#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yq2 s ASP 5 N 0.00 6.56 -0.23 0.00 -1.08 -1.26 -4.91 116.67 115.76 1yq2 s ASP 5 Ca 0.00 0.35 0.12 0.00 -0.52 0.00 0.00 52.55 52.50 1yq2 s ASP 5 Cb 0.00 -2.42 0.46 0.00 -1.46 0.00 0.00 42.92 39.51 1yq2 s ASP 5 CO 0.00 -0.80 1.36 1.33 0.52 0.00 0.00 175.17 177.58 1yq2 n VAL 6 N 5.91 2.33 0.28 1.11 0.24 -1.26 -4.64 118.33 122.31 1yq2 n VAL 6 Ca 0.04 -2.60 0.08 0.00 -2.04 0.00 0.00 64.34 59.82 1yq2 n VAL 6 Cb 0.48 -0.28 0.38 0.00 -1.47 0.00 0.00 33.84 32.95 1yq2 n VAL 6 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1yq2 n SER 7 N -1.05 0.35 0.30 -1.34 3.41 -1.26 -2.45 113.62 111.57 1yq2 n SER 7 Ca 0.25 0.62 0.15 0.00 -0.26 0.00 0.00 58.87 59.64 1yq2 n SER 7 Cb 0.88 -0.68 0.92 0.00 -0.26 0.00 0.00 64.21 65.07 1yq2 n SER 7 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 1yq2 h TYR 8 N 0.00 0.00 -0.23 7.33 -0.00 -1.97 -1.64 116.97 120.46 1yq2 h TYR 8 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.73 58.60 1yq2 h TYR 8 Cb 0.17 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.89 1yq2 h TYR 8 CO 0.00 0.00 -0.41 1.25 -0.00 0.00 0.00 178.16 179.00 1yq2 h LEU 9 N 0.00 0.56 -0.92 0.10 5.85 -1.88 -3.25 115.31 115.77 1yq2 h LEU 9 Ca 0.00 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1yq2 h LEU 9 Cb 0.02 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1yq2 h LEU 9 CO -0.00 0.91 -0.29 0.35 -0.34 0.00 0.00 178.44 179.07 1yq2 n THR 10 N -4.03 0.00 -1.68 1.05 -2.24 -0.98 -1.53 114.28 104.88 1yq2 n THR 10 Ca -0.02 -0.36 -0.44 0.00 -2.27 0.00 0.00 64.05 60.97 1yq2 n THR 10 Cb 0.51 1.19 -0.02 0.00 -2.10 0.00 0.00 70.33 69.92 1yq2 n THR 10 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1yq2 n ASP 11 N -0.06 2.76 -1.07 3.42 2.03 -0.66 -4.73 116.55 118.25 1yq2 n ASP 11 Ca 0.06 1.17 0.11 0.00 0.52 0.00 0.00 54.79 56.65 1yq2 n ASP 11 Cb 0.32 -1.45 0.27 0.00 -0.72 0.00 0.00 41.12 39.54 1yq2 n ASP 11 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1yq2 n GLN 12 N 1.41 2.36 -2.05 -0.67 6.02 -1.26 -4.74 117.38 118.45 1yq2 n GLN 12 Ca 0.09 -2.09 -0.29 0.00 -0.01 0.00 0.00 57.00 54.70 1yq2 n GLN 12 Cb 0.34 -1.48 0.17 0.00 1.02 0.00 0.00 30.24 30.28 1yq2 n GLN 12 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1yq2 s GLY 13 N -1.24 1.77 0.26 1.08 0.00 -1.26 -4.36 107.32 103.57 1yq2 s GLY 13 Ca 0.39 -1.28 0.25 0.00 0.00 0.00 0.00 44.72 44.08 1yq2 s GLY 13 CO 0.29 -0.56 1.74 -1.55 0.00 0.00 0.00 173.10 173.02 1yq2 n PRO 14 N -3.58 0.23 0.00 2.90 -0.04 -1.26 -4.75 135.00 128.50 1yq2 n PRO 14 Ca 0.15 0.38 0.00 0.00 -0.04 0.00 0.00 63.50 63.99 1yq2 n PRO 14 Cb 0.60 -1.88 0.00 0.00 -0.04 0.00 0.00 33.50 32.18 1yq2 n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yq2 n GLY 15 N 0.36 1.90 3.37 0.55 0.00 -1.26 -4.26 105.19 105.84 1yq2 n GLY 15 Ca 0.03 -2.02 -0.14 0.00 0.00 0.00 0.00 46.02 43.89 1yq2 n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1yq2 s SER 16 N 0.00 0.70 0.00 1.61 1.04 -0.75 -4.96 113.70 111.35 1yq2 s SER 16 Ca 0.00 -1.43 0.00 0.00 0.48 0.00 0.00 55.95 55.00 1yq2 s SER 16 Cb 0.00 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.66 1yq2 s SER 16 CO 0.00 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 173.76 1yq2 n GLY 17 N -0.46 -0.10 2.38 7.32 0.00 -1.26 -1.38 105.19 111.69 1yq2 n GLY 17 Ca 0.02 -1.73 -0.39 0.00 0.00 0.00 0.00 46.02 43.92 1yq2 n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yq2 n ARG 18 N 0.00 3.96 -2.41 1.61 1.74 0.31 -4.95 116.66 116.92 1yq2 n ARG 18 Ca 0.00 -2.62 -0.41 0.00 -0.77 0.00 0.00 57.85 54.06 1yq2 n ARG 18 Cb 0.00 -2.76 -0.04 0.00 -1.02 0.00 0.00 32.46 28.64 1yq2 n ARG 18 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1yq2 s ARG 19 N 1.15 4.53 -0.01 5.56 0.52 -1.26 -1.06 118.95 128.38 1yq2 s ARG 19 Ca 0.64 1.84 -0.16 0.00 -0.52 0.00 0.00 55.73 57.53 1yq2 s ARG 19 Cb 0.18 -3.23 -0.06 0.00 0.52 0.00 0.00 34.95 32.36 1yq2 s ARG 19 CO -0.07 -0.01 0.46 0.08 0.02 0.00 0.00 175.30 175.78 1yq2 s VAL 20 N -0.34 5.00 0.30 3.52 1.01 -0.50 -4.84 120.40 124.56 1yq2 s VAL 20 Ca 0.50 0.95 -0.27 0.00 0.00 0.00 0.00 61.98 63.16 1yq2 s VAL 20 Cb -0.32 -3.78 -0.14 0.00 0.00 0.00 0.00 36.38 32.15 1yq2 s VAL 20 CO 0.38 0.52 0.97 -2.65 0.00 0.00 0.00 175.10 174.32 1yq2 n PRO 21 N 2.20 1.28 -1.78 2.72 -0.02 -1.26 -4.66 135.00 133.48 1yq2 n PRO 21 Ca -0.12 0.45 -0.41 0.00 -2.02 0.00 0.00 63.50 61.41 1yq2 n PRO 21 Cb 0.52 -1.82 0.01 0.00 -0.02 0.00 0.00 33.50 32.19 1yq2 n PRO 21 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 s ALA 22 N -1.09 3.45 0.36 3.55 0.00 -1.26 -5.00 121.76 121.78 1yq2 s ALA 22 Ca 0.59 1.56 -0.03 0.00 0.00 0.00 0.00 51.96 54.08 1yq2 s ALA 22 Cb -0.69 -3.61 0.01 0.00 0.00 0.00 0.00 23.12 18.83 1yq2 s ALA 22 CO 0.60 -1.14 0.53 -0.98 0.00 0.00 0.00 175.76 174.76 1yq2 s ARG 23 N -2.25 2.02 0.62 0.00 1.70 -1.26 -4.98 118.95 114.80 1yq2 s ARG 23 Ca 0.56 -1.78 -0.17 0.00 -0.47 0.00 0.00 55.73 53.87 1yq2 s ARG 23 Cb -0.46 0.47 -0.02 0.00 -0.57 0.00 0.00 34.95 34.37 1yq2 s ARG 23 CO 0.61 -0.86 1.14 -1.12 -1.08 0.00 0.00 175.30 174.00 1yq2 s SER 24 N -3.24 5.23 -0.31 -2.89 0.01 -1.04 -3.37 113.70 108.08 1yq2 s SER 24 Ca 0.29 2.16 -0.25 0.00 1.31 0.00 0.00 55.95 59.45 1yq2 s SER 24 Cb -0.01 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.65 1yq2 s SER 24 CO 0.21 -1.55 0.89 0.86 0.41 0.00 0.00 173.24 174.05 1yq2 s TRP 25 N -1.99 3.18 0.11 2.43 -0.00 -0.86 -4.95 118.94 116.86 1yq2 s TRP 25 Ca 0.71 0.93 0.09 0.00 -0.00 0.00 0.00 56.10 57.83 1yq2 s TRP 25 Cb -0.24 -3.38 -0.04 0.00 -0.00 0.00 0.00 33.47 29.81 1yq2 s TRP 25 CO 0.36 -0.64 -0.21 -0.51 -0.00 0.00 0.00 176.95 175.94 1yq2 s LEU 26 N 3.20 2.32 -0.79 5.86 1.43 -1.26 -4.99 118.68 124.44 1yq2 s LEU 26 Ca 0.37 -0.72 -0.22 0.00 -1.03 0.00 0.00 54.13 52.53 1yq2 s LEU 26 Cb -0.13 -0.92 0.08 0.00 0.03 0.00 0.00 46.19 45.25 1yq2 s LEU 26 CO 0.14 0.06 1.11 -1.00 0.23 0.00 0.00 176.35 176.89 1yq2 s HIS 27 N -1.26 2.74 0.20 0.29 3.76 -1.26 -5.02 115.29 114.74 1yq2 s HIS 27 Ca 0.08 -0.77 0.09 0.00 -0.15 0.00 0.00 55.06 54.32 1yq2 s HIS 27 Cb -0.09 -4.38 -0.04 0.00 1.11 0.00 0.00 32.58 29.17 1yq2 s HIS 27 CO 0.05 -1.69 -0.07 0.45 -0.85 0.00 0.00 174.74 172.63 1yq2 s SER 28 N 3.84 4.35 0.00 1.40 0.15 -1.26 -0.90 113.70 121.28 1yq2 s SER 28 Ca 0.30 -0.59 0.17 0.00 0.70 0.00 0.00 55.95 56.53 1yq2 s SER 28 Cb -0.10 -0.77 0.58 0.00 -1.71 0.00 0.00 66.02 64.02 1yq2 s SER 28 CO 0.03 0.08 1.44 -0.90 1.20 0.00 0.00 173.24 175.08 1yq2 n ASP 29 N -0.21 1.78 -4.58 5.45 5.68 -0.72 -4.95 116.55 118.99 1yq2 n ASP 29 Ca -0.09 -1.82 -0.39 0.00 -0.50 0.00 0.00 54.79 51.98 1yq2 n ASP 29 Cb 0.56 -0.16 0.04 0.00 -1.14 0.00 0.00 41.12 40.42 1yq2 n ASP 29 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1yq2 n ALA 30 N 0.42 -0.13 -1.78 2.12 0.00 -1.26 -4.89 120.51 114.98 1yq2 n ALA 30 Ca 0.15 0.07 -0.41 0.00 0.00 0.00 0.00 53.44 53.24 1yq2 n ALA 30 Cb 0.32 -2.04 -0.01 0.00 0.00 0.00 0.00 19.45 17.73 1yq2 n ALA 30 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1yq2 s PRO 31 N -2.37 4.14 0.07 0.00 0.02 -1.26 -4.87 135.00 130.74 1yq2 s PRO 31 Ca 0.70 2.52 -0.13 0.00 0.02 0.00 0.00 61.00 64.11 1yq2 s PRO 31 Cb -0.47 -3.00 0.02 0.00 0.02 0.00 0.00 34.50 31.08 1yq2 s PRO 31 CO 0.52 -0.51 0.31 0.00 -0.33 0.00 0.00 177.00 176.98 1yq2 s ALA 32 N -0.85 -0.66 0.01 -1.55 0.00 -1.26 -0.52 121.76 116.92 1yq2 s ALA 32 Ca 0.55 -0.11 -0.03 0.00 0.00 0.00 0.00 51.96 52.37 1yq2 s ALA 32 Cb -0.46 0.43 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 1yq2 s ALA 32 CO 0.58 -0.48 0.04 -0.48 0.00 0.00 0.00 175.76 175.42 1yq2 s LEU 33 N -2.37 1.94 -0.14 0.00 0.05 -0.12 -4.99 118.68 113.05 1yq2 s LEU 33 Ca -0.01 -0.36 -0.17 0.00 0.05 0.00 0.00 54.13 53.64 1yq2 s LEU 33 Cb 0.01 0.34 -0.04 0.00 -2.05 0.00 0.00 46.19 44.45 1yq2 s LEU 33 CO -0.07 -0.32 0.42 -0.55 -0.55 0.00 0.00 176.35 175.28 1yq2 s SER 34 N -1.38 6.58 0.00 1.48 0.15 -1.26 -0.58 113.70 118.69 1yq2 s SER 34 Ca -0.15 0.68 0.27 0.00 0.70 0.00 0.00 55.95 57.45 1yq2 s SER 34 Cb -0.09 -2.25 1.04 0.00 -1.71 0.00 0.00 66.02 63.01 1yq2 s SER 34 CO 0.00 0.01 1.73 0.18 1.20 0.00 0.00 173.24 176.36 1yq2 n LEU 35 N 3.81 1.44 -4.64 3.45 4.32 0.30 -4.96 117.00 120.71 1yq2 n LEU 35 Ca -0.08 -0.51 -0.39 0.00 -0.02 0.00 0.00 56.01 55.01 1yq2 n LEU 35 Cb 0.52 -0.02 0.04 0.00 -1.62 0.00 0.00 43.42 42.34 1yq2 n LEU 35 CO 0.42 0.25 0.65 0.59 -1.22 0.00 0.00 177.39 178.08 1yq2 n ASN 36 N 0.14 1.32 0.00 -1.43 3.02 -1.23 -4.90 115.26 112.17 1yq2 n ASN 36 Ca 0.19 0.89 0.00 0.00 -0.03 0.00 0.00 54.58 55.63 1yq2 n ASN 36 Cb 0.34 -1.43 0.00 0.00 -0.61 0.00 0.00 39.78 38.08 1yq2 n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yq2 n GLY 37 N 1.14 0.24 3.53 7.41 0.00 0.02 -5.00 105.19 112.52 1yq2 n GLY 37 Ca 0.12 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 1yq2 n GLY 37 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yq2 s ASP 38 N -4.00 6.25 0.08 1.61 1.01 -1.26 -0.22 116.67 120.14 1yq2 s ASP 38 Ca 0.00 -0.32 0.02 0.00 0.71 0.00 0.00 52.55 52.96 1yq2 s ASP 38 Cb 0.00 -2.25 -0.04 0.00 1.01 0.00 0.00 42.92 41.65 1yq2 s ASP 38 CO 0.00 -0.52 0.13 0.26 0.21 0.00 0.00 175.17 175.25 1yq2 s TRP 39 N 2.29 3.30 0.27 4.23 0.52 -0.40 -4.85 118.94 124.30 1yq2 s TRP 39 Ca 0.16 0.13 -0.30 0.00 0.02 0.00 0.00 56.10 56.11 1yq2 s TRP 39 Cb -0.16 -1.66 -0.10 0.00 -1.15 0.00 0.00 33.47 30.40 1yq2 s TRP 39 CO 0.14 0.54 1.38 1.03 0.02 0.00 0.00 176.95 180.06 1yq2 s ARG 40 N -2.48 4.31 -0.06 4.98 0.52 -0.71 -0.66 118.95 124.85 1yq2 s ARG 40 Ca 0.31 2.24 -0.06 0.00 -0.52 0.00 0.00 55.73 57.71 1yq2 s ARG 40 Cb -0.12 -3.11 0.01 0.00 0.52 0.00 0.00 34.95 32.25 1yq2 s ARG 40 CO 0.24 -0.32 0.16 0.12 0.02 0.00 0.00 175.30 175.52 1yq2 s PHE 41 N -0.34 -0.16 0.02 -0.53 5.36 -0.29 -0.87 117.98 121.17 1yq2 s PHE 41 Ca 0.56 0.40 0.01 0.00 -0.96 0.00 0.00 56.93 56.93 1yq2 s PHE 41 Cb -0.40 0.05 -0.02 0.00 -0.34 0.00 0.00 43.02 42.31 1yq2 s PHE 41 CO 0.46 -0.09 -0.04 -0.98 -1.46 0.00 0.00 175.22 173.10 1yq2 s ARG 42 N 0.01 0.36 -0.20 10.12 1.70 -0.80 -3.14 118.95 127.01 1yq2 s ARG 42 Ca -0.01 -0.62 -0.05 0.00 -0.47 0.00 0.00 55.73 54.58 1yq2 s ARG 42 Cb -0.01 -0.02 -0.03 0.00 -0.57 0.00 0.00 34.95 34.32 1yq2 s ARG 42 CO 0.00 -0.02 0.00 -1.17 -1.08 0.00 0.00 175.30 173.04 1yq2 s LEU 43 N -1.40 3.31 -0.01 -1.89 2.96 -1.26 -1.45 118.68 118.94 1yq2 s LEU 43 Ca -0.13 -0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 53.60 1yq2 s LEU 43 Cb -0.09 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 1yq2 s LEU 43 CO -0.01 0.08 0.09 -0.76 -1.32 0.00 0.00 176.35 174.43 1yq2 s LEU 44 N 0.91 3.94 0.09 -0.68 1.43 0.32 -4.96 118.68 119.73 1yq2 s LEU 44 Ca 0.01 0.17 0.25 0.00 -1.03 0.00 0.00 54.13 53.53 1yq2 s LEU 44 Cb -0.14 -2.29 0.97 0.00 0.03 0.00 0.00 46.19 44.76 1yq2 s LEU 44 CO 0.02 0.28 1.77 -0.81 0.23 0.00 0.00 176.35 177.83 1yq2 n PRO 45 N 1.21 0.10 -3.95 1.29 -0.04 -1.26 -1.10 135.00 131.23 1yq2 n PRO 45 Ca -0.13 0.17 -0.09 0.00 -0.04 0.00 0.00 63.50 63.40 1yq2 n PRO 45 Cb 0.53 -1.63 -0.07 0.00 -0.04 0.00 0.00 33.50 32.28 1yq2 n PRO 45 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yq2 s ALA 46 N -3.07 0.03 -0.34 0.55 0.00 -1.21 -1.04 121.76 116.67 1yq2 s ALA 46 Ca 0.10 -0.88 -0.26 0.00 0.00 0.00 0.00 51.96 50.92 1yq2 s ALA 46 Cb 0.14 0.78 0.01 0.00 0.00 0.00 0.00 23.12 24.06 1yq2 s ALA 46 CO 0.48 -0.60 0.95 0.00 0.00 0.00 0.00 175.76 176.58 1yq2 s ALA 47 N -3.95 3.45 0.34 0.00 0.00 -1.25 -4.57 121.76 115.79 1yq2 s ALA 47 Ca 0.15 -0.32 -0.27 0.00 0.00 0.00 0.00 51.96 51.52 1yq2 s ALA 47 Cb 0.04 -3.55 -0.12 0.00 0.00 0.00 0.00 23.12 19.49 1yq2 s ALA 47 CO -0.02 -1.51 1.16 -2.30 0.00 0.00 0.00 175.76 173.08 1yq2 n PRO 48 N 6.73 1.75 -0.18 0.00 -0.02 -1.26 -2.61 135.00 139.41 1yq2 n PRO 48 Ca 0.08 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1yq2 n PRO 48 Cb 0.48 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1yq2 n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yq2 n GLY 49 N 0.97 1.10 3.91 -1.23 0.00 -1.26 -4.95 105.19 103.73 1yq2 n GLY 49 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 1yq2 n GLY 49 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yq2 s THR 50 N -2.63 4.77 0.44 2.61 -4.23 -1.07 -4.83 115.64 110.70 1yq2 s THR 50 Ca 0.00 0.18 0.13 0.00 -1.18 0.00 0.00 61.69 60.82 1yq2 s THR 50 Cb 0.00 -3.82 0.19 0.00 1.34 0.00 0.00 72.50 70.21 1yq2 s THR 50 CO 0.00 -0.81 1.99 0.00 -0.54 0.00 0.00 174.62 175.26 1yq2 h ALA 51 N 0.18 1.68 -0.44 3.99 0.00 -1.96 -1.83 119.26 120.86 1yq2 h ALA 51 Ca -0.47 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1yq2 h ALA 51 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1yq2 h ALA 51 CO 0.61 0.24 0.00 0.41 0.00 0.00 0.00 179.25 180.51 1yq2 n GLY 52 N -1.04 1.23 1.43 0.00 0.00 -1.26 -4.32 105.19 101.22 1yq2 n GLY 52 Ca -0.02 -0.54 -0.12 0.00 0.00 0.00 0.00 46.02 45.34 1yq2 n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 n ALA 53 N 0.92 4.50 0.20 4.61 0.00 -0.69 -4.88 120.51 125.18 1yq2 n ALA 53 Ca 0.17 -3.55 0.14 0.00 0.00 0.00 0.00 53.44 50.19 1yq2 n ALA 53 Cb 0.42 -0.41 0.74 0.00 0.00 0.00 0.00 19.45 20.21 1yq2 n ALA 53 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1yq2 h GLY 54 N 1.64 0.00 -2.34 0.00 0.00 -1.75 -2.85 103.07 97.77 1yq2 h GLY 54 Ca 0.23 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.41 1yq2 h GLY 54 CO 0.47 0.00 -0.76 -1.14 0.00 0.00 0.00 176.54 175.11 1yq2 n SER 55 N -4.23 1.86 0.08 0.19 3.41 -1.26 -4.80 113.62 108.87 1yq2 n SER 55 Ca 0.00 -3.12 -0.05 0.00 -0.26 0.00 0.00 58.87 55.45 1yq2 n SER 55 Cb 0.24 -0.43 0.13 0.00 -0.26 0.00 0.00 64.21 63.89 1yq2 n SER 55 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1yq2 h VAL 56 N 3.46 1.38 -3.38 -3.33 3.04 -1.89 -3.46 116.25 112.06 1yq2 