#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3is4 h GLN 2 N 0.00 1.19 -0.16 -1.46 5.75 -1.99 -1.94 115.11 116.51 3is4 h GLN 2 Ca 0.00 -0.23 0.04 0.00 -0.15 0.00 0.00 58.65 58.32 3is4 h GLN 2 Cb 0.00 -0.19 -0.05 0.00 1.07 0.00 0.00 27.48 28.32 3is4 h GLN 2 CO 0.00 0.97 -0.12 1.25 -2.65 0.00 0.00 178.83 178.28 3is4 h LEU 3 N 1.15 -0.39 -1.17 -2.39 6.46 -2.00 0.14 115.31 117.10 3is4 h LEU 3 Ca 0.26 0.08 0.02 0.00 -0.12 0.00 0.00 57.88 58.12 3is4 h LEU 3 Cb 0.24 0.20 -0.05 0.00 -0.73 0.00 0.00 40.66 40.33 3is4 h LEU 3 CO -0.02 -0.16 0.56 0.00 -0.62 0.00 0.00 178.44 178.20 3is4 h ALA 4 N 0.97 1.43 -0.58 1.25 0.00 -1.99 -2.54 119.26 117.81 3is4 h ALA 4 Ca 0.10 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 3is4 h ALA 4 Cb 0.28 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3is4 h ALA 4 CO -0.24 0.50 -0.03 1.25 0.00 0.00 0.00 179.25 180.74 3is4 h HIS 5 N 1.11 1.15 -0.94 0.00 -0.00 -0.51 -3.02 115.15 112.93 3is4 h HIS 5 Ca 0.33 -0.21 0.11 0.00 -0.00 0.00 0.00 60.37 60.59 3is4 h HIS 5 Cb -0.05 -0.30 -0.07 0.00 -0.00 0.00 0.00 27.41 26.99 3is4 h HIS 5 CO -0.00 1.03 0.60 -0.91 -0.00 0.00 0.00 177.93 178.65 3is4 h ASN 6 N 0.94 0.85 -0.21 3.26 2.35 -0.33 -2.41 115.58 120.03 3is4 h ASN 6 Ca 0.16 0.03 0.06 0.00 -0.55 0.00 0.00 56.30 56.00 3is4 h ASN 6 Cb 0.59 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 3is4 h ASN 6 CO 0.04 0.48 0.16 -0.07 -1.65 0.00 0.00 177.43 176.38 3is4 h LEU 7 N 0.93 0.00 -0.62 1.61 3.38 -1.38 -2.55 115.31 116.67 3is4 h LEU 7 Ca 0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.42 3is4 h LEU 7 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3is4 h LEU 7 CO -0.21 0.00 -0.47 0.35 0.09 0.00 0.00 178.44 178.20 3is4 n THR 8 N -4.41 0.00 -2.63 0.22 -2.24 -0.91 -4.97 114.28 99.33 3is4 n THR 8 Ca 0.02 -0.16 -0.32 0.00 -2.27 0.00 0.00 64.05 61.32 3is4 n THR 8 Cb 0.30 0.85 -0.05 0.00 -2.10 0.00 0.00 70.33 69.33 3is4 n THR 8 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3is4 s LEU 9 N -2.59 3.78 -0.04 3.22 1.43 -0.96 -5.08 118.68 118.44 3is4 s LEU 9 Ca 0.19 1.57 0.00 0.00 -1.03 0.00 0.00 54.13 54.86 3is4 s LEU 9 Cb 0.18 -4.46 0.02 0.00 0.03 0.00 0.00 46.19 41.97 3is4 s LEU 9 CO 0.60 -0.47 -0.02 -0.55 0.23 0.00 0.00 176.35 176.15 3is4 s SER 10 N -2.69 0.81 0.00 2.29 0.15 -1.26 -5.03 113.70 107.96 3is4 s SER 10 Ca 0.59 -0.07 0.15 0.00 0.70 0.00 0.00 55.95 57.32 3is4 s SER 10 Cb -0.10 -0.34 0.70 0.00 -1.71 0.00 0.00 66.02 64.58 3is4 s SER 10 CO 0.23 -0.10 1.47 2.30 1.20 0.00 0.00 173.24 178.35 3is4 n ILE 11 N 4.26 0.80 1.06 6.45 -5.35 -1.26 -1.85 119.36 123.47 3is4 n ILE 11 Ca -0.23 0.20 0.12 0.00 -0.27 0.00 0.00 62.75 62.57 3is4 n ILE 11 Cb 0.50 -0.94 0.09 0.00 -1.74 0.00 0.00 39.64 37.56 3is4 n ILE 11 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3is4 n PHE 12 N -1.42 0.00 -2.11 4.28 3.72 -1.26 -4.93 117.46 115.74 3is4 n PHE 12 Ca 0.05 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.10 3is4 n PHE 12 Cb 0.16 -0.02 0.02 0.00 -0.94 0.00 0.00 39.48 38.69 3is4 n PHE 12 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3is4 s ASP 13 N -2.42 5.51 0.46 4.37 1.01 -0.77 -5.01 116.67 119.81 3is4 s ASP 13 Ca 0.21 2.15 -0.24 0.00 0.71 0.00 0.00 52.55 55.39 3is4 s ASP 13 Cb 0.19 -2.58 -0.07 0.00 1.01 0.00 0.00 42.92 41.47 3is4 s ASP 13 CO 0.53 -1.36 1.26 -2.84 0.21 0.00 0.00 175.17 172.97 3is4 s PRO 14 N -3.49 3.69 0.99 8.23 0.02 -1.26 -5.03 135.00 138.15 3is4 s PRO 14 Ca 0.72 2.02 -0.12 0.00 0.02 0.00 0.00 61.00 63.63 3is4 s PRO 14 Cb -0.24 -2.50 0.18 0.00 0.02 0.00 0.00 34.50 31.97 3is4 s PRO 14 CO 0.31 -0.68 1.10 0.14 -0.33 0.00 0.00 177.00 177.54 3is4 s VAL 15 N -1.38 2.09 0.78 3.83 -7.23 -1.26 -5.02 120.40 112.20 3is4 s VAL 15 Ca 0.63 0.03 -0.12 0.00 -1.81 0.00 0.00 61.98 60.71 3is4 s VAL 15 Cb -0.35 -2.55 0.07 0.00 0.56 0.00 0.00 36.38 34.11 3is4 s VAL 15 CO 0.43 -0.04 1.14 0.00 -0.31 0.00 0.00 175.10 176.32 3is4 s ALA 16 N -3.00 2.03 -2.03 1.32 0.00 -1.26 -4.93 121.76 113.89 3is4 s ALA 16 Ca 0.65 0.58 0.10 0.00 0.00 0.00 0.00 51.96 53.29 3is4 s ALA 16 Cb -0.18 -3.39 0.53 0.00 0.00 0.00 0.00 23.12 20.08 3is4 s ALA 16 CO 0.57 -2.00 1.35 0.27 0.00 0.00 0.00 175.76 175.96 3is4 n ASN 17 N -3.31 0.38 -3.74 0.00 2.04 -1.26 -4.83 115.26 104.55 3is4 n ASN 17 Ca 0.11 -1.75 -0.14 0.00 -0.44 0.00 0.00 54.58 52.36 3is4 n ASN 17 Cb 0.52 -0.04 -0.08 0.00 -2.53 0.00 0.00 39.78 37.65 3is4 n ASN 17 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 3is4 s TYR 18 N -1.93 -0.24 -0.25 -2.53 -0.85 -1.26 -5.03 117.35 105.27 3is4 s TYR 18 Ca 0.16 0.39 -0.08 0.00 -0.52 0.00 0.00 57.07 57.02 3is4 s TYR 18 Cb 0.08 0.13 -0.04 0.00 0.38 0.00 0.00 41.96 42.51 3is4 s TYR 18 CO 0.12 -0.40 0.11 0.50 -1.52 0.00 0.00 175.55 174.36 3is4 s ARG 19 N -1.23 3.80 -0.00 -3.49 3.52 -1.26 -4.98 118.95 115.30 3is4 s ARG 19 Ca -0.13 -0.41 -0.18 0.00 -0.13 0.00 0.00 55.73 54.89 3is4 s ARG 19 Cb -0.05 -3.41 -0.34 0.00 -1.56 0.00 0.00 34.95 29.59 3is4 s ARG 19 CO 0.05 -0.11 0.93 0.00 -0.81 0.00 0.00 175.30 175.36 3is4 h ALA 20 N 8.03 -0.12 -2.54 6.12 0.00 -1.95 -3.44 119.26 125.36 3is4 h ALA 20 Ca -0.37 -0.83 -0.51 0.00 0.00 0.00 0.00 54.91 53.20 3is4 h ALA 20 Cb 1.18 0.18 0.10 0.00 0.00 0.00 0.00 17.79 19.24 3is4 h ALA 20 CO 0.59 0.61 0.40 0.00 0.00 0.00 0.00 179.25 180.85 3is4 s ALA 21 N -2.54 2.50 -0.03 0.00 0.00 -1.26 -0.67 121.76 119.76 3is4 s ALA 21 Ca -0.11 0.68 0.06 0.00 0.00 0.00 0.00 51.96 52.59 3is4 s ALA 21 Cb 0.03 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.78 3is4 s ALA 21 CO 0.90 -1.18 -0.22 1.03 0.00 0.00 0.00 175.76 176.29 3is4 s ARG 22 N -3.81 2.26 -0.20 0.00 1.81 -0.37 -4.91 118.95 113.73 3is4 s ARG 22 Ca 0.70 -0.85 -0.07 0.00 -1.72 0.00 0.00 55.73 53.79 3is4 s ARG 22 Cb -0.23 -2.16 -0.03 0.00 -0.45 0.00 0.00 34.95 32.08 3is4 s ARG 22 CO 0.37 0.57 0.04 0.42 -0.68 0.00 0.00 175.30 176.03 3is4 s ILE 23 N -0.63 4.41 -0.17 1.52 1.01 -1.26 -1.30 121.20 124.79 3is4 s ILE 23 Ca 0.10 -0.16 -0.07 0.00 0.00 0.00 0.00 60.65 60.52 3is4 s ILE 23 Cb -0.10 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.32 3is4 s ILE 23 CO -0.00 0.42 0.06 -0.63 0.00 0.00 0.00 174.94 174.79 3is4 s ILE 24 N 0.83 4.80 -0.12 2.92 1.01 -0.43 -1.50 121.20 128.71 3is4 s ILE 24 Ca 0.03 -0.03 0.03 0.00 0.00 0.00 0.00 60.65 60.68 3is4 s ILE 24 Cb -0.14 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.19 3is4 s ILE 24 CO 0.02 0.48 -0.23 0.00 0.00 0.00 0.00 174.94 175.21 3is4 s THR 26 N 0.55 4.77 0.10 0.00 2.01 -0.66 -0.25 115.64 122.15 3is4 s THR 26 Ca -0.14 1.99 -0.18 0.00 0.31 0.00 0.00 61.69 63.67 3is4 s THR 26 Cb -0.17 -4.28 -0.07 0.00 0.01 0.00 0.00 72.50 68.00 3is4 s THR 26 CO 0.04 0.13 0.57 -0.63 -0.69 0.00 0.00 174.62 174.05 3is4 s ILE 27 N 1.15 4.76 0.00 1.82 -1.09 -0.70 -1.99 121.20 125.14 3is4 s ILE 27 Ca 0.52 1.13 0.00 0.00 -2.23 0.00 0.00 60.65 60.07 3is4 s ILE 27 Cb -0.22 -3.86 0.00 0.00 -1.58 0.00 0.00 42.46 36.81 3is4 s ILE 27 CO 0.27 0.47 0.00 0.61 -1.23 0.00 0.00 174.94 175.05 3is4 n GLY 28 N 1.46 2.94 0.33 6.18 0.00 -1.23 -4.74 105.19 110.13 3is4 n GLY 28 Ca -0.09 -0.88 0.14 0.00 0.00 0.00 0.00 46.02 45.19 3is4 n GLY 28 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3is4 h PRO 29 N 0.00 0.50 0.00 1.61 0.11 -1.82 0.26 132.00 132.67 3is4 h PRO 29 Ca 0.00 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 3is4 h PRO 29 Cb 0.00 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.00 3is4 h PRO 29 CO 0.00 0.33 -0.03 0.77 -0.21 0.00 0.00 178.00 178.86 3is4 h SER 30 N 0.52 0.00 0.00 -2.05 0.02 -1.65 -3.37 113.55 107.02 3is4 h SER 30 Ca 0.59 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.54 3is4 h SER 30 Cb 1.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.62 3is4 h SER 30 CO -0.48 0.03 0.00 0.35 -1.14 0.00 0.00 176.83 175.59 3is4 n THR 31 N -3.31 0.02 0.20 -2.27 -2.24 0.53 -4.88 114.28 102.32 3is4 n THR 31 Ca -0.02 -0.06 0.07 0.00 -2.27 0.00 0.00 64.05 61.77 3is4 n THR 31 Cb 0.16 1.72 0.39 0.00 -2.10 0.00 0.00 70.33 70.51 3is4 n THR 31 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3is4 h GLN 32 N 0.00 0.00 -7.24 -0.78 4.15 -0.80 -3.28 115.11 107.15 3is4 h GLN 32 Ca 0.00 0.00 -0.51 0.00 0.77 0.00 0.00 58.65 58.91 3is4 h GLN 32 Cb 0.54 0.00 0.11 0.00 0.21 0.00 0.00 27.48 28.35 3is4 h GLN 32 CO 0.00 0.32 0.35 -1.54 -1.93 0.00 0.00 178.83 176.03 3is4 s SER 33 N -6.36 4.84 0.25 -0.69 1.04 -1.26 -4.78 113.70 106.74 3is4 s SER 33 Ca 0.00 1.94 -0.05 0.00 0.48 0.00 0.00 55.95 58.32 3is4 s SER 33 Cb 0.11 -2.54 0.30 0.00 0.10 0.00 0.00 66.02 63.98 3is4 s SER 33 CO 0.67 -1.81 1.92 -0.37 0.98 0.00 0.00 173.24 174.63 3is4 h VAL 34 N -0.42 1.22 -0.41 5.02 -1.51 -1.88 -0.94 116.25 117.33 3is4 h VAL 34 Ca -0.46 -0.45 -0.12 0.00 -1.23 0.00 0.00 66.70 64.44 3is4 h VAL 34 Cb 1.24 -0.22 -0.01 0.00 -2.13 0.00 0.00 31.29 30.17 3is4 h VAL 34 CO 0.53 0.24 -0.24 -0.33 -1.23 0.00 0.00 177.57 176.54 3is4 h GLU 35 N 1.33 0.85 -0.48 5.19 4.39 -1.94 0.28 114.58 124.19 3is4 h GLU 35 Ca 0.38 -0.36 -0.14 0.00 0.34 0.00 0.00 59.36 59.59 3is4 h GLU 35 Cb -0.09 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 3is4 h GLU 35 CO -0.10 0.99 -0.23 0.00 -1.16 0.00 0.00 179.01 178.52 3is4 h ALA 36 N 1.00 0.68 -0.65 3.43 0.00 -1.75 -1.26 119.26 120.71 3is4 h ALA 36 Ca 0.10 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.56 3is4 h ALA 36 Cb 0.77 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3is4 h ALA 36 CO 0.06 0.68 0.23 -0.07 0.00 0.00 0.00 179.25 180.15 3is4 h LEU 37 N 0.86 0.92 -0.68 0.00 3.38 -1.00 -0.37 115.31 118.42 3is4 h LEU 37 Ca 0.11 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.92 3is4 h LEU 37 Cb 0.81 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 3is4 h LEU 37 CO 0.07 0.87 0.42 0.11 0.09 0.00 0.00 178.44 179.99 3is4 h LYS 38 N 0.93 0.79 -0.76 1.13 1.57 -0.79 1.00 116.57 120.42 3is4 h LYS 38 Ca 0.21 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.98 3is4 h LYS 38 Cb 0.25 -0.18 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 3is4 h LYS 38 CO -0.01 0.52 0.48 0.78 -0.57 0.00 0.00 179.45 180.65 3is4 h GLY 39 N 0.81 1.11 0.89 3.86 0.00 -0.86 -1.19 103.07 107.69 3is4 h GLY 39 Ca 0.28 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.22 3is4 h GLY 39 CO -0.12 0.30 0.08 1.41 0.00 0.00 0.00 176.54 178.21 3is4 h LEU 40 N 0.93 0.37 0.12 3.11 4.07 -0.34 -0.52 115.31 123.04 3is4 h LEU 40 Ca 0.31 -0.20 0.01 0.00 0.08 0.00 0.00 57.88 58.08 3is4 h LEU 40 Cb 0.04 -0.10 -0.03 0.00 1.08 0.00 0.00 40.66 41.66 3is4 h LEU 40 CO -0.12 0.47 -0.21 0.40 -1.08 0.00 0.00 178.44 177.90 3is4 h ILE 41 N 0.24 0.53 0.00 1.22 2.04 -0.70 -1.06 117.51 119.78 3is4 h ILE 41 Ca 0.08 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 3is4 h ILE 41 Cb 0.24 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 3is4 h ILE 41 CO -0.00 0.00 -0.09 1.56 0.00 0.00 0.00 178.15 179.62 3is4 h GLN 42 N -0.40 0.00 0.00 2.37 4.20 -1.16 -1.54 115.11 118.58 3is4 h GLN 42 Ca 0.02 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.64 3is4 h GLN 42 Cb 0.42 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 3is4 h GLN 42 CO -0.11 0.09 -0.47 0.77 -0.67 0.00 0.00 178.83 178.44 3is4 h SER 43 N 0.00 0.00 0.00 1.46 0.02 -0.58 -3.47 113.55 110.98 3is4 h SER 43 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3is4 h SER 43 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3is4 h SER 43 CO 0.01 0.47 0.00 0.61 -1.14 0.00 0.00 176.83 176.78 3is4 n GLY 44 N 0.51 -0.40 3.73 -3.77 0.00 -0.55 -3.85 105.19 100.86 3is4 n GLY 44 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3is4 n GLY 44 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3is4 s MET 45 N 0.00 4.39 -0.03 1.61 0.00 -0.51 -4.28 119.30 120.49 3is4 s MET 45 Ca 0.00 1.98 0.09 0.00 0.00 0.00 0.00 55.69 57.76 3is4 s MET 45 Cb 0.00 -3.25 -0.14 0.00 0.00 0.00 0.00 34.83 31.45 3is4 s MET 45 CO 0.00 -0.28 0.17 0.43 0.00 0.00 0.00 175.02 175.34 3is4 n SER 46 N 3.23 2.83 -3.85 1.11 7.64 -0.56 -4.61 113.62 119.41 3is4 n SER 46 Ca 0.08 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.77 3is4 n SER 46 Cb 0.44 1.27 -0.16 0.00 -1.01 0.00 0.00 64.21 64.74 3is4 n SER 46 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3is4 s VAL 47 N -2.56 0.35 -0.34 0.44 1.01 -1.13 -2.12 120.40 116.05 3is4 s VAL 47 Ca -0.04 -0.01 -0.14 0.00 0.00 0.00 0.00 61.98 61.80 3is4 s VAL 47 Cb 0.05 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 36.00 3is4 s VAL 47 CO 0.39 0.19 0.30 0.00 0.00 0.00 0.00 175.10 175.97 3is4 s ALA 48 N 1.02 3.50 -0.09 5.51 0.00 -0.34 -0.61 121.76 130.75 3is4 s ALA 48 Ca -0.10 -1.29 -0.17 0.00 0.00 0.00 0.00 51.96 50.41 3is4 s ALA 48 Cb -0.14 -2.74 -0.05 0.00 0.00 0.00 0.00 23.12 20.20 3is4 s ALA 48 CO -0.01 -1.01 0.43 0.50 0.00 0.00 0.00 175.76 175.67 3is4 s ARG 49 N 1.87 4.22 -0.28 0.00 3.52 0.65 -1.21 118.95 127.72 3is4 s ARG 49 Ca 0.09 0.39 -0.07 0.00 -0.13 0.00 0.00 55.73 56.00 3is4 s ARG 49 Cb -0.17 -3.38 -0.00 0.00 -1.56 0.00 0.00 34.95 29.84 3is4 s ARG 49 CO 0.11 0.32 0.08 -1.64 -0.81 0.00 0.00 175.30 173.36 3is4 s MET 50 N 0.13 3.29 -0.68 5.12 -1.94 0.09 -1.73 119.30 123.58 3is4 s MET 50 Ca 0.24 -0.72 -0.25 0.00 -1.71 0.00 0.00 55.69 53.25 3is4 s MET 50 Cb -0.15 -3.37 0.05 0.00 2.01 0.00 0.00 34.83 33.37 3is4 s MET 50 CO 0.10 -0.36 1.10 1.21 -0.01 0.00 0.00 175.02 177.06 3is4 s ASN 51 N 1.55 6.19 0.00 3.03 3.84 -1.26 -1.31 114.94 126.97 3is4 s ASN 51 Ca 0.04 -0.68 0.10 0.00 0.21 0.00 0.00 52.86 52.52 3is4 s ASN 51 Cb -0.16 -2.48 0.58 0.00 -0.55 0.00 0.00 41.25 38.63 3is4 s ASN 51 CO 0.03 -1.59 1.27 0.49 -2.79 0.00 0.00 177.10 174.51 3is4 n PHE 52 N 8.39 0.00 0.22 0.43 3.01 -0.15 -2.64 117.46 126.72 3is4 n PHE 52 Ca -0.00 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.54 3is4 n PHE 52 Cb 0.47 0.00 0.49 0.00 -0.01 0.00 0.00 39.48 40.43 3is4 n PHE 52 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3is4 h SER 53 N 0.00 0.00 -4.02 4.37 0.02 -1.84 -3.38 113.55 108.70 3is4 h SER 53 Ca 0.00 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.63 3is4 h SER 53 Cb 0.00 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 62.39 3is4 h SER 53 CO 0.00 0.26 -0.71 -1.00 -1.14 0.00 0.00 176.83 174.24 3is4 s HIS 54 N -3.94 1.24 0.00 3.45 3.76 -1.08 -5.01 115.29 113.71 3is4 s HIS 54 Ca -0.01 -0.77 0.00 0.00 -0.15 0.00 0.00 55.06 54.12 3is4 s HIS 54 Cb 0.12 -0.64 0.00 0.00 1.11 0.00 0.00 32.58 33.18 3is4 s HIS 54 CO 0.65 0.06 0.00 0.41 -0.85 0.00 0.00 174.74 175.01 3is4 n GLY 55 N -0.19 -1.69 3.97 -2.22 0.00 -1.26 -4.84 105.19 98.96 3is4 n GLY 55 Ca -0.10 -1.41 -0.23 0.00 0.00 0.00 0.00 46.02 44.28 3is4 n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3is4 s SER 56 N -2.41 4.78 0.28 1.61 1.04 -1.26 -4.94 113.70 112.80 3is4 s SER 56 Ca 0.00 -0.06 -0.01 0.00 0.48 0.00 0.00 55.95 56.36 3is4 s SER 56 Cb 0.00 -0.56 0.47 0.00 0.10 0.00 0.00 66.02 66.03 3is4 s SER 56 CO 0.00 -1.54 1.87 0.45 0.98 0.00 0.00 173.24 175.00 3is4 h HIS 57 N -0.32 1.17 -0.84 5.02 -0.00 -1.98 -1.94 115.15 116.26 3is4 h HIS 57 Ca -0.40 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.00 3is4 h HIS 57 Cb 1.29 -0.38 -0.04 0.00 -0.00 0.00 0.00 27.41 28.27 3is4 h HIS 57 CO 0.11 0.56 0.55 1.49 -0.00 0.00 0.00 177.93 180.63 3is4 h GLU 58 N 1.10 1.12 -0.19 2.45 4.81 -1.99 0.21 114.58 122.10 3is4 h GLU 58 Ca 0.46 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.60 3is4 h GLU 58 Cb 0.29 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 3is4 h GLU 58 CO -0.21 0.76 0.08 -0.92 -0.73 0.00 0.00 179.01 178.00 3is4 h TYR 59 N 1.15 0.27 0.00 0.92 3.20 -1.79 -2.73 116.97 117.99 3is4 h TYR 59 Ca 0.31 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 62.08 3is4 h TYR 59 Cb -0.11 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.07 3is4 h TYR 59 CO -0.01 0.31 -0.40 0.45 -1.64 0.00 0.00 178.16 176.87 3is4 h HIS 60 N 0.16 0.00 -0.87 -3.82 3.86 -1.00 -2.27 115.15 111.21 3is4 h HIS 60 Ca 0.06 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.25 3is4 h HIS 60 Cb 0.14 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.57 3is4 h HIS 60 CO -0.02 0.40 0.47 0.37 0.86 0.00 0.00 177.93 180.01 3is4 h GLN 61 N 0.00 1.22 -0.56 2.45 5.75 -0.50 -0.29 115.11 123.17 3is4 h GLN 61 Ca -0.00 -0.15 -0.02 0.00 -0.15 0.00 0.00 58.65 58.33 3is4 h GLN 61 Cb 0.90 -0.24 -0.03 0.00 1.07 0.00 0.00 27.48 29.19 3is4 h GLN 61 CO 0.05 0.90 0.27 1.15 -2.65 0.00 0.00 178.83 178.55 3is4 h THR 62 N 1.22 1.21 0.26 2.39 2.02 -1.10 0.71 112.91 119.61 3is4 h THR 62 Ca 0.31 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.90 3is4 h THR 62 Cb 0.04 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 3is4 h THR 62 CO -0.05 0.24 -0.27 0.74 0.37 0.00 0.00 175.52 176.54 3is4 h THR 63 N 0.76 0.42 -0.25 3.16 2.02 -1.17 0.44 112.91 118.29 