#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rya s MET 2 N 0.00 0.40 -0.16 2.12 0.00 -1.26 -4.90 119.30 115.49 1rya s MET 2 Ca 0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 55.69 55.40 1rya s MET 2 Cb 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 34.83 34.89 1rya s MET 2 CO 0.00 -0.61 0.91 0.12 0.00 0.00 0.00 175.02 175.44 1rya s PHE 3 N 2.19 3.43 0.12 4.11 5.36 -1.26 -4.48 117.98 127.46 1rya s PHE 3 Ca 0.17 1.37 -0.19 0.00 -0.96 0.00 0.00 56.93 57.33 1rya s PHE 3 Cb -0.01 -3.10 -0.07 0.00 -0.34 0.00 0.00 43.02 39.50 1rya s PHE 3 CO -0.15 -0.27 0.61 -0.51 -1.46 0.00 0.00 175.22 173.44 1rya s LEU 4 N 2.26 4.45 0.84 6.12 1.43 -1.26 -5.06 118.68 127.46 1rya s LEU 4 Ca 0.42 1.27 -0.12 0.00 -1.03 0.00 0.00 54.13 54.67 1rya s LEU 4 Cb -0.17 -3.14 0.10 0.00 0.03 0.00 0.00 46.19 43.02 1rya s LEU 4 CO 0.13 0.19 1.19 0.00 0.23 0.00 0.00 176.35 178.09 1rya s ARG 5 N -1.47 1.44 0.32 1.70 1.70 -1.26 -4.67 118.95 116.70 1rya s ARG 5 Ca 0.34 1.70 0.00 0.00 -0.47 0.00 0.00 55.73 57.30 1rya s ARG 5 Cb -0.18 -1.76 0.53 0.00 -0.57 0.00 0.00 34.95 32.97 1rya s ARG 5 CO 0.20 -2.35 1.97 -0.56 -1.08 0.00 0.00 175.30 173.48 1rya h GLN 6 N -1.20 0.98 -0.29 3.89 -0.00 -1.98 -1.04 115.11 115.46 1rya h GLN 6 Ca -0.45 -0.06 0.00 0.00 -0.00 0.00 0.00 58.65 58.14 1rya h GLN 6 Cb 1.29 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.48 28.53 1rya h GLN 6 CO 0.45 0.65 0.18 0.93 -0.00 0.00 0.00 178.83 181.04 1rya h GLU 7 N 1.01 0.39 -0.03 0.06 3.07 -1.99 -0.02 114.58 117.07 1rya h GLU 7 Ca 0.30 -0.03 -0.16 0.00 -0.50 0.00 0.00 59.36 58.97 1rya h GLU 7 Cb -0.04 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 27.77 1rya h GLU 7 CO -0.08 0.28 -0.69 -0.44 -1.40 0.00 0.00 179.01 176.69 1rya h ASP 8 N 0.38 0.18 -0.76 1.42 3.45 -1.79 -1.86 116.42 117.46 1rya h ASP 8 Ca 0.11 -0.12 -0.06 0.00 0.43 0.00 0.00 57.03 57.39 1rya h ASP 8 Cb -0.01 -0.05 -0.03 0.00 -0.56 0.00 0.00 39.33 38.67 1rya h ASP 8 CO -0.02 0.81 0.25 0.15 -1.57 0.00 0.00 179.24 178.86 1rya h PHE 9 N 0.11 1.21 -0.27 4.55 3.57 -0.93 -0.42 116.94 124.76 1rya h PHE 9 Ca -0.01 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.36 1rya h PHE 9 Cb 1.22 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.60 1rya h PHE 9 CO 0.02 0.94 0.15 0.00 -2.23 0.00 0.00 178.31 177.19 1rya h ALA 10 N 1.13 0.34 -0.74 2.41 0.00 -0.76 0.27 119.26 121.91 1rya h ALA 10 Ca 0.25 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1rya h ALA 10 Cb 0.29 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1rya h ALA 10 CO -0.01 -0.13 0.38 1.15 0.00 0.00 0.00 179.25 180.64 1rya h THR 11 N 0.32 1.23 0.23 0.00 2.02 -1.11 -0.96 112.91 114.65 1rya h THR 11 Ca 0.09 -0.61 -0.01 0.00 0.77 0.00 0.00 66.41 66.66 1rya h THR 11 Cb 0.06 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 66.74 1rya h THR 11 CO -0.02 0.26 -0.13 0.58 0.37 0.00 0.00 175.52 176.59 1rya h VAL 12 N 1.03 0.73 -0.81 3.16 2.07 -0.78 -2.07 116.25 119.58 1rya h VAL 12 Ca 0.26 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.75 1rya h VAL 12 Cb 0.07 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 1rya h VAL 12 CO -0.04 0.00 0.39 0.58 0.02 0.00 0.00 177.57 178.52 1rya h VAL 13 N -0.34 1.25 -0.39 2.57 2.07 -0.69 -1.20 116.25 119.52 1rya h VAL 13 Ca -0.03 -0.70 0.01 0.00 0.82 0.00 0.00 66.70 66.81 1rya h VAL 13 Cb 0.28 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 1rya h VAL 13 CO 0.03 0.30 0.26 0.03 0.02 0.00 0.00 177.57 178.22 1rya h ARG 14 N 1.15 0.47 0.00 1.57 3.08 -1.06 -3.35 114.38 116.24 1rya h ARG 14 Ca 0.28 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.30 1rya h ARG 14 Cb 0.11 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1rya h ARG 14 CO -0.04 0.31 -1.21 0.43 -1.07 0.00 0.00 179.97 178.39 1rya n SER 15 N -4.48 1.23 -3.45 7.04 7.64 -0.55 -4.98 113.62 116.07 1rya n SER 15 Ca 0.03 -0.37 -0.12 0.00 1.01 0.00 0.00 58.87 59.42 1rya n SER 15 Cb 0.10 1.37 -0.03 0.00 -1.01 0.00 0.00 64.21 64.64 1rya n SER 15 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1rya s THR 16 N -2.70 0.00 0.35 0.44 -1.32 -0.64 -5.07 115.64 106.71 1rya s THR 16 Ca -0.01 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.20 1rya s THR 16 Cb 0.10 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.99 1rya s THR 16 CO 0.59 0.00 1.27 -2.16 -2.21 0.00 0.00 174.62 172.11 1rya s PRO 17 N -3.26 4.26 0.58 7.08 0.04 -1.26 -4.61 135.00 137.83 1rya s PRO 17 Ca -0.00 2.12 -0.15 0.00 0.04 0.00 0.00 61.00 63.00 1rya s PRO 17 Cb -0.01 -2.96 -0.04 0.00 0.04 0.00 0.00 34.50 31.53 1rya s PRO 17 CO -0.09 -0.23 1.03 -0.51 0.04 0.00 0.00 177.00 177.24 1rya s LEU 18 N -1.99 3.49 -0.12 -3.56 1.43 0.45 -4.92 118.68 113.45 1rya s LEU 18 Ca 0.51 1.70 0.02 0.00 -1.03 0.00 0.00 54.13 55.34 1rya s LEU 18 Cb -0.37 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 41.33 1rya s LEU 18 CO 0.49 -1.01 -0.20 0.68 0.23 0.00 0.00 176.35 176.54 1rya s VAL 19 N -2.60 2.30 0.16 -1.59 -7.23 -1.26 -0.66 120.40 109.52 1rya s VAL 19 Ca 0.61 -0.92 -0.00 0.00 -1.81 0.00 0.00 61.98 59.86 1rya s VAL 19 Cb -0.14 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 34.84 1rya s VAL 19 CO 0.38 0.54 0.06 -0.94 -0.31 0.00 0.00 175.10 174.83 1rya s SER 20 N 0.55 0.54 -0.11 4.85 1.04 -0.38 -0.18 113.70 120.01 1rya s SER 20 Ca -0.12 -1.25 0.01 0.00 0.48 0.00 0.00 55.95 55.07 1rya s SER 20 Cb -0.17 0.26 -0.02 0.00 0.10 0.00 0.00 66.02 66.20 1rya s SER 20 CO 0.04 -0.72 -0.14 -0.76 0.98 0.00 0.00 173.24 