#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 5.28 0.57 9.51 0.11 -1.26 -1.45 120.40 133.17 1r15 s VAL 2 Ca 0.00 0.60 -0.19 0.00 -2.93 0.00 0.00 61.98 59.47 1r15 s VAL 2 Cb 0.00 -3.66 -0.04 0.00 -1.53 0.00 0.00 36.38 31.14 1r15 s VAL 2 CO 0.00 0.36 1.16 -2.16 -3.33 0.00 0.00 175.10 171.14 1r15 s PRO 3 N 0.62 3.15 0.28 1.54 0.04 -1.26 -4.82 135.00 134.54 1r15 s PRO 3 Ca 0.18 1.70 -0.30 0.00 0.04 0.00 0.00 61.00 62.62 1r15 s PRO 3 Cb -0.13 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.33 1r15 s PRO 3 CO 0.05 -1.04 1.52 0.99 0.04 0.00 0.00 177.00 178.56 1r15 s THR 4 N -1.72 2.33 0.60 1.26 2.01 0.71 -4.95 115.64 115.88 1r15 s THR 4 Ca 0.75 0.28 -0.15 0.00 0.31 0.00 0.00 61.69 62.88 1r15 s THR 4 Cb -0.27 -3.18 -0.03 0.00 0.01 0.00 0.00 72.50 69.03 1r15 s THR 4 CO 0.30 0.05 1.05 -0.13 -0.69 0.00 0.00 174.62 175.20 1r15 s ARG 5 N -0.60 3.35 -1.61 4.92 0.52 -1.26 -3.81 118.95 120.46 1r15 s ARG 5 Ca 0.60 1.09 -0.06 0.00 -0.52 0.00 0.00 55.73 56.85 1r15 s ARG 5 Cb -0.45 -2.04 0.06 0.00 0.52 0.00 0.00 34.95 33.04 1r15 s ARG 5 CO 0.47 -0.78 0.15 0.39 0.02 0.00 0.00 175.30 175.55 1r15 n GLU 6 N -2.23 -0.88 -0.34 3.54 1.02 -1.26 -4.73 120.64 115.76 1r15 n GLU 6 Ca 0.08 0.10 -0.05 0.00 -0.02 0.00 0.00 57.16 57.28 1r15 n GLU 6 Cb 0.53 -3.80 -0.00 0.00 -0.02 0.00 0.00 31.44 28.15 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 -1.52 -1.55 -0.60 -4.62 5.85 -1.97 -0.27 115.31 110.63 1r15 h LEU 7 Ca -0.63 0.29 0.07 0.00 0.84 0.00 0.00 57.88 58.44 1r15 h LEU 7 Cb 1.38 0.76 -0.10 0.00 0.37 0.00 0.00 40.66 43.07 1r15 h LEU 7 CO 0.75 -0.29 -0.56 -0.33 -0.34 0.00 0.00 178.44 177.67 1r15 h GLU 8 N -0.06 -0.25 -0.21 1.25 4.39 -1.94 0.16 114.58 117.92 1r15 h GLU 8 Ca 0.27 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.99 1r15 h GLU 8 Cb 0.55 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 1r15 h GLU 8 CO -0.89 -0.17 0.14 -0.91 -1.16 0.00 0.00 179.01 176.01 1r15 h ASN 9 N -0.26 0.24 -0.40 1.42 2.35 -1.50 0.13 115.58 117.55 1r15 h ASN 9 Ca 0.11 -0.01 0.04 0.00 -0.55 0.00 0.00 56.30 55.89 1r15 h ASN 9 Cb 0.54 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.81 1r15 h ASN 9 CO -0.71 0.18 0.15 0.58 -1.65 0.00 0.00 177.43 175.98 1r15 h VAL 10 N 0.28 0.90 0.38 2.81 2.07 -0.62 0.76 116.25 122.82 1r15 h VAL 10 Ca 0.08 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1r15 h VAL 10 Cb -0.02 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1r15 h VAL 10 CO -0.02 0.06 -0.31 0.15 0.02 0.00 0.00 177.57 177.47 1r15 h PHE 11 N 0.32 -0.82 -0.52 1.57 3.04 -0.32 0.18 116.94 120.38 1r15 h PHE 11 Ca 0.18 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.11 1r15 h PHE 11 Cb 0.15 0.31 -0.03 0.00 2.56 0.00 0.00 35.95 38.94 1r15 h PHE 11 CO -0.14 -0.45 0.23 -0.07 -2.02 0.00 0.00 178.31 175.86 1r15 h LEU 12 N -0.69 0.67 0.04 0.59 3.38 -0.31 0.14 115.31 119.13 1r15 h LEU 12 Ca -0.03 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1r15 h LEU 12 Cb 0.60 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1r15 h LEU 12 CO -0.02 0.58 -0.02 1.23 0.09 0.00 0.00 178.44 180.31 1r15 h GLY 13 N 0.86 -0.05 1.39 0.83 0.00 0.96 -0.94 103.07 106.11 1r15 h GLY 13 Ca 0.18 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 1r15 h GLY 13 CO -0.02 -0.02 0.26 3.21 0.00 0.00 0.00 176.54 179.97 1r15 h ARG 14 N -0.39 0.80 0.34 4.80 3.08 -0.39 -0.79 114.38 121.83 1r15 h ARG 14 Ca -0.00 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 1r15 h ARG 14 Cb 0.36 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1r15 h ARG 14 CO 0.01 0.63 -0.16 0.00 -1.07 0.00 0.00 179.97 179.37 1r15 h LYS 16 N -0.61 0.74 -0.71 0.00 1.63 -0.89 0.08 116.57 116.81 1r15 h LYS 16 Ca -0.05 -0.04 0.05 0.00 -0.85 0.00 0.00 60.65 59.76 1r15 h LYS 16 Cb 0.44 -0.17 -0.05 0.00 -0.60 0.00 0.00 32.23 31.85 1r15 h LYS 16 CO 0.08 0.49 0.41 0.22 -3.45 0.00 0.00 179.45 177.20 1r15 h ASP 17 N 0.76 0.63 0.80 4.20 3.58 -1.08 -1.14 116.42 124.17 1r15 h ASP 17 Ca 0.25 0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.68 1r15 h ASP 17 Cb 0.01 -0.11 0.01 0.00 1.72 0.00 0.00 39.33 40.96 1r15 h ASP 17 CO -0.10 0.41 -0.38 0.22 -2.88 0.00 0.00 179.24 176.51 1r15 h TYR 18 N 0.77 -0.99 -0.90 0.28 5.03 -0.67 -0.60 116.97 119.88 1r15 h TYR 18 Ca 0.31 -0.02 0.09 0.00 2.58 0.00 0.00 58.73 61.68 1r15 h TYR 18 Cb 0.16 0.33 -0.12 0.00 1.55 0.00 0.00 36.73 38.65 1r15 h TYR 18 CO -0.06 -0.61 -0.57 1.49 -1.32 0.00 0.00 178.16 177.09 1r15 h GLU 19 N -1.21 -0.06 0.00 1.82 4.81 -0.69 -0.75 114.58 118.50 1r15 h GLU 19 Ca -0.11 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 58.96 1r15 h GLU 19 Cb 0.83 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 1r15 h GLU 19 CO 0.18 -0.04 -0.78 0.82 -0.73 0.00 0.00 179.01 178.46 1r15 h ILE 20 N -0.06 1.42 0.00 2.32 1.08 -1.25 -3.42 117.51 117.60 1r15 h ILE 20 Ca 0.16 -2.79 0.00 0.00 -0.39 0.00 0.00 64.86 61.84 1r15 h ILE 20 Cb 0.45 2.56 0.00 0.00 -3.07 0.00 0.00 36.82 36.76 1r15 h ILE 20 CO -0.89 0.76 0.00 0.35 -0.69 0.00 0.00 178.15 177.69 1r15 n THR 21 N -3.42 0.00 -0.05 -0.27 -2.24 -0.24 -4.99 114.28 103.07 1r15 n THR 21 Ca 0.00 -0.05 -0.01 0.00 -2.27 0.00 0.00 64.05 61.72 1r15 n THR 21 Cb 0.80 1.65 -0.00 0.00 -2.10 0.00 0.00 70.33 70.68 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 -1.01 -0.78 2.47 -1.08 -3.41 114.38 110.57 1r15 h ARG 22 Ca 0.00 0.00 -0.49 0.00 -1.26 0.00 0.00 59.98 58.23 1r15 h ARG 22 Cb 0.33 0.00 -0.42 0.00 -1.65 0.00 0.00 29.97 28.23 1r15 h ARG 22 CO 0.00 0.00 -0.89 0.66 0.56 0.00 0.00 179.97 180.30 1r15 n TYR 23 N -4.67 2.51 -0.32 3.04 4.02 -1.26 -4.87 117.16 115.61 1r15 n TYR 23 Ca -0.01 -2.61 0.23 0.00 -0.01 0.00 0.00 57.90 55.50 1r15 n TYR 23 Cb 0.04 -0.24 0.43 0.00 -0.02 0.00 0.00 39.34 39.56 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 -0.51 0.12 0.09 7.72 4.77 -1.26 -0.35 117.00 127.57 1r15 n LEU 24 Ca 0.31 1.63 0.11 0.00 -0.03 0.00 0.00 56.01 58.04 1r15 n LEU 24 Cb 0.81 -0.70 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 1r15 n LEU 24 CO 0.31 -1.74 -0.04 0.47 -1.33 0.00 0.00 177.39 175.05 1r15 n ASP 25 N -5.32 0.74 -0.03 -1.43 8.00 -1.26 -4.43 116.55 112.83 1r15 n ASP 25 Ca 0.30 0.25 -0.21 0.00 0.71 0.00 0.00 54.79 55.84 1r15 n ASP 25 Cb 1.01 0.61 -0.13 0.00 -0.02 0.00 0.00 41.12 42.59 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 -2.56 1.72 -4.41 0.53 -0.00 0.52 -4.97 119.36 110.19 1r15 n ILE 26 Ca -0.00 -0.62 -0.24 0.00 -0.00 0.00 0.00 62.75 61.89 1r15 n ILE 26 Cb 0.54 -1.68 -0.13 0.00 -0.00 0.00 0.00 39.64 38.36 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 -6.97 2.25 0.72 1.39 1.43 -0.06 -4.67 118.68 112.78 1r15 s LEU 27 Ca -0.25 -0.62 -0.13 0.00 -1.03 0.00 0.00 54.13 52.10 1r15 s LEU 27 Cb 0.07 -0.90 0.03 0.00 0.03 0.00 0.00 46.19 45.43 1r15 s LEU 27 CO 0.73 0.09 1.11 -2.84 0.23 0.00 0.00 176.35 175.67 1r15 s PRO 28 N -1.61 2.42 0.45 1.29 0.02 -1.26 -4.52 135.00 131.78 1r15 s PRO 28 Ca 0.06 1.35 -0.12 0.00 0.02 0.00 0.00 61.00 62.31 1r15 s PRO 28 Cb -0.09 -1.91 -0.07 0.00 0.02 0.00 0.00 34.50 32.45 1r15 s PRO 28 CO 0.03 -1.54 0.85 1.03 -0.33 0.00 0.00 177.00 177.04 1r15 s ARG 29 N -4.41 3.82 0.35 5.54 1.81 -1.26 -4.92 118.95 119.88 1r15 s ARG 29 Ca 0.65 0.63 -0.07 0.00 -1.72 0.00 0.00 55.73 55.22 1r15 s ARG 29 Cb -0.20 -2.30 -0.06 0.00 -0.45 0.00 0.00 34.95 31.95 1r15 s ARG 29 CO 0.48 -0.13 0.66 0.54 -0.68 0.00 0.00 175.30 176.17 1r15 s VAL 30 N -2.49 4.91 0.03 3.52 0.11 -1.26 -5.01 120.40 120.21 1r15 s VAL 30 Ca 0.54 0.30 -0.20 0.00 -2.93 0.00 0.00 61.98 59.69 1r15 s VAL 30 Cb -0.10 -3.74 -0.17 0.00 -1.53 0.00 0.00 36.38 30.84 1r15 s VAL 30 CO 0.32 -0.44 1.26 -0.09 -3.33 0.00 0.00 175.10 172.83 1r15 h ARG 31 N 1.41 0.40 -7.11 1.54 2.43 -1.94 -3.45 114.38 107.67 1r15 h ARG 31 Ca -0.47 -0.28 -0.51 0.00 -0.81 0.00 0.00 59.98 57.91 1r15 h ARG 31 Cb 1.19 0.04 0.09 0.00 -0.42 0.00 0.00 29.97 30.87 1r15 h ARG 31 CO 0.65 0.88 0.43 -1.12 -1.51 0.00 0.00 179.97 179.30 1r15 s SER 32 N -6.36 5.46 0.58 -3.80 0.01 -1.26 -5.04 113.70 103.29 1r15 s SER 32 Ca -0.14 2.20 -0.03 0.00 1.31 0.00 0.00 55.95 59.29 1r15 