#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r15 s VAL 2 N 0.00 5.34 0.57 9.51 0.11 -1.26 -1.38 120.40 133.29 1r15 s VAL 2 Ca 0.00 0.43 -0.19 0.00 -2.93 0.00 0.00 61.98 59.29 1r15 s VAL 2 Cb 0.00 -3.58 -0.04 0.00 -1.53 0.00 0.00 36.38 31.22 1r15 s VAL 2 CO 0.00 0.40 1.16 -2.16 -3.33 0.00 0.00 175.10 171.17 1r15 s PRO 3 N 0.50 3.15 0.29 1.54 0.04 -1.26 -4.82 135.00 134.44 1r15 s PRO 3 Ca 0.14 1.68 -0.30 0.00 0.04 0.00 0.00 61.00 62.56 1r15 s PRO 3 Cb -0.12 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.34 1r15 s PRO 3 CO 0.02 -1.03 1.50 0.99 0.04 0.00 0.00 177.00 178.52 1r15 s THR 4 N -1.74 2.33 0.54 1.26 2.01 0.77 -4.94 115.64 115.86 1r15 s THR 4 Ca 0.74 0.29 -0.18 0.00 0.31 0.00 0.00 61.69 62.85 1r15 s THR 4 Cb -0.26 -3.19 -0.06 0.00 0.01 0.00 0.00 72.50 69.00 1r15 s THR 4 CO 0.30 0.05 1.05 -0.13 -0.69 0.00 0.00 174.62 175.21 1r15 s ARG 5 N -0.82 3.57 -1.54 4.92 0.52 -1.26 -3.80 118.95 120.53 1r15 s ARG 5 Ca 0.59 1.29 -0.02 0.00 -0.52 0.00 0.00 55.73 57.07 1r15 s ARG 5 Cb -0.45 -2.06 0.02 0.00 0.52 0.00 0.00 34.95 32.98 1r15 s ARG 5 CO 0.49 -0.62 0.16 0.39 0.02 0.00 0.00 175.30 175.74 1r15 n GLU 6 N -1.48 -1.56 -0.32 3.54 1.02 -1.26 -4.72 120.64 115.86 1r15 n GLU 6 Ca 0.09 0.18 -0.05 0.00 -0.02 0.00 0.00 57.16 57.36 1r15 n GLU 6 Cb 0.53 -3.92 0.00 0.00 -0.02 0.00 0.00 31.44 28.02 1r15 n GLU 6 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1r15 h LEU 7 N -1.74 -1.49 -0.52 -4.62 5.85 -1.96 -0.09 115.31 110.74 1r15 h LEU 7 Ca -0.65 0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.41 1r15 h LEU 7 Cb 1.39 0.73 -0.08 0.00 0.37 0.00 0.00 40.66 43.07 1r15 h LEU 7 CO 0.70 -0.29 -0.49 -0.33 -0.34 0.00 0.00 178.44 177.69 1r15 h GLU 8 N -0.08 -0.23 -0.40 1.25 4.39 -1.94 0.21 114.58 117.79 1r15 h GLU 8 Ca 0.27 0.02 0.02 0.00 0.34 0.00 0.00 59.36 60.00 1r15 h GLU 8 Cb 0.56 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.23 1r15 h GLU 8 CO -0.86 -0.15 0.24 -0.91 -1.16 0.00 0.00 179.01 176.17 1r15 h ASN 9 N -0.23 0.39 -0.32 1.42 2.35 -1.55 0.82 115.58 118.46 1r15 h ASN 9 Ca 0.09 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.86 1r15 h ASN 9 Cb 0.46 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.72 1r15 h ASN 9 CO -0.61 0.28 0.15 0.58 -1.65 0.00 0.00 177.43 176.18 1r15 h VAL 10 N 0.48 0.97 0.37 2.81 2.07 -0.43 0.63 116.25 123.15 1r15 h VAL 10 Ca 0.16 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1r15 h VAL 10 Cb -0.00 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1r15 h VAL 10 CO -0.07 0.06 -0.36 0.15 0.02 0.00 0.00 177.57 177.37 1r15 h PHE 11 N 0.31 -0.97 -0.54 1.57 3.04 -0.14 0.31 116.94 120.53 1r15 h PHE 11 Ca 0.13 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.08 1r15 h PHE 11 Cb 0.06 0.37 -0.03 0.00 2.56 0.00 0.00 35.95 38.92 1r15 h PHE 11 CO -0.11 -0.50 0.28 -0.07 -2.02 0.00 0.00 178.31 175.89 1r15 h LEU 12 N -0.75 0.66 -0.02 0.59 3.38 -0.45 0.23 115.31 118.95 1r15 h LEU 12 Ca -0.03 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1r15 h LEU 12 Cb 0.67 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1r15 h LEU 12 CO -0.06 0.55 -0.01 1.23 0.09 0.00 0.00 178.44 180.24 1r15 h GLY 13 N 0.83 0.04 1.41 0.83 0.00 0.69 0.06 103.07 106.93 1r15 h GLY 13 Ca 0.19 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.46 1r15 h GLY 13 CO -0.03 0.04 0.25 3.21 0.00 0.00 0.00 176.54 180.01 1r15 h ARG 14 N -0.36 0.77 0.22 4.80 3.08 0.04 -0.20 114.38 122.73 1r15 h ARG 14 Ca 0.00 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1r15 h ARG 14 Cb 0.43 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1r15 h ARG 14 CO 0.00 0.60 -0.10 0.00 -1.07 0.00 0.00 179.97 179.40 1r15 h LYS 16 N -0.48 0.52 -0.75 0.00 1.63 -0.67 0.42 116.57 117.24 1r15 h LYS 16 Ca -0.03 -0.03 0.10 0.00 -0.85 0.00 0.00 60.65 59.84 1r15 h LYS 16 Cb 0.36 -0.12 -0.07 0.00 -0.60 0.00 0.00 32.23 31.80 1r15 h LYS 16 CO 0.05 0.34 0.39 0.22 -3.45 0.00 0.00 179.45 177.01 1r15 h ASP 17 N 0.54 0.52 0.70 4.20 3.58 -0.93 -1.48 116.42 123.54 1r15 h ASP 17 Ca 0.14 0.06 -0.03 0.00 0.42 0.00 0.00 57.03 57.62 1r15 h ASP 17 Cb -0.06 -0.03 0.01 0.00 1.72 0.00 0.00 39.33 40.96 1r15 h ASP 17 CO -0.03 0.29 -0.34 0.22 -2.88 0.00 0.00 179.24 176.51 1r15 h TYR 18 N 0.65 -0.87 -0.98 0.28 5.03 -0.53 -0.50 116.97 120.06 1r15 h TYR 18 Ca 0.37 -0.02 0.10 0.00 2.58 0.00 0.00 58.73 61.76 1r15 h TYR 18 Cb 0.39 0.29 -0.12 0.00 1.55 0.00 0.00 36.73 38.84 1r15 h TYR 18 CO -0.09 -0.51 -0.56 1.49 -1.32 0.00 0.00 178.16 177.16 1r15 h GLU 19 N -1.14 -0.01 0.00 1.82 4.81 -0.57 -0.59 114.58 118.90 1r15 h GLU 19 Ca -0.10 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 58.95 1r15 h GLU 19 Cb 0.75 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 1r15 h GLU 19 CO 0.16 -0.01 -0.86 0.82 -0.73 0.00 0.00 179.01 178.39 1r15 h ILE 20 N -0.01 1.53 0.00 2.32 1.08 -1.32 -3.42 117.51 117.69 1r15 h ILE 20 Ca 0.18 -3.05 0.00 0.00 -0.39 0.00 0.00 64.86 61.60 1r15 h ILE 20 Cb 0.44 2.69 0.00 0.00 -3.07 0.00 0.00 36.82 36.88 1r15 h ILE 20 CO -0.94 0.85 0.00 0.35 -0.69 0.00 0.00 178.15 177.72 1r15 n THR 21 N -3.38 0.00 -0.04 -0.27 -2.24 -0.20 -5.00 114.28 103.16 1r15 n THR 21 Ca 0.00 -0.09 -0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1r15 n THR 21 Cb 0.86 1.52 -0.00 0.00 -2.10 0.00 0.00 70.33 70.61 1r15 n THR 21 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1r15 h ARG 22 N 0.00 0.00 -0.88 -0.78 2.47 -1.06 -3.41 114.38 110.73 1r15 h ARG 22 Ca 0.00 0.00 -0.50 0.00 -1.26 0.00 0.00 59.98 58.22 1r15 h ARG 22 Cb 0.26 0.00 -0.42 0.00 -1.65 0.00 0.00 29.97 28.16 1r15 h ARG 22 CO 0.00 0.00 -0.87 0.66 0.56 0.00 0.00 179.97 180.32 1r15 n TYR 23 N -4.20 2.55 -0.31 3.04 4.02 -1.26 -4.86 117.16 116.14 1r15 n TYR 23 Ca -0.00 -2.44 0.24 0.00 -0.01 0.00 0.00 57.90 55.69 1r15 n TYR 23 Cb 0.01 -0.27 0.45 0.00 -0.02 0.00 0.00 39.34 39.51 1r15 n TYR 23 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1r15 n LEU 24 N -0.60 0.17 0.05 7.72 4.77 -1.26 -0.30 117.00 127.55 1r15 n LEU 24 Ca 0.35 1.57 0.11 0.00 -0.03 0.00 0.00 56.01 58.01 1r15 n LEU 24 Cb 0.87 -0.69 -0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1r15 n LEU 24 CO 0.32 -1.69 -0.08 0.47 -1.33 0.00 0.00 177.39 175.08 1r15 n ASP 25 N -5.22 0.61 -0.04 -1.43 8.00 -1.26 -4.46 116.55 112.76 1r15 n ASP 25 Ca 0.31 0.06 -0.21 0.00 0.71 0.00 0.00 54.79 55.66 1r15 n ASP 25 Cb 1.03 0.80 -0.13 0.00 -0.02 0.00 0.00 41.12 42.79 1r15 n ASP 25 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1r15 n ILE 26 N -2.30 1.68 -4.35 0.53 -0.00 0.59 -4.99 119.36 110.52 1r15 n ILE 26 Ca 0.00 -0.58 -0.24 0.00 -0.00 0.00 0.00 62.75 61.92 1r15 n ILE 26 Cb 0.50 -1.67 -0.13 0.00 -0.00 0.00 0.00 39.64 38.34 1r15 n ILE 26 CO 0.00 0.00 0.00 -0.76 -0.00 0.00 0.00 176.55 175.79 1r15 s LEU 27 N -6.96 2.28 0.68 1.39 1.43 -0.09 -4.68 118.68 112.73 1r15 s LEU 27 Ca -0.27 -0.66 -0.14 0.00 -1.03 0.00 0.00 54.13 52.02 1r15 s LEU 27 Cb 0.07 -0.91 0.01 0.00 0.03 0.00 0.00 46.19 45.39 1r15 s LEU 27 CO 0.70 0.08 1.11 -2.84 0.23 0.00 0.00 176.35 175.63 1r15 s PRO 28 N -1.80 2.67 0.49 1.29 0.02 -1.26 -4.51 135.00 131.89 1r15 s PRO 28 Ca 0.07 1.38 -0.14 0.00 0.02 0.00 0.00 61.00 62.33 1r15 s PRO 28 Cb -0.10 -1.93 -0.07 0.00 0.02 0.00 0.00 34.50 32.42 1r15 s PRO 28 CO 0.04 -1.35 0.92 1.03 -0.33 0.00 0.00 177.00 177.31 1r15 s ARG 29 N -4.21 3.87 0.34 5.54 1.81 -1.26 -4.88 118.95 120.17 1r15 s ARG 29 Ca 0.66 0.79 -0.08 0.00 -1.72 0.00 0.00 55.73 55.38 1r15 s ARG 29 Cb -0.20 -2.21 -0.06 0.00 -0.45 0.00 0.00 34.95 32.02 1r15 s ARG 29 CO 0.44 -0.22 0.66 0.54 -0.68 0.00 0.00 175.30 176.04 1r15 s VAL 30 N -2.59 4.90 0.05 3.52 0.11 -1.26 -4.96 120.40 120.18 1r15 s VAL 30 Ca 0.56 0.35 -0.18 0.00 -2.93 0.00 0.00 61.98 59.78 1r15 s VAL 30 Cb -0.10 -3.73 -0.15 0.00 -1.53 0.00 0.00 36.38 30.87 1r15 s VAL 30 CO 0.33 -0.41 1.29 -0.09 -3.33 0.00 0.00 175.10 172.89 1r15 h ARG 31 N 1.51 0.53 -7.12 1.54 2.43 -1.94 -3.45 114.38 107.88 1r15 h ARG 31 Ca -0.47 -0.36 -0.50 0.00 -0.81 0.00 0.00 59.98 57.83 1r15 h ARG 31 Cb 1.19 0.05 0.07 0.00 -0.42 0.00 0.00 29.97 30.86 1r15 h ARG 31 CO 0.65 0.98 0.41 -1.12 -1.51 0.00 0.00 179.97 179.38 1r15 s SER 32 N -6.54 5.66 0.58 -3.80 0.01 -1.26 -5.04 113.70 103.31 1r15 s SER 32 Ca -0.13 2.09 -0.04 0.00 1.31 0.00 0.00 55.95 59.18 1r15 s SER 32 Cb 0.06 -2.57 0.02 0.00 0.21 0.00 0.00 66.02 63.74 1r15 s SER 32 CO 0.81 -1.26 0.86 1.51 0.41 0.00 0.00 173.24 