172.64 1rya s LEU 21 N -3.12 2.68 -0.07 2.42 1.43 -0.11 -0.57 118.68 121.35 1rya s LEU 21 Ca 0.28 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 1rya s LEU 21 Cb 0.07 -1.59 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 1rya s LEU 21 CO 0.05 0.20 -0.08 -1.81 0.23 0.00 0.00 176.35 174.94 1rya s ASP 22 N 0.14 4.52 -0.26 2.29 -0.00 -0.66 -1.12 116.67 121.59 1rya s ASP 22 Ca -0.07 -0.06 -0.06 0.00 -0.00 0.00 0.00 52.55 52.36 1rya s ASP 22 Cb -0.15 -1.12 -0.00 0.00 -0.00 0.00 0.00 42.92 41.65 1rya s ASP 22 CO 0.05 0.36 0.03 -0.36 -0.00 0.00 0.00 175.17 175.24 1rya s PHE 23 N -0.77 3.07 -0.59 4.23 2.99 -0.18 -1.05 117.98 125.69 1rya s PHE 23 Ca 0.12 -0.90 -0.13 0.00 0.00 0.00 0.00 56.93 56.02 1rya s PHE 23 Cb -0.11 -2.19 0.15 0.00 0.00 0.00 0.00 43.02 40.87 1rya s PHE 23 CO 0.01 -0.54 0.51 0.42 -0.00 0.00 0.00 175.22 175.63 1rya s ILE 24 N 1.50 4.91 -0.21 0.64 1.01 -0.00 -4.04 121.20 125.01 1rya s ILE 24 Ca 0.04 -1.90 -0.06 0.00 0.00 0.00 0.00 60.65 58.74 1rya s ILE 24 Cb -0.16 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 1rya s ILE 24 CO 0.00 -0.88 0.02 -0.69 0.00 0.00 0.00 174.94 173.40 1rya s VAL 25 N 1.10 4.11 -0.02 2.92 1.01 -1.26 -2.06 120.40 126.21 1rya s VAL 25 Ca 0.08 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.81 1rya s VAL 25 Cb -0.24 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 1rya s VAL 25 CO -0.01 0.42 0.04 -0.70 0.00 0.00 0.00 175.10 174.84 1rya s GLU 26 N 1.04 2.94 0.00 2.72 2.12 -0.24 -1.09 118.70 126.18 1rya s GLU 26 Ca 0.03 -0.52 0.00 0.00 0.36 0.00 0.00 54.97 54.83 1rya s GLU 26 Cb -0.14 -2.77 0.00 0.00 0.26 0.00 0.00 34.13 31.47 1rya s GLU 26 CO 0.02 0.65 0.00 0.27 -0.54 0.00 0.00 175.26 175.66 1rya n ASN 27 N 1.43 0.00 -0.04 -1.70 0.23 -0.46 -0.93 115.26 113.78 1rya n ASN 27 Ca -0.15 -0.06 0.14 0.00 -0.53 0.00 0.00 54.58 53.99 1rya n ASN 27 Cb 0.53 0.00 0.61 0.00 -2.08 0.00 0.00 39.78 38.84 1rya n ASN 27 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1rya n SER 28 N -0.18 0.21 -0.80 0.53 7.64 -1.26 -3.68 113.62 116.08 1rya n SER 28 Ca 0.00 -0.11 0.07 0.00 1.01 0.00 0.00 58.87 59.84 1rya n SER 28 Cb 0.00 -0.22 0.21 0.00 -1.01 0.00 0.00 64.21 63.19 1rya n SER 28 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1rya n ARG 29 N -1.27 2.96 -1.40 1.43 1.74 -1.26 -4.97 116.66 113.89 1rya n ARG 29 Ca 0.11 -2.41 -0.09 0.00 -0.77 0.00 0.00 57.85 54.69 1rya n ARG 29 Cb 0.29 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.16 1rya n ARG 29 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rya n GLY 30 N 0.16 0.88 3.80 -0.13 0.00 -1.24 -5.02 105.19 103.64 1rya n GLY 30 Ca 0.16 -0.63 -0.22 0.00 0.00 0.00 0.00 46.02 45.34 1rya n GLY 30 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rya s GLU 31 N -3.01 2.74 0.02 1.61 2.02 -1.26 -4.64 118.70 116.18 1rya s GLU 31 Ca 0.00 -1.22 0.07 0.00 0.02 0.00 0.00 54.97 53.85 1rya s GLU 31 Cb 0.00 -2.45 -0.02 0.00 0.10 0.00 0.00 34.13 31.75 1rya s GLU 31 CO 0.00 0.28 -0.22 -0.06 0.02 0.00 0.00 175.26 175.28 1rya s PHE 32 N -2.23 1.96 -0.10 1.61 0.40 0.35 -1.36 117.98 118.60 1rya s PHE 32 Ca 0.35 -0.38 -0.30 0.00 -0.60 0.00 0.00 56.93 56.01 1rya s PHE 32 Cb -0.07 -1.20 -0.01 0.00 0.51 0.00 0.00 43.02 42.25 1rya s PHE 32 CO 0.25 0.06 1.02 -1.17 0.70 0.00 0.00 175.22 176.07 1rya s LEU 33 N -0.96 4.25 0.00 -0.37 2.96 -0.25 -0.87 118.68 123.44 1rya s LEU 33 Ca 0.09 1.55 0.05 0.00 -0.22 0.00 0.00 54.13 55.59 1rya s LEU 33 Cb -0.09 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.03 1rya s LEU 33 CO 0.01 -0.46 -0.15 -0.76 -1.32 0.00 0.00 176.35 173.67 1rya s LEU 34 N 2.02 2.07 0.12 -0.68 1.43 -0.11 -4.38 118.68 119.16 1rya s LEU 34 Ca 0.49 -0.33 0.10 0.00 -1.03 0.00 0.00 54.13 53.36 1rya s LEU 34 Cb -0.19 -0.73 -0.04 0.00 0.03 0.00 0.00 46.19 45.26 1rya s LEU 34 CO 0.18 0.14 -0.24 -0.83 0.23 0.00 0.00 176.35 175.84 1rya s GLY 35 N -0.59 1.62 -0.46 -3.19 0.00 -0.18 -1.08 107.32 103.44 1rya s GLY 35 Ca 0.05 -1.43 -0.22 0.00 0.00 0.00 0.00 44.72 43.12 1rya s GLY 35 CO 0.00 -1.41 0.73 1.25 0.00 0.00 0.00 173.10 173.68 1rya s LYS 36 N -2.08 3.32 0.22 2.90 2.20 -0.33 -0.92 119.74 125.06 1rya s LYS 36 Ca 0.15 -0.29 -0.30 0.00 -0.36 0.00 0.00 55.97 55.17 1rya s LYS 36 Cb -0.10 -3.97 -0.09 0.00 -1.51 0.00 0.00 37.83 32.16 1rya s LYS 36 CO 0.07 -1.13 1.31 1.03 -0.36 0.00 0.00 175.35 176.27 1rya s ARG 37 N 3.13 4.39 0.05 4.03 0.52 -0.39 -1.72 118.95 128.95 1rya s ARG 37 Ca 0.26 2.08 0.23 0.00 -0.52 0.00 0.00 55.73 57.77 1rya s ARG 37 Cb -0.14 -3.17 0.01 0.00 0.52 0.00 0.00 34.95 32.17 1rya s ARG 37 CO 0.20 -0.23 0.98 0.25 0.02 0.00 0.00 175.30 176.53 1rya n THR 38 N 2.28 0.17 -4.25 0.02 -2.24 -0.36 -0.67 114.28 109.23 1rya n THR 38 Ca 0.05 -0.26 -0.27 0.00 -2.27 0.00 0.00 64.05 61.29 1rya n THR 38 Cb 0.43 0.20 -0.09 0.00 -2.10 0.00 0.00 70.33 68.77 1rya n THR 38 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1rya s ASN 39 N -3.99 4.44 0.52 3.42 0.02 -1.26 -4.87 114.94 113.22 1rya s ASN 39 Ca 0.03 -0.48 -0.18 0.00 -1.02 0.00 0.00 52.86 51.21 1rya s ASN 39 Cb 0.14 -0.84 -0.07 0.00 0.02 0.00 0.00 41.25 40.51 1rya s ASN 39 CO 0.81 0.11 1.02 -0.13 0.02 0.00 0.00 177.10 178.93 1rya s ARG 40 N -2.75 3.74 0.98 -0.60 0.52 -1.26 -3.08 118.95 116.50 1rya s ARG 40 Ca 0.25 1.16 -0.16 0.00 -0.52 0.00 0.00 55.73 56.46 1rya s ARG 40 Cb -0.09 -2.10 0.20 0.00 0.52 0.00 0.00 34.95 33.48 1rya s ARG 40 CO 0.16 -0.46 1.27 -1.25 0.02 0.00 0.00 175.30 175.04 1rya s PRO 41 N -3.75 0.53 -1.39 3.54 0.04 -1.26 -4.01 135.00 128.70 1rya s PRO 41 Ca 0.63 -0.27 -0.03 0.00 0.04 0.00 0.00 61.00 61.37 1rya s PRO 41 Cb -0.13 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.60 1rya s PRO 41 CO 0.28 -2.51 0.23 0.00 0.04 0.00 0.00 177.00 175.04 1rya n ALA 42 N -3.87 -0.84 -1.77 8.56 0.00 -1.26 -4.92 120.51 116.41 1rya n ALA 42 Ca 0.14 0.16 -0.42 0.00 0.00 0.00 0.00 53.44 53.32 1rya n ALA 42 Cb 0.60 -2.44 -0.02 0.00 0.00 0.00 0.00 19.45 17.59 1rya n ALA 42 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1rya s GLN 43 N -5.37 4.14 0.00 0.00 0.74 -1.18 -2.59 119.66 115.41 1rya s GLN 43 Ca 0.14 2.55 0.00 0.00 0.05 0.00 0.00 55.36 58.10 1rya s GLN 43 Cb -0.07 -3.04 0.00 0.00 1.10 0.00 0.00 33.01 31.00 1rya s GLN 43 CO 0.17 -0.62 0.00 0.41 -0.55 0.00 0.00 175.29 174.70 1rya n GLY 44 N 2.38 2.54 3.85 2.59 0.00 0.16 -4.98 105.19 111.72 1rya n GLY 44 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1rya n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rya s TYR 45 N -2.20 3.38 0.16 1.61 1.51 -1.07 -4.64 117.35 116.10 1rya s TYR 45 Ca 0.00 1.29 -0.30 0.00 -1.01 0.00 0.00 57.07 57.05 1rya s TYR 45 Cb 0.00 -2.61 -0.08 0.00 -0.11 0.00 0.00 41.96 39.17 1rya s TYR 45 CO 0.00 -0.02 1.21 -1.58 -1.11 0.00 0.00 175.55 174.05 1rya s TRP 46 N -2.14 3.42 -0.03 2.71 0.52 -0.12 -1.27 118.94 122.04 1rya s TRP 46 Ca 0.56 1.37 -0.17 0.00 0.02 0.00 0.00 56.10 57.87 1rya s TRP 46 Cb -0.10 -3.45 0.03 0.00 -1.15 0.00 0.00 33.47 28.81 1rya s TRP 46 CO 0.20 -1.30 0.38 0.12 0.02 0.00 0.00 176.95 176.37 1rya s PHE 47 N 0.22 -0.28 0.64 -1.98 5.36 -0.10 -1.72 117.98 120.13 1rya s PHE 47 Ca 0.55 0.46 -0.18 0.00 -0.96 0.00 0.00 56.93 56.80 1rya s PHE 47 Cb -0.32 0.15 -0.01 0.00 -0.34 0.00 0.00 43.02 42.49 1rya s PHE 47 CO 0.35 -0.41 1.26 0.14 -1.46 0.00 0.00 175.22 175.09 1rya s VAL 48 N -1.21 2.24 0.50 3.12 -7.23 -1.26 -1.01 120.40 115.55 1rya s VAL 48 Ca -0.12 0.14 -0.22 0.00 -1.81 0.00 0.00 61.98 59.97 1rya s VAL 48 Cb -0.04 -3.02 -0.07 0.00 0.56 0.00 0.00 36.38 33.81 1rya s VAL 48 CO 0.05 -0.04 1.18 -2.84 -0.31 0.00 0.00 175.10 173.15 1rya s PRO 49 N -3.42 3.55 0.00 4.82 0.02 -1.26 -4.87 135.00 133.85 1rya s PRO 49 Ca 0.80 1.80 0.00 0.00 0.02 0.00 0.00 61.00 63.62 1rya s PRO 49 Cb -0.35 -2.28 0.00 0.00 0.02 0.00 0.00 34.50 31.90 1rya s PRO 49 CO 0.38 -0.73 0.00 0.41 -0.33 0.00 0.00 177.00 176.73 1rya n GLY 50 N 0.43 0.73 3.80 0.52 0.00 -1.26 -1.01 105.19 108.40 1rya n GLY 50 Ca 0.09 -0.71 -0.03 0.00 0.00 0.00 0.00 46.02 45.37 1rya n GLY 50 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rya s GLY 51 N 0.00 -0.10 0.35 -0.02 0.00 -0.27 -4.97 107.32 102.31 1rya s GLY 51 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 44.72 44.53 1rya s GLY 51 CO 0.00 1.10 0.80 1.09 0.00 0.00 0.00 173.10 176.09 1rya s ARG 52 N -2.70 4.08 0.04 2.90 1.70 -1.26 -0.93 118.95 122.77 1rya s ARG 52 Ca 0.17 0.80 -0.26 0.00 -0.47 0.00 0.00 55.73 55.97 1rya s ARG 52 Cb -0.01 -2.37 -0.05 0.00 -0.57 0.00 0.00 34.95 31.94 1rya s ARG 52 CO 0.03 0.11 0.81 0.08 -1.08 0.00 0.00 175.30 175.25 1rya s VAL 53 N -2.03 4.74 0.50 4.99 1.01 0.74 -4.91 120.40 125.46 1rya s VAL 53 Ca 0.56 1.73 -0.03 0.00 0.00 0.00 0.00 61.98 64.24 1rya s VAL 53 Cb -0.10 -4.16 -0.01 0.00 0.00 0.00 0.00 36.38 32.11 1rya s VAL 53 CO 0.16 0.32 0.77 -1.10 0.00 0.00 0.00 175.10 175.26 1rya s GLN 54 N 0.17 3.14 0.14 2.72 -0.21 -1.26 -4.70 119.66 119.65 1rya s GLN 54 Ca 0.41 -0.15 -0.35 0.00 0.02 0.00 0.00 55.36 55.30 1rya s GLN 54 Cb -0.21 -2.42 -0.14 0.00 1.00 0.00 0.00 33.01 31.24 1rya s GLN 54 CO 0.24 -0.39 1.53 1.17 -2.12 0.00 0.00 175.29 175.72 1rya n LYS 55 N -2.29 1.92 -1.61 2.91 3.00 -1.26 -1.99 118.16 118.83 1rya n LYS 55 Ca 0.02 0.69 -0.17 0.00 -0.00 0.00 0.00 58.31 58.85 1rya n LYS 55 Cb 0.57 -2.43 -0.07 0.00 0.00 0.00 0.00 35.03 33.10 1rya n LYS 55 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1rya n ASP 56 N 3.29 -5.11 -4.68 3.14 8.00 -1.26 -2.42 116.55 117.51 1rya n ASP 56 Ca 0.17 0.38 -0.35 0.00 0.71 0.00 0.00 54.79 55.70 1rya n ASP 56 Cb 0.26 -4.15 -0.09 0.00 -0.02 0.00 0.00 41.12 37.12 1rya n ASP 56 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1rya s GLU 57 N -3.65 4.09 0.73 -1.24 2.12 -0.84 -4.01 118.70 115.89 1rya s GLU 57 Ca 0.00 -0.27 -0.11 0.00 0.36 0.00 0.00 54.97 54.95 1rya s GLU 57 Cb 0.00 -3.41 0.03 0.00 0.26 0.00 0.00 34.13 31.02 1rya s GLU 57 CO 0.00 0.21 1.08 0.95 -0.54 0.00 0.00 175.26 176.96 1rya s THR 58 N 0.61 3.54 0.32 -1.70 -4.23 -1.26 -4.77 115.64 108.16 1rya s THR 58 Ca 0.07 0.53 -0.00 0.00 -1.18 0.00 0.00 61.69 61.10 1rya s THR 58 Cb -0.12 -3.09 0.25 0.00 1.34 0.00 0.00 72.50 70.88 1rya s THR 58 CO 0.01 -0.63 1.97 -0.07 -0.54 0.00 0.00 174.62 175.36 1rya h LEU 59 N -0.83 0.85 -0.12 4.79 3.38 -1.98 0.08 115.31 121.47 1rya h LEU 59 Ca -0.44 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.49 1rya h LEU 59 Cb 1.23 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1rya h LEU 59 CO 0.53 0.63 0.08 -0.33 0.09 0.00 0.00 178.44 179.44 1rya h GLU 60 N 0.99 0.17 -0.52 1.13 3.07 -2.00 -0.03 114.58 117.39 1rya h GLU 60 Ca 0.26 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 58.99 1rya h GLU 60 Cb -0.08 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 1rya h GLU 60 CO -0.05 0.16 -0.12 0.00 -1.40 0.00 0.00 179.01 177.60 1rya h ALA 61 N 1.00 0.71 -0.96 3.43 0.00 -1.84 -2.82 119.26 118.78 1rya h ALA 61 Ca 0.04 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1rya h ALA 61 Cb 