#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d5r s SER 3 N 0.00 5.03 0.56 1.61 0.01 -1.26 -5.09 113.70 114.57 3d5r s SER 3 Ca 0.00 -0.74 -0.21 0.00 1.31 0.00 0.00 55.95 56.31 3d5r s SER 3 Cb 0.00 -0.61 -0.04 0.00 0.21 0.00 0.00 66.02 65.58 3d5r s SER 3 CO 0.00 -0.61 1.35 -0.13 0.41 0.00 0.00 173.24 174.26 3d5r s ARG 4 N -4.10 3.06 0.76 12.44 3.00 -1.26 -4.99 118.95 127.86 3d5r s ARG 4 Ca 0.47 2.21 -0.11 0.00 0.00 0.00 0.00 55.73 58.29 3d5r s ARG 4 Cb -0.03 -2.20 0.05 0.00 0.00 0.00 0.00 34.95 32.77 3d5r s ARG 4 CO 0.27 -1.25 1.10 0.45 0.00 0.00 0.00 175.30 175.87 3d5r s SER 5 N -1.02 4.86 -0.11 0.23 0.15 -1.26 -5.01 113.70 111.54 3d5r s SER 5 Ca 0.73 1.25 -0.28 0.00 0.70 0.00 0.00 55.95 58.36 3d5r s SER 5 Cb -0.40 -2.01 -0.02 0.00 -1.71 0.00 0.00 66.02 61.88 3d5r s SER 5 CO 0.47 -1.73 0.92 -0.89 1.20 0.00 0.00 173.24 173.20 3d5r s THR 6 N -3.23 4.85 -0.12 6.45 2.01 -1.26 -4.97 115.64 119.38 3d5r s THR 6 Ca 0.60 1.86 -0.36 0.00 0.31 0.00 0.00 61.69 64.10 3d5r s THR 6 Cb -0.13 -4.23 -0.13 0.00 0.01 0.00 0.00 72.50 68.02 3d5r s THR 6 CO 0.53 0.05 1.81 -0.67 -0.69 0.00 0.00 174.62 175.65 3d5r n ASP 7 N 4.82 3.07 -0.25 3.53 2.03 -1.26 -4.84 116.55 123.65 3d5r n ASP 7 Ca 0.06 1.01 0.24 0.00 0.52 0.00 0.00 54.79 56.63 3d5r n ASP 7 Cb 0.49 -1.31 0.59 0.00 -0.72 0.00 0.00 41.12 40.18 3d5r n ASP 7 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3d5r h ALA 8 N 8.28 2.48 0.00 -1.67 0.00 -1.93 0.74 119.26 127.16 3d5r h ALA 8 Ca -0.48 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3d5r h ALA 8 Cb 1.29 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 3d5r h ALA 8 CO 0.94 -0.79 -0.03 1.49 0.00 0.00 0.00 179.25 180.86 3d5r h GLU 9 N 0.25 0.00 0.00 0.00 4.57 -1.93 0.53 114.58 117.99 3d5r h GLU 9 Ca 0.50 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.68 3d5r h GLU 9 Cb 1.51 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.10 3d5r h GLU 9 CO -0.14 0.03 0.00 0.54 -1.18 0.00 0.00 179.01 178.25 3d5r n ARG 10 N -4.04 0.05 -0.08 1.92 5.12 0.25 -3.40 116.66 116.49 3d5r n ARG 10 Ca -0.03 0.15 0.06 0.00 -1.93 0.00 0.00 57.85 56.10 3d5r n ARG 10 Cb 0.11 -1.57 0.09 0.00 -1.16 0.00 0.00 32.46 29.93 3d5r n ARG 10 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3d5r n LEU 11 N -1.66 2.35 0.26 0.55 4.77 0.17 -4.65 117.00 118.80 3d5r n LEU 11 Ca 0.05 -1.43 0.15 0.00 -0.03 0.00 0.00 56.01 54.75 3d5r n LEU 11 Cb 0.28 -0.10 0.84 0.00 -2.33 0.00 0.00 43.42 42.11 3d5r n LEU 11 CO 0.22 0.52 1.12 0.07 -1.33 0.00 0.00 177.39 178.00 3d5r h LYS 12 N 2.11 0.00 0.00 3.23 2.10 -1.56 0.87 116.57 123.32 3d5r h LYS 12 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3d5r h LYS 12 Cb 0.58 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.91 3d5r h LYS 12 CO 0.00 0.00 0.00 -2.39 -2.00 0.00 0.00 179.45 175.06 3d5r n HIS 13 N -3.97 0.00 1.16 0.07 1.44 -1.26 -3.10 115.22 109.55 3d5r n HIS 13 Ca -0.01 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.83 3d5r n HIS 13 Cb 0.16 -0.27 0.49 0.00 0.12 0.00 0.00 29.99 30.49 3d5r n HIS 13 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3d5r n LEU 14 N -1.27 0.38 -4.47 2.39 4.77 0.30 -4.60 117.00 114.50 3d5r n LEU 14 Ca 0.12 0.13 -0.43 0.00 -0.03 0.00 0.00 56.01 55.80 3d5r n LEU 14 Cb 0.19 -0.29 -0.04 0.00 -2.33 0.00 0.00 43.42 40.96 3d5r n LEU 14 CO 0.19 0.08 0.86 -0.63 -1.33 0.00 0.00 177.39 176.56 3d5r s ILE 15 N -2.79 4.22 0.20 -0.08 1.09 -1.18 -1.70 121.20 120.96 3d5r s ILE 15 Ca 0.19 -0.29 0.11 0.00 -1.10 0.00 0.00 60.65 59.56 3d5r s ILE 15 Cb 0.19 -4.74 -0.04 0.00 -1.06 0.00 0.00 42.46 36.80 3d5r s ILE 15 CO 0.56 -1.55 -0.23 -0.69 -0.10 0.00 0.00 174.94 172.94 3d5r s VAL 16 N 4.33 2.42 -0.22 2.92 1.01 -1.26 -5.01 120.40 124.59 3d5r s VAL 16 Ca 0.26 -2.02 -0.22 0.00 0.00 0.00 0.00 61.98 60.00 3d5r s VAL 16 Cb -0.14 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.05 3d5r s VAL 16 CO 0.10 -0.13 0.69 -0.89 0.00 0.00 0.00 175.10 174.86 3d5r s THR 17 N -1.70 4.96 0.16 3.92 2.01 -1.26 -4.82 115.64 118.90 3d5r s THR 17 Ca 0.21 1.28 -0.30 0.00 0.31 0.00 0.00 61.69 63.19 3d5r s THR 17 Cb -0.08 -3.99 -0.07 0.00 0.01 0.00 0.00 72.50 68.37 3d5r s THR 17 CO 0.10 0.04 1.03 -2.16 -0.69 0.00 0.00 174.62 172.94 3d5r s PRO 18 N 2.33 4.66 0.26 4.92 0.04 -1.26 -4.88 135.00 141.08 3d5r s PRO 18 Ca 0.30 1.59 -0.14 0.00 0.04 0.00 0.00 61.00 62.79 3d5r s PRO 18 Cb -0.16 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.07 3d5r s PRO 18 CO 0.09 0.18 0.53 -1.54 0.04 0.00 0.00 177.00 176.30 3d5r s SER 19 N -0.18 -0.06 0.00 6.66 1.04 -1.26 -4.89 113.70 115.00 3d5r s SER 19 Ca 0.47 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.99 3d5r s SER 19 Cb -0.27 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.48 3d5r s SER 19 CO 0.33 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.95 3d5r n GLY 20 N -0.41 -1.77 0.00 7.32 0.00 -1.26 -2.56 105.19 106.51 3d5r n GLY 20 Ca -0.02 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.07 3d5r n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d5r n ALA 21 N 0.07 0.00 -0.19 4.61 0.00 -1.26 -4.44 120.51 119.31 3d5r n ALA 21 Ca 0.00 0.00 0.28 0.00 0.00 0.00 0.00 53.44 53.72 3d5r n ALA 21 Cb 0.00 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.16 3d5r n ALA 21 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3d5r h GLY 22 N 0.00 0.09 0.02 0.00 0.00 -0.95 -0.48 103.07 101.75 3d5r h GLY 22 Ca 0.00 -0.02 -0.36 0.00 0.00 0.00 0.00 47.33 46.95 3d5r h GLY 22 CO 0.00 -0.00 -1.99 1.18 0.00 0.00 0.00 176.54 175.73 3d5r n GLU 23 N -4.29 0.59 -0.09 4.80 1.02 -1.26 -4.22 120.64 117.19 3d5r n GLU 23 Ca 0.19 0.39 0.05 0.00 -0.02 0.00 0.00 57.16 57.77 3d5r n GLU 23 Cb 0.94 -1.61 0.38 0.00 -0.02 0.00 0.00 31.44 31.14 3d5r n GLU 23 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 3d5r h GLN 24 N -0.93 0.65 -0.62 3.49 5.75 -1.80 -1.17 115.11 120.48 3d5r h GLN 24 Ca -0.54 -0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 57.87 3d5r h GLN 24 Cb 1.51 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 29.89 3d5r h GLN 24 CO -0.31 0.43 0.18 -0.97 -2.65 0.00 0.00 178.83 175.51 3d5r h ASN 25 N 0.67 0.89 0.63 -0.69 -1.24 -0.80 -1.60 115.58 113.44 3d5r h ASN 25 Ca 0.22 -0.16 -0.14 0.00 0.71 0.00 0.00 56.30 56.93 3d5r h ASN 25 Cb 0.05 -0.23 -0.02 0.00 0.73 0.00 0.00 38.32 38.85 3d5r h ASN 25 CO -0.06 0.85 -0.66 0.24 -1.29 0.00 0.00 177.43 176.51 3d5r h MET 26 N 0.92 0.02 -0.38 6.67 2.86 -1.42 -0.24 114.93 123.36 3d5r h MET 26 Ca 0.20 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.75 3d5r h MET 26 Cb 0.29 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 3d5r h MET 26 CO -0.01 0.67 -0.07 0.82 1.06 0.00 0.00 176.91 179.39 3d5r h ILE 27 N 0.02 1.24 0.10 -1.22 2.04 -0.71 -1.20 117.51 117.76 3d5r h ILE 27 Ca -0.01 -1.02 -0.27 0.00 1.00 0.00 0.00 64.86 64.56 3d5r h ILE 27 Cb 1.17 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 3d5r h ILE 27 CO 0.09 0.34 -1.29 1.23 0.00 0.00 0.00 178.15 178.52 3d5r h GLY 28 N 0.94 0.23 1.50 5.37 0.00 -1.07 -3.33 103.07 106.71 3d5r h GLY 28 Ca 0.11 -0.59 -0.10 0.00 0.00 0.00 0.00 47.33 46.76 3d5r h GLY 28 CO 0.03 0.52 -0.21 1.98 0.00 0.00 0.00 176.54 178.86 3d5r h MET 29 N 0.06 0.59 0.05 4.80 -1.53 -0.86 -3.35 114.93 114.68 3d5r h MET 29 Ca -0.14 -0.21 0.01 0.00 -3.44 0.00 0.00 59.70 55.91 3d5r h MET 29 Cb 1.95 -0.04 -0.04 0.00 -0.55 0.00 0.00 31.60 32.92 3d5r h MET 29 CO 0.17 0.76 -0.44 1.15 0.14 0.00 0.00 176.91 178.70 3d5r h THR 30 N 0.52 0.00 -0.80 -0.77 2.02 -1.33 -1.75 112.91 110.81 3d5r h THR 30 Ca 0.08 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.36 3d5r h THR 30 Cb 0.65 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.99 3d5r h THR 30 CO 0.05 0.00 0.44 1.55 0.37 0.00 0.00 175.52 177.93 3d5r h PRO 31 N -0.58 0.72 -0.28 6.66 0.13 -1.75 -1.42 132.00 135.47 3d5r h PRO 31 Ca 0.00 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.06 3d5r h PRO 31 Cb 0.61 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.56 3d5r h PRO 31 CO -0.26 0.47 0.05 1.15 -0.23 0.00 0.00 178.00 179.18 3d5r h THR 32 N 0.74 1.23 -0.10 1.56 2.02 -1.21 0.11 112.91 117.26 3d5r h THR 32 Ca 0.39 -0.79 -0.00 0.00 0.77 0.00 0.00 66.41 66.78 3d5r h THR 32 Cb 0.37 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 3d5r h THR 32 CO -0.26 0.26 0.06 0.58 0.37 0.00 0.00 175.52 176.53 3d5r h VAL 33 N 0.29 1.06 -0.22 3.16 2.07 -1.01 -1.99 116.25 119.59 3d5r h VAL 33 Ca 0.09 -0.14 -0.12 0.00 0.82 0.00 0.00 66.70 67.34 3d5r h VAL 33 Cb 0.34 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 3d5r h VAL 33 CO 0.01 0.05 -0.38 -0.29 0.02 0.00 0.00 177.57 176.98 3d5r h ILE 34 N 0.10 1.30 -0.03 4.57 6.09 -1.17 -1.11 117.51 127.25 3d5r h ILE 34 Ca 0.03 -1.51 -0.00 0.00 -1.37 0.00 0.00 64.86 62.01 3d5r h ILE 34 Cb 0.03 1.54 -0.00 0.00 0.47 0.00 0.00 36.82 38.86 3d5r h ILE 34 CO -0.01 0.47 0.02 0.00 -3.07 0.00 0.00 178.15 175.56 3d5r h ALA 35 N 1.18 0.04 -0.43 0.18 0.00 -0.65 0.83 119.26 120.42 3d5r h ALA 35 Ca 0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d5r h ALA 35 Cb 0.85 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3d5r h ALA 35 CO 0.07 -0.42 0.25 0.28 0.00 0.00 0.00 179.25 179.43 3d5r h VAL 36 N -0.03 1.14 -0.48 0.00 2.07 -1.25 0.13 116.25 117.83 3d5r h VAL 36 Ca 0.01 -0.32 0.09 0.00 0.82 0.00 0.00 66.70 67.30 3d5r h VAL 36 Cb 0.07 0.58 -0.08 0.00 -1.52 0.00 0.00 31.29 30.35 3d5r h VAL 36 CO -0.00 0.14 0.03 -0.74 0.02 0.00 0.00 177.57 177.01 3d5r h HIS 37 N 0.56 0.02 -0.30 1.57 6.17 -0.88 0.21 115.15 122.50 3d5r h HIS 37 Ca 0.15 0.03 -0.10 0.00 0.71 0.00 0.00 60.37 61.17 3d5r h HIS 37 Cb 0.00 0.06 -0.01 0.00 2.52 0.00 0.00 27.41 29.99 3d5r h HIS 37 CO -0.03 -0.08 -0.20 -0.92 0.71 0.00 0.00 177.93 177.41 3d5r h TYR 38 N 0.14 0.78 -0.11 5.26 3.20 -0.40 -2.22 116.97 123.63 3d5r h TYR 38 Ca 0.24 -0.21 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 3d5r h TYR 38 Cb 0.35 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 3d5r h TYR 38 CO -0.28 0.92 -0.27 -0.07 -1.64 0.00 0.00 178.16 176.82 3d5r h LEU 39 N 0.41 0.19 0.08 2.82 3.38 -0.36 -1.17 115.31 120.66 3d5r h LEU 39 Ca 0.06 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3d5r h LEU 39 Cb 0.75 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3d5r h LEU 39 CO 0.06 0.47 -0.04 0.44 0.09 0.00 0.00 178.44 179.45 3d5r h ASP 40 N 0.17 -0.09 -0.57 -0.43 5.19 -0.51 -0.89 