.89 3hq2 n PHE 371 Ca 0.31 -0.19 0.03 0.00 1.01 0.00 0.00 57.45 58.61 3hq2 n PHE 371 Cb 1.37 -0.00 0.20 0.00 -0.01 0.00 0.00 39.48 41.04 3hq2 n PHE 371 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3hq2 n SER 372 N 1.42 2.13 -3.41 4.37 3.41 0.18 -4.61 113.62 117.11 3hq2 n SER 372 Ca 0.17 -3.75 -0.23 0.00 -0.26 0.00 0.00 58.87 54.80 3hq2 n SER 372 Cb 0.59 -0.56 -0.01 0.00 -0.26 0.00 0.00 64.21 63.97 3hq2 n SER 372 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3hq2 n ASN 373 N -1.13 -3.25 0.00 4.04 3.02 -1.10 -4.86 115.26 111.98 3hq2 n ASN 373 Ca 0.24 -0.40 0.11 0.00 -0.03 0.00 0.00 54.58 54.50 3hq2 n ASN 373 Cb 0.82 -2.71 0.08 0.00 -0.61 0.00 0.00 39.78 37.35 3hq2 n ASN 373 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hq2 n GLU 374 N -3.64 0.03 -3.85 3.52 1.02 -0.97 -4.94 120.64 111.80 3hq2 n GLU 374 Ca 0.00 -0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.02 3hq2 n GLU 374 Cb 0.53 -1.51 -0.11 0.00 -0.02 0.00 0.00 31.44 30.33 3hq2 n GLU 374 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3hq2 s VAL 375 N -3.02 0.04 0.20 2.62 0.11 -1.26 -4.98 120.40 114.12 3hq2 s VAL 375 Ca 0.09 -0.35 0.03 0.00 -2.93 0.00 0.00 61.98 58.81 3hq2 s VAL 375 Cb 0.17 -0.32 -0.03 0.00 -1.53 0.00 0.00 36.38 34.67 3hq2 s VAL 375 CO 0.78 -0.19 0.34 -0.94 -3.33 0.00 0.00 175.10 171.76 3hq2 s SER 376 N -0.65 6.34 0.38 3.54 1.04 -1.26 -4.72 113.70 118.36 3hq2 s SER 376 Ca -0.07 0.20 0.12 0.00 0.48 0.00 0.00 55.95 56.68 3hq2 s SER 376 Cb -0.04 -1.92 0.93 0.00 0.10 0.00 0.00 66.02 65.09 3hq2 s SER 376 CO 0.01 -0.03 1.86 0.58 0.98 0.00 0.00 173.24 176.64 3hq2 h VAL 377 N 1.41 0.76 -0.57 5.02 2.07 -1.98 -0.85 116.25 122.11 3hq2 h VAL 377 Ca -0.50 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 66.78 3hq2 h VAL 377 Cb 1.21 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 3hq2 h VAL 377 CO 0.66 0.10 0.17 -0.08 0.02 0.00 0.00 177.57 178.44 3hq2 h GLU 378 N 0.57 0.87 -0.19 1.57 4.81 -1.97 -2.83 114.58 117.40 3hq2 h GLU 378 Ca 0.46 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 3hq2 h GLU 378 Cb 0.91 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.15 3hq2 h GLU 378 CO -0.20 0.76 0.00 -0.25 -0.73 0.00 0.00 179.01 178.59 3hq2 n ASP 379 N -4.28 2.11 0.05 1.04 8.00 -0.37 -4.39 116.55 118.72 3hq2 n ASP 379 Ca 0.04 -1.77 -0.13 0.00 0.71 0.00 0.00 54.79 53.65 3hq2 n ASP 379 Cb 0.21 -0.12 -0.08 0.00 -0.02 0.00 0.00 41.12 41.11 3hq2 n ASP 379 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3hq2 h LEU 380 N 2.86 -0.05 -0.79 0.64 3.38 -1.18 -0.69 115.31 119.48 3hq2 h LEU 380 Ca 0.00 -0.09 0.11 0.00 0.09 0.00 0.00 57.88 57.98 3hq2 h LEU 380 Cb 0.62 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.31 3hq2 h LEU 380 CO 0.00 0.06 0.42 -0.65 0.09 0.00 0.00 178.44 178.36 3hq2 h PRO 381 N -0.16 0.66 -0.56 1.13 0.11 -1.78 0.72 132.00 132.13 3hq2 h PRO 381 Ca -0.01 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 3hq2 h PRO 381 Cb 0.14 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.08 3hq2 h PRO 381 CO 0.01 0.44 0.23 1.03 -0.21 0.00 0.00 178.00 179.49 3hq2 h SER 382 N 0.68 0.76 -0.48 -2.05 0.87 -1.81 0.54 113.55 112.08 3hq2 h SER 382 Ca 0.40 -0.17 -0.07 0.00 -1.23 0.00 0.00 61.79 60.72 3hq2 h SER 382 Cb 0.43 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 3hq2 h SER 382 CO -0.28 0.72 0.01 0.25 -0.53 0.00 0.00 176.83 177.00 3hq2 h LEU 383 N 0.76 0.81 0.66 2.23 5.85 0.17 -1.45 115.31 124.35 3hq2 h LEU 383 Ca 0.19 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 3hq2 h LEU 383 Cb 0.19 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3hq2 h LEU 383 CO -0.02 0.91 -0.48 -0.25 -0.34 0.00 0.00 178.44 178.26 3hq2 h TRP 384 N 0.69 -1.31 -0.97 1.25 2.91 0.74 -2.11 115.95 117.14 3hq2 h TRP 384 Ca 0.14 -0.00 0.16 0.00 1.13 0.00 0.00 58.89 60.31 3hq2 h TRP 384 Cb 0.49 0.49 -0.09 0.00 -0.51 0.00 0.00 29.16 29.53 3hq2 h TRP 384 CO 0.04 -0.69 0.61 -0.91 -1.03 0.00 0.00 178.44 176.46 3hq2 h ASN 385 N -1.10 0.77 -0.23 2.65 -0.26 -0.86 -1.77 115.58 114.78 3hq2 h ASN 385 Ca -0.09 0.06 -0.01 0.00 -0.56 0.00 0.00 56.30 55.71 3hq2 h ASN 385 Cb 0.90 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 38.07 3hq2 h ASN 385 CO 0.04 0.35 0.12 -0.61 -1.06 0.00 0.00 177.43 176.27 3hq2 h GLN 386 N 0.79 0.32 -0.71 0.81 5.75 -0.96 -2.81 115.11 118.31 3hq2 h GLN 386 Ca 0.52 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 59.00 3hq2 h GLN 386 Cb 0.76 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.21 3hq2 h GLN 386 CO -0.29 0.31 0.45 0.87 -2.65 0.00 0.00 178.83 177.52 3hq2 h