h VAL 56 Ca -0.04 -1.95 -0.50 0.00 -1.01 0.00 0.00 66.70 63.20 1yq2 h VAL 56 Cb 1.38 1.98 0.01 0.00 -2.01 0.00 0.00 31.29 32.64 1yq2 h VAL 56 CO 0.14 0.58 -0.01 -0.76 -1.01 0.00 0.00 177.57 176.50 1yq2 s LEU 57 N -7.95 3.88 0.68 3.16 1.43 -1.26 -4.93 118.68 113.69 1yq2 s LEU 57 Ca -0.04 0.85 -0.17 0.00 -1.03 0.00 0.00 54.13 53.74 1yq2 s LEU 57 Cb 0.12 -3.73 0.01 0.00 0.03 0.00 0.00 46.19 42.62 1yq2 s LEU 57 CO 0.80 -0.36 1.27 -2.65 0.23 0.00 0.00 176.35 175.64 1yq2 n PRO 58 N -1.46 0.92 -1.61 1.29 -0.02 -1.26 -4.87 135.00 127.99 1yq2 n PRO 58 Ca -0.00 0.37 -0.59 0.00 -2.02 0.00 0.00 63.50 61.26 1yq2 n PRO 58 Cb 0.54 -2.51 -0.08 0.00 -0.02 0.00 0.00 33.50 31.43 1yq2 n PRO 58 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1yq2 n SER 59 N -2.19 1.01 0.00 2.55 7.64 -1.26 -1.73 113.62 119.64 1yq2 n SER 59 Ca 0.15 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.18 1yq2 n SER 59 Cb 0.48 -1.01 0.00 0.00 -1.01 0.00 0.00 64.21 62.68 1yq2 n SER 59 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yq2 n GLY 60 N 2.71 3.00 3.72 0.23 0.00 -1.26 -5.01 105.19 108.57 1yq2 n GLY 60 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1yq2 n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yq2 s GLU 61 N -0.25 4.28 0.57 1.61 2.12 -0.70 -5.01 118.70 121.32 1yq2 s GLU 61 Ca 0.00 2.17 -0.14 0.00 0.36 0.00 0.00 54.97 57.36 1yq2 s GLU 61 Cb 0.00 -3.22 -0.06 0.00 0.26 0.00 0.00 34.13 31.11 1yq2 s GLU 61 CO 0.00 -0.50 1.01 0.95 -0.54 0.00 0.00 175.26 176.18 1yq2 s THR 62 N 1.14 4.62 0.25 -1.70 -4.23 -1.26 -4.87 115.64 109.60 1yq2 s THR 62 Ca 0.66 1.04 -0.11 0.00 -1.18 0.00 0.00 61.69 62.11 1yq2 s THR 62 Cb -0.39 -3.80 0.35 0.00 1.34 0.00 0.00 72.50 70.00 1yq2 s THR 62 CO 0.30 -0.93 1.59 0.58 -0.54 0.00 0.00 174.62 175.62 1yq2 h VAL 63 N 0.27 0.15 -0.20 2.29 2.07 -1.96 -0.67 116.25 118.20 1yq2 h VAL 63 Ca -0.45 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.02 1yq2 h VAL 63 Cb 1.19 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1yq2 h VAL 63 CO 0.62 0.00 -0.05 -0.62 0.02 0.00 0.00 177.57 177.54 1yq2 n GLU 64 N -5.54 2.18 0.31 1.57 1.02 -1.26 -4.70 120.64 114.22 1yq2 n GLU 64 Ca 0.12 -2.88 0.21 0.00 -0.02 0.00 0.00 57.16 54.59 1yq2 n GLU 64 Cb 0.42 -1.74 1.12 0.00 -0.02 0.00 0.00 31.44 31.22 1yq2 n GLU 64 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1yq2 h GLY 65 N 1.11 0.00 2.00 0.62 0.00 -1.48 -2.54 103.07 102.78 1yq2 h GLY 65 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1yq2 h GLY 65 CO 0.19 0.00 0.00 -0.24 0.00 0.00 0.00 176.54 176.49 1yq2 h VAL 66 N 0.00 0.00 0.00 4.60 3.04 -1.84 -2.43 116.25 119.62 1yq2 h VAL 66 Ca 0.00 -0.02 -0.07 0.00 -1.01 0.00 0.00 66.70 65.60 1yq2 h VAL 66 Cb 0.01 0.80 -0.01 0.00 -2.01 0.00 0.00 31.29 30.08 1yq2 h VAL 66 CO 0.00 0.00 -0.33 0.00 -1.01 0.00 0.00 177.57 176.23 1yq2 h ALA 67 N 2.01 0.88 -2.75 3.17 0.00 -1.85 -3.47 119.26 117.26 1yq2 h ALA 67 Ca 0.00 -0.30 -0.51 0.00 0.00 0.00 0.00 54.91 54.09 1yq2 h ALA 67 Cb 0.03 -0.05 0.08 0.00 0.00 0.00 0.00 17.79 17.84 1yq2 h ALA 67 CO 0.00 0.41 0.50 0.00 0.00 0.00 0.00 179.25 180.16 1yq2 s ALA 68 N -3.35 2.88 0.30 0.00 0.00 -0.92 -3.64 121.76 117.03 1yq2 s ALA 68 Ca 0.02 0.99 0.11 0.00 0.00 0.00 0.00 51.96 53.09 1yq2 s ALA 68 Cb 0.09 -3.42 0.48 0.00 0.00 0.00 0.00 23.12 20.28 1yq2 s ALA 68 CO 0.69 -0.83 1.69 0.93 0.00 0.00 0.00 175.76 178.23 1yq2 h GLU 69 N 1.77 0.00 -5.24 0.00 5.08 -1.90 -3.35 114.58 110.93 1yq2 h GLU 69 Ca -0.50 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.17 1yq2 h GLU 69 Cb 1.26 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.36 1yq2 h GLU 69 CO 0.59 0.53 1.32 0.45 -1.00 0.00 0.00 179.01 180.90 1yq2 s SER 70 N -6.87 6.79 -0.10 1.42 0.15 -1.26 -4.97 113.70 108.86 1yq2 s SER 70 Ca -0.02 -2.32 -0.08 0.00 0.70 0.00 0.00 55.95 54.24 1yq2 s SER 70 Cb 0.13 -2.46 0.03 0.00 -1.71 0.00 0.00 66.02 62.02 1yq2 s SER 70 CO 0.75 -1.05 0.26 -0.47 1.20 0.00 0.00 173.24 173.93 1yq2 s TYR 71 N 2.93 -0.32 -0.83 3.44 5.04 -1.26 -5.07 117.35 121.29 1yq2 s TYR 71 Ca 0.41 0.76 -0.20 0.00 -2.44 0.00 0.00 57.07 55.61 1yq2 s TYR 71 Cb -0.02 0.09 0.11 0.00 0.35 0.00 0.00 41.96 42.49 1yq2 s TYR 71 CO -0.04 -0.18 1.05 0.34 -1.34 0.00 0.00 175.55 175.37 1yq2 s ASP 72 N 0.62 6.46 -0.22 4.32 3.68 -1.26 -4.81 116.67 125.47 1yq2 s ASP 72 Ca -0.04 -1.70 0.15 0.00 2.13 0.00 0.00 52.55 53.09 1yq2 s ASP 72 Cb -0.05 -2.40 0.62 0.00 -1.45 0.00 0.00 42.92 39.64 1yq2 s ASP 72 CO -0.04 -1.17 1.55 -0.90 0.13 0.00 0.00 175.17 174.73 1yq2 n ASP 73 N 6.85 4.27 -0.31 -0.34 5.75 -1.26 -4.78 116.55 126.74 1yq2 n ASP 73 Ca 0.13 -3.10 0.06 0.00 -0.01 0.00 0.00 54.79 51.87 1yq2 n ASP 73 Cb 0.47 -0.61 0.26 0.00 -1.03 0.00 0.00 41.12 40.22 1yq2 n ASP 73 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1yq2 h ALA 74 N 2.29 1.57 -0.01 2.12 0.00 -2.03 -1.08 119.26 122.12 1yq2 h ALA 74 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1yq2 h ALA 74 Cb 1.70 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1yq2 h ALA 74 CO 0.36 0.26 -0.09 0.00 0.00 0.00 0.00 179.25 179.78 1yq2 n ALA 75 N -2.39 2.75 -1.77 0.00 0.00 -1.26 -4.93 120.51 112.90 1yq2 n ALA 75 Ca 0.15 -0.33 -0.37 0.00 0.00 0.00 0.00 53.44 52.89 1yq2 n ALA 75 Cb 0.27 -1.28 -0.02 0.00 0.00 0.00 0.00 19.45 18.43 1yq2 n ALA 75 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1yq2 s TRP 76 N -2.27 2.97 1.03 0.00 0.52 -0.41 -5.04 118.94 115.75 1yq2 s TRP 76 Ca 0.33 1.56 -0.14 0.00 0.02 0.00 0.00 56.10 57.87 1yq2 s TRP 76 Cb 0.20 -3.33 0.21 0.00 -1.15 0.00 0.00 33.47 29.40 1yq2 s TRP 76 CO 0.43 -1.31 1.12 -0.51 0.02 0.00 0.00 176.95 176.70 1yq2 s ASP 77 N -1.38 2.37 0.16 2.95 1.01 -1.19 -4.79 116.67 115.80 1yq2 s ASP 77 Ca 0.62 0.94 0.10 0.00 0.71 0.00 0.00 52.55 54.92 1yq2 s ASP 77 Cb -0.27 -1.45 -0.04 0.00 1.01 0.00 0.00 42.92 42.16 1yq2 s ASP 77 CO 0.34 -3.26 -0.18 0.42 0.21 0.00 0.00 175.17 172.69 1yq2 s THR 78 N -3.09 2.74 -0.02 -1.27 -4.23 -1.26 -1.14 115.64 107.36 1yq2 s THR 78 Ca 0.67 -1.71 0.01 0.00 -1.18 0.00 0.00 61.69 59.48 1yq2 s THR 78 Cb -0.15 -2.29 0.01 0.00 1.34 0.00 0.00 72.50 71.41 1yq2 s THR 78 CO 0.56 -0.01 -0.04 -0.22 -0.54 0.00 0.00 174.62 174.37 1yq2 s LEU 79 N -2.45 1.63 0.38 4.79 1.98 0.16 -4.88 118.68 120.29 1yq2 s LEU 79 Ca 0.20 -0.08 -0.27 0.00 -2.89 0.00 0.00 54.13 51.08 1yq2 s LEU 79 Cb -0.09 -0.29 -0.10 0.00 0.66 0.00 0.00 46.19 46.37 1yq2 s LEU 79 CO 0.11 -0.01 1.39 -2.84 -1.89 0.00 0.00 176.35 173.11 1yq2 s PRO 80 N 0.42 4.09 -0.09 0.98 0.02 -1.26 -1.27 135.00 137.89 1yq2 s PRO 80 Ca -0.05 2.37 0.01 0.00 0.02 0.00 0.00 61.00 63.36 1yq2 s PRO 80 Cb -0.08 -2.91 0.02 0.00 0.02 0.00 0.00 34.50 31.55 1yq2 s PRO 80 CO -0.00 -0.47 -0.10 0.08 -0.33 0.00 0.00 177.00 176.18 1yq2 s VAL 81 N -1.16 1.09 0.27 3.83 1.01 0.70 -3.42 120.40 122.72 1yq2 s VAL 81 Ca 0.54 -0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.83 1yq2 s VAL 81 Cb -0.43 -1.05 -0.09 0.00 0.00 0.00 0.00 36.38 34.81 1yq2 s VAL 81 CO 0.57 0.36 1.05 -2.16 0.00 0.00 0.00 175.10 174.92 1yq2 s PRO 82 N 1.18 4.68 0.18 2.72 0.04 -1.26 -0.80 135.00 141.74 1yq2 s PRO 82 Ca -0.05 1.70 -0.24 0.00 0.04 0.00 0.00 61.00 62.45 1yq2 s PRO 82 Cb -0.14 -3.18 0.06 0.00 0.04 0.00 0.00 34.50 31.27 1yq2 s PRO 82 CO -0.02 0.29 0.93 -1.54 0.04 0.00 0.00 177.00 176.69 1yq2 s SER 83 N -1.00 -0.16 -0.17 6.66 1.04 -0.35 -4.92 113.70 114.80 1yq2 s SER 83 Ca 0.44 -0.49 -0.08 0.00 0.48 0.00 0.00 55.95 56.29 1yq2 s SER 83 Cb -0.30 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 1yq2 s SER 83 CO 0.38 -1.01 0.12 -1.00 0.98 0.00 0.00 173.24 172.71 1yq2 s HIS 84 N -3.22 3.43 -0.25 5.02 3.76 -1.26 -3.40 115.29 119.37 1yq2 s HIS 84 Ca 0.13 0.34 0.25 0.00 -0.15 0.00 0.00 55.06 55.64 1yq2 s HIS 84 Cb -0.02 -2.07 1.19 0.00 1.11 0.00 0.00 32.58 32.78 1yq2 s HIS 84 CO 0.04 0.40 1.77 0.11 -0.85 0.00 0.00 174.74 176.21 1yq2 h TRP 85 N 6.13 0.00 -0.18 1.40 0.09 -1.83 -1.92 115.95 119.64 1yq2 h TRP 85 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.53 1yq2 h TRP 85 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.42 1yq2 h TRP 85 CO 0.63 0.00 0.00 1.33 0.09 0.00 0.00 178.44 180.49 1yq2 n VAL 86 N -2.39 0.22 -4.80 0.12 0.24 -1.26 -4.37 118.33 106.08 1yq2 n VAL 86 Ca 0.00 -0.46 -0.30 0.00 -2.04 0.00 0.00 64.34 61.55 1yq2 n VAL 86 Cb 0.16 0.71 -0.14 0.00 -1.47 0.00 0.00 33.84 33.10 1yq2 n VAL 86 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1yq2 s MET 87 N -1.78 1.76 -0.59 7.34 -1.94 -0.72 -4.09 119.30 119.28 1yq2 s MET 87 Ca 0.34 -1.14 0.00 0.00 -1.71 0.00 0.00 55.69 53.18 1yq2 s MET 87 Cb 0.20 -1.99 0.00 0.00 2.01 0.00 0.00 34.83 35.05 1yq2 s MET 87 CO 0.29 0.50 0.00 0.41 -0.01 0.00 0.00 175.02 176.22 1yq2 n GLY 88 N 1.61 0.79 0.30 -0.03 0.00 -1.26 -4.71 105.19 101.89 1yq2 n GLY 88 Ca -0.17 -0.52 0.05 0.00 0.00 0.00 0.00 46.02 45.38 1yq2 n GLY 88 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1yq2 n GLN 89 N -2.46 0.61 -3.61 1.61 1.13 -1.26 -5.00 117.38 108.41 1yq2 n GLN 89 Ca -0.06 -1.75 -0.27 0.00 -1.94 0.00 0.00 57.00 52.99 1yq2 n GLN 89 Cb 0.23 -0.97 -0.01 0.00 0.11 0.00 0.00 30.24 29.60 1yq2 n GLN 89 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1yq2 n ASP 90 N -0.68 -3.53 0.00 1.08 8.00 -1.26 -1.23 116.55 118.93 1yq2 n ASP 90 Ca 0.08 -0.55 0.00 0.00 0.71 0.00 0.00 54.79 55.02 1yq2 n ASP 90 Cb 0.67 -2.92 0.00 0.00 -0.02 0.00 0.00 41.12 38.86 1yq2 n ASP 90 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yq2 n GLY 91 N -1.22 0.71 0.37 0.44 0.00 -1.26 -4.92 105.19 99.30 1yq2 n GLY 91 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 1yq2 n GLY 91 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1yq2 h LYS 92 N 1.91 0.78 -0.89 1.61 3.64 -1.51 -2.30 116.57 119.81 1yq2 h LYS 92 Ca 0.00 -0.05 -0.60 0.00 -1.27 0.00 0.00 60.65 58.74 1yq2 h LYS 92 Cb 0.04 -0.18 -0.38 0.00 -0.41 0.00 0.00 32.23 31.30 1yq2 h LYS 92 CO 0.00 0.52 -0.27 0.66 -2.27 0.00 0.00 179.45 178.09 1yq2 n TYR 93 N -4.53 2.93 -0.10 1.91 4.02 -1.26 -5.08 117.16 115.05 1yq2 n TYR 93 Ca 0.15 -2.51 0.00 0.00 -0.01 0.00 0.00 57.90 55.53 1yq2 n TYR 93 Cb 0.35 -0.68 0.00 0.00 -0.02 0.00 0.00 39.34 38.99 1yq2 n TYR 93 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1yq2 n GLY 94 N -0.76 -3.07 3.20 2.72 0.00 -0.87 -4.48 105.19 101.93 1yq2 n GLY 94 Ca 0.50 -1.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.62 1yq2 n GLY 94 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yq2 s ARG 95 N -0.96 0.92 0.81 1.61 1.81 -1.26 -4.41 118.95 117.47 1yq2 s ARG 95 Ca 0.00 -1.33 -0.14 0.00 -1.72 0.00 0.00 55.73 52.54 1yq2 s ARG 95 Cb 0.00 -0.44 0.06 0.00 -0.45 0.00 0.00 34.95 34.12 1yq2 s ARG 95 CO 0.00 0.04 1.01 -2.30 -0.68 0.00 0.00 175.30 173.37 1yq2 n PRO 96 N 0.06 0.14 -4.37 3.54 -0.02 -1.26 -4.97 135.00 128.12 1yq2 n PRO 96 Ca -0.12 0.12 -0.26 0.00 -2.02 0.00 0.00 63.50 61.21 1yq2 n PRO 96 Cb 0.60 -2.28 -0.17 0.00 -0.02 0.00 0.00 33.50 31.63 1yq2 n PRO 96 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1yq2 s ILE 97 N -2.13 1.17 -0.30 4.25 1.01 -1.21 -4.81 121.20 119.18 1yq2 s ILE 97 Ca 0.70 -0.45 -0.08 0.00 0.00 0.00 0.00 60.65 60.82 1yq2 s ILE 97 Cb -0.29 -1.10 0.00 0.00 0.01 0.00 0.00 42.46 41.08 1yq2 s ILE 97 CO 0.54 0.37 0.11 -0.47 0.00 0.00 0.00 174.94 175.49 1yq2 s TYR 98 N 1.02 3.16 0.15 3.97 5.04 -1.26 -0.12 117.35 129.30 1yq2 s TYR 98 Ca -0.08 -0.81 0.10 0.00 -2.44 0.00 0.00 57.07 53.85 1yq2 s TYR 98 Cb -0.15 -2.29 -0.04 0.00 0.35 0.00 0.00 41.96 39.83 1yq2 s TYR 98 CO -0.01 -0.52 -0.24 0.95 -1.34 0.00 0.00 175.55 174.39 1yq2 s THR 99 N 1.55 2.17 0.00 4.34 -4.23 -1.25 -2.51 115.64 115.70 1yq2 s THR 99 Ca 0.03 -1.85 0.00 0.00 -1.18 0.00 0.00 61.69 58.69 1yq2 s THR 99 Cb -0.17 -1.97 0.00 0.00 1.34 0.00 0.00 72.50 71.70 1yq2 s THR 99 CO 0.04 -0.06 0.00 -3.20 -0.54 0.00 0.00 174.62 170.86 1yq2 n ASN 100 N 0.62 0.00 -0.08 3.99 5.15 -1.26 -3.35 115.26 120.33 1yq2 n ASN 100 Ca -0.16 0.00 -0.22 0.00 -0.60 0.00 0.00 54.58 53.60 1yq2 n ASN 100 Cb 0.55 0.00 -0.12 0.00 -0.53 0.00 0.00 39.78 39.67 1yq2 n ASN 100 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1yq2 n VAL 101 N -0.92 1.61 -1.93 3.44 0.31 -1.26 -4.05 118.33 115.53 1yq2 n VAL 101 Ca 0.00 -0.46 -0.40 0.00 -0.01 0.00 0.00 64.34 63.46 1yq2 n VAL 101 Cb 0.00 -1.74 -0.00 0.00 -0.91 0.00 0.00 33.84 31.19 1yq2 n VAL 101 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yq2 s GLN 102 N -2.50 4.09 0.36 5.55 -2.07 -1.26 -3.77 119.66 120.06 1yq2 s GLN 102 Ca -0.30 2.38 -0.26 0.00 -1.82 0.00 0.00 55.36 55.37 1yq2 s GLN 102 Cb 0.08 -2.91 -0.09 0.00 -1.09 0.00 0.00 33.01 29.00 1yq2 s GLN 102 CO 0.64 -0.48 1.06 0.71 -1.32 0.00 0.00 175.29 175.91 1yq2 s TYR 103 N -1.16 3.37 -1.13 9.60 2.02 -1.26 -4.81 117.35 123.98 1yq2 s TYR 103 Ca 0.54 1.67 0.04 0.00 -0.37 0.00 0.00 57.07 58.94 1yq2 s TYR 103 Cb -0.43 -3.17 0.18 0.00 -0.40 0.00 0.00 41.96 38.15 1yq2 s TYR 103 CO 0.57 -0.58 0.88 -0.35 -1.57 0.00 0.00 175.55 174.50 1yq2 n PRO 104 N 0.32 1.79 -4.03 -1.71 -0.04 -1.26 -4.80 135.00 125.27 1yq2 n PRO 104 Ca 0.03 -0.72 -0.09 0.00 -0.04 0.00 0.00 63.50 62.68 1yq2 n PRO 104 Cb 0.48 -1.54 -0.09 0.00 -0.04 0.00 0.00 33.50 32.32 1yq2 n PRO 104 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1yq2 s PHE 105 N -1.51 0.56 0.48 0.54 -0.71 -1.26 -5.02 117.98 111.06 1yq2 s PHE 105 Ca 0.13 -0.96 -0.23 0.00 -1.04 0.00 0.00 56.93 54.83 1yq2 s PHE 105 Cb 0.09 -0.26 -0.08 0.00 -1.21 0.00 0.00 43.02 41.56 1yq2 s PHE 105 CO 0.05 -0.58 1.19 -2.30 -1.34 0.00 0.00 175.22 172.24 1yq2 n PRO 106 N -0.11 1.60 -2.63 1.99 -0.02 -1.26 -4.90 135.00 129.66 1yq2 n PRO 106 Ca -0.09 0.58 -0.42 0.00 -2.02 0.00 0.00 63.50 61.56 1yq2 n PRO 106 Cb 0.63 -2.33 -0.03 0.00 -0.02 0.00 0.00 33.50 31.75 1yq2 n PRO 106 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1yq2 