116.42 119.30 3d5r h ASP 40 Ca 0.03 -0.29 -0.05 0.00 -0.62 0.00 0.00 57.03 56.09 3d5r h ASP 40 Cb 0.58 0.02 -0.03 0.00 0.18 0.00 0.00 39.33 40.09 3d5r h ASP 40 CO 0.04 0.25 0.18 -0.08 -3.12 0.00 0.00 179.24 176.51 3d5r h GLU 41 N -0.44 0.93 -0.22 3.56 4.22 -1.20 -2.24 114.58 119.18 3d5r h GLU 41 Ca -0.01 -0.18 0.00 0.00 0.08 0.00 0.00 59.36 59.25 3d5r h GLU 41 Cb 0.38 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3d5r h GLU 41 CO 0.02 0.81 0.00 0.25 -2.18 0.00 0.00 179.01 177.90 3d5r n THR 42 N -4.27 0.28 -3.87 0.32 -2.24 -0.46 -4.89 114.28 99.15 3d5r n THR 42 Ca 0.05 -0.43 -0.38 0.00 -2.27 0.00 0.00 64.05 61.01 3d5r n THR 42 Cb 0.22 0.48 0.03 0.00 -2.10 0.00 0.00 70.33 68.96 3d5r n THR 42 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3d5r n GLU 43 N 0.56 -0.76 -0.18 -0.78 1.02 -0.40 -4.89 120.64 115.21 3d5r n GLU 43 Ca 0.16 0.30 0.05 0.00 -0.02 0.00 0.00 57.16 57.65 3d5r n GLU 43 Cb 0.38 -3.31 0.14 0.00 -0.02 0.00 0.00 31.44 28.64 3d5r n GLU 43 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3d5r n GLN 44 N -4.51 2.87 -0.13 3.49 6.02 -0.81 -4.64 117.38 119.66 3d5r n GLN 44 Ca -0.11 -2.07 -0.12 0.00 -0.01 0.00 0.00 57.00 54.69 3d5r n GLN 44 Cb 0.58 -1.30 -0.02 0.00 1.02 0.00 0.00 30.24 30.52 3d5r n GLN 44 CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 3d5r h TRP 45 N 1.68 0.95 0.61 1.08 4.06 -1.91 -3.05 115.95 119.38 3d5r h TRP 45 Ca 0.00 -0.24 -0.02 0.00 2.06 0.00 0.00 58.89 60.69 3d5r h TRP 45 Cb 0.78 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 28.72 3d5r h TRP 45 CO 0.22 1.00 -0.40 0.93 -3.56 0.00 0.00 178.44 176.64 3d5r h GLU 46 N 0.64 -0.92 -2.01 0.49 5.08 -1.91 1.17 114.58 117.11 3d5r h GLU 46 Ca 0.09 0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.40 3d5r h GLU 46 Cb 0.75 0.21 -0.04 0.00 0.50 0.00 0.00 28.75 30.17 3d5r h GLU 46 CO 0.06 -0.62 -0.23 1.63 -1.00 0.00 0.00 179.01 178.86 3d5r n LYS 47 N -5.53 1.57 0.00 2.33 5.02 -1.22 -3.57 118.16 116.77 3d5r n LYS 47 Ca -0.13 -0.58 0.00 0.00 -2.02 0.00 0.00 58.31 55.58 3d5r n LYS 47 Cb 0.42 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 3d5r n LYS 47 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3d5r n PHE 48 N 2.09 0.00 0.00 2.13 7.35 -0.74 -4.97 117.46 123.32 3d5r n PHE 48 Ca 0.25 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.94 3d5r n PHE 48 Cb 0.74 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.57 3d5r n PHE 48 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3d5r n GLY 49 N -0.26 0.28 0.41 7.13 0.00 0.40 -4.95 105.19 108.20 3d5r n GLY 49 Ca 0.00 -0.22 0.21 0.00 0.00 0.00 0.00 46.02 46.01 3d5r n GLY 49 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3d5r h LEU 50 N 0.00 0.00 0.00 0.99 6.46 -1.64 0.37 115.31 121.49 3d5r h LEU 50 Ca 0.00 0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.69 3d5r h LEU 50 Cb 0.00 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 39.92 3d5r h LEU 50 CO 0.00 0.00 -0.35 1.05 -0.62 0.00 0.00 178.44 178.52 3d5r h GLU 51 N 0.00 0.00 0.00 1.25 -0.00 -1.95 -3.15 114.58 110.73 3d5r h GLU 51 Ca 0.23 0.00 -0.04 0.00 -0.00 0.00 0.00 59.36 59.54 3d5r h GLU 51 Cb 1.41 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 30.16 3d5r h GLU 51 CO -0.00 0.35 -0.20 0.87 -0.00 0.00 0.00 179.01 180.02 3d5r h LYS 52 N 0.00 0.00 -0.12 1.06 1.57 -0.62 -2.94 116.57 115.52 3d5r h LYS 52 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3d5r h LYS 52 Cb 1.27 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.57 3d5r h LYS 52 CO 0.05 0.20 0.04 -0.09 -0.57 0.00 0.00 179.45 179.08 3d5r h ARG 53 N 0.00 0.19 -0.79 3.15 2.43 -1.58 -0.08 114.38 117.70 3d5r h ARG 53 Ca -0.00 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.18 3d5r h ARG 53 Cb 0.50 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.98 3d5r h ARG 53 CO 0.03 0.30 0.52 0.37 -1.51 0.00 0.00 179.97 179.68 3d5r h GLN 54 N 0.03 0.91 -0.36 0.20 5.75 -1.67 0.22 115.11 120.20 3d5r h GLN 54 Ca 0.04 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.46 3d5r h GLN 54 Cb 0.19 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.52 3d5r h GLN 54 CO -0.00 0.60 0.14 0.78 -2.65 0.00 0.00 178.83 177.69 3d5r h GLY 55 N 0.93 0.57 1.00 2.39 0.00 -1.36 -0.21 103.07 106.40 3d5r h GLY 55 Ca 0.32 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 3d5r h GLY 55 CO -0.10 0.30 0.41 0.00 0.00 0.00 0.00 176.54 177.15 3d5r h ALA 56 N 0.98 0.87 -0.86 3.60 0.00 0.42 -1.48 119.26 122.80 3d5r h ALA 56 Ca 0.12 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3d5r h ALA 56 Cb 0.20 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 3d5r h ALA 56 CO -0.01 0.35 0.57 -0.07 0.00 0.00 0.00 179.25 180.08 3d5r h LEU 57 N 0.93 0.94 -0.98 0.00 4.07 -0.28 0.40 115.31 120.39 3d5r h LEU 57 Ca 0.25 -0.01 -0.06 0.00 0.08 0.00 0.00 57.88 58.13 3d5r h LEU 57 Cb -0.03 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 41.47 3d5r h LEU 57 CO -0.05 0.65 0.08 -0.08 -1.08 0.00 0.00 178.44 177.97 3d5r h GLU 58 N 1.09 0.82 -0.09 1.13 4.57 -0.08 -0.80 114.58 121.22 3d5r h GLU 58 Ca 0.33 -0.19 -0.15 0.00 -1.18 0.00 0.00 59.36 58.18 3d5r h GLU 58 Cb -0.01 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.45 3d5r h GLU 58 CO -0.09 0.78 -0.60 -0.07 -1.18 0.00 0.00 179.01 177.85 3d5r h LEU 59 N 0.78 0.35 -0.30 1.64 3.38 -0.17 -1.73 115.31 119.26 3d5r h LEU 59 Ca 0.17 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 3d5r h LEU 59 Cb 0.36 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3d5r h LEU 59 CO 0.01 0.86 -0.02 0.40 0.09 0.00 0.00 178.44 179.78 3d5r h ILE 60 N 0.23 1.26 -0.79 1.22 1.08 -0.45 0.25 117.51 120.31 3d5r h ILE 60 Ca -0.00 -0.99 0.02 0.00 -0.39 0.00 0.00 64.86 63.49 3d5r h ILE 60 Cb 1.11 1.31 -0.04 0.00 -3.07 0.00 0.00 36.82 36.12 3d5r h ILE 60 CO 0.10 0.32 0.52 0.11 -0.69 0.00 0.00 178.15 178.51 3d5r h LYS 61 N 0.34 1.01 -0.76 2.37 1.57 -1.09 0.70 116.57 120.71 3d5r h LYS 61 Ca 0.08 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3d5r h LYS 61 Cb 0.47 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 3d5r h LYS 61 CO 0.02 0.67 0.46 -0.22 -0.57 0.00 0.00 179.45 179.81 3d5r h LYS 62 N 1.04 1.03 -0.52 3.15 3.64 -0.98 -0.94 116.57 123.00 3d5r h LYS 62 Ca 0.30 -0.09 -0.10 0.00 -1.27 0.00 0.00 60.65 59.48 3d5r h LYS 62 Cb -0.07 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.51 3d5r h LYS 62 CO -0.08 0.73 -0.08 0.78 -2.27 0.00 0.00 179.45 178.52 3d5r h GLY 63 N 1.04 1.05 0.96 5.01 0.00 -0.02 -2.42 103.07 108.68 3d5r h GLY 63 Ca 0.27 -0.84 -0.02 0.00 0.00 0.00 0.00 47.33 46.75 3d5r h GLY 63 CO -0.05 0.76 -0.16 -1.82 0.00 0.00 0.00 176.54 175.27 3d5r h TYR 64 N 0.83 -0.42 -0.46 5.60 3.20 -0.46 -0.37 116.97 124.90 3d5r h TYR 64 Ca 0.14 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.02 3d5r h TYR 64 Cb 0.64 0.14 -0.03 0.00 1.54 0.00 0.00 36.73 39.02 3d5r h TYR 64 CO 0.05 -0.23 0.27 1.15 -1.64 0.00 0.00 178.16 177.76 3d5r h THR 65 N -0.50 1.05 -0.45 1.81 2.02 -1.21 -1.74 112.91 113.89 3d5r h THR 65 Ca -0.05 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 3d5r h THR 65 Cb 0.38 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 3d5r h THR 65 CO 0.08 0.10 0.24 1.56 0.37 0.00 0.00 175.52 177.87 3d5r h GLN 66 N 0.55 0.62 -0.17 6.66 4.20 -1.35 -1.75 115.11 123.88 3d5r h GLN 66 Ca 0.18 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.74 3d5r h GLN 66 Cb 0.01 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 3d5r h GLN 66 CO -0.08 0.47 -0.32 0.37 -0.67 0.00 0.00 178.83 178.59 3d5r h GLN 67 N 0.63 0.33 0.00 1.46 5.75 -0.21 -2.52 115.11 120.56 3d5r h GLN 67 Ca 0.16 -0.14 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 3d5r h GLN 67 Cb 0.03 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.57 3d5r h GLN 67 CO -0.03 0.62 -0.01 -0.07 -2.65 0.00 0.00 178.83 176.70 3d5r h LEU 68 N 0.29 0.00 -0.59 -2.39 3.38 -0.65 -0.01 115.31 115.34 3d5r h LEU 68 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3d5r h LEU 68 Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3d5r h LEU 68 CO 0.05 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.59 3d5r n ALA 69 N -2.28 1.50 -0.11 1.53 0.00 -0.95 -2.02 120.51 118.19 3d5r n ALA 69 Ca -0.03 0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.53 3d5r n ALA 69 Cb 0.09 -1.30 0.14 0.00 0.00 0.00 0.00 19.45 18.38 3d5r n ALA 69 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3d5r n PHE 70 N -2.00 0.42 -2.52 0.00 3.72 -0.02 -4.77 117.46 112.29 3d5r n PHE 70 Ca 0.02 -0.45 -0.43 0.00 -0.05 0.00 0.00 57.45 56.54 3d5r n PHE 70 Cb 0.16 -0.02 -0.02 0.00 -0.94 0.00 0.00 39.48 38.66 3d5r n PHE 70 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 3d5r s ARG 71 N -0.99 4.28 0.58 -1.08 3.52 -0.86 -3.98 118.95 120.42 3d5r s ARG 71 Ca 0.22 1.55 -0.07 0.00 -0.13 0.00 0.00 55.73 57.31 3d5r s ARG 71 Cb 0.12 -3.67 -0.01 0.00 -1.56 0.00 0.00 34.95 29.83 3d5r s ARG 71 CO 0.16 -0.60 0.91 -0.65 -0.81 0.00 0.00 175.30 174.31 3d5r s GLN 72 N 3.02 3.16 0.55 5.12 -0.21 0.33 -4.92 119.66 126.71 3d5r s GLN 72 Ca 0.51 0.19 0.33 0.00 0.02 0.00 0.00 55.36 56.41 3d5r s GLN 72 Cb -0.20 -2.25 1.48 0.00 1.00 0.00 0.00 33.01 33.04 3d5r s GLN 72 CO 0.14 -0.58 1.83 -1.35 -2.12 0.00 0.00 175.29 173.21 3d5r h PRO 73 N -0.13 0.00 0.00 2.91 0.11 -1.93 0.32 132.00 133.28 3d5r h PRO 73 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3d5r h PRO 73 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3d5r h PRO 73 CO 0.61 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.27 3d5r n SER 74 N -4.07 0.30 0.00 -2.05 3.41 -1.26 -4.89 113.62 105.07 3d5r n SER 74 Ca 0.19 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.33 3d5r n SER 74 Cb 1.04 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 3d5r n SER 74 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3d5r n SER 75 N -1.79 -0.09 -4.93 4.04 7.64 0.11 -4.73 113.62 113.86 3d5r n SER 75 Ca 0.06 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.69 3d5r n SER 75 Cb 0.36 -0.02 0.06 0.00 -1.01 0.00 0.00 64.21 63.60 3d5r n SER 75 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3d5r s ALA 76 N -2.73 3.30 0.14 -0.43 0.00 -1.26 -3.93 121.76 116.85 3d5r s ALA 76 Ca 0.00 -0.95 0.08 0.00 0.00 0.00 0.00 51.96 51.09 3d5r s ALA 76 Cb 0.00 -2.52 -0.04 0.00 0.00 0.00 0.00 23.12 20.56 3d5r s ALA 76 CO 0.00 -1.12 -0.17 -0.06 0.00 0.00 0.00 175.76 174.41 3d5r s PHE 77 