LYS 387 N 0.26 0.87 0.00 1.69 1.79 -0.65 -0.94 116.57 119.59 3hq2 h LYS 387 Ca 0.08 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.49 3hq2 h LYS 387 Cb 0.08 -0.20 -0.00 0.00 -1.58 0.00 0.00 32.23 30.53 3hq2 h LYS 387 CO -0.01 0.58 -0.04 1.88 -1.08 0.00 0.00 179.45 180.78 3hq2 h TYR 388 N 0.90 0.00 0.12 -1.35 -1.99 -1.31 -1.31 116.97 112.04 3hq2 h TYR 388 Ca 0.28 0.00 -0.24 0.00 2.00 0.00 0.00 58.73 60.76 3hq2 h TYR 388 Cb -0.03 0.00 0.03 0.00 2.00 0.00 0.00 36.73 38.73 3hq2 h TYR 388 CO -0.03 0.04 -1.02 0.37 -0.00 0.00 0.00 178.16 177.51 3hq2 h GLN 389 N 0.00 0.47 -0.76 4.88 5.75 -0.90 0.79 115.11 125.35 3hq2 h GLN 389 Ca -0.00 -0.67 -0.01 0.00 -0.15 0.00 0.00 58.65 57.81 3hq2 h GLN 389 Cb 0.08 0.23 -0.04 0.00 1.07 0.00 0.00 27.48 28.82 3hq2 h GLN 389 CO 0.00 1.29 0.43 -0.44 -2.65 0.00 0.00 178.83 177.47 3hq2 h ASP 390 N -0.02 0.94 0.00 -0.69 5.19 -0.51 0.17 116.42 121.51 3hq2 h ASP 390 Ca -0.16 -0.09 -0.16 0.00 -0.62 0.00 0.00 57.03 55.99 3hq2 h ASP 390 Cb 1.75 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 40.99 3hq2 h ASP 390 CO 0.19 0.75 -2.17 -1.22 -3.12 0.00 0.00 179.24 173.68 3hq2 n TYR 391 N -4.46 0.00 -0.05 4.55 4.02 -0.56 -4.64 117.16 116.02 3hq2 n TYR 391 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.96 3hq2 n TYR 391 Cb 0.08 -0.72 0.00 0.00 -0.02 0.00 0.00 39.34 38.68 3hq2 n TYR 391 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3hq2 n LEU 392 N -2.48 0.49 -1.26 7.72 4.77 0.23 -5.00 117.00 121.49 3hq2 n LEU 392 Ca -0.17 -0.70 -0.16 0.00 -0.03 0.00 0.00 56.01 54.95 3hq2 n LEU 392 Cb 0.83 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.85 3hq2 n LEU 392 CO 0.45 0.12 -0.16 0.61 -1.33 0.00 0.00 177.39 177.08 3hq2 n GLY 393 N 0.41 1.63 3.21 -0.72 0.00 0.05 -4.82 105.19 104.95 3hq2 n GLY 393 Ca 0.00 -0.20 -0.17 0.00 0.00 0.00 0.00 46.02 45.65 3hq2 n GLY 393 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hq2 s ILE 394 N -2.58 1.17 -0.11 -0.61 -4.36 -1.21 -4.93 121.20 108.58 3hq2 s ILE 394 Ca 0.00 -1.63 0.02 0.00 -0.26 0.00 0.00 60.65 58.78 3hq2 s ILE 394 Cb 0.00 -1.41 0.01 0.00 1.25 0.00 0.00 42.46 42.32 3hq2 s ILE 394 CO 0.00 -0.43 -0.16 -0.89 0.24 0.00 0.00 174.94 173.69 3hq2 s THR 395 N -2.11 1.57 0.17 8.37 2.01 -1.26 -2.37 115.64 122.03 3hq2 s THR 395 Ca 0.06 -0.69 -0.32 0.00 0.31 0.00 0.00 61.69 61.05 3hq2 s THR 395 Cb -0.05 -1.43 -0.12 0.00 0.01 0.00 0.00 72.50 70.92 3hq2 s THR 395 CO 0.02 0.46 1.77 -2.65 -0.69 0.00 0.00 174.62 173.53 3hq2 n PRO 396 N 4.14 2.78 0.04 4.92 -0.02 -1.26 -4.90 135.00 140.70 3hq2 n PRO 396 Ca -0.19 1.01 0.09 0.00 -2.02 0.00 0.00 63.50 62.38 3hq2 n PRO 396 Cb 0.51 -2.87 -0.09 0.00 -0.02 0.00 0.00 33.50 31.03 3hq2 n PRO 396 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3hq2 n GLN 397 N 4.66 0.63 -4.29 -0.52 1.13 -1.26 -4.96 117.38 112.77 3hq2 n GLN 397 Ca 0.17 -0.01 -0.19 0.00 -1.94 0.00 0.00 57.00 55.03 3hq2 n GLN 397 Cb 0.36 -1.68 -0.11 0.00 0.11 0.00 0.00 30.24 28.92 3hq2 n GLN 397 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3hq2 s THR 398 N -3.34 1.54 0.33 5.09 -4.23 -1.26 -5.04 115.64 108.72 3hq2 s THR 398 Ca -0.04 -1.93 0.09 0.00 -1.18 0.00 0.00 61.69 58.62 3hq2 s THR 398 Cb 0.11 -1.78 0.07 0.00 1.34 0.00 0.00 72.50 72.25 3hq2 s THR 398 CO 0.85 -0.47 1.77 0.44 -0.54 0.00 0.00 174.62 176.66 3hq2 h ASP 399 N 3.12 0.18 -0.49 3.99 3.32 -1.93 -1.85 116.42 122.77 3hq2 h ASP 399 Ca -0.40 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.56 3hq2 h ASP 399 Cb 1.20 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.68 3hq2 h ASP 399 CO 0.55 0.53 0.23 0.00 -1.72 0.00 0.00 179.24 178.83 3hq2 h ALA 400 N 1.48 1.41 -0.02 3.45 0.00 -1.83 -1.89 119.26 121.86 3hq2 h ALA 400 Ca 0.02 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3hq2 h ALA 400 Cb 0.70 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3hq2 h ALA 400 CO 0.05 0.45 -0.18 -0.85 0.00 0.00 0.00 179.25 178.73 3hq2 n GLU 401 N -4.36 1.81 0.00 0.00 0.28 -1.15 -3.29 120.64 113.94 3hq2 n GLU 401 Ca 0.04 -1.45 0.00 0.00 -0.16 0.00 0.00 57.16 55.59 3hq2 n GLU 401 Cb 0.14 -1.47 0.00 0.00 1.43 0.00 0.00 31.44 31.54 3hq2 n GLU 401 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3hq2 n GLY 402 N 1.36 1.27 0.41 -1.84 0.00 -0.71 -4.66 105.19 101.03 3hq2 n GLY 402 Ca 0.13 -0.85 0.22 0.00 0.00 0.00 0.00 46.02 45.51 3hq2 n GLY 402 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3hq2 h ILE 403 N 0.00 0.60 0.00 -0.61 2.10 -1.85 -1.21 117.51 116.54 3hq2 h ILE 403 Ca 0.00 -0.13 0.00 0.00 1.08 0.00 0.00 64.86 65.81 3hq2 h ILE 403 Cb 0.00 0.20 0.00 