s ILE 107 N -1.29 4.06 -0.39 4.25 1.01 -1.26 -4.76 121.20 122.82 1yq2 s ILE 107 Ca 0.66 -0.80 0.10 0.00 0.00 0.00 0.00 60.65 60.61 1yq2 s ILE 107 Cb -0.48 -4.99 0.33 0.00 0.01 0.00 0.00 42.46 37.34 1yq2 s ILE 107 CO 0.54 -1.84 0.80 -0.67 0.00 0.00 0.00 174.94 173.76 1yq2 n ASP 108 N 8.47 0.03 -4.76 3.58 2.03 -1.26 -5.13 116.55 119.52 1yq2 n ASP 108 Ca 0.28 -3.14 -0.38 0.00 0.52 0.00 0.00 54.79 52.07 1yq2 n ASP 108 Cb 0.50 -0.03 0.02 0.00 -0.72 0.00 0.00 41.12 40.89 1yq2 n ASP 108 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1yq2 s PRO 109 N -1.70 3.45 -0.18 -0.67 0.04 -1.26 -1.06 135.00 133.63 1yq2 s PRO 109 Ca 0.36 2.03 0.12 0.00 0.04 0.00 0.00 61.00 63.55 1yq2 s PRO 109 Cb 0.32 -2.35 0.67 0.00 0.04 0.00 0.00 34.50 33.18 1yq2 s PRO 109 CO -0.08 -0.87 1.53 -0.35 0.04 0.00 0.00 177.00 177.26 1yq2 n PRO 110 N -0.73 4.04 -2.35 0.56 -0.04 -1.26 -5.11 135.00 130.11 1yq2 n PRO 110 Ca 0.09 -2.57 -0.38 0.00 -0.04 0.00 0.00 63.50 60.60 1yq2 n PRO 110 Cb 0.46 -2.07 -0.02 0.00 -0.04 0.00 0.00 33.50 31.83 1yq2 n PRO 110 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1yq2 s HIS 111 N -2.32 3.08 0.26 0.54 3.76 -0.23 -4.15 115.29 116.23 1yq2 s HIS 111 Ca 0.45 1.57 0.07 0.00 -0.15 0.00 0.00 55.06 57.01 1yq2 s HIS 111 Cb 0.33 -3.33 -0.05 0.00 1.11 0.00 0.00 32.58 30.64 1yq2 s HIS 111 CO 0.15 -1.19 -0.10 0.14 -0.85 0.00 0.00 174.74 172.89 1yq2 s VAL 112 N -1.50 1.76 0.73 -0.90 -7.23 -1.26 -4.66 120.40 107.34 1yq2 s VAL 112 Ca 0.58 -2.18 -0.16 0.00 -1.81 0.00 0.00 61.98 58.42 1yq2 s VAL 112 Cb -0.28 -2.31 0.03 0.00 0.56 0.00 0.00 36.38 34.39 1yq2 s VAL 112 CO 0.35 -0.40 1.25 -2.65 -0.31 0.00 0.00 175.10 173.33 1yq2 n PRO 113 N -0.52 0.66 -0.24 4.82 -0.02 -1.26 -4.95 135.00 133.48 1yq2 n PRO 113 Ca -0.06 0.29 -0.07 0.00 -2.02 0.00 0.00 63.50 61.64 1yq2 n PRO 113 Cb 0.62 -2.48 0.04 0.00 -0.02 0.00 0.00 33.50 31.66 1yq2 n PRO 113 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1yq2 h ASP 114 N -0.17 0.90 -1.69 2.55 3.32 -1.96 -3.37 116.42 116.00 1yq2 h ASP 114 Ca -0.49 -0.16 -0.47 0.00 0.02 0.00 0.00 57.03 55.93 1yq2 h ASP 114 Cb 1.32 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 40.58 1yq2 h ASP 114 CO 0.49 0.81 1.17 0.00 -1.72 0.00 0.00 179.24 179.99 1yq2 s ALA 115 N -5.61 2.24 -0.34 3.45 0.00 -1.26 -4.35 121.76 115.89 1yq2 s ALA 115 Ca -0.13 -1.17 -0.00 0.00 0.00 0.00 0.00 51.96 50.66 1yq2 s ALA 115 Cb 0.14 -4.37 0.13 0.00 0.00 0.00 0.00 23.12 19.02 1yq2 s ALA 115 CO 0.81 -3.94 0.21 1.21 0.00 0.00 0.00 175.76 174.05 1yq2 s ASN 116 N 6.81 2.87 -0.20 0.00 3.84 -0.21 -5.00 114.94 123.06 1yq2 s ASN 116 Ca 0.59 -1.91 -0.37 0.00 0.21 0.00 0.00 52.86 51.37 1yq2 s ASN 116 Cb -0.09 -0.27 -0.14 0.00 -0.55 0.00 0.00 41.25 40.20 1yq2 s ASN 116 CO 0.12 -0.33 1.82 -2.65 -2.79 0.00 0.00 177.10 173.26 1yq2 n PRO 117 N 4.33 1.63 -4.01 0.43 -0.02 -1.25 -3.28 135.00 132.82 1yq2 n PRO 117 Ca 0.08 0.59 -0.31 0.00 -2.02 0.00 0.00 63.50 61.85 1yq2 n PRO 117 Cb 0.39 -2.36 -0.16 0.00 -0.02 0.00 0.00 33.50 31.35 1yq2 n PRO 117 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1yq2 s THR 118 N 3.89 1.65 -0.25 3.45 2.01 -0.26 -0.67 115.64 125.46 1yq2 s THR 118 Ca 0.96 -0.86 -0.11 0.00 0.31 0.00 0.00 61.69 61.99 1yq2 s THR 118 Cb -0.89 -1.64 -0.05 0.00 0.01 0.00 0.00 72.50 69.93 1yq2 s THR 118 CO 0.59 0.31 0.18 -0.83 -0.69 0.00 0.00 174.62 174.18 1yq2 s GLY 119 N 1.42 1.97 -0.17 4.40 0.00 0.72 -0.52 107.32 115.14 1yq2 s GLY 119 Ca 0.02 -0.92 -0.08 0.00 0.00 0.00 0.00 44.72 43.73 1yq2 s GLY 119 CO -0.09 0.49 0.12 0.99 0.00 0.00 0.00 173.10 174.60 1yq2 s ASP 120 N 1.25 6.12 -0.04 1.64 1.01 -0.53 -0.05 116.67 126.07 1yq2 s ASP 120 Ca 0.08 0.26 0.05 0.00 0.71 0.00 0.00 52.55 53.65 1yq2 s ASP 120 Cb -0.14 -2.04 -0.01 0.00 1.01 0.00 0.00 42.92 41.74 1yq2 s ASP 120 CO 0.06 0.25 -0.19 -0.36 0.21 0.00 0.00 175.17 175.14 1yq2 s PHE 121 N -0.05 1.84 -0.07 4.23 0.40 0.05 -1.90 117.98 122.47 1yq2 s PHE 121 Ca 0.09 -0.51 0.01 0.00 -0.60 0.00 0.00 56.93 55.92 1yq2 s PHE 121 Cb -0.11 -1.22 0.02 0.00 0.51 0.00 0.00 43.02 42.21 1yq2 s PHE 121 CO 0.00 -0.16 -0.06 1.03 0.70 0.00 0.00 175.22 176.73 1yq2 s ARG 122 N -0.05 1.11 -0.10 0.44 0.52 -0.05 -1.41 118.95 119.41 1yq2 s ARG 122 Ca -0.02 -0.16 -0.01 0.00 -0.52 0.00 0.00 55.73 55.01 1yq2 s ARG 122 Cb -0.11 -1.13 0.03 0.00 0.52 0.00 0.00 34.95 34.26 1yq2 s ARG 122 CO 0.02 -0.14 -0.01 0.50 0.02 0.00 0.00 175.30 175.70 1yq2 s ARG 123 N 1.21 0.81 0.00 3.54 6.06 0.20 -1.73 118.95 129.04 1yq2 s ARG 123 Ca -0.06 -0.06 -0.16 0.00 -2.50 0.00 0.00 55.73 52.95 1yq2 s ARG 123 Cb -0.14 -1.30 -0.06 0.00 0.06 0.00 0.00 34.95 33.52 1yq2 s ARG 123 CO -0.02 -0.35 0.45 0.50 -2.50 0.00 0.00 175.30 173.38 1yq2 s ARG 124 N 1.89 4.03 0.17 5.12 6.06 -1.26 -0.22 118.95 134.74 1yq2 s ARG 124 Ca 0.04 0.49 -0.14 0.00 -2.50 0.00 0.00 55.73 53.62 1yq2 s ARG 124 Cb -0.13 -3.25 0.01 0.00 0.06 0.00 0.00 34.95 31.64 1yq2 s ARG 124 CO -0.06 0.62 0.39 -0.59 -2.50 0.00 0.00 175.30 173.16 1yq2 s PHE 125 N -0.88 0.08 -0.03 5.12 -0.12 -0.63 -4.98 117.98 116.53 1yq2 s PHE 125 Ca 0.25 -0.43 0.01 0.00 -0.05 0.00 0.00 56.93 56.71 1yq2 s PHE 125 Cb -0.17 0.18 -0.03 0.00 -0.63 0.00 0.00 43.02 42.36 1yq2 s PHE 125 CO 0.14 -0.79 -0.04 -0.51 -0.05 0.00 0.00 175.22 173.97 1yq2 s ASP 126 N -2.90 4.83 -0.09 1.98 -0.00 -1.26 0.00 116.67 119.24 1yq2 s ASP 126 Ca 0.11 -0.03 0.03 0.00 -0.00 0.00 0.00 52.55 52.66 1yq2 s ASP 126 Cb 0.01 -1.22 0.00 0.00 -0.00 0.00 0.00 42.92 41.71 1yq2 s ASP 126 CO -0.04 0.32 -0.20 -0.69 -0.00 0.00 0.00 175.17 174.56 1yq2 s VAL 127 N -0.94 1.78 0.26 -1.27 1.01 -0.20 -4.96 120.40 116.08 1yq2 s VAL 127 Ca 0.16 -0.86 -0.31 0.00 0.00 0.00 0.00 61.98 60.97 1yq2 s VAL 127 Cb -0.11 -1.56 -0.13 0.00 0.00 0.00 0.00 36.38 34.58 1yq2 s VAL 127 CO 0.05 0.50 1.44 -2.65 0.00 0.00 0.00 175.10 174.44 1yq2 n PRO 128 N 3.62 2.18 -0.27 2.72 -0.02 -1.26 -1.02 135.00 140.95 1yq2 n PRO 128 Ca -0.20 0.78 0.24 0.00 -2.02 0.00 0.00 63.50 62.29 1yq2 n PRO 128 Cb 0.53 -2.45 0.57 0.00 -0.02 0.00 0.00 33.50 32.12 1yq2 n PRO 128 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 h ALA 129 N 4.25 2.42 0.00 3.55 0.00 -1.94 -1.71 119.26 125.83 1yq2 h ALA 129 Ca -0.45 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1yq2 h ALA 129 Cb 1.27 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1yq2 h ALA 129 CO 0.76 -0.75 -0.01 0.37 0.00 0.00 0.00 179.25 179.62 1yq2 h GLN 130 N 0.29 0.00 0.00 0.00 4.15 -1.99 -2.07 115.11 115.49 1yq2 h GLN 130 Ca 0.52 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.94 1yq2 h GLN 130 Cb 1.50 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.19 1yq2 h GLN 130 CO -0.17 0.01 0.00 0.91 -1.93 0.00 0.00 178.83 177.65 1yq2 n TRP 131 N -3.12 0.00 0.30 3.99 7.02 -0.64 -2.47 117.44 122.52 1yq2 n TRP 131 Ca -0.01 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.54 1yq2 n TRP 131 Cb 0.21 -0.37 0.11 0.00 -2.42 0.00 0.00 31.31 28.84 1yq2 n TRP 131 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1yq2 n PHE 132 N -1.37 0.21 -1.84 -5.99 3.72 -0.78 -4.73 117.46 106.68 1yq2 n PHE 132 Ca 0.07 -0.18 -0.31 0.00 -0.05 0.00 0.00 57.45 56.98 1yq2 n PHE 132 Cb 0.17 -0.01 0.03 0.00 -0.94 0.00 0.00 39.48 38.73 1yq2 n PHE 132 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1yq2 s GLU 133 N -1.13 3.30 0.11 -1.08 2.02 -1.03 -4.95 118.70 115.94 1yq2 s GLU 133 Ca 0.21 0.68 0.12 0.00 0.02 0.00 0.00 54.97 56.00 1yq2 s GLU 133 Cb 0.13 -2.05 0.56 0.00 0.10 0.00 0.00 34.13 32.87 1yq2 s GLU 133 CO 0.19 -0.77 1.37 -1.13 0.02 0.00 0.00 175.26 174.94 1yq2 n SER 134 N -2.87 0.23 0.12 -0.19 3.41 -1.26 -1.59 113.62 111.47 1yq2 n SER 134 Ca 0.06 0.58 0.11 0.00 -0.26 0.00 0.00 58.87 59.37 1yq2 n SER 134 Cb 0.55 -0.62 0.48 0.00 -0.26 0.00 0.00 64.21 64.36 1yq2 n SER 134 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1yq2 n THR 135 N -1.78 0.87 -4.30 6.66 -2.24 -1.26 -4.59 114.28 107.63 1yq2 n THR 135 Ca 0.01 0.27 -0.34 0.00 -2.27 0.00 0.00 64.05 61.72 1yq2 n THR 135 Cb 0.08 -1.20 -0.13 0.00 -2.10 0.00 0.00 70.33 66.98 1yq2 n THR 135 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1yq2 s THR 136 N -3.31 3.59 0.00 4.28 2.01 -0.62 -0.58 115.64 121.02 1yq2 s THR 136 Ca 0.04 -0.45 0.04 0.00 0.31 0.00 0.00 61.69 61.63 1yq2 s THR 136 Cb 0.09 -2.59 -0.25 0.00 0.01 0.00 0.00 72.50 69.77 1yq2 s THR 136 CO 0.36 0.47 0.83 0.00 -0.69 0.00 0.00 174.62 175.60 1yq2 h ALA 137 N 7.20 0.48 -2.99 7.40 0.00 -0.84 -3.43 119.26 127.07 1yq2 h ALA 137 Ca -0.33 -1.22 -0.02 0.00 0.00 0.00 0.00 54.91 53.34 1yq2 h ALA 137 Cb 1.19 0.30 -0.12 0.00 0.00 0.00 0.00 17.79 19.16 1yq2 h ALA 137 CO 0.60 1.33 0.20 0.00 0.00 0.00 0.00 179.25 181.39 1yq2 s ALA 138 N -2.62 -1.56 -0.12 0.00 0.00 -1.19 -5.02 121.76 111.25 1yq2 s ALA 138 Ca -0.07 0.43 0.03 0.00 0.00 0.00 0.00 51.96 52.35 1yq2 s ALA 138 Cb 0.08 0.88 0.00 0.00 0.00 0.00 0.00 23.12 24.08 1yq2 s ALA 138 CO 0.83 -0.78 -0.22 -0.51 0.00 0.00 0.00 175.76 175.08 1yq2 s LEU 139 N -2.76 2.17 -0.12 0.00 1.43 -1.26 -1.16 118.68 116.98 1yq2 s LEU 139 Ca 0.02 -0.55 0.02 0.00 -1.03 0.00 0.00 54.13 52.58 1yq2 s LEU 139 Cb -0.01 -1.45 -0.00 0.00 0.03 0.00 0.00 46.19 44.76 1yq2 s LEU 139 CO -0.12 0.13 -0.19 -0.89 0.23 0.00 0.00 176.35 175.51 1yq2 s THR 140 N 0.55 2.44 -0.23 5.49 2.01 -0.22 -0.64 115.64 125.04 1yq2 s THR 140 Ca -0.13 -0.87 -0.10 0.00 0.31 0.00 0.00 61.69 60.89 1yq2 s THR 140 Cb -0.17 -1.98 -0.05 0.00 0.01 0.00 0.00 72.50 70.31 1yq2 s THR 140 CO 0.04 0.54 0.15 -0.22 -0.69 0.00 0.00 174.62 174.44 1yq2 s LEU 141 N 0.50 4.14 -0.11 4.42 2.96 0.15 -1.03 118.68 129.70 1yq2 s LEU 141 Ca -0.13 0.14 0.03 0.00 -0.22 0.00 0.00 54.13 53.95 1yq2 s LEU 141 Cb -0.17 -2.10 -0.00 0.00 0.50 0.00 0.00 46.19 44.42 1yq2 s LEU 141 CO 0.05 0.10 -0.21 -0.60 -1.32 0.00 0.00 176.35 174.37 1yq2 s ARG 142 N 0.87 3.15 -0.22 1.98 3.52 0.31 -0.51 118.95 128.06 1yq2 s ARG 142 Ca 0.08 -0.82 -0.04 0.00 -0.13 0.00 0.00 55.73 54.82 1yq2 s ARG 142 Cb -0.13 -2.41 -0.01 0.00 -1.56 0.00 0.00 34.95 30.85 1yq2 s ARG 142 CO 0.03 0.18 -0.05 -0.06 -0.81 0.00 0.00 175.30 174.59 1yq2 s PHE 143 N 0.38 2.95 -1.24 5.12 0.40 -0.39 -1.48 117.98 123.71 1yq2 s PHE 143 Ca -0.16 -0.93 0.28 0.00 -0.60 0.00 0.00 56.93 55.52 1yq2 s PHE 143 Cb -0.17 -2.10 1.00 0.00 0.51 0.00 0.00 43.02 42.26 1yq2 s PHE 143 CO 0.07 -0.54 1.74 -0.25 0.70 0.00 0.00 175.22 176.95 1yq2 n ASP 144 N 4.76 0.34 0.00 1.36 8.00 -0.65 -1.04 116.55 129.31 1yq2 n ASP 144 Ca -0.18 -0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.18 1yq2 n ASP 144 Cb 0.51 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 1yq2 n ASP 144 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yq2 n GLY 145 N 1.42 1.44 2.83 0.44 0.00 -1.26 -4.17 105.19 105.89 1yq2 n GLY 145 Ca 0.09 0.48 -0.14 0.00 0.00 0.00 0.00 46.02 46.45 1yq2 n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yq2 s VAL 146 N 0.00 -0.06 -0.26 1.61 1.01 -0.96 -2.41 120.40 119.33 1yq2 s VAL 146 Ca 0.00 0.20 -0.04 0.00 0.00 0.00 0.00 61.98 62.14 1yq2 s VAL 146 Cb 0.00 -0.14 0.01 0.00 0.00 0.00 0.00 36.38 36.25 1yq2 s VAL 146 CO 0.00 0.08 0.01 -0.70 0.00 0.00 0.00 175.10 174.49 1yq2 s GLU 147 N 1.10 3.06 -0.03 2.72 2.12 -0.34 -4.14 118.70 123.19 1yq2 s GLU 147 Ca -0.09 -0.85 0.01 0.00 0.36 0.00 0.00 54.97 54.40 1yq2 s GLU 147 Cb -0.12 -3.17 -0.03 0.00 0.26 0.00 0.00 34.13 31.06 1yq2 s GLU 147 CO -0.04 -0.38 -0.02 -1.13 -0.54 0.00 0.00 175.26 173.15 1yq2 n SER 148 N 4.79 3.89 -4.14 -1.70 3.41 -0.58 -1.44 113.62 117.85 1yq2 n SER 148 Ca -0.16 -0.01 -0.21 0.00 -0.26 0.00 0.00 58.87 58.23 1yq2 n SER 148 Cb 0.48 0.14 -0.14 0.00 -0.26 0.00 0.00 64.21 64.43 1yq2 n SER 148 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1yq2 s ARG 149 N -2.07 1.01 0.02 4.33 3.52 -1.22 -4.04 118.95 120.51 1yq2 s ARG 149 Ca -0.04 -0.69 -0.08 0.00 -0.13 0.00 0.00 55.73 54.80 1yq2 s ARG 149 Cb 0.01 -1.01 -0.00 0.00 -1.56 0.00 0.00 34.95 32.39 1yq2 s ARG 149 CO 0.10 0.26 0.15 1.52 -0.81 0.00 0.00 175.30 176.52 1yq2 s TYR 150 N -0.69 0.08 0.07 5.12 -0.85 -0.92 -1.11 117.35 119.05 1yq2 s TYR 150 Ca 0.03 -0.26 0.09 0.00 -0.52 0.00 0.00 57.07 56.41 1yq2 s TYR 150 Cb -0.07 -0.06 -0.03 0.00 0.38 0.00 0.00 41.96 42.18 1yq2 s TYR 150 CO 0.01 -0.36 -0.26 0.21 -1.52 0.00 0.00 175.55 173.63 1yq2 s LYS 151 N -2.10 1.62 -0.06 -3.49 2.20 -0.25 -0.57 119.74 117.09 1yq2 s LYS 151 Ca -0.09 -1.16 0.04 0.00 -0.36 0.00 0.00 55.97 54.40 1yq2 s LYS 151 Cb -0.04 -1.88 0.00 0.00 -1.51 0.00 0.00 37.83 34.40 1yq2 s LYS 151 CO -0.02 0.47 -0.18 0.08 -0.36 0.00 0.00 175.35 175.35 1yq2 s VAL 152 N -0.88 1.53 0.01 4.02 1.01 -0.32 -0.94 120.40 124.83 1yq2 s VAL 152 Ca 0.12 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.39 1yq2 s VAL 152 Cb -0.10 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1yq2 s VAL 152 CO 0.03 0.44 -0.14 0.26 0.00 0.00 0.00 175.10 175.69 1yq2 s TRP 153 N 0.21 1.22 -0.10 5.22 0.51 0.04 -0.61 118.94 125.42 1yq2 s TRP 153 Ca -0.09 -0.27 0.01 0.00 -2.12 0.00 0.00 56.10 53.64 1yq2 s TRP 153 Cb -0.14 -0.77 0.02 0.00 -0.81 0.00 0.00 33.47 31.77 1yq2 s TRP 153 CO 0.04 -0.00 -0.12 0.08 -0.51 0.00 0.00 176.95 176.44 1yq2 s VAL 154 N -0.48 1.25 -1.44 4.03 1.01 0.03 -0.92 120.40 123.87 1yq2 s VAL 154 Ca 0.04 -0.48 -0.13 0.00 0.00 0.00 0.00 61.98 61.41 1yq2 s VAL 154 Cb -0.06 -1.18 0.10 0.00 0.00 0.00 0.00 36.38 35.25 1yq2 s VAL 154 CO 0.00 0.39 0.65 0.59 0.00 0.00 0.00 175.10 176.73 1yq2 n ASN 155 N 4.35 -3.70 0.00 3.32 3.02 -0.12 -0.45 115.26 121.68 1yq2 n ASN 155 Ca -0.18 -0.