0.03 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.59 1rya h ALA 61 CO -0.01 0.63 0.58 0.00 0.00 0.00 0.00 179.25 180.45 1rya h ALA 62 N 0.91 1.22 -0.52 0.00 0.00 -0.76 -1.32 119.26 118.78 1rya h ALA 62 Ca 0.13 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1rya h ALA 62 Cb 0.68 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1rya h ALA 62 CO 0.05 0.67 0.27 0.35 0.00 0.00 0.00 179.25 180.59 1rya h PHE 63 N 1.32 0.73 -0.28 0.00 3.57 -0.85 0.16 116.94 121.59 1rya h PHE 63 Ca 0.34 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.79 1rya h PHE 63 Cb -0.06 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 1rya h PHE 63 CO 0.01 0.55 0.06 0.93 -2.23 0.00 0.00 178.31 177.62 1rya h GLU 64 N 0.69 0.45 -0.37 1.11 5.08 -1.28 -0.78 114.58 119.48 1rya h GLU 64 Ca 0.18 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1rya h GLU 64 Cb 0.08 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1rya h GLU 64 CO -0.03 0.55 0.14 -0.09 -1.00 0.00 0.00 179.01 178.59 1rya h ARG 65 N 0.28 0.56 -0.14 2.33 2.43 -0.98 -2.35 114.38 116.51 1rya h ARG 65 Ca 0.09 -0.11 -0.21 0.00 -0.81 0.00 0.00 59.98 58.94 1rya h ARG 65 Cb 0.31 -0.09 0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1rya h ARG 65 CO 0.00 0.55 -0.76 -0.07 -1.51 0.00 0.00 179.97 178.18 1rya h LEU 66 N 0.45 0.83 -0.60 3.80 3.38 -0.67 -0.08 115.31 122.43 1rya h LEU 66 Ca 0.12 -0.54 -0.05 0.00 0.09 0.00 0.00 57.88 57.50 1rya h LEU 66 Cb 0.20 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1rya h LEU 66 CO -0.01 1.32 0.18 0.71 0.09 0.00 0.00 178.44 180.73 1rya h THR 67 N 0.48 1.25 -0.37 0.22 1.35 -1.15 0.11 112.91 114.79 1rya h THR 67 Ca -0.04 -0.85 -0.02 0.00 -0.55 0.00 0.00 66.41 64.95 1rya h THR 67 Cb 1.37 0.66 -0.02 0.00 -1.73 0.00 0.00 68.15 68.44 1rya h THR 67 CO 0.15 0.32 0.16 -0.03 -0.25 0.00 0.00 175.52 175.87 1rya h MET 68 N 0.85 0.55 -0.28 4.72 1.85 -1.29 0.10 114.93 121.43 1rya h MET 68 Ca 0.19 -0.09 -0.16 0.00 -0.61 0.00 0.00 59.70 59.03 1rya h MET 68 Cb 0.31 -0.09 -0.01 0.00 0.43 0.00 0.00 31.60 32.24 1rya h MET 68 CO -0.00 0.52 -0.47 0.00 -0.40 0.00 0.00 176.91 176.55 1rya h ALA 69 N 1.01 0.66 0.06 0.39 0.00 -0.82 -1.10 119.26 119.45 1rya h ALA 69 Ca 0.13 -0.48 -0.31 0.00 0.00 0.00 0.00 54.91 54.25 1rya h ALA 69 Cb 0.16 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1rya h ALA 69 CO -0.01 0.67 -1.67 0.93 0.00 0.00 0.00 179.25 179.17 1rya h GLU 70 N 0.58 0.14 0.00 0.00 4.39 -0.76 -3.41 114.58 115.52 1rya h GLU 70 Ca 0.03 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.50 1rya h GLU 70 Cb 1.03 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.77 1rya h GLU 70 CO 0.10 0.88 -0.51 1.28 -1.16 0.00 0.00 179.01 179.61 1rya n LEU 71 N -3.29 0.18 0.00 1.33 4.77 0.01 -4.41 117.00 115.59 1rya n LEU 71 Ca -0.19 -0.37 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 1rya n LEU 71 Cb 1.04 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.13 1rya n LEU 71 CO 0.46 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1rya n GLY 72 N 1.40 0.57 2.76 -0.72 0.00 -0.42 -1.50 105.19 107.29 1rya n GLY 72 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1rya n GLY 72 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rya s LEU 73 N 0.00 0.55 -0.19 0.99 2.96 -1.23 -4.26 118.68 117.50 1rya s LEU 73 Ca 0.00 -0.06 -0.29 0.00 -0.22 0.00 0.00 54.13 53.56 1rya s LEU 73 Cb 0.00 -0.39 -0.00 0.00 0.50 0.00 0.00 46.19 46.30 1rya s LEU 73 CO 0.00 -0.20 1.16 -0.60 -1.32 0.00 0.00 176.35 175.39 1rya s ARG 74 N 1.95 4.25 0.08 1.98 3.52 -1.26 -2.91 118.95 126.56 1rya s ARG 74 Ca 0.04 1.52 0.09 0.00 -0.13 0.00 0.00 55.73 57.26 1rya s ARG 74 Cb -0.12 -3.70 -0.03 0.00 -1.56 0.00 0.00 34.95 29.53 1rya s ARG 74 CO -0.05 -0.67 -0.25 -0.51 -0.81 0.00 0.00 175.30 173.02 1rya s LEU 75 N 3.34 2.24 0.55 -0.88 1.43 -1.26 -4.95 118.68 119.14 1rya s LEU 75 Ca 0.50 -0.65 -0.12 0.00 -1.03 0.00 0.00 54.13 52.84 1rya s LEU 75 Cb -0.19 -1.15 -0.05 0.00 0.03 0.00 0.00 46.19 44.84 1rya s LEU 75 CO 0.11 0.18 0.95 -2.16 0.23 0.00 0.00 176.35 175.66 1rya s PRO 76 N -1.60 3.70 0.54 1.29 0.04 -1.26 -3.73 135.00 133.98 1rya s PRO 76 Ca 0.11 0.69 0.26 0.00 0.04 0.00 0.00 61.00 62.10 1rya s PRO 76 Cb -0.10 -2.17 1.54 0.00 0.04 0.00 0.00 34.50 33.81 1rya s PRO 76 CO 0.04 -0.38 2.14 0.97 0.04 0.00 0.00 177.00 179.81 1rya h ILE 77 N 0.24 0.63 0.00 0.56 2.10 -1.92 -0.07 117.51 119.06 1rya h ILE 77 Ca -0.46 -0.30 0.00 0.00 1.08 0.00 0.00 64.86 65.18 1rya h ILE 77 Cb 1.19 1.19 0.00 0.00 -1.09 0.00 0.00 36.82 38.11 1rya h ILE 77 CO 0.62 0.07 0.00 0.71 -1.08 0.00 0.00 178.15 178.47 1rya h THR 78 N 0.00 0.00 0.00 2.19 1.35 -1.98 -0.91 112.91 113.56 1rya h THR 78 Ca -0.00 -0.10 -0.01 0.00 -0.55 0.00 0.00 66.41 65.75 1rya h THR 78 Cb 0.18 1.03 -0.00 0.00 -1.73 0.00 0.00 68.15 67.63 1rya h THR 78 CO 0.01 0.00 -0.06 0.00 -0.25 0.00 0.00 175.52 175.22 1rya h ALA 79 N 2.01 0.99 -2.72 6.62 0.00 -1.38 -3.45 119.26 121.33 1rya h ALA 79 Ca 0.00 -0.06 -0.62 0.00 0.00 0.00 0.00 54.91 54.24 1rya h ALA 79 Cb 0.10 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1rya h ALA 79 CO 0.00 0.08 -0.36 0.20 0.00 0.00 0.00 179.25 179.16 1rya s GLY 80 N -4.22 2.26 -0.36 0.00 0.00 -0.35 -4.71 107.32 99.95 1rya s GLY 80 Ca 0.03 -0.55 -0.14 0.00 0.00 0.00 0.00 44.72 44.06 1rya s GLY 80 CO 0.61 -0.37 0.30 1.62 0.00 0.00 0.00 173.10 175.26 1rya s GLN 81 N -1.84 3.42 0.24 2.90 0.74 0.20 -4.89 119.66 120.42 1rya s GLN 81 Ca 0.29 -0.62 -0.31 0.00 0.05 