0.00 -1.09 0.00 0.00 36.82 35.93 3hq2 h ILE 403 CO 0.00 0.07 0.00 0.18 -1.08 0.00 0.00 178.15 177.32 3hq2 n LEU 404 N -4.53 0.11 -0.36 2.19 4.77 -0.86 -4.29 117.00 114.03 3hq2 n LEU 404 Ca 0.22 0.52 -0.00 0.00 -0.03 0.00 0.00 56.01 56.71 3hq2 n LEU 404 Cb 0.80 -0.49 0.05 0.00 -2.33 0.00 0.00 43.42 41.45 3hq2 n LEU 404 CO 0.29 -0.17 0.60 -0.61 -1.33 0.00 0.00 177.39 176.18 3hq2 h GLN 405 N 0.00 -0.01 -6.07 3.23 4.15 -1.20 -3.43 115.11 111.77 3hq2 h GLN 405 Ca 0.00 0.00 -0.61 0.00 0.77 0.00 0.00 58.65 58.81 3hq2 h GLN 405 Cb 0.39 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.03 3hq2 h GLN 405 CO 0.00 -0.01 -0.54 -0.51 -1.93 0.00 0.00 178.83 175.84 3hq2 s ASP 406 N -5.33 5.94 0.05 -0.69 1.01 -1.26 -5.04 116.67 111.36 3hq2 s ASP 406 Ca -0.14 0.10 0.26 0.00 0.71 0.00 0.00 52.55 53.48 3hq2 s ASP 406 Cb 0.21 -1.71 0.65 0.00 1.01 0.00 0.00 42.92 43.08 3hq2 s ASP 406 CO 0.72 0.14 1.54 0.55 0.21 0.00 0.00 175.17 178.33 3hq2 n VAL 407 N 0.12 0.15 -0.25 -1.27 3.14 -1.26 -4.47 118.33 114.50 3hq2 n VAL 407 Ca -0.07 -0.10 0.05 0.00 -2.96 0.00 0.00 64.34 61.25 3hq2 n VAL 407 Cb 0.52 -0.10 0.15 0.00 -1.06 0.00 0.00 33.84 33.35 3hq2 n VAL 407 CO 0.00 0.00 0.00 0.45 -6.46 0.00 0.00 176.83 170.82 3hq2 h HIS 408 N 0.00 -0.06 -0.29 1.45 3.86 -1.96 -1.58 115.15 116.58 3hq2 h HIS 408 Ca 0.00 0.05 -0.06 0.00 -1.16 0.00 0.00 60.37 59.20 3hq2 h HIS 408 Cb 0.59 0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.19 3hq2 h HIS 408 CO 0.00 -0.23 -0.06 -1.49 0.86 0.00 0.00 177.93 177.01 3hq2 h TRP 409 N 0.10 0.61 -0.72 2.45 6.55 -1.79 0.30 115.95 123.46 3hq2 h TRP 409 Ca 0.40 -0.13 0.18 0.00 0.95 0.00 0.00 58.89 60.30 3hq2 h TRP 409 Cb 0.70 -0.15 -0.04 0.00 -0.86 0.00 0.00 29.16 28.81 3hq2 h TRP 409 CO -0.42 0.73 0.50 0.00 -1.05 0.00 0.00 178.44 178.20 3hq2 h ALA 410 N 0.79 2.42 -0.01 1.49 0.00 -1.60 0.70 119.26 123.05 3hq2 h ALA 410 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3hq2 h ALA 410 Cb 0.53 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3hq2 h ALA 410 CO 0.03 -0.62 -0.02 0.41 0.00 0.00 0.00 179.25 179.04 3hq2 n GLY 411 N -1.60 -0.21 1.67 0.00 0.00 -0.77 -3.52 105.19 100.76 3hq2 n GLY 411 Ca 0.14 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.76 3hq2 n GLY 411 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hq2 n GLY 412 N 1.17 0.71 3.26 -0.02 0.00 0.25 -4.92 105.19 105.63 3hq2 n GLY 412 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3hq2 n GLY 412 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hq2 n ASP 413 N 0.00 4.49 -4.85 1.61 10.43 0.08 -4.96 116.55 123.35 3hq2 n ASP 413 Ca 0.00 -2.88 -0.38 0.00 2.57 0.00 0.00 54.79 54.10 3hq2 n ASP 413 Cb 0.00 -1.71 -0.06 0.00 1.84 0.00 0.00 41.12 41.19 3hq2 n ASP 413 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 3hq2 s PHE 414 N 3.95 3.69 0.00 1.24 0.08 -1.26 -3.87 117.98 121.82 3hq2 s PHE 414 Ca 0.52 0.87 0.00 0.00 0.12 0.00 0.00 56.93 58.44 3hq2 s PHE 414 Cb 0.08 -2.20 0.00 0.00 -0.57 0.00 0.00 43.02 40.33 3hq2 s PHE 414 CO 0.02 0.66 0.00 0.41 -0.10 0.00 0.00 175.22 176.21 3hq2 n GLY 415 N 1.88 0.75 0.08 4.36 0.00 -1.26 -4.70 105.19 106.30 3hq2 n GLY 415 Ca -0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.85 3hq2 n GLY 415 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3hq2 h TYR 416 N 0.00 -0.09 -0.51 1.61 3.20 -1.86 -3.40 116.97 115.92 3hq2 h TYR 416 Ca 0.00 -0.00 0.14 0.00 3.14 0.00 0.00 58.73 62.01 3hq2 h TYR 416 Cb 0.00 0.03 -0.10 0.00 1.54 0.00 0.00 36.73 38.20 3hq2 h TYR 416 CO 0.00 -0.05 0.01 1.19 -1.64 0.00 0.00 178.16 177.67 3hq2 n PHE 417 N -4.61 0.33 0.08 -3.82 0.99 -1.26 -0.30 117.46 108.87 3hq2 n PHE 417 Ca -0.01 0.62 0.20 0.00 -0.00 0.00 0.00 57.45 58.25 3hq2 n PHE 417 Cb 0.04 -0.89 0.75 0.00 -1.00 0.00 0.00 39.48 38.38 3hq2 n PHE 417 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.76 175.41 3hq2 h PRO 418 N 0.00 0.00 -0.00 -1.08 0.11 -1.88 0.42 132.00 129.57 3hq2 h PRO 418 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 3hq2 h PRO 418 Cb 0.65 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.76 3hq2 h PRO 418 CO -0.48 0.00 0.02 0.77 -0.21 0.00 0.00 178.00 178.10 3hq2 h SER 419 N 0.00 0.00 -0.15 -2.05 0.02 -0.94 -0.06 113.55 110.37 3hq2 h SER 419 Ca 0.19 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.97 3hq2 h SER 419 Cb 0.93 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.48 3hq2 h SER 419 CO -0.00 0.00 -0.59 1.88 -1.14 0.00 0.00 176.83 176.98 3hq2 h TYR 420 N 0.00 0.88 0.85 3.45 -1.99 -1.10 0.97 116.97 120.04 3hq2 h TYR 420 Ca 0.00 -0.37 -0.04 0.00 2.00 