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.73 1yq2 n ASN 155 Cb 0.51 -3.04 0.00 0.00 -0.61 0.00 0.00 39.78 36.64 1yq2 n ASN 155 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yq2 n GLY 156 N -1.30 1.59 3.75 7.41 0.00 -1.24 -4.84 105.19 110.56 1yq2 n GLY 156 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1yq2 n GLY 156 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yq2 s GLN 157 N -0.43 4.20 0.12 1.61 -0.21 0.41 -4.84 119.66 120.52 1yq2 s GLN 157 Ca 0.00 0.26 -0.31 0.00 0.02 0.00 0.00 55.36 55.32 1yq2 s GLN 157 Cb 0.00 -3.39 -0.09 0.00 1.00 0.00 0.00 33.01 30.53 1yq2 s GLN 157 CO 0.00 0.31 1.56 -2.00 -2.12 0.00 0.00 175.29 173.04 1yq2 s GLU 158 N 0.20 4.23 -0.22 2.91 2.12 -1.26 -0.79 118.70 125.89 1yq2 s GLU 158 Ca 0.21 2.29 -0.01 0.00 0.36 0.00 0.00 54.97 57.81 1yq2 s GLU 158 Cb -0.14 -3.33 -0.13 0.00 0.26 0.00 0.00 34.13 30.78 1yq2 s GLU 158 CO 0.08 -0.62 -0.22 -0.89 -0.54 0.00 0.00 175.26 173.07 1yq2 n ILE 159 N 4.25 1.25 -3.54 -3.70 2.08 0.22 -4.92 119.36 114.99 1yq2 n ILE 159 Ca 0.14 -0.44 0.00 0.00 0.56 0.00 0.00 62.75 63.01 1yq2 n ILE 159 Cb 0.40 -1.39 0.00 0.00 -0.75 0.00 0.00 39.64 37.90 1yq2 n ILE 159 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1yq2 n GLY 160 N 2.26 -1.44 3.01 7.39 0.00 -1.19 -0.53 105.19 114.70 1yq2 n GLY 160 Ca -0.40 -1.15 -0.22 0.00 0.00 0.00 0.00 46.02 44.25 1yq2 n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yq2 s VAL 161 N -2.93 0.96 0.11 1.61 1.01 -0.48 -1.17 120.40 119.50 1yq2 s VAL 161 Ca 0.00 -0.42 0.08 0.00 0.00 0.00 0.00 61.98 61.64 1yq2 s VAL 161 Cb 0.00 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 1yq2 s VAL 161 CO 0.00 0.30 -0.12 -0.83 0.00 0.00 0.00 175.10 174.45 1yq2 s GLY 162 N 0.42 1.76 0.05 4.51 0.00 0.26 -1.81 107.32 112.51 1yq2 s GLY 162 Ca -0.08 -1.27 -0.02 0.00 0.00 0.00 0.00 44.72 43.35 1yq2 s GLY 162 CO 0.02 -1.25 -0.00 -0.56 0.00 0.00 0.00 173.10 171.30 1yq2 s SER 163 N -2.18 0.40 0.00 1.64 0.01 -1.26 -2.16 113.70 110.16 1yq2 s SER 163 Ca 0.20 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.60 1yq2 s SER 163 Cb -0.11 0.20 0.00 0.00 0.21 0.00 0.00 66.02 66.32 1yq2 s SER 163 CO 0.13 -0.56 0.00 0.61 0.41 0.00 0.00 173.24 173.83 1yq2 n GLY 164 N 0.37 -0.33 0.24 3.44 0.00 -1.26 -4.88 105.19 102.78 1yq2 n GLY 164 Ca -0.16 -0.70 -0.03 0.00 0.00 0.00 0.00 46.02 45.13 1yq2 n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1yq2 h SER 165 N 0.00 0.50 -0.46 1.61 0.02 -1.78 -1.87 113.55 111.56 1yq2 h SER 165 Ca 0.00 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1yq2 h SER 165 Cb 0.00 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.41 1yq2 h SER 165 CO 0.00 0.71 0.00 0.54 -1.14 0.00 0.00 176.83 176.94 1yq2 n ARG 166 N -4.14 3.76 -4.32 3.45 3.00 -1.26 -2.27 116.66 114.87 1yq2 n ARG 166 Ca -0.00 -2.89 -0.32 0.00 -0.01 0.00 0.00 57.85 54.63 1yq2 n ARG 166 Cb 0.38 -1.94 -0.09 0.00 0.00 0.00 0.00 32.46 30.81 1yq2 n ARG 166 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1yq2 s LEU 167 N -2.41 3.36 0.43 0.55 1.43 -0.71 -4.46 118.68 116.86 1yq2 s LEU 167 Ca 0.47 -0.11 -0.22 0.00 -1.03 0.00 0.00 54.13 53.24 1yq2 s LEU 167 Cb 0.34 -1.96 -0.10 0.00 0.03 0.00 0.00 46.19 44.50 1yq2 s LEU 167 CO 0.15 0.26 0.98 0.00 0.23 0.00 0.00 176.35 177.98 1yq2 s ALA 168 N -1.10 3.03 -0.06 4.21 0.00 -1.26 -4.34 121.76 122.23 1yq2 s ALA 168 Ca 0.20 0.51 -0.03 0.00 0.00 0.00 0.00 51.96 52.64 1yq2 s ALA 168 Cb -0.11 -3.20 0.04 0.00 0.00 0.00 0.00 23.12 19.85 1yq2 s ALA 168 CO 0.11 -0.02 0.13 -1.14 0.00 0.00 0.00 175.76 174.84 1yq2 s GLN 169 N -2.95 0.06 -0.02 0.00 2.00 -0.21 -5.01 119.66 113.53 1yq2 s GLN 169 Ca 0.61 0.39 0.02 0.00 -2.00 0.00 0.00 55.36 54.38 1yq2 s GLN 169 Cb -0.14 -0.22 -0.03 0.00 0.80 0.00 0.00 33.01 33.42 1yq2 s GLN 169 CO 0.18 -0.20 -0.03 -1.21 -0.50 0.00 0.00 175.29 173.53 1yq2 s GLU 170 N 1.42 2.72 0.11 1.67 2.02 -1.26 -1.27 118.70 124.10 1yq2 s GLU 170 Ca -0.06 -0.62 0.09 0.00 0.02 0.00 0.00 54.97 54.39 1yq2 s GLU 170 Cb -0.12 -2.61 -0.04 0.00 0.10 0.00 0.00 34.13 31.46 1yq2 s GLU 170 CO -0.05 0.63 -0.22 -0.06 0.02 0.00 0.00 175.26 175.57 1yq2 s PHE 171 N -1.00 1.91 -0.43 1.61 0.40 0.34 -1.40 117.98 119.40 1yq2 s PHE 171 Ca 0.17 -0.41 -0.20 0.00 -0.60 0.00 0.00 56.93 55.89 1yq2 s PHE 171 Cb -0.11 -1.04 0.02 0.00 0.51 0.00 0.00 43.02 42.40 1yq2 s PHE 171 CO 0.07 0.23 0.61 0.34 0.70 0.00 0.00 175.22 177.18 1yq2 s ASP 172 N -1.93 6.31 -0.17 1.36 3.68 -0.23 -0.67 116.67 125.03 1yq2 s ASP 172 Ca 0.08 -0.34 0.17 0.00 2.13 0.00 0.00 52.55 54.58 1yq2 s ASP 172 Cb -0.10 -2.31 0.51 0.00 -1.45 0.00 0.00 42.92 39.57 1yq2 s ASP 172 CO 0.05 -0.74 1.40 1.33 0.13 0.00 0.00 175.17 177.34 1yq2 n VAL 173 N 5.78 2.21 -0.30 1.11 0.24 0.19 -4.71 118.33 122.84 1yq2 n VAL 173 Ca -0.02 -1.87 0.07 0.00 -2.04 0.00 0.00 64.34 60.47 1yq2 n VAL 173 Cb 0.48 -0.22 0.22 0.00 -1.47 0.00 0.00 33.84 32.84 1yq2 n VAL 173 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1yq2 h SER 174 N 1.69 0.61 0.54 -1.34 0.02 -1.89 -1.86 113.55 111.33 1yq2 h SER 174 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1yq2 h SER 174 Cb 1.39 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.90 1yq2 h SER 174 CO 0.20 0.29 -0.37 0.47 -1.14 0.00 0.00 176.83 176.27 1yq2 n ASP 175 N -4.81 0.48 -0.09 3.07 8.00 -1.26 -4.15 116.55 117.78 1yq2 n ASP 175 Ca 0.17 -0.22 -0.10 0.00 0.71 0.00 0.00 54.79 55.35 1yq2 n ASP 175 Cb 0.40 0.10 -0.15 0.00 -0.02 0.00 0.00 41.12 41.45 1yq2 n ASP 175 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yq2 n ALA 176 N -1.37 1.53 -1.52 2.24 0.00 -0.75 -4.98 120.51 115.65 1yq2 n ALA 176 Ca 0.07 -1.27 -0.31 0.00 0.00 0.00 0.00 53.44 51.93 1yq2 n ALA 176 Cb 0.33 -0.16 0.06 0.00 0.00 0.00 0.00 19.45 19.69 1yq2 n ALA 176 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yq2 s LEU 177 N -5.42 3.07 0.07 0.00 1.43 -0.93 -4.67 118.68 112.24 1yq2 s LEU 177 Ca -0.10 1.62 -0.05 0.00 -1.03 0.00 0.00 54.13 54.57 1yq2 s LEU 177 Cb 0.06 -4.45 -0.02 0.00 0.03 0.00 0.00 46.19 41.81 1yq2 s LEU 177 CO 0.78 -1.57 0.09 0.00 0.23 0.00 0.00 176.35 175.88 1yq2 s ARG 178 N -5.03 0.73 0.42 1.70 1.70 -1.26 -5.02 118.95 112.18 1yq2 s ARG 178 Ca 0.59 -1.06 -0.25 0.00 -0.47 0.00 0.00 55.73 54.54 1yq2 s ARG 178 Cb -0.15 0.28 -0.08 0.00 -0.57 0.00 0.00 34.95 34.43 1yq2 s ARG 178 CO 0.55 -0.19 1.24 0.00 -1.08 0.00 0.00 175.30 175.82 1yq2 s ALA 179 N -3.82 3.16 0.00 7.88 0.00 -1.26 -4.55 121.76 123.16 1yq2 s ALA 179 Ca 0.05 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.12 1yq2 s ALA 179 Cb 0.06 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1yq2 s ALA 179 CO -0.10 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 175.34 1yq2 n GLY 180 N 0.64 0.63 3.73 0.00 0.00 -0.19 -4.91 105.19 105.08 1yq2 n GLY 180 Ca 0.05 -1.18 -0.41 0.00 0.00 0.00 0.00 46.02 44.47 1yq2 n GLY 180 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1yq2 s SER 181 N -4.00 7.31 0.09 1.61 0.15 -1.26 -1.03 113.70 116.56 1yq2 s SER 181 Ca 0.00 1.95 0.02 0.00 0.70 0.00 0.00 55.95 58.63 1yq2 s SER 181 Cb 0.00 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.68 1yq2 s SER 181 CO 0.00 -0.23 -0.08 0.20 1.20 0.00 0.00 173.24 174.34 1yq2 s ASN 182 N 0.24 1.17 -0.10 5.45 0.01 0.10 -4.86 114.94 116.95 1yq2 s ASN 182 Ca 0.51 -0.88 0.04 0.00 -0.71 0.00 0.00 52.86 51.81 1yq2 s ASN 182 Cb -0.27 0.06 -0.00 0.00 0.41 0.00 0.00 41.25 41.45 1yq2 s ASN 182 CO 0.32 -0.37 -0.24 -0.22 -1.51 0.00 0.00 177.10 175.08 1yq2 s LEU 183 N -2.66 2.07 -0.13 0.60 2.96 -1.26 -1.61 118.68 118.66 1yq2 s LEU 183 Ca 0.07 -0.55 0.00 0.00 -0.22 0.00 0.00 54.13 53.43 1yq2 s LEU 183 Cb 0.01 -1.39 -0.01 0.00 0.50 0.00 0.00 46.19 45.30 1yq2 s LEU 183 CO -0.03 0.16 -0.14 -0.22 -1.32 0.00 0.00 176.35 174.80 1yq2 s LEU 184 N 0.33 2.67 -0.08 -0.68 2.96 0.69 -0.94 118.68 123.62 1yq2 s LEU 184 Ca -0.18 -0.34 0.03 0.00 -0.22 0.00 0.00 54.13 53.41 1yq2 s LEU 184 Cb -0.18 -1.59 0.01 0.00 0.50 0.00 0.00 46.19 44.93 1yq2 s LEU 184 CO 0.09 0.17 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.42 1yq2 s VAL 185 N 0.33 1.53 -0.07 1.68 1.01 -0.10 -0.63 120.40 124.15 1yq2 s VAL 185 Ca -0.11 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1yq2 s VAL 185 Cb -0.16 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 34.88 1yq2 s VAL 185 CO 0.06 0.44 -0.10 -0.69 0.00 0.00 0.00 175.10 174.81 1yq2 s VAL 186 N 0.55 1.03 -0.21 2.92 1.01 -0.50 -0.78 120.40 124.41 1yq2 s VAL 186 Ca -0.16 -0.39 -0.07 0.00 0.00 0.00 0.00 61.98 61.37 1yq2 s VAL 186 Cb -0.17 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1yq2 s VAL 186 CO 0.06 0.34 0.05 -0.60 0.00 0.00 0.00 175.10 174.95 1yq2 s ARG 187 N 0.94 3.77 -0.12 2.72 3.52 -0.11 -0.77 118.95 128.89 1yq2 s ARG 187 Ca -0.10 -0.44 0.03 0.00 -0.13 0.00 0.00 55.73 55.10 1yq2 s ARG 187 Cb -0.15 -3.22 0.00 0.00 -1.56 0.00 0.00 34.95 30.02 1yq2 s ARG 187 CO 0.01 0.04 -0.22 0.08 -0.81 0.00 0.00 175.30 174.40 1yq2 s VAL 188 N 0.98 2.12 -0.13 7.11 1.01 0.93 -1.09 120.40 131.32 1yq2 s VAL 188 Ca 0.03 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 60.99 1yq2 s VAL 188 Cb -0.14 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 1yq2 s VAL 188 CO 0.03 0.55 0.03 -1.00 0.00 0.00 0.00 175.10 174.71 1yq2 s HIS 189 N 0.59 3.22 0.08 5.22 0.09 -0.27 -0.20 115.29 124.02 1yq2 s HIS 189 Ca -0.12 0.12 -0.26 0.00 -0.00 0.00 0.00 55.06 54.79 1yq2 s HIS 189 Cb -0.17 -1.92 -0.16 0.00 -0.00 0.00 0.00 32.58 30.33 1yq2 s HIS 189 CO 0.03 0.32 1.69 0.37 -0.00 0.00 0.00 174.74 177.16 1yq2 h GLN 190 N 5.87 -0.29 -5.79 1.40 4.15 -1.15 -1.54 115.11 117.75 1yq2 h GLN 190 Ca -0.44 0.02 -0.67 0.00 0.77 0.00 0.00 58.65 58.34 1yq2 h GLN 190 Cb 1.19 0.07 -0.15 0.00 0.21 0.00 0.00 27.48 28.80 1yq2 h GLN 190 CO 0.61 -0.19 -0.60 -1.58 -1.93 0.00 0.00 178.83 175.14 1yq2 s TRP 191 N -6.11 3.21 0.36 3.99 0.23 -1.26 -3.93 118.94 115.42 1yq2 s TRP 191 Ca -0.15 0.17 -0.12 0.00 -2.03 0.00 0.00 56.10 53.97 1yq2 s TRP 191 Cb 0.05 -1.86 0.03 0.00 0.03 0.00 0.00 33.47 31.73 1yq2 s TRP 191 CO 0.65 0.41 0.68 -1.54 0.96 0.00 0.00 176.95 178.11 1yq2 s SER 192 N -0.63 0.25 0.44 2.95 1.04 -1.26 -4.91 113.70 111.58 1yq2 s SER 192 Ca 0.11 -1.20 0.19 0.00 0.48 0.00 0.00 55.95 55.52 1yq2 s SER 192 Cb -0.12 0.78 1.13 0.00 0.10 0.00 0.00 66.02 67.91 1yq2 s SER 192 CO 0.02 -1.53 1.90 0.00 0.98 0.00 0.00 173.24 174.61 1yq2 h ALA 193 N 2.04 2.25 0.00 5.32 0.00 -1.43 0.03 119.26 127.47 1yq2 h ALA 193 Ca -0.30 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1yq2 h ALA 193 Cb 1.25 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1yq2 h ALA 193 CO 0.39 -0.49 -0.03 0.00 0.00 0.00 0.00 179.25 179.12 1yq2 h ALA 194 N 1.63 1.51 -0.22 0.00 0.00 -1.86 -2.51 119.26 117.81 1yq2 h ALA 194 Ca 0.40 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1yq2 h ALA 194 Cb 1.07 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1yq2 h ALA 194 CO -0.12 0.03 0.15 0.77 0.00 0.00 0.00 179.25 180.08 1yq2 h SER 195 N 0.00 0.24 0.14 0.00 0.02 -1.33 -0.08 113.55 112.54 1yq2 h SER 195 Ca -0.00 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1yq2 h SER 195 Cb 0.07 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.55 1yq2 h SER 195 CO 0.00 0.18 -0.07 1.88 -1.14 0.00 0.00 176.83 177.68 1yq2 h TYR 196 N 0.29 0.00 -0.14 3.45 -1.99 -1.60 -2.35 116.97 114.63 1yq2 h TYR 196 Ca 0.08 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.81 1yq2 h TYR 196 Cb -0.02 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.71 1yq2 h TYR 196 CO -0.00 0.07 0.00 1.28 -0.00 0.00 0.00 178.16 179.51 1yq2 n LEU 197 N -3.95 1.98 -2.58 3.88 4.77 -0.05 -4.47 117.00 116.57 1yq2 n LEU 197 Ca -0.03 -0.77 -0.17 0.00 -0.03 0.00 0.00 56.01 55.02 1yq2 n LEU 197 Cb 0.15 -0.08 0.02 0.00 -2.33 0.00 0.00 43.42 41.18 1yq2 n LEU 197 CO 0.30 0.39 0.01 -0.62 -1.33 0.00 0.00 177.39 176.14 1yq2 n GLU 198 N 0.53 2.12 -1.02 3.23 1.02 -0.88 -0.68 120.64 124.96 1yq2 n GLU 198 Ca 0.17 -3.79 -0.22 0.00 -0.02 0.00 0.00 57.16 53.30 1yq2 n GLU 198 Cb 0.40 -1.67 0.07 0.00 -0.02 0.00 0.00 31.44 30.22 1yq2 n GLU 198 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1yq2 n ASP 199 N -0.24 6.19 -4.73 1.62 2.03 -0.26 -4.94 116.55 116.22 1yq2 n ASP 199 Ca 0.22 -3.30 -0.36 0.00 0.52 0.00 0.00 54.79 51.87 1yq2 n ASP 199 Cb 0.75 -0.96 0.07 0.00 -0.72 0.00 0.00 41.12 40.27 1yq2 n ASP 199 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1yq2 s GLN 200 N -2.54 2.43 -1.01 -0.67 1.11 -1.26 -4.71 119.66 113.01 1yq2 s GLN 200 Ca 0.43 1.89 -0.23 0.00 0.01 0.00 0.00 55.36 57.46 1yq2 s GLN 200 Cb 0.34 -1.85 0.03 0.00 -1.01 0.00 0.00 33.01 30.52 1yq2 s GLN 200 CO 0.01 -1.65 1.58 0.34 0.01 0.00 0.00 175.29 175.58 1yq2 s ASP 201 N -1.70 6.19 0.09 5.90 2.15 -1.26 -4.84 116.67 123.20 1yq2 s ASP 201 Ca 0.78 -1.31 -0.26 0.00 0.43 0.00 0.00 52.55 52.19 1yq2 s ASP 201 Cb -0.33 -2.57 0.09 0.00 -0.30 0.00 0.00 42.92 39.81 1yq2 s ASP 201 CO 0.41 -1.80 1.15 0.00 -0.17 0.00 0.00 175.17 174.76 1yq2 s GLN 202 N 5.43 0.87 0.33 4.34 -2.07 -1.21 -5.01 119.66 122.34 1yq2 s GLN 202 Ca 0.52 -0.55 -0.28 0.00 -1.82 0.00 0.00 55.36 53.23 1yq2 s GLN 202 Cb -0.01 0.26 -0.09 0.00 -1.09 0.00 0.00 33.01 32.07 1yq2 s GLN 202 CO -0.07 -0.41 1.17 -1.58 -1.32 0.00 0.00 175.29 173.08 1yq2 s TRP 203 N -2.28 3.30 -0.27 9.60 0.52 -1.26 -3.89 118.94 124.65 1yq2 s TRP 203 Ca 0.22 1.58 -0.27 0.00 0.02 0.00 0.00 56.10 57.65 1yq2 s TRP 203 Cb -0.01 -3.42 0.01 0.00 -1.15 0.00 0.00 33.47 28.91 1yq2 s TRP 203 CO 0.02 -1.09 0.98 -1.58 0.02 0.00 0.00 176.95 175.29 1yq2 s TRP 204 N -1.23 3.25 -0.41 -1.98 0.52 0.83 -4.94 118.94 114.98 1yq2 s TRP 204 Ca 0.49 1.22 0.01 0.00 0.02 0.00 0.00 56.10 57.84 1yq2 s TRP 204 Cb -0.33 -3.37 0.14 0.00 -1.15 0.00 0.00 33.47 28.76 1yq2 s TRP 204 CO 0.43 -0.58 0.24 -0.51 0.02 0.00 0.00 176.95 176.55 1yq2 s LEU 205 N 3.26 1.94 0.69 2.99 1.43 -1.26 -3.30 118.68 124.43 1yq2 s LEU 205 Ca 0.41 -2.49 -0.11 0.00 -1.03 0.00 0.00 54.13 50.91 1yq2 s LEU 205 Cb -0.14 -0.74 0.01 0.00 0.03 0.00 0.00 46.19 45.34 1yq2 s LEU 205 CO 0.10 -0.27 1.06 -2.16 