N -3.12 1.68 0.23 0.00 0.40 -1.26 -0.52 117.98 115.39 3d5r s PHE 77 Ca 0.58 -0.49 -0.20 0.00 -0.60 0.00 0.00 56.93 56.23 3d5r s PHE 77 Cb -0.11 -0.86 0.03 0.00 0.51 0.00 0.00 43.02 42.59 3d5r s PHE 77 CO 0.44 0.25 0.61 0.00 0.70 0.00 0.00 175.22 177.23 3d5r s ALA 78 N -1.95 -1.13 0.38 5.36 0.00 -1.26 -1.12 121.76 122.05 3d5r s ALA 78 Ca 0.12 -0.17 0.12 0.00 0.00 0.00 0.00 51.96 52.03 3d5r s ALA 78 Cb -0.06 0.88 0.91 0.00 0.00 0.00 0.00 23.12 24.85 3d5r s ALA 78 CO 0.05 -0.90 1.89 0.00 0.00 0.00 0.00 175.76 176.81 3d5r h ALA 79 N 2.08 1.94 -3.59 0.00 0.00 -1.90 -3.38 119.26 114.42 3d5r h ALA 79 Ca -0.26 0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.31 3d5r h ALA 79 Cb 1.27 -0.10 -0.25 0.00 0.00 0.00 0.00 17.79 18.71 3d5r h ALA 79 CO 0.32 -0.16 -0.76 -0.06 0.00 0.00 0.00 179.25 178.58 3d5r s PHE 80 N -5.57 0.80 0.60 0.00 0.08 -1.26 -0.48 117.98 112.16 3d5r s PHE 80 Ca -0.09 -0.33 0.31 0.00 0.12 0.00 0.00 56.93 56.94 3d5r s PHE 80 Cb 0.21 -0.49 1.78 0.00 -0.57 0.00 0.00 43.02 43.95 3d5r s PHE 80 CO 0.78 -0.02 2.14 -0.39 -0.10 0.00 0.00 175.22 177.63 3d5r h VAL 81 N 4.65 0.39 -0.33 -0.44 -1.51 -1.84 -0.87 116.25 116.30 3d5r h VAL 81 Ca -0.34 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.13 3d5r h VAL 81 Cb 1.19 0.87 0.00 0.00 -2.13 0.00 0.00 31.29 31.22 3d5r h VAL 81 CO 0.45 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 177.08 3d5r n LYS 82 N -3.65 2.47 -3.19 5.19 4.76 -1.26 -4.88 118.16 117.60 3d5r n LYS 82 Ca -0.00 -2.20 -0.36 0.00 -2.87 0.00 0.00 58.31 52.88 3d5r n LYS 82 Cb 0.26 -1.51 -0.06 0.00 -1.84 0.00 0.00 35.03 31.88 3d5r n LYS 82 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 3d5r s ARG 83 N -1.59 4.14 0.18 1.97 3.52 -0.33 -4.99 118.95 121.85 3d5r s ARG 83 Ca 0.37 0.73 -0.33 0.00 -0.13 0.00 0.00 55.73 56.36 3d5r s ARG 83 Cb 0.22 -2.87 -0.14 0.00 -1.56 0.00 0.00 34.95 30.60 3d5r s ARG 83 CO 0.31 0.41 1.47 0.00 -0.81 0.00 0.00 175.30 176.68 3d5r n ALA 84 N 0.69 0.82 -1.76 6.12 0.00 -1.26 -4.82 120.51 120.31 3d5r n ALA 84 Ca -0.03 0.45 -0.41 0.00 0.00 0.00 0.00 53.44 53.44 3d5r n ALA 84 Cb 0.51 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.70 3d5r n ALA 84 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3d5r n PRO 85 N 2.76 2.53 -3.47 0.00 -0.04 -1.26 -4.83 135.00 130.69 3d5r n PRO 85 Ca 0.15 0.89 -0.37 0.00 -0.04 0.00 0.00 63.50 64.13 3d5r n PRO 85 Cb 0.28 -2.60 -0.07 0.00 -0.04 0.00 0.00 33.50 31.07 3d5r n PRO 85 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3d5r s SER 86 N -0.20 6.49 0.01 3.54 0.15 -0.28 -4.28 113.70 119.13 3d5r s SER 86 Ca 0.54 0.58 -0.25 0.00 0.70 0.00 0.00 55.95 57.52 3d5r s SER 86 Cb -0.49 -2.21 -0.19 0.00 -1.71 0.00 0.00 66.02 61.42 3d5r s SER 86 CO 0.63 0.06 1.39 0.74 1.20 0.00 0.00 173.24 177.26 3d5r h THR 87 N 4.73 1.25 -0.03 6.45 2.02 -1.84 -1.66 112.91 123.83 3d5r h THR 87 Ca -0.41 -0.81 0.01 0.00 0.77 0.00 0.00 66.41 65.97 3d5r h THR 87 Cb 1.17 1.80 -0.01 0.00 -1.74 0.00 0.00 68.15 69.37 3d5r h THR 87 CO 0.75 0.21 -0.03 -0.25 0.37 0.00 0.00 175.52 176.57 3d5r h TRP 88 N -0.37 -0.07 -0.75 3.16 7.01 -1.91 -1.32 115.95 121.70 3d5r h TRP 88 Ca -0.00 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 60.97 3d5r h TRP 88 Cb 0.36 0.04 -0.03 0.00 -2.10 0.00 0.00 29.16 27.42 3d5r h TRP 88 CO 0.04 -0.05 0.32 1.25 -2.79 0.00 0.00 178.44 177.22 3d5r h LEU 89 N -0.04 1.01 -0.75 0.65 5.85 -1.88 0.20 115.31 120.36 3d5r h LEU 89 Ca 0.02 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 3d5r h LEU 89 Cb 0.07 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 3d5r h LEU 89 CO -0.06 0.90 0.30 0.74 -0.34 0.00 0.00 178.44 179.98 3d5r h THR 90 N 1.07 1.25 -0.53 1.05 2.02 -1.15 0.80 112.91 117.41 3d5r h THR 90 Ca 0.25 -0.79 -0.08 0.00 0.77 0.00 0.00 66.41 66.56 3d5r h THR 90 Cb 0.18 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 3d5r h THR 90 CO -0.02 0.32 -0.01 0.00 0.37 0.00 0.00 175.52 176.18 3d5r h ALA 91 N 1.15 0.98 -0.37 6.16 0.00 -0.68 -2.05 119.26 124.44 3d5r h ALA 91 Ca 0.25 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 3d5r h ALA 91 Cb 0.21 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3d5r h ALA 91 CO -0.02 0.62 -0.33 -0.92 0.00 0.00 0.00 179.25 178.60 3d5r h TYR 92 N 0.84 0.99 -0.76 0.00 3.20 -0.00 -0.28 116.97 120.97 3d5r h TYR 92 Ca 0.16 -0.27 -0.02 0.00 3.14 0.00 0.00 58.73 61.74 3d5r h TYR 92 Cb 0.51 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 3d5r h TYR 92 CO 0.03 1.06 0.40 0.28 -1.64 0.00 0.00 178.16 178.29 3d5r h VAL 93 N 0.71 1.23 -0.48 1.81 2.07 -0.65 0.61 116.25 121.54 3d5r h VAL 93 Ca 0.07 -0.58 -0.09 0.00 0.82 0.00 0.00 66.70 66.92 3d5r h VAL 93 Cb 0.89 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3d5r h VAL 93 CO 0.08 0.26 -0.05 0.58 0.02 0.00 0.00 177.57 178.46 3d5r h VAL 94 N 1.06 1.27 0.28 2.57 2.07 -0.95 -0.48 116.25 122.07 3d5r h VAL 94 Ca 0.27 -1.15 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 3d5r h VAL 94 Cb 0.04 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3d5r h VAL 94 CO -0.04 0.40 -0.21 0.50 0.02 0.00 0.00 177.57 178.23 3d5r h LYS 95 N 0.74 -0.48 -0.24 1.57 3.64 -0.16 -1.15 116.57 120.49 3d5r h LYS 95 Ca 0.13 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 3d5r h LYS 95 Cb 0.58 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 3d5r h LYS 95 CO 0.03 -0.32 0.02 0.28 -2.27 0.00 0.00 179.45 177.19 3d5r h VAL 96 N -0.50 1.24 -0.06 2.00 2.07 -0.87 -3.01 116.25 117.11 3d5r h VAL 96 Ca -0.02 -0.82 -0.04 0.00 0.82 0.00 0.00 66.70 66.64 3d5r h VAL 96 Cb 0.44 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 3d5r h VAL 96 CO -0.01 0.26 -0.13 -0.26 0.02 0.00 0.00 177.57 177.45 3d5r h PHE 97 N 0.20 0.09 -0.69 1.57 -1.00 -1.04 -1.30 116.94 114.77 3d5r h PHE 97 Ca 0.07 -0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.77 3d5r h PHE 97 Cb 0.36 -0.03 -0.03 0.00 3.61 0.00 0.00 35.95 39.87 3d5r h PHE 97 CO 0.03 0.22 0.14 0.77 -1.61 0.00 0.00 178.31 177.86 3d5r h SER 98 N 0.09 1.06 0.86 2.17 0.02 -1.08 -1.62 113.55 115.05 3d5r h SER 98 Ca 0.02 -0.24 -0.17 0.00 -0.84 0.00 0.00 61.79 60.56 3d5r h SER 98 Cb 0.29 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 3d5r h SER 98 CO 0.02 1.03 -0.80 0.25 -1.14 0.00 0.00 176.83 176.19 3d5r h LEU 99 N 1.05 0.00 -0.11 5.07 5.85 -1.32 -3.10 115.31 122.74 3d5r h LEU 99 Ca 0.21 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.93 3d5r h LEU 99 Cb 0.40 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.43 3d5r h LEU 99 CO 0.01 0.80 0.00 0.00 -0.34 0.00 0.00 178.44 178.91 3d5r n ALA 100 N -2.37 2.66 0.30 1.25 0.00 -0.54 -3.53 120.51 118.28 3d5r n ALA 100 Ca -0.00 -0.22 0.18 0.00 0.00 0.00 0.00 53.44 53.40 3d5r n ALA 100 Cb 0.78 -1.45 0.88 0.00 0.00 0.00 0.00 19.45 19.66 3d5r n ALA 100 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 3d5r h VAL 101 N 0.27 0.11 -0.01 0.00 -1.51 -1.23 -1.24 116.25 112.64 3d5r h VAL 101 Ca 0.00 -0.36 0.00 0.00 -1.23 0.00 0.00 66.70 65.11 3d5r h VAL 101 Cb 0.06 1.31 0.00 0.00 -2.13 0.00 0.00 31.29 30.53 3d5r h VAL 101 CO 0.00 0.03 -0.21 0.59 -1.23 0.00 0.00 177.57 176.74 3d5r n ASN 102 N -3.19 0.77 -0.04 4.19 4.13 -1.23 -4.40 115.26 115.48 3d5r n ASN 102 Ca -0.01 -0.70 -0.06 0.00 1.68 0.00 0.00 54.58 55.49 3d5r n ASN 102 Cb 0.22 0.05 -0.05 0.00 -1.54 0.00 0.00 39.78 38.46 3d5r n ASN 102 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3d5r n LEU 103 N -0.83 2.12 -4.16 3.41 4.77 -0.50 -5.09 117.00 116.71 3d5r n LEU 103 Ca 0.12 -0.04 -0.12 0.00 -0.03 0.00 0.00 56.01 55.95 3d5r n LEU 103 Cb 0.32 -0.18 -0.08 0.00 -2.33 0.00 0.00 43.42 41.14 3d5r n LEU 103 CO 0.26 0.52 -0.12 0.27 -1.33 0.00 0.00 177.39 176.99 3d5r s ILE 104 N -2.19 0.00 0.05 -0.08 -0.00 -0.98 -5.04 121.20 112.96 3d5r s ILE 104 Ca -0.10 -1.85 -0.31 0.00 -0.00 0.00 0.00 60.65 58.39 3d5r s ILE 104 Cb 0.03 -2.44 -0.06 0.00 -0.00 0.00 0.00 42.46 39.99 3d5r s ILE 104 CO 0.25 0.00 1.32 0.00 -0.00 0.00 0.00 174.94 176.50 3d5r s ALA 105 N -4.01 3.52 -0.08 2.27 0.00 -1.26 -4.61 121.76 117.59 3d5r s ALA 105 Ca 0.35 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.24 3d5r s ALA 105 Cb 0.05 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.66 3d5r s ALA 105 CO 0.13 -0.66 -0.07 0.42 0.00 0.00 0.00 175.76 175.59 3d5r s ILE 106 N 1.57 0.82 -0.12 0.00 1.01 -1.26 -5.09 121.20 118.13 3d5r s ILE 106 Ca 0.62 -0.22 -0.29 0.00 0.00 0.00 0.00 60.65 60.76 3d5r s ILE 106 Cb -0.32 -0.84 -0.05 0.00 0.01 0.00 0.00 42.46 41.26 3d5r s ILE 106 CO 0.28 0.31 1.74 -0.62 0.00 0.00 0.00 174.94 176.65 3d5r s ASP 107 N 1.33 6.42 0.45 3.58 -1.08 -1.26 -4.86 116.67 121.25 3d5r s ASP 107 Ca -0.03 2.04 0.14 0.00 -0.52 0.00 0.00 52.55 54.17 3d5r s ASP 107 Cb -0.14 -2.53 1.07 0.00 -1.46 0.00 0.00 42.92 39.86 3d5r s ASP 107 CO -0.03 -1.16 2.03 0.28 0.52 0.00 0.00 175.17 176.80 3d5r h SER 108 N 10.64 0.29 1.28 -0.34 0.02 -1.99 -1.08 113.55 122.38 3d5r h SER 108 Ca -0.39 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.54 3d5r h SER 108 Cb 1.18 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.66 3d5r h SER 108 CO 0.97 0.19 -0.11 1.56 -1.14 0.00 0.00 176.83 178.30 3d5r h GLN 109 N 0.33 0.00 -0.02 3.45 4.20 -1.96 0.40 115.11 121.52 3d5r h GLN 109 Ca 0.20 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.80 3d5r h GLN 109 Cb 0.37 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.15 3d5r h GLN 109 CO -0.05 0.11 -0.40 0.28 -0.67 0.00 0.00 178.83 178.10 3d5r h VAL 110 N 0.00 1.47 0.13 -0.54 2.07 -1.60 -0.02 116.25 117.77 3d5r h VAL 110 Ca -0.00 -1.95 -0.01 0.00 0.82 0.00 0.00 66.70 65.56 3d5r h VAL 110 Cb 0.78 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 33.15 3d5r h VAL 110 CO 0.01 0.55 -0.06 0.25 0.02 0.00 0.00 177.57 178.34 3d5r h LEU 111 N -0.27 -0.15 -0.84 2.57 5.85 -1.24 -2.41 115.31 118.81 3d5r h LEU 111 Ca -0.05 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.41 3d5r h LEU 111 Cb 1.12 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 3d5r h LEU 111 CO 0.08 0.15 -0.17 0.00 -0.34 0.00 0.00 178.44 178.16 3d5r h GLY 113 N 2.61 0.79 1.03 0.00 0.00 -0.95 0.26 103.07 106.82 3d5r h GLY 113 Ca -0.00 -0.71 -0.04 0.00 0.00 0.00 0.00 47.33 46.58 3d5r h GLY 113 CO 0.02 0.65 0.29 0.00 0.00 0.00 0.00 176.54 177.50 3d5r h ALA 114 N 0.79 0.94 -0.08 3.60 0.00 -1.15 -1.28 119.26 122.07 3d5r h ALA 114 Ca 0.08 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3d5r