0.00 0.00 58.73 60.32 3hq2 h TYR 420 Cb 0.05 -0.14 0.01 0.00 2.00 0.00 0.00 36.73 38.64 3hq2 h TYR 420 CO 0.00 1.17 -0.41 0.00 -0.00 0.00 0.00 178.16 178.92 3hq2 h ALA 421 N 0.53 -1.15 -0.31 3.88 0.00 -1.14 0.52 119.26 121.59 3hq2 h ALA 421 Ca -0.03 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 54.69 3hq2 h ALA 421 Cb 1.22 0.44 -0.07 0.00 0.00 0.00 0.00 17.79 19.39 3hq2 h ALA 421 CO 0.12 -1.14 -0.12 -0.07 0.00 0.00 0.00 179.25 178.05 3hq2 h LEU 422 N -1.16 -0.40 -1.15 0.00 3.38 -1.41 -0.27 115.31 114.30 3hq2 h LEU 422 Ca -0.12 0.11 0.18 0.00 0.09 0.00 0.00 57.88 58.14 3hq2 h LEU 422 Cb 0.88 0.24 -0.09 0.00 0.09 0.00 0.00 40.66 41.78 3hq2 h LEU 422 CO 0.19 -0.15 0.61 1.23 0.09 0.00 0.00 178.44 180.42 3hq2 h GLY 423 N -0.06 1.51 1.08 0.83 0.00 -0.57 0.33 103.07 106.19 3hq2 h GLY 423 Ca 0.16 -0.33 -0.10 0.00 0.00 0.00 0.00 47.33 47.06 3hq2 h GLY 423 CO -0.35 0.00 -0.03 -1.82 0.00 0.00 0.00 176.54 174.34 3hq2 h TYR 424 N 0.72 1.14 -0.27 5.60 5.03 0.80 -1.31 116.97 128.67 3hq2 h TYR 424 Ca 0.53 -0.21 -0.02 0.00 2.58 0.00 0.00 58.73 61.61 3hq2 h TYR 424 Cb 0.88 -0.29 -0.01 0.00 1.55 0.00 0.00 36.73 38.86 3hq2 h TYR 424 CO -0.00 1.02 0.08 0.52 -1.32 0.00 0.00 178.16 178.46 3hq2 h MET 425 N 0.93 0.43 -0.74 1.82 2.86 0.57 -1.69 114.93 119.10 3hq2 h MET 425 Ca 0.16 -0.10 0.05 0.00 -2.06 0.00 0.00 59.70 57.75 3hq2 h MET 425 Cb 0.59 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 32.13 3hq2 h MET 425 CO 0.04 0.50 0.45 1.88 1.06 0.00 0.00 176.91 180.84 3hq2 h TYR 426 N 0.28 0.83 -0.58 -0.22 0.99 -0.50 -1.07 116.97 116.70 3hq2 h TYR 426 Ca 0.09 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.83 3hq2 h TYR 426 Cb 0.26 -0.27 -0.03 0.00 1.00 0.00 0.00 36.73 37.69 3hq2 h TYR 426 CO 0.01 0.43 0.33 0.00 -0.00 0.00 0.00 178.16 178.93 3hq2 h ALA 427 N 1.35 0.74 -0.42 3.88 0.00 -0.99 0.19 119.26 124.02 3hq2 h ALA 427 Ca 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3hq2 h ALA 427 Cb 0.12 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3hq2 h ALA 427 CO -0.15 0.25 0.26 0.00 0.00 0.00 0.00 179.25 179.61 3hq2 h ALA 428 N 1.16 0.53 -0.52 0.00 0.00 -0.64 0.60 119.26 120.39 3hq2 h ALA 428 Ca 0.21 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 3hq2 h ALA 428 Cb 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3hq2 h ALA 428 CO -0.04 0.01 -0.16 0.37 0.00 0.00 0.00 179.25 179.44 3hq2 h GLN 429 N 0.56 1.02 -0.56 0.00 4.15 -0.81 -2.79 115.11 116.67 3hq2 h GLN 429 Ca 0.15 -0.40 -0.08 0.00 0.77 0.00 0.00 58.65 59.08 3hq2 h GLN 429 Cb -0.02 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.60 3hq2 h GLN 429 CO -0.03 1.09 0.02 -0.07 -1.93 0.00 0.00 178.83 177.91 3hq2 h LEU 430 N 0.89 0.95 -0.02 -2.39 3.38 -0.39 -2.87 115.31 114.86 3hq2 h LEU 430 Ca 0.13 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.82 3hq2 h LEU 430 Cb 0.73 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3hq2 h LEU 430 CO 0.06 1.01 -0.09 0.50 0.09 0.00 0.00 178.44 180.01 3hq2 h LYS 431 N 0.86 -0.15 -0.24 1.13 1.63 -0.76 -0.34 116.57 118.71 3hq2 h LYS 431 Ca 0.16 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.96 3hq2 h LYS 431 Cb 0.51 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.16 3hq2 h LYS 431 CO 0.02 -0.10 0.12 -0.56 -3.45 0.00 0.00 179.45 175.48 3hq2 h GLN 432 N -0.15 0.34 0.00 1.90 -0.00 -1.51 -2.27 115.11 113.43 3hq2 h GLN 432 Ca 0.04 -0.05 -0.02 0.00 -0.00 0.00 0.00 58.65 58.62 3hq2 h GLN 432 Cb 0.21 -0.06 -0.00 0.00 -0.00 0.00 0.00 27.48 27.62 3hq2 h GLN 432 CO -0.11 0.34 -0.09 -0.22 -0.00 0.00 0.00 178.83 178.75 3hq2 h LYS 433 N 0.26 0.00 0.00 0.06 1.63 -1.39 -0.44 116.57 116.69 3hq2 h LYS 433 Ca 0.08 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.81 3hq2 h LYS 433 Cb 0.11 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.73 3hq2 h LYS 433 CO -0.01 0.09 -0.34 1.98 -3.45 0.00 0.00 179.45 177.72 3hq2 h MET 434 N 0.00 0.00 -0.39 1.90 4.05 -0.47 -3.06 114.93 116.96 3hq2 h MET 434 Ca -0.00 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3hq2 h MET 434 Cb 0.19 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.97 3hq2 h MET 434 CO 0.01 0.34 0.23 -0.07 0.23 0.00 0.00 176.91 177.65 3hq2 h LEU 435 N 0.00 0.46 -0.29 3.39 3.38 -0.75 0.20 115.31 121.70 3hq2 h LEU 435 Ca -0.00 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.00 3hq2 h LEU 435 Cb 0.75 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.34 3hq2 h LEU 435 CO 0.04 0.36 -0.02 -0.33 0.09 0.00 0.00 178.44 178.59 3hq2 h GLU 436 N 0.54 0.06 0.00 1.13 5.08 -1.63 0.13 114.58 119.89 3hq2 h GLU 436 Ca 0.14 -0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.29 3hq2 h GLU 436 Cb -0.01 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 3hq2 h GLU 436 CO -0.03 0.04 -1.01 -0.44 -1.00 0.00 0.00 179.01 176.58 3hq2 h ASP 437 N 0.07 0.00 -2.10 1.42 3.32 -1.59 -3.39 116.42 114.15 3hq2 h ASP 437 Ca 0.14 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.62 3hq2 h ASP 437 Cb 0.19 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.34 3hq2 h ASP 437 CO -0.25 0.93 -0.87 0.18 -1.72 0.00 0.00 179.24 177.51 3hq2 n LEU 438 N -3.30 1.99 -0.06 1.55 4.77 0.66 -4.91 117.00 117.69 3hq2 n LEU 438 Ca -0.01 -5.09 0.06 0.00 -0.03 0.00 0.00 56.01 50.93 3hq2 n LEU 438 Cb 0.92 0.03 0.42 0.00 -2.33 0.00 0.00 43.42 42.46 3hq2 n LEU 438 CO 0.46 2.10 1.18 -0.65 -1.33 0.00 0.00 177.39 179.15 3hq2 h PRO 439 N 3.94 0.58 -0.85 3.23 0.11 -1.18 -1.51 132.00 136.30 3hq2 h PRO 439 Ca 0.13 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.21 3hq2 h PRO 439 Cb 0.77 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.75 3hq2 h PRO 439 CO 0.64 0.38 0.00 -0.85 -0.21 0.00 0.00 178.00 177.96 3hq2 n GLU 440 N -4.47 0.77 -0.04 1.05 0.00 -1.26 -4.46 120.64 112.23 3hq2 n GLU 440 Ca 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 57.16 57.18 3hq2 n GLU 440 Cb 0.15 -1.34 -0.03 0.00 0.00 0.00 0.00 31.44 30.22 3hq2 n GLU 440 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 3hq2 h PHE 441 N 0.27 -0.56 -0.54 -1.84 3.57 -1.64 0.83 116.94 117.02 3hq2 h PHE 441 Ca 0.00 0.03 0.16 0.00 3.53 0.00 0.00 57.97 61.68 3hq2 h PHE 441 Cb 0.46 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.43 3hq2 h PHE 441 CO 0.00 -0.16 0.41 -0.44 -2.23 0.00 0.00 178.31 175.89 3hq2 h ASP 442 N -0.14 0.00 -0.44 0.41 3.32 -1.88 0.53 116.42 118.22 3hq2 h ASP 442 Ca 0.02 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 3hq2 h ASP 442 Cb 0.20 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 3hq2 h ASP 442 CO -0.19 0.00 -0.12 0.00 -1.72 0.00 0.00 179.24 177.22 3hq2 h ALA 443 N 1.68 0.61 -0.16 3.45 0.00 -1.26 -2.74 119.26 120.84 3hq2 h ALA 443 Ca 0.26 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.84 3hq2 h ALA 443 Cb 1.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 3hq2 h ALA 443 CO -0.00 0.51 0.06 -0.07 0.00 0.00 0.00 179.25 179.75 3hq2 h LEU 444 N 0.69 0.08 -0.93 0.00 3.38 0.12 -2.23 115.31 116.42 3hq2 h LEU 444 Ca 0.11 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.18 3hq2 h LEU 444 Cb 0.66 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.34 3hq2 h LEU 444 CO 0.05 0.07 0.58 -0.07 0.09 0.00 0.00 178.44 179.16 3hq2 h LEU 445 N 0.14 0.89 -1.56 1.67 3.38 -1.40 -0.17 115.31 118.26 3hq2 h LEU 445 Ca 0.07 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 3hq2 h LEU 445 Cb 0.03 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3hq2 h LEU 445 CO -0.06 0.54 -0.22 -0.33 0.09 0.00 0.00 178.44 178.45 3hq2 h GLU 446 N 1.01 0.00 -0.02 1.13 5.08 -1.14 -1.28 114.58 119.36 3hq2 h GLU 446 Ca 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 3hq2 h GLU 446 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3hq2 h GLU 446 CO -0.21 0.22 -0.00 0.54 -1.00 0.00 0.00 179.01 178.56 3hq2 n ARG 447 N -3.81 1.78 -3.25 2.33 1.74 -0.21 -4.42 116.66 110.83 3hq2 n ARG 447 Ca -0.02 -1.13 -0.23 0.00 -0.77 0.00 0.00 57.85 55.70 3hq2 n ARG 447 Cb 0.32 -1.48 0.05 0.00 -1.02 0.00 0.00 32.46 30.34 3hq2 n ARG 447 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hq2 n GLY 448 N 1.21 -0.53 3.22 -0.13 0.00 -0.41 -4.97 105.19 103.57 3hq2 n GLY 448 Ca 0.18 0.18 -0.37 0.00 0.00 0.00 0.00 46.02 46.02 3hq2 n GLY 448 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hq2 s GLU 449 N -5.95 2.46 0.00 1.61 2.56 -0.52 -4.99 118.70 113.88 3hq2 s GLU 449 Ca 0.42 -1.33 0.10 0.00 0.00 0.00 0.00 54.97 54.15 3hq2 s GLU 449 Cb -0.18 -3.42 -0.01 0.00 2.00 0.00 0.00 34.13 32.52 3hq2 s GLU 449 CO 0.52 -0.74 0.61 1.19 -0.56 0.00 0.00 175.26 176.28 3hq2 n PHE 450 N 4.73 0.00 0.12 5.30 3.01 -1.26 -4.39 117.46 124.96 3hq2 n PHE 450 Ca -0.11 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.36 3hq2 n PHE 450 Cb 0.44 0.00 0.35 0.00 -0.01 0.00 0.00 39.48 40.25 3hq2 n PHE 450 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 3hq2 h HIS 451 N 1.03 0.24 -0.19 1.38 3.86 -1.93 -0.90 115.15 118.64 3hq2 h HIS 451 Ca 0.00 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 3hq2 h HIS 451 Cb 0.32 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.72 3hq2 h HIS 451 CO 0.00 0.43 0.09 -1.35 0.86 0.00 0.00 177.93 177.96 3hq2 h PRO 452 N 0.21 0.28 0.11 2.45 0.11 -1.99 0.18 132.00 133.35 3hq2 h PRO 452 Ca 0.04 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 3hq2 h PRO 452 Cb 0.49 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.55 3hq2 h PRO 452 CO 0.03 0.30 -0.05 0.82 -0.21 0.00 0.00 178.00 178.89 3hq2 h ILE 453 N 0.19 0.95 -0.31 4.15 2.04 -1.82 -1.11 117.51 121.61 3hq2 h ILE 453 Ca 0.07 -0.25 0.05 0.00 1.00 0.00 0.00 64.86 65.73 3hq2 h ILE 453 Cb 0.11 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 3hq2 h ILE 453 CO -0.01 0.06 0.04 0.50 0.00 0.00 0.00 178.15 178.75 3hq2 h LYS 454 N -0.27 0.14 -1.00 2.37 3.64 -1.09 -1.54 116.57 118.82 3hq2 h LYS 454 Ca -0.02 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.38 3hq2 h LYS 454 Cb 0.22 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 31.95 3hq2 h LYS 454 CO 0.03 0.09 0.66 0.37 -2.27 0.00 0.00 179.45 178.33 3hq2 h GLN 455 N 0.15 1.26 -0.45 1.90 4.15 -0.49 0.71 115.11 122.33 3hq2 h GLN 455 Ca 0.15 -0.08 0.04 0.00 0.77 0.00 0.00 58.65 59.53 3hq2 h GLN 455 Cb 0.17 -0.28 -0.04 0.00 0.21 0.00 0.00 27.48 27.54 3hq2 h GLN 455 CO -0.21 0.83 0.22 2.35 -1.93 0.00 0.00 178.83 180.09 3hq2 h TRP 456 N 1.29 0.40 -0.26 3.99 7.01 -0.24 -2.33 115.95 125.82 3hq2 h TRP 456 Ca 0.39 0.02 -0.14 0.00 2.11 0.00 0.00 58.89 61.27 3hq2 h TRP 456 Cb -0.05 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 26.89 3hq2 h TRP 456 CO -0.00 0.20 -0.42 -0.07 -2.79 0.00 0.00 178.44 175.36 3hq2 h LEU 457 N 0.44 0.67 -1.12 0.65 3.38 -0.62 -2.46 115.31 116.24 3hq2 h LEU 457 Ca 0.20 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3hq2 h LEU 457 Cb 0.12 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3hq2 h LEU 457 CO -0.15 1.01 0.23 0.74 0.09 0.00 0.00 178.44 180.36 3hq2 h THR 458 N 0.51 1.21 0.00 0.22 2.02 -0.47 0.31 112.91 116.71 3hq2 h THR 458 Ca 0.04 -0.66 -0.14 0.00 0.77 0.00 0.00 66.41 66.42 3hq2 h THR 458 Cb 0.94 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 3hq2 h THR 458 CO 0.09 0.26 -0.90 -0.33 0.37 0.00 0.00 175.52 175.00 3hq2 h GLU 459 N 0.84 0.00 0.04 6.66 5.08 -1.40 0.74 114.58 126.54 3hq2 h GLU 459 Ca 0.20 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.24 3hq2 h GLU 459 Cb 0.17 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 3hq2 h GLU 459 CO -0.02 0.46 -1.83 1.63 -1.00 0.00 0.00 179.01 178.26 3hq2 n LYS 460 N -3.11 0.67 0.03 2.33 4.76 -0.93 -4.87 118.16 117.04 3hq2 n LYS 460 Ca -0.03 0.28 0.00 0.00 -2.87 0.00 0.00 58.31 55.69 3hq2 n LYS 460 Cb 0.80 -1.76 0.00 0.00 -1.84 0.00 0.00 35.03 32.23 3hq2 n LYS 460 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3hq2 n VAL 461 N -3.17 0.27 0.00 -0.18 0.31 0.10 -4.83 118.33 110.83 3hq2 n VAL 461 Ca -0.22 0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 3hq2 n VAL 461 Cb 1.05 -0.80 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 3hq2 n VAL 461 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3hq2 n HIS 462 N -2.87 0.00 -0.27 3.52 8.25 -0.79 -2.58 115.22 120.48 3hq2 n HIS 462 Ca 0.00 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 57.65 3hq2 n HIS 462 Cb 0.00 -0.03 0.36 0.00 1.12 0.00 0.00 29.99 31.44 3hq2 n HIS 462 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 3hq2 n ILE 463 N -1.03 -0.34 0.23 1.59 0.13 0.25 -0.72 119.36 119.45 3hq2 n ILE 463 Ca 0.00 1.73 0.10 0.00 -1.10 0.00 0.00 62.75 63.49 3hq2 n ILE 463 Cb 0.00 -2.66 0.67 0.00 -0.84 0.00 0.00 39.64 36.81 3hq2 n ILE 463 CO 0.00 0.00 0.00 0.45 2.80 0.00 0.00 176.55 179.80 3hq2 h HIS 464 N 0.00 0.00 0.00 9.51 3.86 -1.73 -1.85 115.15 124.94 3hq2 h HIS 464 Ca 0.59 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.80 3hq2 h HIS 464 Cb 1.41 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.88 3hq2 h HIS 464 CO -0.22 0.00 0.00 0.41 0.86 0.00 0.00 177.93 178.98 3hq2 n GLY 465 N -1.53 3.61 1.95 2.45 0.00 0.10 -0.48 105.19 111.28 3hq2 n GLY 465 Ca -0.01 0.04 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 3hq2 n GLY 465 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hq2 n LYS 466 N 14.00 3.66 0.08 1.61 5.02 -0.60 -3.74 118.16 138.19 3hq2 n LYS 466 Ca 0.00 -3.10 0.12 0.00 -2.02 0.00 0.00 58.31 53.32 3hq2 n LYS 466 Cb 0.00 -2.20 0.46 0.00 -0.02 0.00 0.00 35.03 33.27 3hq2 n LYS 466 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3hq2 n ARG 467 N -0.20 0.18 -4.07 1.97 1.74 0.36 -4.76 116.66 111.88 3hq2 n ARG 467 Ca 0.40 0.23 -0.11 0.00 -0.77 0.00 0.00 57.85 57.61 3hq2 n ARG 467 Cb 1.37 -1.74 -0.11 0.00 -1.02 0.00 0.00 32.46 30.96 3hq2 n ARG 467 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3hq2 s LYS 468 N -3.13 0.56 0.29 