3is4 h THR 63 Ca 0.19 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.43 3is4 h THR 63 Cb 0.13 0.42 -0.06 0.00 -1.74 0.00 0.00 68.15 66.89 3is4 h THR 63 CO -0.02 0.00 -0.18 0.40 0.37 0.00 0.00 175.52 176.09 3is4 h ILE 64 N -0.57 0.51 -0.48 3.11 2.04 -0.80 0.66 117.51 121.97 3is4 h ILE 64 Ca -0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 3is4 h ILE 64 Cb 0.53 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 3is4 h ILE 64 CO -0.07 0.00 0.28 0.78 0.00 0.00 0.00 178.15 179.14 3is4 h ASN 65 N -0.17 0.59 0.08 1.72 2.35 -0.79 -2.56 115.58 116.79 3is4 h ASN 65 Ca 0.14 -0.07 -0.13 0.00 -0.55 0.00 0.00 56.30 55.69 3is4 h ASN 65 Cb 0.38 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 3is4 h ASN 65 CO -0.35 0.48 -0.43 0.78 -1.65 0.00 0.00 177.43 176.27 3is4 h ASN 66 N 0.64 0.46 0.10 5.81 2.35 -0.47 -1.70 115.58 122.78 3is4 h ASN 66 Ca 0.17 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 3is4 h ASN 66 Cb 0.01 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.25 3is4 h ASN 66 CO -0.03 0.83 -0.05 0.58 -1.65 0.00 0.00 177.43 177.11 3is4 h VAL 67 N 0.36 0.99 -0.90 2.81 2.07 -0.79 0.73 116.25 121.52 3is4 h VAL 67 Ca 0.03 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.21 3is4 h VAL 67 Cb 0.90 1.23 -0.05 0.00 -1.52 0.00 0.00 31.29 31.85 3is4 h VAL 67 CO 0.08 0.09 0.59 0.03 0.02 0.00 0.00 177.57 178.37 3is4 h ARG 68 N -0.31 1.13 -0.18 1.57 3.08 -1.42 0.16 114.38 118.41 3is4 h ARG 68 Ca -0.01 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 3is4 h ARG 68 Cb 0.26 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3is4 h ARG 68 CO 0.02 0.75 -0.06 0.37 -1.07 0.00 0.00 179.97 179.98 3is4 h GLN 69 N 1.16 0.36 -0.72 0.04 4.15 -1.20 -0.45 115.11 118.46 3is4 h GLN 69 Ca 0.35 -0.15 0.01 0.00 0.77 0.00 0.00 58.65 59.64 3is4 h GLN 69 Cb -0.04 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.60 3is4 h GLN 69 CO -0.11 0.64 0.47 0.00 -1.93 0.00 0.00 178.83 177.91 3is4 h ALA 70 N 0.71 0.92 -0.35 3.38 0.00 -0.55 -1.83 119.26 121.55 3is4 h ALA 70 Ca 0.04 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3is4 h ALA 70 Cb 0.52 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3is4 h ALA 70 CO 0.02 0.31 -0.04 0.00 0.00 0.00 0.00 179.25 179.54 3is4 h ALA 71 N 1.27 0.47 -0.84 0.00 0.00 -0.61 -2.68 119.26 116.87 3is4 h ALA 71 Ca 0.27 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3is4 h ALA 71 Cb -0.09 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 3is4 h ALA 71 CO -0.07 0.28 0.51 0.00 0.00 0.00 0.00 179.25 179.97 3is4 h ALA 72 N 0.84 1.32 -0.05 0.00 0.00 -0.94 0.14 119.26 120.57 3is4 h ALA 72 Ca 0.09 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 3is4 h ALA 72 Cb 0.52 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3is4 h ALA 72 CO 0.03 0.59 -0.53 0.93 0.00 0.00 0.00 179.25 180.26 3is4 h GLU 73 N 1.15 0.15 -0.00 0.00 5.08 -1.21 -2.58 114.58 117.17 3is4 h GLU 73 Ca 0.30 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 3is4 h GLU 73 Cb -0.05 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.20 3is4 h GLU 73 CO -0.06 0.65 -0.54 1.28 -1.00 0.00 0.00 179.01 179.34 3is4 n LEU 74 N -3.92 0.55 -1.32 1.33 4.77 -1.02 -4.98 117.00 112.41 3is4 n LEU 74 Ca -0.02 -0.05 -0.09 0.00 -0.03 0.00 0.00 56.01 55.83 3is4 n LEU 74 Cb 0.56 -0.23 0.01 0.00 -2.33 0.00 0.00 43.42 41.44 3is4 n LEU 74 CO 0.43 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 3is4 n GLY 75 N 1.50 0.22 3.61 -0.72 0.00 0.35 -5.05 105.19 105.10 3is4 n GLY 75 Ca 0.05 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.37 3is4 n GLY 75 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3is4 s VAL 76 N -2.78 1.73 -0.22 1.61 -7.23 -0.25 -5.01 120.40 108.24 3is4 s VAL 76 Ca 0.12 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.26 3is4 s VAL 76 Cb -0.05 -2.84 -0.00 0.00 0.56 0.00 0.00 36.38 34.05 3is4 s VAL 76 CO 0.15 0.00 -0.07 0.20 -0.31 0.00 0.00 175.10 175.07 3is4 s ASN 77 N -3.70 4.12 -0.13 4.85 0.01 -1.26 -4.32 114.94 114.52 3is4 s ASN 77 Ca 0.31 -0.44 0.01 0.00 -0.71 0.00 0.00 52.86 52.03 3is4 s ASN 77 Cb 0.08 -1.70 -0.01 0.00 0.41 0.00 0.00 41.25 40.04 3is4 s ASN 77 CO 0.16 -0.02 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.94 3is4 s ILE 78 N 1.45 2.78 0.42 0.60 -1.09 -1.26 -4.81 121.20 119.30 3is4 s ILE 78 Ca 0.06 -0.75 -0.23 0.00 -2.23 0.00 0.00 60.65 57.49 3is4 s ILE 78 Cb -0.14 -2.15 -0.09 0.00 -1.58 0.00 0.00 42.46 38.50 3is4 s ILE 78 CO -0.05 0.53 1.06 0.00 -1.23 0.00 0.00 174.94 175.25 3is4 s ALA 79 N 0.44 3.03 -0.20 9.38 0.00 -0.90 -4.92 121.76 128.58 3is4 s ALA 79 Ca -0.12 0.71 0.01 0.00 0.00 0.00 0.00 51.96 52.56 3is4 s ALA 79 Cb -0.16 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.70 3is4 s ALA 79 CO 0.05 -0.29 -0.17 0.42 0.00 0.00 0.00 175.76 175.78 3is4 s ILE 80 N -1.71 2.26 -0.12 0.00 1.01 -1.26 -1.20 121.20 120.18 3is4 s ILE 80 Ca 0.60 -0.97 -0.02 0.00 0.00 0.00 0.00 60.65 60.27 3is4 s ILE 80 Cb -0.22 -2.01 -0.03 0.00 0.01 0.00 0.00 42.46 40.22 3is4 s ILE 80 CO 0.27 0.45 -0.06 0.00 0.00 0.00 0.00 174.94 175.60 3is4 s ALA 81 N 1.29 2.95 -0.38 9.38 0.00 -0.35 -1.41 121.76 133.24 3is4 s ALA 81 Ca 0.03 -0.85 -0.12 0.00 0.00 0.00 0.00 51.96 51.02 3is4 s ALA 81 Cb -0.14 -1.39 0.02 0.00 0.00 0.00 0.00 23.12 21.61 3is4 s ALA 81 CO -0.11 0.36 0.23 -1.17 0.00 0.00 0.00 175.76 175.07 3is4 s LEU 82 N -0.09 4.78 -0.41 0.00 0.20 -0.53 -0.73 118.68 121.89 3is4 s LEU 82 Ca 0.01 -0.93 -0.17 0.00 0.69 0.00 0.00 54.13 53.73 3is4 s LEU 82 Cb -0.13 -2.06 0.02 0.00 -0.43 0.00 0.00 46.19 43.59 3is4 s LEU 82 CO 0.03 -0.39 0.40 -0.62 -0.29 0.00 0.00 176.35 175.48 3is4 s ASP 83 N 1.59 6.18 0.50 3.68 -1.08 -0.43 -0.57 116.67 126.53 3is4 s ASP 83 Ca 0.03 -0.66 -0.20 0.00 -0.52 0.00 0.00 52.55 51.20 3is4 s ASP 83 Cb -0.19 -2.21 -0.07 0.00 -1.46 0.00 0.00 42.92 38.99 3is4 s ASP 83 CO 0.08 -0.53 1.08 0.42 0.52 0.00 0.00 175.17 176.74 3is4 s THR 84 N 2.04 3.49 0.12 1.71 -4.23 -0.87 -0.98 115.64 116.92 3is4 s THR 84 Ca 0.11 0.95 -0.20 0.00 -1.18 0.00 0.00 61.69 61.37 3is4 s THR 84 Cb -0.17 -3.40 -0.08 0.00 1.34 0.00 0.00 72.50 70.19 3is4 s THR 84 CO 0.13 -0.18 1.76 0.50 -0.54 0.00 0.00 174.62 176.29 3is4 h LYS 85 N 1.50 0.17 0.00 3.99 3.64 -1.93 -3.40 116.57 120.55 3is4 h LYS 85 Ca -0.50 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 3is4 h LYS 85 Cb 1.24 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 3is4 h LYS 85 CO 0.58 0.12 0.00 0.41 -2.27 0.00 0.00 179.45 178.29 3is4 n GLY 86 N -1.14 -1.59 3.77 5.01 0.00 -1.26 -4.90 105.19 105.08 3is4 n GLY 86 Ca -0.04 -1.53 -0.37 0.00 0.00 0.00 0.00 46.02 44.08 3is4 n GLY 86 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3is4 s PRO 87 N -1.57 3.71 0.01 1.61 0.02 -1.26 -4.77 135.00 132.76 3is4 s PRO 87 Ca 0.00 1.78 0.00 0.00 0.02 0.00 0.00 61.00 62.80 3is4 s PRO 87 Cb 0.00 -2.38 -0.01 0.00 0.02 0.00 0.00 34.50 32.13 3is4 s PRO 87 CO 0.00 -0.59 -0.02 -1.21 -0.33 0.00 0.00 177.00 174.84 3is4 s GLU 88 N -2.74 0.23 -0.24 5.54 2.02 -1.26 -4.98 118.70 117.28 3is4 s GLU 88 Ca 0.64 -0.44 -0.06 0.00 0.02 0.00 0.00 54.97 55.13 3is4 s GLU 88 Cb -0.29 0.07 -0.02 0.00 0.10 0.00 0.00 34.13 33.99 3is4 s GLU 88 CO 0.35 -0.03 0.04 0.42 0.02 0.00 0.00 175.26 176.05 3is4 s ILE 89 N -1.05 4.03 0.18 -1.63 1.01 -1.26 -4.90 121.20 117.57 3is4 s ILE 89 Ca -0.11 -0.27 0.08 0.00 0.00 0.00 0.00 60.65 60.35 3is4 s ILE 89 Cb -0.07 -2.87 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 3is4 s ILE 89 CO -0.01 0.37 -0.17 -0.13 0.00 0.00 0.00 174.94 175.00 3is4 s ARG 90 N 1.55 1.27 0.88 2.79 0.52 -1.26 -0.61 118.95 124.09 3is4 s ARG 90 Ca 0.06 -1.45 -0.12 0.00 -0.52 0.00 0.00 55.73 53.69 3is4 s ARG 90 Cb -0.15 -1.22 0.12 0.00 0.52 0.00 0.00 34.95 34.22 3is4 s ARG 90 CO 0.02 0.23 1.14 0.95 0.02 0.00 0.00 175.30 177.66 3is4 s THR 91 N -2.37 2.12 0.00 0.02 -4.23 0.49 -1.33 115.64 110.34 3is4 s THR 91 Ca 0.17 0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.72 3is4 s THR 91 Cb -0.04 -2.83 0.00 0.00 1.34 0.00 0.00 72.50 70.97 3is4 s THR 91 CO 0.06 -0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 3is4 n GLY 92 N -2.37 0.05 3.93 3.99 0.00 0.50 -3.84 105.19 107.45 3is4 n GLY 92 Ca 0.07 -1.71 -0.25 0.00 0.00 0.00 0.00 46.02 44.13 3is4 n GLY 92 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3is4 s GLN 93 N 0.73 3.39 0.13 1.61 -0.21 0.96 -1.90 119.66 124.37 3is4 s GLN 93 Ca 0.00 -0.16 0.10 0.00 0.02 0.00 0.00 55.36 55.32 3is4 s GLN 93 Cb 0.00 -2.52 -0.04 0.00 1.00 0.00 0.00 33.01 31.45 3is4 s GLN 93 CO 0.00 -0.10 -0.25 -0.06 -2.12 0.00 0.00 175.29 172.76 3is4 s PHE 94 N -2.55 2.18 -0.13 0.91 0.08 -1.26 -1.50 117.98 115.71 3is4 s PHE 94 Ca 0.45 -0.39 -0.29 0.00 0.12 0.00 0.00 56.93 56.82 3is4 s PHE 94 Cb -0.10 -1.18 -0.04 0.00 -0.57 0.00 0.00 43.02 41.13 3is4 s PHE 94 CO 0.40 0.31 1.66 0.08 -0.10 0.00 0.00 175.22 177.57 3is4 s VAL 95 N -1.11 3.61 0.00 -0.44 1.01 0.63 -0.78 120.40 123.32 3is4 s VAL 95 Ca 0.12 0.71 0.00 0.00 0.00 0.00 0.00 61.98 62.82 3is4 s VAL 95 Cb -0.10 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.74 3is4 s VAL 95 CO 0.06 -0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.61 3is4 n GLY 96 N 4.41 0.67 2.42 4.51 0.00 -1.26 -4.13 105.19 111.81 3is4 n GLY 96 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 3is4 n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3is4 n GLY 97 N -2.61 1.30 3.43 -0.02 0.00 0.04 -4.96 105.19 102.37 3is4 n GLY 97 Ca 0.00 -0.31 -0.16 0.00 0.00 0.00 0.00 46.02 45.55 3is4 n GLY 97 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3is4 s ASP 98 N -2.77 -0.51 -0.19 1.61 2.15 -1.26 -3.95 116.67 111.75 3is4 s ASP 98 Ca 0.00 0.44 -0.04 0.00 0.43 0.00 0.00 52.55 53.38 3is4 s ASP 98 Cb 0.00 0.48 0.10 0.00 -0.30 0.00 0.00 42.92 43.20 3is4 s ASP 98 CO 0.00 -0.61 0.31 0.00 -0.17 0.00 0.00 175.17 174.70 3is4 s ALA 99 N -1.55 -0.73 -0.58 3.66 0.00 -0.62 -4.56 121.76 117.38 3is4 s ALA 99 Ca -0.10 0.84 -0.23 0.00 0.00 0.00 0.00 51.96 52.46 3is4 s ALA 99 Cb -0.01 -1.34 0.05 0.00 0.00 0.00 0.00 23.12 21.82 3is4 s ALA 99 CO 0.06 -0.99 0.94 0.08 0.00 0.00 0.00 175.76 175.85 3is4 s VAL 100 N 2.46 4.38 -0.07 0.00 1.01 -1.26 -1.99 120.40 124.93 3is4 s VAL 100 Ca 0.06 0.07 -0.16 0.00 0.00 0.00 0.00 61.98 61.95 3is4 s VAL 100 Cb -0.14 -4.57 -0.05 0.00 0.00 0.00 0.00 36.38 31.62 3is4 s VAL 100 CO -0.12 -1.20 0.42 -0.04 0.00 0.00 0.00 175.10 174.16 3is4 s MET 101 N 3.95 4.16 0.02 2.72 -1.94 -1.03 -4.91 119.30 122.27 3is4 s MET 101 Ca 0.27 0.39 0.07 0.00 -1.71 0.00 0.00 55.69 54.71 3is4 s MET 101 Cb -0.14 -3.34 -0.02 0.00 2.01 0.00 0.00 34.83 33.34 3is4 s MET 101 CO 0.16 0.39 -0.21 -1.21 -0.01 0.00 0.00 175.02 174.15 3is4 s GLU 102 N -0.12 1.53 0.19 2.03 2.02 -1.26 -1.98 118.70 121.11 3is4 s GLU 102 Ca 0.24 -0.85 -0.33 0.00 0.02 0.00 0.00 54.97 54.05 3is4 s GLU 102 Cb -0.16 -1.57 -0.13 0.00 0.10 0.00 0.00 34.13 32.37 3is4 s GLU 102 CO 0.11 0.42 1.64 -2.13 0.02 0.00 0.00 175.26 175.31 3is4 n ARG 103 N 2.19 2.44 0.00 1.61 0.63 -1.26 -2.14 116.66 120.12 3is4 n ARG 103 Ca -0.16 0.88 0.00 0.00 -0.92 0.00 0.00 57.85 57.65 3is4 n ARG 103 Cb 0.53 -2.68 0.00 0.00 0.45 0.00 0.00 32.46 30.76 3is4 n ARG 103 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3is4 n GLY 104 N 3.57 3.08 3.76 5.14 0.00 -0.28 -5.00 105.19 115.47 3is4 n GLY 104 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 3is4 n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3is4 s ALA 105 N -2.70 2.57 -0.14 4.61 0.00 -0.91 -4.75 121.76 120.44 3is4 s ALA 105 Ca 0.00 0.93 -0.09 0.00 0.00 0.00 0.00 51.96 52.80 3is4 s ALA 105 Cb 0.00 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 3is4 s ALA 105 CO 0.00 -1.08 0.17 0.99 0.00 0.00 0.00 175.76 175.84 3is4 s THR 106 N -1.69 5.43 0.21 0.00 2.01 -1.26 -1.20 115.64 119.13 3is4 s THR 106 Ca 0.76 0.28 0.01 0.00 0.31 0.00 0.00 61.69 63.04 3is4 s THR 106 Cb -0.28 -3.46 -0.05 0.00 0.01 0.00 0.00 72.50 68.72 3is4 s THR 106 CO 0.32 0.55 0.05 0.00 -0.69 0.00 0.00 174.62 174.84 3is4 s TYR 108 N -3.74 2.13 -0.20 0.00 1.51 0.31 -0.53 117.35 116.83 3is4 s TYR 108 Ca 0.30 -1.24 -0.12 0.00 -1.01 0.00 0.00 57.07 55.00 3is4 s TYR 108 Cb 0.07 -1.56 -0.05 0.00 -0.11 0.00 0.00 41.96 40.32 3is4 s TYR 108 CO 0.08 -0.67 0.22 0.14 -1.11 0.00 0.00 175.55 174.22 3is4 s VAL 109 N 1.50 5.33 0.08 0.71 -7.23 -0.80 -1.38 120.40 118.61 3is4 s VAL 109 Ca 0.03 0.36 0.07 0.00 -1.81 0.00 0.00 61.98 60.64 3is4 s VAL 109 Cb -0.14 -3.56 -0.03 0.00 0.56 0.00 0.00 36.38 33.21 3is4 s VAL 109 CO -0.10 0.36 -0.19 0.28 -0.31 0.00 0.00 175.10 175.15 3is4 s THR 110 N 0.78 1.54 -2.21 5.32 -1.32 -0.08 -1.07 115.64 118.60 3is4 s THR 110 Ca 0.12 -1.40 0.22 0.00 -1.21 0.00 0.00 61.69 59.42 3is4 s THR 110 Cb -0.13 -1.40 0.48 0.00 -1.51 0.00 0.00 72.50 69.94 3is4 s THR 110 CO 0.03 -0.05 1.42 0.35 -2.21 0.00 0.00 174.62 174.17 3is4 n THR 111 N 1.31 0.67 -2.24 5.08 -2.24 -0.37 -1.28 114.28 115.22 3is4 n THR 111 Ca -0.19 -0.83 -0.43 0.00 -2.27 0.00 0.00 64.05 60.33 3is4 n THR 111 Cb 0.54 0.82 -0.02 0.00 -2.10 0.00 0.00 70.33 69.57 3is4 n THR 111 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3is4 s ASP 112 N -1.30 6.76 0.62 3.42 2.15 -1.26 -4.91 116.67 122.15 3is4 s ASP 112 Ca 0.40 1.84 0.35 0.00 0.43 0.00 0.00 52.55 55.58 3is4 s ASP 112 Cb 0.23 -2.54 2.00 0.00 -0.30 0.00 0.00 42.92 42.31 3is4 s ASP 112 CO 0.31 -0.90 2.25 -0.65 -0.17 0.00 0.00 175.17 176.01 3is4 h PRO 113 N 9.07 0.00 -0.13 4.34 0.11 -1.97 -2.64 132.00 140.79 3is4 h PRO 113 Ca -0.32 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.82 3is4 h PRO 113 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3is4 h PRO 113 CO 0.97 0.00 0.09 0.00 -0.21 0.00 0.00 178.00 178.85 3is4 h ALA 114 N 1.92 2.08 -0.40 -0.75 0.00 -2.00 -2.01 119.26 118.11 3is4 h ALA 114 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3is4 h ALA 114 Cb 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3is4 h ALA 114 CO -0.00 -0.11 0.00 1.19 0.00 0.00 0.00 179.25 180.33 3is4 n PHE 115 N -4.51 0.53 -0.18 0.00 3.72 -0.99 -4.31 117.46 111.72 3is4 n PHE 115 Ca -0.00 -0.26 -0.01 0.00 -0.05 0.00 0.00 57.45 57.12 3is4 n PHE 115 Cb 0.19 0.00 0.22 0.00 -0.94 0.00 0.00 39.48 38.95 3is4 n PHE 115 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3is4 h ALA 116 N 3.86 1.34 0.00 4.37 0.00 -1.54 -3.16 119.26 124.14 3is4 h ALA 116 Ca 0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 3is4 h ALA 116 Cb 0.58 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3is4 h ALA 116 CO 0.00 0.52 -1.68 -0.40 0.00 0.00 0.00 179.25 177.69 3is4 n ASP 117 N -4.35 0.35 -2.58 0.00 5.75 -1.26 -0.03 116.55 114.42 3is4 n ASP 117 Ca 0.06 0.14 -0.25 0.00 -0.01 0.00 0.00 54.79 54.73 3is4 n ASP 117 Cb 0.12 1.24 -0.00 0.00 -1.03 0.00 0.00 41.12 41.45 3is4 n ASP 117 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 3is4 n LYS 118 N -2.50 3.17 -2.60 0.11 2.85 -1.19 -4.48 118.16 113.51 3is4 n LYS 118 Ca -0.06 -4.44 -0.33 0.00 -1.05 0.00 0.00 58.31 52.42 3is4 n LYS 118 Cb 0.65 -2.16 -0.04 0.00 -0.65 0.00 0.00 35.03 32.83 3is4 n LYS 118 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3is4 s GLY 119 N -3.48 2.42 0.31 2.58 0.00 -0.57 -4.78 107.32 103.81 3is4 s GLY 119 Ca 0.46 0.49 0.04 0.00 0.00 0.00 0.00 44.72 45.72 3is4 s GLY 119 CO -0.16 0.79 0.20 -0.51 0.00 0.00 0.00 173.10 173.42 3is4 s THR 120 N -2.12 0.20 0.59 0.90 -4.23 0.54 -0.27 115.64 111.24 3is4 s THR 120 Ca 0.65 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 59.44 3is4 s THR 120 Cb -0.13 -2.48 0.35 0.00 1.34 0.00 0.00 72.50 71.57 3is4 s THR 120 CO 0.19 0.00 2.24 0.07 -0.54 0.00 0.00 174.62 176.58 3is4 h LYS 121 N 2.18 0.00 0.17 3.99 2.10 -1.91 -2.98 116.57 120.13 3is4 h LYS 121 Ca -0.31 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.04 3is4 h LYS 121 Cb 1.25 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.59 3is4 h LYS 121 CO 0.47 0.00 -1.49 -0.44 -2.00 0.00 0.00 179.45 175.99 3is4 h ASP 122 N 0.00 0.58 -3.34 7.07 3.32 -1.93 -3.43 116.42 118.69 3is4 h ASP 122 Ca 0.01 -0.91 -0.18 0.00 0.02 0.00 0.00 57.03 55.96 3is4 h ASP 122 Cb 0.03 -0.19 -0.29 0.00 0.22 0.00 0.00 39.33 39.10 3is4 h ASP 122 CO -0.00 1.68 -0.44 -0.75 -1.72 0.00 0.00 179.24 178.01 3is4 s LYS 123 N -2.53 0.25 0.20 3.56 2.20 -1.12 0.11 119.74 122.40 3is4 s LYS 123 Ca -0.16 0.58 -0.13 0.00 -0.36 0.00 0.00 55.97 55.91 3is4 s LYS 123 Cb 0.04 -0.09 0.00 0.00 -1.51 0.00 0.00 37.83 36.28 3is4 s LYS 123 CO 0.84 -0.16 0.41 -0.59 -0.36 0.00 0.00 175.35 175.50 3is4 s PHE 124 N 1.25 0.24 0.09 4.03 -0.71 -0.48 -0.34 117.98 122.06 3is4 s PHE 124 Ca -0.09 -0.60 -0.14 0.00 -1.04 0.00 0.00 56.93 55.06 3is4 s PHE 124 Cb -0.10 0.15 -0.06 0.00 -1.21 0.00 0.00 43.02 41.80 3is4 s PHE 124 CO -0.09 -0.86 0.48 -0.47 -1.34 0.00 0.00 175.22 172.94 3is4 s TYR 125 N -3.96 3.65 -0.08 3.49 5.04 -1.25 -0.90 117.35 123.33 3is4 s TYR 125 Ca 0.17 1.00 0.01 0.00 -2.44 0.00 0.00 57.07 55.81 3is4 s TYR 125 Cb 0.01 -2.31 0.02 0.00 0.35 0.00 0.00 41.96 40.02 3is4 s TYR 125 CO 0.02 0.52 -0.08 0.42 -1.34 0.00 0.00 175.55 175.09 3is4 s ILE 126 N -1.32 0.93 -1.92 3.14 1.01 -0.40 -0.37 121.20 122.26 3is4 s ILE 126 Ca 0.32 -0.28 0.23 0.00 0.00 0.00 0.00 60.65 60.92 3is4 s ILE 126 Cb -0.16 -0.92 0.62 0.00 0.01 0.00 0.00 42.46 42.01 3is4 s ILE 126 CO 0.18 0.33 1.74 -0.90 0.00 0.00 0.00 174.94 176.29 3is4 n ASP 127 N 4.48 0.00 -4.49 3.58 5.68 -0.44 -4.36 116.55 121.00 3is4 n ASP 127 Ca -0.17 -0.63 -0.43 0.00 -0.50 0.00 0.00 54.79 53.06 3is4 n ASP 127 Cb 0.51 -0.04 -0.04 0.00 -1.14 0.00 0.00 41.12 40.41 3is4 n ASP 127 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3is4 s TYR 128 N -2.08 2.63 0.35 2.11 5.04 -1.26 -4.91 117.35 119.24 3is4 s TYR 128 Ca 0.33 -0.33 0.38 0.00 -2.44 0.00 0.00 57.07 55.01 3is4 s TYR 128 Cb 0.16 -4.30 1.83 0.00 0.35 0.00 0.00 41.96 39.99 3is4 s TYR 128 CO 0.28 -1.66 2.15 1.96 -1.34 0.00 0.00 175.55 176.94 3is4 h GLN 129 N 9.59 0.00 -0.49 4.97 4.20 -1.91 -1.62 115.11 129.85 3is4 h GLN 129 Ca -0.28 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.43 3is4 h GLN 129 Cb 1.