s SER 32 Cb 0.05 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.72 1r15 s SER 32 CO 0.78 -1.40 0.86 1.51 0.41 0.00 0.00 173.24 175.40 1r15 s ASP 33 N -1.87 5.37 0.20 2.44 1.47 -1.26 -4.87 116.67 118.15 1r15 s ASP 33 Ca 0.73 0.42 -0.10 0.00 1.18 0.00 0.00 52.55 54.77 1r15 s ASP 33 Cb -0.25 -1.35 0.23 0.00 -0.34 0.00 0.00 42.92 41.22 1r15 s ASP 33 CO 0.31 -1.15 1.79 0.00 0.68 0.00 0.00 175.17 176.80 1r15 h SER 35 N 0.58 0.91 -0.31 0.00 0.02 -1.98 0.35 113.55 113.13 1r15 h SER 35 Ca 0.29 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.22 1r15 h SER 35 Cb 0.22 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1r15 h SER 35 CO -0.20 0.60 0.12 0.00 -1.14 0.00 0.00 176.83 176.20 1r15 h ALA 36 N 1.40 0.40 -0.64 3.77 0.00 -1.71 -1.41 119.26 121.07 1r15 h ALA 36 Ca 0.38 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1r15 h ALA 36 Cb 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1r15 h ALA 36 CO -0.15 0.01 0.34 -0.07 0.00 0.00 0.00 179.25 179.38 1r15 h LEU 37 N 0.35 0.79 -0.24 0.00 3.38 -0.20 -1.72 115.31 117.67 1r15 h LEU 37 Ca 0.10 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1r15 h LEU 37 Cb 0.20 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1r15 h LEU 37 CO -0.01 0.65 0.07 -0.25 0.09 0.00 0.00 178.44 178.99 1r15 h TRP 38 N 0.90 0.40 -0.39 1.13 2.91 0.08 -0.84 115.95 120.13 1r15 h TRP 38 Ca 0.23 -0.04 0.04 0.00 1.13 0.00 0.00 58.89 60.25 1r15 h TRP 38 Cb 0.04 -0.11 -0.04 0.00 -0.51 0.00 0.00 29.16 28.54 1r15 h TRP 38 CO 0.01 0.46 0.16 0.87 -1.03 0.00 0.00 178.44 178.90 1r15 h LYS 39 N 0.22 0.32 -0.80 2.65 1.57 -0.74 0.49 116.57 120.27 1r15 h LYS 39 Ca 0.08 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1r15 h LYS 39 Cb 0.25 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 1r15 h LYS 39 CO -0.00 0.21 0.47 -0.44 -0.57 0.00 0.00 179.45 179.12 1r15 h ASP 40 N 0.33 0.97 0.06 0.86 3.32 -1.15 -1.25 116.42 119.56 1r15 h ASP 40 Ca 0.17 -0.06 -0.22 0.00 0.02 0.00 0.00 57.03 56.94 1r15 h ASP 40 Cb 0.13 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 39.44 1r15 h ASP 40 CO -0.16 0.76 -0.82 0.15 -1.72 0.00 0.00 179.24 177.46 1r15 h PHE 41 N 1.11 0.84 0.00 4.55 3.57 -0.41 -3.23 116.94 123.38 1r15 h PHE 41 Ca 0.29 -0.39 -0.00 0.00 3.53 0.00 0.00 57.97 61.39 1r15 h PHE 41 Cb -0.02 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.60 1r15 h PHE 41 CO 0.01 1.20 -0.00 0.35 -2.23 0.00 0.00 178.31 177.64 1r15 h PHE 42 N 0.40 -0.00 -0.77 0.41 3.57 0.36 -3.15 116.94 117.76 1r15 h PHE 42 Ca -0.06 -0.00 0.19 0.00 3.53 0.00 0.00 57.97 61.63 1r15 h PHE 42 Cb 1.43 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 40.13 1r15 h PHE 42 CO 0.07 0.51 0.53 1.57 -2.23 0.00 0.00 178.31 178.76 1r15 h LYS 43 N -0.51 0.20 -0.92 1.11 2.10 -1.36 0.36 116.57 117.55 1r15 h LYS 43 Ca -0.00 -0.01 0.16 0.00 -2.00 0.00 0.00 60.65 58.79 1r15 h LYS 43 Cb 0.51 -0.05 -0.08 0.00 -0.90 0.00 0.00 32.23 31.72 1r15 h LYS 43 CO 0.00 0.13 0.59 0.00 -2.00 0.00 0.00 179.45 178.18 1r15 h ALA 44 N 1.64 1.83 0.00 0.07 0.00 -1.56 -3.29 119.26 117.96 1r15 h ALA 44 Ca 0.38 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1r15 h ALA 44 Cb 1.17 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1r15 h ALA 44 CO -0.08 -0.10 0.00 1.97 0.00 0.00 0.00 179.25 181.04 1r15 n PHE 45 N -4.59 0.00 -2.38 0.00 -1.74 -0.69 -4.80 117.46 103.26 1r15 n PHE 45 Ca 0.19 0.00 -0.38 0.00 -0.56 0.00 0.00 57.45 56.69 1r15 n PHE 45 Cb 0.51 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.48 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 -0.45 6.74 -0.83 5.98 1.04 0.03 -3.36 113.70 122.86 1r15 s SER 46 Ca 0.00 2.28 0.00 0.00 0.48 0.00 0.00 55.95 58.71 1r15 s SER 46 Cb 0.00 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.51 1r15 s SER 46 CO 0.00 -0.52 0.00 0.49 0.98 0.00 0.00 173.24 174.19 1r15 n PHE 47 N 0.32 0.00 -4.02 5.02 3.72 -0.12 -4.92 117.46 117.45 1r15 n PHE 47 Ca 0.03 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.19 1r15 n PHE 47 Cb 0.46 -2.29 -0.07 0.00 -0.94 0.00 0.00 39.48 36.65 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 2.28 0.41 -1.08 1.02 -1.21 -4.44 119.74 114.23 1r15 s LYS 48 Ca 0.00 -1.78 -0.22 0.00 0.02 0.00 0.00 55.97 53.99 1r15 s LYS 48 Cb 0.00 -2.06 -0.10 0.00 -0.52 0.00 0.00 37.83 35.15 1r15 s LYS 48 CO 0.00 -0.13 0.96 -0.80 -0.92 0.00 0.00 175.35 174.47 1r15 s ASN 49 N -3.95 6.94 0.39 2.83 0.01 -1.26 -1.98 114.94 117.92 1r15 s ASN 49 Ca 0.42 1.76 0.23 0.00 -0.71 0.00 0.00 52.86 54.56 1r15 s ASN 49 Cb 0.02 -2.55 1.28 0.00 0.41 0.00 0.00 41.25 40.41 1r15 s ASN 49 CO 0.24 -0.36 1.65 1.55 -1.51 0.00 0.00 177.10 178.66 1r15 h PRO 50 N 2.14 0.18 -0.60 -0.60 0.13 -1.87 0.49 132.00 131.87 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 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1r15 h PRO 50 CO 0.62 0.12 0.00 0.00 -0.23 0.00 0.00 178.00 178.50 1r15 n ASP 52 N 0.77 6.77 -3.90 0.00 -0.08 0.17 -4.74 116.55 115.54 1r15 n ASP 52 Ca 0.18 -3.41 -0.09 0.00 -1.51 0.00 0.00 54.79 49.96 1r15 n ASP 52 Cb 0.64 -1.29 -0.07 0.00 2.34 0.00 0.00 41.12 42.75 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 -2.77 1.18 0.26 -2.67 1.43 -1.26 -4.75 118.68 110.10 1r15 s LEU 53 Ca 0.38 -0.76 -0.08 0.00 -1.03 0.00 0.00 54.13 52.65 1r15 s LEU 53 Cb 0.12 1.12 -0.01 0.00 0.03 0.00 0.00 46.19 47.46 1r15 s LEU 53 CO -0.01 -0.81 0.42 1.51 0.23 0.00 0.00 176.35 177.68 1r15 s ASP 54 N -2.91 0.20 0.63 2.29 -4.77 -1.24 -2.63 116.67 108.25 1r15 s ASP 54 Ca 0.11 -1.16 0.20 0.00 -3.30 0.00 0.00 52.55 48.41 1r15 s ASP 54 Cb 0.04 0.57 0.94 0.00 -1.09 0.00 0.00 42.92 43.38 1r15 s ASP 54 CO -0.06 -1.13 1.48 -0.07 0.70 0.00 0.00 175.17 176.10 1r15 h LEU 55 N 2.28 0.00 0.00 2.11 -0.00 -1.82 0.24 115.31 118.13 1r15 h LEU 55 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.60 1r15 h LEU 55 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.91 1r15 h LEU 55 CO 0.39 0.00 -1.15 0.61 -0.00 0.00 0.00 178.44 178.30 1r15 n GLY 56 N -1.49 -1.37 0.31 0.83 0.00 -1.26 -4.42 105.19 97.79 1r15 n GLY 56 Ca 0.08 -0.29 0.10 0.00 0.00 0.00 0.00 46.02 45.90 1r15 n GLY 56 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1r15 h SER 57 N 0.00 -0.34 -0.56 1.61 0.02 -0.84 0.45 113.55 113.88 1r15 h SER 57 Ca 0.00 0.23 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1r15 h SER 57 Cb 0.97 0.39 0.00 0.00 0.14 0.00 0.00 62.40 63.89 1r15 h SER 57 CO 0.00 -0.24 0.00 -1.22 -1.14 0.00 0.00 176.83 174.23 1r15 n TYR 58 N -5.38 1.89 -0.09 3.45 4.01 -1.26 -4.41 117.16 115.38 1r15 n TYR 58 Ca 0.19 -0.67 -0.07 0.00 -0.16 0.00 0.00 57.90 57.18 1r15 n TYR 58 Cb 0.62 -0.45 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 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 3.83 0.25 -0.41 -0.72 3.64 -1.12 0.36 116.57 122.41 1r15 h LYS 59 Ca 0.00 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1r15 h LYS 59 Cb 1.83 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 33.57 1r15 h LYS 59 CO 0.43 0.17 0.19 -0.44 -2.27 0.00 0.00 179.45 177.52 1r15 h ASP 60 N 0.26 0.54 0.17 4.20 3.32 -1.80 -0.80 116.42 122.31 1r15 h ASP 60 Ca 0.14 -0.14 0.01 0.00 0.02 0.00 0.00 57.03 57.06 1r15 h ASP 60 Cb 0.10 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1r15 h ASP 60 CO -0.13 0.53 -0.28 0.15 -1.72 0.00 0.00 179.24 177.79 1r15 h PHE 61 N 0.51 -0.75 0.00 4.55 3.57 -1.62 -1.82 116.94 121.38 1r15 h PHE 61 Ca 0.14 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 1r15 h PHE 61 Cb 0.14 0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 1r15 h PHE 61 CO -0.01 -0.39 -0.03 0.74 -2.23 0.00 0.00 178.31 176.39 1r15 h PHE 62 N -0.53 0.00 -0.25 0.41 0.04 -0.73 0.07 116.94 115.95 1r15 h PHE 62 Ca 0.02 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.72 1r15 h PHE 62 Cb 0.53 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.67 1r15 h PHE 62 CO -0.23 0.03 -0.09 1.15 -0.60 0.00 0.00 178.31 178.58 1r15 h THR 63 N 0.00 1.29 0.00 -1.55 2.02 -0.56 -0.45 112.91 113.66 1r15 h THR 63 Ca -0.00 -1.13 -0.12 0.00 0.77 0.00 0.00 66.41 65.93 1r15 h THR 63 Cb 0.08 1.