5.56 1.02 -1.26 -5.09 119.74 117.70 3hq2 s LYS 468 Ca 0.09 -0.93 -0.02 0.00 0.02 0.00 0.00 55.97 55.13 3hq2 s LYS 468 Cb 0.12 -0.11 -0.04 0.00 -0.52 0.00 0.00 37.83 37.28 3hq2 s LYS 468 CO 0.50 -0.01 0.52 0.15 -0.92 0.00 0.00 175.35 175.59 3hq2 s LYS 469 N -2.43 3.55 0.23 1.68 1.02 -1.26 -4.83 119.74 117.70 3hq2 s LYS 469 Ca -0.04 -0.19 -0.14 0.00 0.02 0.00 0.00 55.97 55.62 3hq2 s LYS 469 Cb -0.04 -2.69 0.28 0.00 -0.52 0.00 0.00 37.83 34.86 3hq2 s LYS 469 CO -0.03 0.23 1.45 -0.35 -0.92 0.00 0.00 175.35 175.73 3hq2 n PRO 470 N -1.20 -0.18 -0.21 -1.68 -0.04 -1.26 -0.91 135.00 129.51 3hq2 n PRO 470 Ca -0.03 1.44 0.02 0.00 -0.04 0.00 0.00 63.50 64.89 3hq2 n PRO 470 Cb 0.55 -2.15 0.11 0.00 -0.04 0.00 0.00 33.50 31.97 3hq2 n PRO 470 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3hq2 h LEU 471 N 0.00 -0.27 -0.59 1.53 5.85 -1.96 -0.59 115.31 119.28 3hq2 h LEU 471 Ca 0.36 0.16 -0.15 0.00 0.84 0.00 0.00 57.88 59.08 3hq2 h LEU 471 Cb 0.59 0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 3hq2 h LEU 471 CO -0.94 -0.12 -0.67 0.44 -0.34 0.00 0.00 178.44 176.81 3hq2 h ASP 472 N 0.12 0.19 0.21 1.25 3.32 -1.41 -0.92 116.42 119.19 3hq2 h ASP 472 Ca 0.34 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 3hq2 h ASP 472 Cb 0.55 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 3hq2 h ASP 472 CO -0.54 0.81 -0.14 0.40 -1.72 0.00 0.00 179.24 178.04 3hq2 h ILE 473 N 0.11 0.70 -0.14 0.35 1.08 0.38 -0.50 117.51 119.49 3hq2 h ILE 473 Ca -0.01 0.00 -0.17 0.00 -0.39 0.00 0.00 64.86 64.29 3hq2 h ILE 473 Cb 1.20 0.70 0.01 0.00 -3.07 0.00 0.00 36.82 35.66 3hq2 h ILE 473 CO 0.10 0.00 -0.58 -0.29 -0.69 0.00 0.00 178.15 176.69 3hq2 h ILE 474 N -0.34 1.33 -0.37 -0.67 6.09 -1.22 -2.38 117.51 119.95 3hq2 h ILE 474 Ca -0.02 -1.84 -0.02 0.00 -1.37 0.00 0.00 64.86 61.62 3hq2 h ILE 474 Cb 0.29 2.05 -0.02 0.00 0.47 0.00 0.00 36.82 39.61 3hq2 h ILE 474 CO 0.01 0.57 0.16 0.50 -3.07 0.00 0.00 178.15 176.32 3hq2 h LYS 475 N 0.31 0.55 -0.61 2.19 3.64 -1.17 -0.40 116.57 121.08 3hq2 h LYS 475 Ca -0.03 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.22 3hq2 h LYS 475 Cb 1.21 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.91 3hq2 h LYS 475 CO 0.12 0.52 0.24 -0.44 -2.27 0.00 0.00 179.45 177.61 3hq2 h ASP 476 N 0.46 0.81 0.26 4.20 5.19 -1.12 2.31 116.42 128.53 3hq2 h ASP 476 Ca 0.13 -0.11 -0.27 0.00 -0.62 0.00 0.00 57.03 56.15 3hq2 h ASP 476 Cb 0.16 -0.21 0.02 0.00 0.18 0.00 0.00 39.33 39.48 3hq2 h ASP 476 CO -0.01 0.73 -1.15 0.00 -3.12 0.00 0.00 179.24 175.69 3hq2 h ALA 477 N 1.38 0.12 -0.00 3.45 0.00 -1.14 -3.37 119.26 119.71 3hq2 h ALA 477 Ca 0.21 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3hq2 h ALA 477 Cb 0.18 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3hq2 h ALA 477 CO -0.02 0.77 -0.11 0.25 0.00 0.00 0.00 179.25 180.15 3hq2 n THR 478 N -3.74 0.00 -3.04 0.00 -2.24 -0.18 -4.96 114.28 100.12 3hq2 n THR 478 Ca -0.11 -0.45 -0.18 0.00 -2.27 0.00 0.00 64.05 61.05 3hq2 n THR 478 Cb 0.95 1.01 0.04 0.00 -2.10 0.00 0.00 70.33 70.23 3hq2 n THR 478 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hq2 n GLY 479 N 0.87 -0.22 3.64 3.38 0.00 0.78 -5.00 105.19 108.64 3hq2 n GLY 479 Ca 0.01 -0.04 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 3hq2 n GLY 479 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hq2 s GLU 480 N -5.65 0.48 1.06 1.61 2.12 -1.21 -5.01 118.70 112.09 3hq2 s GLU 480 Ca 0.32 0.73 -0.12 0.00 0.36 0.00 0.00 54.97 56.26 3hq2 s GLU 480 Cb -0.14 0.15 0.22 0.00 0.26 0.00 0.00 34.13 34.62 3hq2 s GLU 480 CO 0.39 -0.08 1.07 -1.83 -0.54 0.00 0.00 175.26 174.27 3hq2 s GLU 481 N 1.01 -0.08 -0.24 4.30 -1.05 -1.26 -4.03 118.70 117.35 3hq2 s GLU 481 Ca -0.05 1.07 -0.39 0.00 -0.15 0.00 0.00 54.97 55.45 3hq2 s GLU 481 Cb -0.04 -1.63 -0.15 0.00 -0.44 0.00 0.00 34.13 31.86 3hq2 s GLU 481 CO -0.12 -3.23 1.77 -0.11 0.95 0.00 0.00 175.26 174.51 3hq2 n LEU 482 N -4.60 2.58 -3.89 1.83 -0.00 -1.26 -4.94 117.00 106.73 3hq2 n LEU 482 Ca 0.06 1.06 -0.26 0.00 -0.00 0.00 0.00 56.01 56.87 3hq2 n LEU 482 Cb 0.54 -1.18 -0.17 0.00 -0.00 0.00 0.00 43.42 42.60 3hq2 n LEU 482 CO 0.55 -0.37 -0.43 0.21 -0.00 0.00 0.00 177.39 177.35 3hq2 s ASN 483 N 3.60 2.13 0.41 1.96 3.04 -1.26 -5.04 114.94 119.78 3hq2 s ASN 483 Ca 0.97 -0.29 0.08 0.00 0.04 0.00 0.00 52.86 53.66 3hq2 s ASN 483 Cb -1.00 -0.79 0.87 0.00 -1.54 0.00 0.00 41.25 38.79 3hq2 s ASN 483 CO 0.63 -0.13 2.03 0.58 -3.04 0.00 0.00 177.10 177.16 3hq2 h VAL 484 N 6.21 1.11 -0.89 -5.21 2.07 -1.93 -3.20 116.25 114.41 3hq2 h VAL 484 Ca -0.28 -0.32 0.27 0.00 