h ALA 114 Cb 0.70 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3d5r h ALA 114 CO 0.05 0.56 0.04 0.28 0.00 0.00 0.00 179.25 180.18 3d5r h VAL 115 N 1.03 1.09 -0.70 0.00 2.07 -1.16 -1.81 116.25 116.78 3d5r h VAL 115 Ca 0.24 -0.27 0.06 0.00 0.82 0.00 0.00 66.70 67.56 3d5r h VAL 115 Cb 0.21 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.05 3d5r h VAL 115 CO -0.02 0.08 0.39 0.50 0.02 0.00 0.00 177.57 178.55 3d5r h LYS 116 N 0.03 0.70 -0.61 1.57 3.64 -0.71 -1.96 116.57 119.24 3d5r h LYS 116 Ca 0.03 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 3d5r h LYS 116 Cb 0.09 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 3d5r h LYS 116 CO -0.00 0.46 0.29 2.35 -2.27 0.00 0.00 179.45 180.28 3d5r h TRP 117 N 0.72 0.87 -0.60 1.91 7.01 -1.00 -0.07 115.95 124.80 3d5r h TRP 117 Ca 0.31 -0.04 0.01 0.00 2.11 0.00 0.00 58.89 61.28 3d5r h TRP 117 Cb 0.20 -0.27 -0.03 0.00 -2.10 0.00 0.00 29.16 26.95 3d5r h TRP 117 CO -0.07 0.67 0.39 -0.07 -2.79 0.00 0.00 178.44 176.56 3d5r h LEU 118 N 0.83 0.67 0.38 0.65 3.38 -0.78 0.20 115.31 120.63 3d5r h LEU 118 Ca 0.21 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 3d5r h LEU 118 Cb 0.12 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3d5r h LEU 118 CO -0.03 0.48 -0.18 0.40 0.09 0.00 0.00 178.44 179.20 3d5r h ILE 119 N 0.79 0.49 -0.61 1.22 2.04 -1.10 -1.41 117.51 118.94 3d5r h ILE 119 Ca 0.22 -0.62 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 3d5r h ILE 119 Cb -0.07 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 3d5r h ILE 119 CO -0.06 0.09 0.21 -0.07 0.00 0.00 0.00 178.15 178.33 3d5r h LEU 120 N -0.92 0.86 0.01 1.44 4.07 -1.00 -3.24 115.31 116.53 3d5r h LEU 120 Ca -0.05 -0.19 -0.36 0.00 0.08 0.00 0.00 57.88 57.35 3d5r h LEU 120 Cb 0.54 -0.23 -0.06 0.00 1.08 0.00 0.00 40.66 41.99 3d5r h LEU 120 CO 0.09 0.82 -2.27 -0.62 -1.08 0.00 0.00 178.44 175.38 3d5r n GLU 121 N -4.42 0.68 -0.00 1.13 -0.58 0.68 -4.71 120.64 113.41 3d5r n GLU 121 Ca 0.04 0.11 0.06 0.00 -0.42 0.00 0.00 57.16 56.94 3d5r n GLU 121 Cb 0.19 -1.58 0.05 0.00 -0.57 0.00 0.00 31.44 29.53 3d5r n GLU 121 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3d5r n LYS 122 N -3.00 0.76 -3.79 3.49 4.76 -0.56 -4.97 118.16 114.85 3d5r n LYS 122 Ca -0.34 -1.25 -0.35 0.00 -2.87 0.00 0.00 58.31 53.50 3d5r n LYS 122 Cb 1.09 -1.24 -0.09 0.00 -1.84 0.00 0.00 35.03 32.95 3d5r n LYS 122 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 3d5r s GLN 123 N -1.03 4.12 0.67 1.97 0.74 -1.05 -1.77 119.66 123.32 3d5r s GLN 123 Ca 0.15 -0.26 -0.11 0.00 0.05 0.00 0.00 55.36 55.19 3d5r s GLN 123 Cb 0.10 -3.38 -0.01 0.00 1.10 0.00 0.00 33.01 30.83 3d5r s GLN 123 CO 0.15 0.27 1.05 0.15 -0.55 0.00 0.00 175.29 176.37 3d5r s LYS 124 N 0.43 3.17 0.61 1.67 -0.14 0.88 -4.92 119.74 121.44 3d5r s LYS 124 Ca 0.07 0.76 0.36 0.00 -1.36 0.00 0.00 55.97 55.79 3d5r s LYS 124 Cb -0.12 -2.03 1.99 0.00 -1.68 0.00 0.00 37.83 35.99 3d5r s LYS 124 CO -0.01 -0.88 2.26 -1.35 -0.76 0.00 0.00 175.35 174.61 3d5r h PRO 125 N -0.55 0.00 -0.01 -1.68 0.11 -1.99 0.94 132.00 128.82 3d5r h PRO 125 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3d5r h PRO 125 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3d5r h PRO 125 CO 0.61 0.02 0.00 -0.40 -0.21 0.00 0.00 178.00 178.01 3d5r n ASP 126 N -3.47 0.44 0.00 -2.05 5.75 -1.26 -4.91 116.55 111.05 3d5r n ASP 126 Ca -0.03 -1.16 0.00 0.00 -0.01 0.00 0.00 54.79 53.60 3d5r n ASP 126 Cb 0.11 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 3d5r n ASP 126 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d5r n GLY 127 N 1.05 3.49 3.74 6.12 0.00 0.32 -4.38 105.19 115.53 3d5r n GLY 127 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 3d5r n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d5r s VAL 128 N -3.00 2.25 -0.11 1.61 1.01 -1.26 -4.10 120.40 116.80 3d5r s VAL 128 Ca 0.00 0.16 -0.00 0.00 0.00 0.00 0.00 61.98 62.14 3d5r s VAL 128 Cb 0.00 -3.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 3d5r s VAL 128 CO 0.00 -0.03 -0.09 -0.36 0.00 0.00 0.00 175.10 174.62 3d5r s PHE 129 N -1.44 2.88 0.10 5.22 0.08 -1.26 -0.08 117.98 123.47 3d5r s PHE 129 Ca 0.79 -0.36 0.09 0.00 0.12 0.00 0.00 56.93 57.57 3d5r s PHE 129 Cb -0.36 -1.82 -0.04 0.00 -0.57 0.00 0.00 43.02 40.23 3d5r s PHE 129 CO 0.39 -0.01 -0.18 -0.65 -0.10 0.00 0.00 175.22 174.67 3d5r s GLN 130 N -0.01 1.84 -0.32 0.44 -0.21 -0.73 -4.46 119.66 116.22 3d5r s GLN 130 Ca -0.02 -1.14 -0.07 0.00 0.02 0.00 0.00 55.36 54.16 3d5r s GLN 130 Cb -0.14 -2.13 0.03 0.00 1.00 0.00 0.00 33.01 31.77 3d5r s GLN 130 CO 0.03 0.49 0.10 -2.00 -2.12 0.00 0.00 175.29 171.80 3d5r s GLU 131 N -1.99 2.80 0.00 2.91 2.56 -1.26 -4.71 118.70 119.01 3d5r s GLU 131 Ca 0.17 -1.06 0.23 0.00 0.00 0.00 0.00 54.97 54.31 3d5r s GLU 131 Cb -0.11 -3.44 0.00 0.00 2.00 0.00 0.00 34.13 32.58 3d5r s GLU 131 CO 0.09 -0.59 1.09 -0.25 -0.56 0.00 0.00 175.26 175.04 3d5r n ASP 132 N 4.84 1.87 -3.07 -1.70 8.00 -1.26 -4.70 116.55 120.52 3d5r n ASP 132 Ca -0.13 -1.42 -0.16 0.00 0.71 0.00 0.00 54.79 53.79 3d5r n ASP 132 Cb 0.46 0.52 -0.04 0.00 -0.02 0.00 0.00 41.12 42.04 3d5r n ASP 132 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d5r n ALA 133 N -0.23 0.49 -1.53 2.24 0.00 -1.26 -5.06 120.51 115.16 3d5r n ALA 133 Ca 0.09 -2.07 -0.40 0.00 0.00 0.00 0.00 53.44 51.05 3d5r n ALA 133 Cb 0.45 -1.12 0.02 0.00 0.00 0.00 0.00 19.45 18.80 3d5r n ALA 133 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3d5r n PRO 134 N 2.87 0.86 -2.01 0.00 -0.02 -1.26 -4.22 135.00 131.22 3d5r n PRO 134 Ca 0.24 0.32 -0.34 0.00 -2.02 0.00 0.00 63.50 61.70 3d5r n PRO 134 Cb 0.52 -1.81 0.02 0.00 -0.02 0.00 0.00 33.50 32.21 3d5r n PRO 134 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3d5r s VAL 135 N -1.46 3.39 0.10 -1.45 -7.23 -1.26 -4.95 120.40 107.54 3d5r s VAL 135 Ca 0.66 0.72 -0.19 0.00 -1.81 0.00 0.00 61.98 61.36 3d5r s VAL 135 Cb -0.53 -3.24 -0.06 0.00 0.56 0.00 0.00 36.38 33.11 3d5r s VAL 135 CO 0.55 -0.33 1.64 0.40 -0.31 0.00 0.00 175.10 177.05 3d5r h ILE 136 N 0.53 1.18 -0.58 -0.62 2.04 -2.02 -3.34 117.51 114.69 3d5r h ILE 136 Ca -0.48 -0.57 -0.71 0.00 1.00 0.00 0.00 64.86 64.11 3d5r h ILE 136 Cb 1.24 1.06 -0.08 0.00 -0.74 0.00 0.00 36.82 38.31 3d5r h ILE 136 CO 0.56 0.19 2.59 1.41 0.00 0.00 0.00 178.15 182.90 3d5r n HIS 137 N -4.75 3.94 0.31 1.37 8.25 -1.26 -4.77 115.22 118.30 3d5r n HIS 137 Ca -0.03 -2.94 0.18 0.00 -0.26 0.00 0.00 57.72 54.67 3d5r n HIS 137 Cb 0.14 -2.49 0.96 0.00 1.12 0.00 0.00 29.99 29.72 3d5r n HIS 137 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 3d5r h GLN 138 N 6.56 0.00 0.00 -0.41 1.08 -1.99 -0.32 115.11 120.02 3d5r h GLN 138 Ca 0.49 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.69 3d5r h GLN 138 Cb 0.73 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.16 3d5r h GLN 138 CO 1.68 0.00 0.00 -0.85 -0.95 0.00 0.00 178.83 178.71 3d5r n GLU 139 N -2.85 0.14 0.00 1.46 0.00 -1.26 -3.24 120.64 114.89 3d5r n GLU 139 Ca -0.02 0.18 0.13 0.00 0.00 0.00 0.00 57.16 57.46 3d5r n GLU 139 Cb 0.18 -1.68 0.45 0.00 0.00 0.00 0.00 31.44 30.39 3d5r n GLU 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3d5r n MET 140 N -1.93 1.30 -0.24 3.44 0.00 -0.13 -3.96 117.12 115.59 3d5r n MET 140 Ca 0.05 -0.76 0.11 0.00 0.00 0.00 0.00 57.70 57.10 3d5r n MET 140 Cb 0.34 -1.48 0.24 0.00 0.00 0.00 0.00 33.22 32.32 3d5r n MET 140 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 175.97 176.41 3d5r n ILE 141 N -0.18 0.68 -4.41 3.17 -5.35 -1.20 -4.12 119.36 107.95 3d5r n ILE 141 Ca 0.16 -0.84 0.00 0.00 -0.27 0.00 0.00 62.75 61.80 3d5r n ILE 141 Cb 0.36 0.81 0.00 0.00 -1.74 0.00 0.00 39.64 39.06 3d5r n ILE 141 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d5r n GLY 142 N 1.47 2.21 0.19 3.28 0.00 -1.25 -2.55 105.19 108.53 3d5r n GLY 142 Ca 0.20 -0.43 0.09 0.00 0.00 0.00 0.00 46.02 45.88 3d5r n GLY 142 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3d5r h GLY 143 N 0.00 0.00 1.09 -0.02 0.00 -1.92 -1.30 103.07 100.93 3d5r h GLY 143 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3d5r h GLY 143 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 3d5r n LEU 144 N -2.23 0.00 0.08 3.11 4.32 -1.06 -2.58 117.00 118.65 3d5r n LEU 144 Ca -0.01 0.05 -0.07 0.00 -0.02 0.00 0.00 56.01 55.96 3d5r n LEU 144 Cb 0.23 -0.05 0.07 0.00 -1.62 0.00 0.00 43.42 42.06 3d5r n LEU 144 CO 0.08 -0.02 0.40 -0.09 -1.22 0.00 0.00 177.39 176.54 3d5r h ARG 145 N 0.00 0.24 -6.72 3.23 2.43 -1.44 -3.44 114.38 108.69 3d5r h ARG 145 Ca 0.00 -0.20 -0.56 0.00 -0.81 0.00 0.00 59.98 58.42 3d5r h ARG 145 Cb 0.03 0.04 0.09 0.00 -0.42 0.00 0.00 29.97 29.70 3d5r h ARG 145 CO 0.00 0.84 0.73 -1.71 -1.51 0.00 0.00 179.97 178.33 3d5r n ASN 146 N -3.80 3.32 0.17 -3.80 2.85 -1.06 -4.91 115.26 108.02 3d5r n ASN 146 Ca -0.03 1.16 0.05 0.00 -0.11 0.00 0.00 54.58 55.65 3d5r n ASN 146 Cb 0.68 -1.52 0.16 0.00 1.24 0.00 0.00 39.78 40.34 3d5r n ASN 146 CO 0.00 0.00 0.00 0.78 -2.11 0.00 0.00 177.26 175.93 3d5r h ASN 147 N 4.24 0.00 -3.56 1.20 4.21 -1.91 -3.44 115.58 116.32 3d5r h ASN 147 Ca -0.46 0.00 -0.52 0.00 1.21 0.00 0.00 56.30 56.53 3d5r h ASN 147 Cb 1.25 0.00 0.04 0.00 -1.12 0.00 0.00 38.32 38.49 3d5r h ASN 147 CO 0.75 0.40 0.61 0.20 -1.29 0.00 0.00 177.43 178.10 3d5r s ASN 148 N -6.38 6.94 -1.44 5.81 0.01 -1.26 -3.32 114.94 115.30 3d5r s ASN 148 Ca 0.03 2.43 -0.08 0.00 -0.71 0.00 0.00 52.86 54.53 3d5r s ASN 148 Cb 0.08 -2.62 0.02 0.00 0.41 0.00 0.00 41.25 39.14 3d5r s ASN 148 CO 0.71 -0.46 0.95 -0.62 -1.51 0.00 0.00 177.10 176.18 3d5r n GLU 149 N 2.01 -6.59 -0.11 -0.60 1.02 -1.26 -4.91 120.64 110.21 3d5r n GLU 149 Ca 0.04 0.83 -0.05 0.00 -0.02 0.00 0.00 57.16 57.95 3d5r n GLU 149 Cb 0.43 -5.80 0.14 0.00 -0.02 0.00 0.00 31.44 26.20 3d5r n GLU 149 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3d5r h LYS 150 N -2.15 0.80 -0.81 3.49 3.64 -1.84 -1.04 116.57 118.66 3d5r h LYS 150 Ca -0.55 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 58.55 3d5r h LYS 150 Cb 1.37 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 33.07 3d5r h LYS 150 CO 0.57 0.83 0.35 -0.44 -2.27 0.00 0.00 179.45 178.49 3d5r h ASP 151 N 0.74 1.09 -0.03 4.20 3.32 -1.90 0.24 116.42 124.07 3d5r h ASP 151 Ca 0.14 -0.15 -0.06 0.00 0.02 0.00 0.00 57.03 56.98 3d5r h ASP 151 Cb 0.50 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3d5r h ASP 151 CO 