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.85 3is4 h GLN 129 CO 1.18 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 179.43 3is4 n ASN 130 N -3.10 2.62 -0.17 1.46 3.02 -1.26 -4.61 115.26 113.22 3is4 n ASN 130 Ca -0.01 -2.01 -0.02 0.00 -0.03 0.00 0.00 54.58 52.51 3is4 n ASN 130 Cb 0.20 -0.33 0.06 0.00 -0.61 0.00 0.00 39.78 39.10 3is4 n ASN 130 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3is4 h LEU 131 N 2.82 -0.29 -0.43 3.41 5.85 -1.69 -2.69 115.31 122.30 3is4 h LEU 131 Ca 0.00 0.13 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 3is4 h LEU 131 Cb 0.66 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 3is4 h LEU 131 CO 0.01 -0.11 -0.25 0.28 -0.34 0.00 0.00 178.44 178.03 3is4 h SER 132 N 0.08 0.97 1.25 1.25 0.02 -1.85 -2.37 113.55 112.91 3is4 h SER 132 Ca 0.26 -0.42 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 3is4 h SER 132 Cb 0.40 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.67 3is4 h SER 132 CO -0.46 1.18 0.00 2.29 -1.14 0.00 0.00 176.83 178.69 3is4 n LYS 133 N -4.14 0.18 -0.05 3.45 2.85 -1.14 -3.40 118.16 115.91 3is4 n LYS 133 Ca -0.01 0.19 -0.08 0.00 -1.05 0.00 0.00 58.31 57.35 3is4 n LYS 133 Cb 0.47 -1.73 -0.15 0.00 -0.65 0.00 0.00 35.03 32.98 3is4 n LYS 133 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 3is4 n VAL 134 N -2.05 1.46 -3.62 0.58 0.31 -1.03 -4.94 118.33 109.04 3is4 n VAL 134 Ca 0.05 -0.81 -0.36 0.00 -0.01 0.00 0.00 64.34 63.21 3is4 n VAL 134 Cb 0.38 -0.74 -0.06 0.00 -0.91 0.00 0.00 33.84 32.51 3is4 n VAL 134 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3is4 s VAL 135 N -2.59 5.16 0.30 2.52 1.01 -0.90 -4.77 120.40 121.13 3is4 s VAL 135 Ca -0.07 0.50 0.09 0.00 0.00 0.00 0.00 61.98 62.50 3is4 s VAL 135 Cb 0.07 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 3is4 s VAL 135 CO 0.83 0.45 0.07 -0.13 0.00 0.00 0.00 175.10 176.31 3is4 s ARG 136 N -1.48 2.35 0.28 2.72 1.81 -1.26 -4.89 118.95 118.48 3is4 s ARG 136 Ca 0.26 -1.47 -0.30 0.00 -1.72 0.00 0.00 55.73 52.50 3is4 s ARG 136 Cb -0.14 -2.18 -0.11 0.00 -0.45 0.00 0.00 34.95 32.06 3is4 s ARG 136 CO 0.14 0.25 1.62 -2.14 -0.68 0.00 0.00 175.30 174.50 3is4 s PRO 137 N -3.75 4.12 0.00 3.54 0.02 -1.26 -2.42 135.00 135.24 3is4 s PRO 137 Ca 0.34 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.96 3is4 s PRO 137 Cb -0.05 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.45 3is4 s PRO 137 CO 0.21 -0.66 0.00 0.41 -0.33 0.00 0.00 177.00 176.63 3is4 n GLY 138 N 2.44 2.51 3.72 0.52 0.00 0.29 -5.01 105.19 109.67 3is4 n GLY 138 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 3is4 n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3is4 s ASN 139 N -0.04 4.12 0.01 1.61 0.01 -1.02 -4.69 114.94 114.95 3is4 s ASN 139 Ca 0.00 2.29 0.01 0.00 -0.71 0.00 0.00 52.86 54.45 3is4 s ASN 139 Cb 0.00 -2.58 -0.04 0.00 0.41 0.00 0.00 41.25 39.04 3is4 s ASN 139 CO 0.00 -2.31 0.06 -0.31 -1.51 0.00 0.00 177.10 173.03 3is4 s TYR 140 N -2.12 3.22 -0.22 2.20 2.02 -1.26 -0.86 117.35 120.33 3is4 s TYR 140 Ca 0.72 0.15 -0.02 0.00 -0.37 0.00 0.00 57.07 57.56 3is4 s TYR 140 Cb -0.27 -1.70 0.01 0.00 -0.40 0.00 0.00 41.96 39.59 3is4 s TYR 140 CO 0.47 0.52 -0.08 0.42 -1.57 0.00 0.00 175.55 175.31 3is4 s ILE 141 N -1.20 2.97 -0.06 2.71 1.01 0.18 -4.32 121.20 122.49 3is4 s ILE 141 Ca 0.23 -0.74 -0.14 0.00 0.00 0.00 0.00 60.65 60.00 3is4 s ILE 141 Cb -0.12 -2.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.92 3is4 s ILE 141 CO 0.14 0.38 0.37 -0.31 0.00 0.00 0.00 174.94 175.52 3is4 s TYR 142 N 1.40 3.64 0.01 3.97 1.51 -0.33 -0.26 117.35 127.28 3is4 s TYR 142 Ca 0.04 0.86 0.01 0.00 -1.01 0.00 0.00 57.07 56.97 3is4 s TYR 142 Cb -0.15 -2.30 -0.01 0.00 -0.11 0.00 0.00 41.96 39.40 3is4 s TYR 142 CO -0.06 0.52 -0.04 0.42 -1.11 0.00 0.00 175.55 175.29 3is4 s ILE 143 N -0.58 0.27 -0.46 2.71 1.01 0.13 -0.14 121.20 124.14 3is4 s ILE 143 Ca 0.22 -0.33 -0.07 0.00 0.00 0.00 0.00 60.65 60.46 3is4 s ILE 143 Cb -0.15 -0.27 0.01 0.00 0.01 0.00 0.00 42.46 42.06 3is4 s ILE 143 CO 0.10 -0.05 0.52 -0.67 0.00 0.00 0.00 174.94 174.85 3is4 n ASP 144 N 2.66 -6.80 -4.15 3.58 2.03 -0.25 -1.69 116.55 111.93 3is4 n ASP 144 Ca -0.15 0.22 -0.35 0.00 0.52 0.00 0.00 54.79 55.03 3is4 n ASP 144 Cb 0.58 -4.56 -0.03 0.00 -0.72 0.00 0.00 41.12 36.39 3is4 n ASP 144 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3is4 n ASP 145 N -0.90 -3.11 -0.37 1.67 8.00 -1.26 -1.40 116.55 119.18 3is4 n ASP 145 Ca 0.06 -0.95 -0.05 0.00 0.71 0.00 0.00 54.79 54.56 3is4 n ASP 145 Cb 0.43 -2.57 -0.02 0.00 -0.02 0.00 0.00 41.12 38.94 3is4 n ASP 145 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3is4 n GLY 146 N -1.29 0.64 0.07 0.44 0.00 -1.24 -4.91 105.19 98.90 3is4 n GLY 146 Ca 0.08 -0.16 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 3is4 n GLY 146 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3is4 h ILE 147 N 0.00 1.45 -3.31 -0.61 2.04 -1.10 -3.43 117.51 112.56 3is4 h ILE 147 Ca -0.10 -1.65 -0.57 0.00 1.00 0.00 0.00 64.86 63.55 3is4 h ILE 147 Cb 0.70 2.53 -0.05 0.00 -0.74 0.00 0.00 36.82 39.26 3is4 h ILE 147 CO 0.15 0.41 0.41 -0.22 0.00 0.00 0.00 178.15 178.89 3is4 s LEU 148 N -8.75 4.24 -0.14 1.44 2.96 -0.68 -4.95 118.68 112.78 3is4 s LEU 148 Ca -0.16 1.35 0.01 0.00 -0.22 0.00 0.00 54.13 55.10 3is4 s LEU 148 Cb -0.01 -3.36 0.00 0.00 0.50 0.00 0.00 46.19 43.33 3is4 s LEU 148 CO 0.64 -0.36 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.49 3is4 s ILE 149 N 1.81 2.45 0.03 6.68 1.01 -1.26 -0.69 121.20 131.23 3is4 s ILE 149 Ca 0.43 -0.85 0.05 0.00 0.00 0.00 0.00 60.65 60.28 3is4 s ILE 149 Cb -0.18 -2.01 -0.03 0.00 0.01 0.00 0.00 42.46 40.25 3is4 s ILE 149 CO 0.17 0.53 -0.11 -0.76 0.00 0.00 0.00 174.94 174.76 3is4 s LEU 150 N 0.72 2.95 -0.15 2.97 1.43 0.65 -1.77 118.68 125.47 3is4 s LEU 150 Ca -0.08 -0.29 -0.02 0.00 -1.03 0.00 0.00 54.13 52.72 3is4 s LEU 150 Cb -0.16 -1.72 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 3is4 s LEU 150 CO 0.01 0.25 -0.10 -1.58 0.23 0.00 0.00 176.35 175.17 3is4 s GLN 151 N -1.57 3.47 0.04 1.70 0.74 -0.06 0.47 119.66 124.45 3is4 s GLN 151 Ca 0.17 -0.63 -0.30 0.00 0.05 0.00 0.00 55.36 54.64 3is4 s GLN 151 Cb -0.11 -2.75 -0.06 0.00 1.10 0.00 0.00 33.01 31.20 3is4 s GLN 151 CO 0.08 0.19 1.28 0.08 -0.55 0.00 0.00 175.29 176.37 3is4 s VAL 152 N 0.45 3.86 -0.27 1.34 1.01 -0.04 -0.83 120.40 125.93 3is4 s VAL 152 Ca -0.07 1.30 -0.15 0.00 0.00 0.00 0.00 61.98 63.06 3is4 s VAL 152 Cb -0.15 -3.83 -0.12 0.00 0.00 0.00 0.00 36.38 32.28 3is4 s VAL 152 CO 0.04 0.06 -0.33 0.00 0.00 0.00 0.00 175.10 174.87 3is4 n GLN 153 N 4.47 0.58 -3.87 2.72 1.13 0.72 -0.55 117.38 122.58 3is4 n GLN 153 Ca 0.11 0.27 -0.07 0.00 -1.94 0.00 0.00 57.00 55.37 3is4 n GLN 153 Cb 0.45 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.28 3is4 n GLN 153 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 3is4 s SER 154 N -7.36 -0.24 -0.48 1.08 1.04 -1.18 -4.69 113.70 101.86 3is4 s SER 154 Ca -0.38 -0.64 -0.25 0.00 0.48 0.00 0.00 55.95 55.16 3is4 s SER 154 Cb 0.14 0.71 0.03 0.00 0.10 0.00 0.00 66.02 67.00 3is4 s SER 154 CO 0.49 -1.32 0.91 -1.00 0.98 0.00 0.00 173.24 173.30 3is4 s HIS 155 N -3.93 2.90 0.15 5.02 3.76 -1.26 -0.94 115.29 120.99 3is4 s HIS 155 Ca 0.12 0.26 -0.12 0.00 -0.15 0.00 0.00 55.06 55.18 3is4 s HIS 155 Cb -0.05 -3.96 0.02 0.00 1.11 0.00 0.00 32.58 29.69 3is4 s HIS 155 CO 0.07 -1.15 1.58 1.49 -0.85 0.00 0.00 174.74 175.89 3is4 h GLU 156 N 9.13 0.92 0.00 1.40 4.57 -1.29 -3.47 114.58 125.83 3is4 h GLU 156 Ca -0.25 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 57.61 3is4 h GLU 156 Cb 1.08 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.60 3is4 h GLU 156 CO 1.03 0.98 0.00 -0.40 -1.18 0.00 0.00 179.01 179.44 3is4 n ASP 157 N -4.26 0.00 0.24 1.04 5.68 -0.87 -4.96 116.55 113.42 3is4 n ASP 157 Ca 0.01 -0.50 0.07 0.00 -0.50 0.00 0.00 54.79 53.87 3is4 n ASP 157 Cb 0.36 0.00 0.58 0.00 -1.14 0.00 0.00 41.12 40.92 3is4 n ASP 157 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3is4 h GLU 158 N 0.00 0.00 -0.00 0.11 4.81 -2.03 -3.11 114.58 114.35 3is4 h GLU 158 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3is4 h GLU 158 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3is4 h GLU 158 CO 0.00 0.12 -0.31 1.04 -0.73 0.00 0.00 179.01 179.13 3is4 n GLN 159 N -4.31 3.15 -4.72 1.92 6.02 -1.26 -4.81 117.38 113.36 3is4 n GLN 159 Ca -0.03 -0.27 -0.25 0.00 -0.01 0.00 0.00 57.00 56.44 3is4 n GLN 159 Cb 0.19 -0.99 -0.16 0.00 1.02 0.00 0.00 30.24 30.31 3is4 n GLN 159 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3is4 s THR 160 N -1.58 1.28 -0.09 5.09 2.01 -1.18 -1.23 115.64 119.94 3is4 s THR 160 Ca 0.05 -0.62 0.01 0.00 0.31 0.00 0.00 61.69 61.45 3is4 s THR 160 Cb 0.07 -1.12 -0.02 0.00 0.01 0.00 0.00 72.50 71.44 3is4 s THR 160 CO 0.30 0.38 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.73 3is4 s LEU 161 N 0.18 2.83 -0.17 4.42 1.43 -0.23 -0.81 118.68 126.34 3is4 s LEU 161 Ca -0.06 -0.21 -0.24 0.00 -1.03 0.00 0.00 54.13 52.59 3is4 s LEU 161 Cb -0.12 -1.61 -0.02 0.00 0.03 0.00 0.00 46.19 44.47 3is4 s LEU 161 CO 0.02 0.27 0.77 -0.70 0.23 0.00 0.00 176.35 176.94 3is4 s GLU 162 N -0.26 4.29 0.04 1.70 2.12 -0.12 -1.91 118.70 124.56 3is4 s GLU 162 Ca 0.02 0.91 0.06 0.00 0.36 0.00 0.00 54.97 56.32 3is4 s GLU 162 Cb -0.13 -3.56 -0.02 0.00 0.26 0.00 0.00 34.13 30.68 3is4 s GLU 162 CO 0.03 -0.27 -0.18 0.00 -0.54 0.00 0.00 175.26 174.30 3is4 s THR 164 N -0.80 5.10 -0.45 0.00 2.01 -0.01 -0.77 115.64 120.71 3is4 s THR 164 Ca 0.05 0.84 -0.26 0.00 0.31 0.00 0.00 61.69 62.64 3is4 s THR 164 Cb -0.08 -3.73 0.03 0.00 0.01 0.00 0.00 72.50 68.72 3is4 s THR 164 CO 0.02 0.49 0.94 -0.69 -0.69 0.00 0.00 174.62 174.69 3is4 s VAL 165 N -0.46 4.47 -0.34 3.82 1.01 -0.34 -0.88 120.40 127.67 3is4 s VAL 165 Ca 0.24 0.84 0.21 0.00 0.00 0.00 0.00 61.98 63.26 3is4 s VAL 165 Cb -0.16 -4.44 0.27 0.00 0.00 0.00 0.00 36.38 32.05 3is4 s VAL 165 CO 0.12 -0.81 1.58 0.71 0.00 0.00 0.00 175.10 176.70 3is4 h THR 166 N 6.06 0.23 -3.16 3.92 1.35 -1.66 -0.74 112.91 118.91 3is4 h THR 166 Ca -0.24 -1.30 -0.11 0.00 -0.55 0.00 0.00 66.41 64.21 3is4 h THR 166 Cb 1.07 2.09 -0.19 0.00 -1.73 0.00 0.00 68.15 69.40 3is4 h THR 166 CO 1.03 0.13 -0.26 0.54 -0.25 0.00 0.00 175.52 176.71 3is4 s ASN 167 N -6.26 -0.16 -0.15 5.36 4.22 -1.25 -4.79 114.94 111.91 3is4 s ASN 167 Ca 0.06 -0.05 -0.29 0.00 -2.14 0.00 0.00 52.86 50.44 3is4 s ASN 167 Cb 0.06 0.33 -0.01 0.00 1.28 0.00 0.00 41.25 42.91 3is4 s ASN 167 CO 0.68 -0.53 1.20 -0.44 -2.04 0.00 0.00 177.10 175.98 3is4 s SER 168 N -1.68 7.00 -0.24 3.54 0.01 -1.26 -4.32 113.70 116.75 3is4 s SER 168 Ca -0.09 1.66 -0.20 0.00 1.31 0.00 0.00 55.95 58.63 3is4 s SER 168 Cb -0.03 -2.54 0.06 0.00 0.21 0.00 0.00 66.02 63.72 3is4 s SER 168 CO 0.01 -0.70 0.62 -2.28 0.41 0.00 0.00 173.24 171.30 3is4 s HIS 169 N 3.13 -0.76 -0.22 2.43 5.04 -0.84 -4.98 115.29 119.09 3is4 s HIS 169 Ca 0.53 1.75 -0.16 0.00 -1.54 0.00 0.00 55.06 55.64 3is4 s HIS 169 Cb -0.21 0.32 -0.04 0.00 0.04 0.00 0.00 32.58 32.69 3is4 s HIS 169 CO 0.15 -0.37 0.40 0.99 -2.34 0.00 0.00 174.74 173.57 3is4 s THR 170 N 0.67 5.19 0.07 0.89 2.01 -1.26 -2.45 115.64 120.76 3is4 s THR 170 Ca -0.03 0.69 0.05 0.00 0.31 0.00 0.00 61.69 62.72 3is4 s THR 170 Cb -0.05 -3.73 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 3is4 s THR 170 CO -0.04 0.22 -0.07 0.27 -0.69 0.00 0.00 174.62 174.31 3is4 s ILE 171 N 1.53 3.57 0.08 1.82 -4.36 -0.84 -4.97 121.20 118.02 3is4 s ILE 171 Ca 0.18 -1.06 0.01 0.00 -0.26 0.00 0.00 60.65 59.52 3is4 s ILE 171 Cb -0.15 -2.63 0.01 0.00 1.25 0.00 0.00 42.46 40.94 3is4 s ILE 171 CO 0.08 0.21 0.08 -1.54 0.24 0.00 0.00 174.94 174.01 3is4 n SER 172 N 0.96 0.90 -4.76 4.36 3.41 -1.26 -1.58 113.62 115.65 3is4 n SER 172 Ca -0.14 -1.26 -0.36 0.00 -0.26 0.00 0.00 58.87 56.85 3is4 n SER 172 Cb 0.52 -0.03 0.03 0.00 -0.26 0.00 0.00 64.21 64.47 3is4 n SER 172 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3is4 s ASP 173 N -1.49 5.33 -1.46 4.04 1.11 -1.25 -4.04 116.67 118.91 3is4 s ASP 173 Ca 0.06 2.42 -0.07 0.00 0.18 0.00 0.00 52.55 55.14 3is4 s ASP 173 Cb -0.00 -2.60 0.05 0.00 1.07 0.00 0.00 42.92 41.43 3is4 s ASP 173 CO 0.04 -1.50 0.71 0.54 1.18 0.00 0.00 175.17 176.14 3is4 n ARG 174 N -1.38 -4.35 -3.01 8.23 3.00 -0.80 -4.96 116.66 113.40 3is4 n ARG 174 Ca 0.12 0.51 -0.36 0.00 -0.01 0.00 0.00 57.85 58.12 3is4 n ARG 174 Cb 0.49 -5.06 -0.06 0.00 0.00 0.00 0.00 32.46 27.83 3is4 n ARG 174 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 3is4 s ARG 175 N -6.47 4.34 0.28 5.56 3.00 -1.26 -4.70 118.95 119.70 3is4 s ARG 175 Ca 0.29 0.99 -0.29 0.00 0.00 0.00 0.00 55.73 56.72 3is4 s ARG 175 Cb -0.15 -2.84 -0.09 0.00 0.00 0.00 0.00 34.95 31.87 3is4 s ARG 175 CO 0.86 0.35 1.13 0.20 0.00 0.00 0.00 175.30 177.84 3is4 s GLY 176 N -1.66 3.03 0.17 -3.53 0.00 -1.26 -0.38 107.32 103.68 3is4 s GLY 176 Ca 0.45 0.94 0.11 0.00 0.00 0.00 0.00 44.72 46.22 3is4 s GLY 176 CO 0.21 1.57 -0.23 -1.34 0.00 0.00 0.00 173.10 173.32 3is4 s VAL 177 N -1.06 2.44 0.04 1.40 -7.23 0.22 -1.09 120.40 115.12 3is4 s VAL 177 Ca 0.46 -1.88 0.05 0.00 -1.81 0.00 0.00 61.98 58.79 3is4 s VAL 177 Cb -0.33 -2.15 -0.02 0.00 0.56 0.00 0.00 36.38 34.45 3is4 s VAL 177 CO 0.42 -0.04 -0.14 0.20 -0.31 0.00 0.00 175.10 175.23 3is4 s ASN 178 N -2.47 1.62 -0.64 4.85 0.01 0.80 -4.60 114.94 114.51 3is4 s ASN 178 Ca 0.19 -0.45 0.04 0.00 -0.71 0.00 0.00 52.86 51.93 3is4 s ASN 178 Cb -0.09 -0.10 0.16 0.00 0.41 0.00 0.00 41.25 41.62 3is4 s ASN 178 CO 0.09 0.03 0.42 -0.76 -1.51 0.00 0.00 177.10 175.37 3is4 s LEU 179 N -1.10 4.68 0.42 0.60 1.02 -1.26 -1.19 118.68 121.85 3is4 s LEU 179 Ca 0.01 -3.49 0.09 0.00 0.02 0.00 0.00 54.13 50.77 3is4 s LEU 179 Cb -0.08 -1.66 0.92 0.00 0.02 0.00 0.00 46.19 45.39 3is4 s LEU 179 CO 0.01 -0.16 2.04 -0.65 0.02 0.00 0.00 176.35 177.62 3is4 h PRO 180 N 5.91 0.37 -0.59 1.29 0.11 -1.91 -2.47 132.00 134.71 3is4 h PRO 180 Ca 0.05 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.13 3is4 h PRO 180 Cb 0.82 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.85 3is4 h PRO 180 CO 0.71 0.30 0.00 0.41 -0.21 0.00 0.00 178.00 179.21 3is4 n GLY 181 N -1.34 2.65 3.30 -0.55 0.00 -1.26 -4.87 105.19 103.12 3is4 n GLY 181 Ca 0.01 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.09 3is4 n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3is4 s ASP 183 N -1.33 6.68 -0.15 0.00 1.01 -1.26 -4.88 116.67 116.73 3is4 s ASP 183 Ca 0.09 0.54 -0.29 0.00 0.71 0.00 0.00 52.55 53.60 3is4 s ASP 183 Cb -0.09 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 3is4 s ASP 183 CO 0.02 -1.10 1.07 -0.69 0.21 0.00 0.00 175.17 174.68 3is4 s VAL 184 N 4.08 4.62 -0.22 -1.27 1.01 -1.26 -4.94 120.40 122.42 3is4 s VAL 184 Ca 0.45 1.92 0.15 0.00 0.00 0.00 0.00 61.98 64.50 3is4 s VAL 184 Cb -0.09 -4.24 0.72 0.00 0.00 0.00 0.00 36.38 32.77 3is4 s VAL 184 CO 0.26 -0.08 1.64 -0.90 0.00 0.00 0.00 175.10 176.02 3is4 n ASP 185 N 5.72 5.05 -4.61 3.32 3.85 -1.26 -4.99 116.55 123.63 3is4 n ASP 185 Ca 0.11 -2.98 -0.37 0.00 -0.71 0.00 0.00 54.79 50.83 3is4 n ASP 185 Cb 0.47 -0.64 0.06 0.00 -1.35 0.00 0.00 41.12 39.66 3is4 n ASP 185 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 3is4 n LEU 186 N 0.18 3.58 -4.56 -2.12 4.77 -1.26 -4.97 117.00 112.62 3is4 n LEU 186 Ca 0.26 0.78 -0.29 0.00 -0.03 0.00 0.00 56.01 56.72 3is4 n LEU 186 Cb 1.10 -1.38 0.22 0.00 -2.33 0.00 0.00 43.42 41.03 3is4 n LEU 186 CO 0.27 -1.97 0.58 -2.16 -1.33 0.00 0.00 177.39 172.78 3is4 s PRO 