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.99 1r15 h THR 63 CO 0.00 0.35 -0.56 0.28 0.37 0.00 0.00 175.52 175.97 1r15 h SER 64 N 0.23 0.00 0.11 4.18 0.02 -0.48 -3.20 113.55 114.41 1r15 h SER 64 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1r15 h SER 64 Cb 0.57 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.11 1r15 h SER 64 CO 0.03 0.56 -0.46 0.00 -1.14 0.00 0.00 176.83 175.82 1r15 n ALA 65 N -2.39 3.52 -2.35 3.77 0.00 -0.09 -4.52 120.51 118.45 1r15 n ALA 65 Ca -0.01 -0.54 -0.42 0.00 0.00 0.00 0.00 53.44 52.47 1r15 n ALA 65 Cb 0.59 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 19.08 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 -2.57 4.41 0.19 0.00 2.00 -0.19 -4.50 119.66 119.00 1r15 s GLN 66 Ca 0.19 1.84 0.06 0.00 -2.00 0.00 0.00 55.36 55.45 1r15 s GLN 66 Cb 0.18 -3.32 -0.04 0.00 0.80 0.00 0.00 33.01 30.63 1r15 s GLN 66 CO 0.59 -0.30 0.15 -0.65 -0.50 0.00 0.00 175.29 174.59 1r15 s GLN 67 N 1.05 2.89 0.10 1.67 -0.21 -1.26 -4.97 119.66 118.93 1r15 s GLN 67 Ca 0.60 -0.93 -0.30 0.00 0.02 0.00 0.00 55.36 54.74 1r15 s GLN 67 Cb -0.31 -2.61 -0.06 0.00 1.00 0.00 0.00 33.01 31.02 1r15 s GLN 67 CO 0.30 0.46 1.14 -0.65 -2.12 0.00 0.00 175.29 174.42 1r15 s GLN 68 N -3.33 4.50 -0.07 2.91 -0.21 -1.26 -4.97 119.66 117.23 1r15 s GLN 68 Ca 0.31 1.72 -0.10 0.00 0.02 0.00 0.00 55.36 57.31 1r15 s GLN 68 Cb -0.09 -3.33 -0.05 0.00 1.00 0.00 0.00 33.01 30.54 1r15 s GLN 68 CO 0.24 -0.12 0.26 -0.51 -2.12 0.00 0.00 175.29 173.03 1r15 s LEU 69 N 0.54 4.42 0.16 2.90 1.43 -1.26 -4.50 118.68 122.37 1r15 s LEU 69 Ca 0.55 0.67 -0.34 0.00 -1.03 0.00 0.00 54.13 53.99 1r15 s LEU 69 Cb -0.29 -2.29 -0.14 0.00 0.03 0.00 0.00 46.19 43.50 1r15 s LEU 69 CO 0.31 0.36 1.60 -0.81 0.23 0.00 0.00 176.35 178.05 1r15 n PRO 70 N 1.98 2.22 -1.60 1.29 -0.04 -1.26 -4.60 135.00 132.99 1r15 n PRO 70 Ca -0.17 0.80 -0.53 0.00 -0.04 0.00 0.00 63.50 63.56 1r15 n PRO 70 Cb 0.54 -2.58 -0.06 0.00 -0.04 0.00 0.00 33.50 31.36 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 3.61 1.11 -0.44 0.54 4.81 -1.26 -1.89 118.16 124.64 1r15 n LYS 71 Ca 0.17 0.40 0.00 0.00 -0.87 0.00 0.00 58.31 58.01 1r15 n LYS 71 Cb 0.29 -2.04 0.00 0.00 0.02 0.00 0.00 35.03 33.30 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 2.72 0.00 -1.08 3.14 3.02 0.19 -4.86 115.26 118.39 1r15 n ASN 72 Ca 0.19 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.86 1r15 n ASN 72 Cb 0.18 -0.93 0.23 0.00 -0.61 0.00 0.00 39.78 38.65 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 -2.00 2.41 -2.83 3.52 4.76 -0.79 -4.70 118.16 118.54 1r15 n LYS 73 Ca 0.00 -2.13 -0.41 0.00 -2.87 0.00 0.00 58.31 52.90 1r15 n LYS 73 Cb 0.00 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 31.65 1r15 n LYS 73 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1r15 s VAL 74 N -1.55 4.70 0.01 -0.18 1.01 -1.26 0.09 120.40 123.21 1r15 s VAL 74 Ca 0.38 1.89 0.07 0.00 0.00 0.00 0.00 61.98 64.31 1r15 s VAL 74 Cb 0.22 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 1r15 s VAL 74 CO 0.31 0.29 -0.20 -0.32 0.00 0.00 0.00 175.10 175.18 1r15 s MET 75 N 0.28 1.52 0.16 2.72 0.00 -0.45 -1.14 119.30 122.38 1r15 s MET 75 Ca 0.45 -0.80 0.10 0.00 0.00 0.00 0.00 55.69 55.44 1r15 s MET 75 Cb -0.21 -1.53 -0.04 0.00 0.00 0.00 0.00 34.83 33.04 1r15 s MET 75 CO 0.26 0.41 -0.23 -0.06 0.00 0.00 0.00 175.02 175.40 1r15 s PHE 76 N -0.60 2.14 0.12 4.11 0.08 0.25 -4.44 117.98 119.64 1r15 s PHE 76 Ca 0.07 -0.39 -0.07 0.00 0.12 0.00 0.00 56.93 56.66 1r15 s PHE 76 Cb -0.08 -1.10 -0.01 0.00 -0.57 0.00 0.00 43.02 41.26 1r15 s PHE 76 CO 0.00 0.39 0.19 1.67 -0.10 0.00 0.00 175.22 177.38 1r15 s TRP 77 N -1.53 0.36 -0.05 0.36 1.48 -1.26 -0.68 118.94 117.62 1r15 s TRP 77 Ca 0.16 -0.77 -0.02 0.00 -1.06 0.00 0.00 56.10 54.42 1r15 s TRP 77 Cb -0.08 -0.13 0.03 0.00 -1.16 0.00 0.00 33.47 32.13 1r15 s TRP 77 CO 0.08 -0.60 0.08 -1.12 -4.06 0.00 0.00 176.95 171.33 1r15 s SER 78 N -2.93 0.58 -1.15 -2.66 0.01 -0.55 -4.81 113.70 102.18 1r15 s SER 78 Ca 0.12 0.15 -0.06 0.00 1.31 0.00 0.00 55.95 57.47 1r15 s SER 78 Cb 0.05 0.01 0.04 0.00 0.21 0.00 0.00 66.02 66.33 1r15 s SER 78 CO -0.05 -0.20 0.32 0.61 0.41 0.00 0.00 173.24 174.32 1r15 n GLY 79 N 4.83 -0.49 2.74 3.44 0.00 -1.26 -3.38 105.19 111.07 1r15 n GLY 79 Ca -0.14 0.06 -0.02 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.71 0.63 -0.20 1.61 0.24 -1.26 -4.68 118.33 110.96 1r15 n VAL 80 Ca -0.06 -2.04 -0.13 0.00 -2.04 0.00 0.00 64.34 60.07 1r15 n VAL 80 Cb 0.56 1.10 -0.10 0.00 -1.47 0.00 0.00 33.84 33.94 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 1.94 -1.73 -0.34 6.34 5.03 -1.96 0.23 116.97 126.48 1r15 h TYR 81 Ca -0.27 0.09 0.03 0.00 2.58 0.00 0.00 58.73 61.16 1r15 h TYR 81 Cb 1.28 0.83 -0.03 0.00 1.55 0.00 0.00 36.73 40.35 1r15 h TYR 81 CO 0.24 -0.46 0.16 -0.44 -1.32 0.00 0.00 178.16 176.33 1r15 h ASP 82 N -0.31 0.22 -0.55 -2.11 3.32 -1.99 -0.42 116.42 114.58 1r15 h ASP 82 Ca 0.10 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.10 1r15 h ASP 82 Cb 0.56 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 1r15 h ASP 82 CO -0.67 0.17 0.08 -0.33 -1.72 0.00 0.00 179.24 176.76 1r15 h GLU 83 N 0.33 0.93 -0.22 3.56 3.07 -1.80 -1.31 114.58 119.14 1r15 h GLU 83 Ca 0.15 -0.26 -0.01 0.00 -0.50 0.00 0.00 59.36 58.74 1r15 h GLU 83 Cb 0.07 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 27.87 1r15 h GLU 83 CO -0.11 0.90 0.11 0.00 -1.40 0.00 0.00 179.01 178.50 1r15 h ALA 84 N 0.99 0.28 -0.29 3.43 0.00 -0.29 -1.78 119.26 121.61 1r15 h ALA 84 Ca 0.17 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1r15 h ALA 84 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1r15 h ALA 84 CO 0.01 -0.17 -0.30 0.45 0.00 0.00 0.00 179.25 179.24 1r15 h HIS 85 N 0.23 0.69 -0.49 0.00 3.86 -1.01 -0.69 115.15 117.73 1r15 h HIS 85 Ca 0.08 -0.17 -0.03 0.00 -1.16 0.00 0.00 60.37 59.08 1r15 h HIS 85 Cb 0.10 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.39 1r15 h HIS 85 CO -0.03 0.83 0.18 -0.44 0.86 0.00 0.00 177.93 179.33 1r15 h ASP 86 N 0.51 0.69 -0.40 2.45 3.32 -1.11 -0.25 116.42 121.63 1r15 h ASP 86 Ca 0.06 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 56.88 1r15 h ASP 86 Cb 0.78 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 1r15 h ASP 86 CO 0.06 0.69 0.06 0.22 -1.72 0.00 0.00 179.24 178.55 1r15 h TYR 87 N 0.65 0.70 -0.04 4.55 3.20 -1.14 -2.13 116.97 122.76 1r15 h TYR 87 Ca 0.16 -0.10 0.01 0.00 3.14 0.00 0.00 58.73 61.95 1r15 h TYR 87 Cb 0.22 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.30 1r15 h TYR 87 CO 0.01 0.69 0.03 0.00 -1.64 0.00 0.00 178.16 177.25 1r15 h ALA 88 N 0.92 1.92 -5.96 1.82 0.00 -0.82 -3.43 119.26 113.72 1r15 h ALA 88 Ca 0.12 -0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.64 1r15 h ALA 88 Cb 0.37 0.00 0.09 0.00 0.00 0.00 0.00 17.79 18.25 1r15 h ALA 88 CO 0.01 -0.05 -0.82 -1.71 0.00 0.00 0.00 179.25 176.67 1r15 n ASN 89 N -4.35 -1.80 -3.59 0.00 4.05 -0.13 -1.33 115.26 108.10 1r15 n ASN 89 Ca -0.02 -0.78 -0.26 0.00 0.45 0.00 0.00 54.58 53.97 1r15 n ASN 89 Cb 0.13 -4.34 0.05 0.00 1.23 0.00 0.00 39.78 36.85 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 -4.18 -6.41 -0.17 -0.44 -1.04 -1.26 -1.75 114.28 99.04 1r15 n THR 90 Ca -0.28 -0.99 0.00 0.00 -2.04 0.00 0.00 64.05 60.74 1r15 n THR 90 Cb 0.67 -4.74 0.00 0.00 -1.82 0.00 0.00 70.33 64.44 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 -1.57 1.51 0.21 3.41 0.00 -1.12 -4.84 105.19 102.79 1r15 n GLY 91 Ca -0.12 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 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 1.30 0.70 0.00 1.61 3.08 -1.27 -3.38 114.38 116.41 1r15 h ARG 92 Ca 0.00 -0.34 -0.46 0.00 0.07 0.00 0.00 59.98 59.25 1r15 h ARG 92 Cb 0.00 -0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.98 1r15 h ARG 92 CO 0.00 0.94 -2.51 1.17 -1.07 0.00 0.00 179.97 178.50 1r15 n LYS 93 N -4.31 0.59 -3.99 0.04 4.81 -0.44 -5.02 118.16 109.84 1r15 n LYS 93 Ca -0.03 0.26 -0.08 0.00 -0.87 0.00 0.00 58.31 57.59 1r15 n LYS 93 Cb 0.43 -1.49 -0.10 0.00 0.02 0.00 0.00 35.03 33.89 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 