175.57 1r15 s ASP 33 N -2.04 5.45 0.22 2.44 1.47 -1.26 -4.87 116.67 118.08 1r15 s ASP 33 Ca 0.70 0.47 -0.08 0.00 1.18 0.00 0.00 52.55 54.83 1r15 s ASP 33 Cb -0.22 -1.44 0.31 0.00 -0.34 0.00 0.00 42.92 41.24 1r15 s ASP 33 CO 0.30 -1.10 1.77 0.00 0.68 0.00 0.00 175.17 176.82 1r15 h SER 35 N 0.56 1.08 -0.40 0.00 0.02 -1.98 0.27 113.55 113.10 1r15 h SER 35 Ca 0.33 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.21 1r15 h SER 35 Cb 0.35 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 1r15 h SER 35 CO -0.27 0.75 0.02 0.00 -1.14 0.00 0.00 176.83 176.19 1r15 h ALA 36 N 1.40 0.54 -0.47 3.77 0.00 -1.66 -1.62 119.26 121.21 1r15 h ALA 36 Ca 0.39 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1r15 h ALA 36 Cb -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1r15 h ALA 36 CO -0.12 0.30 0.10 -0.07 0.00 0.00 0.00 179.25 179.47 1r15 h LEU 37 N 0.53 0.66 -0.15 0.00 3.38 -0.22 -1.94 115.31 117.58 1r15 h LEU 37 Ca 0.12 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1r15 h LEU 37 Cb 0.45 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1r15 h LEU 37 CO 0.02 0.66 0.06 -0.25 0.09 0.00 0.00 178.44 179.01 1r15 h TRP 38 N 0.69 0.22 -0.26 1.13 2.91 -0.17 -1.13 115.95 119.35 1r15 h TRP 38 Ca 0.15 -0.02 0.05 0.00 1.13 0.00 0.00 58.89 60.20 1r15 h TRP 38 Cb 0.27 -0.07 -0.04 0.00 -0.51 0.00 0.00 29.16 28.81 1r15 h TRP 38 CO 0.01 0.31 -0.01 0.87 -1.03 0.00 0.00 178.44 178.59 1r15 h LYS 39 N 0.07 0.06 -0.86 2.65 1.57 -0.93 0.59 116.57 119.73 1r15 h LYS 39 Ca 0.05 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 1r15 h LYS 39 Cb 0.18 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.43 1r15 h LYS 39 CO -0.00 0.04 0.57 -0.44 -0.57 0.00 0.00 179.45 179.04 1r15 h ASP 40 N 0.06 0.93 -0.01 0.86 3.32 -1.25 -0.79 116.42 119.54 1r15 h ASP 40 Ca 0.12 -0.01 -0.21 0.00 0.02 0.00 0.00 57.03 56.96 1r15 h ASP 40 Cb 0.17 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1r15 h ASP 40 CO -0.22 0.64 -0.75 0.15 -1.72 0.00 0.00 179.24 177.34 1r15 h PHE 41 N 1.08 0.89 -0.03 4.55 3.57 -0.15 -3.24 116.94 123.61 1r15 h PHE 41 Ca 0.34 -0.39 -0.02 0.00 3.53 0.00 0.00 57.97 61.44 1r15 h PHE 41 Cb 0.03 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.63 1r15 h PHE 41 CO -0.00 1.19 -0.05 0.35 -2.23 0.00 0.00 178.31 177.57 1r15 h PHE 42 N 0.45 0.10 -0.44 0.41 3.57 0.67 -3.17 116.94 118.52 1r15 h PHE 42 Ca -0.04 -0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.55 1r15 h PHE 42 Cb 1.35 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 40.06 1r15 h PHE 42 CO 0.07 0.62 0.36 1.57 -2.23 0.00 0.00 178.31 178.69 1r15 h LYS 43 N -0.45 0.00 -0.77 1.11 2.10 -1.27 0.33 116.57 117.61 1r15 h LYS 43 Ca 0.00 0.00 0.07 0.00 -2.00 0.00 0.00 60.65 58.72 1r15 h LYS 43 Cb 0.61 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.89 1r15 h LYS 43 CO 0.01 0.00 0.50 0.00 -2.00 0.00 0.00 179.45 177.96 1r15 h ALA 44 N 1.71 1.69 0.00 0.07 0.00 -1.57 -3.32 119.26 117.84 1r15 h ALA 44 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1r15 h ALA 44 Cb 0.92 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1r15 h ALA 44 CO -0.00 0.18 -0.02 1.97 0.00 0.00 0.00 179.25 181.38 1r15 n PHE 45 N -4.49 0.00 -2.25 0.00 -1.74 -0.69 -4.81 117.46 103.49 1r15 n PHE 45 Ca 0.12 0.00 -0.39 0.00 -0.56 0.00 0.00 57.45 56.62 1r15 n PHE 45 Cb 0.25 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.23 1r15 n PHE 45 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 1r15 s SER 46 N -0.60 6.61 -0.81 5.98 1.04 0.02 -3.33 113.70 122.61 1r15 s SER 46 Ca 0.00 2.44 0.00 0.00 0.48 0.00 0.00 55.95 58.87 1r15 s SER 46 Cb 0.00 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.49 1r15 s SER 46 CO 0.00 -0.62 0.00 0.49 0.98 0.00 0.00 173.24 174.09 1r15 n PHE 47 N 0.33 0.00 -4.02 5.02 3.72 -0.12 -4.92 117.46 117.46 1r15 n PHE 47 Ca 0.03 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.18 1r15 n PHE 47 Cb 0.45 -2.29 -0.06 0.00 -0.94 0.00 0.00 39.48 36.64 1r15 n PHE 47 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1r15 s LYS 48 N -2.49 2.29 0.43 -1.08 1.02 -1.21 -4.40 119.74 114.30 1r15 s LYS 48 Ca 0.00 -1.83 -0.21 0.00 0.02 0.00 0.00 55.97 53.95 1r15 s LYS 48 Cb 0.00 -2.05 -0.11 0.00 -0.52 0.00 0.00 37.83 35.15 1r15 s LYS 48 CO 0.00 -0.20 0.97 -0.80 -0.92 0.00 0.00 175.35 174.39 1r15 s ASN 49 N -3.99 6.86 0.35 2.83 0.01 -1.26 -2.03 114.94 117.71 1r15 s ASN 49 Ca 0.40 1.74 0.17 0.00 -0.71 0.00 0.00 52.86 54.46 1r15 s ASN 49 Cb 0.02 -2.55 1.16 0.00 0.41 0.00 0.00 41.25 40.29 1r15 s ASN 49 CO 0.23 -0.42 1.65 1.55 -1.51 0.00 0.00 177.10 178.60 1r15 h PRO 50 N 1.92 0.24 -0.61 -0.60 0.13 -1.85 0.33 132.00 131.56 1r15 h PRO 50 Ca -0.49 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1r15 h PRO 50 Cb 1.19 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1r15 h PRO 50 CO 0.61 0.16 0.00 0.00 -0.23 0.00 0.00 178.00 178.54 1r15 n ASP 52 N 0.55 7.14 -3.91 0.00 -0.08 0.12 -4.73 116.55 115.64 1r15 n ASP 52 Ca 0.15 -3.49 -0.09 0.00 -1.51 0.00 0.00 54.79 49.86 1r15 n ASP 52 Cb 0.61 -1.25 -0.07 0.00 2.34 0.00 0.00 41.12 42.74 1r15 n ASP 52 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1r15 s LEU 53 N -3.29 1.38 0.26 -2.67 1.43 -1.26 -4.76 118.68 109.77 1r15 s LEU 53 Ca 0.40 -0.74 -0.06 0.00 -1.03 0.00 0.00 54.13 52.70 1r15 s LEU 53 Cb 0.15 1.00 -0.01 0.00 0.03 0.00 0.00 46.19 47.36 1r15 s LEU 53 CO -0.06 -0.76 0.37 1.51 0.23 0.00 0.00 176.35 177.64 1r15 s ASP 54 N -2.90 0.30 0.61 2.29 -4.77 -1.23 -2.37 116.67 108.60 1r15 s ASP 54 Ca 0.09 -1.23 0.26 0.00 -3.30 0.00 0.00 52.55 48.36 1r15 s ASP 54 Cb 0.05 0.55 1.12 0.00 -1.09 0.00 0.00 42.92 43.55 1r15 s ASP 54 CO -0.08 -1.10 1.55 -0.07 0.70 0.00 0.00 175.17 176.18 1r15 h LEU 55 N 2.31 0.00 0.00 2.11 -0.00 -1.83 0.13 115.31 118.04 1r15 h LEU 55 Ca -0.29 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.53 1r15 h LEU 55 Cb 1.25 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.90 1r15 h LEU 55 CO 0.41 0.00 -0.93 1.23 -0.00 0.00 0.00 178.44 179.16 1r15 h GLY 56 N 0.00 0.00 -0.52 0.83 0.00 -1.92 -3.40 103.07 98.06 1r15 h GLY 56 Ca 0.31 0.00 0.27 0.00 0.00 0.00 0.00 47.33 47.91 1r15 h GLY 56 CO -0.00 0.00 0.35 1.76 0.00 0.00 0.00 176.54 178.65 1r15 h SER 57 N 0.00 0.17 -0.54 0.19 0.02 -1.07 0.99 113.55 113.30 1r15 h SER 57 Ca -0.04 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1r15 h SER 57 Cb 1.20 0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.97 1r15 h SER 57 CO 0.02 -0.17 0.00 -1.22 -1.14 0.00 0.00 176.83 174.32 1r15 n TYR 58 N -5.18 1.72 -0.11 3.45 4.01 -1.26 -4.36 117.16 115.42 1r15 n TYR 58 Ca 0.26 -0.72 -0.06 0.00 -0.16 0.00 0.00 57.90 57.22 1r15 n TYR 58 Cb 0.81 -0.40 0.02 0.00 -0.31 0.00 0.00 39.34 39.47 1r15 n TYR 58 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1r15 h LYS 59 N 3.65 0.29 -0.32 -0.72 3.64 -1.01 0.12 116.57 122.21 1r15 h LYS 59 Ca 0.00 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1r15 h LYS 59 Cb 1.74 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 33.48 1r15 h LYS 59 CO 0.37 0.19 0.15 -0.44 -2.27 0.00 0.00 179.45 177.45 1r15 h ASP 60 N 0.30 0.43 0.09 4.20 3.32 -1.81 -1.05 116.42 121.90 1r15 h ASP 60 Ca 0.17 -0.14 0.02 0.00 0.02 0.00 0.00 57.03 57.11 1r15 h ASP 60 Cb 0.15 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1r15 h ASP 60 CO -0.17 0.45 -0.23 0.15 -1.72 0.00 0.00 179.24 177.72 1r15 h PHE 61 N 0.38 -0.60 0.00 4.55 3.57 -1.56 -1.75 116.94 121.53 1r15 h PHE 61 Ca 0.11 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 1r15 h PHE 61 Cb 0.14 0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 1r15 h PHE 61 CO -0.01 -0.32 -0.05 0.74 -2.23 0.00 0.00 178.31 176.43 1r15 h PHE 62 N -0.41 0.00 -0.23 0.41 0.04 -0.56 0.54 116.94 116.73 1r15 h PHE 62 Ca 0.04 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.71 1r15 h PHE 62 Cb 0.44 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.59 1r15 h PHE 62 CO -0.22 0.05 -0.23 1.15 -0.60 0.00 0.00 178.31 178.46 1r15 h THR 63 N 0.00 1.32 -0.01 -1.55 2.02 -0.50 -0.74 112.91 113.45 1r15 h THR 63 Ca -0.00 -1.39 -0.12 0.00 0.77 0.00 0.00 66.41 65.67 1r15 h THR 63 Cb 0.14 1.71 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 1r15 h THR 63 CO 0.01 0.43 -0.54 0.28 0.37 0.00 0.00 175.52 176.07 1r15 h SER 64 N 0.25 0.03 0.10 4.18 0.02 -0.46 -3.23 113.55 114.45 1r15 h SER 64 Ca 0.04 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1r15 