0.23 0.00 0.00 176.35 175.31 1yq2 s PRO 206 N 0.60 2.95 0.00 1.29 0.04 -1.26 -4.78 135.00 133.84 1yq2 s PRO 206 Ca 0.19 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.21 1yq2 s PRO 206 Cb -0.22 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1yq2 s PRO 206 CO -0.01 -1.09 0.00 0.41 0.04 0.00 0.00 177.00 176.35 1yq2 n GLY 207 N -1.88 2.51 3.49 0.56 0.00 -0.52 -2.36 105.19 106.99 1yq2 n GLY 207 Ca 0.08 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.80 1yq2 n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yq2 s ILE 208 N -1.72 4.29 -1.48 -0.61 1.01 -1.22 -1.20 121.20 120.27 1yq2 s ILE 208 Ca 0.00 -0.71 0.12 0.00 0.00 0.00 0.00 60.65 60.06 1yq2 s ILE 208 Cb 0.00 -4.82 0.11 0.00 0.01 0.00 0.00 42.46 37.76 1yq2 s ILE 208 CO 0.00 -1.62 0.91 2.22 0.00 0.00 0.00 174.94 176.44 1yq2 n PHE 209 N 7.81 0.03 -4.45 3.97 1.16 -1.01 -1.21 117.46 123.76 1yq2 n PHE 209 Ca 0.13 -0.03 -0.22 0.00 -1.87 0.00 0.00 57.45 55.45 1yq2 n PHE 209 Cb 0.48 -0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 38.26 1yq2 n PHE 209 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 1yq2 s ARG 210 N -1.00 1.74 0.65 3.97 0.52 -1.07 -4.36 118.95 119.39 1yq2 s ARG 210 Ca 0.15 -2.01 -0.18 0.00 -0.52 0.00 0.00 55.73 53.17 1yq2 s ARG 210 Cb 0.10 -0.63 -0.02 0.00 0.52 0.00 0.00 34.95 34.92 1yq2 s ARG 210 CO 0.15 -0.34 1.17 -0.25 0.02 0.00 0.00 175.30 176.05 1yq2 n ASP 211 N -0.94 1.54 -4.04 0.23 9.92 -1.26 -4.58 116.55 117.42 1yq2 n ASP 211 Ca -0.03 0.80 -0.31 0.00 -0.53 0.00 0.00 54.79 54.72 1yq2 n ASP 211 Cb 0.66 -1.50 -0.16 0.00 -0.64 0.00 0.00 41.12 39.48 1yq2 n ASP 211 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1yq2 s VAL 212 N -1.48 1.70 0.08 2.53 1.01 -1.26 -1.63 120.40 121.36 1yq2 s VAL 212 Ca 0.80 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 62.07 1yq2 s VAL 212 Cb -0.38 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1yq2 s VAL 212 CO 0.43 0.47 -0.06 0.42 0.00 0.00 0.00 175.10 176.36 1yq2 s THR 213 N 1.43 0.61 0.03 3.92 -4.23 -0.55 -0.54 115.64 116.32 1yq2 s THR 213 Ca 0.05 -1.79 0.08 0.00 -1.18 0.00 0.00 61.69 58.85 1yq2 s THR 213 Cb -0.13 -1.50 -0.03 0.00 1.34 0.00 0.00 72.50 72.19 1yq2 s THR 213 CO -0.11 -0.81 -0.24 -0.22 -0.54 0.00 0.00 174.62 172.69 1yq2 s LEU 214 N -2.80 2.15 -0.01 4.79 2.96 0.26 -0.53 118.68 125.50 1yq2 s LEU 214 Ca 0.08 -0.54 0.01 0.00 -0.22 0.00 0.00 54.13 53.46 1yq2 s LEU 214 Cb 0.03 -1.18 -0.00 0.00 0.50 0.00 0.00 46.19 45.54 1yq2 s LEU 214 CO -0.05 0.23 -0.05 -1.58 -1.32 0.00 0.00 176.35 173.59 1yq2 s GLN 215 N -1.11 0.43 -0.50 1.98 0.74 -0.20 -0.94 119.66 120.06 1yq2 s GLN 215 Ca 0.10 -0.16 -0.17 0.00 0.05 0.00 0.00 55.36 55.17 1yq2 s GLN 215 Cb -0.09 -0.43 0.07 0.00 1.10 0.00 0.00 33.01 33.65 1yq2 s GLN 215 CO 0.01 0.09 0.52 0.00 -0.55 0.00 0.00 175.29 175.36 1yq2 s ALA 216 N -0.00 3.48 -0.23 1.58 0.00 0.32 -1.05 121.76 125.85 1yq2 s ALA 216 Ca 0.00 -1.96 -0.29 0.00 0.00 0.00 0.00 51.96 49.72 1yq2 s ALA 216 Cb -0.03 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.84 1yq2 s ALA 216 CO -0.00 -1.89 1.64 1.03 0.00 0.00 0.00 175.76 176.53 1yq2 s ARG 217 N 2.14 3.74 0.41 0.00 1.81 -0.31 -4.04 118.95 122.70 1yq2 s ARG 217 Ca 0.09 1.63 -0.26 0.00 -1.72 0.00 0.00 55.73 55.48 1yq2 s ARG 217 Cb -0.22 -4.05 -0.08 0.00 -0.45 0.00 0.00 34.95 30.14 1yq2 s ARG 217 CO 0.09 -1.36 1.25 -2.14 -0.68 0.00 0.00 175.30 172.46 1yq2 s PRO 218 N 4.79 3.98 0.19 3.54 0.02 -1.26 -0.26 135.00 145.99 1yq2 s PRO 218 Ca 0.72 2.04 -0.30 0.00 0.02 0.00 0.00 61.00 63.48 1yq2 s PRO 218 Cb -0.25 -2.72 -0.09 0.00 0.02 0.00 0.00 34.50 31.47 1yq2 s PRO 218 CO 0.30 -0.45 1.40 0.00 -0.33 0.00 0.00 177.00 177.92 1yq2 s ALA 219 N -1.32 3.61 -0.51 -1.55 0.00 0.26 -1.50 121.76 120.75 1yq2 s ALA 219 Ca 0.57 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.75 1yq2 s ALA 219 Cb -0.35 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.23 1yq2 s ALA 219 CO 0.45 -0.65 0.00 0.41 0.00 0.00 0.00 175.76 175.97 1yq2 n GLY 220 N 2.75 0.71 2.44 0.00 0.00 -1.26 -4.74 105.19 105.08 1yq2 n GLY 220 Ca 0.09 -0.83 -0.17 0.00 0.00 0.00 0.00 46.02 45.10 1yq2 n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 221 N -2.29 -0.65 3.17 -0.02 0.00 -0.56 -4.28 105.19 100.55 1yq2 n GLY 221 Ca -0.05 -1.80 -0.35 0.00 0.00 0.00 0.00 46.02 43.82 1yq2 n GLY 221 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yq2 s ILE 222 N -2.50 3.10 0.08 -0.61 1.01 -1.26 -4.37 121.20 116.65 1yq2 s ILE 222 Ca 0.46 -1.49 -0.22 0.00 0.00 0.00 0.00 60.65 59.40 1yq2 s ILE 222 Cb -0.02 -2.85 -0.12 0.00 0.01 0.00 0.00 42.46 39.49 1yq2 s ILE 222 CO 0.31 -0.22 1.64 0.74 0.00 0.00 0.00 174.94 177.41 1yq2 h THR 223 N 6.43 1.13 -3.49 2.92 2.02 -1.50 -3.46 112.91 116.95 1yq2 h THR 223 Ca -0.20 -0.37 -0.11 0.00 0.77 0.00 0.00 66.41 66.50 1yq2 h THR 223 Cb 1.06 1.17 -0.18 0.00 -1.74 0.00 0.00 68.15 68.47 1yq2 h THR 223 CO 0.57 0.11 -0.38 -0.62 0.37 0.00 0.00 175.52 175.57 1yq2 s ASP 224 N -5.45 -0.00 -0.07 4.18 2.15 -1.03 -4.85 116.67 111.59 1yq2 s ASP 224 Ca -0.14 -0.30 -0.07 0.00 0.43 0.00 0.00 52.55 52.48 1yq2 s ASP 224 Cb 0.06 0.29 0.02 0.00 -0.30 0.00 0.00 42.92 42.99 1yq2 s ASP 224 CO 0.69 -0.54 0.20 0.00 -0.17 0.00 0.00 175.17 175.35 1yq2 s ALA 225 N -2.36 -0.49 -0.20 3.66 0.00 -1.26 -0.56 121.76 120.56 1yq2 s ALA 225 Ca -0.07 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.43 1yq2 s ALA 225 Cb -0.02 -0.30 0.05 0.00 0.00 0.00 0.00 23.12 22.84 1yq2 s ALA 225 CO -0.03 -0.10 -0.09 -0.46 0.00 0.00 0.00 175.76 175.09 1yq2 s TRP 226 N 0.03 2.32 -0.81 0.00 -0.00 0.14 -4.87 118.94 115.76 1yq2 s TRP 226 Ca -0.01 -1.55 -0.14 0.00 -0.00 0.00 0.00 56.10 54.41 1yq2 s TRP 226 Cb -0.02 -1.59 0.21 0.00 -0.00 0.00 0.00 33.47 32.08 1yq2 s TRP 226 CO 0.00 -0.73 0.74 -0.51 -0.00 0.00 0.00 176.95 176.45 1yq2 s LEU 227 N 1.43 6.67 -0.31 5.86 1.43 -1.26 -1.05 118.68 131.45 1yq2 s LEU 227 Ca -0.02 -2.66 -0.25 0.00 -1.03 0.00 0.00 54.13 50.17 1yq2 s LEU 227 Cb -0.16 -2.19 0.01 0.00 0.03 0.00 0.00 46.19 43.87 1yq2 s LEU 227 CO -0.08 -0.57 0.86 -0.60 0.23 0.00 0.00 176.35 176.19 1yq2 s ARG 228 N 0.21 3.99 0.35 1.70 3.52 -1.17 -4.90 118.95 122.66 1yq2 s ARG 228 Ca 0.17 0.72 0.07 0.00 -0.13 0.00 0.00 55.73 56.56 1yq2 s ARG 228 Cb -0.11 -3.73 -0.02 0.00 -1.56 0.00 0.00 34.95 29.53 1yq2 s ARG 228 CO -0.08 -0.74 0.39 0.95 -0.81 0.00 0.00 175.30 175.01 1yq2 s THR 229 N 3.14 3.55 0.29 4.11 -4.23 -1.26 0.09 115.64 121.33 1yq2 s THR 229 Ca 0.36 -1.21 -0.20 0.00 -1.18 0.00 0.00 61.69 59.46 1yq2 s THR 229 Cb -0.14 -3.22 0.02 0.00 1.34 0.00 0.00 72.50 70.51 1yq2 s THR 229 CO 0.13 -0.13 0.73 -0.83 -0.54 0.00 0.00 174.62 173.98 1yq2 s GLY 230 N -4.10 -0.02 -0.07 3.99 0.00 -0.59 -4.58 107.32 101.95 1yq2 s GLY 230 Ca 0.45 -0.38 -0.23 0.00 0.00 0.00 0.00 44.72 44.56 1yq2 s GLY 230 CO 0.29 -0.13 0.53 0.86 0.00 0.00 0.00 173.10 174.65 1yq2 s TRP 231 N -3.69 -0.49 -0.10 1.90 -0.00 -1.26 -1.39 118.94 113.91 1yq2 s TRP 231 Ca 0.12 0.92 -0.10 0.00 -0.00 0.00 0.00 56.10 57.04 1yq2 s TRP 231 Cb -0.06 0.26 0.03 0.00 -0.00 0.00 0.00 33.47 33.70 1yq2 s TRP 231 CO 0.08 -0.46 0.28 0.45 -0.00 0.00 0.00 176.95 177.29 1yq2 s SER 232 N -0.90 -0.28 0.31 5.86 0.15 -0.55 -4.46 113.70 113.83 1yq2 s SER 232 Ca -0.09 0.54 -0.28 0.00 0.70 0.00 0.00 55.95 56.82 1yq2 s SER 232 Cb -0.03 0.56 -0.09 0.00 -1.71 0.00 0.00 66.02 64.75 1yq2 s SER 232 CO 0.06 -0.11 1.10 0.00 1.20 0.00 0.00 173.24 175.49 1yq2 s ALA 233 N 0.09 3.33 0.05 5.45 0.00 -1.26 -1.08 121.76 128.34 1yq2 s ALA 233 Ca -0.01 0.88 -0.15 0.00 0.00 0.00 0.00 51.96 52.69 1yq2 s ALA 233 Cb -0.02 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.80 1yq2 s ALA 233 CO 0.00 -0.22 0.33 0.50 0.00 0.00 0.00 175.76 176.38 1yq2 s ARG 234 N -1.71 0.86 0.07 0.00 6.06 -1.26 -4.82 118.95 118.15 1yq2 s ARG 234 Ca 0.48 -0.51 -0.31 0.00 -2.50 0.00 0.00 55.73 52.89 1yq2 s ARG 234 Cb -0.30 0.38 -0.08 0.00 0.06 0.00 0.00 34.95 35.00 1yq2 s ARG 234 CO 0.39 -0.29 1.64 -1.54 -2.50 0.00 0.00 175.30 173.00 1yq2 s SER 235 N -2.15 6.61 0.00 -2.12 1.04 -1.26 -3.96 113.70 111.86 1yq2 s SER 235 Ca -0.04 2.47 0.00 0.00 0.48 0.00 0.00 55.95 58.86 1yq2 s SER 235 Cb -0.00 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.55 1yq2 s SER 235 CO -0.04 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 173.91 1yq2 n GLY 236 N 3.98 -1.16 0.23 7.32 0.00 -1.26 -4.72 105.19 109.58 1yq2 n GLY 236 Ca 0.16 -2.12 0.04 0.00 0.00 0.00 0.00 46.02 44.10 1yq2 n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 h ALA 237 N 0.00 1.60 0.00 4.61 0.00 -1.84 -3.49 119.26 120.14 1yq2 h ALA 237 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1yq2 h ALA 237 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1yq2 h ALA 237 CO 0.00 0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.96 1yq2 n GLY 238 N -0.93 -0.28 3.41 0.00 0.00 -1.22 -4.47 105.19 101.69 1yq2 n GLY 238 Ca -0.02 -2.28 -0.34 0.00 0.00 0.00 0.00 46.02 43.38 1yq2 n GLY 238 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yq2 s THR 239 N -0.96 3.63 0.12 2.61 2.01 -0.24 -0.58 115.64 122.23 1yq2 s THR 239 Ca 0.00 -0.43 -0.04 0.00 0.31 0.00 0.00 61.69 61.53 1yq2 s THR 239 Cb 0.00 -2.62 -0.05 0.00 0.01 0.00 0.00 72.50 69.84 1yq2 s THR 239 CO 0.00 0.46 0.34 -0.83 -0.69 0.00 0.00 174.62 173.89 1yq2 s GLY 240 N 0.88 2.23 0.02 4.40 0.00 0.12 -1.49 107.32 113.48 1yq2 s GLY 240 Ca -0.01 -0.62 0.05 0.00 0.00 0.00 0.00 44.72 44.14 1yq2 s GLY 240 CO 0.01 -0.55 -0.16 -0.51 0.00 0.00 0.00 173.10 171.89 1yq2 s THR 241 N -1.61 1.28 -0.11 0.90 -4.23 -0.49 0.43 115.64 111.81 1yq2 s THR 241 Ca 0.39 -0.89 0.03 0.00 -1.18 0.00 0.00 61.69 60.04 1yq2 s THR 241 Cb -0.12 -1.11 0.01 0.00 1.34 0.00 0.00 72.50 72.61 1yq2 s THR 241 CO 0.25 0.20 -0.21 -0.63 -0.54 0.00 0.00 174.62 173.69 1yq2 s ILE 242 N -0.62 1.94 -0.65 2.99 1.01 -0.33 -1.53 121.20 124.00 1yq2 s ILE 242 Ca 0.05 -0.93 -0.00 0.00 0.00 0.00 0.00 60.65 59.77 1yq2 s ILE 242 Cb -0.07 -1.70 0.16 0.00 0.01 0.00 0.00 42.46 40.86 1yq2 s ILE 242 CO 0.01 0.53 0.45 -0.62 0.00 0.00 0.00 174.94 175.31 1yq2 s ASP 243 N 0.62 5.07 0.30 3.58 2.15 0.11 -1.15 116.67 127.36 1yq2 s ASP 243 Ca -0.13 -3.12 -0.27 0.00 0.43 0.00 0.00 52.55 49.47 1yq2 s ASP 243 Cb -0.17 -1.79 -0.10 0.00 -0.30 0.00 0.00 42.92 40.57 1yq2 s ASP 243 CO 0.03 -0.28 0.94 -2.16 -0.17 0.00 0.00 175.17 173.53 1yq2 s PRO 244 N -0.44 4.63 -0.11 4.34 0.04 -1.26 -3.06 135.00 139.14 1yq2 s PRO 244 Ca 0.19 1.35 0.02 0.00 0.04 0.00 0.00 61.00 62.60 1yq2 s PRO 244 Cb -0.18 -2.90 0.01 0.00 0.04 0.00 0.00 34.50 31.47 1yq2 s PRO 244 CO -0.05 0.33 -0.17 -2.00 0.04 0.00 0.00 177.00 175.15 1yq2 s GLU 245 N -1.87 2.37 -0.18 4.56 2.12 -0.21 -4.73 118.70 120.75 1yq2 s GLU 245 Ca 0.48 -0.62 0.01 0.00 0.36 0.00 0.00 54.97 55.20 1yq2 s GLU 245 Cb -0.20 -1.95 0.02 0.00 0.26 0.00 0.00 34.13 32.25 1yq2 s GLU 245 CO 0.25 -0.01 -0.19 0.42 -0.54 0.00 0.00 175.26 175.19 1yq2 s ILE 246 N 0.84 2.13 -0.46 -3.70 -1.09 -1.26 -0.68 121.20 116.99 1yq2 s ILE 246 Ca -0.09 -0.92 -0.14 0.00 -2.23 0.00 0.00 60.65 57.27 1yq2 s ILE 246 Cb -0.15 -1.90 0.07 0.00 -1.58 0.00 0.00 42.46 38.90 1yq2 s ILE 246 CO 0.00 0.53 0.36 -0.89 -1.23 0.00 0.00 174.94 173.72 1yq2 s THR 247 N 1.29 5.04 -0.02 2.92 2.01 0.28 -5.01 115.64 122.14 1yq2 s THR 247 Ca 0.05 -1.10 -0.27 0.00 0.31 0.00 0.00 61.69 60.68 1yq2 s THR 247 Cb -0.13 -4.01 0.06 0.00 0.01 0.00 0.00 72.50 68.43 1yq2 s THR 247 CO -0.12 -0.54 0.60 0.00 -0.69 0.00 0.00 174.62 173.87 1yq2 s ALA 248 N 1.60 -1.56 0.73 7.40 0.00 -1.26 -1.06 121.76 127.61 1yq2 s ALA 248 Ca 0.04 1.05 -0.13 0.00 0.00 0.00 0.00 51.96 52.92 1yq2 s ALA 248 Cb -0.24 0.09 0.04 0.00 0.00 0.00 0.00 23.12 23.01 1yq2 s ALA 248 CO 0.06 -0.39 1.12 0.34 0.00 0.00 0.00 175.76 176.89 1yq2 s ASP 249 N -1.37 4.61 0.40 0.00 2.15 -1.26 -4.93 116.67 116.27 1yq2 s ASP 249 Ca -0.10 1.99 0.14 0.00 0.43 0.00 0.00 52.55 55.01 1yq2 s ASP 249 Cb -0.01 -2.55 0.99 0.00 -0.30 0.00 0.00 42.92 41.05 1yq2 s ASP 249 CO 0.07 -1.97 1.89 0.00 -0.17 0.00 0.00 175.17 174.98 1yq2 h ALA 250 N -0.58 2.05 0.00 3.66 0.00 -1.99 -1.30 119.26 121.11 1yq2 h ALA 250 Ca -0.45 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1yq2 h ALA 250 Cb 1.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1yq2 h ALA 250 CO 0.52 -0.29 0.00 1.79 0.00 0.00 0.00 179.25 181.26 1yq2 h THR 251 N 0.50 0.00 -0.06 0.00 1.35 -1.95 -2.93 112.91 109.82 1yq2 h THR 251 Ca 0.42 -0.20 -0.08 0.00 -0.55 0.00 0.00 66.41 66.00 1yq2 h THR 251 Cb 0.90 1.12 -0.01 0.00 -1.73 0.00 0.00 68.15 68.43 1yq2 h THR 251 CO -0.16 0.00 -0.34 0.00 -0.25 0.00 0.00 175.52 174.77 1yq2 h ALA 252 N 2.02 1.33 -2.63 6.62 0.00 -1.41 -3.44 119.26 121.75 1yq2 h ALA 252 Ca 0.00 -0.33 -0.49 0.00 0.00 0.00 0.00 54.91 54.08 1yq2 h ALA 252 Cb 0.21 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 17.96 1yq2 h ALA 252 CO 0.00 0.48 0.45 -0.06 0.00 0.00 0.00 179.25 180.12 1yq2 s PHE 253 N -4.28 3.27 0.30 0.00 0.08 -1.11 -4.31 117.98 111.94 1yq2 s PHE 253 Ca -0.04 1.63 -0.29 0.00 0.12 0.00 0.00 56.93 58.36 1yq2 s PHE 253 Cb 0.14 -3.23 -0.10 0.00 -0.57 0.00 0.00 43.02 39.26 1yq2 s PHE 253 CO 0.74 -0.81 1.12 -1.25 -0.10 0.00 0.00 175.22 174.92 1yq2 s PRO 254 N -2.24 4.53 -0.10 0.24 0.04 -1.26 -5.02 135.00 131.19 1yq2 s PRO 254 Ca 0.55 1.82 0.02 0.00 0.04 0.00 0.00 61.00 63.44 1yq2 s PRO 254 Cb -0.26 -3.08 -0.01 0.00 0.04 0.00 0.00 34.50 31.18 1yq2 s PRO 254 CO 0.33 0.10 -0.17 0.08 0.04 0.00 0.00 177.00 177.39 1yq2 s VAL 255 N -1.22 2.75 -0.13 -0.36 1.01 -0.61 -4.43 120.40 117.41 1yq2 s VAL 255 Ca 0.47 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.66 1yq2 s VAL 255 Cb -0.32 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 1yq2 s VAL 255 CO 0.41 0.55 -0.15 -0.89 0.00 0.00 0.00 175.10 175.02 1yq2 s THR 256 N 0.04 2.83 -0.19 3.92 2.01 -0.01 -0.42 115.64 123.82 1yq2 s THR 256 Ca -0.06 -0.74 -0.14 0.00 0.31 0.00 0.00 61.69 61.06 1yq2 s THR 256 Cb -0.15 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.14 1yq2 s THR 256 CO 0.05 0.53 0.33 -0.22 -0.69 0.00 0.00 174.62 174.61 1yq2 s LEU 257 N 0.43 4.18 -0.11 4.42 2.96 0.41 -1.17 118.68 129.81 1yq2 s LEU 257 Ca -0.11 0.46 0.01 0.00 -0.22 0.00 0.00 54.13 54.27 1yq2 s LEU 257 Cb -0.16 -2.41 0.02 0.00 0.50 0.00 0.00 46.19 44.13 1yq2 s LEU 257 CO 0.05 0.01 -0.14 -0.55 -1.32 0.00 0.00 176.35 174.40 1yq2 s SER 258 N 0.83 2.36 -0.56 3.68 0.15 -0.35 -0.93 113.70 118.88 1yq2 s SER 258 Ca 0.17 -0.40 0.04 0.00 0.70 0.00 0.00 55.95 56.45 1yq2 s SER 258 Cb -0.14 -1.04 0.16 0.00 -1.71 0.00 0.00 66.02 63.29 1yq2 s SER 258 CO 0.06 -0.01 0.37 -0.69 1.20 0.00 0.00 173.24 174.17 1yq2 s VAL 259 N 1.11 1.96 0.17 4.45 1.01 0.11 -1.02 120.40 128.18 1yq2 s VAL 259 Ca -0.05 -3.41 -0.15 0.00 0.00 0.00 0.00 61.98 58.37 1yq2 s VAL 259 Cb -0.14 -2.32 0.06 0.00 0.00 0.00 0.00 36.38 33.97 1yq2 s VAL 259 CO -0.03 -1.00 1.73 -0.65 0.00 0.00 0.00 175.10 175.15 1yq2 h PRO 260 N 5.90 0.22 -0.04 2.72 0.11 -1.74 -0.54 132.00 138.63 1yq2 h PRO 260 Ca 0.11 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.22 1yq2 h PRO 260 Cb 0.84 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 1yq2 h PRO 260 CO 0.58 0.15 0.11 1.49 -0.21 0.00 0.00 178.00 180.12 1yq2 h GLU 261 N 0.23 0.00 -0.37 1.05 4.81 -1.94 -1.00 114.58 117.36 1yq2 h GLU 261 Ca 0.19 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1yq2 h GLU 261 Cb 0.