0.33 0.17 5.64 2.02 -1.06 -4.89 117.35 117.05 1r15 s TYR 94 Ca -0.39 -0.73 0.05 0.00 -0.37 0.00 0.00 57.07 55.63 1r15 s TYR 94 Cb 0.15 -0.24 -0.04 0.00 -0.40 0.00 0.00 41.96 41.43 1r15 s TYR 94 CO 0.49 -0.36 0.17 0.96 -1.57 0.00 0.00 175.55 175.24 1r15 s ILE 95 N -3.08 4.63 0.34 2.71 -4.36 0.11 -2.80 121.20 118.75 1r15 s ILE 95 Ca -0.01 -1.05 0.05 0.00 -0.26 0.00 0.00 60.65 59.38 1r15 s ILE 95 Cb 0.02 -3.38 -0.07 0.00 1.25 0.00 0.00 42.46 40.28 1r15 s ILE 95 CO -0.07 -0.14 0.03 0.42 0.24 0.00 0.00 174.94 175.43 1r15 s THR 96 N -1.80 1.44 0.36 8.37 -4.23 -1.26 -1.35 115.64 117.18 1r15 s THR 96 Ca 0.32 -2.01 0.12 0.00 -1.18 0.00 0.00 61.69 58.93 1r15 s THR 96 Cb -0.10 -2.81 0.34 0.00 1.34 0.00 0.00 72.50 71.28 1r15 s THR 96 CO 0.24 -0.04 1.82 0.25 -0.54 0.00 0.00 174.62 176.36 1r15 h LEU 97 N 2.05 0.60 -0.27 4.79 5.85 -1.98 0.29 115.31 126.65 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 1.24 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1r15 h LEU 97 CO 0.72 0.23 0.00 -0.62 -0.34 0.00 0.00 178.44 178.43 1r15 n GLU 98 N -4.62 0.05 0.05 1.25 4.71 -1.26 -2.08 120.64 118.74 1r15 n GLU 98 Ca 0.21 0.39 0.11 0.00 -0.01 0.00 0.00 57.16 57.86 1r15 n GLU 98 Cb 0.63 -1.61 0.01 0.00 -1.01 0.00 0.00 31.44 29.45 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 -1.71 0.62 -4.89 1.62 8.00 0.10 -3.23 116.55 117.06 1r15 n ASP 99 Ca 0.02 0.01 -0.29 0.00 0.71 0.00 0.00 54.79 55.24 1r15 n ASP 99 Cb 0.12 0.77 0.03 0.00 -0.02 0.00 0.00 41.12 42.02 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 -3.28 3.99 0.15 -3.53 -4.23 -0.88 -4.77 115.64 103.09 1r15 s THR 100 Ca 0.01 0.39 -0.28 0.00 -1.18 0.00 0.00 61.69 60.63 1r15 s THR 100 Cb 0.13 -3.61 -0.02 0.00 1.34 0.00 0.00 72.50 70.34 1r15 s THR 100 CO 0.80 -0.72 1.57 0.25 -0.54 0.00 0.00 174.62 175.98 1r15 h LEU 101 N -0.32 -1.42 -0.74 4.79 5.85 -1.87 0.32 115.31 121.91 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 -0.04 0.00 0.37 0.00 0.00 40.66 42.83 1r15 h LEU 101 CO 0.62 -0.39 0.47 -0.65 -0.34 0.00 0.00 178.44 178.16 1r15 h PRO 102 N -0.38 0.91 -0.28 5.25 0.11 -1.90 0.08 132.00 135.78 1r15 h PRO 102 Ca 0.12 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.07 1r15 h PRO 102 Cb 0.60 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 1r15 h PRO 102 CO -0.53 0.60 -0.21 0.78 -0.21 0.00 0.00 178.00 178.44 1r15 h GLY 103 N 0.94 0.70 0.97 -0.55 0.00 -1.50 -2.07 103.07 101.56 1r15 h GLY 103 Ca 0.29 -0.67 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 1r15 h GLY 103 CO -0.10 0.61 0.21 -1.82 0.00 0.00 0.00 176.54 175.44 1r15 h TYR 104 N 0.38 0.74 0.00 5.60 3.20 -0.17 0.12 116.97 126.85 1r15 h TYR 104 Ca 0.06 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1r15 h TYR 104 Cb 0.75 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.80 1r15 h TYR 104 CO 0.07 0.61 -0.00 0.52 -1.64 0.00 0.00 178.16 177.72 1r15 h MET 105 N 0.66 -0.01 -0.14 1.82 2.86 -0.87 -3.22 114.93 116.03 1r15 h MET 105 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1r15 h MET 105 Cb 0.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.83 1r15 h MET 105 CO -0.02 0.19 0.00 1.28 1.06 0.00 0.00 176.91 179.42 1r15 n LEU 106 N -5.00 2.22 -4.67 1.22 7.99 -0.79 -4.85 117.00 113.12 1r15 n LEU 106 Ca -0.08 -0.85 -0.49 0.00 -0.01 0.00 0.00 56.01 54.58 1r15 n LEU 106 Cb 0.12 -0.08 -0.05 0.00 -0.11 0.00 0.00 43.42 43.30 1r15 n LEU 106 CO 0.33 0.42 1.33 -3.20 -1.51 0.00 0.00 177.39 174.77 1r15 n ASN 107 N 0.70 3.04 0.00 -1.43 5.15 0.40 -0.97 115.26 122.16 1r15 n ASN 107 Ca 0.17 1.03 0.00 0.00 -0.60 0.00 0.00 54.58 55.18 1r15 n ASN 107 Cb 0.44 -1.34 0.00 0.00 -0.53 0.00 0.00 39.78 38.35 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 5.21 0.00 -4.84 1.20 7.64 -1.26 -4.99 113.62 116.57 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 -0.80 -0.01 0.00 -1.01 0.00 0.00 64.21 62.65 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 3.49 -0.08 -3.43 1.43 -0.14 -5.00 118.68 114.94 1r15 s LEU 109 Ca 0.00 1.57 0.01 0.00 -1.03 0.00 0.00 54.13 54.69 1r15 s LEU 109 Cb 0.00 -4.50 0.02 0.00 0.03 0.00 0.00 46.19 41.73 1r15 s LEU 109 CO 0.00 -0.78 -0.12 -0.69 0.23 0.00 0.00 176.35 174.99 1r15 s VAL 110 N -2.76 1.17 0.14 -1.59 1.01 -1.26 -4.97 120.40 112.13 1r15 s VAL 110 Ca 0.59 -0.46 -0.23 0.00 0.00 0.00 0.00 61.98 61.88 1r15 s VAL 110 Cb -0.11 -1.09 0.06 0.00 0.00 0.00 0.00 36.38 35.24 1r15 s VAL 110 CO 0.39 0.37 0.58 -1.66 0.00 0.00 0.00 175.10 174.78 1r15 s TRP 111 N 0.97 -0.50 -0.05 5.22 -2.14 -1.26 -0.21 118.94 120.97 1r15 s TRP 111 Ca -0.08 0.33 -0.29 0.00 2.66 0.00 0.00 56.10 58.71 1r15 s TRP 111 Cb -0.15 0.50 0.10 0.00 -3.10 0.00 0.00 33.47 30.83 1r15 s TRP 111 CO -0.00 -0.81 0.85 0.00 -2.66 0.00 0.00 176.95 174.33 1r15 s GLY 113 N -1.71 1.73 0.06 0.00 0.00 -1.25 -1.30 107.32 104.84 1r15 s GLY 113 Ca -0.02 -1.13 -0.15 0.00 0.00 0.00 0.00 44.72 43.42 1r15 s GLY 113 CO -0.01 -0.68 0.33 -0.86 0.00 0.00 0.00 173.10 171.88 1r15 s GLN 114 N -5.23 0.88 0.09 2.90 -2.07 -0.84 -2.76 119.66 112.63 1r15 s GLN 114 Ca 0.62 -0.54 0.04 0.00 -1.82 0.00 0.00 55.36 53.66 1r15 s GLN 114 Cb -0.09 0.38 -0.23 0.00 -1.09 0.00 0.00 33.01 31.98 1r15 s GLN 114 CO 0.45 -0.30 1.18 0.00 -1.32 0.00 0.00 175.29 175.30 1r15 h ARG 115 N 3.01 0.08 -7.03 9.60 3.08 -1.77 -2.83 114.38 118.52 1r15 h ARG 115 Ca -0.32 -0.14 -0.49 0.00 0.07 0.00 0.00 59.98 59.10 1r15 h ARG 115 Cb 1.21 0.05 0.04 0.00 0.08 0.00 0.00 29.97 31.35 1r15 h ARG 115 CO 0.46 1.03 0.42 0.00 -1.07 0.00 0.00 179.97 180.82 1r15 s ALA 116 N -2.68 2.91 0.57 0.04 0.00 -1.26 -4.70 121.76 116.63 1r15 s ALA 116 Ca -0.01 0.74 -0.20 0.00 0.00 0.00 0.00 51.96 52.49 1r15 s ALA 116 Cb 0.09 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 1r15 s ALA 116 CO 0.84 -0.46 1.06 0.09 0.00 0.00 0.00 175.76 177.30 1r15 n ASN 117 N -0.73 1.27 0.00 0.00 3.02 -1.26 -0.94 115.26 116.62 1r15 n ASN 117 Ca 0.08 0.87 0.11 0.00 -0.03 0.00 0.00 54.58 55.61 1r15 n ASN 117 Cb 0.51 -1.43 0.60 0.00 -0.61 0.00 0.00 39.78 38.84 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 -0.92 0.50 0.00 3.52 -0.04 -1.26 -4.90 135.00 131.90 1r15 n PRO 118 Ca 0.13 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 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 0.45 0.82 3.22 0.55 0.00 -0.12 -4.83 105.19 105.28 1r15 n GLY 119 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.13 -0.02 1.61 -0.71 -1.26 -0.95 117.98 114.53 1r15 s PHE 120 Ca 0.00 0.14 -0.23 0.00 -1.04 0.00 0.00 56.93 55.80 1r15 s PHE 120 Cb 0.00 0.07 -0.05 0.00 -1.21 0.00 0.00 43.02 41.84 1r15 s PHE 120 CO 0.00 -0.40 0.70 1.21 -1.34 0.00 0.00 175.22 175.39 1r15 s ASN 121 N -1.48 7.05 0.00 1.98 3.84 -0.42 -4.69 114.94 121.22 1r15 s ASN 121 Ca -0.12 1.26 0.07 0.00 0.21 0.00 0.00 52.86 54.28 1r15 s ASN 121 Cb -0.05 -2.42 0.06 0.00 -0.55 0.00 0.00 41.25 38.30 1r15 s ASN 121 CO 0.02 -0.03 0.75 -0.62 -2.79 0.00 0.00 177.10 174.43 1r15 n GLU 122 N 3.27 0.18 -0.13 0.43 1.02 -1.26 -4.54 120.64 119.61 1r15 n GLU 122 Ca -0.03 -0.98 -0.25 0.00 -0.02 0.00 0.00 57.16 55.89 1r15 n GLU 122 Cb 0.51 -1.13 -0.10 0.00 -0.02 0.00 0.00 31.44 30.70 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 0.36 0.55 -3.64 3.49 5.02 -1.26 -4.75 118.16 117.93 1r15 n LYS 123 Ca 0.04 0.21 -0.12 0.00 -2.02 0.00 0.00 58.31 56.42 1r15 n LYS 123 Cb 0.18 -1.42 -0.06 0.00 -0.02 0.00 0.00 35.03 33.72 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 -2.47 0.05 0.05 -0.18 0.11 -1.26 -4.47 120.40 112.23 1r15 s VAL 124 Ca -0.35 -0.45 0.06 0.00 -2.93 0.00 0.00 61.98 58.31 1r15 s VAL 124 Cb 0.12 -1.01 -0.02 0.00 -1.53 0.00 0.00 36.38 33.94 1r15 s VAL 124 CO 0.47 -0.25 -0.17 0.00 -3.33 0.00 0.00 175.10 171.82 1r15 s PRO 126 N -1.27 1.71 0.39 0.00 0.04 -1.26 -3.35 135.00 131.26 1r15 s PRO 126 Ca 0.04 1.55 -0.24 0.00 0.04 0.00 0.00 61.00 62.40 1r15 s PRO 126 Cb -0.09 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.55 1r15 s PRO 126 CO 0.02 -2.12 1.00 0.34 0.04 0.00 0.00 177.00 176.28 1r15 s ASP 127 N -2.56 6.91 0.00 6.66 -1.08 -1.26 -4.78 116.67 120.56 1r15 s ASP 