h SER 64 Cb 0.78 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1r15 h SER 64 CO 0.06 0.57 -0.40 0.00 -1.14 0.00 0.00 176.83 175.91 1r15 n ALA 65 N -2.44 3.40 -2.34 3.77 0.00 0.08 -4.53 120.51 118.45 1r15 n ALA 65 Ca -0.01 -0.54 -0.43 0.00 0.00 0.00 0.00 53.44 52.46 1r15 n ALA 65 Cb 0.55 -0.94 -0.02 0.00 0.00 0.00 0.00 19.45 19.03 1r15 n ALA 65 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1r15 s GLN 66 N -2.51 4.14 0.28 0.00 2.00 -0.29 -4.49 119.66 118.78 1r15 s GLN 66 Ca 0.21 1.67 -0.09 0.00 -2.00 0.00 0.00 55.36 55.14 1r15 s GLN 66 Cb 0.18 -3.84 -0.07 0.00 0.80 0.00 0.00 33.01 30.09 1r15 s GLN 66 CO 0.56 -0.85 0.61 -0.65 -0.50 0.00 0.00 175.29 174.46 1r15 s GLN 67 N 3.79 3.78 0.28 1.67 -0.21 -1.26 -4.98 119.66 122.73 1r15 s GLN 67 Ca 0.59 0.29 -0.29 0.00 0.02 0.00 0.00 55.36 55.96 1r15 s GLN 67 Cb -0.23 -2.58 -0.10 0.00 1.00 0.00 0.00 33.01 31.10 1r15 s GLN 67 CO 0.19 0.22 1.31 -0.65 -2.12 0.00 0.00 175.29 174.24 1r15 s GLN 68 N -3.18 4.37 -0.23 2.91 -1.52 -1.26 -4.99 119.66 115.77 1r15 s GLN 68 Ca 0.48 2.16 -0.08 0.00 -1.95 0.00 0.00 55.36 55.97 1r15 s GLN 68 Cb -0.11 -3.12 -0.04 0.00 -0.22 0.00 0.00 33.01 29.53 1r15 s GLN 68 CO 0.24 -0.21 0.09 -0.51 -0.25 0.00 0.00 175.29 174.65 1r15 s LEU 69 N -1.12 3.72 -0.36 2.90 1.02 -1.26 -4.48 118.68 119.10 1r15 s LEU 69 Ca 0.52 -0.04 -0.44 0.00 0.02 0.00 0.00 54.13 54.18 1r15 s LEU 69 Cb -0.39 -1.98 -0.19 0.00 0.02 0.00 0.00 46.19 43.65 1r15 s LEU 69 CO 0.47 0.05 1.53 -0.81 0.02 0.00 0.00 176.35 177.61 1r15 n PRO 70 N 4.37 0.24 -1.65 1.29 -0.04 -1.26 -4.56 135.00 133.39 1r15 n PRO 70 Ca -0.16 0.09 -0.46 0.00 -0.04 0.00 0.00 63.50 62.93 1r15 n PRO 70 Cb 0.52 -1.63 -0.03 0.00 -0.04 0.00 0.00 33.50 32.32 1r15 n PRO 70 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1r15 n LYS 71 N 3.77 1.85 -0.83 0.54 4.81 -1.26 -2.31 118.16 124.72 1r15 n LYS 71 Ca 0.28 0.66 0.00 0.00 -0.87 0.00 0.00 58.31 58.38 1r15 n LYS 71 Cb 0.00 -2.29 0.00 0.00 0.02 0.00 0.00 35.03 32.77 1r15 n LYS 71 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1r15 n ASN 72 N 2.21 -3.44 -0.15 3.14 3.02 -0.84 -4.77 115.26 114.42 1r15 n ASN 72 Ca 0.13 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.75 1r15 n ASN 72 Cb 0.30 -2.74 -0.05 0.00 -0.61 0.00 0.00 39.78 36.67 1r15 n ASN 72 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1r15 n LYS 73 N -0.48 1.77 -2.29 3.52 5.02 -0.98 -4.74 118.16 119.99 1r15 n LYS 73 Ca 0.00 -0.34 -0.42 0.00 -2.02 0.00 0.00 58.31 55.54 1r15 n LYS 73 Cb 0.27 -1.26 -0.03 0.00 -0.02 0.00 0.00 35.03 33.99 1r15 n LYS 73 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1r15 s VAL 74 N -2.25 3.52 0.01 -0.18 1.01 -1.25 -1.15 120.40 120.11 1r15 s VAL 74 Ca 0.09 1.16 0.08 0.00 0.00 0.00 0.00 61.98 63.31 1r15 s VAL 74 Cb 0.12 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 1r15 s VAL 74 CO 0.55 0.13 -0.23 -0.32 0.00 0.00 0.00 175.10 175.23 1r15 s MET 75 N 0.52 1.71 0.18 2.72 0.00 -0.42 -1.20 119.30 122.82 1r15 s MET 75 Ca 0.59 -0.91 0.10 0.00 0.00 0.00 0.00 55.69 55.47 1r15 s MET 75 Cb -0.34 -1.75 -0.04 0.00 0.00 0.00 0.00 34.83 32.70 1r15 s MET 75 CO 0.33 0.47 -0.21 -0.06 0.00 0.00 0.00 175.02 175.55 1r15 s PHE 76 N -0.66 2.03 0.16 4.11 0.08 0.22 -4.45 117.98 119.47 1r15 s PHE 76 Ca 0.09 -0.42 -0.11 0.00 0.12 0.00 0.00 56.93 56.61 1r15 s PHE 76 Cb -0.09 -1.00 0.00 0.00 -0.57 0.00 0.00 43.02 41.36 1r15 s PHE 76 CO 0.00 0.42 0.32 1.67 -0.10 0.00 0.00 175.22 177.54 1r15 s TRP 77 N -1.95 0.23 -0.08 0.36 1.48 -1.26 -0.94 118.94 116.78 1r15 s TRP 77 Ca 0.19 -0.60 -0.03 0.00 -1.06 0.00 0.00 56.10 54.59 1r15 s TRP 77 Cb -0.06 0.04 0.04 0.00 -1.16 0.00 0.00 33.47 32.33 1r15 s TRP 77 CO 0.08 -0.73 0.17 -1.12 -4.06 0.00 0.00 176.95 171.29 1r15 s SER 78 N -2.92 0.23 -1.08 -2.66 0.01 -0.42 -4.81 113.70 102.04 1r15 s SER 78 Ca 0.13 0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.74 1r15 s SER 78 Cb 0.03 0.28 0.00 0.00 0.21 0.00 0.00 66.02 66.53 1r15 s SER 78 CO -0.03 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.04 1r15 n GLY 79 N 4.71 -0.36 2.78 3.44 0.00 -1.26 -3.44 105.19 111.06 1r15 n GLY 79 Ca -0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 1r15 n GLY 79 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1r15 n VAL 80 N -3.26 0.83 -0.30 1.61 0.24 -1.26 -4.69 118.33 111.50 1r15 n VAL 80 Ca -0.14 -2.27 -0.12 0.00 -2.04 0.00 0.00 64.34 59.77 1r15 n VAL 80 Cb 0.59 1.20 -0.10 0.00 -1.47 0.00 0.00 33.84 34.06 1r15 n VAL 80 CO 0.00 0.00 0.00 0.22 -2.14 0.00 0.00 176.83 174.91 1r15 h TYR 81 N 2.07 -1.81 -0.16 6.34 5.03 -1.96 0.21 116.97 126.69 1r15 h TYR 81 Ca -0.25 0.11 0.01 0.00 2.58 0.00 0.00 58.73 61.19 1r15 h TYR 81 Cb 1.28 0.89 -0.01 0.00 1.55 0.00 0.00 36.73 40.43 1r15 h TYR 81 CO 0.31 -0.42 0.07 -0.44 -1.32 0.00 0.00 178.16 176.35 1r15 h ASP 82 N -0.16 0.10 -0.47 -2.11 3.32 -1.99 -0.71 116.42 114.40 1r15 h ASP 82 Ca 0.13 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 1r15 h ASP 82 Cb 0.49 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 1r15 h ASP 82 CO -0.80 0.08 0.21 -0.33 -1.72 0.00 0.00 179.24 176.68 1r15 h GLU 83 N 0.16 0.69 -0.21 3.56 3.07 -1.75 -1.15 114.58 118.94 1r15 h GLU 83 Ca 0.06 -0.11 -0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1r15 h GLU 83 Cb 0.02 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 27.80 1r15 h GLU 83 CO -0.05 0.60 0.13 0.00 -1.40 0.00 0.00 179.01 178.29 1r15 h ALA 84 N 1.05 0.27 -0.29 3.43 0.00 -0.36 -1.54 119.26 121.82 1r15 h ALA 84 Ca 0.16 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1r15 h ALA 84 Cb 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1r15 h ALA 84 CO -0.02 -0.23 -0.23 0.45 0.00 0.00 0.00 179.25 179.23 1r15 h HIS 85 N 0.27 0.62 -0.53 0.00 3.86 -0.96 0.56 115.15 118.95 1r15 h HIS 85 Ca 0.08 -0.13 -0.04 0.00 -1.16 0.00 0.00 60.37 59.12 1r15 h HIS 85 Cb 0.01 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.30 1r15 h HIS 85 CO -0.05 0.74 0.17 -0.44 0.86 0.00 0.00 177.93 179.21 1r15 h ASP 86 N 0.49 0.77 -0.36 2.45 3.32 -0.95 0.71 116.42 122.85 1r15 h ASP 86 Ca 0.07 -0.20 -0.07 0.00 0.02 0.00 0.00 57.03 56.85 1r15 h ASP 86 Cb 0.66 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1r15 h ASP 86 CO 0.05 0.77 -0.06 0.22 -1.72 0.00 0.00 179.24 178.50 1r15 h TYR 87 N 0.74 0.75 -0.02 4.55 3.20 -1.03 -2.47 116.97 122.70 1r15 h TYR 87 Ca 0.17 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1r15 h TYR 87 Cb 0.27 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.35 1r15 h TYR 87 CO 0.02 0.81 0.01 0.00 -1.64 0.00 0.00 178.16 177.36 1r15 h ALA 88 N 0.84 1.85 -5.99 1.82 0.00 -0.51 -3.43 119.26 113.83 1r15 h ALA 88 Ca 0.10 -0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.60 1r15 h ALA 88 Cb 0.55 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.42 1r15 h ALA 88 CO 0.03 -0.02 -0.80 -1.71 0.00 0.00 0.00 179.25 176.75 1r15 n ASN 89 N -4.29 -1.93 -3.56 0.00 4.05 0.21 -1.55 115.26 108.19 1r15 n ASN 89 Ca -0.03 -0.76 -0.24 0.00 0.45 0.00 0.00 54.58 54.01 1r15 n ASN 89 Cb 0.10 -4.34 0.05 0.00 1.23 0.00 0.00 39.78 36.82 1r15 n ASN 89 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 177.26 174.62 1r15 n THR 90 N -4.31 -6.46 -0.07 -0.44 -1.04 -1.26 -1.97 114.28 98.73 1r15 n THR 90 Ca -0.25 -0.96 0.00 0.00 -2.04 0.00 0.00 64.05 60.80 1r15 n THR 90 Cb 0.66 -4.83 0.00 0.00 -1.82 0.00 0.00 70.33 64.34 1r15 n THR 90 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1r15 n GLY 91 N -1.53 1.97 0.21 3.41 0.00 -1.10 -4.85 105.19 103.31 1r15 n GLY 91 Ca -0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 1r15 n GLY 91 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1r15 h ARG 92 N 1.45 0.69 0.00 1.61 3.08 -1.32 -3.37 114.38 116.51 1r15 h ARG 92 Ca 0.00 -0.27 -0.45 0.00 0.07 0.00 0.00 59.98 59.33 1r15 h ARG 92 Cb 0.00 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 29.95 1r15 h ARG 92 CO 0.00 0.86 -2.52 1.17 -1.07 0.00 0.00 179.97 178.41 1r15 n LYS 93 N -4.39 0.60 -3.94 0.04 4.81 -0.60 -5.02 118.16 109.67 1r15 n LYS 93 Ca -0.02 0.25 -0.09 0.00 -0.87 0.00 0.00 58.31 57.57 1r15 n LYS 93 Cb 0.35 -1.50 -0.09 0.00 0.02 0.00 0.00 35.03 33.81 1r15 n LYS 93 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1r15 s TYR 94 N -2.51 0.23 0.17 5.64 2.02 -1.07 -4.87 117.35 116.96 1r15 s TYR 94 Ca -0.38 -0.57 0.05 0.00 -0.37 0.00 0.00 57.07 55.80 1r15 s TYR 94 Cb 0.14 -0.16 -0.04 0.00 -0.40 0.00 