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1yq2 h GLU 261 CO -0.24 0.00 0.00 1.28 -0.73 0.00 0.00 179.01 179.32 1yq2 n LEU 262 N -3.34 3.45 -0.81 1.64 4.77 -0.27 -4.95 117.00 117.49 1yq2 n LEU 262 Ca -0.02 -2.35 -0.11 0.00 -0.03 0.00 0.00 56.01 53.51 1yq2 n LEU 262 Cb 0.19 -0.37 -0.05 0.00 -2.33 0.00 0.00 43.42 40.86 1yq2 n LEU 262 CO 0.22 0.73 -0.10 0.61 -1.33 0.00 0.00 177.39 177.52 1yq2 n GLY 263 N 0.32 1.13 3.68 -0.72 0.00 -0.38 -4.98 105.19 104.24 1yq2 n GLY 263 Ca 0.16 -0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 1yq2 n GLY 263 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yq2 s VAL 264 N -2.19 5.03 -0.31 1.61 1.01 -0.85 -4.98 120.40 119.72 1yq2 s VAL 264 Ca 0.00 1.23 0.02 0.00 0.00 0.00 0.00 61.98 63.23 1yq2 s VAL 264 Cb 0.00 -3.96 0.16 0.00 0.00 0.00 0.00 36.38 32.58 1yq2 s VAL 264 CO 0.00 0.15 0.39 0.21 0.00 0.00 0.00 175.10 175.85 1yq2 s ASN 265 N 1.07 0.69 -0.11 3.32 3.84 -1.25 -0.71 114.94 121.79 1yq2 s ASN 265 Ca 0.30 -0.71 0.03 0.00 0.21 0.00 0.00 52.86 52.69 1yq2 s ASN 265 Cb -0.16 0.93 -0.00 0.00 -0.55 0.00 0.00 41.25 41.47 1yq2 s ASN 265 CO 0.12 -0.33 -0.21 -0.69 -2.79 0.00 0.00 177.10 173.19 1yq2 s VAL 266 N 2.26 2.29 -0.17 -5.21 1.01 -0.11 -4.99 120.40 115.48 1yq2 s VAL 266 Ca 0.11 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 61.13 1yq2 s VAL 266 Cb -0.13 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 1yq2 s VAL 266 CO -0.24 0.55 -0.06 -0.89 0.00 0.00 0.00 175.10 174.45 1yq2 s THR 267 N 0.42 3.46 -0.30 3.92 2.01 -1.26 -0.44 115.64 123.44 1yq2 s THR 267 Ca -0.15 -0.49 -0.11 0.00 0.31 0.00 0.00 61.69 61.24 1yq2 s THR 267 Cb -0.17 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.78 1yq2 s THR 267 CO 0.07 0.47 0.19 0.26 -0.69 0.00 0.00 174.62 174.92 1yq2 s TRP 268 N 0.78 3.21 -0.58 4.92 0.51 0.44 -4.97 118.94 123.25 1yq2 s TRP 268 Ca -0.02 -0.15 0.24 0.00 -2.12 0.00 0.00 56.10 54.05 1yq2 s TRP 268 Cb -0.15 -2.40 0.55 0.00 -0.81 0.00 0.00 33.47 30.66 1yq2 s TRP 268 CO 0.02 -0.30 1.66 0.87 -0.51 0.00 0.00 176.95 178.69 1yq2 h LYS 269 N 8.40 0.00 -3.67 4.98 1.57 -1.93 -1.62 116.57 124.30 1yq2 h LYS 269 Ca -0.33 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.38 1yq2 h LYS 269 Cb 1.17 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.39 1yq2 h LYS 269 CO 0.59 0.00 -0.11 -1.54 -0.57 0.00 0.00 179.45 177.82 1yq2 s SER 270 N -5.32 -0.03 0.32 0.86 1.04 -1.26 -4.46 113.70 104.86 1yq2 s SER 270 Ca 0.08 -0.97 0.05 0.00 0.48 0.00 0.00 55.95 55.60 1yq2 s SER 270 Cb 0.09 0.60 0.69 0.00 0.10 0.00 0.00 66.02 67.49 1yq2 s SER 270 CO 0.64 -1.16 1.86 0.00 0.98 0.00 0.00 173.24 175.56 1yq2 h ALA 271 N 2.24 1.68 0.00 5.32 0.00 -1.94 -2.50 119.26 124.06 1yq2 h ALA 271 Ca -0.26 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1yq2 h ALA 271 Cb 1.25 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1yq2 h ALA 271 CO 0.36 0.09 0.00 1.05 0.00 0.00 0.00 179.25 180.75 1yq2 h GLU 272 N 0.84 0.00 0.00 0.00 9.09 -1.99 -2.74 114.58 119.78 1yq2 h GLU 272 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.87 1yq2 h GLU 272 Cb 0.57 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.67 1yq2 h GLU 272 CO -0.22 0.00 -0.18 0.93 0.05 0.00 0.00 179.01 179.58 1yq2 h GLU 273 N 0.00 0.00 -6.37 1.06 5.08 -1.85 -3.45 114.58 109.05 1yq2 h GLU 273 Ca 0.00 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.82 1yq2 h GLU 273 Cb 0.49 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.75 1yq2 h GLU 273 CO 0.00 0.00 1.07 0.08 -1.00 0.00 0.00 179.01 179.16 1yq2 s VAL 274 N -3.13 3.23 0.07 3.13 1.01 -1.04 -4.94 120.40 118.73 1yq2 s VAL 274 Ca 0.09 0.48 -0.16 0.00 0.00 0.00 0.00 61.98 62.40 1yq2 s VAL 274 Cb 0.12 -3.31 0.03 0.00 0.00 0.00 0.00 36.38 33.22 1yq2 s VAL 274 CO 0.64 -0.02 0.36 0.00 0.00 0.00 0.00 175.10 176.08 1yq2 s ALA 275 N 3.45 -0.83 0.56 5.51 0.00 -1.26 -5.03 121.76 124.16 1yq2 s ALA 275 Ca 0.76 0.03 -0.20 0.00 0.00 0.00 0.00 51.96 52.55 1yq2 s ALA 275 Cb -0.38 0.47 -0.04 0.00 0.00 0.00 0.00 23.12 23.17 1yq2 s ALA 275 CO 0.33 -0.51 1.25 -2.14 0.00 0.00 0.00 175.76 174.68 1yq2 s PRO 276 N -3.07 3.12 0.06 0.00 0.02 -1.26 -4.56 135.00 129.31 1yq2 s PRO 276 Ca -0.01 1.95 0.07 0.00 0.02 0.00 0.00 61.00 63.02 1yq2 s PRO 276 Cb 0.01 -2.09 -0.03 0.00 0.02 0.00 0.00 34.50 32.41 1yq2 s PRO 276 CO -0.07 -1.12 -0.18 -0.51 -0.33 0.00 0.00 177.00 174.79 1yq2 s LEU 277 N -3.77 2.22 -0.10 -5.54 1.02 -0.30 -5.00 118.68 107.21 1yq2 s LEU 277 Ca 0.74 -0.56 -0.00 0.00 0.02 0.00 0.00 54.13 54.33 1yq2 s LEU 277 Cb -0.33 -0.79 -0.03 0.00 0.02 0.00 0.00 46.19 45.06 1yq2 s LEU 277 CO 0.38 0.07 -0.08 0.00 0.02 0.00 0.00 176.35 176.73 1yq2 s ALA 278 N -0.97 2.88 -0.13 4.21 0.00 -1.26 -1.19 121.76 125.31 1yq2 s ALA 278 Ca 0.04 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.15 1yq2 s ALA 278 Cb -0.09 -1.28 0.01 0.00 0.00 0.00 0.00 23.12 21.76 1yq2 s ALA 278 CO 0.02 0.42 -0.21 -0.51 0.00 0.00 0.00 175.76 175.49 1yq2 s LEU 279 N -0.30 2.01 0.58 0.00 1.02 0.17 -5.00 118.68 117.17 1yq2 s LEU 279 Ca 0.04 -0.55 -0.13 0.00 0.02 0.00 0.00 54.13 53.50 1yq2 s LEU 279 Cb -0.13 -1.35 -0.05 0.00 0.02 0.00 0.00 46.19 44.68 1yq2 s LEU 279 CO 0.02 0.08 1.01 -1.61 0.02 0.00 0.00 176.35 175.88 1yq2 s GLU 280 N 0.78 3.71 -1.19 1.70 0.41 -1.26 -0.70 118.70 122.14 1yq2 s GLU 280 Ca -0.09 0.85 -0.03 0.00 -0.41 0.00 0.00 54.97 55.29 1yq2 s GLU 280 Cb -0.16 -2.10 -0.02 0.00 -1.78 0.00 0.00 34.13 30.08 1yq2 s GLU 280 CO -0.00 -0.48 0.87 0.09 -0.49 0.00 0.00 175.26 175.26 1yq2 n ASN 281 N -2.28 -3.05 -4.49 -0.19 4.13 -0.54 -4.85 115.26 104.00 1yq2 n ASN 281 Ca 0.06 -0.73 -0.34 0.00 1.68 0.00 0.00 54.58 55.26 1yq2 n ASN 281 Cb 0.54 -4.69 -0.12 0.00 -1.54 0.00 0.00 39.78 33.97 1yq2 n ASN 281 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1yq2 s VAL 282 N -3.47 3.69 0.10 2.41 1.01 0.26 -4.85 120.40 119.55 1yq2 s VAL 282 Ca 0.14 -0.44 -0.24 0.00 0.00 0.00 0.00 61.98 61.44 1yq2 s VAL 282 Cb -0.03 -2.59 -0.07 0.00 0.00 0.00 0.00 36.38 33.70 1yq2 s VAL 282 CO 0.77 0.52 0.72 -1.61 0.00 0.00 0.00 175.10 175.50 1yq2 s GLU 283 N 0.15 4.47 0.46 2.72 2.02 -1.26 -3.45 118.70 123.80 1yq2 s GLU 283 Ca -0.03 1.03 -0.16 0.00 0.02 0.00 0.00 54.97 55.83 1yq2 s GLU 283 Cb -0.14 -3.29 -0.08 0.00 0.10 0.00 0.00 34.13 30.72 1yq2 s GLU 283 CO 0.03 0.49 0.91 -1.25 0.02 0.00 0.00 175.26 175.47 1yq2 s PRO 284 N -0.78 3.97 -0.01 0.39 0.04 -1.26 -4.60 135.00 132.76 1yq2 s PRO 284 Ca 0.35 0.86 -0.21 0.00 0.04 0.00 0.00 61.00 62.05 1yq2 s PRO 284 Cb -0.21 -2.22 -0.05 0.00 0.04 0.00 0.00 34.50 32.05 1yq2 s PRO 284 CO 0.23 -0.14 0.60 -0.46 0.04 0.00 0.00 177.00 177.27 1yq2 s TRP 285 N -2.44 3.68 0.23 0.56 -0.00 0.59 -4.25 118.94 117.31 1yq2 s TRP 285 Ca 0.57 1.20 -0.09 0.00 -0.00 0.00 0.00 56.10 57.79 1yq2 s TRP 285 Cb -0.10 -2.61 -0.01 0.00 -0.00 0.00 0.00 33.47 30.74 1yq2 s TRP 285 CO 0.27 0.35 0.36 -1.54 -0.00 0.00 0.00 176.95 176.39 1yq2 s SER 286 N -0.17 -0.01 0.38 5.86 1.04 -0.31 -4.65 113.70 115.83 1yq2 s SER 286 Ca 0.31 -1.05 0.06 0.00 0.48 0.00 0.00 55.95 55.75 1yq2 s SER 286 Cb -0.18 0.52 0.74 0.00 0.10 0.00 0.00 66.02 67.20 1yq2 s SER 286 CO 0.17 -1.03 1.97 0.00 0.98 0.00 0.00 173.24 175.32 1yq2 h ALA 287 N 2.38 1.54 -0.11 5.32 0.00 -1.88 -1.90 119.26 124.61 1yq2 h ALA 287 Ca -0.29 -0.12 -0.24 0.00 0.00 0.00 0.00 54.91 54.26 1yq2 h ALA 287 Cb 1.25 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.90 1yq2 h ALA 287 CO 0.41 0.35 -0.85 0.93 0.00 0.00 0.00 179.25 180.09 1yq2 h GLU 288 N 0.49 0.78 -2.80 0.00 5.08 -1.93 -3.40 114.58 112.80 1yq2 h GLU 288 Ca 0.12 -0.68 -0.61 0.00 -1.00 0.00 0.00 59.36 57.19 1yq2 h GLU 288 Cb 0.15 0.16 -0.40 0.00 0.50 0.00 0.00 28.75 29.16 1yq2 h GLU 288 CO -0.01 1.28 -0.77 0.08 -1.00 0.00 0.00 179.01 178.59 1yq2 s VAL 289 N -3.64 1.48 -1.51 3.13 1.01 -1.05 -5.02 120.40 114.80 1yq2 s VAL 289 Ca -0.10 -3.11 -0.11 0.00 0.00 0.00 0.00 61.98 58.66 1yq2 s VAL 289 Cb 0.08 -2.00 -0.00 0.00 0.00 0.00 0.00 36.38 34.46 1yq2 s VAL 289 CO 0.91 -1.05 2.56 -0.81 0.00 0.00 0.00 175.10 176.71 1yq2 n PRO 290 N 2.83 3.48 -2.10 2.72 -0.04 -0.74 -1.17 135.00 139.98 1yq2 n PRO 290 Ca 0.19 -2.57 -0.42 0.00 -0.04 0.00 0.00 63.50 60.66 1yq2 n PRO 290 Cb 0.39 -2.97 -0.03 0.00 -0.04 0.00 0.00 33.50 30.86 1yq2 n PRO 290 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1yq2 s ARG 291 N 2.07 4.23 0.03 0.54 6.06 -1.26 -4.82 118.95 125.79 1yq2 s ARG 291 Ca 0.58 2.10 0.08 0.00 -2.50 0.00 0.00 55.73 55.98 1yq2 s ARG 291 Cb 0.16 -3.73 -0.02 0.00 0.06 0.00 0.00 34.95 31.42 1yq2 s ARG 291 CO -0.07 -0.71 -0.22 -0.51 -2.50 0.00 0.00 175.30 171.29 1yq2 s LEU 292 N 3.07 2.14 -0.14 -0.88 1.43 -1.26 -4.34 118.68 118.69 1yq2 s LEU 292 Ca 0.69 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 53.28 1yq2 s LEU 292 Cb -0.33 -1.08 -0.01 0.00 0.03 0.00 0.00 46.19 44.80 1yq2 s LEU 292 CO 0.28 0.21 -0.14 -0.31 0.23 0.00 0.00 176.35 176.61 1yq2 s TYR 293 N -0.73 2.79 0.14 0.29 1.51 0.25 -4.88 117.35 116.73 1yq2 s TYR 293 Ca 0.09 -0.86 -0.31 0.00 -1.01 0.00 0.00 57.07 54.97 1yq2 s TYR 293 Cb -0.09 -1.87 -0.08 0.00 -0.11 0.00 0.00 41.96 39.81 1yq2 s TYR 293 CO 0.01 -0.36 1.40 -1.21 -1.11 0.00 0.00 175.55 174.28 1yq2 s GLU 294 N 0.62 4.31 0.12 -0.62 0.41 -1.26 -0.22 118.70 122.07 1yq2 s GLU 294 Ca -0.08 2.12 -0.04 0.00 -0.41 0.00 0.00 54.97 56.56 1yq2 s GLU 294 Cb -0.16 -3.22 -0.03 0.00 -1.78 0.00 0.00 34.13 28.95 1yq2 s GLU 294 CO 0.03 -0.43 0.12 0.00 -0.49 0.00 0.00 175.26 174.49 1yq2 s ALA 295 N 0.89 0.45 -0.03 5.21 0.00 -0.06 -4.13 121.76 124.09 1yq2 s ALA 295 Ca 0.64 -1.18 -0.06 0.00 0.00 0.00 0.00 51.96 51.36 1yq2 s ALA 295 Cb -0.38 0.74 0.01 0.00 0.00 0.00 0.00 23.12 23.49 1yq2 s ALA 295 CO 0.32 -0.52 0.14 -1.54 0.00 0.00 0.00 175.76 174.16 1yq2 s SER 296 N -2.99 -0.06 -0.12 0.00 1.04 -0.19 -1.09 113.70 110.29 1yq2 s SER 296 Ca 0.18 0.06 0.03 0.00 0.48 0.00 0.00 55.95 56.69 1yq2 s SER 296 Cb 0.06 0.26 0.01 0.00 0.10 0.00 0.00 66.02 66.44 1yq2 s SER 296 CO -0.02 -0.19 -0.21 0.68 0.98 0.00 0.00 173.24 174.48 1yq2 s VAL 297 N -0.57 1.92 0.03 5.02 -7.23 -0.59 -1.21 120.40 117.77 1yq2 s VAL 297 Ca -0.07 -0.91 0.01 0.00 -1.81 0.00 0.00 61.98 59.20 1yq2 s VAL 297 Cb -0.04 -1.70 -0.02 0.00 0.56 0.00 0.00 36.38 35.18 1yq2 s VAL 297 CO 0.01 0.53 -0.05 -0.94 -0.31 0.00 0.00 175.10 174.34 1yq2 s SER 298 N 0.71 0.44 0.49 4.85 1.04 -0.32 -1.08 113.70 119.84 1yq2 s SER 298 Ca -0.11 -0.51 0.05 0.00 0.48 0.00 0.00 55.95 55.86 1yq2 s SER 298 Cb -0.16 0.08 -0.01 0.00 0.10 0.00 0.00 66.02 66.03 1yq2 s SER 298 CO 0.01 -0.26 0.19 -0.94 0.98 0.00 0.00 173.24 173.22 1yq2 s SER 299 N -1.47 4.37 0.39 7.02 1.04 0.55 -0.83 113.70 124.77 1yq2 s SER 299 Ca -0.14 -1.34 0.12 0.00 0.48 0.00 0.00 55.95 55.07 1yq2 s SER 299 Cb -0.10 0.17 0.92 0.00 0.10 0.00 0.00 66.02 67.11 1yq2 s SER 299 CO -0.01 -0.84 1.89 0.00 0.98 0.00 0.00 173.24 175.27 1yq2 h ALA 300 N 1.18 1.96 0.00 5.32 0.00 -1.80 -2.98 119.26 122.95 1yq2 h ALA 300 Ca -0.41 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1yq2 h ALA 300 Cb 1.29 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1yq2 h ALA 300 CO 0.68 -0.18 -0.82 0.00 0.00 0.00 0.00 179.25 178.92 1yq2 h ALA 301 N 1.62 0.50 -1.96 0.00 0.00 -1.85 -3.48 119.26 114.08 1yq2 h ALA 301 Ca 0.42 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 1yq2 h ALA 301 Cb 0.79 0.00 -0.21 0.00 0.00 0.00 0.00 17.79 18.36 1yq2 h ALA 301 CO -0.17 0.00 0.16 -2.00 0.00 0.00 0.00 179.25 177.24 1yq2 s GLU 302 N -3.24 0.81 -0.02 0.00 2.12 -1.12 -4.87 118.70 112.37 1yq2 s GLU 302 Ca 0.03 0.97 0.04 0.00 0.36 0.00 0.00 54.97 56.37 1yq2 s GLU 302 Cb 0.12 0.39 -0.01 0.00 0.26 0.00 0.00 34.13 34.90 1yq2 s GLU 302 CO 0.76 -0.10 -0.14 0.45 -0.54 0.00 0.00 175.26 175.69 1yq2 s SER 303 N 0.39 1.74 -0.13 -1.70 0.15 -1.26 -0.33 113.70 112.56 1yq2 s SER 303 Ca 0.00 -0.27 0.02 0.00 0.70 0.00 0.00 55.95 56.40 1yq2 s SER 303 Cb -0.05 -0.34 0.01 0.00 -1.71 0.00 0.00 66.02 63.93 1yq2 s SER 303 CO -0.00 0.15 -0.21 -0.63 1.20 0.00 0.00 173.24 173.75 1yq2 s ILE 304 N -0.10 1.96 -0.14 6.45 1.01 -0.24 -1.76 121.20 128.38 1yq2 s ILE 304 Ca 0.01 -0.92 -0.10 0.00 0.00 0.00 0.00 60.65 59.64 1yq2 s ILE 304 Cb -0.08 -1.74 -0.05 0.00 0.01 0.00 