187 N -2.81 -0.16 0.11 3.23 0.04 -1.26 -4.95 135.00 129.20 3is4 s PRO 187 Ca 0.76 1.11 -0.17 0.00 0.04 0.00 0.00 61.00 62.74 3is4 s PRO 187 Cb -0.41 -1.62 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 3is4 s PRO 187 CO 0.47 -3.29 1.58 0.00 0.04 0.00 0.00 177.00 175.80 3is4 h ALA 188 N -2.32 0.43 -4.13 8.56 0.00 -1.93 -3.44 119.26 116.42 3is4 h ALA 188 Ca -0.54 -0.20 -0.64 0.00 0.00 0.00 0.00 54.91 53.53 3is4 h ALA 188 Cb 1.31 -0.12 -0.26 0.00 0.00 0.00 0.00 17.79 18.72 3is4 h ALA 188 CO 0.47 0.13 -0.86 0.14 0.00 0.00 0.00 179.25 179.13 3is4 s VAL 189 N -5.15 1.92 0.83 0.00 -7.23 -1.26 -4.62 120.40 104.88 3is4 s VAL 189 Ca -0.13 -1.34 -0.10 0.00 -1.81 0.00 0.00 61.98 58.60 3is4 s VAL 189 Cb 0.09 -1.66 0.14 0.00 0.56 0.00 0.00 36.38 35.51 3is4 s VAL 189 CO 0.76 0.25 1.16 -0.94 -0.31 0.00 0.00 175.10 176.02 3is4 s SER 190 N -1.31 3.90 0.18 4.85 1.04 -1.26 -4.91 113.70 116.19 3is4 s SER 190 Ca 0.10 0.17 -0.12 0.00 0.48 0.00 0.00 55.95 56.58 3is4 s SER 190 Cb -0.09 -0.47 0.09 0.00 0.10 0.00 0.00 66.02 65.65 3is4 s SER 190 CO 0.02 -2.20 1.75 0.00 0.98 0.00 0.00 173.24 173.79 3is4 h ALA 191 N -1.08 0.80 -0.63 5.32 0.00 -2.01 -2.77 119.26 118.89 3is4 h ALA 191 Ca -0.42 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 3is4 h ALA 191 Cb 1.27 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 3is4 h ALA 191 CO 0.45 0.38 0.38 -0.22 0.00 0.00 0.00 179.25 180.24 3is4 h LYS 192 N 0.85 0.86 -0.41 0.00 3.64 -1.97 -2.96 116.57 116.58 3is4 h LYS 192 Ca 0.21 -0.08 0.08 0.00 -1.27 0.00 0.00 60.65 59.59 3is4 h LYS 192 Cb 0.15 -0.18 -0.07 0.00 -0.41 0.00 0.00 32.23 31.72 3is4 h LYS 192 CO -0.02 0.62 -0.03 -0.44 -2.27 0.00 0.00 179.45 177.31 3is4 h ASP 193 N 0.85 -0.23 -0.73 4.20 3.32 -1.88 -0.82 116.42 121.13 3is4 h ASP 193 Ca 0.23 0.10 0.09 0.00 0.02 0.00 0.00 57.03 57.47 3is4 h ASP 193 Cb -0.02 0.20 -0.07 0.00 0.22 0.00 0.00 39.33 39.66 3is4 h ASP 193 CO -0.04 -0.08 0.37 0.03 -1.72 0.00 0.00 179.24 177.81 3is4 h ARG 194 N 0.08 0.62 -0.38 3.56 3.08 -1.33 1.03 114.38 121.04 3is4 h ARG 194 Ca 0.20 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.16 3is4 h ARG 194 Cb 0.30 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3is4 h ARG 194 CO -0.37 0.41 0.02 0.28 -1.07 0.00 0.00 179.97 179.24 3is4 h VAL 195 N 0.63 1.25 -0.31 2.04 2.07 -1.41 -2.37 116.25 118.16 3is4 h VAL 195 Ca 0.36 -0.96 -0.14 0.00 0.82 0.00 0.00 66.70 66.78 3is4 h VAL 195 Cb 0.36 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 3is4 h VAL 195 CO -0.26 0.32 -0.36 0.44 0.02 0.00 0.00 177.57 177.73 3is4 h ASP 196 N 0.48 0.75 -0.33 0.57 3.32 0.05 -2.32 116.42 118.95 3is4 h ASP 196 Ca 0.11 -0.32 -0.13 0.00 0.02 0.00 0.00 57.03 56.70 3is4 h ASP 196 Cb 0.44 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 3is4 h ASP 196 CO 0.02 1.04 -0.28 -0.07 -1.72 0.00 0.00 179.24 178.23 3is4 h LEU 197 N 0.59 0.87 -0.57 1.55 3.38 0.11 -1.21 115.31 120.03 3is4 h LEU 197 Ca 0.06 -0.35 -0.10 0.00 0.09 0.00 0.00 57.88 57.58 3is4 h LEU 197 Cb 0.89 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 3is4 h LEU 197 CO 0.08 1.09 -0.03 -0.61 0.09 0.00 0.00 178.44 179.07 3is4 h GLN 198 N 0.72 1.02 -0.68 1.13 5.75 -1.37 -1.79 115.11 119.89 3is4 h GLN 198 Ca 0.09 -0.34 0.03 0.00 -0.15 0.00 0.00 58.65 58.27 3is4 h GLN 198 Cb 0.83 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.25 3is4 h GLN 198 CO 0.07 1.02 0.43 0.35 -2.65 0.00 0.00 178.83 178.06 3is4 h PHE 199 N 0.91 0.81 -0.97 3.99 3.57 -1.28 -0.93 116.94 123.03 3is4 h PHE 199 Ca 0.16 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.70 3is4 h PHE 199 Cb 0.58 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 39.00 3is4 h PHE 199 CO 0.04 0.47 0.64 0.78 -2.23 0.00 0.00 178.31 178.01 3is4 h GLY 200 N 0.85 1.37 0.87 2.40 0.00 -0.90 -0.26 103.07 107.40 3is4 h GLY 200 Ca 0.27 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 3is4 h GLY 200 CO -0.10 0.48 0.05 -2.08 0.00 0.00 0.00 176.54 174.89 3is4 h VAL 201 N 1.29 1.22 -0.62 4.60 2.07 -0.94 -1.23 116.25 122.64 3is4 h VAL 201 Ca 0.36 -0.75 0.02 0.00 0.82 0.00 0.00 66.70 67.15 3is4 h VAL 201 Cb -0.12 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 3is4 h VAL 201 CO -0.09 0.24 0.41 -0.33 0.02 0.00 0.00 177.57 177.83 3is4 h GLU 202 N 0.24 0.77 -0.12 1.57 5.08 -0.81 -2.50 114.58 118.80 3is4 h GLU 202 Ca 0.08 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3is4 h GLU 202 Cb 0.32 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3is4 h GLU 202 CO 0.00 0.51 0.00 1.04 -1.00 0.00 0.00 179.01 179.57 3is4 n GLN 203 N -4.45 1.84 -3.17 2.33 1.13 -0.14 -4.97 117.38 109.95 3is4 n GLN 203 Ca 0.07 -1.24 -0.15 0.00 -1.94 0.00 0.00 57.00 53.74 3is4 n GLN 203 Cb 0.08 -1.44 0.06 0.00 0.11 0.00 0.00 30.24 29.05 3is4 n GLN 203 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3is4 n GLY 204 N 1.20 -0.10 3.76 1.08 0.00 -0.84 -5.01 105.19 105.29 3is4 n GLY 204 Ca 0.17 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 3is4 n GLY 204 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3is4 s VAL 205 N -3.23 3.00 0.02 1.61 -7.23 -0.52 -4.97 120.40 109.07 3is4 s VAL 205 Ca 0.27 0.55 0.11 0.00 -1.81 0.00 0.00 61.98 61.09 3is4 s VAL 205 Cb -0.12 -3.13 -0.22 0.00 0.56 0.00 0.00 36.38 33.47 3is4 s VAL 205 CO 0.51 -0.21 0.90 0.44 -0.31 0.00 0.00 175.10 176.42 3is4 h ASP 206 N 0.54 0.00 -5.01 4.85 3.32 -1.59 -3.46 116.42 115.08 3is4 h ASP 206 Ca -0.49 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 3is4 h ASP 206 Cb 1.27 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.65 3is4 h ASP 206 CO 0.55 0.99 0.12 0.00 -1.72 0.00 0.00 179.24 179.18 3is4 s MET 207 N -2.64 1.08 -0.14 3.56 0.23 -1.19 -2.24 119.30 117.95 3is4 s MET 207 Ca -0.02 -0.07 -0.02 0.00 -1.03 0.00 0.00 55.69 54.55 3is4 s MET 207 Cb 0.09 0.50 -0.02 0.00 -1.53 0.00 0.00 34.83 33.86 3is4 s MET 207 CO 0.82 -0.38 -0.08 0.42 -2.03 0.00 0.00 175.02 173.77 3is4 s ILE 208 N -2.11 3.54 -0.60 3.16 -1.09 0.66 -1.46 121.20 123.29 3is4 s ILE 208 Ca -0.07 -0.49 -0.19 0.00 -2.23 0.00 0.00 60.65 57.67 3is4 s ILE 208 Cb -0.01 -2.52 0.10 0.00 -1.58 0.00 0.00 42.46 38.45 3is4 s ILE 208 CO 0.01 0.51 0.74 -0.36 -1.23 0.00 0.00 174.94 174.61 3is4 s PHE 209 N 0.35 2.95 -0.35 3.97 0.08 0.26 -0.09 117.98 125.16 3is4 s PHE 209 Ca -0.07 -0.91 -0.23 0.00 0.12 0.00 0.00 56.93 55.84 3is4 s PHE 209 Cb -0.15 -4.06 0.01 0.00 -0.57 0.00 0.00 43.02 38.25 3is4 s PHE 209 CO 0.04 -1.35 0.76 0.00 -0.10 0.00 0.00 175.22 174.57 3is4 s ALA 210 N 2.87 3.46 0.51 5.36 0.00 0.80 -2.06 121.76 132.71 3is4 s ALA 210 Ca 0.13 -0.62 -0.21 0.00 0.00 0.00 0.00 51.96 51.26 3is4 s ALA 210 Cb -0.23 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 3is4 s ALA 210 CO 0.07 -1.38 1.16 -1.12 0.00 0.00 0.00 175.76 174.49 3is4 s SER 211 N 1.77 5.84 -1.42 0.00 0.01 -1.26 -0.86 113.70 117.78 3is4 s SER 211 Ca 0.30 2.27 -0.10 0.00 1.31 0.00 0.00 55.95 59.73 3is4 s SER 211 Cb -0.14 -2.59 0.04 0.00 0.21 0.00 0.00 66.02 63.54 3is4 s SER 211 CO 0.15 -1.14 1.12 0.33 0.41 0.00 0.00 173.24 174.11 3is4 n PHE 212 N -0.98 -2.69 -2.49 2.43 7.35 -1.21 -4.82 117.46 115.05 3is4 n PHE 212 Ca 0.10 0.98 -0.43 0.00 -0.76 0.00 0.00 57.45 57.34 3is4 n PHE 212 Cb 0.49 -4.69 -0.02 0.00 0.35 0.00 0.00 39.48 35.61 3is4 n PHE 212 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 3is4 s ILE 213 N -3.32 4.36 -0.03 -2.13 -1.09 -0.86 -4.90 121.20 113.23 3is4 s ILE 213 Ca 0.61 1.66 0.05 0.00 -2.23 0.00 0.00 60.65 60.74 3is4 s ILE 213 Cb -0.28 -4.07 -0.08 0.00 -1.58 0.00 0.00 42.46 36.45 3is4 s ILE 213 CO 0.76 -0.06 0.07 0.54 -1.23 0.00 0.00 174.94 175.02 3is4 n ARG 214 N 5.71 1.80 -3.86 2.79 1.74 -1.26 -4.08 116.66 119.51 3is4 n ARG 214 Ca 0.12 -0.02 -0.09 0.00 -0.77 0.00 0.00 57.85 57.08 3is4 n ARG 214 Cb 0.46 -1.14 -0.06 0.00 -1.02 0.00 0.00 32.46 30.70 3is4 n ARG 214 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3is4 s SER 215 N -3.21 0.01 0.23 0.55 1.04 -1.26 -3.67 113.70 107.39 3is4 s SER 215 Ca -0.02 -0.69 -0.07 0.00 0.48 0.00 0.00 55.95 55.65 3is4 s SER 215 Cb 0.03 0.42 0.22 0.00 0.10 0.00 0.00 66.02 66.78 3is4 s SER 215 CO 0.23 -0.84 1.85 0.00 0.98 0.00 0.00 173.24 175.46 3is4 h ALA 216 N 2.57 1.16 -0.99 5.32 0.00 -1.85 -2.90 119.26 122.57 3is4 h ALA 216 Ca -0.33 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 54.54 3is4 h ALA 216 Cb 1.22 -0.35 -0.07 0.00 0.00 0.00 0.00 17.79 18.59 3is4 h ALA 216 CO 0.50 0.66 0.63 1.49 0.00 0.00 0.00 179.25 182.53 3is4 h GLU 217 N 1.24 1.03 0.00 0.00 4.81 -1.97 -2.08 114.58 117.62 3is4 h GLU 217 Ca 0.31 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 3is4 h GLU 217 Cb 0.05 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.19 3is4 h GLU 217 CO -0.05 0.68 -0.12 1.96 -0.73 0.00 0.00 179.01 180.76 3is4 h GLN 218 N 1.06 0.00 -0.30 1.92 4.20 -1.94 -2.38 115.11 117.68 3is4 h GLN 218 Ca 0.45 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.15 3is4 h GLN 218 Cb 0.32 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 3is4 h GLN 218 CO -0.21 0.12 0.16 0.28 -0.67 0.00 0.00 178.83 178.51 3is4 h VAL 219 N 0.00 1.14 -0.28 -0.54 2.07 -1.47 -2.13 116.25 115.04 3is4 h VAL 219 Ca -0.00 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 3is4 h VAL 219 Cb 0.27 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3is4 h VAL 219 CO 0.02 0.14 0.16 1.23 0.02 0.00 0.00 177.57 179.14 3is4 h GLY 220 N 0.36 0.41 0.92 2.17 0.00 -1.52 -1.59 103.07 103.83 3is4 h GLY 220 Ca 0.11 -0.16 -0.05 0.00 0.00 0.00 0.00 47.33 47.22 3is4 h GLY 220 CO -0.02 0.16 0.02 -0.55 0.00 0.00 0.00 176.54 176.16 3is4 h ASP 221 N 0.39 0.61 -0.72 0.19 3.32 -1.22 -0.30 116.42 118.69 3is4 h ASP 221 Ca 0.10 -0.29 0.05 0.00 0.02 0.00 0.00 57.03 56.91 3is4 h ASP 221 Cb 0.01 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.34 3is4 h ASP 221 CO -0.02 0.75 0.43 0.58 -1.72 0.00 0.00 179.24 179.27 3is4 h VAL 222 N 0.46 1.02 -0.18 -1.35 2.07 -0.97 -0.75 116.25 116.54 3is4 h VAL 222 Ca 0.11 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.36 3is4 h VAL 222 Cb 0.42 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 3is4 h VAL 222 CO 0.01 0.15 0.09 -0.09 0.02 0.00 0.00 177.57 177.75 3is4 h ARG 223 N 0.81 0.19 -0.77 1.57 9.65 -1.07 -2.00 114.38 122.76 3is4 h ARG 223 Ca 0.31 -0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.24 3is4 h ARG 223 Cb 0.13 -0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 28.61 3is4 h ARG 223 CO -0.16 0.12 0.46 0.87 2.80 0.00 0.00 179.97 184.06 3is4 h LYS 224 N 0.19 0.81 0.00 0.20 1.57 -0.68 -2.00 116.57 116.66 3is4 h LYS 224 Ca 0.07 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 3is4 h LYS 224 Cb 0.02 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 3is4 h LYS 224 CO -0.05 0.53 -0.10 0.00 -0.57 0.00 0.00 179.45 179.26 3is4 h ALA 225 N 1.38 1.31 0.00 3.86 0.00 -0.69 -1.90 119.26 123.22 3is4 h ALA 225 Ca 0.34 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.08 3is4 h ALA 225 Cb 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3is4 h ALA 225 CO -0.18 0.12 -0.41 -0.07 0.00 0.00 0.00 179.25 178.71 3is4 h LEU 226 N 0.00 0.00 -0.07 0.00 3.38 -0.64 -3.41 115.31 114.57 3is4 h LEU 226 Ca -0.00 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 3is4 h LEU 226 Cb 0.28 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 3is4 h LEU 226 CO 0.01 0.41 -0.14 0.61 0.09 0.00 0.00 178.44 179.42 3is4 n GLY 227 N 1.16 -1.64 0.31 0.83 0.00 -0.71 -3.38 105.19 101.74 3is4 n GLY 227 Ca 0.02 -1.44 0.02 0.00 0.00 0.00 0.00 46.02 44.62 3is4 n GLY 227 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3is4 h PRO 228 N -0.29 0.63 0.00 1.61 0.11 -1.89 -2.00 132.00 130.17 3is4 h PRO 228 Ca -0.00 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3is4 h PRO 228 Cb 0.29 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.27 3is4 h PRO 228 CO 0.01 0.48 0.00 1.63 -0.21 0.00 0.00 178.00 179.91 3is4 n LYS 229 N -4.40 0.04 -0.57 1.05 5.02 -1.26 -3.21 118.16 114.83 3is4 n LYS 229 Ca 0.04 0.21 0.05 0.00 -2.02 0.00 0.00 58.31 56.59 3is4 n LYS 229 Cb 0.11 -1.56 0.26 0.00 -0.02 0.00 0.00 35.03 33.82 3is4 n LYS 229 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3is4 n GLY 230 N 0.43 4.13 0.24 0.72 0.00 -0.75 -4.74 105.19 105.22 3is4 n GLY 230 Ca 0.04 -1.07 0.12 0.00 0.00 0.00 0.00 46.02 45.11 3is4 n GLY 230 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3is4 h ARG 231 N 1.79 0.00 -0.22 1.61 0.11 -1.61 -2.72 114.38 113.34 3is4 h ARG 231 Ca 0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.15 3is4 h ARG 231 Cb 1.58 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.66 3is4 h ARG 231 CO 0.31 0.16 0.00 -0.25 0.10 0.00 0.00 179.97 180.29 3is4 n ASP 232 N -3.34 2.90 -4.72 0.08 8.00 -1.26 -4.90 116.55 113.30 3is4 n ASP 232 Ca 0.00 -1.91 -0.41 0.00 0.71 0.00 0.00 54.79 53.17 3is4 n ASP 232 Cb 0.38 -0.13 -0.04 0.00 -0.02 0.00 0.00 41.12 41.32 3is4 n ASP 232 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3is4 s ILE 233 N -1.74 4.56 0.20 0.53 1.01 -1.03 -4.99 121.20 119.75 3is4 s ILE 233 Ca 0.34 2.00 -0.30 0.00 0.00 0.00 0.00 60.65 62.70 3is4 s ILE 233 Cb 0.21 -4.28 -0.08 0.00 0.01 0.00 0.00 42.46 38.32 3is4 s ILE 233 CO 0.31 0.25 1.01 -0.04 0.00 0.00 0.00 174.94 176.46 3is4 s MET 234 N 0.39 4.73 -0.37 2.79 -1.94 -0.95 -4.90 119.30 119.04 3is4 s MET 234 Ca 0.50 1.58 -0.10 0.00 -1.71 0.00 0.00 55.69 55.95 3is4 s MET 234 Cb -0.23 -3.29 0.03 0.00 2.01 0.00 0.00 34.83 33.35 3is4 s MET 234 CO 0.29 0.30 0.20 0.42 -0.01 0.00 0.00 175.02 176.22 3is4 s ILE 235 N -0.69 4.46 -0.30 2.53 1.01 -1.26 -0.25 121.20 126.71 3is4 s ILE 235 Ca 0.45 -0.93 -0.11 0.00 0.00 0.00 0.00 60.65 60.06 3is4 s ILE 235 Cb -0.27 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 3is4 s ILE 235 CO 0.34 -0.25 0.19 -0.63 0.00 0.00 0.00 174.94 174.59 3is4 s ILE 236 N 1.53 5.18 -0.22 2.92 -1.09 0.87 -1.08 121.20 129.30 3is4 s ILE 236 Ca 0.01 -0.01 -0.22 0.00 -2.23 0.00 0.00 60.65 58.20 3is4 s ILE 236 Cb -0.19 -3.53 -0.02 0.00 -1.58 0.00 0.00 42.46 37.14 3is4 s ILE 236 CO 0.06 0.17 0.70 0.00 -1.23 0.00 0.00 174.94 174.64 3is4 s LYS 238 N 2.33 4.19 -0.34 0.00 1.02 -0.04 -1.00 119.74 125.91 3is4 s LYS 238 Ca 0.30 1.05 -0.15 0.00 0.02 0.00 0.00 55.97 57.20 3is4 s LYS 238 Cb -0.16 -3.65 -0.01 0.00 -0.52 0.00 0.00 37.83 33.49 3is4 s LYS 238 CO 0.09 -0.57 0.33 0.42 -0.92 0.00 0.00 175.35 174.70 3is4 s ILE 239 N 2.98 5.20 0.00 2.17 -1.09 -0.33 -2.03 121.20 128.10 3is4 s ILE 239 Ca 0.38 0.00 0.00 0.00 -2.23 0.00 0.00 60.65 58.80 3is4 s ILE 239 Cb -0.15 -3.79 0.00 0.00 -1.58 0.00 0.00 42.46 36.94 3is4 s ILE 239 CO 0.07 -0.06 0.00 -0.62 -1.23 0.00 0.00 174.94 173.11 3is4 n GLU 240 N 5.31 4.40 -3.59 2.79 1.02 -1.26 -2.97 120.64 126.34 3is4 n GLU 240 Ca -0.10 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.91 3is4 n GLU 240 Cb 0.50 -0.35 -0.03 0.00 -0.02 0.00 0.00 31.44 31.53 3is4 n GLU 240 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 3is4 n ASN 241 N -0.66 -1.05 0.11 1.62 6.94 -1.26 -3.06 115.26 117.89 3is4 n ASN 241 Ca 0.00 -2.59 0.05 0.00 -0.02 0.00 0.00 54.58 52.02 3is4 n ASN 241 Cb 0.00 2.00 0.48 0.00 -2.36 0.00 0.00 39.78 39.90 3is4 n ASN 241 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 3is4 h HIS 242 N 1.84 0.29 -0.20 -2.53 2.07 -1.94 -2.25 115.15 112.42 3is4 h HIS 242 Ca -0.22 -0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.27 3is4 h HIS 242 Cb 0.98 -0.09 -0.01 0.00 2.57 0.00 0.00 27.41 30.86 3is4 h HIS 242 CO 0.00 0.24 0.04 1.96 -3.07 0.00 0.00 177.93 177.10 3is4 h GLN 243 N 0.30 0.33 -0.59 5.12 4.20 -1.93 0.30 115.11 122.84 3is4 h GLN 243 Ca 0.08 -0.08 0.05 0.00 0.06 0.00 0.00 58.65 58.75 3is4 h GLN 243 Cb 0.08 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.77 3is4 h GLN 243 CO -0.01 0.47 0.33 0.78 -0.67 0.00 0.00 178.83 179.73 3is4 h GLY 244 N 0.14 0.85 0.78 3.46 0.00 -1.54 -0.22 103.07 106.53 3is4 h GLY 244 Ca 0.06 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 3is4 h GLY 244 CO 0.00 0.16 -0.02 -2.08 0.00 0.00 0.00 176.54 174.60 3is4 h VAL 245 N 0.62 1.12 -0.82 4.60 2.07 -1.20 -2.05 116.25 120.59 3is4 h VAL 245 Ca 0.26 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 3is4 h VAL 245 Cb 0.13 1.