0.00 0.00 55.36 54.76 1rya s GLN 81 Cb -0.13 -3.84 -0.13 0.00 1.10 0.00 0.00 33.01 30.01 1rya s GLN 81 CO 0.17 -0.54 1.45 0.34 -0.55 0.00 0.00 175.29 176.16 1rya n PHE 82 N 5.24 2.27 -2.68 1.67 7.35 -1.26 -0.97 117.46 129.08 1rya n PHE 82 Ca -0.11 0.39 -0.06 0.00 -0.76 0.00 0.00 57.45 56.91 1rya n PHE 82 Cb 0.49 -2.49 0.04 0.00 0.35 0.00 0.00 39.48 37.87 1rya n PHE 82 CO 0.00 0.00 0.00 0.98 -0.76 0.00 0.00 176.76 176.98 1rya n TYR 83 N 2.08 1.53 0.00 -5.13 9.36 0.73 -4.87 117.16 120.86 1rya n TYR 83 Ca 0.12 -2.35 0.00 0.00 3.32 0.00 0.00 57.90 58.99 1rya n TYR 83 Cb 0.32 -0.27 0.00 0.00 -0.63 0.00 0.00 39.34 38.76 1rya n TYR 83 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1rya n GLY 84 N -0.48 0.79 3.36 2.98 0.00 -1.26 -4.33 105.19 106.25 1rya n GLY 84 Ca 0.14 -1.85 -0.36 0.00 0.00 0.00 0.00 46.02 43.94 1rya n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rya s VAL 85 N -2.38 3.87 0.39 1.61 1.01 -0.34 -1.59 120.40 122.97 1rya s VAL 85 Ca 0.00 -0.47 0.08 0.00 0.00 0.00 0.00 61.98 61.58 1rya s VAL 85 Cb 0.00 -2.87 -0.06 0.00 0.00 0.00 0.00 36.38 33.45 1rya s VAL 85 CO 0.00 0.27 0.09 0.26 0.00 0.00 0.00 175.10 175.72 1rya s TRP 86 N 1.53 2.57 -0.07 5.22 0.52 0.37 -4.05 118.94 125.02 1rya s TRP 86 Ca 0.05 -0.55 -0.02 0.00 0.02 0.00 0.00 56.10 55.60 1rya s TRP 86 Cb -0.16 -1.76 0.03 0.00 -1.15 0.00 0.00 33.47 30.43 1rya s TRP 86 CO 0.01 0.34 0.03 -0.65 0.02 0.00 0.00 176.95 176.70 1rya s GLN 87 N -3.80 0.35 -0.14 4.98 -0.21 -1.26 -0.74 119.66 118.84 1rya s GLN 87 Ca 0.38 0.17 0.03 0.00 0.02 0.00 0.00 55.36 55.95 1rya s GLN 87 Cb 0.04 -0.90 0.01 0.00 1.00 0.00 0.00 33.01 33.15 1rya s GLN 87 CO 0.21 -0.34 -0.22 -1.01 -2.12 0.00 0.00 175.29 171.80 1rya s HIS 88 N 2.04 2.66 -0.14 0.91 3.76 -0.40 -5.00 115.29 119.12 1rya s HIS 88 Ca 0.05 -1.30 0.02 0.00 -0.15 0.00 0.00 55.06 53.67 1rya s HIS 88 Cb -0.13 -1.81 0.01 0.00 1.11 0.00 0.00 32.58 31.77 1rya s HIS 88 CO -0.05 -0.59 -0.21 -0.06 -0.85 0.00 0.00 174.74 172.99 1rya s PHE 89 N 0.76 2.58 0.09 1.40 0.40 -1.26 -0.89 117.98 121.06 1rya s PHE 89 Ca -0.08 -1.33 0.09 0.00 -0.60 0.00 0.00 56.93 55.01 1rya s PHE 89 Cb -0.16 -1.77 -0.03 0.00 0.51 0.00 0.00 43.02 41.57 1rya s PHE 89 CO -0.01 -0.62 -0.24 0.71 0.70 0.00 0.00 175.22 175.76 1rya s TYR 90 N 0.91 2.08 -1.13 0.36 1.51 -0.17 -5.01 117.35 115.90 1rya s TYR 90 Ca -0.05 -0.40 0.28 0.00 -1.01 0.00 0.00 57.07 55.90 1rya s TYR 90 Cb -0.15 -1.17 1.13 0.00 -0.11 0.00 0.00 41.96 41.66 1rya s TYR 90 CO -0.03 0.22 1.84 -0.25 -1.11 0.00 0.00 175.55 176.21 1rya n ASP 91 N 1.30 0.15 -2.37 2.29 8.00 -1.26 -1.56 116.55 123.11 1rya n ASP 91 Ca -0.18 0.15 -0.07 0.00 0.71 0.00 0.00 54.79 55.39 1rya n ASP 91 Cb 0.53 -0.28 -0.02 0.00 -0.02 0.00 0.00 41.12 41.34 1rya n ASP 91 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1rya n ASP 92 N -1.41 1.69 -4.05 -2.24 5.75 -1.25 -4.10 116.55 110.94 1rya n ASP 92 Ca 0.09 -1.54 -0.10 0.00 -0.01 0.00 0.00 54.79 53.22 1rya n ASP 92 Cb 0.32 0.17 -0.07 0.00 -1.03 0.00 0.00 41.12 40.51 1rya n ASP 92 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1rya s ASN 93 N -1.65 -0.01 0.58 -1.12 4.22 -0.44 -2.55 114.94 113.96 1rya s ASN 93 Ca 0.03 -1.06 0.30 0.00 -2.14 0.00 0.00 52.86 49.99 1rya s ASN 93 Cb 0.00 0.52 1.37 0.00 1.28 0.00 0.00 41.25 44.42 1rya s ASN 93 CO 0.02 -1.04 1.74 2.19 -2.04 0.00 0.00 177.10 177.97 1rya h PHE 94 N 2.38 0.00 0.00 1.54 -5.15 -1.94 -2.49 116.94 111.27 1rya h PHE 94 Ca -0.29 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.48 1rya h PHE 94 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.42 1rya h PHE 94 CO 0.38 0.00 -0.11 -1.13 -2.00 0.00 0.00 178.31 175.45 1rya n SER 95 N -3.69 1.23 0.00 -0.68 3.41 -1.26 -4.60 113.62 108.03 1rya n SER 95 Ca 0.16 -2.11 0.00 0.00 -0.26 0.00 0.00 58.87 56.66 1rya n SER 95 Cb 1.00 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.79 1rya n SER 95 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rya n GLY 96 N -0.56 -1.21 0.05 5.00 0.00 -0.94 -5.00 105.19 102.53 1rya n GLY 96 Ca 0.05 -1.03 0.06 0.00 0.00 0.00 0.00 46.02 45.09 1rya n GLY 96 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rya n THR 97 N 5.34 1.48 1.05 2.61 -2.24 -1.26 -1.33 114.28 119.93 1rya n THR 97 Ca 0.00 -1.70 0.11 0.00 -2.27 0.00 0.00 64.05 60.19 1rya n THR 97 Cb 0.00 0.08 0.09 0.00 -2.10 0.00 0.00 70.33 68.40 1rya n THR 97 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1rya n ASP 98 N -1.02 1.21 -3.48 3.42 5.75 -1.26 -4.81 116.55 116.37 1rya n ASP 98 Ca 0.09 -0.98 -0.12 0.00 -0.01 0.00 0.00 54.79 53.77 1rya n ASP 98 Cb 0.48 0.52 -0.02 0.00 -1.03 0.00 0.00 41.12 41.07 1rya n ASP 98 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1rya s PHE 99 N -2.74 -0.47 0.63 2.11 -0.12 -1.26 -5.12 117.98 111.00 1rya s PHE 99 Ca 0.15 0.23 -0.08 0.00 -0.05 0.00 0.00 56.93 57.18 1rya s PHE 99 Cb 0.18 0.53 0.00 0.00 -0.63 0.00 0.00 43.02 43.10 1rya s PHE 99 CO 0.68 -0.85 0.97 0.95 -0.05 0.00 0.00 175.22 176.91 1rya s THR 100 N -3.77 3.76 -0.03 -4.49 -4.23 -1.26 -3.44 115.64 102.19 1rya s THR 100 Ca 0.02 0.25 0.07 0.00 -1.18 0.00 0.00 61.69 60.85 1rya s THR 100 Cb -0.01 -3.52 -0.02 0.00 1.34 0.00 0.00 72.50 70.29 1rya s THR 100 CO -0.12 -0.60 -0.25 -0.89 -0.54 0.00 0.00 174.62 172.23 1rya s THR 101 N -3.12 1.96 -0.10 3.99 2.01 -0.60 -4.53 115.64 115.26 1rya s THR 101 Ca 0.55 -1.05 0.01 0.00 0.31 0.00 0.00 61.69 61.52 1rya s THR 101 Cb -0.11 -1.64 0.02 0.00 0.01 0.00 0.00 72.50 70.78 1rya s