0.00 42.46 40.61 1yq2 s ILE 304 CO 0.00 0.53 0.19 -0.44 0.00 0.00 0.00 174.94 175.22 1yq2 s SER 305 N 0.80 6.39 0.02 3.58 0.01 -0.08 -1.54 113.70 122.89 1yq2 s SER 305 Ca -0.08 0.46 0.01 0.00 1.31 0.00 0.00 55.95 57.65 1yq2 s SER 305 Cb -0.16 -2.11 -0.02 0.00 0.21 0.00 0.00 66.02 63.95 1yq2 s SER 305 CO -0.01 0.30 -0.04 0.68 0.41 0.00 0.00 173.24 174.57 1yq2 s VAL 306 N -0.45 0.28 -0.19 3.43 -7.23 -0.25 -4.17 120.40 111.82 1yq2 s VAL 306 Ca 0.14 -0.69 -0.05 0.00 -1.81 0.00 0.00 61.98 59.57 1yq2 s VAL 306 Cb -0.12 -0.34 -0.03 0.00 0.56 0.00 0.00 36.38 36.45 1yq2 s VAL 306 CO 0.03 -0.27 0.00 -0.13 -0.31 0.00 0.00 175.10 174.42 1yq2 s ARG 307 N -1.02 3.69 -0.20 4.82 0.52 -1.26 -0.88 118.95 124.62 1yq2 s ARG 307 Ca -0.08 -0.49 -0.12 0.00 -0.52 0.00 0.00 55.73 54.52 1yq2 s ARG 307 Cb -0.07 -3.06 -0.05 0.00 0.52 0.00 0.00 34.95 32.29 1yq2 s ARG 307 CO -0.00 0.11 0.21 -0.51 0.02 0.00 0.00 175.30 175.13 1yq2 s LEU 308 N 0.74 4.18 -0.20 2.53 1.43 0.70 -4.85 118.68 123.21 1yq2 s LEU 308 Ca 0.00 0.30 -0.02 0.00 -1.03 0.00 0.00 54.13 53.39 1yq2 s LEU 308 Cb -0.14 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.86 1yq2 s LEU 308 CO 0.02 0.09 -0.12 -0.83 0.23 0.00 0.00 176.35 175.75 1yq2 s GLY 309 N 0.68 1.51 -0.29 -3.19 0.00 -1.26 -0.58 107.32 104.18 1yq2 s GLY 309 Ca 0.11 -1.17 -0.21 0.00 0.00 0.00 0.00 44.72 43.46 1yq2 s GLY 309 CO 0.03 0.32 0.64 -1.36 0.00 0.00 0.00 173.10 172.73 1yq2 s PHE 310 N 1.33 3.23 -0.12 1.90 0.40 -1.26 -4.78 117.98 118.67 1yq2 s PHE 310 Ca 0.04 0.65 -0.30 0.00 -0.60 0.00 0.00 56.93 56.72 1yq2 s PHE 310 Cb -0.14 -2.97 0.09 0.00 0.51 0.00 0.00 43.02 40.51 1yq2 s PHE 310 CO -0.07 -0.45 0.80 -0.98 0.70 0.00 0.00 175.22 175.23 1yq2 s ARG 311 N 2.61 0.86 -0.09 0.44 1.04 -1.26 -0.30 118.95 122.26 1yq2 s ARG 311 Ca 0.26 0.30 0.02 0.00 -1.04 0.00 0.00 55.73 55.27 1yq2 s ARG 311 Cb -0.15 0.41 0.01 0.00 -2.04 0.00 0.00 34.95 33.18 1yq2 s ARG 311 CO 0.11 -0.25 -0.13 0.99 -0.04 0.00 0.00 175.30 175.98 1yq2 s THR 312 N -0.96 1.27 -0.23 4.99 2.01 -1.26 -3.98 115.64 117.49 1yq2 s THR 312 Ca -0.06 -0.53 -0.10 0.00 0.31 0.00 0.00 61.69 61.31 1yq2 s THR 312 Cb -0.01 -1.17 -0.05 0.00 0.01 0.00 0.00 72.50 71.28 1yq2 s THR 312 CO 0.06 0.39 0.15 -0.69 -0.69 0.00 0.00 174.62 173.84 1yq2 s VAL 313 N 0.89 5.35 -0.01 3.82 1.01 -1.26 -1.05 120.40 129.14 1yq2 s VAL 313 Ca -0.10 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.06 1yq2 s VAL 313 Cb -0.15 -3.48 0.01 0.00 0.00 0.00 0.00 36.38 32.76 1yq2 s VAL 313 CO 0.01 0.37 0.01 -0.13 0.00 0.00 0.00 175.10 175.36 1yq2 s ARG 314 N 0.89 -0.01 -0.21 2.72 1.81 -0.19 -4.86 118.95 119.09 1yq2 s ARG 314 Ca 0.07 0.08 -0.13 0.00 -1.72 0.00 0.00 55.73 54.03 1yq2 s ARG 314 Cb -0.13 -0.11 -0.05 0.00 -0.45 0.00 0.00 34.95 34.22 1yq2 s ARG 314 CO 0.03 -0.07 0.26 0.42 -0.68 0.00 0.00 175.30 175.26 1yq2 s ILE 315 N 0.45 5.30 -0.26 1.52 1.01 -1.26 -0.35 121.20 127.61 1yq2 s ILE 315 Ca -0.04 0.41 0.01 0.00 0.00 0.00 0.00 60.65 61.04 1yq2 s ILE 315 Cb -0.05 -3.59 0.07 0.00 0.01 0.00 0.00 42.46 38.89 1yq2 s ILE 315 CO -0.01 0.33 -0.02 -0.69 0.00 0.00 0.00 174.94 174.54 1yq2 s VAL 316 N 0.99 1.56 0.00 2.92 1.01 -0.33 -4.99 120.40 121.57 1yq2 s VAL 316 Ca 0.13 -1.39 0.00 0.00 0.00 0.00 0.00 61.98 60.71 1yq2 s VAL 316 Cb -0.14 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.34 1yq2 s VAL 316 CO 0.05 -0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.53 1yq2 n GLY 317 N 4.63 3.72 1.69 4.51 0.00 -1.26 -1.12 105.19 117.36 1yq2 n GLY 317 Ca -0.09 -0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.91 1yq2 n GLY 317 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1yq2 n ASP 318 N 5.76 4.33 -4.42 1.61 5.68 -1.22 -4.25 116.55 124.04 1yq2 n ASP 318 Ca 0.00 -2.87 -0.33 0.00 -0.50 0.00 0.00 54.79 51.09 1yq2 n ASP 318 Cb 0.00 -0.68 -0.14 0.00 -1.14 0.00 0.00 41.12 39.16 1yq2 n ASP 318 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 1yq2 s GLN 319 N -2.41 3.06 -0.43 0.11 -1.52 -0.28 -3.57 119.66 114.63 1yq2 s GLN 319 Ca 0.42 -0.68 -0.14 0.00 -1.95 0.00 0.00 55.36 53.02 1yq2 s GLN 319 Cb 0.33 -2.54 0.05 0.00 -0.22 0.00 0.00 33.01 30.63 1yq2 s GLN 319 CO 0.11 0.37 0.32 0.12 -0.25 0.00 0.00 175.29 175.96 1yq2 s PHE 320 N -0.06 3.26 -0.05 0.91 5.36 -1.26 -1.18 117.98 124.95 1yq2 s PHE 320 Ca -0.02 -0.93 -0.00 0.00 -0.96 0.00 0.00 56.93 55.01 1yq2 s PHE 320 Cb -0.14 -2.86 -0.03 0.00 -0.34 0.00 0.00 43.02 39.65 1yq2 s PHE 320 CO 0.04 -0.72 -0.00 -0.51 -1.46 0.00 0.00 175.22 172.56 1yq2 s LEU 321 N 1.61 3.54 -0.07 6.12 1.43 0.53 -1.58 118.68 130.26 1yq2 s LEU 321 Ca 0.04 0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.25 1yq2 s LEU 321 Cb -0.22 -1.89 0.01 0.00 0.03 0.00 0.00 46.19 44.12 1yq2 s LEU 321 CO 0.07 0.34 -0.17 -0.69 0.23 0.00 0.00 176.35 176.13 1yq2 s VAL 322 N -0.96 1.45 -1.48 -1.59 1.01 -0.65 -1.03 120.40 117.15 1yq2 s VAL 322 Ca 0.16 -0.68 -0.13 0.00 0.00 0.00 0.00 61.98 61.33 1yq2 s VAL 322 Cb -0.11 -1.28 0.10 0.00 0.00 0.00 0.00 36.38 35.08 1yq2 s VAL 322 CO 0.05 0.42 0.73 0.59 0.00 0.00 0.00 175.10 176.89 1yq2 n ASN 323 N 3.58 -4.05 0.00 3.32 3.02 -0.22 -1.98 115.26 118.93 1yq2 n ASN 323 Ca -0.21 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.68 1yq2 n ASN 323 Cb 0.52 -3.30 0.00 0.00 -0.61 0.00 0.00 39.78 36.40 1yq2 n ASN 323 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yq2 n GLY 324 N -1.40 0.75 3.08 7.41 0.00 -1.26 -4.95 105.19 108.82 1yq2 n GLY 324 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 1yq2 n GLY 324 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yq2 s ARG 325 N -0.13 0.89 0.23 1.61 0.52 -0.83 -5.03 118.95 116.20 1yq2 s ARG 325 Ca 0.00 -0.51 -0.32 0.00 -0.52 0.00 0.00 55.73 54.38 1yq2 s ARG 325 Cb 0.00 -0.86 -0.12 0.00 0.52 0.00 0.00 34.95 34.49 1yq2 s ARG 325 CO 0.00 0.23 1.67 -2.13 0.02 0.00 0.00 175.30 175.09 1yq2 n ARG 326 N 2.50 2.68 -3.52 3.54 0.63 -1.26 -1.64 116.66 119.59 1yq2 n ARG 326 Ca -0.15 0.96 -0.38 0.00 -0.92 0.00 0.00 57.85 57.36 1yq2 n ARG 326 Cb 0.56 -2.78 -0.09 0.00 0.45 0.00 0.00 32.46 30.59 1yq2 n ARG 326 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1yq2 s VAL 327 N 0.83 5.27 -0.22 5.15 1.01 -0.61 -4.86 120.40 126.96 1yq2 s VAL 327 Ca 0.73 0.40 -0.13 0.00 0.00 0.00 0.00 61.98 62.98 1yq2 s VAL 327 Cb -0.52 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 1yq2 s VAL 327 CO 0.37 0.26 0.28 -0.69 0.00 0.00 0.00 175.10 175.32 1yq2 s VAL 328 N 1.48 5.28 -0.30 2.92 1.01 -1.26 -4.80 120.40 124.73 1yq2 s VAL 328 Ca 0.12 0.44 -0.19 0.00 0.00 0.00 0.00 61.98 62.36 1yq2 s VAL 328 Cb -0.15 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 1yq2 s VAL 328 CO 0.08 0.29 0.54 -0.36 0.00 0.00 0.00 175.10 175.65 1yq2 s PHE 329 N 1.23 3.23 -0.89 5.22 0.08 0.13 -4.98 117.98 121.99 1yq2 s PHE 329 Ca 0.13 0.50 -0.04 0.00 0.12 0.00 0.00 56.93 57.64 1yq2 s PHE 329 Cb -0.14 -2.84 0.22 0.00 -0.57 0.00 0.00 43.02 39.69 1yq2 s PHE 329 CO 0.06 -0.40 0.79 -1.01 -0.10 0.00 0.00 175.22 174.57 1yq2 s HIS 330 N 2.41 3.89 0.47 0.36 3.76 -1.26 -1.49 115.29 123.43 1yq2 s HIS 330 Ca 0.21 -2.85 0.05 0.00 -0.15 0.00 0.00 55.06 52.33 1yq2 s HIS 330 Cb -0.15 -3.39 -0.02 0.00 1.11 0.00 0.00 32.58 30.13 1yq2 s HIS 330 CO 0.11 -0.81 0.19 0.20 -0.85 0.00 0.00 174.74 173.58 1yq2 s GLY 331 N 0.41 2.53 0.03 -2.22 0.00 -0.37 -1.27 107.32 106.43 1yq2 s GLY 331 Ca 0.26 -1.47 0.02 0.00 0.00 0.00 0.00 44.72 43.53 1yq2 s GLY 331 CO -0.10 -2.00 -0.07 -1.34 0.00 0.00 0.00 173.10 169.59 1yq2 s VAL 332 N -2.72 0.47 -0.03 1.40 -7.23 -0.60 -0.79 120.40 110.91 1yq2 s VAL 332 Ca 0.30 -0.84 -0.29 0.00 -1.81 0.00 0.00 61.98 59.34 1yq2 s VAL 332 Cb 0.02 -0.51 -0.03 0.00 0.56 0.00 0.00 36.38 36.42 1yq2 s VAL 332 CO 0.17 -0.26 0.92 0.20 -0.31 0.00 0.00 175.10 175.82 1yq2 s ASN 333 N -1.19 7.27 -0.05 4.85 0.01 -0.31 -1.34 114.94 124.18 1yq2 s ASN 333 Ca -0.07 1.55 -0.03 0.00 -0.71 0.00 0.00 52.86 53.59 1yq2 s ASN 333 Cb -0.08 -2.54 0.03 0.00 0.41 0.00 0.00 41.25 39.07 1yq2 s ASN 333 CO 0.00 -0.25 0.13 -0.60 -1.51 0.00 0.00 177.10 174.87 1yq2 s ARG 334 N 1.08 0.10 0.25 -0.60 3.52 -0.47 -1.19 118.95 121.64 1yq2 s ARG 334 Ca 0.49 0.28 0.02 0.00 -0.13 0.00 0.00 55.73 56.39 1yq2 s ARG 334 Cb -0.20 -0.10 -0.05 0.00 -1.56 0.00 0.00 34.95 33.04 1yq2 s ARG 334 CO 0.25 -0.11 0.06 -3.38 -0.81 0.00 0.00 175.30 171.30 1yq2 s HIS 335 N 0.76 1.58 0.15 5.12 -3.43 -1.26 -2.94 115.29 115.27 1yq2 s HIS 335 Ca -0.06 -1.07 -0.31 0.00 -0.80 0.00 0.00 55.06 52.82 1yq2 s HIS 335 Cb -0.08 -0.94 -0.09 0.00 -1.43 0.00 0.00 32.58 30.03 1yq2 s HIS 335 CO -0.04 -0.20 1.51 -2.00 -2.00 0.00 0.00 174.74 172.02 1yq2 s GLU 336 N -3.96 4.25 -0.18 -0.38 2.56 -1.26 -4.98 118.70 114.74 1yq2 s GLU 336 Ca 0.34 2.27 -0.14 0.00 0.00 0.00 0.00 54.97 57.45 1yq2 s GLU 336 Cb 0.07 -3.18 0.05 0.00 2.00 0.00 0.00 34.13 33.08 1yq2 s GLU 336 CO 0.12 -0.55 0.47 -0.08 -0.56 0.00 0.00 175.26 174.66 1yq2 s THR 337 N 1.10 -0.01 -0.15 -1.70 -1.32 -1.25 -4.38 115.64 107.92 1yq2 s THR 337 Ca 0.68 0.04 -0.11 0.00 -1.21 0.00 0.00 61.69 61.09 1yq2 s THR 337 Cb -0.42 -0.67 0.05 0.00 -1.51 0.00 0.00 72.50 69.95 1yq2 s THR 337 CO 0.31 0.02 0.39 -2.28 -2.21 0.00 0.00 174.62 170.84 1yq2 s HIS 338 N 0.84 -0.50 0.55 9.09 5.04 -0.61 -4.96 115.29 124.74 1yq2 s HIS 338 Ca -0.05 1.13 0.40 0.00 -1.54 0.00 0.00 55.06 55.01 1yq2 s HIS 338 Cb -0.05 0.19 2.19 0.00 0.04 0.00 0.00 32.58 34.95 1yq2 s HIS 338 CO -0.07 -0.27 2.23 -1.35 -2.34 0.00 0.00 174.74 172.95 1yq2 h PRO 339 N 6.37 0.00 0.00 2.88 0.11 -1.86 -1.20 132.00 138.31 1yq2 h PRO 339 Ca -0.32 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.62 1yq2 h PRO 339 Cb 1.18 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1yq2 h PRO 339 CO 0.29 0.00 -1.71 -0.25 -0.21 0.00 0.00 178.00 176.12 1yq2 n ASP 340 N -2.94 2.35 -0.00 -2.05 8.00 -1.26 -1.79 116.55 118.85 1yq2 n ASP 340 Ca -0.03 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.51 1yq2 n ASP 340 Cb 0.10 0.87 -0.04 0.00 -0.02 0.00 0.00 41.12 42.02 1yq2 n ASP 340 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1yq2 n ARG 341 N -2.33 4.18 0.00 -1.24 1.74 -1.17 -4.17 116.66 113.67 1yq2 n ARG 341 Ca -0.15 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.92 1yq2 n ARG 341 Cb 0.78 -0.87 0.00 0.00 -1.02 0.00 0.00 32.46 31.34 1yq2 n ARG 341 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yq2 n GLY 342 N 1.26 2.04 1.56 -0.13 0.00 -0.46 -3.20 105.19 106.27 1yq2 n GLY 342 Ca 0.01 -0.39 0.09 0.00 0.00 0.00 0.00 46.02 45.73 1yq2 n GLY 342 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yq2 n ARG 343 N 12.79 3.64 -2.34 1.61 1.74 -1.26 -1.57 116.66 131.26 1yq2 n ARG 343 Ca 0.00 -2.77 -0.42 0.00 -0.77 0.00 0.00 57.85 53.89 1yq2 n ARG 343 Cb 0.00 -1.88 -0.03 0.00 -1.02 0.00 0.00 32.46 29.53 1yq2 n ARG 343 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1yq2 s VAL 344 N -1.83 3.76 0.20 1.55 1.01 -1.19 -4.87 120.40 119.02 1yq2 s VAL 344 Ca 0.50 1.29 -0.30 0.00 0.00 0.00 0.00 61.98 63.47 1yq2 s VAL 344 Cb 0.32 -3.83 -0.08 0.00 0.00 0.00 0.00 36.38 32.79 1yq2 s VAL 344 CO 0.24 0.12 1.05 0.12 0.00 0.00 0.00 175.10 176.63 1yq2 s PHE 345 N 0.90 3.70 -0.10 5.22 5.36 -1.26 -4.90 117.98 126.90 1yq2 s PHE 345 Ca 0.59 1.71 -0.01 0.00 -0.96 0.00 0.00 56.93 58.26 1yq2 s PHE 345 Cb -0.32 -3.19 0.03 0.00 -0.34 0.00 0.00 43.02 39.20 1yq2 s PHE 345 CO 0.31 -0.27 -0.04 0.34 -1.46 0.00 0.00 175.22 174.09 1yq2 s ASP 346 N -0.44 2.00 0.11 6.13 2.15 -1.26 -5.06 116.67 120.30 1yq2 s ASP 346 Ca 0.46 -0.25 -0.21 0.00 0.43 0.00 0.00 52.55 52.99 1yq2 s ASP 346 Cb -0.28 -0.68 -0.09 0.00 -0.30 0.00 0.00 42.92 41.56 1yq2 s ASP 346 CO 0.35 -0.16 1.75 -0.08 -0.17 0.00 0.00 175.17 176.87 1yq2 h GLU 347 N 8.23 0.13 -0.61 4.34 4.81 -1.99 -0.00 114.58 129.49 1yq2 h GLU 347 Ca -0.25 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 58.98 1yq2 h GLU 347 Cb 1.13 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 1yq2 h GLU 347 CO 0.35 0.09 0.40 0.00 -0.73 0.00 0.00 179.01 179.12 1yq2 h ALA 348 N 1.06 0.78 -0.66 2.92 0.00 -1.99 0.58 119.26 121.95 1yq2 h ALA 348 Ca 0.05 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1yq2 h ALA 348 Cb 0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1yq2 h ALA 348 CO -0.04 0.20 0.30 0.78 0.00 0.00 0.00 179.25 180.50 1yq2 h GLY 349 N 0.83 1.03 1.19 0.00 0.00 -1.94 -1.67 103.07 102.51 1yq2 h GLY 349 Ca 0.23 -0.53 -0.12 0.00 0.00 0.00 0.00 47.33 46.91 1yq2 h GLY 349 CO -0.05 0.50 -0.18 0.00 0.00 0.00 0.00 176.54 176.81 1yq2 h ALA 350 N 1.13 0.78 -0.78 3.60 0.00 -0.58 -1.49 119.26 121.92 1yq2 h ALA 350 Ca 0.22 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1yq2 h ALA 350 Cb 0.15 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1yq2 h ALA 350 CO -0.03 0.66 0.43 -0.09 0.00 0.00 0.00 179.25 180.22 1yq2 h ARG 351 N 0.82 1.08 -0.33 0.00 2.43 -0.72 -0.91 114.38 116.76 1yq2 h ARG 351 Ca 0.12 -0.13 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 1yq2 h ARG 351 Cb 0.73 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1yq2 h ARG 351 CO 0.06 0.80 -0.19 1.49 -1.51 0.00 0.00 179.97 180.62 1yq2 h GLU 352 N 1.08 0.60 -0.24 0.20 4.57 -1.12 -0.54 114.58 119.13 1yq2 h GLU 352 Ca 0.27 -0.21 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 1yq2 h GLU 352 Cb 0.03 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 1yq2 h GLU 352 CO -0.04 0.76 0.06 0.22 -1.18 0.00 0.00 179.01 178.82 1yq2 h ASP 353 N 0.54 0.36 0.12 1.04 3.58 -0.87 -0.15 116.42 121.04 1yq2 h ASP 353 Ca 0.09 -0.23 -0.13 0.00 0.42 0.00 0.00 57.03 57.17 1yq2 h ASP 353 Cb 0.63 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 1yq2 h ASP 353 CO 0.04 0.50 -0.47 -0.07 -2.88 0.00 0.00 179.24 176.37 1yq2 h LEU 354 N 0.21 0.44 -0.61 2.28 3.38 -0.99 -1.78 115.31 118.24 1yq2 h LEU 354 Ca 0.08 