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 3is4 h VAL 245 CO -0.15 0.13 0.46 -0.61 0.02 0.00 0.00 177.57 177.42 3is4 h GLN 246 N -0.28 1.14 -0.64 1.57 5.75 -0.27 -2.76 115.11 119.62 3is4 h GLN 246 Ca -0.01 -0.12 0.00 0.00 -0.15 0.00 0.00 58.65 58.37 3is4 h GLN 246 Cb 0.25 -0.23 0.00 0.00 1.07 0.00 0.00 27.48 28.58 3is4 h GLN 246 CO 0.01 0.82 0.00 0.09 -2.65 0.00 0.00 178.83 177.10 3is4 n ASN 247 N -4.35 3.68 -0.35 -0.69 3.02 -0.11 -4.65 115.26 111.81 3is4 n ASN 247 Ca 0.09 -2.40 0.08 0.00 -0.03 0.00 0.00 54.58 52.31 3is4 n ASN 247 Cb 0.09 -0.52 0.26 0.00 -0.61 0.00 0.00 39.78 39.00 3is4 n ASN 247 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3is4 h ILE 248 N 2.80 0.90 0.05 2.41 6.09 -1.06 -1.87 117.51 126.83 3is4 h ILE 248 Ca 0.00 -0.32 -0.00 0.00 -1.37 0.00 0.00 64.86 63.16 3is4 h ILE 248 Cb 1.21 -0.13 0.00 0.00 0.47 0.00 0.00 36.82 38.37 3is4 h ILE 248 CO 0.21 0.17 -0.03 0.44 -3.07 0.00 0.00 178.15 175.88 3is4 h ASP 249 N 0.95 -0.06 0.45 2.19 3.32 -1.86 0.79 116.42 122.19 3is4 h ASP 249 Ca 0.50 -0.03 -0.15 0.00 0.02 0.00 0.00 57.03 57.37 3is4 h ASP 249 Cb 0.54 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 3is4 h ASP 249 CO -0.27 -0.01 -0.64 0.77 -1.72 0.00 0.00 179.24 177.37 3is4 h SER 250 N -0.11 0.21 -0.11 6.45 4.64 -1.87 -1.89 113.55 120.87 3is4 h SER 250 Ca -0.01 -0.13 -0.01 0.00 -0.47 0.00 0.00 61.79 61.17 3is4 h SER 250 Cb 0.09 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 3is4 h SER 250 CO 0.01 0.79 0.01 0.40 -0.87 0.00 0.00 176.83 177.18 3is4 h ILE 251 N 0.13 1.23 -0.57 0.95 2.04 -1.17 -2.75 117.51 117.36 3is4 h ILE 251 Ca -0.01 -0.72 0.07 0.00 1.00 0.00 0.00 64.86 65.20 3is4 h ILE 251 Cb 1.15 1.49 -0.06 0.00 -0.74 0.00 0.00 36.82 38.66 3is4 h ILE 251 CO 0.10 0.21 0.26 0.40 0.00 0.00 0.00 178.15 179.11 3is4 h ILE 252 N -0.05 0.87 -0.57 -0.67 2.04 -0.75 -0.11 117.51 118.27 3is4 h ILE 252 Ca 0.03 -0.17 0.12 0.00 1.00 0.00 0.00 64.86 65.84 3is4 h ILE 252 Cb 0.31 0.35 -0.09 0.00 -0.74 0.00 0.00 36.82 36.64 3is4 h ILE 252 CO 0.00 0.09 0.02 -0.08 0.00 0.00 0.00 178.15 178.18 3is4 h GLU 253 N 0.48 0.14 0.00 2.37 4.81 -1.23 -2.60 114.58 118.56 3is4 h GLU 253 Ca 0.27 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.31 3is4 h GLU 253 Cb 0.25 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 3is4 h GLU 253 CO -0.23 0.09 -0.90 0.93 -0.73 0.00 0.00 179.01 178.17 3is4 h GLU 254 N 0.14 0.00 -7.69 1.92 4.39 -1.16 -3.47 114.58 108.70 3is4 h GLU 254 Ca 0.30 0.00 -0.46 0.00 0.34 0.00 0.00 59.36 59.54 3is4 h GLU 254 Cb 0.47 0.00 0.13 0.00 -0.10 0.00 0.00 28.75 29.25 3is4 h GLU 254 CO -0.47 0.79 0.40 -1.54 -1.16 0.00 0.00 179.01 177.03 3is4 s SER 255 N -6.57 3.72 0.00 1.42 1.04 -0.09 -4.96 113.70 108.26 3is4 s SER 255 Ca 0.01 0.57 0.20 0.00 0.48 0.00 0.00 55.95 57.21 3is4 s SER 255 Cb 0.09 -0.87 0.23 0.00 0.10 0.00 0.00 66.02 65.57 3is4 s SER 255 CO 0.80 -2.38 1.19 0.47 0.98 0.00 0.00 173.24 174.29 3is4 n ASP 256 N -3.59 2.83 0.00 7.02 8.00 -0.24 -4.96 116.55 125.61 3is4 n ASP 256 Ca 0.11 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.75 3is4 n ASP 256 Cb 0.60 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 3is4 n ASP 256 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3is4 n GLY 257 N 1.15 0.36 2.91 0.44 0.00 -1.21 -4.12 105.19 104.72 3is4 n GLY 257 Ca 0.13 -1.19 -0.17 0.00 0.00 0.00 0.00 46.02 44.79 3is4 n GLY 257 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3is4 s ILE 258 N -2.00 0.38 -0.23 -0.61 -1.09 -0.75 -1.39 121.20 115.51 3is4 s ILE 258 Ca 0.00 -0.12 -0.08 0.00 -2.23 0.00 0.00 60.65 58.22 3is4 s ILE 258 Cb 0.00 -0.38 -0.04 0.00 -1.58 0.00 0.00 42.46 40.47 3is4 s ILE 258 CO 0.00 0.15 0.09 -0.32 -1.23 0.00 0.00 174.94 173.63 3is4 s MET 259 N 0.40 3.85 -0.68 2.79 -2.45 -0.17 -0.66 119.30 122.39 3is4 s MET 259 Ca -0.04 -0.39 -0.22 0.00 -1.25 0.00 0.00 55.69 53.78 3is4 s MET 259 Cb -0.08 -3.35 0.07 0.00 1.25 0.00 0.00 34.83 32.73 3is4 s MET 259 CO -0.00 0.01 0.98 0.08 1.05 0.00 0.00 175.02 177.14 3is4 s VAL 260 N 1.11 4.33 -1.05 10.11 1.01 0.30 -1.18 120.40 135.02 3is4 s VAL 260 Ca 0.05 -0.41 -0.17 0.00 0.00 0.00 0.00 61.98 61.45 3is4 s VAL 260 Cb -0.14 -4.70 0.14 0.00 0.00 0.00 0.00 36.38 31.68 3is4 s VAL 260 CO 0.04 -1.48 1.27 0.00 0.00 0.00 0.00 175.10 174.93 3is4 s ALA 261 N 4.04 3.61 0.22 5.51 0.00 -1.16 -2.14 121.76 131.84 3is4 s ALA 261 Ca 0.23 -3.00 -0.08 0.00 0.00 0.00 0.00 51.96 49.11 3is4 s ALA 261 Cb -0.16 -4.10 0.23 0.00 0.00 0.00 0.00 23.12 19.09 3is4 s ALA 261 CO 0.09 -2.92 1.87 0.00 0.00 0.00 0.00 175.76 174.81 3is4 h ARG 262 N 8.16 1.00 -0.42 0.00 -0.00 -1.81 -1.41 114.38 119.90 3is4 h ARG 262 Ca 0.23 -0.06 -0.06 0.00 -0.50 0.00 0.00 59.98 59.58 3is4 h ARG 262 Cb 0.96 -0.22 -0.02 0.00 0.00 0.00 0.00 29.97 30.69 3is4 h ARG 262 CO 1.17 0.66 0.02 0.78 0.00 0.00 0.00 179.97 182.61 3is4 h GLY 263 N 1.03 0.79 0.87 0.04 0.00 -1.84 0.12 103.07 104.08 3is4 h GLY 263 Ca 0.32 -0.56 -0.07 0.00 0.00 0.00 0.00 47.33 47.01 3is4 h GLY 263 CO -0.10 0.52 -0.13 -0.55 0.00 0.00 0.00 176.54 176.28 3is4 h ASP 264 N 0.57 0.57 -0.89 0.19 3.32 -1.84 -2.81 116.42 115.53 3is4 h ASP 264 Ca 0.12 -0.41 0.08 0.00 0.02 0.00 0.00 57.03 56.84 3is4 h ASP 264 Cb 0.45 -0.16 -0.07 0.00 0.22 0.00 0.00 39.33 39.77 3is4 h ASP 264 CO 0.02 0.85 0.55 -0.07 -1.72 0.00 0.00 179.24 178.87 3is4 h LEU 265 N 0.28 0.83 -0.28 1.55 3.38 -1.18 -2.58 115.31 117.31 3is4 h LEU 265 Ca 0.06 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3is4 h LEU 265 Cb 0.64 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3is4 h LEU 265 CO 0.04 0.50 0.00 0.61 0.09 0.00 0.00 178.44 179.68 3is4 n GLY 266 N -1.33 -1.00 0.26 0.83 0.00 0.41 -1.15 105.19 103.21 3is4 n GLY 266 Ca 0.14 0.01 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 3is4 n GLY 266 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3is4 h VAL 267 N 0.00 1.28 0.00 1.61 2.07 -1.27 -3.36 116.25 116.58 3is4 h VAL 267 Ca 0.00 -1.52 -0.13 0.00 0.82 0.00 0.00 66.70 65.87 3is4 h VAL 267 Cb 0.23 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 3is4 h VAL 267 CO 0.00 0.51 -2.01 -0.62 0.02 0.00 0.00 177.57 175.47 3is4 n GLU 268 N -4.11 0.78 -5.28 1.57 1.02 -0.91 -4.78 120.64 108.94 3is4 n GLU 268 Ca -0.02 -0.11 -0.31 0.00 -0.02 0.00 0.00 57.16 56.70 3is4 n GLU 268 Cb 0.52 -1.46 -0.16 0.00 -0.02 0.00 0.00 31.44 30.32 3is4 n GLU 268 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3is4 s ILE 269 N -2.98 2.05 0.37 -3.67 1.01 -0.30 -4.90 121.20 112.78 3is4 s ILE 269 Ca -0.08 -1.08 -0.26 0.00 0.00 0.00 0.00 60.65 59.23 3is4 s ILE 269 Cb 0.10 -1.72 -0.12 0.00 0.01 0.00 0.00 42.46 40.73 3is4 s ILE 269 CO 0.77 0.57 1.12 -2.65 0.00 0.00 0.00 174.94 174.76 3is4 n PRO 270 N 2.73 1.65 -0.31 2.79 -0.02 -1.26 -4.31 135.00 136.28 3is4 n PRO 270 Ca -0.17 0.58 0.07 0.00 -2.02 0.00 0.00 63.50 61.97 3is4 n PRO 270 Cb 0.52 -2.12 0.28 0.00 -0.02 0.00 0.00 33.50 32.15 3is4 n PRO 270 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3is4 h ALA 271 N 2.01 1.60 -0.28 3.55 0.00 -1.96 -0.95 119.26 123.24 3is4 h ALA 271 Ca -0.44 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.41 3is4 h ALA 271 Cb 1.32 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3is4 h ALA 271 CO 0.60 0.20 -0.08 1.05 0.00 0.00 0.00 179.25 181.01 3is4 h GLU 272 N 0.93 0.45 -0.06 0.00 9.09 -2.01 -2.13 114.58 120.85 3is4 h GLU 272 Ca 0.44 -0.11 -0.17 0.00 0.05 0.00 0.00 59.36 59.57 3is4 h GLU 272 Cb 0.43 -0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.46 3is4 h GLU 272 CO -0.20 0.55 -0.69 0.87 0.05 0.00 0.00 179.01 179.59 3is4 h LYS 273 N 0.43 0.29 -0.61 1.06 1.57 -1.55 -3.09 116.57 114.66 3is4 h LYS 273 Ca 0.09 -0.23 -0.07 0.00 -1.87 0.00 0.00 60.65 58.57 3is4 h LYS 273 Cb 0.42 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 3is4 h LYS 273 CO 0.02 0.87 0.10 0.28 -0.57 0.00 0.00 179.45 180.15 3is4 h VAL 274 N 0.20 1.25 -0.62 0.50 2.07 -1.07 0.11 116.25 118.70 3is4 h VAL 274 Ca -0.02 -0.98 0.09 0.00 0.82 0.00 0.00 66.70 66.62 3is4 h VAL 274 Cb 1.24 0.67 -0.07 0.00 -1.52 0.00 0.00 31.29 31.61 3is4 h VAL 274 CO 0.11 0.36 0.25 0.58 0.02 0.00 0.00 177.57 178.90 3is4 h VAL 275 N 0.94 0.79 -0.22 2.57 2.07 -1.37 0.42 116.25 121.45 3is4 h VAL 275 Ca 0.19 -0.15 -0.12 0.00 0.82 0.00 0.00 66.70 67.44 3is4 h VAL 275 Cb 0.40 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 3is4 h VAL 275 CO 0.01 0.08 -0.33 0.58 0.02 0.00 0.00 177.57 177.93 3is4 h VAL 276 N 0.45 1.32 -0.81 2.57 2.07 -1.38 -2.80 116.25 117.67 3is4 h VAL 276 Ca 0.31 -1.53 0.02 0.00 0.82 0.00 0.00 66.70 66.32 3is4 h VAL 276 Cb 0.37 1.78 -0.04 0.00 -1.52 0.00 0.00 31.29 31.88 3is4 h VAL 276 CO -0.29 0.48 0.53 0.00 0.02 0.00 0.00 177.57 178.31 3is4 h ALA 277 N 0.63 1.47 -0.46 1.67 0.00 -0.51 -1.40 119.26 120.67 3is4 h ALA 277 Ca 0.02 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.95 3is4 h ALA 277 Cb 0.91 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 3is4 h ALA 277 CO 0.08 0.46 0.15 0.37 0.00 0.00 0.00 179.25 180.30 3is4 h GLN 278 N 1.04 0.30 -0.27 0.00 4.15 -0.83 0.04 115.11 119.55 3is4 h GLN 278 Ca 0.31 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.75 3is4 h GLN 278 Cb -0.03 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.56 3is4 h GLN 278 CO -0.08 0.20 0.05 0.87 -1.93 0.00 0.00 178.83 177.94 3is4 h LYS 279 N 0.31 0.14 0.33 1.69 1.57 -1.03 -1.67 116.57 117.92 3is4 h LYS 279 Ca 0.22 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.98 3is4 h LYS 279 Cb 0.24 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.52 3is4 h LYS 279 CO -0.24 0.09 -0.16 0.82 -0.57 0.00 0.00 179.45 179.39 3is4 h ILE 280 N 0.15 0.69 -0.50 1.86 2.04 -1.06 -2.06 117.51 118.62 3is4 h ILE 280 Ca 0.12 -0.33 0.02 0.00 1.00 0.00 0.00 64.86 65.67 3is4 h ILE 280 Cb 0.13 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 3is4 h ILE 280 CO -0.17 0.07 0.31 -0.07 0.00 0.00 0.00 178.15 178.29 3is4 h LEU 281 N -0.63 0.52 -0.12 1.44 4.07 -0.97 0.12 115.31 119.74 3is4 h LEU 281 Ca -0.05 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.91 3is4 h LEU 281 Cb 0.45 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.07 3is4 h LEU 281 CO 0.07 0.37 0.06 0.40 -1.08 0.00 0.00 178.44 178.27 3is4 h ILE 282 N 0.63 1.10 -0.80 1.22 2.04 -1.33 -1.61 117.51 118.76 3is4 h ILE 282 Ca 0.19 -0.28 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 3is4 h ILE 282 Cb -0.02 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 3is4 h ILE 282 CO -0.07 0.09 0.42 0.28 0.00 0.00 0.00 178.15 178.87 3is4 h SER 283 N 0.09 1.02 -0.79 1.72 0.02 -1.08 0.18 113.55 114.72 3is4 h SER 283 Ca 0.04 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 3is4 h SER 283 Cb 0.09 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.33 3is4 h SER 283 CO -0.01 0.85 0.44 0.11 -1.14 0.00 0.00 176.83 177.08 3is4 h LYS 284 N 1.13 1.10 -0.38 3.45 1.57 -0.81 -1.20 116.57 121.42 3is4 h LYS 284 Ca 0.28 -0.12 -0.13 0.00 -1.87 0.00 0.00 60.65 58.81 3is4 h LYS 284 Cb 0.07 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 3is4 h LYS 284 CO -0.04 0.81 -0.25 0.00 -0.57 0.00 0.00 179.45 179.39 3is4 h ASN 286 N 0.65 0.40 -0.39 0.00 -0.26 -0.64 -0.72 115.58 114.62 3is4 h ASN 286 Ca 0.08 0.06 -0.11 0.00 -0.56 0.00 0.00 56.30 55.76 3is4 h ASN 286 Cb 0.82 -0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 38.05 3is4 h ASN 286 CO 0.07 0.24 -0.16 0.58 -1.06 0.00 0.00 177.43 177.11 3is4 h VAL 287 N 0.55 1.27 0.00 2.81 2.07 -1.08 -2.64 116.25 119.23 3is4 h VAL 287 Ca 0.32 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.56 3is4 h VAL 287 Cb 0.32 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 3is4 h VAL 287 CO -0.25 0.44 0.00 0.00 0.02 0.00 0.00 177.57 177.77 3is4 n ALA 288 N -2.50 2.02 -2.37 1.67 0.00 -0.48 -4.91 120.51 113.95 3is4 n ALA 288 Ca 0.01 -0.08 -0.13 0.00 0.00 0.00 0.00 53.44 53.23 3is4 n ALA 288 Cb 0.41 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.50 3is4 n ALA 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3is4 n GLY 289 N 0.73 -0.16 3.31 0.00 0.00 -0.34 -5.03 105.19 103.71 3is4 n GLY 289 Ca 0.06 -0.30 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 3is4 n GLY 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3is4 s LYS 290 N -4.80 2.30 0.47 1.61 1.02 -0.84 -4.76 119.74 114.74 3is4 s LYS 290 Ca 0.04 -0.90 -0.24 0.00 0.02 0.00 0.00 55.97 54.89 3is4 s LYS 290 Cb -0.02 -2.12 -0.07 0.00 -0.52 0.00 0.00 37.83 35.10 3is4 s LYS 290 CO 0.06 0.51 1.41 -1.25 -0.92 0.00 0.00 175.35 175.16 3is4 s PRO 291 N -0.48 3.56 -0.04 -1.68 0.04 -1.26 -4.41 135.00 130.74 3is4 s PRO 291 Ca 0.06 2.38 0.03 0.00 0.04 0.00 0.00 61.00 63.50 3is4 s PRO 291 Cb -0.11 -2.57 0.01 0.00 0.04 0.00 0.00 34.50 31.87 3is4 s PRO 291 CO 0.01 -0.90 -0.10 0.54 0.04 0.00 0.00 177.00 176.58 3is4 s VAL 292 N -1.22 0.89 -0.15 -0.36 0.11 -1.26 -1.81 120.40 116.59 3is4 s VAL 292 Ca 0.63 -0.40 -0.02 0.00 -2.93 0.00 0.00 61.98 59.27 3is4 s VAL 292 Cb -0.43 -0.80 -0.02 0.00 -1.53 0.00 0.00 36.38 33.61 3is4 s VAL 292 CO 0.54 0.28 -0.09 -0.63 -3.33 0.00 0.00 175.10 171.88 3is4 s ILE 293 N 0.32 3.38 -0.28 7.04 1.01 0.16 -1.46 121.20 131.37 3is4 s ILE 293 Ca -0.06 -0.53 -0.18 0.00 0.00 0.00 0.00 60.65 59.88 3is4 s ILE 293 Cb -0.11 -2.46 -0.02 0.00 0.01 0.00 0.00 42.46 39.88 3is4 s ILE 293 CO 0.01 0.50 0.51 0.00 0.00 0.00 0.00 174.94 175.96 3is4 s ALA 295 N 2.33 1.05 0.33 0.00 0.00 -0.91 -1.32 121.76 123.23 3is4 s ALA 295 Ca 0.20 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.88 3is4 s ALA 295 Cb -0.16 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.07 3is4 s ALA 295 CO 0.10 -0.15 0.00 0.25 0.00 0.00 0.00 175.76 175.96 3is4 n THR 296 N 0.19 -3.34 -3.76 0.00 -2.24 -1.26 -2.84 114.28 101.03 3is4 n THR 296 Ca -0.14 1.37 -0.25 0.00 -2.27 0.00 0.00 64.05 62.76 3is4 n THR 296 Cb 0.60 -1.93 0.02 0.00 -2.10 0.00 0.00 70.33 66.92 3is4 n THR 296 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3is4 n GLN 297 N -1.13 -3.14 -0.09 -0.78 6.02 -1.26 -4.69 117.38 112.31 3is4 n GLN 297 Ca 0.00 0.51 -0.12 0.00 -0.01 0.00 0.00 57.00 57.38 3is4 n GLN 297 Cb 0.04 -4.67 -0.05 0.00 1.02 0.00 0.00 30.24 26.59 3is4 n GLN 297 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3is4 n MET 298 N -4.25 0.51 -2.61 -1.09 2.81 -1.26 -4.69 117.12 106.55 3is4 n MET 298 Ca -0.23 0.40 -0.12 0.00 -1.81 0.00 0.00 57.70 55.93 3is4 n MET 298 Cb 0.65 -1.59 0.03 0.00 -0.71 0.00 0.00 33.22 31.60 3is4 n MET 298 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3is4 n LEU 299 N -4.49 2.44 -0.36 4.03 4.77 -1.26 -4.66 117.00 117.47 3is4 n LEU 299 Ca -0.19 -3.98 0.10 0.00 -0.03 0.00 0.00 56.01 51.91 3is4 n LEU 299 Cb 0.49 0.19 0.28 0.00 -2.33 0.00 0.00 43.42 42.05 3is4 n LEU 299 CO 0.14 1.65 1.22 -0.08 -1.33 0.00 0.00 177.39 178.99 3is4 h GLU 300 N 2.77 0.87 0.00 3.23 4.81 -1.98 -0.75 114.58 123.54 3is4 h GLU 300 Ca 0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3is4 h GLU 300 Cb 1.17 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.36 3is4 h GLU 300 CO 0.53 0.57 0.00 0.66 -0.73 0.00 0.00 179.01 180.05 3is4 h SER 301 N 0.89 0.00 -0.02 1.04 4.64 -1.93 -1.14 113.55 117.04 3is4 h SER 301 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3is4 h SER 301 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 3is4 h SER 301 CO -0.31 0.00 0.00 0.80 -0.87 0.00 0.00 176.83 176.45 3is4 n MET 302 N -2.75 1.06 -0.23 4.77 0.00 -0.29 -2.03 117.12 117.66 3is4 n MET 302 Ca -0.00 -0.09 -0.07 0.00 -0.00 0.00 0.00 57.70 57.54 3is4 n MET 302 Cb 0.18 -1.23 0.04 0.00 0.00 0.00 0.00 33.22 32.21 3is4 n MET 302 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 3is4 h THR 303 N 0.16 1.23 0.00 1.12 2.02 -1.35 -3.39 112.91 112.70 3is4 h THR 303 Ca 0.00 -0.68 0.00 0.00 0.77 0.00 0.00 66.41 66.50 3is4 h THR 303 Cb 0.04 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 3is4 h THR 303 CO 0.00 0.27 -0.33 -1.22 0.37 0.00 0.00 175.52 174.61 3is4 n TYR 304 N -4.46 0.00 -3.92 3.16 4.01 -1.20 0.46 117.16 115.20 3is4 n TYR 304 Ca 0.04 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.44 3is4 n TYR 304 Cb 0.15 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.13 3is4 n TYR 304 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3is4 s ASN 305 N -1.03 6.29 0.13 7.72 0.02 -0.86 -4.95 114.94 122.27 3is4 s ASN 305 Ca 0.00 0.34 0.18 0.00 -1.02 0.00 0.00 52.86 52.36 3is4 s ASN 305 Cb 0.00 -1.97 0.77 0.00 0.02 0.00 0.00 41.25 40.08 3is4 s ASN 305 CO 0.00 0.28 1.56 -0.81 0.02 0.00 0.00 177.10 178.15 3is4 n PRO 306 N 1.10 0.10 -4.04 -0.60 -0.04 -1.26 -4.26 135.00 125.99 3is4 n PRO 306 Ca -0.12 0.37 -0.12 0.00 -0.04 0.00 0.00 63.50 63.58 3is4 n PRO 306 Cb 0.53 -1.69 -0.11 0.00 -0.04 0.00 0.00 33.50 32.18 3is4 n PRO 306 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3is4 s ARG 307 N -3.18 0.47 0.72 0.54 0.52 -1.26 -5.00 118.95 111.76 3is4 s ARG 307 Ca 0.05 -0.69 -0.03 0.00 -0.52 0.00 0.00 55.73 54.54 3is4 s ARG 307 Cb 0.09 -0.20 0.11 0.00 0.52 0.00 0.00 34.95 35.47 3is4 s ARG 307 CO 0.30 0.03 1.00 -1.25 0.02 0.00 0.00 175.30 175.40 3is4 s PRO 308 N -1.47 1.75 0.68 3.54 0.04 -1.26 -4.44 135.00 133.83 3is4 s PRO 308 Ca -0.11 -0.90 -0.11 0.00 0.04 0.00 0.00 61.00 59.92 3is4 s PRO 308 Cb -0.10 -2.29 -0.00 0.00 0.04 0.00 0.00 34.50 32.16 3is4 s PRO 308 CO 0.00 -1.42 1.05 0.95 0.04 0.00 0.00 177.00 177.62 3is4 s THR 309 N -3.18 4.17 0.25 1.26 -4.23 -1.26 -4.94 115.64 107.71 3is4 s THR 309 Ca 0.65 0.70 -0.06 0.00 -1.18 0.00 0.00 61.69 61.81 3is4 s THR 309 Cb -0.06 -3.50 0.24 0.00 1.34 0.00 0.00 72.50 70.52 3is4 s THR 309 CO 0.44 -0.92 1.90 -0.09 -0.54 0.00 0.00 174.62 175.42 3is4 h ARG 310 N -0.64 1.26 -0.48 3.99 2.43 -2.00 -2.43 114.38 116.52 3is4 h ARG 310 Ca -0.44 -0.11 -0.06 0.00 -0.81 0.00 0.00 59.98 58.56 3is4 h ARG 310 Cb 1.21 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 30.47 3is4 h ARG 310 CO 0.58 0.87 0.05 0.00 -1.51 0.00 0.00 179.97 179.96 3is4 h ALA 311 N 1.35 1.20 -0.63 2.80 0.00 -1.99 -2.28 119.26 119.70 3is4 h ALA 311 Ca 0.33 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3is4 h ALA 311 Cb -0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 3is4 h ALA 311 CO -0.06 0.54 0.20 0.93 0.00 0.00 0.00 179.25 180.86 3is4 h GLU 312 N 0.72 0.98 -0.52 0.00 5.08 -1.77 -1.17 114.58 117.91 3is4 h GLU 312 Ca 0.15 -0.21 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 3is4 h GLU 312 Cb 0.36 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 3is4 h GLU 312 CO 0.01 0.86 0.28 0.28 -1.00 0.00 0.00 179.01 179.44 3is4 h VAL 313 N 0.91 0.99 -0.20 3.13 2.07 -1.18 -2.24 116.25 119.72 3is4 h VAL 313 Ca 0.21 -0.19 -0.08 0.00 0.82 0.00 0.00 66.70 67.46 3is4 h VAL 313 Cb 0.28 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 3is4 h VAL 313 CO -0.01 0.10 -0.22 0.77 0.02 0.00 0.00 177.57 178.23 3is4 h SER 314 N 0.54 0.35 0.01 0.57 4.64 -1.04 -2.22 113.55 116.40 3is4 h SER 314 Ca 0.22 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3is4 h SER 314 Cb 0.10 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3is4 h SER 314 CO -0.14 0.58 -0.02 -0.78 -0.87 0.00 0.00 176.83 175.60 3is4 h ASP 315 N 0.32 -0.06 -0.14 4.97 3.58 -0.87 -0.68 116.42 123.55 3is4 h ASP 315 Ca 0.05 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.51 3is4 h ASP 315 Cb 0.57 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.64 3is4 h ASP 315 CO 0.04 -0.03 0.09 0.58 -2.88 0.00 0.00 179.24 177.04 3is4 h VAL 316 N -0.04 1.04 -0.92 2.25 2.07 -1.17 -1.30 116.25 118.18 3is4 h VAL 316 Ca 0.01 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 3is4 h VAL 316 Cb 0.05 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 3is4 h VAL 316 CO -0.02 0.04 0.55 0.00 0.02 0.00 0.00 177.57 178.16 3is4 h ALA 317 N 1.04 1.17 0.00 1.67 0.00 -1.33 -2.76 119.26 119.06 3is4 h ALA 317 Ca 0.05 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3is4 h ALA 317 Cb -0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 3is4 h ALA 317 CO -0.01 0.63 -0.46 -0.91 0.00 0.00 0.00 179.25 178.50 3is4 h ASN 318 N 1.27 0.00 -0.81 0.00 2.35 -0.90 -0.76 115.58 116.73 3is4 h ASN 318 Ca 0.33 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.08 3is4 h ASN 318 Cb -0.05 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.28 3is4 h ASN 318 CO -0.06 0.46 0.49 0.00 -1.65 0.00 0.00 177.43 176.68 3is4 h ALA 319 N 1.54 1.03 -0.13 -0.83 0.00 -0.96 0.14 119.26 120.05 3is4 h ALA 319 Ca -0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 3is4 h ALA 319 Cb 1.03 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 3is4 h ALA 319 CO 0.06 0.49 -0.02 0.28 0.00 0.00 0.00 179.25 180.05 3is4 h VAL 320 N 1.11 1.28 -0.79 0.00 2.07 -1.26 -1.81 116.25 116.85 3is4 h VAL 320 Ca 0.29 -0.94 0.06 0.00 0.82 0.00 0.00 66.70 66.94 3is4 h VAL 320 Cb -0.05 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.31 3is4 h VAL 320 CO -0.06 0.27 0.52 -0.26 0.02 0.00 0.00 177.57 178.06 3is4 h PHE 321 N -0.05 0.86 -0.23 1.57 0.04 -1.00 -0.96 116.94 117.17 3is4 h PHE 321 Ca 0.03 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 3is4 h PHE 321 Cb 0.43 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 3is4 h PHE 321 CO 0.05 0.45 0.13 -0.91 -0.60 0.00 0.00 178.31 177.44 3is4 h ASN 322 N 0.85 0.26 0.00 2.17 -0.26 -0.61 -3.47 115.58 114.53 3is4 h ASN 322 Ca 0.34 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 56.07 3is4 h ASN 322 Cb 0.24 -0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.43 3is4 h ASN 322 CO -0.12 0.21 0.00 0.61 -1.06 0.00 0.00 177.43 177.07 3is4 n GLY 323 N -1.46 1.59 3.78 2.83 0.00 -0.37 -4.55 105.19 107.01 3is4 n GLY 323 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3is4 n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3is4 s ALA 324 N -2.00 3.61 0.08 4.61 0.00 -0.70 -4.90 121.76 122.46 3is4 s ALA 324 Ca 0.00 1.60 -0.15 0.00 0.00 0.00 0.00 51.96 53.41 3is4 s ALA 324 Cb 0.00 -3.63 -0.15 0.00 0.00 0.00 0.00 23.12 19.35 3is4 s ALA 324 CO 0.00 -1.08 1.30 -0.44 0.00 0.00 0.00 175.76 175.55 3is4 h ASP 325 N 3.27 0.80 -4.45 0.00 5.19 -1.57 -3.45 116.42 116.21 3is4 h ASP 325 Ca -0.50 -0.60 -0.33 0.00 -0.62 0.00 0.00 57.03 54.97 3is4 h ASP 325 Cb 1.24 -0.24 -0.19 0.00 0.18 0.00 0.00 39.33 40.32 3is4 h ASP 325 CO 0.66 1.27 -0.74 0.00 -3.12 0.00 0.00 179.24 177.31 3is4 s VAL 327 N -2.08 1.60 0.03 0.00 -7.23 -0.42 -0.94 120.40 111.37 3is4 s VAL 327 Ca 0.02 -1.10 0.08 0.00 -1.81 0.00 0.00 61.98 59.17 3is4 s VAL 327 Cb -0.05 -1.38 -0.02 0.00 0.56 0.00 0.00 36.38 35.48 3is4 s VAL 327 CO 0.01 0.25 -0.23 -0.32 -0.31 0.00 0.00 175.10 174.50 3is4 s MET 328 N -0.99 1.63 -0.06 4.82 1.75 -0.43 -1.32 119.30 124.69 3is4 s MET 328 Ca 0.07 -0.98 0.04 0.00 -1.25 0.00 0.00 55.69 53.57 3is4 s MET 328 Cb -0.08 -1.73 -0.02 0.00 2.84 0.00 0.00 34.83 35.83 3is4 s MET 328 CO 0.01 0.45 -0.17 -0.51 -0.65 0.00 0.00 175.02 174.16 3is4 s LEU 329 N -1.07 2.58 0.00 4.11 1.43 -0.01 -4.35 118.68 121.38 3is4 s LEU 329 Ca 0.09 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 3is4 s LEU 329 Cb -0.09 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.61 3is4 s LEU 329 CO 0.01 0.31 0.00 -1.20 0.23 0.00 0.00 176.35 175.70 3is4 n SER 330 N 2.57 0.00 0.26 2.29 7.64 -1.26 -1.66 113.62 123.46 3is4 n SER 330 Ca -0.17 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.82 3is4 n SER 330 Cb 0.52 0.00 0.71 0.00 -1.01 0.00 0.00 64.21 64.43 3is4 n SER 330 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3is4 h GLY 331 N 0.00 0.00 1.11 0.23 0.00 -1.97 -0.70 103.07 101.74 3is4 h GLY 331 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 3is4 h GLY 331 CO 0.00 0.00 0.38 0.83 0.00 0.00 0.00 176.54 177.75 3is4 h GLU 332 N 0.00 0.39 0.00 4.80 3.07 -1.89 0.11 114.58 121.05 3is4 h GLU 332 Ca -0.00 -0.02 -0.23 0.00 -0.50 0.00 0.00 59.36 58.60 3is4 h GLU 332 Cb 0.27 -0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 28.05 3is4 h GLU 332 CO 0.01 0.26 -1.88 0.25 -1.40 0.00 0.00 179.01 176.25 3is4 n THR 333 N -4.47 0.89 -0.00 1.13 -2.24 -0.96 -3.72 114.28 104.90 3is4 n THR 333 Ca 0.09 -0.47 -0.12 0.00 -2.27 0.00 0.00 64.05 61.27 3is4 n THR 333 Cb 0.34 -0.80 -0.08 0.00 -2.10 0.00 0.00 70.33 67.69 3is4 n THR 333 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3is4 h ALA 334 N 0.41 0.04 0.00 6.98 0.00 -0.50 -3.37 119.26 122.83 3is4 h ALA 334 Ca -0.35 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3is4 h ALA 334 Cb 1.70 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.48 3is4 h ALA 334 CO -0.01 -0.30 0.00 0.36 0.00 0.00 0.00 179.25 179.31 3is4 n LYS 335 N -4.91 -0.51 -1.03 0.00 2.85 -0.58 -2.07 118.16 111.90 3is4 n LYS 335 Ca -0.07 -0.38 -0.29 0.00 -1.05 0.00 0.00 58.31 56.51 3is4 n LYS 335 Cb 0.17 -0.83 0.17 0.00 -0.65 0.00 0.00 35.03 33.89 3is4 n LYS 335 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3is4 s GLY 336 N -0.04 1.60 0.16 2.58 0.00 0.27 -4.82 107.32 107.08 3is4 s GLY 336 Ca 0.00 -0.07 0.19 0.00 0.00 0.00 0.00 44.72 44.84 3is4 s GLY 336 CO 0.00 0.48 1.04 1.70 0.00 0.00 0.00 173.10 176.32 3is4 h LYS 337 N -1.84 0.00 -1.83 2.90 3.64 -0.23 -3.41 116.57 115.80 3is4 h LYS 337 Ca -0.52 0.00 -0.53 0.00 -1.27 0.00 0.00 60.65 58.33 3is4 h LYS 337 Cb 1.30 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.71 3is4 h LYS 337 CO 0.53 0.21 -0.87 0.66 -2.27 0.00 0.00 179.45 177.71 3is4 n TYR 338 N -2.89 2.58 -0.13 1.91 4.01 -1.26 -4.95 117.16 116.43 3is4 n TYR 338 Ca -0.04 -3.55 -0.07 0.00 -0.16 0.00 0.00 57.90 54.08 3is4 n TYR 338 Cb 0.71 -0.35 0.02 0.00 -0.31 0.00 0.00 39.34 39.41 3is4 n TYR 338 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3is4 h PRO 339 N 2.89 0.46 -0.13 -0.72 0.13 -1.80 -0.71 132.00 132.12 3is4 h PRO 339 Ca 0.13 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3is4 h PRO 339 Cb 0.82 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 3is4 h PRO 339 CO 0.71 0.31 0.06 -0.91 -0.23 0.00 0.00 178.00 177.94 3is4 h ASN 340 N 0.48 0.17 -0.72 1.44 2.35 -1.92 -2.89 115.58 114.49 3is4 h ASN 340 Ca 0.17 -0.12 -0.04 0.00 -0.55 0.00 0.00 56.30 55.76 3is4 h ASN 340 Cb 0.03 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.33 3is4 h ASN 340 CO -0.09 0.24 0.28 -0.33 -1.65 0.00 0.00 177.43 175.88 3is4 h GLU 341 N 0.08 1.10 -0.50 0.81 3.07 -1.90 -1.18 114.58 116.07 3is4 h GLU 341 Ca 0.04 -0.20 -0.06 0.00 -0.50 0.00 0.00 59.36 58.64 3is4 h GLU 341 Cb 0.12 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 27.83 3is4 h GLU 341 CO -0.01 0.90 0.07 -0.24 -1.40 0.00 0.00 179.01 178.33 3is4 h VAL 342 N 1.07 1.25 -0.56 3.13 3.04 -1.13 0.22 116.25 123.27 3is4 h VAL 342 Ca 0.25 -0.96 -0.09 0.00 -1.01 0.00 0.00 66.70 64.89 3is4 h VAL 342 Cb 0.22 0.90 -0.02 0.00 -2.01 0.00 0.00 31.29 30.38 3is4 h VAL 342 CO -0.02 0.34 0.01 0.58 -1.01 0.00 0.00 177.57 177.47 3is4 h VAL 343 N 0.71 1.26 -0.57 1.51 2.07 -1.31 0.37 116.25 120.29 3is4 h VAL 343 Ca 0.15 -1.12 -0.08 0.00 0.82 0.00 0.00 66.70 66.47 3is4 h VAL 343 Cb 0.42 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3is4 h VAL 343 CO 0.01 0.40 0.02 1.56 0.02 0.00 0.00 177.57 179.59 3is4 h GLN 344 N 0.88 0.97 -0.30 1.57 4.20 -1.08 -0.88 115.11 120.47 3is4 h GLN 344 Ca 0.16 -0.28 -0.11 0.00 0.06 0.00 0.00 58.65 58.48 3is4 h GLN 344 Cb 0.54 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 3is4 h GLN 344 CO 0.03 0.94 -0.24 -0.92 -0.67 0.00 0.00 178.83 177.96 3is4 h TYR 345 N 0.90 0.82 -0.55 2.96 3.20 -0.78 -2.18 116.97 121.34 3is4 h TYR 345 Ca 0.17 -0.23 0.07 0.00 3.14 0.00 0.00 58.73 61.87 3is4 h TYR 345 Cb 0.49 -0.18 -0.06 0.00 1.54 0.00 0.00 36.73 38.53 3is4 h TYR 345 CO 0.03 0.96 0.24 1.98 -1.64 0.00 0.00 178.16 179.74 3is4 h MET 346 N 0.44 0.44 -0.69 1.82 4.05 -0.71 -0.22 114.93 120.06 3is4 h MET 346 Ca 0.05 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.45 3is4 h MET 346 Cb 0.80 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.47 3is4 h MET 346 CO 0.06 0.29 0.43 0.00 0.23 0.00 0.00 176.91 177.92 3is4 h ALA 347 N 1.34 0.88 -0.62 0.39 0.00 -1.13 -1.66 119.26 118.46 3is4 h ALA 347 Ca 0.26 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3is4 h ALA 347 Cb 0.25 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3is4 h ALA 347 CO -0.23 0.34 0.35 -0.09 0.00 0.00 0.00 179.25 179.63 3is4 h ARG 348 N 0.94 0.86 -0.29 0.00 2.43 -0.77 -1.22 114.38 116.34 3is4 h ARG 348 Ca 0.25 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 3is4 h ARG 348 Cb -0.05 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 3is4 h ARG 348 CO -0.05 0.65 0.09 0.82 -1.51 0.00 0.00 179.97 179.97 3is4 h ILE 349 N 0.85 1.20 -0.16 1.20 2.04 -0.81 -1.76 117.51 120.06 3is4 h ILE 349 Ca 0.22 -0.62 0.02 0.00 1.00 0.00 0.00 64.86 65.48 3is4 h ILE 349 Cb 0.03 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 3is4 h ILE 349 CO -0.04 0.21 0.04 0.00 0.00 0.00 0.00 178.15 178.36 3is4 h LEU 351 N 0.11 0.81 -0.22 0.00 5.85 -1.17 0.13 115.31 120.82 3is4 h LEU 351 Ca 0.07 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 3is4 h LEU 351 Cb 0.06 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3is4 h LEU 351 CO -0.09 0.56 0.08 -0.08 -0.34 0.00 0.00 178.44 178.57 3is4 h GLU 352 N 0.96 0.33 -0.54 1.25 4.57 -1.05 -2.11 114.58 117.99 3is4 h GLU 352 Ca 0.31 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.42 3is4 h GLU 352 Cb 0.02 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.54 3is4 h GLU 352 CO -0.12 0.40 0.29 0.00 -1.18 0.00 0.00 179.01 178.40 3is4 h ALA 353 N 0.92 0.69 -0.92 2.92 0.00 -0.85 -2.80 119.26 119.22 3is4 h ALA 353 Ca 0.07 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3is4 h ALA 353 Cb 0.20 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 3is4 h ALA 353 CO -0.00 0.21 0.60 0.37 0.00 0.00 0.00 179.25 180.43 3is4 h GLN 354 N 0.72 1.15 0.00 0.00 4.15 -0.67 -0.45 115.11 120.01 3is4 h GLN 354 Ca 0.19 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.51 3is4 h GLN 354 Cb 0.05 -0.26 -0.00 0.00 0.21 0.00 0.00 27.48 27.48 3is4 h GLN 354 CO -0.03 0.76 -0.13 0.77 -1.93 0.00 0.00 178.83 178.27 3is4 h SER 355 N 1.18 0.00 1.09 -0.69 0.02 -1.12 -1.65 113.55 112.38 3is4 h SER 355 Ca 0.36 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.29 3is4 h SER 355 Cb -0.03 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.51 3is4 h SER 355 CO -0.11 0.13 -0.92 0.00 -1.14 0.00 0.00 176.83 174.79 3is4 h ALA 356 N 1.87 0.57 -2.52 3.77 0.00 -1.17 -3.47 119.26 118.31 3is4 h ALA 356 Ca -0.00 -0.09 -0.53 0.00 0.00 0.00 0.00 54.91 54.29 3is4 h ALA 356 Cb 0.27 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3is4 h ALA 356 CO 0.02 0.10 0.54 -1.17 0.00 0.00 0.00 179.25 178.73 3is4 s LEU 357 N -5.51 4.39 -0.78 0.00 0.20 -0.27 -4.84 118.68 111.87 3is4 s LEU 357 Ca 0.00 2.03 -0.20 0.00 0.69 0.00 0.00 54.13 56.65 3is4 s LEU 357 Cb 0.09 -3.58 0.10 0.00 -0.43 0.00 0.00 46.19 42.37 3is4 s LEU 357 CO 0.78 -0.42 1.01 0.21 -0.29 0.00 0.00 176.35 177.64 3is4 s ASN 358 N 0.83 6.40 0.48 3.68 2.47 -1.26 -4.90 114.94 122.63 3is4 s ASN 358 Ca 0.57 -1.56 0.13 0.00 0.42 0.00 0.00 52.86 52.41 3is4 s ASN 358 Cb -0.29 -2.39 1.13 0.00 -1.45 0.00 0.00 41.25 38.24 3is4 s ASN 358 CO 0.30 -1.22 2.11 -0.33 -3.72 0.00 0.00 177.10 174.25 3is4 h GLU 359 N 9.16 0.16 -0.52 0.43 3.07 -1.92 -2.48 114.58 122.48 3is4 h GLU 359 Ca -0.07 -0.01 0.01 0.00 -0.50 0.00 0.00 59.36 58.79 3is4 h GLU 359 Cb 1.05 -0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.90 3is4 h GLU 359 CO 1.13 0.12 0.34 -0.92 -1.40 0.00 0.00 179.01 178.29 3is4 h TYR 360 N 0.16 0.62 -0.66 4.33 3.20 -1.91 -1.62 116.97 121.11 3is4 h TYR 360 Ca 0.04 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.95 3is4 h TYR 360 Cb 0.01 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.02 3is4 h TYR 360 CO 0.00 0.38 0.42 0.28 -1.64 0.00 0.00 178.16 177.60 3is4 h VAL 361 N 0.67 1.10 -0.11 1.81 2.07 -1.84 0.13 116.25 120.08 3is4 h VAL 361 Ca 0.20 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 3is4 h VAL 361 Cb -0.02 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 29.95 3is4 h VAL 361 CO -0.05 0.15 0.02 -0.26 0.02 0.00 0.00 177.57 177.45 3is4 h PHE 362 N 0.82 0.19 -0.02 1.57 -1.00 -1.45 -1.06 116.94 116.00 3is4 h PHE 362 Ca 0.26 -0.03 0.03 0.00 2.81 0.00 0.00 57.97 61.04 3is4 h PHE 362 Cb -0.00 -0.05 -0.03 0.00 3.61 0.00 0.00 35.95 39.47 3is4 h PHE 362 CO -0.04 0.38 -0.16 0.35 -1.61 0.00 0.00 178.31 177.23 3is4 h PHE 363 N -0.05 -0.40 -0.02 -0.55 3.57 -1.01 -0.87 116.94 117.61 3is4 h PHE 363 Ca 0.03 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.55 3is4 h PHE 363 Cb 0.29 0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 3is4 h PHE 363 CO 0.02 -0.23 0.01 -0.97 -2.23 0.00 0.00 178.31 174.91 3is4 h ASN 364 N -0.25 0.02 -0.55 0.41 -0.00 -0.76 -0.45 115.58 114.01 3is4 h ASN 364 Ca 0.06 -0.14 0.05 0.00 -0.00 0.00 0.00 56.30 56.27 3is4 h ASN 364 Cb 0.32 -0.01 -0.05 0.00 -0.00 0.00 0.00 38.32 38.59 3is4 h ASN 364 CO -0.17 0.16 0.27 0.28 -0.00 0.00 0.00 177.43 177.97 3is4 h SER 365 N -0.11 0.37 -0.34 1.15 0.02 -1.11 -1.26 113.55 112.26 3is4 h SER 365 Ca 0.01 0.04 -0.12 0.00 -0.84 0.00 0.00 61.79 60.88 3is4 h SER 365 Cb 0.14 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 3is4 h SER 365 CO -0.00 0.25 -0.25 0.40 -1.14 0.00 0.00 176.83 176.09 3is4 h ILE 366 N 0.51 1.29 -0.50 3.27 2.04 -1.03 -3.12 117.51 119.97 3is4 h ILE 366 Ca 0.25 -1.39 0.01 0.00 1.00 0.00 0.00 64.86 64.73 3is4 h ILE 366 Cb 0.18 1.