0.03 0.94 -0.20 0.24 -1.72 0.00 0.00 179.24 178.53 3d5r h MET 152 N 1.16 0.18 -0.30 3.56 2.86 -1.91 -1.88 114.93 118.61 3d5r h MET 152 Ca 0.27 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.75 3d5r h MET 152 Cb 0.18 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 3d5r h MET 152 CO -0.03 0.85 0.18 0.00 1.06 0.00 0.00 176.91 178.96 3d5r h ALA 153 N 0.34 0.38 -0.34 6.32 0.00 -1.08 0.33 119.26 125.22 3d5r h ALA 153 Ca -0.02 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 3d5r h ALA 153 Cb 0.90 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3d5r h ALA 153 CO 0.04 -0.11 -0.38 1.25 0.00 0.00 0.00 179.25 180.06 3d5r h LEU 154 N 0.38 0.84 -0.73 0.00 5.85 -0.63 -0.93 115.31 120.09 3d5r h LEU 154 Ca 0.11 -0.37 -0.08 0.00 0.84 0.00 0.00 57.88 58.37 3d5r h LEU 154 Cb 0.03 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 3d5r h LEU 154 CO -0.02 1.12 0.07 0.74 -0.34 0.00 0.00 178.44 180.01 3d5r h THR 155 N 0.65 1.26 -0.13 1.05 2.02 -1.15 -0.69 112.91 115.93 3d5r h THR 155 Ca 0.06 -1.05 -0.01 0.00 0.77 0.00 0.00 66.41 66.18 3d5r h THR 155 Cb 0.93 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 3d5r h THR 155 CO 0.09 0.39 0.04 0.00 0.37 0.00 0.00 175.52 176.40 3d5r h ALA 156 N 1.10 0.16 -0.12 6.16 0.00 -0.75 0.15 119.26 125.96 3d5r h ALA 156 Ca 0.19 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.01 3d5r h ALA 156 Cb 0.46 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3d5r h ALA 156 CO 0.02 -0.22 -0.11 0.35 0.00 0.00 0.00 179.25 179.28 3d5r h PHE 157 N 0.02 -0.29 -0.53 0.00 3.57 -0.91 0.65 116.94 119.45 3d5r h PHE 157 Ca 0.04 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.52 3d5r h PHE 157 Cb 0.22 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.08 3d5r h PHE 157 CO -0.00 -0.17 0.17 0.28 -2.23 0.00 0.00 178.31 176.36 3d5r h VAL 158 N -0.14 1.23 -0.58 1.41 2.07 -1.07 -2.28 116.25 116.90 3d5r h VAL 158 Ca 0.08 -0.77 0.04 0.00 0.82 0.00 0.00 66.70 66.87 3d5r h VAL 158 Cb 0.26 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 3d5r h VAL 158 CO -0.21 0.29 0.33 0.25 0.02 0.00 0.00 177.57 178.25 3d5r h LEU 159 N 0.73 0.52 -0.46 2.57 5.85 -0.58 -0.93 115.31 123.01 3d5r h LEU 159 Ca 0.17 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.97 3d5r h LEU 159 Cb 0.27 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.15 3d5r h LEU 159 CO -0.01 0.35 0.12 0.40 -0.34 0.00 0.00 178.44 178.97 3d5r h ILE 160 N 0.64 0.80 -0.42 4.05 1.08 -0.50 0.44 117.51 123.60 3d5r h ILE 160 Ca 0.24 -0.09 0.03 0.00 -0.39 0.00 0.00 64.86 64.65 3d5r h ILE 160 Cb 0.08 0.50 -0.03 0.00 -3.07 0.00 0.00 36.82 34.30 3d5r h ILE 160 CO -0.13 0.05 0.23 0.28 -0.69 0.00 0.00 178.15 177.89 3d5r h SER 161 N 0.27 0.35 -0.51 1.72 0.02 -0.77 0.12 113.55 114.76 3d5r h SER 161 Ca 0.22 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.13 3d5r h SER 161 Cb 0.26 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.71 3d5r h SER 161 CO -0.26 0.25 0.12 -0.07 -1.14 0.00 0.00 176.83 175.73 3d5r h LEU 162 N 0.46 0.82 -0.36 5.07 3.38 -0.59 -1.32 115.31 122.77 3d5r h LEU 162 Ca 0.17 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 3d5r h LEU 162 Cb 0.05 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3d5r h LEU 162 CO -0.10 0.82 -0.05 1.56 0.09 0.00 0.00 178.44 180.75 3d5r h GLN 163 N 0.84 0.67 0.00 1.13 4.20 -0.42 -0.04 115.11 121.49 3d5r h GLN 163 Ca 0.18 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.65 3d5r h GLN 163 Cb 0.33 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.06 3d5r h GLN 163 CO 0.00 0.81 0.00 0.93 -0.67 0.00 0.00 178.83 179.90 3d5r h GLU 164 N 0.47 0.00 0.00 1.46 5.08 -0.76 -2.77 114.58 118.07 3d5r h GLU 164 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3d5r h GLU 164 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3d5r h GLU 164 CO 0.03 0.00 -1.00 0.00 -1.00 0.00 0.00 179.01 177.04 3d5r n ALA 165 N -2.03 3.65 -0.22 3.43 0.00 -0.52 -4.59 120.51 120.23 3d5r n ALA 165 Ca 0.01 -0.44 -0.06 0.00 0.00 0.00 0.00 53.44 52.95 3d5r n ALA 165 Cb 0.31 -0.94 -0.01 0.00 0.00 0.00 0.00 19.45 18.81 3d5r n ALA 165 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3d5r h LYS 166 N 0.00 -0.16 -0.74 0.00 3.64 -0.71 0.18 116.57 118.78 3d5r h LYS 166 Ca 0.00 0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.53 3d5r h LYS 166 Cb 0.67 0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 32.43 3d5r h LYS 166 CO 0.00 -0.11 0.29 -0.44 -2.27 0.00 0.00 179.45 176.92 3d5r h ASP 167 N -0.17 0.28 0.08 4.20 3.32 -1.81 0.79 116.42 123.10 3d5r h ASP 167 Ca 0.22 0.10 -0.19 0.00 0.02 0.00 0.00 57.03 57.19 3d5r h ASP 167 Cb 0.56 0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.19 3d5r h ASP 167 CO -0.72 0.11 -0.68 0.40 -1.72 0.00 0.00 179.24 176.64 3d5r h ILE 168 N 0.44 1.33 -0.02 0.35 1.08 -1.59 -3.34 117.51 115.78 3d5r h ILE 168 Ca 0.40 -1.98 0.00 0.00 -0.39 0.00 0.00 64.86 62.89 3d5r h ILE 168 Cb 0.59 1.96 0.00 0.00 -3.07 0.00 0.00 36.82 36.30 3d5r h ILE 168 CO -0.39 0.61 -0.29 0.00 -0.69 0.00 0.00 178.15 177.39 3d5r h GLU 170 N 2.52 -0.28 0.00 0.00 4.39 0.46 -1.84 114.58 119.83 3d5r h GLU 170 Ca 0.00 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.72 3d5r h GLU 170 Cb 0.68 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 3d5r h GLU 170 CO 0.00 -0.19 0.00 0.93 -1.16 0.00 0.00 179.01 178.59 3d5r h GLU 171 N -0.29 0.00 -0.01 2.33 4.39 -1.84 -3.20 114.58 115.96 3d5r h GLU 171 Ca 0.10 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.80 3d5r h GLU 171 Cb 0.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 3d5r h GLU 171 CO -0.69 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.16 3d5r n GLN 172 N -2.30 -0.17 -3.69 2.33 10.64 -0.79 -4.86 117.38 118.53 3d5r n GLN 172 Ca 0.00 -0.75 -0.28 0.00 -1.83 0.00 0.00 57.00 54.14 3d5r n GLN 172 Cb 0.14 -1.03 -0.12 0.00 -0.86 0.00 0.00 30.24 28.38 3d5r n GLN 172 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 3d5r s VAL 173 N -0.26 1.66 0.40 -0.39 1.01 -0.76 -4.98 120.40 117.07 3d5r s VAL 173 Ca 0.02 -3.23 0.19 0.00 0.00 0.00 0.00 61.98 58.96 3d5r s VAL 173 Cb 0.01 -2.12 0.39 0.00 0.00 0.00 0.00 36.38 34.66 3d5r s VAL 173 CO 0.02 -1.03 1.75 0.78 0.00 0.00 0.00 175.10 176.62 3d5r h ASN 174 N 5.92 0.44 0.84 3.32 -0.26 -1.88 -0.31 115.58 123.67 3d5r h ASN 174 Ca 0.13 0.09 0.00 0.00 -0.56 0.00 0.00 56.30 55.96 3d5r h ASN 174 Cb 0.86 0.02 0.00 0.00 -1.06 0.00 0.00 38.32 38.14 3d5r h ASN 174 CO 0.54 0.06 -0.03 -1.54 -1.06 0.00 0.00 177.43 175.40 3d5r n SER 175 N -4.65 0.05 -0.02 5.81 3.41 -1.26 -4.21 113.62 112.74 3d5r n SER 175 Ca 0.26 0.26 -0.09 0.00 -0.26 0.00 0.00 58.87 59.05 3d5r n SER 175 Cb 0.92 -0.39 -0.02 0.00 -0.26 0.00 0.00 64.21 64.45 3d5r n SER 175 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3d5r h LEU 176 N 0.02 -0.70 -0.41 1.04 5.85 -1.43 -0.25 115.31 119.44 3d5r h LEU 176 Ca 0.00 0.12 0.08 0.00 0.84 0.00 0.00 57.88 58.92 3d5r h LEU 176 Cb 0.44 0.32 -0.07 0.00 0.37 0.00 0.00 40.66 41.73 3d5r h LEU 176 CO 0.00 -0.27 -0.00 -0.65 -0.34 0.00 0.00 178.44 177.18 3d5r h PRO 177 N -0.25 0.10 -0.31 5.25 0.11 -1.79 -1.81 132.00 133.29 3d5r h PRO 177 Ca 0.12 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.15 3d5r h PRO 177 Cb 0.43 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 3d5r h PRO 177 CO -0.33 0.07 -0.12 0.78 -0.21 0.00 0.00 178.00 178.19 3d5r h GLY 178 N 0.10 0.57 0.92 -0.55 0.00 -1.72 -2.27 103.07 100.13 3d5r h GLY 178 Ca 0.20 -0.40 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 3d5r h GLY 178 CO -0.34 0.37 0.09 0.23 0.00 0.00 0.00 176.54 176.88 3d5r h SER 179 N 0.49 0.54 -0.58 0.19 0.87 -0.49 -1.91 113.55 112.66 3d5r h SER 179 Ca 0.09 -0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.42 3d5r h SER 179 Cb 0.50 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.29 3d5r h SER 179 CO 0.03 0.63 0.38 0.40 -0.53 0.00 0.00 176.83 177.74 3d5r h ILE 180 N 0.43 1.15 0.20 2.23 2.04 -1.18 -0.34 117.51 122.04 3d5r h ILE 180 Ca 0.11 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.69 3d5r h ILE 180 Cb 0.30 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 3d5r h ILE 180 CO 0.00 0.15 -0.21 0.74 0.00 0.00 0.00 178.15 178.83 3d5r h THR 181 N 0.79 0.54 -0.95 -0.27 2.02 -1.20 0.89 112.91 114.74 3d5r h THR 181 Ca 0.21 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.45 3d5r h THR 181 Cb -0.08 0.54 -0.06 0.00 -1.74 0.00 0.00 68.15 66.81 3d5r h THR 181 CO -0.04 0.00 0.61 0.11 0.37 0.00 0.00 175.52 176.57 3d5r h LYS 182 N -0.45 1.10 -0.36 6.66 1.79 -1.09 0.51 116.57 124.72 3d5r h LYS 182 Ca 0.00 -0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.37 3d5r h LYS 182 Cb 0.42 -0.25 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 3d5r h LYS 182 CO -0.05 0.73 0.08 0.00 -1.08 0.00 0.00 179.45 179.12 3d5r h ALA 183 N 1.42 0.48 -0.78 3.86 0.00 -0.70 -2.44 119.26 121.09 3d5r h ALA 183 Ca 0.40 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.15 3d5r h ALA 183 Cb 0.12 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 3d5r h ALA 183 CO -0.16 0.16 0.50 0.78 0.00 0.00 0.00 179.25 180.53 3d5r h GLY 184 N 0.44 1.13 0.63 0.00 0.00 0.17 -1.92 103.07 103.52 3d5r h GLY 184 Ca 0.11 -0.38 0.06 0.00 0.00 0.00 0.00 47.33 47.12 3d5r h GLY 184 CO 0.00 0.33 0.25 -0.55 0.00 0.00 0.00 176.54 176.57 3d5r h ASP 185 N 0.98 0.32 0.01 0.19 3.32 -0.69 0.12 116.42 120.67 3d5r h ASP 185 Ca 0.31 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.40 3d5r h ASP 185 Cb -0.01 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3d5r h ASP 185 CO -0.11 0.22 -0.00 0.15 -1.72 0.00 0.00 179.24 177.78 3d5r h PHE 186 N 0.47 -0.01 -0.63 4.55 3.57 -0.94 -1.65 116.94 122.30 3d5r h PHE 186 Ca 0.25 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.79 3d5r h PHE 186 Cb 0.20 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.90 3d5r h PHE 186 CO -0.12 0.01 0.37 -0.07 -2.23 0.00 0.00 178.31 176.27 3d5r h LEU 187 N -0.03 0.58 -0.21 0.59 3.38 -0.82 -2.97 115.31 115.82 3d5r h LEU 187 Ca -0.00 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3d5r h LEU 187 Cb 0.03 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3d5r h LEU 187 CO 0.00 0.39 0.11 -0.08 0.09 0.00 0.00 178.44 178.95 3d5r h GLU 188 N 0.71 0.22 0.00 1.13 4.81 -0.40 -0.16 114.58 120.89 3d5r h GLU 188 Ca 0.26 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 3d5r h GLU 188 Cb 0.09 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.42 3d5r h GLU 188 CO -0.13 0.15 0.00 0.00 -0.73 0.00 0.00 179.01 178.29 3d5r n ALA 189 N -2.19 1.44 -0.25 2.92 0.00 -0.65 -2.89 120.51 118.89 3d5r n ALA 189 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3d5r n ALA 189 Cb 0.05 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.28 3d5r n ALA 189 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3d5r n ASN 190 N -1.76 0.55 -0.10 0.00 3.02 -1.07 -4.80 115.26 111.11 3d5r n ASN 190 Ca 0.02 -0.87 -0.06 0.00 -0.03 0.00 0.00 54.58 53.64 3d5r n ASN 190 Cb 0.13 0.14 0.01 0.00 -0.61 0.00 0.00 39.78 39.45 3d5r n ASN 190 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 3d5r h TYR 191 N 0.00 0.15 0.00 3.10 3.20 -0.89 -1.84 116.97 120.69 3d5r h TYR 191 Ca 0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 3d5r h TYR 191 Cb 0.12 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 3d5r h TYR 191 CO 0.00 0.04 -0.00 0.52 -1.64 0.00 0.00 178.16 177.08 3d5r h MET 192 N 0.21 0.00 -0.01 1.82 2.86 -1.87 -1.65 114.93 116.30 3d5r h MET 192 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 3d5r h MET 192 Cb 0.