127 Ca 0.69 1.91 0.00 0.00 -0.52 0.00 0.00 52.55 54.62 1r15 s ASP 127 Cb -0.24 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.65 1r15 s ASP 127 CO 0.52 -0.38 0.46 0.33 0.52 0.00 0.00 175.17 176.62 1r15 n PHE 128 N -0.10 0.00 0.29 -5.34 7.35 -1.26 -0.51 117.46 117.89 1r15 n PHE 128 Ca 0.05 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.81 1r15 n PHE 128 Cb 0.51 -0.17 0.39 0.00 0.35 0.00 0.00 39.48 40.56 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 -0.04 -4.13 6.56 -2.00 -2.44 116.57 114.52 1r15 h LYS 129 Ca 0.00 0.00 -0.14 0.00 -1.06 0.00 0.00 60.65 59.45 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 -0.63 1.15 -2.06 0.00 0.00 179.45 177.91 1r15 h THR 130 N 0.00 1.41 -2.71 -0.16 2.02 -1.17 -3.46 112.91 108.84 1r15 h THR 130 Ca 0.00 -2.08 -0.49 0.00 0.77 0.00 0.00 66.41 64.61 1r15 h THR 130 Cb 1.20 2.08 -0.00 0.00 -1.74 0.00 0.00 68.15 69.69 1r15 h THR 130 CO 0.00 0.61 -0.28 0.00 0.37 0.00 0.00 175.52 176.22 1r15 s PRO 132 N -3.93 2.71 0.19 0.00 0.04 -1.26 -4.68 135.00 128.06 1r15 s PRO 132 Ca 0.39 1.55 -0.12 0.00 0.04 0.00 0.00 61.00 62.85 1r15 s PRO 132 Cb -0.10 -1.92 0.19 0.00 0.04 0.00 0.00 34.50 32.71 1r15 s PRO 132 CO 0.32 -1.35 1.74 -0.39 0.04 0.00 0.00 177.00 177.37 1r15 h VAL 133 N 0.17 0.80 -0.30 -0.36 -1.51 -1.97 -0.39 116.25 112.69 1r15 h VAL 133 Ca -0.48 -0.12 0.09 0.00 -1.23 0.00 0.00 66.70 64.96 1r15 h VAL 133 Cb 1.27 0.43 -0.01 0.00 -2.13 0.00 0.00 31.29 30.84 1r15 h VAL 133 CO 0.53 0.06 0.33 0.06 -1.23 0.00 0.00 177.57 177.33 1r15 h GLN 134 N 0.34 0.00 0.04 5.19 -0.00 -1.91 0.39 115.11 119.17 1r15 h GLN 134 Ca 0.25 0.00 -0.24 0.00 -0.00 0.00 0.00 58.65 58.66 1r15 h GLN 134 Cb 0.28 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.74 1r15 h GLN 134 CO -0.27 0.00 -1.31 0.00 -0.00 0.00 0.00 178.83 177.25 1r15 h ALA 135 N 1.61 0.26 -0.95 0.06 0.00 -0.99 -2.91 119.26 116.34 1r15 h ALA 135 Ca 0.14 -1.17 0.12 0.00 0.00 0.00 0.00 54.91 54.01 1r15 h ALA 135 Cb 0.81 0.64 -0.09 0.00 0.00 0.00 0.00 17.79 19.15 1r15 h ALA 135 CO -0.00 0.77 0.57 -0.09 0.00 0.00 0.00 179.25 180.50 1r15 h ARG 136 N -0.71 0.86 -0.47 0.00 2.43 -0.19 -1.70 114.38 114.59 1r15 h ARG 136 Ca -0.33 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 1r15 h ARG 136 Cb 1.47 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 1r15 h ARG 136 CO -0.10 0.57 0.00 0.39 -1.51 0.00 0.00 179.97 179.31 1r15 n GLU 137 N -4.69 2.91 -0.19 0.20 1.02 0.13 -4.71 120.64 115.31 1r15 n GLU 137 Ca 0.18 -2.33 -0.00 0.00 -0.02 0.00 0.00 57.16 54.98 1r15 n GLU 137 Cb 0.37 -1.44 0.08 0.00 -0.02 0.00 0.00 31.44 30.43 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 2.76 -0.33 0.06 1.62 0.87 -1.09 0.51 113.55 117.95 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 0.91 0.28 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 1r15 h SER 138 CO 0.03 -0.13 -0.03 0.15 -0.53 0.00 0.00 176.83 176.33 1r15 h PHE 139 N 0.08 -0.07 0.00 2.24 3.57 -1.84 -2.98 116.94 117.94 1r15 h PHE 139 Ca 0.29 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.76 1r15 h PHE 139 Cb 0.46 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1r15 h PHE 139 CO -0.38 -0.05 -0.18 -1.49 -2.23 0.00 0.00 178.31 173.99 1r15 h TRP 140 N -0.66 0.00 0.43 0.41 4.06 -1.89 0.28 115.95 118.58 1r15 h TRP 140 Ca -0.01 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.92 1r15 h TRP 140 Cb 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.22 1r15 h TRP 140 CO 0.01 0.18 -0.21 0.78 -3.56 0.00 0.00 178.44 175.63 1r15 h GLY 141 N 0.66 -0.61 0.80 1.49 0.00 -0.13 0.37 103.07 105.65 1r15 h GLY 141 Ca -0.00 0.23 0.03 0.00 0.00 0.00 0.00 47.33 47.59 1r15 h GLY 141 CO 0.02 -0.22 0.25 1.98 0.00 0.00 0.00 176.54 178.57 1r15 h MET 142 N -0.78 0.48 -0.23 4.80 1.85 -1.23 -0.10 114.93 119.71 1r15 h MET 142 Ca -0.06 -0.03 0.06 0.00 -0.61 0.00 0.00 59.70 59.06 1r15 h MET 142 Cb 0.54 -0.11 -0.06 0.00 0.43 0.00 0.00 31.60 32.40 1r15 h MET 142 CO 0.10 0.32 -0.17 0.00 -0.40 0.00 0.00 176.91 176.76 1r15 h ALA 143 N 1.24 -0.00 -0.84 0.39 0.00 -0.36 0.28 119.26 119.97 1r15 h ALA 143 Ca 0.20 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.24 1r15 h ALA 143 Cb 0.08 0.37 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 1r15 h ALA 143 CO -0.12 -0.58 0.53 0.77 0.00 0.00 0.00 179.25 179.85 1r15 h SER 144 N -0.16 0.86 0.40 0.00 0.02 -0.26 0.56 113.55 114.97 1r15 h SER 144 Ca 0.13 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1r15 h SER 144 Cb 0.36 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1r15 h SER 144 CO -0.33 0.58 -0.19 0.28 -1.14 0.00 0.00 176.83 176.02 1r15 h SER 145 N 1.01 -0.46 -0.66 3.07 0.02 0.45 0.12 113.55 117.11 1r15 h SER 145 Ca 0.35 -0.06 0.07 0.00 -0.84 0.00 0.00 61.79 61.32 1r15 h SER 145 Cb 0.08 0.12 -0.06 0.00 0.14 0.00 0.00 62.40 62.67 1r15 h SER 145 CO -0.14 -0.22 0.34 -1.28 -1.14 0.00 0.00 176.83 174.39 1r15 h SER 146 N -0.67 0.47 0.49 3.07 0.87 -0.26 0.87 113.55 118.39 1r15 h SER 146 Ca -0.05 0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 1r15 h SER 146 Cb 0.48 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 1r15 h SER 146 CO 0.09 0.29 -0.31 0.22 -0.53 0.00 0.00 176.83 176.60 1r15 h TYR 147 N 0.61 -0.81 -0.96 2.24 3.20 -0.72 -2.73 116.97 117.80 1r15 h TYR 147 Ca 0.31 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.22 1r15 h TYR 147 Cb 0.26 0.29 -0.06 0.00 1.54 0.00 0.00 36.73 38.76 1r15 h TYR 147 CO -0.10 -0.47 0.62 0.00 -1.64 0.00 0.00 178.16 176.58 1r15 h ALA 148 N -0.31 1.30 -0.30 1.82 0.00 -0.44 -0.22 119.26 121.12 1r15 h ALA 148 Ca -0.06 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.91 1r15 h ALA 148 Cb 0.62 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1r15 h ALA 148 CO 0.05 0.47 0.22 1.25 0.00 0.00 0.00 179.25 181.24 1r15 h HIS 149 N 1.18 0.00 0.00 0.00 -0.00 -0.60 -1.19 115.15 114.54 1r15 h HIS 149 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.77 1r15 h HIS 149 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.48 1r15 h HIS 149 CO -0.01 0.00 -0.53 0.43 -0.00 0.00 0.00 177.93 177.82 1r15 n SER 150 N -4.37 0.53 -4.74 3.26 7.64 -0.12 -4.51 113.62 111.31 1r15 n SER 150 Ca 0.04 -0.13 -0.41 0.00 1.01 0.00 0.00 58.87 59.38 1r15 n SER 150 Cb 0.39 0.22 -0.02 0.00 -1.01 0.00 0.00 64.21 63.79 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 -3.05 3.71 0.05 -0.43 0.00 -0.45 -4.11 121.76 117.48 1r15 s ALA 151 Ca 0.10 1.46 0.03 0.00 0.00 0.00 0.00 51.96 53.55 1r15 s ALA 151 Cb 0.16 -3.61 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 1r15 s ALA 151 CO 0.70 -0.87 -0.09 -1.21 0.00 0.00 0.00 175.76 174.28 1r15 s GLU 152 N -0.29 0.61 4.14 0.00 2.02 -1.26 -4.24 118.70 119.68 1r15 s GLU 152 Ca 0.63 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.79 1r15 s GLU 152 Cb -0.45 -0.43 0.00 0.00 0.10 0.00 0.00 34.13 33.35 1r15 s GLU 152 CO 0.44 0.08 0.00 0.41 0.02 0.00 0.00 175.26 176.22 1r15 n GLY 153 N 1.36 0.80 3.77 -1.39 0.00 0.55 -0.64 105.19 109.64 1r15 n GLY 153 Ca -0.22 -0.81 -0.38 0.00 0.00 0.00 0.00 46.02 44.61 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 4.27 0.07 1.61 2.02 -1.26 -0.39 118.70 125.01 1r15 s GLU 154 Ca 0.00 1.68 0.08 0.00 0.02 0.00 0.00 54.97 56.75 1r15 s GLU 154 Cb 0.00 -2.76 -0.03 0.00 0.10 0.00 0.00 34.13 31.44 1r15 s GLU 154 CO 0.00 -0.09 -0.21 0.08 0.02 0.00 0.00 175.26 175.06 1r15 s VAL 155 N -1.45 1.70 -0.00 2.63 1.01 -0.23 -3.51 120.40 120.54 1r15 s VAL 155 Ca 0.54 -1.36 0.08 0.00 0.00 0.00 0.00 61.98 61.23 1r15 s VAL 155 Cb -0.27 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 1r15 s VAL 155 CO 0.34 0.08 -0.24 -0.89 0.00 0.00 0.00 175.10 174.40 1r15 s THR 156 N -0.97 1.88 -0.11 3.92 2.01 -0.29 -1.02 115.64 121.06 1r15 s THR 156 Ca 0.07 -1.08 -0.01 0.00 0.31 0.00 0.00 61.69 60.99 1r15 s THR 156 Cb -0.09 -1.57 0.03 0.00 0.01 0.00 0.00 72.50 70.87 1r15 s THR 156 CO 0.03 0.48 -0.07 -0.47 -0.69 0.00 0.00 174.62 173.90 1r15 s TYR 157 N -0.61 1.41 -0.18 4.92 5.04 0.23 0.88 117.35 129.04 1r15 s TYR 157 Ca 0.09 -0.69 -0.06 0.00 -2.44 0.00 0.00 57.07 53.98 1r15 s TYR 157 Cb -0.09 -1.19 -0.03 0.00 0.35 0.00 0.00 41.96 40.99 1r15 s TYR 157 CO -0.00 -0.50 0.02 1.41 -1.34 0.00 0.00 175.55 175.14 1r15 s MET 158 N 1.73 3.80 0.17 4.97 -2.45 0.15 0.12 119.30 127.80 1r15 s MET 158 Ca 0.05 -0.44 0.07 0.00 -1.25 0.00 0.00 55.69 54.12 1r15 s MET 158 Cb -0.12 -3.10 -0.04 0.00 1.25 0.00 0.00 34.83 32.81 1r15 s MET 158 CO -0.08 0.20 -0.14 0.14 1.05 0.00 0.00 175.02 176.19 1r15 s VAL 159 N 0.54 1.54 -0.34 10.11 -7.23 -0.36 -1.48 120.40 123.17 1r15 s VAL 159 Ca 0.00 -2.07 -0.23 0.00 -1.81 0.00 0.00 61.98 57.87 1r15 s VAL 159 Cb -0.13 -1.89 0.01 0.00 0.56 0.00 0.00 36.38 34.92 1r15 s VAL 159 CO 0.02 -0.58 0.79 -0.62 -0.31 0.00 0.00 175.10 174.40 1r15 s ASP 160 N -3.08 6.59 -0.09 4.85 -1.08 -1.22 -0.39 116.67 122.26 1r15 s ASP 160 Ca 0.18 0.47 0.19 0.00 -0.52 0.00 0.00 52.55 52.87 1r15 s ASP 160 Cb -0.01 -2.40 0.69 0.00 -1.46 0.00 0.00 42.92 39.74 1r15 s ASP 160 CO 0.05 -0.69 1.60 0.61 0.52 0.00 0.00 175.17 177.26 1r15 n GLY 161 N 4.41 2.75 0.46 2.66 0.00 0.12 -3.99 105.19 111.60 1r15 n GLY 161 Ca 0.03 -0.83 0.07 0.00 0.00 0.00 0.00 46.02 45.29 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 1.16 1.86 -4.15 1.61 7.64 -1.24 -0.51 113.62 120.00 1r15 n SER 162 Ca 0.25 -3.53 -0.36 0.00 1.01 0.00 0.00 58.87 56.24 1r15 n SER 162 Cb 0.83 -0.48 -0.12 0.00 -1.01 0.00 0.00 64.21 63.43 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 -3.03 5.20 0.53 6.43 3.04 -1.26 -4.83 114.94 121.02 1r15 s ASN 163 Ca 0.35 -1.79 0.24 0.00 0.04 0.00 0.00 52.86 51.70 1r15 s ASN 163 Cb 0.33 -1.81 1.38 0.00 -1.54 0.00 0.00 41.25 39.61 1r15 s ASN 163 CO -0.04 -0.47 2.02 1.55 -3.04 0.00 0.00 177.10 177.13 1r15 h PRO 164 N 8.06 0.00 0.00 0.43 0.13 -1.93 -2.30 132.00 136.39 1r15 h PRO 164 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 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 0.66 0.00 -0.91 0.87 -0.23 0.00 0.00 178.00 178.39 1r15 h LYS 165 N 0.00 0.00 -3.71 0.86 1.57 -2.03 -3.45 116.57 109.82 1r15 h LYS 165 Ca 0.21 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.44 1r15 h LYS 165 Cb 0.84 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.75 1r15 h LYS 165 CO -0.00 0.00 -0.77 0.08 -0.57 0.00 0.00 179.45 178.19 1r15 s VAL 166 N -3.30 0.79 0.63 0.50 1.01 -0.87 -5.13 120.40 114.04 1r15 s VAL 166 Ca 0.02 -0.85 -0.18 0.00 0.00 0.00 0.00 61.98 60.96 1r15 s VAL 166 Cb 0.11 -1.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 1r15 s VAL 166 CO 0.77 -0.28 1.21 -0.81 0.00 0.00 0.00 175.10 176.00 1r15 n PRO 167 N 4.94 1.09 -0.15 2.72 -0.04 -1.26 -4.53 135.00 137.77 1r15 n PRO 167 Ca -0.08 0.43 -0.07 0.00 -0.04 0.00 0.00 63.50 63.73 1r15 n PRO 167 Cb 0.45 -2.44 -0.02 0.00 -0.04 0.00 0.00 33.50 31.46 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 0.57 -0.20 -3.43 0.55 0.00 -1.90 -3.38 119.26 111.47 1r15 h ALA 168 Ca -0.50 0.11 -0.68 0.00 0.00 0.00 0.00 54.91 53.84 1r15 h ALA 168 Cb 1.34 0.79 -0.17 0.00 0.00 0.00 0.00 17.79 19.75 1r15 h ALA 168 CO 0.53 -0.75 -0.65 -0.47 0.00 0.00 0.00 179.25 177.91 1r15 s TYR 169 N -5.95 3.08 -0.03 0.00 5.04 -1.26 -4.70 117.35 113.52 1r15 s TYR 169 Ca -0.15 0.10 -0.01 0.00 -2.44 0.00 0.00 57.07 54.57 1r15 s TYR 169 Cb 0.14 -1.78 0.03 0.00 0.35 0.00 0.00 41.96 40.70 1r15 s TYR 169 CO 0.68 0.38 0.06 1.03 -1.34 0.00 0.00 175.55 176.36 1r15 s ARG 170 N -0.74 -0.00 0.56 4.97 0.52 -1.26 -4.82 118.95 118.18 1r15 s ARG 170 Ca 0.11 0.23 0.29 0.00 -0.52 0.00 0.00 55.73 55.84 1r15 s ARG 170 Cb -0.11 -0.22 1.47 0.00 0.52 0.00 0.00 34.95 36.61 1r15 s ARG 170 CO 0.02 -0.16 1.93 -1.35 0.02 0.00 0.00 175.30 175.76 1r15 h PRO 171 N 7.23 0.00 -0.69 3.54 0.11 -1.99 -2.43 132.00 137.78 1r15 h PRO 171 Ca -0.44 0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.19 1r15 h PRO 171 Cb 1.13 0.00 -0.33 0.00 0.11 0.00 0.00 31.00 31.91 1r15 h PRO 171 CO 0.47 0.00 -0.36 -0.40 -0.21 0.00 0.00 178.00 177.49 1r15 n ASP 172 N -4.00 4.86 -4.96 -2.05 5.75 -1.26 -2.84 116.55 112.05 1r15 n ASP 172 Ca 0.10 -3.78 -0.22 0.00 -0.01 0.00 0.00 54.79 50.89 1r15 n ASP 172 Cb 0.69 -0.52 0.02 0.00 -1.03 0.00 0.00 41.12 40.28 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 -3.08 5.64 0.49 -1.12 1.04 -0.91 -4.83 113.70 110.93 1r15 s SER 173 Ca 0.52 0.15 0.17 0.00 0.48 0.00 0.00 55.95 57.26 1r15 s SER 173 Cb 0.43 -1.27 1.19 0.00 0.10 0.00 0.00 66.02 66.47 1r15 s SER 173 CO 0.02 -0.84 2.06 -0.26 0.98 0.00 0.00 173.24 175.19 1r15 h PHE 174 N 0.31 0.17 0.36 5.02 -1.00 -1.92 0.34 116.94 120.21 1r15 h PHE 174 Ca -0.45 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.32 1r15 h PHE 174 Cb 1.27 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 40.78 1r15 h PHE 174 CO 0.42 0.09 -0.17 0.35 -1.61 0.00 0.00 178.31 177.39 1r15 h PHE 175 N 0.17 -0.44 0.00 -0.55 3.57 -1.89 0.24 116.94 118.03 1r15 h PHE 175 Ca 0.14 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 1r15 h PHE 175 Cb 0.36 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 1r15 h PHE 175 CO -0.00 -0.16 -0.17 0.78 -2.23 0.00 0.00 178.31 176.54 1r15 h GLY 176 N -0.69 0.00 0.59 2.40 0.00 -1.42 0.21 103.07 104.15 1r15 h GLY 176 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.99 1r15 h GLY 176 CO 0.08 0.00 -1.50 0.50 0.00 0.00 0.00 176.54 175.62 1r15 h LYS 177 N 0.00 0.26 0.00 4.80 1.57 -0.21 -3.40 116.57 119.58 1r15 h LYS 177 Ca -0.00 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1r15 h LYS 177 Cb 0.35 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1r15 h LYS 177 CO 0.02 1.21 -0.93 0.66 -0.57 0.00 0.00 179.45 179.85 1r15 n TYR 178 N -3.86 0.00 -0.02 -1.35 4.01 0.82 -4.75 117.16 112.02 1r15 n TYR 178 Ca -0.26 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 -0.59 -0.72 5.08 -0.80 -3.34 114.58 114.22 1r15 h GLU 179 Ca 0.00 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.48 1r15 h GLU 179 Cb 0.42 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.56 1r15 h GLU 179 CO 0.00 0.00 -0.08 1.25 -1.00 0.00 0.00 179.01 179.18 1r15 h LEU 180 N -0.26 -0.42 -1.73 1.33 5.85 -0.93 -0.69 115.31 118.46 1r15 h LEU 180 Ca 0.00 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1r15 h LEU 180 Cb 0.10 0.32 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1r15 h LEU 180 CO 0.00 -0.16 0.00 -0.65 -0.34 0.00 0.00 178.44 177.29 1r15 h PRO 181 N 0.05 0.00 -0.13 5.25 0.11 -1.78 -2.65 132.00 132.85 1r15 h PRO 181 Ca 0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.40 1r15 h PRO 181 Cb 0.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.57 1r15 h PRO 181 CO -0.56 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.32 1r15 n ASN 182 N -2.68 3.06 -4.72 -2.05 3.02 -0.28 -4.94 115.26 106.68 1r15 n ASN 182 Ca -0.01 -1.96 -0.42 0.00 -0.03 0.00 0.00 54.58 52.16 1r15 n ASN 182 Cb 0.15 -0.07 -0.03 0.00 -0.61 0.00 0.00 39.78 39.22 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 -1.79 4.37 0.78 3.41 1.43 -1.00 -3.76 118.68 122.12 1r15 s LEU 183 Ca 0.30 2.73 -0.07 0.00 -1.03 0.00 0.00 54.13 56.06 1r15 s LEU 183 Cb 0.20 -3.59 0.12 0.00 0.03 0.00 0.00 46.19 42.95 1r15 s LEU 183 CO 0.29 -0.90 1.09 0.42 0.23 0.00 0.00 176.35 177.48 1r15 s THR 184 N 1.32 2.16 -1.72 5.49 -4.23 -1.26 -4.93 115.64 112.46 1r15 s THR 184 Ca 0.73 -0.33 0.16 0.00 -1.18 0.00 0.00 61.69 61.07 1r15 s THR 184 Cb -0.46 -2.83 0.36 0.00 1.34 0.00 0.00 72.50 70.91 1r15 s THR 184 CO 0.32 0.00 1.40 -0.46 -0.54 0.00 0.00 174.62 175.33 1r15 n ASN 185 N -3.11 0.00 0.13 3.99 6.94 -1.26 -1.20 115.26 120.75 1r15 n ASN 185 Ca 0.13 -0.22 0.13 0.00 -0.02 0.00 0.00 54.58 54.59 1r15 n ASN 185 Cb 0.60 -0.14 0.42 0.00 -2.36 0.00 0.00 39.78 38.30 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 -6.49 -3.83 1.57 -1.92 -3.44 116.57 102.47 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 0.07 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 1r15 h LYS 186 CO 0.00 0.00 0.20 0.08 -0.57 0.00 0.00 179.45 179.16 1r15 s VAL 187 N -3.20 4.44 -0.27 0.50 1.01 -0.34 -0.33 120.40 122.21 1r15 s VAL 187 Ca 0.08 1.75 -0.14 0.00 0.00 0.00 0.00 61.98 63.66 1r15 s VAL 187 Cb 0.11 -4.16 -0.11 0.00 0.00 0.00 0.00 36.38 32.21 1r15 s VAL 187 