THR 101 CO 0.48 0.55 -0.13 -2.28 -0.69 0.00 0.00 174.62 172.56 1rya s HIS 102 N -0.42 1.72 -0.04 4.92 5.04 -1.26 -0.99 115.29 124.26 1rya s HIS 102 Ca 0.05 -0.77 0.06 0.00 -1.54 0.00 0.00 55.06 52.85 1rya s HIS 102 Cb -0.11 -1.28 -0.02 0.00 0.04 0.00 0.00 32.58 31.21 1rya s HIS 102 CO 0.01 -0.42 -0.21 0.71 -2.34 0.00 0.00 174.74 172.49 1rya s TYR 103 N 1.02 2.50 -0.25 3.88 1.51 -0.07 -0.41 117.35 125.54 1rya s TYR 103 Ca -0.07 -0.38 -0.09 0.00 -1.01 0.00 0.00 57.07 55.52 1rya s TYR 103 Cb -0.15 -1.58 -0.04 0.00 -0.11 0.00 0.00 41.96 40.09 1rya s TYR 103 CO -0.01 0.01 0.12 0.08 -1.11 0.00 0.00 175.55 174.64 1rya s VAL 104 N -0.55 4.87 -0.11 0.71 1.01 0.16 -1.28 120.40 125.22 1rya s VAL 104 Ca 0.08 0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.10 1rya s VAL 104 Cb -0.11 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 32.99 1rya s VAL 104 CO 0.00 0.33 -0.22 -0.69 0.00 0.00 0.00 175.10 174.53 1rya s VAL 105 N 1.39 2.27 -0.32 2.92 1.01 0.08 -1.25 120.40 126.50 1rya s VAL 105 Ca 0.06 -0.95 -0.14 0.00 0.00 0.00 0.00 61.98 60.96 1rya s VAL 105 Cb -0.15 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 1rya s VAL 105 CO 0.06 0.55 0.30 -0.76 0.00 0.00 0.00 175.10 175.25 1rya s LEU 106 N 0.33 4.36 0.21 3.92 1.43 0.27 -0.48 118.68 128.72 1rya s LEU 106 Ca -0.17 -0.21 -0.20 0.00 -1.03 0.00 0.00 54.13 52.52 1rya s LEU 106 Cb -0.17 -2.25 -0.08 0.00 0.03 0.00 0.00 46.19 43.72 1rya s LEU 106 CO 0.08 -0.24 0.72 -0.83 0.23 0.00 0.00 176.35 176.31 1rya s GLY 107 N 1.73 2.64 -0.02 -3.19 0.00 -0.62 -1.66 107.32 106.20 1rya s GLY 107 Ca 0.09 0.17 0.01 0.00 0.00 0.00 0.00 44.72 44.99 1rya s GLY 107 CO 0.11 0.54 -0.03 -1.36 0.00 0.00 0.00 173.10 172.36 1rya s PHE 108 N -1.47 0.44 -0.06 1.90 0.40 -0.22 -0.19 117.98 118.78 1rya s PHE 108 Ca 0.42 -0.07 -0.00 0.00 -0.60 0.00 0.00 56.93 56.67 1rya s PHE 108 Cb -0.17 -0.40 -0.03 0.00 0.51 0.00 0.00 43.02 42.93 1rya s PHE 108 CO 0.21 -0.09 -0.03 1.03 0.70 0.00 0.00 175.22 177.05 1rya s ARG 109 N 0.53 2.85 0.11 0.44 0.52 -0.14 -0.82 118.95 122.43 1rya s ARG 109 Ca -0.06 -0.50 -0.25 0.00 -0.52 0.00 0.00 55.73 54.40 1rya s ARG 109 Cb -0.09 -2.69 0.08 0.00 0.52 0.00 0.00 34.95 32.77 1rya s ARG 109 CO -0.01 0.67 0.67 -0.59 0.02 0.00 0.00 175.30 176.07 1rya s PHE 110 N -0.89 -0.50 -0.09 -0.53 -0.12 -0.88 -0.63 117.98 114.34 1rya s PHE 110 Ca 0.14 0.36 -0.00 0.00 -0.05 0.00 0.00 56.93 57.37 1rya s PHE 110 Cb -0.11 0.55 -0.03 0.00 -0.63 0.00 0.00 43.02 42.79 1rya s PHE 110 CO 0.03 -0.77 -0.05 0.50 -0.05 0.00 0.00 175.22 174.89 1rya s ARG 111 N -3.44 2.97 0.23 1.99 3.52 -1.26 -1.08 118.95 121.88 1rya s ARG 111 Ca 0.01 -0.52 0.02 0.00 -0.13 0.00 0.00 55.73 55.11 1rya s ARG 111 Cb -0.01 -2.68 -0.05 0.00 -1.56 0.00 0.00 34.95 30.65 1rya s ARG 111 CO -0.11 0.58 0.04 0.14 -0.81 0.00 0.00 175.30 175.14 1rya s VAL 112 N -0.58 0.76 -0.04 7.11 -7.23 -0.11 -4.93 120.40 115.39 1rya s VAL 112 Ca 0.09 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.05 1rya s VAL 112 Cb -0.12 -2.40 -0.05 0.00 0.56 0.00 0.00 36.38 34.38 1rya s VAL 112 CO 0.02 -0.24 0.57 -0.55 -0.31 0.00 0.00 175.10 174.59 1rya s SER 113 N -3.27 6.89 0.34 4.85 0.15 -1.26 -4.11 113.70 117.29 1rya s SER 113 Ca 0.31 1.07 0.07 0.00 0.70 0.00 0.00 55.95 58.10 1rya s SER 113 Cb 0.07 -2.35 0.76 0.00 -1.71 0.00 0.00 66.02 62.79 1rya s SER 113 CO 0.09 0.06 1.88 -0.33 1.20 0.00 0.00 173.24 176.14 1rya h GLU 114 N 6.02 0.73 0.00 5.44 5.08 -1.95 -2.06 114.58 127.83 1rya h GLU 114 Ca -0.44 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1rya h GLU 114 Cb 1.20 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1rya h GLU 114 CO 0.71 0.49 0.00 0.93 -1.00 0.00 0.00 179.01 180.14 1rya h GLU 115 N 0.76 0.00 0.00 2.33 4.39 -2.05 -2.62 114.58 117.39 1rya h GLU 115 Ca 0.43 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.13 1rya h GLU 115 Cb 0.61 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1rya h GLU 115 CO -0.20 0.00 -0.72 0.39 -1.16 0.00 0.00 179.01 177.33 1rya n GLU 116 N -2.32 0.16 -3.01 2.33 1.02 -0.78 -4.88 120.64 113.17 1rya n GLU 116 Ca 0.02 0.02 -0.31 0.00 -0.02 0.00 0.00 57.16 56.87 1rya n GLU 116 Cb 0.24 -1.58 -0.05 0.00 -0.02 0.00 0.00 31.44 30.04 1rya n GLU 116 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1rya s LEU 117 N -3.61 3.95 -0.55 -4.62 1.43 -0.99 -4.69 118.68 109.60 1rya s LEU 117 Ca 0.07 1.18 0.04 0.00 -1.03 0.00 0.00 54.13 54.40 1rya s LEU 117 Cb 0.15 -4.02 0.16 0.00 0.03 0.00 0.00 46.19 42.52 1rya s LEU 117 CO 0.74 -0.30 0.39 -0.76 0.23 0.00 0.00 176.35 176.66 1rya s LEU 118 N -3.42 3.15 -0.06 1.79 1.43 -0.56 -5.01 118.68 116.01 1rya s LEU 118 Ca 0.52 -3.35 -0.30 0.00 -1.03 0.00 0.00 54.13 49.97 1rya s LEU 118 Cb -0.10 -1.07 -0.05 0.00 0.03 0.00 0.00 46.19 44.99 1rya s LEU 118 CO 0.25 -0.15 1.58 -0.76 0.23 0.00 0.00 176.35 177.50 1rya s LEU 119 N -0.58 4.31 0.61 1.79 1.43 -1.25 -3.55 118.68 121.44 1rya s LEU 119 Ca 0.27 2.17 -0.09 0.00 -1.03 0.00 0.00 54.13 55.45 1rya s LEU 119 Cb -0.04 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.62 1rya s LEU 119 CO -0.15 -0.89 0.98 -2.16 0.23 0.00 0.00 176.35 174.36 1rya s PRO 120 N 3.75 3.32 -0.04 1.29 0.04 -1.26 -5.01 135.00 137.09 1rya s PRO 120 Ca 0.70 0.46 0.14 0.00 0.04 0.00 0.00 61.00 62.34 1rya s PRO 120 Cb -0.32 -2.16 0.43 0.00 0.04 0.00 0.00 34.50 32.50 1rya s PRO 120 CO 0.28 -0.62 1.36 -0.40 0.04 0.00 0.00 177.00 177.66 1rya n ASP 121 N -2.68 3.42 -0.01 6.66 3.85 -1.26 -4.49 116.55 122.03 