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.83 3d5r h MET 192 CO -0.20 0.00 -0.11 0.09 1.06 0.00 0.00 176.91 177.75 3d5r n ASN 193 N -3.64 0.72 -4.75 1.22 5.03 -0.70 -4.93 115.26 108.20 3d5r n ASN 193 Ca -0.03 -0.83 -0.37 0.00 0.87 0.00 0.00 54.58 54.22 3d5r n ASN 193 Cb 0.08 -0.01 0.03 0.00 -1.02 0.00 0.00 39.78 38.86 3d5r n ASN 193 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3d5r s LEU 194 N -2.36 3.78 0.00 3.41 1.43 -0.62 -4.95 118.68 119.36 3d5r s LEU 194 Ca 0.31 2.50 0.00 0.00 -1.03 0.00 0.00 54.13 55.91 3d5r s LEU 194 Cb 0.20 -4.44 0.00 0.00 0.03 0.00 0.00 46.19 41.98 3d5r s LEU 194 CO 0.45 -1.49 0.00 0.00 0.23 0.00 0.00 176.35 175.54 3d5r n GLN 195 N -1.24 0.55 -3.60 1.70 1.13 -1.26 -5.03 117.38 109.64 3d5r n GLN 195 Ca 0.12 0.00 -0.37 0.00 -1.94 0.00 0.00 57.00 54.81 3d5r n GLN 195 Cb 0.48 -0.97 -0.07 0.00 0.11 0.00 0.00 30.24 29.80 3d5r n GLN 195 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3d5r s ARG 196 N -1.87 4.05 0.41 -1.09 0.52 -1.26 -4.96 118.95 114.75 3d5r s ARG 196 Ca 0.00 0.10 0.07 0.00 -0.52 0.00 0.00 55.73 55.38 3d5r s ARG 196 Cb 0.00 -3.35 0.86 0.00 0.52 0.00 0.00 34.95 32.99 3d5r s ARG 196 CO 0.00 0.42 2.06 0.77 0.02 0.00 0.00 175.30 178.57 3d5r h SER 197 N 6.02 0.47 0.35 0.23 0.02 -1.95 -1.83 113.55 116.85 3d5r h SER 197 Ca -0.45 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.47 3d5r h SER 197 Cb 1.19 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.61 3d5r h SER 197 CO 0.70 0.34 -0.17 0.22 -1.14 0.00 0.00 176.83 176.77 3d5r h TYR 198 N 0.55 -0.45 -0.57 3.45 3.20 -1.89 -1.21 116.97 120.05 3d5r h TYR 198 Ca 0.15 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.96 3d5r h TYR 198 Cb -0.06 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 3d5r h TYR 198 CO 0.00 -0.28 0.15 1.15 -1.64 0.00 0.00 178.16 177.55 3d5r h THR 199 N -0.48 1.23 -0.57 1.81 2.02 -1.88 -1.22 112.91 113.82 3d5r h THR 199 Ca -0.05 -0.80 0.01 0.00 0.77 0.00 0.00 66.41 66.34 3d5r h THR 199 Cb 0.37 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 3d5r h THR 199 CO 0.07 0.30 0.37 0.58 0.37 0.00 0.00 175.52 177.22 3d5r h VAL 200 N 0.83 1.15 0.19 3.16 2.07 -1.13 0.44 116.25 122.97 3d5r h VAL 200 Ca 0.19 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 3d5r h VAL 200 Cb 0.28 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3d5r h VAL 200 CO -0.00 0.14 -0.09 0.00 0.02 0.00 0.00 177.57 177.64 3d5r h ALA 201 N 1.21 -0.26 -0.45 1.67 0.00 -0.80 0.25 119.26 120.88 3d5r h ALA 201 Ca 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3d5r h ALA 201 Cb -0.09 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3d5r h ALA 201 CO -0.04 -0.45 0.18 0.97 0.00 0.00 0.00 179.25 179.91 3d5r h ILE 202 N -0.66 1.20 -0.03 0.00 -0.00 -1.22 -1.22 117.51 115.59 3d5r h ILE 202 Ca -0.03 -0.63 -0.11 0.00 -0.00 0.00 0.00 64.86 64.10 3d5r h ILE 202 Cb 0.47 0.78 -0.01 0.00 -0.00 0.00 0.00 36.82 38.06 3d5r h ILE 202 CO 0.04 0.23 -0.48 0.00 -0.00 0.00 0.00 178.15 177.95 3d5r h ALA 203 N 1.02 1.16 -0.26 0.18 0.00 -0.96 -2.33 119.26 118.07 3d5r h ALA 203 Ca 0.15 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 3d5r h ALA 203 Cb 0.19 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3d5r h ALA 203 CO -0.01 0.61 0.12 0.78 0.00 0.00 0.00 179.25 180.75 3d5r h GLY 204 N 1.40 0.39 1.01 0.00 0.00 0.08 -0.22 103.07 105.74 3d5r h GLY 204 Ca 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.11 3d5r h GLY 204 CO 0.07 0.18 0.31 -1.82 0.00 0.00 0.00 176.54 175.27 3d5r h TYR 205 N 0.28 0.98 -0.19 5.60 3.20 -1.07 0.27 116.97 126.05 3d5r h TYR 205 Ca 0.09 -0.06 0.01 0.00 3.14 0.00 0.00 58.73 61.92 3d5r h TYR 205 Cb 0.11 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.06 3d5r h TYR 205 CO -0.02 0.75 0.08 0.00 -1.64 0.00 0.00 178.16 177.32 3d5r h ALA 206 N 1.14 0.22 -0.52 1.82 0.00 -1.12 -1.23 119.26 119.57 3d5r h ALA 206 Ca 0.23 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 3d5r h ALA 206 Cb 0.15 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3d5r h ALA 206 CO -0.03 -0.34 -0.16 -0.07 0.00 0.00 0.00 179.25 178.64 3d5r h LEU 207 N 0.18 1.04 -1.23 0.00 3.38 -0.73 -3.06 115.31 114.88 3d5r h LEU 207 Ca 0.08 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.69 3d5r h LEU 207 Cb 0.03 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.46 3d5r h LEU 207 CO -0.07 1.18 0.52 0.00 0.09 0.00 0.00 178.44 180.16 3d5r h ALA 208 N 0.90 1.45 0.00 1.53 0.00 -0.18 0.26 119.26 123.22 3d5r h ALA 208 Ca 0.13 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3d5r h ALA 208 Cb 0.74 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3d5r h ALA 208 CO 0.06 0.51 -0.09 1.96 0.00 0.00 0.00 179.25 181.69 3d5r h GLN 209 N 1.05 0.00 -0.53 0.00 4.20 -1.12 -1.68 115.11 117.04 3d5r h GLN 209 Ca 0.29 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.84 3d5r h GLN 209 Cb -0.10 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 27.58 3d5r h GLN 209 CO -0.07 0.09 0.13 0.00 -0.67 0.00 0.00 178.83 178.32 3d5r n MET 210 N -4.34 2.99 -2.85 1.46 0.00 -0.83 -4.95 117.12 108.59 3d5r n MET 210 Ca -0.03 -3.04 -0.21 0.00 0.00 0.00 0.00 57.70 54.42 3d5r n MET 210 Cb 0.17 -2.02 0.02 0.00 0.00 0.00 0.00 33.22 31.38 3d5r n MET 210 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3d5r n GLY 211 N -0.54 -0.51 0.38 3.17 0.00 -0.63 -4.89 105.19 102.18 3d5r n GLY 211 Ca 0.35 0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.49 3d5r n GLY 211 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d5r n ARG 212 N -3.63 2.87 -3.29 1.61 1.74 0.02 -4.84 116.66 111.13 3d5r n ARG 212 Ca -0.14 -1.89 -0.46 0.00 -0.77 0.00 0.00 57.85 54.58 3d5r n ARG 212 Cb 0.63 -1.20 -0.02 0.00 -1.02 0.00 0.00 32.46 30.85 3d5r n ARG 212 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3d5r s LEU 213 N -1.15 6.54 0.00 0.55 2.96 -1.22 -4.85 118.68 121.50 3d5r s LEU 213 Ca 0.15 -2.81 -0.08 0.00 -0.22 0.00 0.00 54.13 51.17 3d5r s LEU 213 Cb 0.09 -2.23 0.03 0.00 0.50 0.00 0.00 46.19 44.59 3d5r s LEU 213 CO 0.09 -0.56 0.58 2.29 -1.32 0.00 0.00 176.35 177.42 3d5r n LYS 214 N 3.96 0.83 0.00 1.98 -0.00 -1.26 -4.54 118.16 119.13 3d5r n LYS 214 Ca 0.17 -2.13 0.00 0.00 -0.00 0.00 0.00 58.31 56.35 3d5r n LYS 214 Cb 0.46 2.37 0.00 0.00 -0.00 0.00 0.00 35.03 37.86 3d5r n LYS 214 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3d5r n GLY 215 N -0.48 3.17 0.26 2.58 0.00 -1.26 -1.92 105.19 107.54 3d5r n GLY 215 Ca -0.04 -0.25 0.14 0.00 0.00 0.00 0.00 46.02 45.87 3d5r n GLY 215 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d5r h PRO 216 N 0.00 0.00 -0.15 1.61 0.13 -1.99 -2.16 132.00 129.43 3d5r h PRO 216 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 3d5r h PRO 216 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 3d5r h PRO 216 CO 0.00 0.11 -0.07 -0.07 -0.23 0.00 0.00 178.00 177.74 3d5r h LEU 217 N 0.00 0.32 -0.84 1.56 4.07 -1.76 0.69 115.31 119.35 3d5r h LEU 217 Ca -0.00 -0.41 -0.03 0.00 0.08 0.00 0.00 57.88 57.51 3d5r h LEU 217 Cb 0.51 -0.09 -0.04 0.00 1.08 0.00 0.00 40.66 42.13 3d5r h LEU 217 CO 0.01 0.66 0.39 0.25 -1.08 0.00 0.00 178.44 178.68 3d5r h LEU 218 N -0.02 1.10 -0.52 1.67 5.85 -1.33 0.88 115.31 122.95 3d5r h LEU 218 Ca 0.03 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 3d5r h LEU 218 Cb 0.54 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 3d5r h LEU 218 CO 0.02 0.94 0.30 -1.13 -0.34 0.00 0.00 178.44 178.23 3d5r h ASN 219 N 1.20 0.63 0.17 1.25 -1.24 -1.17 0.61 115.58 117.01 3d5r h ASN 219 Ca 0.29 -0.07 -0.00 0.00 0.71 0.00 0.00 56.30 57.23 3d5r h ASN 219 Cb 0.13 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 3d5r h ASN 219 CO -0.03 0.51 -0.11 0.50 -1.29 0.00 0.00 177.43 177.00 3d5r h LYS 220 N 0.69 -0.27 -0.26 6.67 3.64 -0.23 -0.30 116.57 126.52 3d5r h LYS 220 Ca 0.18 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.65 3d5r h LYS 220 Cb 0.00 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.82 3d5r h LYS 220 CO -0.03 -0.18 -0.22 0.35 -2.27 0.00 0.00 179.45 177.10 3d5r h PHE 221 N -0.28 -0.57 -0.23 1.91 3.57 -0.43 -1.14 116.94 119.77 3d5r h PHE 221 Ca -0.01 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 3d5r h PHE 221 Cb 0.24 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 3d5r h PHE 221 CO -0.10 -0.30 0.03 -0.07 -2.23 0.00 0.00 178.31 175.65 3d5r h LEU 222 N -0.21 0.37 -0.82 0.59 3.38 -0.77 -3.05 115.31 114.79 3d5r h LEU 222 Ca 0.14 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3d5r h LEU 222 Cb 0.43 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3d5r h LEU 222 CO -0.38 0.54 0.00 0.71 0.09 0.00 0.00 178.44 179.40 3d5r h THR 223 N 0.18 0.00 0.00 0.22 1.35 -0.82 -2.71 112.91 111.13 3d5r h THR 223 Ca 0.07 -0.24 -0.09 0.00 -0.55 0.00 0.00 66.41 65.61 3d5r h THR 223 Cb 0.34 0.97 -0.01 0.00 -1.73 0.00 0.00 68.15 67.72 3d5r h THR 223 CO 0.01 0.00 -0.42 0.74 -0.25 0.00 0.00 175.52 175.60 3d5r h THR 224 N 0.00 1.02 -4.03 6.82 2.02 -1.09 -3.45 112.91 114.20 3d5r h THR 224 Ca 0.00 -1.58 -0.55 0.00 0.77 0.00 0.00 66.41 65.05 3d5r h THR 224 Cb 0.35 1.93 0.13 0.00 -1.74 0.00 0.00 68.15 68.82 3d5r h THR 224 CO 0.00 0.41 0.65 0.00 0.37 0.00 0.00 175.52 176.95 3d5r s ALA 225 N -3.69 2.99 -0.19 6.16 0.00 -1.02 -4.80 