0.82 0.00 0.00 66.70 67.19 3hq2 h VAL 484 Cb 1.13 0.71 -0.16 0.00 -1.52 0.00 0.00 31.29 31.45 3hq2 h VAL 484 CO 0.39 0.13 0.13 -1.14 0.02 0.00 0.00 177.57 177.09 3hq2 n ARG 485 N -4.43 -0.07 -0.02 1.57 0.63 -1.26 -0.87 116.66 112.21 3hq2 n ARG 485 Ca 0.02 1.30 -0.09 0.00 -0.92 0.00 0.00 57.85 58.16 3hq2 n ARG 485 Cb 0.11 -2.13 -0.02 0.00 0.45 0.00 0.00 32.46 30.87 3hq2 n ARG 485 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 3hq2 h TYR 486 N 0.00 -0.37 -0.26 -0.14 -1.99 -1.93 0.40 116.97 112.69 3hq2 h TYR 486 Ca 0.59 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 61.34 3hq2 h TYR 486 Cb 1.32 0.19 -0.01 0.00 2.00 0.00 0.00 36.73 40.23 3hq2 h TYR 486 CO -0.35 -0.22 0.14 1.25 -0.00 0.00 0.00 178.16 178.99 3hq2 h LEU 487 N -0.16 0.32 -0.89 3.88 5.85 -1.24 0.78 115.31 123.84 3hq2 h LEU 487 Ca 0.11 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.78 3hq2 h LEU 487 Cb 0.32 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 3hq2 h LEU 487 CO -0.27 0.31 0.58 0.40 -0.34 0.00 0.00 178.44 179.12 3hq2 h ILE 488 N 0.31 1.16 -0.09 4.05 2.04 -1.00 -0.13 117.51 123.85 3hq2 h ILE 488 Ca 0.09 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.53 3hq2 h ILE 488 Cb 0.06 -0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.06 3hq2 h ILE 488 CO -0.01 0.21 -0.05 0.44 0.00 0.00 0.00 178.15 178.74 3hq2 h ASP 489 N 1.14 0.20 0.06 1.72 3.32 0.15 -0.15 116.42 122.85 3hq2 h ASP 489 Ca 0.35 -0.42 0.02 0.00 0.02 0.00 0.00 57.03 57.00 3hq2 h ASP 489 Cb -0.02 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 39.42 3hq2 h ASP 489 CO -0.11 0.57 -0.45 0.22 -1.72 0.00 0.00 179.24 177.75 3hq2 h TYR 490 N -0.18 -1.29 0.40 4.55 3.20 -0.49 0.15 116.97 123.31 3hq2 h TYR 490 Ca 0.02 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 3hq2 h TYR 490 Cb 0.50 0.56 -0.01 0.00 1.54 0.00 0.00 36.73 39.31 3hq2 h TYR 490 CO 0.07 -0.53 -0.31 -0.07 -1.64 0.00 0.00 178.16 175.68 3hq2 h LEU 491 N -0.64 -0.82 0.09 2.82 3.38 -1.07 -0.83 115.31 118.23 3hq2 h LEU 491 Ca 0.03 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.07 3hq2 h LEU 491 Cb 0.69 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 3hq2 h LEU 491 CO -0.29 -0.46 -0.53 -1.28 0.09 0.00 0.00 178.44 175.96 3hq2 h SER 492 N -0.71 -1.61 -0.98 -0.43 0.87 -0.83 -0.07 113.55 109.79 3hq2 h SER 492 Ca -0.03 0.17 0.09 0.00 -1.23 0.00 0.00 61.79 60.79 3hq2 h SER 492 Cb 0.61 0.60 -0.07 0.00 -0.44 0.00 0.00 62.40 63.10 3hq2 h SER 492 CO -0.01 -0.55 0.63 -1.13 -0.53 0.00 0.00 176.83 175.24 3hq2 h ASN 493 N -0.73 0.95 0.17 6.23 -0.73 -0.70 -2.21 115.58 118.57 3hq2 h ASN 493 Ca -0.00 0.03 -0.17 0.00 1.87 0.00 0.00 56.30 58.02 3hq2 h ASN 493 Cb 0.75 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 39.16 3hq2 h ASN 493 CO -0.31 0.57 -0.66 0.50 -0.37 0.00 0.00 177.43 177.16 3hq2 h LYS 494 N 1.06 0.45 -0.69 6.67 3.64 -0.60 -3.23 116.57 123.87 3hq2 h LYS 494 Ca 0.45 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 3hq2 h LYS 494 Cb 0.33 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 3hq2 h LYS 494 CO -0.20 0.96 0.00 0.66 -2.27 0.00 0.00 179.45 178.59 3hq2 n TYR 495 N -3.89 1.20 -0.06 1.91 4.02 -0.09 -3.40 117.16 116.86 3hq2 n TYR 495 Ca -0.04 -0.53 0.00 0.00 -0.01 0.00 0.00 57.90 57.33 3hq2 n TYR 495 Cb 0.66 -0.11 -0.16 0.00 -0.02 0.00 0.00 39.34 39.71 3hq2 n TYR 495 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3hq2 n SER 496 N 1.38 0.06 0.04 7.72 7.64 -0.85 -4.00 113.62 125.60 3hq2 n SER 496 Ca 0.25 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.96 3hq2 n SER 496 Cb 0.73 1.48 -0.14 0.00 -1.01 0.00 0.00 64.21 65.27 3hq2 n SER 496 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 3hq2 h ASN 497 N 0.00 0.33 0.27 6.43 -0.26 -1.64 -2.79 115.58 117.92 3hq2 h ASN 497 Ca -0.28 -0.52 -0.15 0.00 -0.56 0.00 0.00 56.30 54.79 3hq2 h ASN 497 Cb 1.62 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 38.76 3hq2 h ASN 497 CO 0.02 1.44 -0.61 -0.07 -1.06 0.00 0.00 177.43 177.15 3hq2 h LEU 498 N 0.06 0.38 0.00 1.61 3.38 -1.76 -3.42 115.31 115.56 3hq2 h LEU 498 Ca -0.27 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.48 3hq2 h LEU 498 Cb 2.01 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.65 3hq2 h LEU 498 CO 0.14 0.90 0.00 -1.22 0.09 0.00 0.00 178.44 178.35 3hq2 n TYR 499 N -3.89 0.00 0.00 1.13 4.02 -1.26 -5.02 117.16 112.15 3hq2 n TYR 499 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 3hq2 n TYR 499 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.95 3hq2 n TYR 499 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13