1rya n ASP 121 Ca 0.05 -2.19 -0.13 0.00 -0.71 0.00 0.00 54.79 51.81 1rya n ASP 121 Cb 0.55 -0.35 -0.10 0.00 -1.35 0.00 0.00 41.12 39.88 1rya n ASP 121 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1rya h GLU 122 N 2.56 0.01 0.00 0.11 3.07 -1.95 -3.36 114.58 115.03 1rya h GLU 122 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1rya h GLU 122 Cb 0.95 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.86 1rya h GLU 122 CO 0.06 0.49 -1.27 1.04 -1.40 0.00 0.00 179.01 177.92 1rya n GLN 123 N -4.85 0.20 -3.84 2.33 6.02 -1.26 -4.81 117.38 111.17 1rya n GLN 123 Ca -0.08 -0.06 -0.12 0.00 -0.01 0.00 0.00 57.00 56.73 1rya n GLN 123 Cb 0.25 -1.51 -0.13 0.00 1.02 0.00 0.00 30.24 29.86 1rya n GLN 123 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1rya s HIS 124 N -3.16 -0.09 -2.15 1.08 3.76 -1.26 -1.23 115.29 112.25 1rya s HIS 124 Ca 0.03 0.23 0.20 0.00 -0.15 0.00 0.00 55.06 55.37 1rya s HIS 124 Cb 0.15 0.02 0.33 0.00 1.11 0.00 0.00 32.58 34.19 1rya s HIS 124 CO 0.87 -0.05 1.27 -0.40 -0.85 0.00 0.00 174.74 175.59 1rya n ASP 125 N 3.13 3.09 -3.50 1.40 5.68 -0.70 -4.40 116.55 121.25 1rya n ASP 125 Ca -0.13 -1.90 -0.11 0.00 -0.50 0.00 0.00 54.79 52.15 1rya n ASP 125 Cb 0.59 -0.18 -0.03 0.00 -1.14 0.00 0.00 41.12 40.36 1rya n ASP 125 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1rya s ASP 126 N -1.38 -0.44 0.01 -1.12 2.15 -1.26 -4.99 116.67 109.63 1rya s ASP 126 Ca 0.31 0.14 0.00 0.00 0.43 0.00 0.00 52.55 53.44 1rya s ASP 126 Cb 0.19 0.44 -0.01 0.00 -0.30 0.00 0.00 42.92 43.24 1rya s ASP 126 CO 0.26 -0.66 -0.03 -0.31 -0.17 0.00 0.00 175.17 174.27 1rya s TYR 127 N -2.75 0.22 0.04 -5.34 1.51 -1.26 -1.18 117.35 108.59 1rya s TYR 127 Ca 0.01 -0.26 -0.02 0.00 -1.01 0.00 0.00 57.07 55.79 1rya s TYR 127 Cb -0.01 -0.15 -0.03 0.00 -0.11 0.00 0.00 41.96 41.67 1rya s TYR 127 CO -0.06 -0.08 0.01 1.03 -1.11 0.00 0.00 175.55 175.34 1rya s ARG 128 N -0.72 0.53 -0.30 -0.62 0.52 -0.24 -5.01 118.95 113.12 1rya s ARG 128 Ca -0.07 -0.93 -0.05 0.00 -0.52 0.00 0.00 55.73 54.16 1rya s ARG 128 Cb -0.05 0.19 0.02 0.00 0.52 0.00 0.00 34.95 35.64 1rya s ARG 128 CO -0.00 -0.11 0.06 -1.58 0.02 0.00 0.00 175.30 173.68 1rya s TRP 129 N -2.94 3.17 0.05 -0.53 0.52 -1.26 -0.94 118.94 117.02 1rya s TRP 129 Ca -0.02 -1.27 0.07 0.00 0.02 0.00 0.00 56.10 54.90 1rya s TRP 129 Cb 0.01 -2.22 -0.03 0.00 -1.15 0.00 0.00 33.47 30.08 1rya s TRP 129 CO -0.06 -0.66 -0.15 -0.51 0.02 0.00 0.00 176.95 175.59 1rya s LEU 130 N 1.42 2.78 0.72 2.99 1.43 -0.05 -4.69 118.68 123.29 1rya s LEU 130 Ca 0.00 -0.39 -0.12 0.00 -1.03 0.00 0.00 54.13 52.59 1rya s LEU 130 Cb -0.18 -1.62 0.03 0.00 0.03 0.00 0.00 46.19 44.45 1rya s LEU 130 CO 0.01 0.24 1.10 0.42 0.23 0.00 0.00 176.35 178.35 1rya s THR 131 N -1.00 3.33 0.20 5.49 -4.23 -1.26 -0.50 115.64 117.67 1rya s THR 131 Ca 0.16 0.51 -0.11 0.00 -1.18 0.00 0.00 61.69 61.07 1rya s THR 131 Cb -0.11 -3.02 0.13 0.00 1.34 0.00 0.00 72.50 70.84 1rya s THR 131 CO 0.07 -0.49 1.72 -1.28 -0.54 0.00 0.00 174.62 174.11 1rya h SER 132 N -0.61 0.08 -0.42 3.99 0.87 -1.98 -0.74 113.55 114.74 1rya h SER 132 Ca -0.45 0.09 0.02 0.00 -1.23 0.00 0.00 61.79 60.21 1rya h SER 132 Cb 1.24 0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 63.27 1rya h SER 132 CO 0.53 0.06 0.25 0.44 -0.53 0.00 0.00 176.83 177.58 1rya h ASP 133 N 0.30 0.41 -0.26 6.23 3.45 -1.98 -1.13 116.42 123.43 1rya h ASP 133 Ca 0.28 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.70 1rya h ASP 133 Cb 0.37 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 39.04 1rya h ASP 133 CO -0.33 0.29 0.02 0.00 -1.57 0.00 0.00 179.24 177.65 1rya h ALA 134 N 1.18 0.35 -0.20 3.45 0.00 -1.85 -2.16 119.26 120.03 1rya h ALA 134 Ca 0.16 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1rya h ALA 134 Cb -0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1rya h ALA 134 CO -0.07 0.07 -0.27 1.37 0.00 0.00 0.00 179.25 180.35 1rya h LEU 135 N 0.25 0.38 -1.03 0.00 8.10 -1.02 -2.58 115.31 119.40 1rya h LEU 135 Ca 0.08 -0.13 -0.10 0.00 0.11 0.00 0.00 57.88 57.84 1rya h LEU 135 Cb 0.39 -0.10 -0.01 0.00 -0.44 0.00 0.00 40.66 40.49 1rya h LEU 135 CO 0.01 0.65 -0.46 -0.07 -4.11 0.00 0.00 178.44 174.46 1rya h LEU 136 N 0.34 0.00 0.00 0.17 3.38 -1.11 -2.99 115.31 115.10 1rya h LEU 136 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1rya h LEU 136 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1rya h LEU 136 CO 0.05 0.46 -0.15 0.00 0.09 0.00 0.00 178.44 178.89 1rya n ALA 137 N -2.41 2.46 -2.61 1.53 0.00 -0.82 -4.81 120.51 113.85 1rya n ALA 137 Ca -0.01 -0.09 -0.39 0.00 0.00 0.00 0.00 53.44 52.95 1rya n ALA 137 Cb 0.50 -1.40 -0.11 0.00 0.00 0.00 0.00 19.45 18.45 1rya n ALA 137 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1rya s SER 138 N -4.24 5.97 0.00 0.00 0.15 -1.07 -4.95 113.70 109.55 1rya s SER 138 Ca 0.10 -0.21 0.24 0.00 0.70 0.00 0.00 55.95 56.79 1rya s SER 138 Cb 0.13 -2.11 1.37 0.00 -1.71 0.00 0.00 66.02 63.71 1rya s SER 138 CO 0.62 -0.13 1.82 0.47 1.20 0.00 0.00 173.24 177.22 1rya n ASP 139 N 5.07 0.00 -0.00 5.45 10.43 -1.26 -1.90 116.55 134.33 1rya n ASP 139 Ca -0.14 -0.48 0.13 0.00 2.57 0.00 0.00 54.79 56.87 1rya n ASP 139 Cb 0.51 -0.12 0.45 0.00 1.84 0.00 0.00 41.12 43.80 1rya n ASP 139 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1rya n ASN 140 N -1.12 0.23 -4.65 -2.24 3.02 -1.26 -4.66 115.26 104.58 1rya n ASN 140 Ca 0.16 0.16 -0.41 0.00 -0.03 0.00 0.00 54.58 54.46 1rya n ASN 140 Cb 0.13 -0.16 -0.05 0.00 -0.61 0.00 0.00 39.78 39.09 1rya n ASN 140 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1rya s VAL 141 N -3.00 4.93 0.50 2.41 1.01 -0.80 -0.94 120.40 124.51 1rya s VAL 141 Ca 0.13 1.37 -0.23 0.00 0.00 0.00 0.00 61.98 63.25 1rya s VAL 141 Cb 0.18 -4.03 -0.07 0.00 0.00 0.00 0.00 36.38 32.46 1rya s VAL 141 CO 0.61 0.02 1.31 1.57 0.00 0.00 0.00 175.10 178.60 1rya n HIS 142 N 5.54 2.17 -0.31 5.22 -0.00 -0.70 -4.72 115.22 122.42 1rya n HIS 142 Ca 0.02 0.45 0.19 0.00 0.46 0.00 0.00 57.72 58.84 1rya n HIS 142 Cb 0.49 -2.36 0.45 0.00 -0.12 0.00 0.00 29.99 28.44 1rya n HIS 142 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1rya h ALA 143 N 1.68 2.04 0.00 1.57 0.00 -1.92 -0.22 119.26 122.41 1rya h ALA 143 Ca -0.50 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 1rya h ALA 143 Cb 1.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1rya h ALA 143 CO 0.58 -0.40 -0.17 -0.91 0.00 0.00 0.00 179.25 178.35 1rya h ASN 144 N 0.52 0.00 0.19 0.00 2.35 -1.98 -1.13 115.58 115.54 1rya h ASN 144 Ca 0.56 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.99 1rya h ASN 144 Cb 1.22 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.60 1rya h ASN 144 CO -0.29 0.17 -1.50 0.28 -1.65 0.00 0.00 177.43 174.44 1rya h SER 145 N 0.00 0.64 -0.68 5.81 0.02 -1.43 -3.35 113.55 114.56 1rya h SER 145 Ca -0.00 -0.92 0.11 0.00 -0.84 0.00 0.00 61.79 60.13 1rya h SER 145 Cb 0.70 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 1rya h SER 145 CO 0.02 1.69 0.45 0.03 -1.14 0.00 0.00 176.83 177.89 1rya h ARG 146 N -0.00 0.48 -0.49 3.45 3.08 -1.03 -2.88 114.38 116.97 1rya h ARG 146 Ca -0.29 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 59.79 1rya h ARG 146 Cb 2.02 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 31.93 1rya h ARG 146 CO 0.19 0.31 0.33 0.00 -1.07 0.00 0.00 179.97 179.74 1rya h ALA 147 N 1.66 1.92 0.00 0.04 0.00 -1.34 -0.16 119.26 121.38 1rya h ALA 147 Ca 0.32 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 1rya h ALA 147 Cb 0.58 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1rya h ALA 147 CO -0.10 -0.00 -0.00 1.88 0.00 0.00 0.00 179.25 181.03 1rya h TYR 148 N 0.43 0.00 -0.21 0.00 0.99 -1.70 -2.72 116.97 113.76 1rya h TYR 148 Ca 0.21 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.94 1rya h TYR 148 Cb 0.31 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.04 1rya h TYR 148 CO -0.00 0.00 0.00 1.19 -0.00 0.00 0.00 178.16 179.35 1rya n PHE 149 N -3.09 0.28 -3.80 4.88 3.01 -0.08 -4.94 117.46 113.72 1rya n PHE 149 Ca -0.03 -0.28 -0.36 0.00 1.01 0.00 0.00 57.45 57.79 1rya n PHE 149 Cb 0.10 -0.01 -0.13 0.00 -0.01 0.00 0.00 39.48 39.43 1rya n PHE 149 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1rya s LEU 150 N -0.99 3.48 0.33 4.37 1.43 -1.03 -5.00 118.68 121.27 1rya s LEU 150 Ca 0.20 -0.48 0.07 0.00 -1.03 0.00 0.00 54.13 52.88 1rya s LEU 150 Cb 0.11 -1.86 0.76 0.00 0.03 0.00 0.00 46.19 45.24 1rya s LEU 150 CO 0.16 -0.10 1.82 0.00 0.23 0.00 0.00 176.35 178.46 1rya h ALA 151 N 8.20 1.75 -0.11 4.21 0.00 -1.92 -1.76 119.26 129.63 1rya h ALA 151 Ca -0.36 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 1rya h ALA 151 Cb 1.15 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1rya h ALA 151 CO 0.59 -0.05 -0.31 1.49 0.00 0.00 0.00 179.25 180.97 1rya h GLU 152 N 0.76 0.20 0.00 0.00 4.81 -1.94 -2.41 114.58 116.00 1rya h GLU 152 Ca 0.52 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.63 1rya h GLU 152 Cb 0.81 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 1rya h GLU 152 CO -0.29 0.50 -0.24 0.87 -0.73 0.00 0.00 179.01 179.12 1rya h LYS 153 N 0.18 0.00 0.00 1.92 1.79 -1.61 -3.27 116.57 115.58 1rya h LYS 153 Ca 0.03 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.44 1rya h LYS 153 Cb 0.64 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.28 1rya h LYS 153 CO 0.05 0.24 -0.26 0.00 -1.08 0.00 0.00 179.45 178.40 1rya h ARG 154 N 0.00 0.00 -6.62 3.15 3.08 -1.04 -3.43 114.38 109.53 1rya h ARG 154 Ca -0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 1rya h ARG 154 Cb 1.06 0.00 0.05 0.00 0.08 0.00 0.00 29.97 31.16 1rya h ARG 154 CO 0.03 0.26 1.01 0.99 -1.07 0.00 0.00 179.97 181.19 1rya s THR 155 N -3.42 2.25 0.00 2.04 2.01 -1.19 -2.20 115.64 115.12 1rya s THR 155 Ca 0.02 0.11 0.00 0.00 0.31 0.00 0.00 61.69 62.13 1rya s THR 155 Cb 0.09 -3.07 0.00 0.00 0.01 0.00 0.00 72.50 69.53 1rya s THR 155 CO 0.66 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 175.21 1rya n GLY 156 N 3.99 0.50 3.66 4.40 0.00 -1.26 -5.00 105.19 111.48 1rya n GLY 156 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1rya n GLY 156 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rya s VAL 157 N -2.23 4.56 0.21 1.61 1.01 -0.94 -4.99 120.40 119.63 1rya s VAL 157 Ca 0.00 1.88 -0.32 0.00 0.00 0.00 0.00 61.98 63.54 1rya s VAL 157 Cb 0.00 -4.22 -0.12 0.00 0.00 0.00 0.00 36.38 32.04 1rya s VAL 157 CO 0.00 -0.17 1.67 -2.65 0.00 0.00 0.00 175.10 173.95 1rya n PRO 158 N 6.41 2.64 0.00 2.72 -0.02 -1.26 -2.23 135.00 143.27 1rya n PRO 158 Ca 0.13 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.56 1rya n PRO 158 Cb 0.46 -2.77 0.00 0.00 -0.02 0.00 0.00 33.50 31.17 1rya n PRO 158 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rya n GLY 159 N 3.55 1.84 0.66 -1.23 0.00 -1.26 -1.20 105.19 107.55 1rya n GLY 159 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 1rya n GLY 159 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36