0.00 41.96 41.50 1r15 s TYR 94 CO 0.51 -0.38 0.17 0.96 -1.57 0.00 0.00 175.55 175.24 1r15 s ILE 95 N -2.84 4.63 0.37 2.71 -4.36 -0.30 -2.69 121.20 118.71 1r15 s ILE 95 Ca -0.03 -1.05 0.04 0.00 -0.26 0.00 0.00 60.65 59.36 1r15 s ILE 95 Cb 0.00 -3.38 -0.06 0.00 1.25 0.00 0.00 42.46 40.27 1r15 s ILE 95 CO -0.06 -0.13 0.05 0.42 0.24 0.00 0.00 174.94 175.46 1r15 s THR 96 N -1.79 1.35 0.27 8.37 -4.23 -1.26 -1.30 115.64 117.05 1r15 s THR 96 Ca 0.32 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.82 1r15 s THR 96 Cb -0.10 -2.77 0.26 0.00 1.34 0.00 0.00 72.50 71.23 1r15 s THR 96 CO 0.24 0.00 1.81 0.25 -0.54 0.00 0.00 174.62 176.39 1r15 h LEU 97 N 1.95 0.78 -0.70 4.79 5.85 -1.98 0.13 115.31 126.14 1r15 h LEU 97 Ca -0.41 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1r15 h LEU 97 Cb 1.25 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1r15 h LEU 97 CO 0.72 0.40 0.00 -0.62 -0.34 0.00 0.00 178.44 178.60 1r15 n GLU 98 N -4.71 0.12 0.05 1.25 4.71 -1.26 -1.61 120.64 119.20 1r15 n GLU 98 Ca 0.18 0.46 0.12 0.00 -0.01 0.00 0.00 57.16 57.91 1r15 n GLU 98 Cb 0.36 -1.79 0.20 0.00 -1.01 0.00 0.00 31.44 29.21 1r15 n GLU 98 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1r15 n ASP 99 N -2.03 0.65 -4.90 1.62 8.00 0.46 -3.00 116.55 117.35 1r15 n ASP 99 Ca 0.01 0.08 -0.28 0.00 0.71 0.00 0.00 54.79 55.31 1r15 n ASP 99 Cb 0.14 0.14 0.02 0.00 -0.02 0.00 0.00 41.12 41.40 1r15 n ASP 99 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1r15 s THR 100 N -3.13 4.19 0.15 -3.53 -4.23 -0.63 -4.80 115.64 103.65 1r15 s THR 100 Ca 0.07 0.32 -0.28 0.00 -1.18 0.00 0.00 61.69 60.63 1r15 s THR 100 Cb 0.14 -3.66 -0.02 0.00 1.34 0.00 0.00 72.50 70.30 1r15 s THR 100 CO 0.71 -0.74 1.58 0.25 -0.54 0.00 0.00 174.62 175.87 1r15 h LEU 101 N -0.18 -1.41 -0.77 4.79 5.85 -1.86 0.32 115.31 122.05 1r15 h LEU 101 Ca -0.45 0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.50 1r15 h LEU 101 Cb 1.23 0.61 -0.05 0.00 0.37 0.00 0.00 40.66 42.82 1r15 h LEU 101 CO 0.62 -0.38 0.49 -0.65 -0.34 0.00 0.00 178.44 178.17 1r15 h PRO 102 N -0.37 0.94 -0.33 5.25 0.11 -1.89 0.60 132.00 136.30 1r15 h PRO 102 Ca 0.12 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.09 1r15 h PRO 102 Cb 0.59 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 1r15 h PRO 102 CO -0.53 0.62 -0.13 0.78 -0.21 0.00 0.00 178.00 178.53 1r15 h GLY 103 N 0.97 0.73 1.01 -0.55 0.00 -1.54 -1.65 103.07 102.04 1r15 h GLY 103 Ca 0.30 -0.64 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 1r15 h GLY 103 CO -0.10 0.58 0.21 -1.82 0.00 0.00 0.00 176.54 175.41 1r15 h TYR 104 N 0.45 0.99 -0.03 5.60 3.20 -0.11 0.23 116.97 127.29 1r15 h TYR 104 Ca 0.08 -0.09 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 1r15 h TYR 104 Cb 0.65 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.63 1r15 h TYR 104 CO 0.06 0.80 0.00 0.52 -1.64 0.00 0.00 178.16 177.90 1r15 h MET 105 N 0.89 0.04 -0.12 1.82 2.86 -0.73 -3.23 114.93 116.46 1r15 h MET 105 Ca 0.20 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1r15 h MET 105 Cb 0.26 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1r15 h MET 105 CO -0.01 0.32 0.00 1.28 1.06 0.00 0.00 176.91 179.56 1r15 n LEU 106 N -4.92 2.24 -4.67 1.22 7.99 -0.63 -4.84 117.00 113.38 1r15 n LEU 106 Ca -0.07 -0.84 -0.49 0.00 -0.01 0.00 0.00 56.01 54.59 1r15 n LEU 106 Cb 0.17 -0.07 -0.05 0.00 -0.11 0.00 0.00 43.42 43.36 1r15 n LEU 106 CO 0.34 0.42 1.30 -3.20 -1.51 0.00 0.00 177.39 174.74 1r15 n ASN 107 N 0.72 2.97 0.00 -1.43 5.15 0.79 -0.78 115.26 122.67 1r15 n ASN 107 Ca 0.17 1.04 0.00 0.00 -0.60 0.00 0.00 54.58 55.19 1r15 n ASN 107 Cb 0.45 -1.33 0.00 0.00 -0.53 0.00 0.00 39.78 38.37 1r15 n ASN 107 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1r15 n SER 108 N 4.96 0.00 -4.84 1.20 7.64 -1.26 -4.99 113.62 116.34 1r15 n SER 108 Ca 0.21 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.77 1r15 n SER 108 Cb 0.26 -0.86 -0.03 0.00 -1.01 0.00 0.00 64.21 62.57 1r15 n SER 108 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1r15 s LEU 109 N 0.00 3.60 -0.09 -3.43 1.43 0.04 -5.00 118.68 115.23 1r15 s LEU 109 Ca 0.00 1.61 0.02 0.00 -1.03 0.00 0.00 54.13 54.73 1r15 s LEU 109 Cb 0.00 -4.51 0.01 0.00 0.03 0.00 0.00 46.19 41.72 1r15 s LEU 109 CO 0.00 -0.67 -0.15 -0.69 0.23 0.00 0.00 176.35 175.07 1r15 s VAL 110 N -2.60 1.39 0.17 -1.59 1.01 -1.26 -4.97 120.40 112.55 1r15 s VAL 110 Ca 0.60 -0.61 -0.22 0.00 0.00 0.00 0.00 61.98 61.75 1r15 s VAL 110 Cb -0.11 -1.26 0.06 0.00 0.00 0.00 0.00 36.38 35.07 1r15 s VAL 110 CO 0.32 0.42 0.60 -1.66 0.00 0.00 0.00 175.10 174.77 1r15 s TRP 111 N 0.79 -0.46 -0.09 5.22 -2.14 -1.26 -0.17 118.94 120.83 1r15 s TRP 111 Ca -0.11 0.21 -0.30 0.00 2.66 0.00 0.00 56.10 58.55 1r15 s TRP 111 Cb -0.16 0.55 0.12 0.00 -3.10 0.00 0.00 33.47 30.88 1r15 s TRP 111 CO 0.02 -0.89 0.97 0.00 -2.66 0.00 0.00 176.95 174.39 1r15 s GLY 113 N -1.83 1.74 0.03 0.00 0.00 -1.25 -1.43 107.32 104.58 1r15 s GLY 113 Ca 0.02 -1.08 -0.14 0.00 0.00 0.00 0.00 44.72 43.52 1r15 s GLY 113 CO -0.04 -0.72 0.30 -0.86 0.00 0.00 0.00 173.10 171.79 1r15 s GLN 114 N -5.08 0.78 0.12 2.90 -2.07 -0.86 -2.58 119.66 112.87 1r15 s GLN 114 Ca 0.59 -0.45 0.01 0.00 -1.82 0.00 0.00 55.36 53.70 1r15 s GLN 114 Cb -0.10 0.34 -0.16 0.00 -1.09 0.00 0.00 33.01 31.99 1r15 s GLN 114 CO 0.42 -0.24 1.27 0.00 -1.32 0.00 0.00 175.29 175.42 1r15 h ARG 115 N 3.36 0.17 -7.02 9.60 3.08 -1.76 -2.79 114.38 119.02 1r15 h ARG 115 Ca -0.31 -0.24 -0.49 0.00 0.07 0.00 0.00 59.98 59.00 1r15 h ARG 115 Cb 1.19 0.08 0.05 0.00 0.08 0.00 0.00 29.97 31.38 1r15 h ARG 115 CO 0.45 1.06 0.44 0.00 -1.07 0.00 0.00 179.97 180.85 1r15 s ALA 116 N -2.87 2.94 0.56 0.04 0.00 -1.26 -4.71 121.76 116.46 1r15 s ALA 116 Ca -0.02 0.81 -0.20 0.00 0.00 0.00 0.00 51.96 52.55 1r15 s ALA 116 Cb 0.09 -3.33 -0.06 0.00 0.00 0.00 0.00 23.12 19.82 1r15 s ALA 116 CO 0.85 -0.52 0.96 0.09 0.00 0.00 0.00 175.76 177.14 1r15 n ASN 117 N -0.60 0.81 0.00 0.00 3.02 -1.26 -1.16 115.26 116.06 1r15 n ASN 117 Ca 0.08 0.85 0.11 0.00 -0.03 0.00 0.00 54.58 55.59 1r15 n ASN 117 Cb 0.50 -1.37 0.63 0.00 -0.61 0.00 0.00 39.78 38.92 1r15 n ASN 117 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1r15 n PRO 118 N -0.71 0.56 0.00 3.52 -0.04 -1.26 -4.90 135.00 132.17 1r15 n PRO 118 Ca 0.12 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1r15 n PRO 118 Cb 0.46 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 1r15 n PRO 118 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1r15 n GLY 119 N 0.47 0.70 3.25 0.55 0.00 -0.31 -4.83 105.19 105.01 1r15 n GLY 119 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1r15 n GLY 119 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1r15 s PHE 120 N -2.00 -0.17 -0.01 1.61 -0.71 -1.26 -0.95 117.98 114.50 1r15 s PHE 120 Ca 0.00 0.19 -0.21 0.00 -1.04 0.00 0.00 56.93 55.86 1r15 s PHE 120 Cb 0.00 0.10 -0.05 0.00 -1.21 0.00 0.00 43.02 41.86 1r15 s PHE 120 CO 0.00 -0.43 0.63 1.21 -1.34 0.00 0.00 175.22 175.29 1r15 s ASN 121 N -1.57 7.00 0.00 1.98 3.84 -0.51 -4.70 114.94 120.98 1r15 s ASN 121 Ca -0.11 1.19 0.05 0.00 0.21 0.00 0.00 52.86 54.20 1r15 s ASN 121 Cb -0.04 -2.38 0.04 0.00 -0.55 0.00 0.00 41.25 38.33 1r15 s ASN 121 CO 0.02 0.05 0.68 -0.62 -2.79 0.00 0.00 177.10 174.44 1r15 n GLU 122 N 2.94 -0.15 -0.14 0.43 1.02 -1.26 -4.54 120.64 118.93 1r15 n GLU 122 Ca -0.05 -0.85 -0.28 0.00 -0.02 0.00 0.00 57.16 55.96 1r15 n GLU 122 Cb 0.51 -1.10 -0.10 0.00 -0.02 0.00 0.00 31.44 30.73 1r15 n GLU 122 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1r15 n LYS 123 N 0.28 0.60 -3.65 3.49 5.02 -1.26 -4.75 118.16 117.89 1r15 n LYS 123 Ca 0.03 0.26 -0.13 0.00 -2.02 0.00 0.00 58.31 56.46 1r15 n LYS 123 Cb 0.14 -1.51 -0.06 0.00 -0.02 0.00 0.00 35.03 33.58 1r15 n LYS 123 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1r15 s VAL 124 N -2.50 0.05 0.06 -0.18 0.11 -1.26 -4.49 120.40 112.18 1r15 s VAL 124 Ca -0.38 -0.44 0.07 0.00 -2.93 0.00 0.00 61.98 58.30 1r15 s VAL 124 Cb 0.14 -0.98 -0.03 0.00 -1.53 0.00 0.00 36.38 33.98 1r15 s VAL 124 CO 0.51 -0.24 -0.19 0.00 -3.33 0.00 0.00 175.10 171.85 1r15 s PRO 126 N -1.34 1.76 0.39 0.00 0.04 -1.26 -3.34 135.00 131.25 1r15 s PRO 126 Ca 0.05 1.60 -0.24 0.00 0.04 0.00 0.00 61.00 62.46 1r15 s PRO 126 Cb -0.09 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.55 1r15 s PRO 126 CO 0.02 -2.09 1.01 0.34 0.04 0.00 0.00 177.00 176.32 