CO 0.55 0.47 -0.36 0.41 0.00 0.00 0.00 175.10 176.17 1r15 n THR 188 N 1.98 1.52 -4.00 3.92 -1.04 0.47 -4.81 114.28 112.32 1r15 n THR 188 Ca -0.04 -0.32 -0.09 0.00 -2.04 0.00 0.00 64.05 61.56 1r15 n THR 188 Cb 0.49 -1.94 -0.08 0.00 -1.82 0.00 0.00 70.33 66.98 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 -2.56 0.92 -0.26 -2.82 3.52 -1.24 -1.68 118.95 114.84 1r15 s ARG 189 Ca -0.37 -1.18 0.00 0.00 -0.13 0.00 0.00 55.73 54.04 1r15 s ARG 189 Cb 0.14 0.31 0.07 0.00 -1.56 0.00 0.00 34.95 33.91 1r15 s ARG 189 CO 0.48 -0.29 0.01 0.08 -0.81 0.00 0.00 175.30 174.77 1r15 s VAL 190 N -3.95 1.29 -0.22 7.11 1.01 -0.68 -1.07 120.40 123.89 1r15 s VAL 190 Ca 0.14 -1.27 -0.13 0.00 0.00 0.00 0.00 61.98 60.72 1r15 s VAL 190 Cb 0.05 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 1r15 s VAL 190 CO -0.04 -0.30 0.27 -0.54 0.00 0.00 0.00 175.10 174.48 1r15 s LYS 191 N 1.47 4.11 -0.05 2.72 1.02 -0.19 -2.06 119.74 126.75 1r15 s LYS 191 Ca 0.00 -0.06 -0.02 0.00 0.02 0.00 0.00 55.97 55.91 1r15 s LYS 191 Cb -0.18 -3.54 -0.04 0.00 -0.52 0.00 0.00 37.83 33.55 1r15 s LYS 191 CO -0.11 0.01 0.06 0.08 -0.92 0.00 0.00 175.35 174.46 1r15 s VAL 192 N 1.20 4.67 -0.21 3.17 1.01 -0.09 -0.60 120.40 129.56 1r15 s VAL 192 Ca 0.13 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.87 1r15 s VAL 192 Cb -0.14 -3.05 0.04 0.00 0.00 0.00 0.00 36.38 33.23 1r15 s VAL 192 CO 0.06 0.50 -0.12 -0.63 0.00 0.00 0.00 175.10 174.90 1r15 s ILE 193 N -1.04 1.82 -0.14 2.22 1.01 0.12 -1.37 121.20 123.82 1r15 s ILE 193 Ca 0.18 -1.12 -0.16 0.00 0.00 0.00 0.00 60.65 59.55 1r15 s ILE 193 Cb -0.12 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 1r15 s ILE 193 CO 0.08 0.20 0.39 -0.69 0.00 0.00 0.00 174.94 174.92 1r15 s VAL 194 N 1.32 5.24 -0.23 2.92 1.01 0.92 -1.23 120.40 130.36 1r15 s VAL 194 Ca -0.02 0.77 -0.09 0.00 0.00 0.00 0.00 61.98 62.64 1r15 s VAL 194 Cb -0.16 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 1r15 s VAL 194 CO -0.08 0.35 0.12 -0.22 0.00 0.00 0.00 175.10 175.26 1r15 s LEU 195 N 0.58 3.91 -0.69 3.92 0.20 0.48 -1.20 118.68 125.88 1r15 s LEU 195 Ca 0.22 0.04 -0.05 0.00 0.69 0.00 0.00 54.13 55.03 1r15 s LEU 195 Cb -0.14 -2.03 0.18 0.00 -0.43 0.00 0.00 46.19 43.77 1r15 s LEU 195 CO 0.07 0.08 0.54 -1.00 -0.29 0.00 0.00 176.35 175.75 1r15 s HIS 196 N 0.97 3.51 0.17 5.38 3.76 -1.26 0.13 115.29 127.95 1r15 s HIS 196 Ca 0.06 -2.61 -0.30 0.00 -0.15 0.00 0.00 55.06 52.06 1r15 s HIS 196 Cb -0.14 -3.33 -0.17 0.00 1.11 0.00 0.00 32.58 30.06 1r15 s HIS 196 CO 0.03 -0.86 0.67 0.54 -0.85 0.00 0.00 174.74 174.27 1r15 n ARG 197 N 3.45 0.13 -1.91 1.40 1.74 -1.26 -4.81 116.66 115.41 1r15 n ARG 197 Ca 0.10 0.05 -0.41 0.00 -0.77 0.00 0.00 57.85 56.82 1r15 n ARG 197 Cb 0.39 -1.17 -0.01 0.00 -1.02 0.00 0.00 32.46 30.65 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 2.23 4.36 -1.35 0.55 1.43 -1.26 -2.89 118.68 121.76 1r15 s LEU 198 Ca 0.69 2.87 -0.04 0.00 -1.03 0.00 0.00 54.13 56.61 1r15 s LEU 198 Cb -0.97 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 41.61 1r15 s LEU 198 CO 0.56 -0.77 0.52 0.61 0.23 0.00 0.00 176.35 177.50 1r15 n GLY 199 N 1.32 -0.35 3.03 -3.19 0.00 -1.26 -5.00 105.19 99.73 1r15 n GLY 199 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 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 -5.53 0.87 0.18 1.61 0.41 -1.14 -5.10 118.70 110.00 1r15 s GLU 200 Ca 0.26 -0.34 -0.33 0.00 -0.41 0.00 0.00 54.97 54.14 1r15 s GLU 200 Cb -0.11 -0.83 -0.14 0.00 -1.78 0.00 0.00 34.13 31.27 1r15 s GLU 200 CO 0.32 0.18 1.58 1.17 -0.49 0.00 0.00 175.26 178.02 1r15 n LYS 201 N 3.00 2.23 -2.25 1.61 4.81 -1.26 -4.86 118.16 121.45 1r15 n LYS 201 Ca -0.15 0.80 -0.42 0.00 -0.87 0.00 0.00 58.31 57.67 1r15 n LYS 201 Cb 0.56 -2.57 -0.03 0.00 0.02 0.00 0.00 35.03 33.00 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 0.84 3.46 -0.17 3.15 1.01 -1.26 -4.69 121.20 123.54 1r15 s ILE 202 Ca 0.77 1.08 -0.06 0.00 0.00 0.00 0.00 60.65 62.44 1r15 s ILE 202 Cb -0.65 -3.69 -0.08 0.00 0.01 0.00 0.00 42.46 38.05 1r15 s ILE 202 CO 0.38 0.10 -0.20 -0.38 0.00 0.00 0.00 174.94 174.85 1r15 n ILE 203 N 3.63 0.92 -4.25 2.92 2.08 0.34 -5.00 119.36 119.99 1r15 n ILE 203 Ca 0.10 -0.26 -0.30 0.00 0.56 0.00 0.00 62.75 62.85 1r15 n ILE 203 Cb 0.43 -1.58 -0.10 0.00 -0.75 0.00 0.00 39.64 37.65 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 -2.31 2.23 0.04 0.38 0.41 0.05 -5.01 118.70 114.48 1r15 s GLU 204 Ca -0.23 -0.97 -0.00 0.00 -0.41 0.00 0.00 54.97 53.36 1r15 s GLU 204 Cb 0.08 -2.35 -0.03 0.00 -1.78 0.00 0.00 34.13 30.05 1r15 s GLU 204 CO 0.31 0.52 -0.03 0.15 -0.49 0.00 0.00 175.26 175.72 1r15 s LYS 205 N -2.12 0.45 0.56 1.61 1.02 -1.26 -4.85 119.74 115.15 1r15 s LYS 205 Ca 0.21 -0.86 -0.21 0.00 0.02 0.00 0.00 55.97 55.14 1r15 s LYS 205 Cb -0.11 0.10 -0.05 0.00 -0.52 0.00 0.00 37.83 37.25 1r15 s LYS 205 CO 0.13 -0.06 1.19 0.00 -0.92 0.00 0.00 175.35 175.70 1r15 n GLY 207 N 0.98 0.27 3.18 0.00 0.00 -1.26 -4.93 105.19 103.44 1r15 n GLY 207 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.65 1.06 0.00 4.61 0.00 -0.87 -4.60 121.76 120.31 1r15 s ALA 208 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.58 1r15 s ALA 208 Cb 0.00 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.29 1r15 s ALA 208 CO 0.00 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1r15 n GLY 209 N -0.07 2.69 0.21 0.00 0.00 -1.26 -1.70 105.19 105.06 1r15 n GLY 209 Ca -0.12 -0.17 0.07 0.00 0.00 0.00 0.00 46.02 45.81 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 2.30 0.00 -0.32 1.61 4.64 -1.91 -2.37 113.55 117.50 1r15 h SER 210 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1r15 h SER 210 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1r15 h SER 210 CO 0.00 0.28 -0.12 -0.07 -0.87 0.00 0.00 176.83 176.05 1r15 h LEU 211 N 0.00 0.74 -0.68 5.97 -0.00 -1.59 0.54 115.31 120.29 1r15 h LEU 211 Ca -0.00 -0.23 -0.10 0.00 -0.00 0.00 0.00 57.88 57.55 1r15 h LEU 211 Cb 0.65 -0.20 -0.02 0.00 -0.00 0.00 0.00 40.66 41.09 1r15 h LEU 211 CO 0.04 0.89 -0.11 0.25 -0.00 0.00 0.00 178.44 179.51 1r15 h LEU 212 N 0.68 0.91 -0.34 1.67 7.12 -0.86 -0.76 115.31 123.73 1r15 h LEU 212 Ca 0.11 -0.29 -0.09 0.00 0.13 0.00 0.00 57.88 57.75 1r15 h LEU 212 Cb 0.60 -0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 40.47 1r15 h LEU 212 CO 0.04 1.03 -0.13 0.44 -0.13 0.00 0.00 178.44 179.69 1r15 h ASP 213 N 0.82 0.71 -0.36 1.25 3.32 -0.98 -2.72 116.42 118.45 1r15 h ASP 213 Ca 0.13 -0.39 0.02 0.00 0.02 0.00 0.00 57.03 56.81 1r15 h ASP 213 Cb 0.63 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1r15 h ASP 213 CO 0.04 0.93 0.21 0.25 -1.72 0.00 0.00 179.24 178.96 1r15 h LEU 214 N 0.47 0.34 -0.48 1.55 5.85 -0.76 0.33 115.31 122.61 1r15 h LEU 214 Ca 0.08 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.90 1r15 h LEU 214 Cb 0.65 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.53 1r15 h LEU 214 CO 0.04 0.25 0.01 -0.08 -0.34 0.00 0.00 178.44 178.32 1r15 h GLU 215 N 0.43 0.12 -0.11 1.25 4.81 -1.00 0.61 114.58 120.69 1r15 h GLU 215 Ca 0.14 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1r15 h GLU 215 Cb 0.01 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 1r15 h GLU 215 CO -0.07 0.08 0.05 0.87 -0.73 0.00 0.00 179.01 179.21 1r15 h LYS 216 N 0.13 0.15 -0.94 1.92 1.57 -1.13 -0.66 116.57 117.60 1r15 h LYS 216 Ca 0.24 -0.02 0.11 0.00 -1.87 0.00 0.00 60.65 59.11 1r15 h LYS 216 Cb 0.36 -0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.56 1r15 h LYS 216 CO -0.39 0.22 0.58 1.25 -0.57 0.00 0.00 179.45 180.53 1r15 h LEU 217 N 0.05 0.85 -0.02 2.94 5.85 0.11 0.15 115.31 125.24 1r15 h LEU 217 Ca 0.04 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1r15 h LEU 217 Cb 0.11 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.02 1r15 h LEU 217 CO -0.00 0.47 -0.04 0.58 -0.34 0.00 0.00 178.44 179.10 1r15 h VAL 218 N 0.94 1.45 0.00 1.05 2.07 0.48 -2.36 116.25 119.88 1r15 h VAL 218 Ca 0.46 -1.40 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 1r15 h VAL 218 Cb 0.42 2.35 -0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1r15 