121.76 121.21 3d5r s ALA 225 Ca -0.01 1.40 -0.17 0.00 0.00 0.00 0.00 51.96 53.18 3d5r s ALA 225 Cb 0.12 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 3d5r s ALA 225 CO 0.70 -1.32 0.44 0.15 0.00 0.00 0.00 175.76 175.73 3d5r s LYS 226 N -2.73 4.21 -1.55 0.00 -0.14 0.17 -4.07 119.74 115.64 3d5r s LYS 226 Ca 0.67 0.30 0.00 0.00 -1.36 0.00 0.00 55.97 55.58 3d5r s LYS 226 Cb -0.42 -3.52 0.00 0.00 -1.68 0.00 0.00 37.83 32.21 3d5r s LYS 226 CO 0.52 -0.02 0.00 -0.25 -0.76 0.00 0.00 175.35 174.83 3d5r n ASP 227 N 4.39 -4.34 -1.48 2.83 8.00 -1.26 -1.77 116.55 122.91 3d5r n ASP 227 Ca -0.07 0.29 -0.18 0.00 0.71 0.00 0.00 54.79 55.54 3d5r n ASP 227 Cb 0.51 -3.84 -0.08 0.00 -0.02 0.00 0.00 41.12 37.69 3d5r n ASP 227 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3d5r n LYS 228 N -2.35 -1.42 0.00 -1.24 5.02 -1.26 -4.76 118.16 112.15 3d5r n LYS 228 Ca -0.17 1.07 0.00 0.00 -2.02 0.00 0.00 58.31 57.19 3d5r n LYS 228 Cb 0.56 -5.41 0.00 0.00 -0.02 0.00 0.00 35.03 30.17 3d5r n LYS 228 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3d5r n ASN 229 N -1.08 0.24 -3.49 4.39 2.04 -0.73 -4.44 115.26 112.19 3d5r n ASN 229 Ca -0.18 -0.70 -0.14 0.00 -0.44 0.00 0.00 54.58 53.13 3d5r n ASN 229 Cb 0.60 0.14 -0.04 0.00 -2.53 0.00 0.00 39.78 37.95 3d5r n ASN 229 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3d5r s ARG 230 N -0.14 1.16 -0.33 -3.83 1.70 -1.13 -4.16 118.95 112.23 3d5r s ARG 230 Ca 0.00 -0.27 0.01 0.00 -0.47 0.00 0.00 55.73 54.99 3d5r s ARG 230 Cb 0.00 0.54 0.08 0.00 -0.57 0.00 0.00 34.95 35.00 3d5r s ARG 230 CO 0.00 -0.46 0.04 -1.58 -1.08 0.00 0.00 175.30 172.22 3d5r s TRP 231 N -2.89 3.48 0.13 5.89 0.51 -1.26 0.46 118.94 125.27 3d5r s TRP 231 Ca -0.03 -2.41 0.04 0.00 -2.12 0.00 0.00 56.10 51.58 3d5r s TRP 231 Cb -0.01 -2.56 -0.04 0.00 -0.81 0.00 0.00 33.47 30.05 3d5r s TRP 231 CO -0.05 -0.90 -0.08 -1.83 -0.51 0.00 0.00 176.95 173.57 3d5r s GLU 232 N 1.10 1.00 0.12 4.98 -1.05 -1.26 -4.12 118.70 119.46 3d5r s GLU 232 Ca 0.02 -1.42 0.01 0.00 -0.15 0.00 0.00 54.97 53.42 3d5r s GLU 232 Cb -0.20 -0.48 -0.04 0.00 -0.44 0.00 0.00 34.13 32.96 3d5r s GLU 232 CO -0.05 0.03 -0.02 -0.51 0.95 0.00 0.00 175.26 175.66 3d5r s ASP 233 N -3.13 0.98 -0.40 0.83 1.01 -1.26 -4.61 116.67 110.10 3d5r s ASP 233 Ca 0.16 -1.08 -0.29 0.00 0.71 0.00 0.00 52.55 52.05 3d5r s ASP 233 Cb 0.04 0.14 0.01 0.00 1.01 0.00 0.00 42.92 44.11 3d5r s ASP 233 CO -0.01 -0.55 1.42 -2.16 0.21 0.00 0.00 175.17 174.08 3d5r s PRO 234 N -3.90 3.60 0.00 8.23 0.04 -1.26 -4.79 135.00 136.93 3d5r s PRO 234 Ca 0.17 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.20 3d5r s PRO 234 Cb 0.06 -4.02 0.00 0.00 0.04 0.00 0.00 34.50 30.58 3d5r s PRO 234 CO -0.02 -1.53 0.00 0.41 0.04 0.00 0.00 177.00 175.90 3d5r n GLY 235 N 5.01 -0.63 3.76 0.56 0.00 -1.26 -5.12 105.19 107.51 3d5r n GLY 235 Ca 0.17 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 3d5r n GLY 235 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d5r s LYS 236 N -0.64 4.23 0.46 1.61 -0.14 -1.26 -4.89 119.74 119.12 3d5r s LYS 236 Ca 0.00 2.39 0.14 0.00 -1.36 0.00 0.00 55.97 57.14 3d5r s LYS 236 Cb 0.00 -3.05 1.05 0.00 -1.68 0.00 0.00 37.83 34.15 3d5r s LYS 236 CO 0.00 -0.42 2.03 1.96 -0.76 0.00 0.00 175.35 178.16 3d5r h GLN 237 N 4.07 0.03 -0.70 1.68 1.08 -2.00 -2.51 115.11 116.76 3d5r h GLN 237 Ca -0.48 -0.00 0.07 0.00 -1.45 0.00 0.00 58.65 56.78 3d5r h GLN 237 Cb 1.23 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.61 3d5r h GLN 237 CO 0.71 0.15 0.46 -0.07 -0.95 0.00 0.00 178.83 179.14 3d5r h LEU 238 N 0.03 0.61 -0.91 1.46 3.38 -1.98 -1.15 115.31 116.76 3d5r h LEU 238 Ca 0.01 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 3d5r h LEU 238 Cb 0.23 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3d5r h LEU 238 CO 0.02 0.39 -0.17 1.88 0.09 0.00 0.00 178.44 180.65 3d5r h TYR 239 N 0.69 0.68 -0.17 1.13 0.05 -1.83 -1.54 116.97 115.98 3d5r h TYR 239 Ca 0.31 -0.13 -0.17 0.00 0.05 0.00 0.00 58.73 58.79 3d5r h TYR 239 Cb 0.31 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 3d5r h TYR 239 CO -0.00 0.74 -0.58 -0.91 -1.05 0.00 0.00 178.16 176.36 3d5r h ASN 240 N 0.55 0.61 -0.62 3.88 2.35 -1.31 0.22 115.58 121.26 3d5r h ASN 240 Ca 0.09 -0.34 -0.09 0.00 -0.55 0.00 0.00 56.30 55.41 3d5r h ASN 240 Cb 0.60 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 3d5r h ASN 240 CO 0.04 1.06 0.05 0.58 -1.65 0.00 0.00 177.43 177.51 3d5r h VAL 241 N 0.41 1.26 -0.14 2.81 2.07 -1.12 0.82 116.25 122.37 3d5r h VAL 241 Ca 0.00 -1.10 -0.04 0.00 0.82 0.00 0.00 66.70 66.39 3d5r h VAL 241 Cb 1.13 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 3d5r h VAL 241 CO 0.11 0.40 -0.06 -0.08 0.02 0.00 0.00 177.57 177.96 3d5r h GLU 242 N 0.97 0.30 -0.01 1.57 4.81 -1.10 -2.16 114.58 118.95 3d5r h GLU 242 Ca 0.18 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3d5r h GLU 242 Cb 0.51 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 3d5r h GLU 242 CO 0.02 0.61 -0.02 0.00 -0.73 0.00 0.00 179.01 178.90 3d5r h ALA 243 N 0.68 -0.01 0.00 2.92 0.00 -0.41 -1.36 119.26 121.09 3d5r h ALA 243 Ca 0.03 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3d5r h ALA 243 Cb 0.51 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3d5r h ALA 243 CO 0.02 -0.51 -0.13 1.15 0.00 0.00 0.00 179.25 179.78 3d5r h THR 244 N -0.03 0.92 -0.24 0.00 2.02 -0.87 0.06 112.91 114.78 3d5r h THR 244 Ca 0.01 -0.48 -0.19 0.00 0.77 0.00 0.00 66.41 66.52 3d5r h THR 244 Cb 0.04 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 3d5r h THR 244 CO -0.02 0.13 -0.61 0.28 0.37 0.00 0.00 175.52 175.67 3d5r h SER 245 N 0.00 0.90 -0.56 4.18 0.02 -0.83 0.07 113.55 117.32 3d5r h SER 245 Ca -0.00 -0.51 -0.09 0.00 -0.84 0.00 0.00 61.79 60.36 3d5r h SER 245 Cb 0.26 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 3d5r h SER 245 CO 0.02 1.29 0.03 1.88 -1.14 0.00 0.00 176.83 178.91 3d5r h TYR 246 N 0.59 1.07 -0.80 3.45 0.05 -0.24 -1.91 116.97 119.18 3d5r h TYR 246 Ca -0.00 -0.17 -0.04 0.00 0.05 0.00 0.00 58.73 58.57 3d5r h TYR 246 Cb 1.21 -0.29 -0.04 0.00 1.01 0.00 0.00 36.73 38.63 3d5r h TYR 246 CO 0.07 0.94 0.33 0.00 -1.05 0.00 0.00 178.16 178.45 3d5r h ALA 247 N 1.10 1.03 -0.59 3.88 0.00 -0.75 -1.05 119.26 122.87 3d5r h ALA 247 Ca 0.17 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3d5r h ALA 247 Cb 0.50 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3d5r h ALA 247 CO 0.02 0.65 0.28 1.25 0.00 0.00 0.00 179.25 181.46 3d5r h LEU 248 N 1.15 0.77 -1.42 0.00 5.85 -0.60 -0.40 115.31 120.66 3d5r h LEU 248 Ca 0.27 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 3d5r h LEU 248 Cb 0.20 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 3d5r h LEU 248 CO -0.02 0.69 0.07 -0.07 -0.34 0.00 0.00 178.44 178.76 3d5r h LEU 249 N 0.80 0.41 -0.10 2.25 3.38 -0.91 -0.28 115.31 120.86 3d5r h LEU 249 Ca 0.20 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 3d5r h LEU 249 Cb 0.12 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 3d5r h LEU 249 CO -0.03 0.43 -0.05 0.00 0.09 0.00 0.00 178.44 178.88 3d5r h ALA 250 N 1.63 0.14 -0.88 1.53 0.00 -0.43 -1.75 119.26 119.51 3d5r h ALA 250 Ca 0.11 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.81 3d5r h ALA 250 Cb 0.19 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 3d5r h ALA 250 CO -0.00 -0.09 0.56 -0.07 0.00 0.00 0.00 179.25 179.65 3d5r h LEU 251 N -0.15 0.93 -0.91 0.00 3.38 -0.62 0.02 115.31 117.96 3d5r h LEU 251 Ca 0.02 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 3d5r h LEU 251 Cb 0.50 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3d5r h LEU 251 CO 0.01 0.63 0.07 -0.07 0.09 0.00 0.00 178.44 179.17 3d5r h LEU 252 N 1.08 0.82 -1.07 1.67 3.38 -0.99 0.12 115.31 120.31 3d5r h LEU 252 Ca 0.36 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 58.07 3d5r h LEU 252 Cb 0.04 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3d5r h LEU 252 CO -0.13 0.85 -0.12 -0.61 0.09 0.00 0.00 178.44 178.52 3d5r h GLN 253 N 0.82 0.52 0.00 1.13 5.75 -0.33 -2.29 115.11 120.70 3d5r h GLN 253 Ca 0.17 -0.15 -0.01 0.00 -0.15 0.00 0.00 58.65 58.50 3d5r h GLN 253 Cb 0.39 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 28.89 3d5r h GLN 253 CO 0.01 0.63 -0.15 -0.07 -2.65 0.00 0.00 178.83 176.61 3d5r h LEU 254 N 0.48 0.00 0.72 -2.39 3.38 -0.37 -3.48 115.31 113.65 3d5r h LEU 254 Ca 0.09 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.92 3d5r h LEU 254 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3d5r h LEU 254 CO 0.03 0.07 -0.18 0.29 0.09 0.00 0.00 178.44 178.73 3d5r n LYS 255 N -3.09 -0.84 -2.28 1.13 5.02 0.32 -4.94 118.16 113.48 3d5r n LYS 255 Ca 0.03 0.33 -0.42 0.00 -2.02 0.00 0.00 58.31 56.23 3d5r n LYS 255 Cb 0.56 -4.14 0.00 0.00 -0.02 0.00 0.00 35.03 31.43 3d5r n LYS 255 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3d5r n ASP 256 N 0.58 5.66 0.00 4.39 -0.08 -0.66 -4.76 116.55 121.68 3d5r n ASP 256 Ca -0.07 -3.12 0.06 0.00 -1.51 0.00 0.00 54.79 50.15 3d5r n ASP 256 Cb 0.56 -1.45 0.34 0.00 2.34 0.00 0.00 41.12 42.91 3d5r n ASP 256 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3d5r n PHE 257 N 3.40 0.00 0.05 -0.67 3.72 -1.26 -2.19 117.46 120.51 3d5r n PHE 257 Ca 0.43 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.74 3d5r n PHE 257 Cb 0.34 -0.24 -0.13 0.00 -0.94 0.00 0.00 39.48 38.51 3d5r n PHE 257 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3d5r h ASP 258 N 0.00 0.11 0.91 4.37 5.19 -1.98 -3.31 116.42 121.71 3d5r h ASP 258 Ca 0.00 -0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.28 3d5r h ASP 258 Cb 0.11 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.58 3d5r h ASP 258 CO 0.00 1.11 -0.80 0.15 -3.12 0.00 0.00 179.24 176.58 3d5r h PHE 259 N 0.02 0.00 0.14 4.55 3.04 -1.85 -3.41 116.94 119.43 3d5r h PHE 259 Ca -0.12 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.82 3d5r h PHE 259 Cb 1.88 0.00 0.00 0.00 2.56 0.00 0.00 35.95 40.39 3d5r h PHE 259 CO 0.02 0.00 -0.07 0.28 -2.02 0.00 0.00 178.31 176.52 3d5r h VAL 260 N 0.00 0.97 -0.88 1.41 2.07 -1.60 -3.34 116.25 114.88 3d5r h VAL 260 Ca 0.00 -0.52 0.21 0.00 0.82 0.00 0.00 66.70 67.21 3d5r h VAL 260 Cb 0.86 1.30 -0.16 0.00 -1.52 0.00 0.00 31.29 31.76 3d5r h VAL 260 CO 0.00 0.12 -0.03 -0.65 0.02 0.00 0.00 177.57 177.04 3d5r h PRO 261 N -0.44 0.05 -0.59 1.57 0.11 -1.79 -0.21 132.00 130.69 3d5r h PRO 261 Ca -0.02 