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3is4 h ILE 366 CO -0.19 0.46 0.31 0.50 0.00 0.00 0.00 178.15 179.23 3is4 h LYS 367 N 0.55 0.62 0.00 2.37 3.64 -0.82 -2.62 116.57 120.30 3is4 h LYS 367 Ca 0.07 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3is4 h LYS 367 Cb 0.81 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.49 3is4 h LYS 367 CO 0.07 0.41 -0.02 0.87 -2.27 0.00 0.00 179.45 178.51 3is4 h LYS 368 N 0.63 0.00 -0.00 1.90 1.57 -1.19 -2.10 116.57 117.39 3is4 h LYS 368 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 3is4 h LYS 368 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 3is4 h LYS 368 CO -0.07 0.02 -0.32 1.28 -0.57 0.00 0.00 179.45 179.79 3is4 n LEU 369 N -3.27 0.43 -4.74 2.94 4.77 -0.99 -4.90 117.00 111.24 3is4 n LEU 369 Ca -0.02 0.09 -0.41 0.00 -0.03 0.00 0.00 56.01 55.64 3is4 n LEU 369 Cb 0.13 -0.29 -0.03 0.00 -2.33 0.00 0.00 43.42 40.91 3is4 n LEU 369 CO 0.24 0.10 1.01 -1.10 -1.33 0.00 0.00 177.39 176.30 3is4 s GLN 370 N -2.90 4.37 0.02 3.23 -1.52 -0.79 -5.00 119.66 117.07 3is4 s GLN 370 Ca 0.15 2.11 -0.30 0.00 -1.95 0.00 0.00 55.36 55.37 3is4 s GLN 370 Cb 0.18 -3.17 -0.04 0.00 -0.22 0.00 0.00 33.01 29.77 3is4 s GLN 370 CO 0.62 -0.27 0.96 -1.58 -0.25 0.00 0.00 175.29 174.77 3is4 s HIS 371 N -0.04 3.69 -0.20 0.91 5.65 -1.26 -5.02 115.29 119.02 3is4 s HIS 371 Ca 0.56 1.70 -0.10 0.00 0.25 0.00 0.00 55.06 57.47 3is4 s HIS 371 Cb -0.38 -3.09 -0.05 0.00 -1.18 0.00 0.00 32.58 27.88 3is4 s HIS 371 CO 0.40 0.04 0.13 0.42 -0.65 0.00 0.00 174.74 175.08 3is4 s ILE 372 N 0.81 5.37 0.26 0.89 1.09 -1.26 -2.88 121.20 125.48 3is4 s ILE 372 Ca 0.50 0.18 -0.29 0.00 -1.10 0.00 0.00 60.65 59.94 3is4 s ILE 372 Cb -0.21 -3.45 -0.09 0.00 -1.06 0.00 0.00 42.46 37.64 3is4 s ILE 372 CO 0.28 0.43 1.19 -2.16 -0.10 0.00 0.00 174.94 174.59 3is4 s PRO 373 N 0.41 4.51 0.44 2.79 0.04 -1.26 -5.18 135.00 136.76 3is4 s PRO 373 Ca 0.08 1.95 -0.16 0.00 0.04 0.00 0.00 61.00 62.90 3is4 s PRO 373 Cb -0.11 -3.17 -0.09 0.00 0.04 0.00 0.00 34.50 31.17 3is4 s PRO 373 CO -0.01 0.00 0.90 -1.64 0.04 0.00 0.00 177.00 176.28 3is4 s MET 374 N -1.11 3.99 0.77 4.56 -1.94 -1.14 -5.08 119.30 119.34 3is4 s MET 374 Ca 0.49 0.86 -0.11 0.00 -1.71 0.00 0.00 55.69 55.21 3is4 s MET 374 Cb -0.34 -2.24 0.05 0.00 2.01 0.00 0.00 34.83 34.31 3is4 s MET 374 CO 0.43 -0.10 1.08 -1.54 -0.01 0.00 0.00 175.02 174.88 3is4 s SER 375 N -2.75 4.66 0.22 3.03 1.04 -1.26 -4.85 113.70 113.79 3is4 s SER 375 Ca 0.57 1.57 -0.07 0.00 0.48 0.00 0.00 55.95 58.50 3is4 s SER 375 Cb -0.10 -2.34 0.35 0.00 0.10 0.00 0.00 66.02 64.04 3is4 s SER 375 CO 0.25 -1.90 1.73 0.00 0.98 0.00 0.00 173.24 174.30 3is4 h ALA 376 N -1.03 0.88 0.09 5.32 0.00 -1.98 -1.88 119.26 120.65 3is4 h ALA 376 Ca -0.45 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3is4 h ALA 376 Cb 1.24 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 3is4 h ALA 376 CO 0.56 -0.21 -0.05 0.38 0.00 0.00 0.00 179.25 179.92 3is4 h ASP 377 N 0.40 -0.13 -0.44 0.00 -0.00 -1.94 -0.78 116.42 113.54 3is4 h ASP 377 Ca 0.35 0.01 0.02 0.00 -0.00 0.00 0.00 57.03 57.41 3is4 h ASP 377 Cb 0.49 0.04 -0.03 0.00 -0.00 0.00 0.00 39.33 39.83 3is4 h ASP 377 CO -0.36 -0.09 0.26 -0.08 -0.00 0.00 0.00 179.24 178.97 3is4 h GLU 378 N -0.14 0.51 -0.46 4.15 4.57 -1.85 -1.54 114.58 119.83 3is4 h GLU 378 Ca -0.01 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 3is4 h GLU 378 Cb 0.11 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 3is4 h GLU 378 CO 0.01 0.34 0.19 0.00 -1.18 0.00 0.00 179.01 178.37 3is4 h ALA 379 N 1.19 0.59 -0.22 2.92 0.00 -1.18 -1.88 119.26 120.69 3is4 h ALA 379 Ca 0.17 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3is4 h ALA 379 Cb 0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3is4 h ALA 379 CO -0.08 0.19 0.10 0.28 0.00 0.00 0.00 179.25 179.74 3is4 h VAL 380 N 0.60 1.15 -0.08 0.00 2.07 -0.82 -1.50 116.25 117.66 3is4 h VAL 380 Ca 0.15 -0.45 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 3is4 h VAL 380 Cb 0.18 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 3is4 h VAL 380 CO -0.01 0.15 -0.02 0.00 0.02 0.00 0.00 177.57 177.71 3is4 h SER 382 N -0.17 0.63 -0.68 0.00 4.64 -1.40 -1.68 113.55 114.89 3is4 h SER 382 Ca 0.02 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3is4 h SER 382 Cb 0.42 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.32 3is4 h SER 382 CO 0.01 0.45 0.42 0.28 -0.87 0.00 0.00 176.83 177.12 3is4 h SER 383 N 0.75 0.81 -0.36 4.97 0.02 -1.22 0.11 113.55 118.63 3is4 h SER 383 Ca 0.21 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.13 3is4 h SER 383 Cb -0.07 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.24 3is4 h SER 383 CO -0.06 0.63 0.19 0.00 -1.14 0.00 0.00 176.83 176.45 3is4 h ALA 384 N 1.22 0.44 -0.56 3.77 0.00 -0.75 0.30 119.26 123.68 3is4 h ALA 384 Ca 0.25 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 3is4 h ALA 384 Cb -0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3is4 h ALA 384 CO -0.05 -0.18 0.09 0.28 0.00 0.00 0.00 179.25 179.40 3is4 h VAL 385 N 0.38 1.25 -0.85 0.00 2.07 -1.09 -2.02 116.25 116.00 3is4 h VAL 385 Ca 0.15 -0.97 0.08 0.00 0.82 0.00 0.00 66.70 66.78 3is4 h VAL 385 Cb 0.04 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 30.54 3is4 h VAL 385 CO -0.09 0.35 0.51 -1.13 0.02 0.00 0.00 177.57 177.23 3is4 h ASN 386 N 0.82 0.76 -0.10 0.57 -0.73 -0.27 -1.28 115.58 115.35 3is4 h ASN 386 Ca 0.17 0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.34 3is4 h ASN 386 Cb 0.41 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 38.87 3is4 h ASN 386 CO 0.01 0.45 -0.02 0.28 -0.37 0.00 0.00 177.43 177.79 3is4 h SER 387 N 0.88 0.27 0.25 1.15 0.02 -0.04 -0.84 113.55 115.23 3is4 h SER 387 Ca 0.39 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.29 3is4 h SER 387 Cb 0.29 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.76 3is4 h SER 387 CO -0.22 0.34 -0.12 0.58 -1.14 0.00 0.00 176.83 176.27 3is4 h VAL 388 N 0.29 0.75 -0.76 2.27 2.07 -0.52 -1.20 116.25 119.15 3is4 h VAL 388 Ca 0.07 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 3is4 h VAL 388 Cb 0.23 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 3is4 h VAL 388 CO 0.01 0.00 0.46 1.88 0.02 0.00 0.00 177.57 179.94 3is4 h TYR 389 N -0.35 1.00 -0.28 1.57 0.05 -1.13 0.22 116.97 118.06 3is4 h TYR 389 Ca -0.03 -0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.59 3is4 h TYR 389 Cb 0.27 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 37.67 3is4 h TYR 389 CO -0.06 0.67 -0.44 0.93 -1.05 0.00 0.00 178.16 178.21 3is4 h GLU 390 N 1.04 0.70 -0.02 4.88 5.08 -1.08 -3.17 114.58 122.01 3is4 h GLU 390 Ca 0.27 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3is4 h GLU 390 Cb -0.04 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3is4 h GLU 390 CO -0.05 1.00 -0.34 0.25 -1.00 0.00 0.00 179.01 178.87 3is4 n THR 391 N -4.02 0.00 -3.79 1.13 -2.24 -0.46 -4.97 114.28 99.92 3is4 n THR 391 Ca -0.02 -0.29 -0.26 0.00 -2.27 0.00 0.00 64.05 61.20 3is4 n THR 391 Cb 0.55 1.18 0.04 0.00 -2.10 0.00 0.00 70.33 70.00 3is4 n THR 391 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3is4 n LYS 392 N 0.20 -5.57 -1.81 -0.78 5.02 0.70 -4.90 118.16 111.01 3is4 n LYS 392 Ca 0.11 0.64 -0.38 0.00 -2.02 0.00 0.00 58.31 56.66 3is4 n LYS 392 Cb 0.48 -5.42 0.05 0.00 -0.02 0.00 0.00 35.03 30.11 3is4 n LYS 392 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3is4 s ALA 393 N -3.44 2.67 -1.93 7.82 0.00 -0.65 -4.77 121.76 121.45 3is4 s ALA 393 Ca 0.39 1.25 0.20 0.00 0.00 0.00 0.00 51.96 53.80 3is4 s ALA 393 Cb -0.19 -3.55 0.02 0.00 0.00 0.00 0.00 23.12 19.40 3is4 s ALA 393 CO 0.81 -1.39 1.02 1.63 0.00 0.00 0.00 175.76 177.82 3is4 n LYS 394 N -1.32 1.50 -3.46 0.00 4.76 -0.59 -4.82 118.16 114.23 3is4 n LYS 394 Ca 0.12 -1.05 -0.13 0.00 -2.87 0.00 0.00 58.31 54.38 3is4 n LYS 394 Cb 0.46 -1.39 -0.03 0.00 -1.84 0.00 0.00 35.03 32.23 3is4 n LYS 394 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3is4 s ALA 395 N -2.16 -1.68 0.07 7.82 0.00 -1.25 -4.30 121.76 120.26 3is4 s ALA 395 Ca 0.18 0.81 0.08 0.00 0.00 0.00 0.00 51.96 53.02 3is4 s ALA 395 Cb 0.16 0.54 -0.04 0.00 0.00 0.00 0.00 23.12 23.79 3is4 s ALA 395 CO 0.46 -0.64 -0.18 -1.64 0.00 0.00 0.00 175.76 173.76 3is4 s MET 396 N -2.94 1.94 -0.15 0.00 -1.94 -0.31 -1.68 119.30 114.22 3is4 s MET 396 Ca -0.01 -1.07 0.00 0.00 -1.71 0.00 0.00 55.69 52.90 3is4 s MET 396 Cb -0.01 -2.16 0.03 0.00 2.01 0.00 0.00 34.83 34.70 3is4 s MET 396 CO -0.06 0.51 -0.12 0.08 -0.01 0.00 0.00 175.02 175.42 3is4 s VAL 397 N -1.02 1.44 -0.17 -6.03 1.01 0.03 -0.49 120.40 115.16 3is4 s VAL 397 Ca 0.16 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.55 3is4 s VAL 397 Cb -0.11 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 34.89 3is4 s VAL 397 CO 0.07 0.39 -0.20 -0.69 0.00 0.00 0.00 175.10 174.67 3is4 s VAL 398 N 1.53 2.02 -0.24 2.92 1.01 0.20 -0.60 120.40 127.25 3is4 s VAL 398 Ca 0.04 -0.92 -0.22 0.00 0.00 0.00 0.00 61.98 60.88 3is4 s VAL 398 Cb -0.13 -1.83 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 3is4 s VAL 398 CO -0.10 0.53 0.69 -0.76 0.00 0.00 0.00 175.10 175.46 3is4 s LEU 399 N 1.26 4.08 -0.08 3.92 1.02 -0.25 -0.76 118.68 127.86 3is4 s LEU 399 Ca 0.04 0.81 -0.04 0.00 0.02 0.00 0.00 54.13 54.97 3is4 s LEU 399 Cb -0.13 -2.95 0.04 0.00 0.02 0.00 0.00 46.19 43.17 3is4 s LEU 399 CO -0.12 -0.40 0.18 -0.55 0.02 0.00 0.00 176.35 175.49 3is4 s SER 400 N 1.41 -0.01 -0.13 2.29 0.15 -0.90 -4.60 113.70 111.90 3is4 s SER 400 Ca 0.29 0.39 -0.17 0.00 0.70 0.00 0.00 55.95 57.16 3is4 s SER 400 Cb -0.15 0.30 -0.25 0.00 -1.71 0.00 0.00 66.02 64.20 3is4 s SER 400 CO 0.08 -0.17 0.49 0.78 1.20 0.00 0.00 173.24 175.62 3is4 h ASN 401 N 7.45 0.28 0.81 5.45 2.35 -1.93 -3.35 115.58 126.63 3is4 h ASN 401 Ca -0.37 -0.80 0.00 0.00 -0.55 0.00 0.00 56.30 54.58 3is4 h ASN 401 Cb 1.14 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.42 3is4 h ASN 401 CO 0.35 1.57 -0.80 0.71 -1.65 0.00 0.00 177.43 177.61 3is4 h THR 402 N -0.46 0.00 0.00 2.81 1.35 -1.97 -3.40 112.91 111.23 3is4 h THR 402 Ca -0.30 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 64.95 3is4 h THR 402 Cb 1.64 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 69.17 3is4 h THR 402 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3is4 n GLY 403 N 1.30 0.23 0.19 5.82 0.00 -1.26 -4.86 105.19 106.61 3is4 n GLY 403 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 3is4 n GLY 403 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3is4 h ARG 404 N 3.98 -0.24 -0.29 1.61 2.43 -1.93 -1.89 114.38 118.04 3is4 h ARG 404 Ca 0.00 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.12 3is4 h ARG 404 Cb 0.00 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 3is4 h ARG 404 CO 0.00 -0.16 -0.10 0.66 -1.51 0.00 0.00 179.97 178.86 3is4 h SER 405 N -0.25 0.46 -0.53 -3.80 4.64 -1.92 -1.64 113.55 110.52 3is4 h SER 405 Ca 0.04 -0.11 -0.08 0.00 -0.47 0.00 0.00 61.79 61.17 3is4 h SER 405 Cb 0.30 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 3is4 h SER 405 CO -0.12 0.60 0.03 0.00 -0.87 0.00 0.00 176.83 176.46 3is4 h ALA 406 N 1.45 0.72 -0.18 5.18 0.00 -1.83 -1.11 119.26 123.49 3is4 h ALA 406 Ca 0.09 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 3is4 h ALA 406 Cb 0.45 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3is4 h ALA 406 CO 0.02 0.51 -0.33 0.00 0.00 0.00 0.00 179.25 179.46 3is4 h ARG 407 N 0.80 0.36 -0.27 0.00 3.08 -1.16 -0.77 114.38 116.42 3is4 h ARG 407 Ca 0.15 -0.15 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 3is4 h ARG 407 Cb 0.49 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 3is4 h ARG 407 CO 0.02 0.65 -0.44 1.25 -1.07 0.00 0.00 179.97 180.38 3is4 h LEU 408 N 0.31 0.74 -0.16 3.04 5.85 -0.98 -1.35 115.31 122.77 3is4 h LEU 408 Ca 0.04 -0.35 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 3is4 h LEU 408 Cb 0.73 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 3is4 h LEU 408 CO 0.06 1.08 -0.15 0.58 -0.34 0.00 0.00 178.44 179.66 3is4 h VAL 409 N 0.56 1.34 -0.67 1.05 2.07 -1.10 -3.21 116.25 116.29 3is4 h VAL 409 Ca 0.04 -1.30 0.03 0.00 0.82 0.00 0.00 66.70 66.29 3is4 h VAL 409 Cb 0.99 1.83 -0.04 0.00 -1.52 0.00 0.00 31.29 32.55 3is4 h VAL 409 CO 0.09 0.39 0.44 0.00 0.02 0.00 0.00 177.57 178.51 3is4 h ALA 410 N 0.62 1.62 -1.00 1.67 0.00 -1.08 -1.66 119.26 119.43 3is4 h ALA 410 Ca 0.03 -0.03 0.23 0.00 0.00 0.00 0.00 54.91 55.13 3is4 h ALA 410 Cb 0.68 -0.23 -0.09 0.00 0.00 0.00 0.00 17.79 18.15 3is4 h ALA 410 CO 0.04 0.31 0.63 -0.22 0.00 0.00 0.00 179.25 180.01 3is4 h LYS 411 N 0.81 0.52 -0.03 0.00 3.64 -1.24 -1.38 116.57 118.88 3is4 h LYS 411 Ca 0.27 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.62 3is4 h LYS 411 Cb 0.06 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3is4 h LYS 411 CO -0.07 0.34 0.00 0.66 -2.27 0.00 0.00 179.45 178.11 3is4 n TYR 412 N -4.67 0.03 -3.39 1.91 4.01 -0.63 -4.86 117.16 109.56 3is4 n TYR 412 Ca 0.24 -0.01 -0.17 0.00 -0.16 0.00 0.00 57.90 57.79 3is4 n TYR 412 Cb 0.73 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.79 3is4 n TYR 412 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3is4 n ARG 413 N -0.19 -1.55 -1.07 -0.72 5.12 -0.52 -4.04 116.66 113.70 3is4 n ARG 413 Ca 0.20 0.92 -0.31 0.00 -1.93 0.00 0.00 57.85 56.73 3is4 n ARG 413 Cb 0.26 -4.84 0.12 0.00 -1.16 0.00 0.00 32.46 26.85 3is4 n ARG 413 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3is4 s PRO 414 N -4.52 1.80 -0.42 5.56 0.04 -1.26 -4.56 135.00 131.64 3is4 s PRO 414 Ca 0.26 1.34 0.01 0.00 0.04 0.00 0.00 61.00 62.65 3is4 s PRO 414 Cb -0.07 -1.83 0.45 0.00 0.04 0.00 0.00 34.50 33.09 3is4 s PRO 414 CO 0.80 -2.01 1.84 0.27 0.04 0.00 0.00 177.00 177.94 3is4 n ASN 415 N -3.74 5.03 -4.00 6.66 6.94 -1.26 -4.89 115.26 120.01 3is4 n ASN 415 Ca 0.10 -3.34 -0.09 0.00 -0.02 0.00 0.00 54.58 51.23 3is4 n ASN 415 Cb 0.53 -0.86 -0.08 0.00 -2.36 0.00 0.00 39.78 37.00 3is4 n ASN 415 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3is4 s PRO 417 N -3.97 3.08 -0.21 0.00 0.02 -1.26 -4.82 135.00 127.84 3is4 s PRO 417 Ca 0.17 1.84 -0.06 0.00 0.02 0.00 0.00 61.00 62.98 3is4 s PRO 417 Cb 0.05 -2.00 -0.03 0.00 0.02 0.00 0.00 34.50 32.54 3is4 s PRO 417 CO -0.01 -1.12 0.02 0.42 -0.33 0.00 0.00 177.00 175.97 3is4 s ILE 418 N -1.58 4.07 -0.30 2.83 1.01 -0.46 -1.16 121.20 125.62 3is4 s ILE 418 Ca 0.76 -0.27 -0.09 0.00 0.00 0.00 0.00 60.65 61.05 3is4 s ILE 418 Cb -0.31 -2.85 -0.01 0.00 0.01 0.00 0.00 42.46 39.30 3is4 s ILE 418 CO 0.34 0.41 0.13 -0.69 0.00 0.00 0.00 174.94 175.13 3is4 s VAL 419 N 1.07 4.46 -0.23 2.92 1.01 0.36 -0.85 120.40 129.14 3is4 s VAL 419 Ca 0.03 -0.42 -0.14 0.00 0.00 0.00 0.00 61.98 61.45 3is4 s VAL 419 Cb -0.14 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 3is4 s VAL 419 CO 0.02 0.12 0.30 0.00 0.00 0.00 0.00 175.10 175.53 3is4 s VAL 421 N 1.32 4.92 0.14 0.00 1.01 0.06 -0.26 120.40 127.59 3is4 s VAL 421 Ca 0.14 -0.21 0.07 0.00 0.00 0.00 0.00 61.98 61.98 3is4 s VAL 421 Cb -0.14 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 3is4 s VAL 421 CO 0.07 0.11 -0.17 0.28 0.00 0.00 0.00 175.10 175.39 3is4 s THR 422 N 1.68 1.59 -2.21 3.92 -1.32 -0.18 -2.11 115.64 117.00 3is4 s THR 422 Ca 0.06 -1.78 0.20 0.00 -1.21 0.00 0.00 61.69 58.95 3is4 s THR 422 Cb -0.17 -1.67 0.46 0.00 -1.51 0.00 0.00 72.50 69.61 3is4 s THR 422 CO 0.08 -0.33 1.44 0.35 -2.21 0.00 0.00 174.62 173.95 3is4 n THR 423 N 0.50 0.53 -4.13 5.08 -2.24 -1.26 0.08 114.28 112.84 3is4 n THR 423 Ca -0.15 -0.64 -0.28 0.00 -2.27 0.00 0.00 64.05 60.72 3is4 n THR 423 Cb 0.57 0.54 -0.17 0.00 -2.10 0.00 0.00 70.33 69.17 3is4 n THR 423 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3is4 s ARG 424 N -1.47 1.86 0.39 -0.78 0.52 -1.26 -4.73 118.95 113.47 3is4 s ARG 424 Ca 0.36 -0.40 0.07 0.00 -0.52 0.00 0.00 55.73 55.24 3is4 s ARG 424 Cb 0.20 -1.73 0.82 0.00 0.52 0.00 0.00 34.95 34.75 3is4 s ARG 424 CO 0.27 -0.18 2.00 -0.07 0.02 0.00 0.00 175.30 177.34 3is4 h LEU 425 N 7.83 0.56 -1.29 2.53 3.38 -1.95 -1.98 115.31 124.39 3is4 h LEU 425 Ca -0.32 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.57 3is4 h LEU 425 Cb 1.15 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 3is4 h LEU 425 CO 0.46 0.37 -0.35 -0.61 0.09 0.00 0.00 178.44 178.40 3is4 h GLN 426 N 0.64 0.00 -0.39 1.13 4.15 -1.96 -1.84 115.11 116.84 3is4 h GLN 426 Ca 0.25 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.61 3is4 h GLN 426 Cb 0.19 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 3is4 h GLN 426 CO -0.07 0.35 0.01 1.15 -1.93 0.00 0.00 178.83 178.33 3is4 h THR 427 N 0.00 1.26 -0.64 2.39 2.02 -1.66 0.13 112.91 116.40 3is4 h THR 427 Ca -0.00 -0.99 0.12 0.00 0.77 0.00 0.00 66.41 66.31 3is4 h THR 427 Cb 0.64 1.14 -0.09 0.00 -1.74 0.00 0.00 68.15 68.10 3is4 h THR 427 CO 0.05 0.33 0.16 0.00 0.37 0.00 0.00 175.52 176.43 3is4 h ARG 429 N 0.30 0.52 0.00 0.00 3.08 -1.05 -3.27 114.38 113.95 3is4 h ARG 429 Ca 0.34 -0.29 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 3is4 h ARG 429 Cb 0.51 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 3is4 h ARG 429 CO -0.41 0.88 -0.39 1.96 -1.07 0.00 0.00 179.97 180.95 3is4 h GLN 430 N 0.19 0.00 0.00 0.04 4.20 -0.49 -2.52 115.11 116.53 3is4 h GLN 430 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3is4 h GLN 430 Cb 0.81 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.59 3is4 h GLN 430 CO 0.06 0.39 0.00 1.28 -0.67 0.00 0.00 178.83 179.89 3is4 n LEU 431 N -3.89 0.06 0.04 1.46 4.77 -0.48 -3.12 117.00 115.84 3is4 n LEU 