h VAL 218 CO -0.25 0.37 -0.03 0.11 0.02 0.00 0.00 177.57 177.79 1r15 h LYS 219 N -0.50 0.00 -0.15 1.57 1.57 -0.78 -0.40 116.57 117.88 1r15 h LYS 219 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1r15 h LYS 219 Cb 0.63 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 1r15 h LYS 219 CO 0.01 0.03 0.04 0.00 -0.57 0.00 0.00 179.45 178.96 1r15 h ALA 220 N 1.97 0.20 0.00 3.86 0.00 -0.51 0.42 119.26 125.21 1r15 h ALA 220 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1r15 h ALA 220 Cb 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1r15 h ALA 220 CO 0.00 -0.16 0.00 1.63 0.00 0.00 0.00 179.25 180.72 1r15 n LYS 221 N -4.82 0.58 -2.89 0.00 5.02 -0.19 -4.82 118.16 111.02 1r15 n LYS 221 Ca -0.05 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.13 1r15 n LYS 221 Cb 0.16 -1.17 0.05 0.00 -0.02 0.00 0.00 35.03 34.05 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 -0.67 -1.34 -4.43 2.13 8.25 0.14 -5.03 115.22 114.28 1r15 n HIS 222 Ca 0.05 0.53 -0.26 0.00 -0.26 0.00 0.00 57.72 57.78 1r15 n HIS 222 Cb 0.02 -3.55 -0.11 0.00 1.12 0.00 0.00 29.99 27.47 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 2.29 0.79 4.41 0.08 -1.03 -5.00 117.98 116.33 1r15 s PHE 223 Ca 0.11 -0.36 -0.12 0.00 0.12 0.00 0.00 56.93 56.68 1r15 s PHE 223 Cb -0.05 -1.11 0.06 0.00 -0.57 0.00 0.00 43.02 41.36 1r15 s PHE 223 CO 0.40 0.53 1.11 0.00 -0.10 0.00 0.00 175.22 177.17 1r15 s ALA 224 N -1.82 2.43 -0.05 5.36 0.00 -0.68 -4.05 121.76 122.95 1r15 s ALA 224 Ca 0.22 -0.34 -0.03 0.00 0.00 0.00 0.00 51.96 51.81 1r15 s ALA 224 Cb -0.07 -3.06 0.02 0.00 0.00 0.00 0.00 23.12 20.01 1r15 s ALA 224 CO 0.11 -1.61 0.13 0.12 0.00 0.00 0.00 175.76 174.50 1r15 s PHE 225 N -3.28 -0.14 0.24 0.00 5.36 -1.26 -1.69 117.98 117.20 1r15 s PHE 225 Ca 0.60 0.39 0.05 0.00 -0.96 0.00 0.00 56.93 57.01 1r15 s PHE 225 Cb -0.13 -0.02 -0.05 0.00 -0.34 0.00 0.00 43.02 42.48 1r15 s PHE 225 CO 0.53 -0.11 -0.05 -0.51 -1.46 0.00 0.00 175.22 173.62 1r15 s ASP 226 N 0.57 2.24 -0.28 6.13 1.01 -0.88 -4.97 116.67 120.49 1r15 s ASP 226 Ca -0.04 -1.16 -0.18 0.00 0.71 0.00 0.00 52.55 51.87 1r15 s ASP 226 Cb -0.06 -0.07 0.10 0.00 1.01 0.00 0.00 42.92 43.90 1r15 s ASP 226 CO -0.03 -0.39 0.81 0.00 0.21 0.00 0.00 175.17 175.77 1r15 s VAL 228 N 1.24 0.14 -0.20 0.00 -7.23 -0.47 -4.95 120.40 108.93 1r15 s VAL 228 Ca -0.07 -0.59 -0.05 0.00 -1.81 0.00 0.00 61.98 59.46 1r15 s VAL 228 Cb -0.05 -0.22 -0.02 0.00 0.56 0.00 0.00 36.38 36.65 1r15 s VAL 228 CO -0.14 -0.29 -0.00 -1.61 -0.31 0.00 0.00 175.10 172.74 1r15 s GLU 229 N -0.92 3.62 -1.13 4.82 2.02 -1.26 -0.06 118.70 125.79 1r15 s GLU 229 Ca -0.09 -0.52 -0.27 0.00 0.02 0.00 0.00 54.97 54.11 1r15 s GLU 229 Cb -0.06 -3.06 0.03 0.00 0.10 0.00 0.00 34.13 31.13 1r15 s GLU 229 CO -0.00 0.03 0.69 0.09 0.02 0.00 0.00 175.26 176.09 1r15 n ASN 230 N 4.18 -4.53 -4.76 -0.19 4.13 -0.34 -4.86 115.26 108.89 1r15 n ASN 230 Ca -0.17 -1.18 -0.40 0.00 1.68 0.00 0.00 54.58 54.51 1r15 n ASN 230 Cb 0.52 -2.03 0.03 0.00 -1.54 0.00 0.00 39.78 36.76 1r15 n ASN 230 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1r15 n PRO 231 N -4.47 2.10 -0.29 3.52 -0.04 -1.26 -4.44 135.00 130.12 1r15 n PRO 231 Ca -0.14 0.75 0.11 0.00 -0.04 0.00 0.00 63.50 64.18 1r15 n PRO 231 Cb 0.59 -2.61 0.25 0.00 -0.04 0.00 0.00 33.50 31.68 1r15 n PRO 231 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r15 h ARG 232 N 2.05 0.19 -0.67 0.54 3.08 -1.98 0.24 114.38 117.82 1r15 h ARG 232 Ca -0.51 -0.01 0.12 0.00 0.07 0.00 0.00 59.98 59.65 1r15 h ARG 232 Cb 1.28 -0.04 -0.09 0.00 0.08 0.00 0.00 29.97 31.20 1r15 h ARG 232 CO 0.60 0.13 0.23 0.00 -1.07 0.00 0.00 179.97 179.85 1r15 h ALA 233 N 1.75 0.89 -0.09 0.04 0.00 -2.01 -1.05 119.26 118.79 1r15 h ALA 233 Ca 0.51 0.11 -0.15 0.00 0.00 0.00 0.00 54.91 55.38 1r15 h ALA 233 Cb 0.99 0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.90 1r15 h ALA 233 CO -0.64 -0.24 -0.54 0.28 0.00 0.00 0.00 179.25 178.11 1r15 h VAL 234 N 0.38 1.37 -0.49 0.00 2.07 -1.00 -3.13 116.25 115.45 1r15 h VAL 234 Ca 0.36 -1.87 0.09 0.00 0.82 0.00 0.00 66.70 66.10 1r15 h VAL 234 Cb 0.52 2.24 -0.07 0.00 -1.52 0.00 0.00 31.29 32.45 1r15 h VAL 234 CO -0.38 0.56 0.06 0.25 0.02 0.00 0.00 177.57 178.07 1r15 h LEU 235 N 0.12 -0.09 -1.47 2.57 5.85 -0.36 0.39 115.31 122.31 1r15 h LEU 235 Ca -0.04 0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.84 1r15 h LEU 235 Cb 1.19 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 42.34 1r15 h LEU 235 CO 0.11 -0.02 0.42 -0.26 -0.34 0.00 0.00 178.44 178.36 1r15 h PHE 236 N 0.18 0.65 -0.58 1.25 0.04 -1.25 0.12 116.94 117.35 1r15 h PHE 236 Ca 0.25 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 61.01 1r15 h PHE 236 Cb 0.35 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 38.26 1r15 h PHE 236 CO -0.26 0.35 0.26 1.25 -0.60 0.00 0.00 178.31 179.31 1r15 h LEU 237 N 0.65 0.78 -0.60 1.54 5.85 -0.88 -1.72 115.31 120.92 1r15 h LEU 237 Ca 0.28 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1r15 h LEU 237 Cb 0.26 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1r15 h LEU 237 CO -0.08 0.71 0.23 -0.07 -0.34 0.00 0.00 178.44 178.89 1r15 h LEU 238 N 0.80 0.84 -1.36 2.25 3.38 -0.38 -2.63 115.31 118.20 1r15 h LEU 238 Ca 0.20 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1r15 h LEU 238 Cb 0.15 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1r15 h LEU 238 CO -0.02 0.79 0.45 0.00 0.09 0.00 0.00 178.44 179.74 1r15 h SER 240 N 0.84 0.37 0.49 0.00 0.87 -0.93 -0.05 113.55 115.15 1r15 h SER 240 Ca 0.26 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.90 1r15 h SER 240 Cb 0.01 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1r15 h SER 240 CO -0.07 0.20 -0.04 0.47 -0.53 0.00 0.00 176.83 176.86 1r15 n ASP 241 N -4.92 0.13 -2.80 6.23 9.92 -1.03 -4.33 116.55 119.75 1r15 n ASP 241 Ca 0.11 -0.29 -0.06 0.00 -0.53 0.00 0.00 54.79 54.02 1r15 n ASP 241 Cb 0.31 -0.21 0.01 0.00 -0.64 0.00 0.00 41.12 40.59 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 -1.19 -3.15 -0.18 -2.24 4.05 -0.20 -5.02 115.26 107.32 1r15 n ASN 242 Ca 0.15 -2.96 0.01 0.00 0.45 0.00 0.00 54.58 52.23 1r15 n ASN 242 Cb 0.25 1.61 0.27 0.00 1.23 0.00 0.00 39.78 43.14 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 4.84 0.91 0.00 1.20 0.11 -1.28 -2.89 132.00 134.90 1r15 h PRO 243 Ca 0.03 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.05 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 0.09 0.61 -0.17 -0.91 -0.21 0.00 0.00 178.00 177.41 1r15 h ASN 244 N 0.93 0.00 -0.93 -2.05 4.21 -1.96 -3.44 115.58 112.35 1r15 h ASN 244 Ca 0.25 0.00 -0.65 0.00 1.21 0.00 0.00 56.30 57.11 1r15 h ASN 244 Cb -0.09 0.00 0.09 0.00 -1.12 0.00 0.00 38.32 37.20 1r15 h ASN 244 CO -0.05 0.17 -0.35 0.00 -1.29 0.00 0.00 177.43 175.91 1r15 n ALA 245 N -2.20 -2.92 -0.30 -0.83 0.00 -1.09 -4.80 120.51 108.36 1r15 n ALA 245 Ca 0.00 0.45 0.03 0.00 0.00 0.00 0.00 53.44 53.92 1r15 n ALA 245 Cb 0.39 -1.53 0.23 0.00 0.00 0.00 0.00 19.45 18.55 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 1.41 1.02 0.00 0.00 1.12 -1.91 -1.88 114.38 114.14 1r15 h ARG 246 Ca -0.32 -0.06 0.00 0.00 -1.11 0.00 0.00 59.98 58.49 1r15 h ARG 246 Cb 1.33 -0.23 0.00 0.00 -0.01 0.00 0.00 29.97 31.06 1r15 h ARG 246 CO 0.55 0.67 0.00 0.39 -3.11 0.00 0.00 179.97 178.47 1r15 n GLU 247 N -4.48 0.27 -0.09 0.20 4.71 -1.26 -2.57 120.64 117.42 1r15 n GLU 247 Ca 0.13 0.11 0.08 0.00 -0.01 0.00 0.00 57.16 57.47 1r15 n GLU 247 Cb 0.18 -1.50 0.12 0.00 -1.01 0.00 0.00 31.44 29.23 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 0.87 1.81 -2.88 0.00 1.74 -1.06 -4.91 116.66 112.22 1r15 n ARG 249 Ca 0.12 0.65 -0.40 0.00 -0.77 0.00 0.00 57.85 57.45 1r15 n ARG 249 Cb 0.42 -2.39 -0.05 0.00 -1.02 0.00 0.00 32.46 29.42 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 4.56 0.00 0.55 1.43 -1.26 -5.15 118.68 120.08 1r15 s LEU 250 Ca 0.83 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 55.62 1r15 s LEU 250 Cb -0.78 -3.40 0.00 0.00 0.03 0.00 0.00 46.19 42.04 1r15 s LEU 250 CO 0.43 0.10 0.23 0.00 0.23 0.00 0.00 176.35 177.35