1r15 s ASP 127 N -2.45 6.89 0.00 6.66 -1.08 -1.26 -4.77 116.67 120.67 1r15 s ASP 127 Ca 0.70 1.94 0.00 0.00 -0.52 0.00 0.00 52.55 54.67 1r15 s ASP 127 Cb -0.25 -2.58 0.00 0.00 -1.46 0.00 0.00 42.92 38.63 1r15 s ASP 127 CO 0.51 -0.39 0.40 0.33 0.52 0.00 0.00 175.17 176.54 1r15 n PHE 128 N -0.04 0.00 0.30 -5.34 7.35 -1.26 -0.64 117.46 117.83 1r15 n PHE 128 Ca 0.05 0.00 0.09 0.00 -0.76 0.00 0.00 57.45 56.83 1r15 n PHE 128 Cb 0.50 -0.15 0.47 0.00 0.35 0.00 0.00 39.48 40.66 1r15 n PHE 128 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1r15 h LYS 129 N 0.00 0.00 -0.09 -4.13 6.56 -2.00 -2.34 116.57 114.57 1r15 h LYS 129 Ca 0.00 0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 59.44 1r15 h LYS 129 Cb 0.00 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 1r15 h LYS 129 CO 0.00 0.00 -0.60 1.15 -2.06 0.00 0.00 179.45 177.94 1r15 h THR 130 N 0.00 1.37 -2.84 -0.16 2.02 -1.25 -3.46 112.91 108.59 1r15 h THR 130 Ca 0.00 -1.95 -0.50 0.00 0.77 0.00 0.00 66.41 64.73 1r15 h THR 130 Cb 1.11 1.96 -0.00 0.00 -1.74 0.00 0.00 68.15 69.47 1r15 h THR 130 CO 0.00 0.58 -0.25 0.00 0.37 0.00 0.00 175.52 176.23 1r15 s PRO 132 N -3.82 2.73 0.20 0.00 0.04 -1.26 -4.66 135.00 128.23 1r15 s PRO 132 Ca 0.40 1.71 -0.11 0.00 0.04 0.00 0.00 61.00 63.03 1r15 s PRO 132 Cb -0.10 -1.91 0.25 0.00 0.04 0.00 0.00 34.50 32.77 1r15 s PRO 132 CO 0.32 -1.37 1.70 -0.39 0.04 0.00 0.00 177.00 177.30 1r15 h VAL 133 N 0.41 0.65 -0.24 -0.36 -1.51 -1.97 0.08 116.25 113.30 1r15 h VAL 133 Ca -0.49 -0.07 0.07 0.00 -1.23 0.00 0.00 66.70 64.98 1r15 h VAL 133 Cb 1.28 0.41 -0.01 0.00 -2.13 0.00 0.00 31.29 30.85 1r15 h VAL 133 CO 0.53 0.04 0.27 0.06 -1.23 0.00 0.00 177.57 177.24 1r15 h GLN 134 N 0.22 0.00 0.02 5.19 -0.00 -1.91 0.34 115.11 118.97 1r15 h GLN 134 Ca 0.29 0.00 -0.24 0.00 -0.00 0.00 0.00 58.65 58.70 1r15 h GLN 134 Cb 0.42 0.00 -0.03 0.00 -0.00 0.00 0.00 27.48 27.87 1r15 h GLN 134 CO -0.39 0.00 -1.29 0.00 -0.00 0.00 0.00 178.83 177.15 1r15 h ALA 135 N 1.69 0.26 -0.90 0.06 0.00 -0.84 -2.82 119.26 116.71 1r15 h ALA 135 Ca 0.11 -1.19 0.16 0.00 0.00 0.00 0.00 54.91 54.00 1r15 h ALA 135 Cb 0.65 0.68 -0.10 0.00 0.00 0.00 0.00 17.79 19.02 1r15 h ALA 135 CO -0.00 0.74 0.49 -0.09 0.00 0.00 0.00 179.25 180.39 1r15 h ARG 136 N -0.83 0.65 -0.45 0.00 2.43 -0.23 -1.70 114.38 114.25 1r15 h ARG 136 Ca -0.34 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 1r15 h ARG 136 Cb 1.40 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 1r15 h ARG 136 CO -0.15 0.43 0.00 0.39 -1.51 0.00 0.00 179.97 179.13 1r15 n GLU 137 N -4.84 2.89 -0.21 0.20 1.02 0.11 -4.68 120.64 115.14 1r15 n GLU 137 Ca 0.19 -2.28 0.01 0.00 -0.02 0.00 0.00 57.16 55.06 1r15 n GLU 137 Cb 0.47 -1.40 0.10 0.00 -0.02 0.00 0.00 31.44 30.60 1r15 n GLU 137 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1r15 h SER 138 N 2.64 -0.27 0.00 1.62 0.87 -1.04 0.34 113.55 117.72 1r15 h SER 138 Ca 0.00 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1r15 h SER 138 Cb 0.86 0.27 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 1r15 h SER 138 CO 0.02 -0.11 -0.01 0.15 -0.53 0.00 0.00 176.83 176.35 1r15 h PHE 139 N 0.12 0.00 0.00 2.24 3.57 -1.83 -3.03 116.94 118.01 1r15 h PHE 139 Ca 0.32 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 1r15 h PHE 139 Cb 0.52 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 1r15 h PHE 139 CO -0.37 0.00 -0.11 -1.49 -2.23 0.00 0.00 178.31 174.12 1r15 h TRP 140 N -0.73 0.00 0.13 0.41 4.06 -1.89 0.31 115.95 118.24 1r15 h TRP 140 Ca 0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 1r15 h TRP 140 Cb 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.17 1r15 h TRP 140 CO -0.00 0.11 -0.06 0.78 -3.56 0.00 0.00 178.44 175.70 1r15 h GLY 141 N 0.44 -0.18 0.98 1.49 0.00 -0.47 0.11 103.07 105.44 1r15 h GLY 141 Ca -0.00 0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 1r15 h GLY 141 CO 0.01 -0.07 0.20 1.98 0.00 0.00 0.00 176.54 178.67 1r15 h MET 142 N -0.52 0.46 -0.40 4.80 1.85 -1.30 -0.57 114.93 119.24 1r15 h MET 142 Ca -0.02 -0.04 0.08 0.00 -0.61 0.00 0.00 59.70 59.11 1r15 h MET 142 Cb 0.41 -0.10 -0.07 0.00 0.43 0.00 0.00 31.60 32.27 1r15 h MET 142 CO 0.03 0.34 -0.05 0.00 -0.40 0.00 0.00 176.91 176.83 1r15 h ALA 143 N 1.09 0.32 -0.85 0.39 0.00 -0.26 0.29 119.26 120.24 1r15 h ALA 143 Ca 0.12 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1r15 h ALA 143 Cb 0.00 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1r15 h ALA 143 CO -0.02 -0.43 0.54 0.77 0.00 0.00 0.00 179.25 180.11 1r15 h SER 144 N 0.05 0.99 0.25 0.00 0.02 -0.13 0.20 113.55 114.93 1r15 h SER 144 Ca 0.19 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1r15 h SER 144 Cb 0.29 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1r15 h SER 144 CO -0.37 0.74 -0.12 0.28 -1.14 0.00 0.00 176.83 176.22 1r15 h SER 145 N 1.16 -0.28 -0.53 3.07 0.02 0.55 -0.26 113.55 117.29 1r15 h SER 145 Ca 0.31 -0.18 0.06 0.00 -0.84 0.00 0.00 61.79 61.14 1r15 h SER 145 Cb -0.10 0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.46 1r15 h SER 145 CO -0.06 0.03 0.23 -1.28 -1.14 0.00 0.00 176.83 174.62 1r15 h SER 146 N -0.62 0.30 0.49 3.07 0.87 -0.36 0.73 113.55 118.03 1r15 h SER 146 Ca -0.03 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.56 1r15 h SER 146 Cb 0.44 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 1r15 h SER 146 CO 0.06 0.20 -0.41 0.22 -0.53 0.00 0.00 176.83 176.37 1r15 h TYR 147 N 0.45 -1.10 -0.82 2.24 3.20 -0.84 -2.56 116.97 117.54 1r15 h TYR 147 Ca 0.24 0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.19 1r15 h TYR 147 Cb 0.21 0.42 -0.07 0.00 1.54 0.00 0.00 36.73 38.83 1r15 h TYR 147 CO -0.13 -0.58 0.49 0.00 -1.64 0.00 0.00 178.16 176.30 1r15 h ALA 148 N -0.56 1.15 -0.46 1.82 0.00 -0.66 -0.18 119.26 120.36 1r15 h ALA 148 Ca -0.05 0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1r15 h ALA 148 Cb 0.76 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1r15 h ALA 148 CO -0.02 0.17 0.32 1.25 0.00 0.00 0.00 179.25 180.97 1r15 h HIS 149 N 0.85 0.11 -0.01 0.00 -0.00 -0.60 -0.31 115.15 115.19 1r15 h HIS 149 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.75 1r15 h HIS 149 Cb 0.26 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 27.64 1r15 h HIS 149 CO -0.05 0.05 -0.21 0.43 -0.00 0.00 0.00 177.93 178.15 1r15 n SER 150 N -4.43 0.76 -4.77 3.26 7.64 -0.10 -4.56 113.62 111.43 1r15 n SER 150 Ca 0.08 -0.71 -0.38 0.00 1.01 0.00 0.00 58.87 58.87 1r15 n SER 150 Cb 0.46 0.05 -0.01 0.00 -1.01 0.00 0.00 64.21 63.70 1r15 n SER 150 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1r15 s ALA 151 N -2.52 3.05 0.07 -0.43 0.00 -0.13 -4.21 121.76 117.59 1r15 s ALA 151 Ca 0.25 1.03 -0.00 0.00 0.00 0.00 0.00 51.96 53.24 1r15 s ALA 151 Cb 0.19 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 1r15 s ALA 151 CO 0.51 -0.72 -0.03 -1.21 0.00 0.00 0.00 175.76 174.31 1r15 s GLU 152 N -2.54 0.71 5.06 0.00 2.02 -1.26 -4.43 118.70 118.26 1r15 s GLU 152 Ca 0.62 -1.28 0.00 0.00 0.02 0.00 0.00 54.97 54.33 1r15 s GLU 152 Cb -0.32 0.07 0.00 0.00 0.10 0.00 0.00 34.13 33.99 1r15 s GLU 152 CO 0.39 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 175.99 1r15 n GLY 153 N 0.04 2.02 3.77 -1.39 0.00 0.28 -1.99 105.19 107.93 1r15 n GLY 153 Ca -0.13 -0.51 -0.39 0.00 0.00 0.00 0.00 46.02 44.99 1r15 n GLY 153 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r15 s GLU 154 N 0.00 4.36 0.07 1.61 2.02 -1.26 -0.70 118.70 124.79 1r15 s GLU 154 Ca 0.00 1.82 0.08 0.00 0.02 0.00 0.00 54.97 56.89 1r15 s GLU 154 Cb 0.00 -2.92 -0.03 0.00 0.10 0.00 0.00 34.13 31.28 1r15 s GLU 154 CO 0.00 -0.05 -0.22 0.08 0.02 0.00 0.00 175.26 175.09 1r15 s VAL 155 N -1.31 1.81 -0.01 2.63 1.01 -0.23 -3.45 120.40 120.85 1r15 s VAL 155 Ca 0.51 -1.38 0.07 0.00 0.00 0.00 0.00 61.98 61.18 1r15 s VAL 155 Cb -0.31 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 1r15 s VAL 155 CO 0.40 0.14 -0.23 -0.89 0.00 0.00 0.00 175.10 174.52 1r15 s THR 156 N -0.93 1.82 -0.09 3.92 2.01 -0.34 -1.00 115.64 121.03 1r15 s THR 156 Ca 0.08 -1.03 -0.00 0.00 0.31 0.00 0.00 61.69 61.06 1r15 s THR 156 Cb -0.09 -1.52 0.02 0.00 0.01 0.00 0.00 72.50 70.92 1r15 s THR 156 CO 0.03 0.47 -0.06 -0.47 -0.69 0.00 0.00 174.62 173.91 1r15 s TYR 157 N -0.58 1.20 -0.17 4.92 5.04 0.24 0.68 117.35 128.68 1r15 s TYR 157 Ca 0.09 -0.52 -0.05 0.00 -2.44 0.00 0.00 57.07 54.15 1r15 s TYR 157 Cb -0.09 -1.05 -0.03 0.00 0.35 