431 Ca -0.01 0.51 0.04 0.00 -0.03 0.00 0.00 56.01 56.52 3is4 n LEU 431 Cb 0.44 -0.50 0.22 0.00 -2.33 0.00 0.00 43.42 41.25 3is4 n LEU 431 CO 0.38 -0.22 0.64 0.59 -1.33 0.00 0.00 177.39 177.45 3is4 n ASN 432 N -1.56 0.17 -1.13 -1.43 4.13 -0.95 -0.98 115.26 113.50 3is4 n ASN 432 Ca 0.04 0.57 0.11 0.00 1.68 0.00 0.00 54.58 56.98 3is4 n ASN 432 Cb 0.21 -0.59 0.24 0.00 -1.54 0.00 0.00 39.78 38.10 3is4 n ASN 432 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 3is4 n ILE 433 N -1.71 0.72 -3.97 2.41 -5.35 -1.18 -4.78 119.36 105.50 3is4 n ILE 433 Ca 0.00 -0.86 -0.35 0.00 -0.27 0.00 0.00 62.75 61.27 3is4 n ILE 433 Cb 0.06 0.77 -0.12 0.00 -1.74 0.00 0.00 39.64 38.61 3is4 n ILE 433 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 3is4 s THR 434 N -1.22 4.37 0.51 7.28 2.01 -0.15 -4.61 115.64 123.83 3is4 s THR 434 Ca 0.39 -0.17 -0.22 0.00 0.31 0.00 0.00 61.69 62.01 3is4 s THR 434 Cb 0.22 -3.00 -0.06 0.00 0.01 0.00 0.00 72.50 69.67 3is4 s THR 434 CO 0.29 0.41 1.24 0.00 -0.69 0.00 0.00 174.62 175.87 3is4 s GLN 435 N 0.98 3.43 0.00 4.92 1.03 -1.26 -3.76 119.66 124.99 3is4 s GLN 435 Ca 0.03 1.94 0.00 0.00 0.04 0.00 0.00 55.36 57.37 3is4 s GLN 435 Cb -0.14 -2.29 0.00 0.00 0.03 0.00 0.00 33.01 30.61 3is4 s GLN 435 CO 0.03 -0.87 0.00 0.41 -2.54 0.00 0.00 175.29 172.32 3is4 n GLY 436 N 0.55 0.44 3.38 2.60 0.00 0.16 -4.89 105.19 107.42 3is4 n GLY 436 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 3is4 n GLY 436 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3is4 s VAL 437 N -1.94 2.48 0.00 1.61 1.01 -1.25 -1.35 120.40 120.96 3is4 s VAL 437 Ca 0.00 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.10 3is4 s VAL 437 Cb 0.00 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.45 3is4 s VAL 437 CO 0.00 0.58 -0.19 -1.61 0.00 0.00 0.00 175.10 173.89 3is4 s GLU 438 N -0.61 1.43 -0.01 2.72 2.02 -0.03 -4.92 118.70 119.29 3is4 s GLU 438 Ca 0.09 -0.74 0.03 0.00 0.02 0.00 0.00 54.97 54.37 3is4 s GLU 438 Cb -0.11 -1.43 -0.03 0.00 0.10 0.00 0.00 34.13 32.66 3is4 s GLU 438 CO 0.00 0.38 -0.07 -1.12 0.02 0.00 0.00 175.26 174.47 3is4 s SER 439 N -0.68 4.60 -0.15 -0.19 0.01 -1.26 -0.32 113.70 115.71 3is4 s SER 439 Ca 0.07 -0.12 0.01 0.00 1.31 0.00 0.00 55.95 57.22 3is4 s SER 439 Cb -0.08 -1.08 0.02 0.00 0.21 0.00 0.00 66.02 65.09 3is4 s SER 439 CO 0.00 0.30 -0.19 -0.69 0.41 0.00 0.00 173.24 173.07 3is4 s VAL 440 N -0.95 1.91 0.03 3.43 1.01 0.65 -4.95 120.40 121.53 3is4 s VAL 440 Ca 0.16 -0.87 -0.30 0.00 0.00 0.00 0.00 61.98 60.97 3is4 s VAL 440 Cb -0.11 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 3is4 s VAL 440 CO 0.06 0.52 1.02 0.12 0.00 0.00 0.00 175.10 176.82 3is4 s PHE 441 N 1.14 3.63 -0.26 5.22 5.36 -1.26 -1.02 117.98 130.79 3is4 s PHE 441 Ca -0.00 1.63 0.02 0.00 -0.96 0.00 0.00 56.93 57.62 3is4 s PHE 441 Cb -0.14 -3.17 0.06 0.00 -0.34 0.00 0.00 43.02 39.42 3is4 s PHE 441 CO -0.08 -0.24 -0.09 0.12 -1.46 0.00 0.00 175.22 173.47 3is4 s PHE 442 N 0.87 3.24 -0.83 10.12 5.36 0.11 -4.91 117.98 131.93 3is4 s PHE 442 Ca 0.53 -2.19 -0.25 0.00 -0.96 0.00 0.00 56.93 54.05 3is4 s PHE 442 Cb -0.23 -1.96 0.04 0.00 -0.34 0.00 0.00 43.02 40.53 3is4 s PHE 442 CO 0.29 -0.86 1.31 0.34 -1.46 0.00 0.00 175.22 174.83 3is4 s ASP 443 N 1.14 6.29 0.33 6.13 -1.08 -1.26 -4.15 116.67 124.07 3is4 s ASP 443 Ca -0.07 -0.88 0.05 0.00 -0.52 0.00 0.00 52.55 51.13 3is4 s ASP 443 Cb -0.19 -2.55 0.58 0.00 -1.46 0.00 0.00 42.92 39.30 3is4 s ASP 443 CO -0.05 -1.67 1.83 0.00 0.52 0.00 0.00 175.17 175.80 3is4 h ALA 444 N 9.87 1.31 0.00 3.66 0.00 -1.85 0.11 119.26 132.36 3is4 h ALA 444 Ca -0.11 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 3is4 h ALA 444 Cb 1.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 3is4 h ALA 444 CO 1.31 0.46 -0.19 -0.44 0.00 0.00 0.00 179.25 180.40 3is4 h ASP 445 N 0.38 0.00 0.03 0.00 3.32 -1.89 0.10 116.42 118.37 3is4 h ASP 445 Ca 0.07 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.84 3is4 h ASP 445 Cb 0.48 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.00 3is4 h ASP 445 CO 0.03 0.19 -1.52 1.17 -1.72 0.00 0.00 179.24 177.39 3is4 n LYS 446 N -3.42 0.62 -0.00 3.56 4.81 -0.97 -4.70 118.16 118.06 3is4 n LYS 446 Ca -0.00 0.48 0.08 0.00 -0.87 0.00 0.00 58.31 58.00 3is4 n LYS 446 Cb 0.38 -1.73 -0.12 0.00 0.02 0.00 0.00 35.03 33.59 3is4 n LYS 446 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3is4 n LEU 447 N -4.17 0.44 0.00 3.14 4.77 0.33 -5.10 117.00 116.42 3is4 n LEU 447 Ca -0.33 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.37 3is4 n LEU 447 Cb 0.79 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.88 3is4 n LEU 447 CO 0.24 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 3is4 n GLY 448 N 1.45 2.86 0.07 -0.72 0.00 0.36 -4.80 105.19 104.40 3is4 n GLY 448 Ca 0.00 -1.97 0.10 0.00 0.00 0.00 0.00 46.02 44.15 3is4 n GLY 448 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3is4 n HIS 449 N -0.03 0.42 -3.86 1.61 8.25 -1.26 -4.43 115.22 115.91 3is4 n HIS 449 Ca 0.00 0.16 -0.24 0.00 -0.26 0.00 0.00 57.72 57.38 3is4 n HIS 449 Cb 0.00 -0.77 -0.00 0.00 1.12 0.00 0.00 29.99 30.34 3is4 n HIS 449 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3is4 n ASP 450 N -1.88 -0.80 -0.07 0.41 2.03 -1.26 -4.82 116.55 110.15 3is4 n ASP 450 Ca 0.03 -0.95 0.18 0.00 0.52 0.00 0.00 54.79 54.57 3is4 n ASP 450 Cb 0.20 -3.36 0.61 0.00 -0.72 0.00 0.00 41.12 37.85 3is4 n ASP 450 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 3is4 h GLU 451 N -1.85 0.17 -0.01 -0.67 9.09 -2.01 0.25 114.58 119.55 3is4 h GLU 451 Ca -0.63 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 58.77 3is4 h GLU 451 Cb 1.37 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 28.43 3is4 h GLU 451 CO 0.60 0.11 -0.04 0.41 0.05 0.00 0.00 179.01 180.14 3is4 n GLY 452 N -1.59 -0.57 3.71 1.06 0.00 -1.26 -4.94 105.19 101.60 3is4 n GLY 452 Ca 0.12 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3is4 n GLY 452 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3is4 n LYS 453 N -0.50 0.00 -0.26 1.61 4.01 0.86 -4.87 118.16 119.01 3is4 n LYS 453 Ca 0.19 0.00 -0.07 0.00 -0.51 0.00 0.00 58.31 57.92 3is4 n LYS 453 Cb 0.26 -3.15 0.05 0.00 -0.51 0.00 0.00 35.03 31.68 3is4 n LYS 453 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 3is4 h GLU 454 N 1.30 1.11 -0.42 1.97 3.07 -1.92 -1.38 114.58 118.31 3is4 h GLU 454 Ca 0.00 -0.24 -0.09 0.00 -0.50 0.00 0.00 59.36 58.53 3is4 h GLU 454 Cb 0.00 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.74 3is4 h GLU 454 CO 0.00 0.96 -0.08 0.45 -1.40 0.00 0.00 179.01 178.94 3is4 h HIS 455 N 1.05 0.89 -0.43 4.33 3.86 -1.89 -1.39 115.15 121.57 3is4 h HIS 455 Ca 0.23 -0.18 -0.13 0.00 -1.16 0.00 0.00 60.37 59.12 3is4 h HIS 455 Cb 0.31 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 3is4 h HIS 455 CO 0.03 0.91 -0.24 0.00 0.86 0.00 0.00 177.93 179.48 3is4 h ARG 456 N 0.63 0.92 -0.49 2.45 3.08 -1.88 -0.28 114.38 118.81 3is4 h ARG 456 Ca 0.11 -0.41 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 3is4 h ARG 456 Cb 0.60 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 3is4 h ARG 456 CO 0.04 1.07 0.28 0.28 -1.07 0.00 0.00 179.97 180.57 3is4 h VAL 457 N 0.74 1.16 -0.75 2.04 2.07 -1.25 -0.74 116.25 119.53 3is4 h VAL 457 Ca 0.09 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.23 3is4 h VAL 457 Cb 0.81 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3is4 h VAL 457 CO 0.07 0.17 0.47 0.00 0.02 0.00 0.00 177.57 178.29 3is4 h ALA 458 N 1.13 0.95 -0.98 1.67 0.00 -1.11 0.79 119.26 121.70 3is4 h ALA 458 Ca 0.17 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.07 3is4 h ALA 458 Cb 0.02 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 17.44 3is4 h ALA 458 CO -0.03 0.39 0.63 0.00 0.00 0.00 0.00 179.25 180.24 3is4 h ALA 459 N 1.25 1.34 0.41 0.00 0.00 -0.67 0.24 119.26 121.83 3is4 h ALA 459 Ca 0.27 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 3is4 h ALA 459 Cb -0.07 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.41 3is4 h ALA 459 CO -0.05 0.45 -0.20 0.78 0.00 0.00 0.00 179.25 180.23 3is4 h GLY 460 N 1.17 -0.58 0.64 0.00 0.00 -0.29 -2.31 103.07 101.70 3is4 h GLY 460 Ca 0.41 0.21 0.07 0.00 0.00 0.00 0.00 47.33 48.03 3is4 h GLY 460 CO -0.16 -0.21 0.43 -2.08 0.00 0.00 0.00 176.54 174.52 3is4 h VAL 461 N -0.82 0.97 -0.10 4.60 2.07 -0.79 -1.84 116.25 120.33 3is4 h VAL 461 Ca -0.06 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.20 3is4 h VAL 461 Cb 0.54 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 3is4 h VAL 461 CO 0.09 0.14 0.06 -0.08 0.02 0.00 0.00 177.57 177.81 3is4 h GLU 462 N 0.77 0.13 -0.57 1.57 4.57 -0.96 -0.64 114.58 119.46 3is4 h GLU 462 Ca 0.34 -0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.60 3is4 h GLU 462 Cb 0.23 -0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 28.73 3is4 h GLU 462 CO -0.20 0.11 0.21 0.35 -1.18 0.00 0.00 179.01 178.30 3is4 h PHE 463 N 0.11 0.36 -0.87 0.92 3.57 -1.15 0.33 116.94 120.22 3is4 h PHE 463 Ca 0.04 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.57 3is4 h PHE 463 Cb 0.01 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 3is4 h PHE 463 CO -0.06 0.10 0.57 0.00 -2.23 0.00 0.00 178.31 176.69 3is4 h ALA 464 N 1.39 1.38 -0.25 2.41 0.00 -0.98 -2.37 119.26 120.84 3is4 h ALA 464 Ca 0.28 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 3is4 h ALA 464 Cb 0.33 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3is4 h ALA 464 CO -0.29 0.58 -0.05 0.87 0.00 0.00 0.00 179.25 180.36 3is4 h LYS 465 N 1.18 0.48 0.00 0.00 1.57 -0.30 -1.12 116.57 118.38 3is4 h LYS 465 Ca 0.32 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3is4 h LYS 465 Cb -0.14 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 3is4 h LYS 465 CO -0.07 0.69 -0.01 0.66 -0.57 0.00 0.00 179.45 180.15 3is4 h SER 466 N 0.23 0.00 0.24 0.86 4.64 -0.64 -1.24 113.55 117.64 3is4 h SER 466 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3is4 h SER 466 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3is4 h SER 466 CO 0.02 0.01 -0.45 0.29 -0.87 0.00 0.00 176.83 175.83 3is4 n LYS 467 N -3.74 0.57 -0.85 4.77 4.76 -0.92 -4.95 118.16 117.79 3is4 n LYS 467 Ca -0.03 -0.38 0.00 0.00 -2.87 0.00 0.00 58.31 55.03 3is4 n LYS 467 Cb 0.09 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.79 3is4 n LYS 467 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3is4 n GLY 468 N 1.42 0.56 0.23 0.72 0.00 -0.47 -4.95 105.19 102.69 3is4 n GLY 468 Ca 0.09 -0.16 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 3is4 n GLY 468 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3is4 h TYR 469 N 0.00 1.01 -3.57 1.61 0.05 -1.43 -3.46 116.97 111.18 3is4 h TYR 469 Ca 0.00 -0.38 -0.43 0.00 0.05 0.00 0.00 58.73 57.97 3is4 h TYR 469 Cb 0.00 -0.18 -0.18 0.00 1.01 0.00 0.00 36.73 37.37 3is4 h TYR 469 CO 0.00 1.19 -0.76 0.14 -1.05 0.00 0.00 178.16 177.68 3is4 s VAL 470 N -4.02 1.38 0.34 -2.88 -7.23 -1.21 -4.71 120.40 102.06 3is4 s VAL 470 Ca -0.11 -1.72 0.06 0.00 -1.81 0.00 0.00 61.98 58.40 3is4 s VAL 470 Cb 0.09 -1.55 -0.03 0.00 0.56 0.00 0.00 36.38 35.45 3is4 s VAL 470 CO 0.88 -0.39 0.24 0.00 -0.31 0.00 0.00 175.10 175.51 3is4 s GLN 471 N -2.63 1.76 0.11 4.82 -2.07 -1.26 -4.39 119.66 115.99 3is4 s GLN 471 Ca 0.09 -2.03 -0.36 0.00 -1.82 0.00 0.00 55.36 51.25 3is4 s GLN 471 Cb -0.05 0.13 -0.16 0.00 -1.09 0.00 0.00 33.01 31.84 3is4 s GLN 471 CO 0.03 -0.60 1.38 2.41 -1.32 0.00 0.00 175.29 177.19 3is4 n THR 472 N -0.66 0.08 0.00 3.63 -1.04 -1.26 -1.85 114.28 113.18 3is4 n THR 472 Ca 0.04 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 3is4 n THR 472 Cb 0.63 -0.98 0.00 0.00 -1.82 0.00 0.00 70.33 68.16 3is4 n THR 472 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3is4 n GLY 473 N 2.66 1.79 3.84 3.41 0.00 -0.37 -5.01 105.19 111.51 3is4 n GLY 473 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 3is4 n GLY 473 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3is4 s ASP 474 N -1.98 6.24 0.13 1.61 1.01 -0.77 -4.79 116.67 118.12 3is4 s ASP 474 Ca 0.00 1.56 -0.10 0.00 0.71 0.00 0.00 52.55 54.73 3is4 s ASP 474 Cb 0.00 -2.50 -0.06 0.00 1.01 0.00 0.00 42.92 41.37 3is4 s ASP 474 CO 0.00 -0.86 0.45 -0.31 0.21 0.00 0.00 175.17 174.66 3is4 s TYR 475 N -2.82 3.54 -0.05 4.23 2.02 -1.26 -0.89 117.35 122.12 3is4 s TYR 475 Ca 0.58 0.82 0.01 0.00 -0.37 0.00 0.00 57.07 58.11 3is4 s TYR 475 Cb -0.12 -2.19 0.02 0.00 -0.40 0.00 0.00 41.96 39.28 3is4 s TYR 475 CO 0.42 0.45 -0.05 0.00 -1.57 0.00 0.00 175.55 174.79 3is4 s VAL 477 N 0.88 5.20 -0.09 0.00 1.01 -0.68 -0.40 120.40 126.32 3is4 s VAL 477 Ca -0.12 0.59 -0.01 0.00 0.00 0.00 0.00 61.98 62.45 3is4 s VAL 477 Cb -0.14 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 3is4 s VAL 477 CO 0.01 0.21 -0.05 -0.69 0.00 0.00 0.00 175.10 174.58 3is4 s VAL 478 N 1.70 3.88 -0.01 2.92 1.01 0.39 -0.79 120.40 129.50 3is4 s VAL 478 Ca 0.16 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.75 3is4 s VAL 478 Cb -0.15 -2.62 0.00 0.00 0.00 0.00 0.00 36.38 33.61 3is4 s VAL 478 CO 0.09 0.58 -0.04 -0.51 0.00 0.00 0.00 175.10 175.22 3is4 s ILE 479 N -0.61 0.33 0.32 2.22 -1.16 0.24 -1.03 121.20 121.52 3is4 s ILE 479 Ca 0.09 -0.13 -0.09 0.00 -0.51 0.00 0.00 60.65 60.01 3is4 s ILE 479 Cb -0.12 -0.31 0.04 0.00 0.61 0.00 0.00 42.46 42.68 3is4 s ILE 479 CO 0.02 0.12 0.58 0.00 -2.81 0.00 0.00 174.94 172.85 3is4 n HIS 480 N 3.28 -1.88 -1.03 3.50 1.44 -0.48 -1.09 115.22 118.96 3is4 n HIS 480 Ca -0.16 -1.72 0.00 0.00 -2.01 0.00 0.00 57.72 53.82 3is4 n HIS 480 Cb 0.56 0.68 0.00 0.00 0.12 0.00 0.00 29.99 31.35 3is4 n HIS 480 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3is4 n ALA 481 N -0.97 0.00 0.00 1.59 0.00 -1.26 -1.70 120.51 118.17 3is4 n ALA 481 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 3is4 n ALA 481 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 3is4 n ALA 481 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 3is4 n TYR 488 N 0.00 0.00 -3.38 0.00 4.11 -1.26 -4.82 117.16 111.81 3is4 n TYR 488 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 57.90 57.92 3is4 n TYR 488 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 39.34 39.30 3is4 n TYR 488 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 3is4 s ALA 489 N -0.16 -2.82 0.00 -3.48 0.00 -1.26 -4.72 121.76 109.33 3is4 s ALA 489 Ca 0.00 1.99 0.00 0.00 0.00 0.00 0.00 51.96 53.95 3is4 s ALA 489 Cb 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 23.12 21.04 3is4 s ALA 489 CO 0.00 -0.87 0.08 0.27 0.00 0.00 0.00 175.76 175.24 3is4 n ASN 490 N 4.64 0.00 -3.88 0.00 2.04 -0.87 -4.18 115.26 113.01 3is4 n ASN 490 Ca -0.10 -1.00 -0.18 0.00 -0.44 0.00 0.00 54.58 52.86 3is4 n ASN 490 Cb 0.54 0.00 -0.16 0.00 -2.53 0.00 0.00 39.78 37.63 3is4 n ASN 490 CO 0.00 0.00 0.00 -1.58 -0.44 0.00 0.00 177.26 175.24 3is4 s GLN 491 N 0.00 0.59 0.05 -3.83 0.74 -0.69 -5.01 119.66 111.51 3is4 s GLN 491 Ca 0.00 -0.07 0.05 0.00 0.05 0.00 0.00 55.36 55.39 3is4 s GLN 491 Cb 0.00 -0.64 -0.02 0.00 1.10 0.00 0.00 33.01 33.45 3is4 s GLN 491 CO 0.00 -0.06 -0.14 0.99 -0.55 0.00 0.00 175.29 175.53 3is4 s THR 492 N 0.74 1.08 0.00 -0.34 2.01 -1.26 -1.38 115.64 116.49 3is4 s THR 492 Ca -0.09 -1.07 -0.00 0.00 0.31 0.00 0.00 61.69 60.84 3is4 s THR 492 Cb -0.12 -1.00 -0.00 0.00 0.01 0.00 0.00 72.50 71.39 3is4 s THR 492 CO -0.00 -0.07 -0.00 -0.13 -0.69 0.00 0.00 174.62 173.73 3is4 s ARG 493 N -1.30 0.03 -0.39 4.92 0.52 -0.19 -4.99 118.95 117.54 3is4 s ARG 493 Ca 0.00 -0.05 -0.13 0.00 -0.52 0.00 0.00 55.73 55.03 3is4 s ARG 493 Cb -0.08 0.01 0.03 0.00 0.52 0.00 0.00 34.95 35.42 3is4 s ARG 493 CO 0.01 -0.00 0.25 0.42 0.02 0.00 0.00 175.30 176.00 3is4 s ILE 494 N -0.12 4.89 -0.19 1.52 1.01 -1.26 -0.46 121.20 126.57 3is4 s ILE 494 Ca -0.01 -0.79 -0.08 0.00 0.00 0.00 0.00 60.65 59.76 3is4 s ILE 494 Cb -0.01 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 3is4 s ILE 494 CO -0.00 -0.29 0.08 -0.22 0.00 0.00 0.00 174.94 174.52 3is4 s LEU 495 N 1.61 3.92 -0.19 2.97 0.20 0.46 -4.94 118.68 122.72 3is4 s LEU 495 Ca 0.03 0.12 -0.27 0.00 0.69 0.00 0.00 54.13 54.70 3is4 s LEU 495 Cb -0.19 -2.00 -0.00 0.00 -0.43 0.00 0.00 46.19 43.56 3is4 s LEU 495 CO 0.08 0.17 0.93 -0.22 -0.29 0.00 0.00 176.35 177.02 3is4 s LEU 496 N 0.42 4.15 0.06 -0.68 2.96 -1.26 -0.68 118.68 123.65 3is4 s LEU 496 Ca 0.05 1.28 -0.31 0.00 -0.22 0.00 0.00 54.13 54.93 3is4 s LEU 496 Cb -0.12 -3.38 -0.06 0.00 0.50 0.00 0.00 46.19 43.13 3is4 s LEU 496 CO -0.00 -0.51 1.20 -0.69 -1.32 0.00 0.00 176.35 175.02 3is4 s VAL 497 N 2.58 4.04 -2.49 1.68 1.01 -0.07 -4.95 120.40 122.20 3is4 s VAL 497 Ca 0.41 1.46 0.28 0.00 0.00 0.00 0.00 61.98 64.14 3is4 s VAL 497 Cb -0.16 -3.94 0.56 0.00 0.00 0.00 0.00 36.38 32.84 3is4 s VAL 497 CO 0.11 0.11 1.76 -0.62 0.00 0.00 0.00 175.10 176.45