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.03 3d5r h PRO 261 Cb 0.35 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.42 3d5r h PRO 261 CO 0.03 0.03 0.16 -1.35 -0.21 0.00 0.00 178.00 176.66 3d5r h PRO 262 N 0.05 0.91 -0.11 1.05 0.11 -1.87 -0.68 132.00 131.47 3d5r h PRO 262 Ca 0.49 -0.19 -0.02 0.00 0.11 0.00 0.00 66.00 66.40 3d5r h PRO 262 Cb 0.91 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.88 3d5r h PRO 262 CO -0.81 0.81 0.00 0.28 -0.21 0.00 0.00 178.00 178.07 3d5r h VAL 263 N 0.88 1.24 -0.86 3.15 2.07 -1.22 -0.38 116.25 121.14 3d5r h VAL 263 Ca 0.19 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 3d5r h VAL 263 Cb 0.30 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 3d5r h VAL 263 CO -0.00 0.22 0.45 0.58 0.02 0.00 0.00 177.57 178.84 3d5r h VAL 264 N -0.08 1.26 -0.57 2.57 2.07 -1.15 -1.13 116.25 119.22 3d5r h VAL 264 Ca 0.03 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 3d5r h VAL 264 Cb 0.34 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 3d5r h VAL 264 CO 0.00 0.30 0.33 0.03 0.02 0.00 0.00 177.57 178.25 3d5r h ARG 265 N 1.21 0.79 -0.10 1.57 3.08 -0.93 -1.17 114.38 118.82 3d5r h ARG 265 Ca 0.30 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.26 3d5r h ARG 265 Cb 0.06 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 29.95 3d5r h ARG 265 CO -0.04 0.59 0.06 2.35 -1.07 0.00 0.00 179.97 181.85 3d5r h TRP 266 N 0.77 0.14 -0.34 3.04 7.01 -0.54 -0.50 115.95 125.53 3d5r h TRP 266 Ca 0.20 -0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.25 3d5r h TRP 266 Cb 0.02 -0.05 -0.05 0.00 -2.10 0.00 0.00 29.16 26.99 3d5r h TRP 266 CO -0.02 0.15 0.05 -0.07 -2.79 0.00 0.00 178.44 175.77 3d5r h LEU 267 N 0.09 -0.02 -0.70 0.65 3.38 -0.97 -1.99 115.31 115.75 3d5r h LEU 267 Ca 0.04 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3d5r h LEU 267 Cb 0.05 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3d5r h LEU 267 CO -0.01 0.03 0.36 0.78 0.09 0.00 0.00 178.44 179.69 3d5r h ASN 268 N 0.17 0.90 0.20 -0.43 2.35 -1.05 -1.80 115.58 115.93 3d5r h ASN 268 Ca 0.16 -0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3d5r h ASN 268 Cb 0.19 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3d5r h ASN 268 CO -0.22 0.76 0.00 -0.33 -1.65 0.00 0.00 177.43 175.99 3d5r h GLU 269 N 0.98 0.00 0.00 0.81 5.08 -0.46 0.08 114.58 121.07 3d5r h GLU 269 Ca 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 3d5r h GLU 269 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 3d5r h GLU 269 CO -0.03 0.00 0.00 1.96 -1.00 0.00 0.00 179.01 179.94 3d5r h GLN 270 N 0.00 0.00 -6.68 2.33 1.08 -0.62 -3.47 115.11 107.76 3d5r h GLN 270 Ca 0.00 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.66 3d5r h GLN 270 Cb 0.10 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.47 3d5r h GLN 270 CO 0.00 0.00 -0.94 0.54 -0.95 0.00 0.00 178.83 177.48 3d5r n ARG 271 N -2.88 -1.81 -3.57 1.46 1.74 0.01 -4.91 116.66 106.70 3d5r n ARG 271 Ca 0.03 0.28 -0.40 0.00 -0.77 0.00 0.00 57.85 56.99 3d5r n ARG 271 Cb 0.43 -3.87 -0.11 0.00 -1.02 0.00 0.00 32.46 27.89 3d5r n ARG 271 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3d5r s TYR 272 N -3.91 3.21 -0.20 -1.55 5.04 -1.26 -4.95 117.35 113.73 3d5r s TYR 272 Ca 0.17 -0.31 0.16 0.00 -2.44 0.00 0.00 57.07 54.64 3d5r s TYR 272 Cb -0.08 -2.44 0.55 0.00 0.35 0.00 0.00 41.96 40.35 3d5r s TYR 272 CO 0.93 -0.38 1.46 0.66 -1.34 0.00 0.00 175.55 176.87 3d5r n TYR 273 N 5.07 1.08 -1.56 4.97 4.01 -1.26 -5.06 117.16 124.41 3d5r n TYR 273 Ca -0.13 -0.96 0.14 0.00 -0.16 0.00 0.00 57.90 56.80 3d5r n TYR 273 Cb 0.50 -0.36 -0.04 0.00 -0.31 0.00 0.00 39.34 39.13 3d5r n TYR 273 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3d5r n GLY 274 N -0.51 -1.89 0.00 2.72 0.00 -1.26 -4.88 105.19 99.37 3d5r n GLY 274 Ca 0.24 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 45.04 3d5r n GLY 274 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d5r n GLY 275 N -3.25 -0.33 0.00 -0.02 0.00 -1.26 -5.00 105.19 95.33 3d5r n GLY 275 Ca 0.01 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.47 3d5r n GLY 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d5r n GLY 276 N 0.15 1.14 3.60 -0.02 0.00 -1.26 -4.71 105.19 104.09 3d5r n GLY 276 Ca 0.00 -1.89 -0.52 0.00 0.00 0.00 0.00 46.02 43.61 3d5r n GLY 276 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3d5r n TYR 277 N 1.37 1.60 -1.16 1.61 9.36 -1.26 -1.76 117.16 126.92 3d5r n TYR 277 Ca 0.00 0.61 -0.06 0.00 3.32 0.00 0.00 57.90 61.77 3d5r n TYR 277 Cb 0.00 -2.35 -0.02 0.00 -0.63 0.00 0.00 39.34 36.33 3d5r n TYR 277 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3d5r n GLY 278 N 2.68 0.73 0.39 2.98 0.00 -1.26 -4.90 105.19 105.81 3d5r n GLY 278 Ca 0.19 -0.23 0.12 0.00 0.00 0.00 0.00 46.02 46.09 3d5r n GLY 278 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d5r n SER 279 N -0.23 1.61 -0.13 1.61 3.41 -0.72 -4.70 113.62 114.47 3d5r n SER 279 Ca -0.06 -1.26 -0.08 0.00 -0.26 0.00 0.00 58.87 57.21 3d5r n SER 279 Cb 0.33 0.34 -0.06 0.00 -0.26 0.00 0.00 64.21 64.56 3d5r n SER 279 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3d5r h THR 280 N 1.92 0.00 -0.67 6.66 2.02 -1.83 0.35 112.91 121.35 3d5r h THR 280 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 3d5r h THR 280 Cb 0.65 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 3d5r h THR 280 CO 0.00 0.00 0.33 1.56 0.37 0.00 0.00 175.52 177.78 3d5r h GLN 281 N -0.19 0.97 -0.56 6.66 1.08 -1.84 -1.64 115.11 119.60 3d5r h GLN 281 Ca 0.06 -0.14 -0.06 0.00 -1.45 0.00 0.00 58.65 57.06 3d5r h GLN 281 Cb 0.34 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.57 3d5r h GLN 281 CO -0.42 0.77 0.11 0.00 -0.95 0.00 0.00 178.83 178.34 3d5r h ALA 282 N 1.15 1.14 0.11 3.87 0.00 -1.74 -0.55 119.26 123.24 3d5r h ALA 282 Ca 0.23 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3d5r h ALA 282 Cb 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3d5r h ALA 282 CO -0.03 0.57 -0.05 1.15 0.00 0.00 0.00 179.25 180.89 3d5r h THR 283 N 0.84 1.09 -0.17 0.00 2.02 -0.11 -1.69 112.91 114.90 3d5r h THR 283 Ca 0.18 -0.96 0.02 0.00 0.77 0.00 0.00 66.41 66.41 3d5r h THR 283 Cb 0.34 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 3d5r h THR 283 CO 0.00 0.23 0.05 0.15 0.37 0.00 0.00 175.52 176.32 3d5r h PHE 284 N -0.61 0.10 -0.17 3.16 3.04 -1.24 -3.01 116.94 118.21 3d5r h PHE 284 Ca -0.02 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.89 3d5r h PHE 284 Cb 0.48 -0.02 -0.00 0.00 2.56 0.00 0.00 35.95 38.97 3d5r h PHE 284 CO 0.07 0.05 -0.12 0.52 -2.02 0.00 0.00 178.31 176.81 3d5r h MET 285 N 0.13 0.38 -0.82 1.11 2.86 -1.16 -1.20 114.93 116.24 3d5r h MET 285 Ca 0.07 -0.18 0.05 0.00 -2.06 0.00 0.00 59.70 57.58 3d5r h MET 285 Cb 0.05 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.65 3d5r h MET 285 CO -0.08 0.72 0.51 -0.24 1.06 0.00 0.00 176.91 178.88 3d5r h VAL 286 N 0.05 1.07 0.00 -2.22 3.04 -1.35 0.19 116.25 117.03 3d5r h VAL 286 Ca 0.03 -0.33 -0.11 0.00 -1.01 0.00 0.00 66.70 65.29 3d5r h VAL 286 Cb 0.62 0.02 -0.02 0.00 -2.01 0.00 0.00 31.29 29.91 3d5r h VAL 286 CO 0.03 0.18 -0.57 -0.26 -1.01 0.00 0.00 177.57 175.94 3d5r h PHE 287 N 0.96 0.00 -0.29 3.17 0.04 -1.54 -0.24 116.94 119.05 3d5r h PHE 287 Ca 0.35 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.97 3d5r h PHE 287 Cb 0.10 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.25 3d5r h PHE 287 CO -0.03 0.50 -0.39 0.37 -0.60 0.00 0.00 178.31 178.16 3d5r h GLN 288 N 0.00 0.77 -0.24 1.51 4.15 -0.84 -1.13 115.11 119.33 3d5r h GLN 288 Ca -0.02 -0.44 -0.05 0.00 0.77 0.00 0.00 58.65 58.91 3d5r h GLN 288 Cb 1.39 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 29.11 3d5r h GLN 288 CO 0.06 1.07 -0.04 0.00 -1.93 0.00 0.00 178.83 178.00 3d5r h ALA 289 N 0.69 0.33 -0.38 3.38 0.00 -0.91 -0.83 119.26 121.55 3d5r h ALA 289 Ca 0.03 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 3d5r h ALA 289 Cb 0.98 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 3d5r h ALA 289 CO 0.09 0.11 -0.24 -0.07 0.00 0.00 0.00 179.25 179.14 3d5r h LEU 290 N 0.21 0.77 -0.31 0.00 3.38 -1.05 -0.52 115.31 117.79 3d5r h LEU 290 Ca 0.06 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 3d5r h LEU 290 Cb 0.49 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3d5r h LEU 290 CO 0.02 0.99 0.12 0.00 0.09 0.00 0.00 178.44 179.66 3d5r h ALA 291 N 1.07 0.41 -0.77 1.53 0.00 -1.14 -0.49 119.26 119.86 3d5r h ALA 291 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3d5r h ALA 291 Cb 0.75 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 3d5r h ALA 291 CO 0.06 0.01 0.48 0.37 0.00 0.00 0.00 179.25 180.17 3d5r h GLN 292 N 0.35 1.03 0.04 0.00 5.75 -0.93 0.44 115.11 121.80 3d5r h GLN 292 Ca 0.10 -0.08 0.02 0.00 -0.15 0.00 0.00 58.65 58.54 3d5r h GLN 292 Cb 0.19 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.49 3d5r h GLN 292 CO -0.01 0.71 -0.16 -0.92 -2.65 0.00 0.00 178.83 175.80 3d5r h TYR 293 N 1.05 -0.43 -0.92 3.99 3.20 -0.73 0.18 116.97 123.31 3d5r h TYR 293 Ca 0.28 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.23 3d5r h TYR 293 Cb -0.07 0.19 -0.07 0.00 1.54 0.00 0.00 36.73 38.32 3d5r h TYR 293 CO -0.01 -0.24 0.58 1.96 -1.64 0.00 0.00 178.16 178.80 3d5r h GLN 294 N -0.29 1.00 -0.17 1.82 1.08 -0.60 -0.93 115.11 117.02 3d5r h GLN 294 Ca 0.04 -0.06 -0.04 0.00 -1.45 0.00 0.00 58.65 57.14 3d5r h GLN 294 Cb 0.34 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.54 3d5r h GLN 294 CO -0.13 0.66 -0.05 -0.22 -0.95 0.00 0.00 178.83 178.14 3d5r h LYS 295 N 1.03 0.34 0.00 1.46 3.64 -0.13 -3.41 116.57 119.51 3d5r h LYS 295 Ca 0.41 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 3d5r h LYS 295 Cb 0.22 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3d5r h LYS 295 CO -0.19 0.62 -0.49 -0.25 -2.27 0.00 0.00 179.45 176.87 3d5r n ASP 296 N -4.65 1.59 -1.84 4.20 8.00 0.56 -5.01 116.55 119.40 3d5r n ASP 296 Ca -0.05 0.55 -0.22 0.00 0.71 0.00 0.00 54.79 55.78 3d5r n ASP 296 Cb 0.28 -0.81 -0.02 0.00 -0.02 0.00 0.00 41.12 40.55 3d5r n ASP 296 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3d5r n ALA 297 N -3.55 -1.79 0.62 2.24 0.00 -0.37 -5.08 120.51 112.58 3d5r n ALA 297 Ca -0.07 0.21 0.05 0.00 0.00 0.00 0.00 53.44 53.63 3d5r n ALA 297 Cb 0.26 -0.69 0.29 0.00 0.00 0.00 0.00 19.45 19.31 3d5r n ALA 297 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20