0.00 0.00 41.96 41.14 1r15 s TYR 157 CO -0.00 -0.41 -0.01 1.41 -1.34 0.00 0.00 175.55 175.20 1r15 s MET 158 N 1.59 3.73 0.18 4.97 -2.45 -0.12 -0.04 119.30 127.17 1r15 s MET 158 Ca 0.01 -0.48 0.06 0.00 -1.25 0.00 0.00 55.69 54.03 1r15 s MET 158 Cb -0.13 -3.02 -0.05 0.00 1.25 0.00 0.00 34.83 32.88 1r15 s MET 158 CO -0.05 0.20 -0.11 0.14 1.05 0.00 0.00 175.02 176.25 1r15 s VAL 159 N 0.50 1.42 -0.32 10.11 -7.23 -0.22 -1.31 120.40 123.36 1r15 s VAL 159 Ca -0.01 -2.13 -0.22 0.00 -1.81 0.00 0.00 61.98 57.81 1r15 s VAL 159 Cb -0.14 -2.00 -0.00 0.00 0.56 0.00 0.00 36.38 34.80 1r15 s VAL 159 CO 0.02 -0.63 0.71 -0.62 -0.31 0.00 0.00 175.10 174.27 1r15 s ASP 160 N -3.25 6.55 -0.04 4.85 -1.08 -1.22 -0.25 116.67 122.22 1r15 s ASP 160 Ca 0.21 0.46 0.20 0.00 -0.52 0.00 0.00 52.55 52.90 1r15 s ASP 160 Cb 0.01 -2.37 0.63 0.00 -1.46 0.00 0.00 42.92 39.74 1r15 s ASP 160 CO 0.04 -0.58 1.54 0.61 0.52 0.00 0.00 175.17 177.31 1r15 n GLY 161 N 4.39 2.67 0.38 2.66 0.00 0.98 -4.01 105.19 112.27 1r15 n GLY 161 Ca 0.01 -0.78 0.08 0.00 0.00 0.00 0.00 46.02 45.33 1r15 n GLY 161 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1r15 n SER 162 N 1.28 1.96 -4.13 1.61 7.64 -1.24 -0.36 113.62 120.39 1r15 n SER 162 Ca 0.23 -3.53 -0.36 0.00 1.01 0.00 0.00 58.87 56.22 1r15 n SER 162 Cb 0.70 -0.48 -0.12 0.00 -1.01 0.00 0.00 64.21 63.30 1r15 n SER 162 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1r15 s ASN 163 N -3.06 5.20 0.54 6.43 3.04 -1.26 -4.83 114.94 121.00 1r15 s ASN 163 Ca 0.35 -1.90 0.25 0.00 0.04 0.00 0.00 52.86 51.60 1r15 s ASN 163 Cb 0.33 -1.81 1.42 0.00 -1.54 0.00 0.00 41.25 39.65 1r15 s ASN 163 CO -0.03 -0.50 2.01 1.55 -3.04 0.00 0.00 177.10 177.10 1r15 h PRO 164 N 8.04 0.00 0.00 0.43 0.13 -1.93 -2.18 132.00 136.49 1r15 h PRO 164 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1r15 h PRO 164 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1r15 h PRO 164 CO 0.67 0.00 -1.01 1.63 -0.23 0.00 0.00 178.00 179.06 1r15 n LYS 165 N -4.28 0.59 -3.80 0.86 5.02 -1.26 -4.83 118.16 110.46 1r15 n LYS 165 Ca 0.08 0.11 -0.29 0.00 -2.02 0.00 0.00 58.31 56.20 1r15 n LYS 165 Cb 0.55 -1.81 -0.16 0.00 -0.02 0.00 0.00 35.03 33.59 1r15 n LYS 165 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1r15 s VAL 166 N -3.36 0.91 0.64 -0.18 1.01 -0.82 -5.12 120.40 113.49 1r15 s VAL 166 Ca -0.00 -0.89 -0.18 0.00 0.00 0.00 0.00 61.98 60.90 1r15 s VAL 166 Cb 0.10 -1.37 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 1r15 s VAL 166 CO 0.79 -0.23 1.28 -0.81 0.00 0.00 0.00 175.10 176.13 1r15 n PRO 167 N 4.89 1.13 -0.15 2.72 -0.04 -1.26 -4.54 135.00 137.76 1r15 n PRO 167 Ca -0.09 0.44 -0.07 0.00 -0.04 0.00 0.00 63.50 63.74 1r15 n PRO 167 Cb 0.45 -2.52 -0.01 0.00 -0.04 0.00 0.00 33.50 31.38 1r15 n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r15 h ALA 168 N 0.56 -0.16 -3.51 0.55 0.00 -1.90 -3.39 119.26 111.41 1r15 h ALA 168 Ca -0.51 0.12 -0.68 0.00 0.00 0.00 0.00 54.91 53.84 1r15 h ALA 168 Cb 1.34 0.76 -0.18 0.00 0.00 0.00 0.00 17.79 19.71 1r15 h ALA 168 CO 0.53 -0.73 -0.67 -0.47 0.00 0.00 0.00 179.25 177.92 1r15 s TYR 169 N -5.98 3.02 -0.06 0.00 5.04 -1.26 -4.69 117.35 113.43 1r15 s TYR 169 Ca -0.15 0.04 -0.02 0.00 -2.44 0.00 0.00 57.07 54.50 1r15 s TYR 169 Cb 0.14 -1.76 0.04 0.00 0.35 0.00 0.00 41.96 40.72 1r15 s TYR 169 CO 0.68 0.34 0.12 1.03 -1.34 0.00 0.00 175.55 176.38 1r15 s ARG 170 N -0.70 0.06 0.60 4.97 0.52 -1.26 -4.82 118.95 118.33 1r15 s ARG 170 Ca 0.11 0.33 0.29 0.00 -0.52 0.00 0.00 55.73 55.94 1r15 s ARG 170 Cb -0.11 -0.20 1.59 0.00 0.52 0.00 0.00 34.95 36.75 1r15 s ARG 170 CO 0.02 -0.17 1.99 -1.35 0.02 0.00 0.00 175.30 175.81 1r15 h PRO 171 N 7.26 0.00 -0.59 3.54 0.11 -1.99 -2.44 132.00 137.89 1r15 h PRO 171 Ca -0.44 0.00 -0.42 0.00 0.11 0.00 0.00 66.00 65.25 1r15 h PRO 171 Cb 1.14 0.00 -0.30 0.00 0.11 0.00 0.00 31.00 31.94 1r15 h PRO 171 CO 0.44 0.00 -0.50 -0.40 -0.21 0.00 0.00 178.00 177.32 1r15 n ASP 172 N -3.60 4.34 -4.96 -2.05 5.75 -1.26 -2.97 116.55 111.79 1r15 n ASP 172 Ca 0.04 -3.79 -0.22 0.00 -0.01 0.00 0.00 54.79 50.81 1r15 n ASP 172 Cb 0.48 -0.47 0.01 0.00 -1.03 0.00 0.00 41.12 40.10 1r15 n ASP 172 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1r15 s SER 173 N -3.23 5.91 0.46 -1.12 1.04 -0.92 -4.83 113.70 111.02 1r15 s SER 173 Ca 0.49 0.23 0.18 0.00 0.48 0.00 0.00 55.95 57.33 1r15 s SER 173 Cb 0.41 -1.54 1.15 0.00 0.10 0.00 0.00 66.02 66.14 1r15 s SER 173 CO 0.01 -0.60 1.97 -0.26 0.98 0.00 0.00 173.24 175.34 1r15 h PHE 174 N 0.53 0.31 0.33 5.02 -1.00 -1.93 0.29 116.94 120.49 1r15 h PHE 174 Ca -0.47 0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.31 1r15 h PHE 174 Cb 1.25 -0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.71 1r15 h PHE 174 CO 0.45 0.13 -0.16 0.35 -1.61 0.00 0.00 178.31 177.48 1r15 h PHE 175 N 0.28 -0.41 0.00 -0.55 3.57 -1.89 0.32 116.94 118.26 1r15 h PHE 175 Ca 0.29 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.74 1r15 h PHE 175 Cb 0.76 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 1r15 h PHE 175 CO -0.00 -0.15 -0.20 0.78 -2.23 0.00 0.00 178.31 176.51 1r15 h GLY 176 N -0.61 0.00 0.57 2.40 0.00 -1.24 0.19 103.07 104.38 1r15 h GLY 176 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 46.99 1r15 h GLY 176 CO 0.07 0.00 -1.56 0.50 0.00 0.00 0.00 176.54 175.56 1r15 h LYS 177 N 0.00 0.25 0.00 4.80 1.57 -0.37 -3.41 116.57 119.41 1r15 h LYS 177 Ca -0.00 -0.42 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1r15 h LYS 177 Cb 0.43 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1r15 h LYS 177 CO 0.03 1.20 -0.93 0.66 -0.57 0.00 0.00 179.45 179.84 1r15 n TYR 178 N -3.84 0.00 -0.02 -1.35 4.01 0.11 -4.75 117.16 111.33 1r15 n TYR 178 Ca -0.27 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.47 1r15 n TYR 178 Cb 0.93 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.96 1r15 n TYR 178 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 1r15 h GLU 179 N 0.00 0.00 -0.63 -0.72 5.08 -0.55 -3.33 114.58 114.44 1r15 h GLU 179 Ca 0.00 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.49 1r15 h GLU 179 Cb 0.69 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.85 1r15 h GLU 179 CO 0.00 0.00 0.08 1.25 -1.00 0.00 0.00 179.01 179.34 1r15 h LEU 180 N -0.27 -0.12 -1.44 1.33 5.85 -0.99 -1.11 115.31 118.56 1r15 h LEU 180 Ca 0.00 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1r15 h LEU 180 Cb 0.06 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.31 1r15 h LEU 180 CO 0.00 -0.06 0.00 -0.65 -0.34 0.00 0.00 178.44 177.39 1r15 h PRO 181 N 0.19 0.00 -0.30 5.25 0.11 -1.79 -2.74 132.00 132.72 1r15 h PRO 181 Ca 0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.44 1r15 h PRO 181 Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 1r15 h PRO 181 CO -0.47 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.41 1r15 n ASN 182 N -2.58 3.18 -4.72 -2.05 3.02 -0.44 -4.94 115.26 106.73 1r15 n ASN 182 Ca 0.00 -1.93 -0.42 0.00 -0.03 0.00 0.00 54.58 52.20 1r15 n ASN 182 Cb 0.17 -0.19 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 1r15 n ASN 182 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1r15 s LEU 183 N -1.41 4.37 0.75 3.41 1.43 -1.04 -3.72 118.68 122.47 1r15 s LEU 183 Ca 0.33 2.58 -0.06 0.00 -1.03 0.00 0.00 54.13 55.95 1r15 s LEU 183 Cb 0.20 -3.59 0.11 0.00 0.03 0.00 0.00 46.19 42.93 1r15 s LEU 183 CO 0.28 -0.80 1.05 0.42 0.23 0.00 0.00 176.35 177.52 1r15 s THR 184 N 1.15 2.21 -1.71 5.49 -4.23 -1.26 -4.94 115.64 112.35 1r15 s THR 184 Ca 0.69 -0.36 0.13 0.00 -1.18 0.00 0.00 61.69 60.97 1r15 s THR 184 Cb -0.43 -2.85 0.30 0.00 1.34 0.00 0.00 72.50 70.86 1r15 s THR 184 CO 0.31 0.00 1.27 -0.46 -0.54 0.00 0.00 174.62 175.20 1r15 n ASN 185 N -3.01 0.00 0.16 3.99 6.94 -1.26 -1.13 115.26 120.94 1r15 n ASN 185 Ca 0.12 -0.15 0.13 0.00 -0.02 0.00 0.00 54.58 54.66 1r15 n ASN 185 Cb 0.60 -0.15 0.38 0.00 -2.36 0.00 0.00 39.78 38.25 1r15 n ASN 185 CO 0.00 0.00 0.00 0.11 -1.03 0.00 0.00 177.26 176.34 1r15 h LYS 186 N 0.00 0.00 -6.47 -3.83 1.57 -1.92 -3.43 116.57 102.49 1r15 h LYS 186 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1r15 h LYS 186 Cb 0.06 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1r15 h LYS 186 CO 0.00 0.00 0.22 0.08 -0.57 0.00 0.00 179.45 179.18 1r15 s VAL 187 N -3.21 4.50 -0.25 0.50 1.01 -0.29 -0.55 120.40 122.11 1r15 s VAL 187 Ca 0.08 1.79 -0.16 0.00 0.00 0.00 0.00 61.98 63.69 1r15 s VAL 187 Cb 0.10 -4.18 -0.12 0.00 0.00 0.00 0.00 36.38 32.17 1r15 s VAL 187 CO 0.58 0.42 -0.27 0.41 0.00 0.00 0.00 175.10 176.25 1r15 n THR 188 N 2.28 1.52 -4.03 3.92 -1.04 0.12 -4.82 114.28 112.24 1r15 n THR 188 Ca -0.03 -0.25 -0.09 0.00 -2.04 0.00 0.00 64.05 61.65 1r15 n THR 188 Cb 0.49 -1.98 -0.09 0.00 -1.82 0.00 0.00 70.33 66.93 1r15 n THR 188 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 1r15 s ARG 189 N -2.53 0.84 -0.27 -2.82 3.52 -1.24 -1.58 118.95 114.87 1r15 s ARG 189 Ca -0.35 -1.21 0.01 0.00 -0.13 0.00 0.00 55.73 54.05 1r15 s ARG 189 Cb 0.12 0.28 0.08 0.00 -1.56 0.00 0.00 34.95 33.86 1r15 s ARG 189 CO 0.49 -0.24 0.00 0.08 -0.81 0.00 0.00 175.30 174.82 1r15 s VAL 190 N -3.95 1.44 -0.21 7.11 1.01 -0.53 -1.07 120.40 124.20 1r15 s VAL 190 Ca 0.13 -1.40 -0.14 0.00 0.00 0.00 0.00 61.98 60.56 1r15 s VAL 190 Cb 0.06 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1r15 s VAL 190 CO -0.06 -0.32 0.32 -0.54 0.00 0.00 0.00 175.10 174.51 1r15 s LYS 191 N 1.40 4.16 -0.05 2.72 1.02 -0.17 -1.87 119.74 126.94 1r15 s LYS 191 Ca 0.01 0.07 -0.02 0.00 0.02 0.00 0.00 55.97 56.05 1r15 s LYS 191 Cb -0.18 -3.52 -0.04 0.00 -0.52 0.00 0.00 37.83 33.57 1r15 s LYS 191 CO -0.11 0.02 0.05 0.08 -0.92 0.00 0.00 175.35 174.47 1r15 s VAL 192 N 1.14 4.63 -0.20 3.17 1.01 -0.06 -0.59 120.40 129.50 1r15 s VAL 192 Ca 0.16 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.88 1r15 s VAL 192 Cb -0.14 -3.03 0.04 0.00 0.00 0.00 0.00 36.38 33.25 1r15 s VAL 192 CO 0.07 0.49 -0.13 -0.63 0.00 0.00 0.00 175.10 174.90 1r15 s ILE 193 N -1.04 1.82 -0.17 2.22 1.01 0.95 -1.47 121.20 124.52 1r15 s ILE 193 Ca 0.18 -1.09 -0.16 0.00 0.00 0.00 0.00 60.65 59.58 1r15 s ILE 193 Cb -0.12 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.47 1r15 s ILE 193 CO 0.08 0.23 0.37 -0.69 0.00 0.00 0.00 174.94 174.93 1r15 s VAL 194 N 1.32 5.24 -0.23 2.92 1.01 0.52 -1.05 120.40 130.13 1r15 s VAL 194 Ca -0.01 0.69 -0.11 0.00 0.00 0.00 0.00 61.98 62.56 1r15 s VAL 194 Cb -0.16 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 1r15 s VAL 194 CO -0.09 0.32 0.17 -0.22 0.00 0.00 0.00 175.10 175.28 1r15 s LEU 195 N 0.83 4.13 -0.68 3.92 0.20 0.65 -1.35 118.68 126.38 1r15 s LEU 195 Ca 0.19 0.15 -0.05 0.00 0.69 0.00 0.00 54.13 55.11 1r15 s LEU 195 Cb -0.14 -2.13 0.18 0.00 -0.43 0.00 0.00 46.19 43.67 1r15 s LEU 195 CO 0.07 0.07 0.53 -1.00 -0.29 0.00 0.00 176.35 175.73 1r15 s HIS 196 N 0.97 3.49 0.20 5.38 3.76 -1.26 -0.01 115.29 127.82 1r15 s HIS 196 Ca 0.08 -2.57 -0.29 0.00 -0.15 0.00 0.00 55.06 52.14 1r15 s HIS 196 Cb -0.13 -3.34 -0.17 0.00 1.11 0.00 0.00 32.58 30.05 1r15 s HIS 196 CO 0.04 -0.87 0.66 0.54 -0.85 0.00 0.00 174.74 174.26 1r15 n ARG 197 N 3.54 0.28 -1.91 1.40 1.74 -1.26 -4.81 116.66 115.64 1r15 n ARG 197 Ca 0.10 0.10 -0.41 0.00 -0.77 0.00 0.00 57.85 56.86 1r15 n ARG 197 Cb 0.40 -1.22 -0.02 0.00 -1.02 0.00 0.00 32.46 30.60 1r15 n ARG 197 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1r15 s LEU 198 N 2.27 4.37 -1.26 0.55 1.43 -1.26 -2.88 118.68 121.90 1r15 s LEU 198 Ca 0.65 2.80 -0.06 0.00 -1.03 0.00 0.00 54.13 56.49 1r15 s LEU 198 Cb -0.91 -3.63 0.01 0.00 0.03 0.00 0.00 46.19 41.69 1r15 s LEU 198 CO 0.57 -0.79 0.79 0.61 0.23 0.00 0.00 176.35 177.75 1r15 n GLY 199 N 2.09 -0.35 3.01 -3.19 0.00 -1.26 -5.01 105.19 100.48 1r15 n GLY 199 Ca 0.07 0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.98 1r15 n GLY 199 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r15 s GLU 200 N -5.85 0.67 0.21 1.61 0.41 -1.14 -5.10 118.70 109.51 1r15 s GLU 200 Ca 0.39 -0.30 -0.32 0.00 -0.41 0.00 0.00 54.97 54.32 1r15 s GLU 200 Cb -0.17 -0.65 -0.13 0.00 -1.78 0.00 0.00 34.13 31.40 1r15 s GLU 200 CO 0.48 0.18 1.63 1.17 -0.49 0.00 0.00 175.26 178.23 1r15 n LYS 201 N 2.86 2.50 -2.23 1.61 4.81 -1.26 -4.86 118.16 121.59 1r15 n LYS 201 Ca -0.13 0.90 -0.42 0.00 -0.87 0.00 0.00 58.31 57.79 1r15 n LYS 201 Cb 0.57 -2.70 -0.03 0.00 0.02 0.00 0.00 35.03 32.89 1r15 n LYS 201 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1r15 s ILE 202 N 0.83 3.43 -0.16 3.15 1.01 -1.26 -4.67 121.20 123.53 1r15 s ILE 202 Ca 0.74 1.05 -0.05 0.00 0.00 0.00 0.00 60.65 62.39 1r15 s ILE 202 Cb -0.57 -3.67 -0.08 0.00 0.01 0.00 0.00 42.46 38.14 1r15 s ILE 202 CO 0.38 0.10 -0.19 -0.38 0.00 0.00 0.00 174.94 174.85 1r15 n ILE 203 N 3.65 0.87 -4.20 2.92 2.08 0.52 -5.00 119.36 120.20 1r15 n ILE 203 Ca 0.10 -0.25 -0.29 0.00 0.56 0.00 0.00 62.75 62.86 1r15 n ILE 203 Cb 0.43 -1.53 -0.09 0.00 -0.75 0.00 0.00 39.64 37.71 1r15 n ILE 203 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1r15 s GLU 204 N -2.30 2.26 0.04 0.38 0.41 0.30 -5.01 118.70 114.78 1r15 s GLU 204 Ca -0.22 -1.00 -0.04 0.00 -0.41 0.00 0.00 54.97 53.30 1r15 s GLU 204 Cb 0.08 -2.36 -0.02 0.00 -1.78 0.00 0.00 34.13 30.05 1r15 s GLU 204 CO 0.30 0.50 0.05 0.15 -0.49 0.00 0.00 175.26 175.78 1r15 s LYS 205 N -2.37 0.55 0.56 1.61 1.02 -1.26 -4.86 119.74 115.00 1r15 s LYS 205 Ca 0.23 -0.82 -0.21 0.00 0.02 0.00 0.00 55.97 55.20 1r15 s LYS 205 Cb -0.11 0.21 -0.04 0.00 -0.52 0.00 0.00 37.83 37.36 1r15 s LYS 205 CO 0.16 -0.12 1.31 0.00 -0.92 0.00 0.00 175.35 175.77 1r15 n GLY 207 N 0.84 0.27 3.19 0.00 0.00 -1.26 -4.93 105.19 103.30 1r15 n GLY 207 Ca 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 1r15 n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r15 s ALA 208 N -1.66 1.11 0.00 4.61 0.00 -0.90 -4.60 121.76 120.33 1r15 s ALA 208 Ca 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.55 1r15 s ALA 208 Cb 0.00 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.33 1r15 s ALA 208 CO 0.00 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1r15 n GLY 209 N -0.10 2.58 0.22 0.00 0.00 -1.26 -1.81 105.19 104.83 1r15 n GLY 209 Ca -0.11 -0.19 0.08 0.00 0.00 0.00 0.00 46.02 45.80 1r15 n GLY 209 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1r15 h SER 210 N 2.70 0.00 -0.11 1.61 4.64 -1.91 -2.26 113.55 118.21 1r15 h SER 210 Ca 0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 1r15 h SER 210 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1r15 h SER 210 CO 0.00 0.24 -0.23 -0.07 -0.87 0.00 0.00 176.83 175.90 1r15 h LEU 211 N 0.00 0.54 -0.48 5.97 -0.00 -1.63 0.57 115.31 120.29 1r15 h LEU 211 Ca -0.00 -0.18 -0.14 0.00 -0.00 0.00 0.00 57.88 57.56 1r15 h LEU 211 Cb 0.55 -0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 41.06 1r15 h LEU 211 CO 0.03 0.77 -0.29 0.25 -0.00 0.00 0.00 178.44 179.20 1r15 h LEU 212 N 0.48 0.99 -0.35 1.67 7.12 -0.82 -1.33 115.31 123.08 1r15 h LEU 212 Ca 0.07 -0.41 -0.06 0.00 0.13 0.00 0.00 57.88 57.62 1r15 h LEU 212 Cb 0.66 -0.28 -0.01 0.00 -0.53 0.00 0.00 40.66 40.50 1r15 h LEU 212 CO 0.05 1.20 -0.00 0.44 -0.13 0.00 0.00 178.44 179.99 1r15 h ASP 213 N 0.80 0.60 -0.49 1.25 3.32 -0.94 -2.73 116.42 118.24 1r15 h ASP 213 Ca 0.09 -0.31 0.03 0.00 0.02 0.00 0.00 57.03 56.85 1r15 h ASP 213 Cb 0.87 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.22 1r15 h ASP 213 CO 0.08 0.77 0.28 0.25 -1.72 0.00 0.00 179.24 178.90 1r15 h LEU 214 N 0.42 0.45 -0.38 1.55 5.85 -0.82 0.14 115.31 122.53 1r15 h LEU 214 Ca 0.10 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.90 1r15 h LEU 214 Cb 0.46 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.34 1r15 h LEU 214 CO 0.02 0.32 -0.03 -0.08 -0.34 0.00 0.00 178.44 178.32 1r15 h GLU 215 N 0.56 0.06 -0.10 1.25 4.81 -1.08 0.78 114.58 120.87 1r15 h GLU 215 Ca 0.20 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1r15 h GLU 215 Cb 0.04 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1r15 h GLU 215 CO -0.10 0.04 0.06 0.87 -0.73 0.00 0.00 179.01 179.15 1r15 h LYS 216 N 0.07 0.14 -0.99 1.92 1.57 -1.15 -0.25 116.57 117.87 1r15 h LYS 216 Ca 0.18 -0.01 0.10 0.00 -1.87 0.00 0.00 60.65 59.05 1r15 h LYS 216 Cb 0.27 -0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.47 1r15 h LYS 216 CO -0.34 0.13 0.63 1.25 -0.57 0.00 0.00 179.45 180.56 1r15 h LEU 217 N 0.10 0.96 0.02 2.94 5.85 0.08 0.17 115.31 125.43 1r15 h LEU 217 Ca 0.04 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1r15 h LEU 217 Cb 0.03 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.90 1r15 h LEU 217 CO -0.01 0.56 -0.01 0.58 -0.34 0.00 0.00 178.44 179.22 1r15 h VAL 218 N 1.06 1.37 -0.02 1.05 2.07 0.90 -2.50 116.25 120.18 1r15 h VAL 218 Ca 0.47 -1.29 0.01 0.00 0.82 0.00 0.00 66.70 66.70 1r15 h VAL 218 Cb 0.35 2.23 -0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1r15 h VAL 218 CO -0.23 0.33 0.02 0.11 0.02 0.00 0.00 177.57 177.82 1r15 h LYS 219 N -0.60 0.00 -0.08 1.57 1.57 -0.73 -0.34 116.57 117.96 1r15 h LYS 219 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1r15 h LYS 219 Cb 0.56 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.87 1r15 h LYS 219 CO 0.01 0.00 0.04 0.00 -0.57 0.00 0.00 179.45 178.92 1r15 h ALA 220 N 1.99 0.11 0.00 3.86 0.00 -0.52 0.15 119.26 124.84 1r15 h ALA 220 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1r15 h ALA 220 Cb 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1r15 h ALA 220 CO -0.00 -0.31 0.00 1.63 0.00 0.00 0.00 179.25 180.57 1r15 n LYS 221 N -4.94 0.54 -2.87 0.00 5.02 -0.17 -4.82 118.16 110.91 1r15 n LYS 221 Ca -0.06 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.13 1r15 n LYS 221 Cb 0.10 -1.18 0.05 0.00 -0.02 0.00 0.00 35.03 33.99 1r15 n LYS 221 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1r15 n HIS 222 N -0.68 -1.31 -4.39 2.13 8.25 0.04 -5.03 115.22 114.23 1r15 n HIS 222 Ca 0.05 0.53 -0.24 0.00 -0.26 0.00 0.00 57.72 57.79 1r15 n HIS 222 Cb 0.02 -3.56 -0.11 0.00 1.12 0.00 0.00 29.99 27.46 1r15 n HIS 222 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1r15 s PHE 223 N -3.19 2.10 0.78 4.41 0.08 -1.02 -4.99 117.98 116.13 1r15 s PHE 223 Ca 0.09 -0.40 -0.12 0.00 0.12 0.00 0.00 56.93 56.62 1r15 s PHE 223 Cb -0.04 -1.02 0.06 0.00 -0.57 0.00 0.00 43.02 41.44 1r15 s PHE 223 CO 0.40 0.46 1.10 0.00 -0.10 0.00 0.00 175.22 177.08 1r15 s ALA 224 N -1.94 2.46 -0.05 5.36 0.00 -0.62 -3.99 121.76 122.97 1r15 s ALA 224 Ca 0.20 -0.29 -0.03 0.00 0.00 0.00 0.00 51.96 51.83 1r15 s ALA 224 Cb -0.07 -3.07 0.03 0.00 0.00 0.00 0.00 23.12 20.01 1r15 s ALA 224 CO 0.09 -1.57 0.12 0.12 0.00 0.00 0.00 175.76 174.53 1r15 s PHE 225 N -3.25 -0.13 0.24 0.00 5.36 -1.26 -1.46 117.98 117.48 1r15 s PHE 225 Ca 0.60 0.38 0.06 0.00 -0.96 0.00 0.00 56.93 57.01 1r15 s PHE 225 Cb -0.13 -0.04 -0.05 0.00 -0.34 0.00 0.00 43.02 42.45 1r15 s PHE 225 CO 0.53 -0.12 -0.07 -0.51 -1.46 0.00 0.00 175.22 173.60 1r15 s ASP 226 N 0.70 2.46 -0.28 6.13 1.01 -0.78 -4.97 116.67 120.94 1r15 s ASP 226 Ca -0.05 -1.15 -0.20 0.00 0.71 0.00 0.00 52.55 51.85 1r15 s ASP 226 Cb -0.07 -0.11 0.09 0.00 1.01 0.00 0.00 42.92 43.84 1r15 s ASP 226 CO -0.03 -0.34 0.79 0.00 0.21 0.00 0.00 175.17 175.79 1r15 s VAL 228 N 0.98 0.05 -0.19 0.00 -7.23 -0.54 -4.94 120.40 108.53 1r15 s VAL 228 Ca -0.05 -0.45 -0.05 0.00 -1.81 0.00 0.00 61.98 59.63 1r15 s VAL 228 Cb -0.05 -0.21 -0.03 0.00 0.56 0.00 0.00 36.38 36.65 1r15 s VAL 228 CO -0.10 -0.25 -0.01 -1.61 -0.31 0.00 0.00 175.10 172.82 1r15 s GLU 229 N -0.76 3.64 -1.08 4.82 2.02 -1.26 -0.35 118.70 125.73 1r15 s GLU 229 Ca -0.08 -0.52 -0.23 0.00 0.02 0.00 0.00 54.97 54.16 1r15 s GLU 229 Cb -0.05 -3.03 0.03 0.00 0.10 0.00 0.00 34.13 31.18 1r15 s GLU 229 CO -0.00 0.08 0.65 0.09 0.02 0.00 0.00 175.26 176.11 1r15 n ASN 230 N 4.02 -4.38 -4.77 -0.19 4.13 -0.46 -4.87 115.26 108.75 1r15 n ASN 230 Ca -0.17 -1.19 -0.40 0.00 1.68 0.00 0.00 54.58 54.50 1r15 n ASN 230 Cb 0.52 -1.64 0.01 0.00 -1.54 0.00 0.00 39.78 37.14 1r15 n ASN 230 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1r15 s PRO 231 N -6.56 3.74 0.29 3.52 0.04 -1.26 -4.46 135.00 130.30 1r15 s PRO 231 Ca 0.32 2.37 0.01 0.00 0.04 0.00 0.00 61.00 63.74 1r15 s PRO 231 Cb -0.18 -2.67 0.70 0.00 0.04 0.00 0.00 34.50 32.39 1r15 s PRO 231 CO 0.95 -0.76 1.63 0.00 0.04 0.00 0.00 177.00 178.86 1r15 h ARG 232 N 2.39 0.14 -0.72 4.56 3.08 -1.98 0.24 114.38 122.09 1r15 h ARG 232 Ca -0.51 -0.01 0.12 0.00 0.07 0.00 0.00 59.98 59.66 1r15 h ARG 232 Cb 1.26 -0.03 -0.08 0.00 0.08 0.00 0.00 29.97 31.20 1r15 h ARG 232 CO 0.61 0.09 0.31 0.00 -1.07 0.00 0.00 179.97 179.91 1r15 h ALA 233 N 1.82 1.00 -0.06 0.04 0.00 -2.00 -0.04 119.26 120.01 1r15 h ALA 233 Ca 0.55 0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.43 1r15 h ALA 233 Cb 1.12 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.96 1r15 h ALA 233 CO -0.72 -0.16 -0.46 0.28 0.00 0.00 0.00 179.25 178.19 1r15 h VAL 234 N 0.49 1.41 -0.56 0.00 2.07 -0.98 -3.15 116.25 115.52 1r15 h VAL 234 Ca 0.38 -1.86 0.10 0.00 0.82 0.00 0.00 66.70 66.14 1r15 h VAL 234 Cb 0.51 2.36 -0.08 0.00 -1.52 0.00 0.00 31.29 32.56 1r15 h VAL 234 CO -0.35 0.55 0.11 0.25 0.02 0.00 0.00 177.57 178.15 1r15 h LEU 235 N -0.04 -0.00 -1.50 2.57 5.85 -0.26 0.39 115.31 122.32 1r15 h LEU 235 Ca -0.04 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.85 1r15 h LEU 235 Cb 1.13 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.26 1r15 h LEU 235 CO 0.09 0.02 0.42 -0.26 -0.34 0.00 0.00 178.44 178.37 1r15 h PHE 236 N 0.25 0.61 -0.49 1.25 0.04 -1.07 0.61 116.94 118.14 1r15 h PHE 236 Ca 0.29 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 61.02 1r15 h PHE 236 Cb 0.41 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.33 1r15 h PHE 236 CO -0.24 0.32 0.11 1.25 -0.60 0.00 0.00 178.31 179.16 1r15 h LEU 237 N 0.61 0.76 -0.66 1.54 5.85 -0.90 -1.84 115.31 120.65 1r15 h LEU 237 Ca 0.28 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 1r15 h LEU 237 Cb 0.31 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 1r15 h LEU 237 CO -0.09 0.80 0.31 -0.07 -0.34 0.00 0.00 178.44 179.05 1r15 h LEU 238 N 0.68 0.88 -1.40 2.25 3.38 -0.41 -2.68 115.31 118.01 1r15 h LEU 238 Ca 0.15 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1r15 h LEU 238 Cb 0.34 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1r15 h LEU 238 CO 0.00 0.77 0.35 0.00 0.09 0.00 0.00 178.44 179.66 1r15 h SER 240 N 0.77 0.35 0.61 0.00 0.87 -0.98 0.60 113.55 115.78 1r15 h SER 240 Ca 0.21 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 1r15 h SER 240 Cb -0.05 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 1r15 h SER 240 CO -0.04 0.19 -0.02 0.47 -0.53 0.00 0.00 176.83 176.90 1r15 n ASP 241 N -4.93 0.05 -2.81 6.23 9.92 -1.04 -4.33 116.55 119.63 1r15 n ASP 241 Ca 0.11 -0.09 -0.07 0.00 -0.53 0.00 0.00 54.79 54.21 1r15 n ASP 241 Cb 0.31 -0.29 0.01 0.00 -0.64 0.00 0.00 41.12 40.51 1r15 n ASP 241 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1r15 n ASN 242 N -1.29 -3.10 -0.19 -2.24 4.05 -0.10 -5.02 115.26 107.37 1r15 n ASN 242 Ca 0.13 -2.94 0.00 0.00 0.45 0.00 0.00 54.58 52.22 1r15 n ASN 242 Cb 0.26 1.56 0.24 0.00 1.23 0.00 0.00 39.78 43.07 1r15 n ASN 242 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 1r15 h PRO 243 N 4.87 0.94 0.00 1.20 0.11 -1.16 -2.92 132.00 135.04 1r15 h PRO 243 Ca 0.04 -0.08 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 1r15 h PRO 243 Cb 1.08 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 1r15 h PRO 243 CO 0.10 0.66 -0.18 -0.91 -0.21 0.00 0.00 178.00 177.45 1r15 h ASN 244 N 0.95 0.00 -0.95 -2.05 4.21 -1.96 -3.44 115.58 112.34 1r15 h ASN 244 Ca 0.25 0.00 -0.67 0.00 1.21 0.00 0.00 56.30 57.09 1r15 h ASN 244 Cb -0.03 0.00 0.09 0.00 -1.12 0.00 0.00 38.32 37.25 1r15 h ASN 244 CO -0.05 0.18 -0.33 0.00 -1.29 0.00 0.00 177.43 175.94 1r15 n ALA 245 N -2.21 -3.01 -0.20 -0.83 0.00 -1.10 -4.80 120.51 108.35 1r15 n ALA 245 Ca -0.00 0.47 0.05 0.00 0.00 0.00 0.00 53.44 53.95 1r15 n ALA 245 Cb 0.39 -1.58 0.32 0.00 0.00 0.00 0.00 19.45 18.58 1r15 n ALA 245 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1r15 h ARG 246 N 1.54 0.81 0.00 0.00 1.12 -1.91 -1.48 114.38 114.45 1r15 h ARG 246 Ca -0.33 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 58.49 1r15 h ARG 246 Cb 1.37 -0.18 0.00 0.00 -0.01 0.00 0.00 29.97 31.15 1r15 h ARG 246 CO 0.57 0.53 0.00 0.39 -3.11 0.00 0.00 179.97 178.35 1r15 n GLU 247 N -4.47 0.48 -0.08 0.20 4.71 -1.26 -2.51 120.64 117.71 1r15 n GLU 247 Ca 0.10 0.04 0.06 0.00 -0.01 0.00 0.00 57.16 57.35 1r15 n GLU 247 Cb 0.18 -1.50 0.10 0.00 -1.01 0.00 0.00 31.44 29.21 1r15 n GLU 247 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1r15 n ARG 249 N 0.61 1.86 -2.90 0.00 1.74 -1.04 -4.91 116.66 112.01 1r15 n ARG 249 Ca 0.09 0.67 -0.40 0.00 -0.77 0.00 0.00 57.85 57.44 1r15 n ARG 249 Cb 0.35 -2.42 -0.05 0.00 -1.02 0.00 0.00 32.46 29.32 1r15 n ARG 249 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1r15 s LEU 250 N 1.28 4.55 0.00 0.55 1.43 -1.26 -5.15 118.68 120.08 1r15 s LEU 250 Ca 0.83 1.67 0.00 0.00 -1.03 0.00 0.00 54.13 55.60 1r15 s LEU 250 Cb -0.77 -3.38 0.00 0.00 0.03 0.00 0.00 46.19 42.07 1r15 s LEU 250 CO 0.43 0.11 0.23 0.00 0.23 0.00 0.00 176.35 177.34