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1yq2 h LEU 354 Cb 0.28 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1yq2 h LEU 354 CO 0.00 0.85 0.32 0.00 0.09 0.00 0.00 178.44 179.69 1yq2 h ALA 355 N 1.17 0.79 -0.59 1.53 0.00 -0.92 -1.03 119.26 120.21 1yq2 h ALA 355 Ca 0.02 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.84 1yq2 h ALA 355 Cb 0.95 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 1yq2 h ALA 355 CO 0.08 0.32 0.36 1.25 0.00 0.00 0.00 179.25 181.26 1yq2 h LEU 356 N 0.83 0.58 -0.35 0.00 5.85 -0.72 -2.29 115.31 119.22 1yq2 h LEU 356 Ca 0.21 0.00 0.07 0.00 0.84 0.00 0.00 57.88 59.01 1yq2 h LEU 356 Cb 0.08 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.92 1yq2 h LEU 356 CO -0.03 0.41 -0.10 0.24 -0.34 0.00 0.00 178.44 178.62 1yq2 h MET 357 N 0.71 -0.02 -0.91 1.25 2.86 -0.91 -2.37 114.93 115.54 1yq2 h MET 357 Ca 0.24 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.93 1yq2 h MET 357 Cb 0.02 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.63 1yq2 h MET 357 CO -0.10 -0.01 0.59 0.87 1.06 0.00 0.00 176.91 179.32 1yq2 h LYS 358 N -0.02 1.03 0.00 1.72 1.79 -0.88 -1.25 116.57 118.96 1yq2 h LYS 358 Ca 0.17 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.58 1yq2 h LYS 358 Cb 0.28 -0.23 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 1yq2 h LYS 358 CO -0.37 0.68 0.00 0.00 -1.08 0.00 0.00 179.45 178.68 1yq2 h ARG 359 N 1.06 0.00 -0.36 3.15 3.08 -0.89 -2.44 114.38 117.98 1yq2 h ARG 359 Ca 0.38 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.37 1yq2 h ARG 359 Cb 0.15 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.16 1yq2 h ARG 359 CO -0.14 0.00 0.03 1.19 -1.07 0.00 0.00 179.97 179.98 1yq2 n PHE 360 N -2.93 1.25 -1.62 3.04 3.72 -0.52 -4.97 117.46 115.43 1yq2 n PHE 360 Ca -0.01 -1.05 -0.12 0.00 -0.05 0.00 0.00 57.45 56.21 1yq2 n PHE 360 Cb 0.17 -0.41 -0.04 0.00 -0.94 0.00 0.00 39.48 38.26 1yq2 n PHE 360 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1yq2 n ASN 361 N -0.52 -4.32 -4.73 4.37 3.02 -0.92 -4.19 115.26 107.97 1yq2 n ASN 361 Ca 0.27 0.21 -0.41 0.00 -0.03 0.00 0.00 54.58 54.62 1yq2 n ASN 361 Cb 1.01 -3.10 -0.03 0.00 -0.61 0.00 0.00 39.78 37.05 1yq2 n ASN 361 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1yq2 s VAL 362 N -2.51 3.78 0.00 2.41 1.01 -0.93 -4.88 120.40 119.29 1yq2 s VAL 362 Ca 0.00 1.42 0.00 0.00 0.00 0.00 0.00 61.98 63.40 1yq2 s VAL 362 Cb 0.00 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.47 1yq2 s VAL 362 CO 0.00 0.19 0.59 -0.46 0.00 0.00 0.00 175.10 175.42 1yq2 n ASN 363 N 2.97 1.15 -3.63 3.32 0.23 -0.40 -4.41 115.26 114.49 1yq2 n ASN 363 Ca 0.06 -1.27 -0.15 0.00 -0.53 0.00 0.00 54.58 52.68 1yq2 n ASN 363 Cb 0.45 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.08 1yq2 n ASN 363 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1yq2 s ALA 364 N -0.27 -1.39 -0.04 -2.53 0.00 -1.22 -1.14 121.76 115.16 1yq2 s ALA 364 Ca 0.00 1.13 0.03 0.00 0.00 0.00 0.00 51.96 53.12 1yq2 s ALA 364 Cb 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.86 1yq2 s ALA 364 CO 0.00 -0.31 -0.13 0.42 0.00 0.00 0.00 175.76 175.74 1yq2 s ILE 365 N -0.78 1.11 -0.21 0.00 1.01 0.27 -1.55 121.20 121.05 1yq2 s ILE 365 Ca -0.08 -0.51 -0.06 0.00 0.00 0.00 0.00 60.65 59.99 1yq2 s ILE 365 Cb -0.03 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.43 1yq2 s ILE 365 CO 0.06 0.34 0.04 -0.60 0.00 0.00 0.00 174.94 174.77 1yq2 s ARG 366 N 0.31 3.76 -1.10 2.79 3.52 -0.45 -1.20 118.95 126.58 1yq2 s ARG 366 Ca -0.07 -0.45 -0.19 0.00 -0.13 0.00 0.00 55.73 54.89 1yq2 s ARG 366 Cb -0.12 -3.19 0.09 0.00 -1.56 0.00 0.00 34.95 30.17 1yq2 s ARG 366 CO 0.02 0.06 1.46 0.95 -0.81 0.00 0.00 175.30 176.97 1yq2 s THR 367 N 0.93 4.31 -0.31 4.11 -4.23 -0.80 -1.37 115.64 118.28 1yq2 s THR 367 Ca 0.03 -1.52 -0.21 0.00 -1.18 0.00 0.00 61.69 58.80 1yq2 s THR 367 Cb -0.14 -5.02 -0.00 0.00 1.34 0.00 0.00 72.50 68.68 1yq2 s THR 367 CO 0.02 -1.83 0.69 -0.94 -0.54 0.00 0.00 174.62 172.03 1yq2 s SER 368 N 4.18 6.55 -0.47 3.99 1.04 -1.15 -1.86 113.70 125.98 1yq2 s SER 368 Ca 0.45 0.49 0.07 0.00 0.48 0.00 0.00 55.95 57.45 1yq2 s SER 368 Cb -0.00 -2.36 0.25 0.00 0.10 0.00 0.00 66.02 64.01 1yq2 s SER 368 CO -0.04 -0.54 0.61 1.41 0.98 0.00 0.00 173.24 175.66 1yq2 n HIS 369 N 6.01 1.04 0.00 5.02 -0.00 -1.26 -4.31 115.22 121.71 1yq2 n HIS 369 Ca 0.01 -3.77 0.00 0.00 -0.00 0.00 0.00 57.72 53.96 1yq2 n HIS 369 Cb 0.49 -0.42 0.00 0.00 -0.00 0.00 0.00 29.99 30.05 1yq2 n HIS 369 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.34 178.82 1yq2 n TYR 370 N 1.18 0.00 -2.18 4.41 0.18 -0.78 -3.89 117.16 116.08 1yq2 n TYR 370 Ca 0.24 0.00 -0.39 0.00 1.88 0.00 0.00 57.90 59.63 1yq2 n TYR 370 Cb 0.49 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.44 1yq2 n TYR 370 CO 0.00 0.00 0.00 -2.14 -2.08 0.00 0.00 176.86 172.64 1yq2 s PRO 371 N -2.00 4.04 0.56 -3.48 0.02 -0.98 -4.59 135.00 128.56 1yq2 s PRO 371 Ca 0.00 2.00 -0.08 0.00 0.02 0.00 0.00 61.00 62.94 1yq2 s PRO 371 Cb 0.00 -2.74 0.12 0.00 0.02 0.00 0.00 34.50 31.90 1yq2 s PRO 371 CO 0.00 -0.38 0.76 -0.35 -0.33 0.00 0.00 177.00 176.70 1yq2 n PRO 372 N 0.16 -0.56 -1.69 5.54 -0.04 -1.26 -4.89 135.00 132.26 1yq2 n PRO 372 Ca 0.04 -1.34 -0.43 0.00 -0.04 0.00 0.00 63.50 61.73 1yq2 n PRO 372 Cb 0.45 -0.73 -0.02 0.00 -0.04 0.00 0.00 33.50 33.16 1yq2 n PRO 372 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1yq2 n HIS 373 N -2.92 2.25 0.27 0.54 -0.00 -1.26 -4.84 115.22 109.25 1yq2 n HIS 373 Ca 0.10 0.49 0.14 0.00 -0.00 0.00 0.00 57.72 58.45 1yq2 n HIS 373 Cb 0.35 -2.44 0.83 0.00 -0.00 0.00 0.00 29.99 28.73 1yq2 n HIS 373 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1yq2 h PRO 374 N 3.35 0.00 0.00 1.57 0.13 -1.95 -1.07 132.00 134.03 1yq2 h PRO 374 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 1yq2 h PRO 374 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1yq2 h PRO 374 CO 0.69 0.00 -0.24 -0.09 -0.23 0.00 0.00 178.00 178.12 1yq2 h ARG 375 N 0.00 0.00 -0.57 0.86 9.65 -2.01 -2.48 114.38 119.83 1yq2 h ARG 375 Ca 0.02 0.00 0.04 0.00 -1.10 0.00 0.00 59.98 58.94 1yq2 h ARG 375 Cb 0.11 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.66 1yq2 h ARG 375 CO -0.00 0.24 0.38 1.25 2.80 0.00 0.00 179.97 184.64 1yq2 h LEU 376 N 0.00 0.55 -0.98 3.80 5.85 -1.54 -2.04 115.31 120.95 1yq2 h LEU 376 Ca -0.00 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.61 1yq2 h LEU 376 Cb 0.56 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1yq2 h LEU 376 CO 0.03 0.38 -0.43 -0.07 -0.34 0.00 0.00 178.44 178.01 1yq2 h LEU 377 N 0.64 0.17 -0.81 2.25 -0.00 -1.60 -1.32 115.31 114.64 1yq2 h LEU 377 Ca 0.23 -0.07 0.04 0.00 -0.00 0.00 0.00 57.88 58.08 1yq2 h LEU 377 Cb 0.12 -0.05 -0.05 0.00 -0.00 0.00 0.00 40.66 40.68 1yq2 h LEU 377 CO -0.06 0.59 0.51 0.44 -0.00 0.00 0.00 178.44 179.91 1yq2 h ASP 378 N 0.14 0.83 -0.63 -0.43 3.32 -1.46 -0.80 116.42 117.38 1yq2 h ASP 378 Ca 0.01 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 1yq2 h ASP 378 Cb 0.82 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 1yq2 h ASP 378 CO 0.06 0.56 0.08 -0.07 -1.72 0.00 0.00 179.24 178.15 1yq2 h LEU 379 N 0.97 1.02 -0.90 1.55 3.38 -1.11 -2.43 115.31 117.80 1yq2 h LEU 379 Ca 0.34 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1yq2 h LEU 379 Cb 0.07 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1yq2 h LEU 379 CO -0.14 1.03 0.27 0.00 0.09 0.00 0.00 178.44 179.70 1yq2 h ALA 380 N 1.02 1.12 -0.77 1.53 0.00 -0.84 0.39 119.26 121.71 1yq2 h ALA 380 Ca 0.19 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1yq2 h ALA 380 Cb 0.46 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1yq2 h ALA 380 CO 0.02 0.62 0.50 -0.44 0.00 0.00 0.00 179.25 179.96 1yq2 h ASP 381 N 1.05 0.88 0.08 0.00 3.32 -0.99 -0.56 116.42 120.21 1yq2 h ASP 381 Ca 0.24 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.15 1yq2 h ASP 381 Cb 0.22 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.56 1yq2 h ASP 381 CO -0.02 0.64 -0.50 -0.08 -1.72 0.00 0.00 179.24 177.57 1yq2 h GLU 382 N 1.04 0.19 0.00 3.56 4.81 -1.21 -3.37 114.58 119.60 1yq2 h GLU 382 Ca 0.28 -0.32 -0.22 0.00 -0.13 0.00 0.00 59.36 58.97 1yq2 h GLU 382 Cb -0.11 0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.35 1yq2 h GLU 382 CO -0.06 1.14 -1.24 0.52 -0.73 0.00 0.00 179.01 178.64 1yq2 h MET 383 N -0.59 0.00 0.00 1.92 2.86 -0.96 -3.45 114.93 114.72 1yq2 h MET 383 Ca -0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1yq2 h MET 383 Cb 1.38 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.04 1yq2 h MET 383 CO 0.09 0.68 0.00 0.41 1.06 0.00 0.00 176.91 179.15 1yq2 n GLY 384 N 1.41 0.11 2.93 8.32 0.00 -0.24 -4.88 105.19 112.86 1yq2 n GLY 384 Ca -0.07 -0.71 -0.16 0.00 0.00 0.00 0.00 46.02 45.09 1yq2 n GLY 384 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yq2 s PHE 385 N 0.00 0.41 0.10 1.61 0.40 -1.10 -4.70 117.98 114.70 1yq2 s PHE 385 Ca 0.00 -0.08 -0.30 0.00 -0.60 0.00 0.00 56.93 55.95 1yq2 s PHE 385 Cb 0.00 -0.28 -0.06 0.00 0.51 0.00 0.00 43.02 43.18 1yq2 s PHE 385 CO 0.00 -0.02 1.18 -1.58 0.70 0.00 0.00 175.22 175.50 1yq2 s TRP 386 N 0.02 3.46 -0.09 0.36 0.52 -0.29 -4.66 118.94 118.25 1yq2 s TRP 386 Ca 0.00 1.37 0.04 0.00 0.02 0.00 0.00 56.10 57.53 1yq2 s TRP 386 Cb -0.03 -3.40 -0.01 0.00 -1.15 0.00 0.00 33.47 28.89 1yq2 s TRP 386 CO -0.00 -1.16 -0.23 0.08 0.02 0.00 0.00 176.95 175.66 1yq2 s VAL 387 N 0.65 2.19 -0.42 4.03 1.01 0.15 -0.57 120.40 127.44 1yq2 s VAL 387 Ca 0.56 -0.99 -0.17 0.00 0.00 0.00 0.00 61.98 61.39 1yq2 s VAL 387 Cb -0.30 -1.83 0.02 0.00 0.00 0.00 0.00 36.38 34.27 1yq2 s VAL 387 CO 0.31 0.56 0.40 -0.63 0.00 0.00 0.00 175.10 175.74 1yq2 s ILE 388 N 0.18 5.14 -0.39 2.22 1.01 -0.34 -1.39 121.20 127.64 1yq2 s ILE 388 Ca -0.13 -0.49 -0.18 0.00 0.00 0.00 0.00 60.65 59.85 1yq2 s ILE 388 Cb -0.16 -4.02 0.01 0.00 0.01 0.00 0.00 42.46 38.30 1yq2 s ILE 388 CO 0.07 -0.41 0.49 -0.22 0.00 0.00 0.00 174.94 174.87 1yq2 s LEU 389 N 1.98 4.57 -0.15 2.97 1.98 -0.82 -1.91 118.68 127.29 1yq2 s LEU 389 Ca 0.09 -0.34 -0.08 0.00 -2.89 0.00 0.00 54.13 50.92 1yq2 s LEU 389 Cb -0.18 -2.51 -0.04 0.00 0.66 0.00 0.00 46.19 44.12 1yq2 s LEU 389 CO 0.12 -0.55 0.14 -0.70 -1.89 0.00 0.00 176.35 173.47 1yq2 s GLU 390 N 2.33 3.75 0.60 1.98 2.12 -1.26 -1.21 118.70 127.00 1yq2 s GLU 390 Ca 0.16 -0.16 -0.18 0.00 0.36 0.00 0.00 54.97 55.15 1yq2 s GLU 390 Cb -0.16 -3.28 -0.03 0.00 0.26 0.00 0.00 34.13 30.91 1yq2 s GLU 390 CO 0.14 0.58 1.13 0.00 -0.54 0.00 0.00 175.26 176.58 1yq2 s ASP 392 N -2.04 6.20 -0.27 0.00 -1.08 -1.26 -3.95 116.67 114.26 1yq2 s ASP 392 Ca 0.71 -1.47 -0.12 0.00 -0.52 0.00 0.00 52.55 51.16 1yq2 s ASP 392 Cb -0.24 -2.57 0.10 0.00 -1.46 0.00 0.00 42.92 38.76 1yq2 s ASP 392 CO 0.33 -1.80 0.62 -0.22 0.52 0.00 0.00 175.17 174.63 1yq2 s LEU 393 N 6.24 -0.95 -0.24 -1.34 2.96 -1.25 -4.91 118.68 119.18 1yq2 s LEU 393 Ca 0.53 1.44 -0.08 0.00 -0.22 0.00 0.00 54.13 55.81 1yq2 s LEU 393 Cb -0.01 2.16 0.11 0.00 0.50 0.00 0.00 46.19 48.95 1yq2 s LEU 393 CO -0.04 -0.23 0.51 -0.70 -1.32 0.00 0.00 176.35 174.58 1yq2 s GLU 394 N 2.33 0.43 -0.20 1.98 2.12 0.15 -1.48 118.70 124.02 1yq2 s GLU 394 Ca -0.07 1.21 0.13 0.00 0.36 0.00 0.00 54.97 56.60 1yq2 s GLU 394 Cb -0.09 0.56 0.41 0.00 0.26 0.00 0.00 34.13 35.26 1yq2 s GLU 394 CO -0.18 -0.23 1.25 0.25 -0.54 0.00 0.00 175.26 175.81 1yq2 n THR 395 N 5.42 2.19 -0.31 -1.70 -2.24 -1.23 -1.10 114.28 115.30 1yq2 n THR 395 Ca -0.10 -2.87 0.24 0.00 -2.27 0.00 0.00 64.05 59.05 1yq2 n THR 395 Cb 0.49 -0.25 0.55 0.00 -2.10 0.00 0.00 70.33 69.02 1yq2 n THR 395 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1yq2 h HIS 396 N 0.79 0.53 0.00 4.78 6.17 -1.62 -0.71 115.15 125.10 1yq2 h HIS 396 Ca 0.03 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.13 1yq2 h HIS 396 Cb 1.12 -0.16 0.00 0.00 2.52 0.00 0.00 27.41 30.89 1yq2 h HIS 396 CO 0.60 0.06 0.00 0.41 0.71 0.00 0.00 177.93 179.71 1yq2 n GLY 397 N -1.53 -0.99 0.04 5.26 0.00 -1.25 -1.82 105.19 104.91 1yq2 n GLY 397 Ca 0.24 0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.45 1yq2 n GLY 397 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1yq2 n PHE 398 N -1.95 0.32 -0.09 1.61 3.01 -0.27 -4.12 117.46 115.97 1yq2 n PHE 398 Ca 0.01 0.11 -0.10 0.00 1.01 0.00 0.00 57.45 58.48 1yq2 n PHE 398 Cb 0.13 -0.67 -0.03 0.00 -0.01 0.00 0.00 39.48 38.90 1yq2 n PHE 398 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1yq2 h GLU 399 N 0.00 0.42 -0.36 -1.08 4.81 -1.57 -1.48 114.58 115.32 1yq2 h GLU 399 Ca 0.00 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.20 1yq2 h GLU 399 Cb 0.46 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 1yq2 h GLU 399 CO 0.00 0.43 0.24 0.00 -0.73 0.00 0.00 179.01 178.95 1yq2 h ALA 400 N 0.97 1.93 -0.30 2.92 0.00 -1.81 0.20 119.26 123.17 1yq2 h ALA 400 Ca 0.10 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1yq2 h ALA 400 Cb 0.16 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1yq2 h ALA 400 CO -0.01 0.01 0.09 0.41 0.00 0.00 0.00 179.25 179.75 1yq2 n GLY 401 N -1.52 2.42 2.26 0.00 0.00 -1.17 -4.88 105.19 102.31 1yq2 n GLY 401 Ca 0.04 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.53 1yq2 n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 402 N 0.12 0.35 2.46 -0.02 0.00 0.69 -3.31 105.19 105.48 1yq2 n GLY 402 Ca 0.16 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 1yq2 n GLY 402 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1yq2 n TRP 403 N -3.56 0.00 -2.04 1.61 7.02 -0.57 -4.97 117.44 114.93 1yq2 n TRP 403 Ca -0.13 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 55.93 1yq2 n TRP 403 Cb 0.53 -2.18 -0.03 0.00 -2.42 0.00 0.00 31.31 27.21 1yq2 n TRP 403 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1yq2 s VAL 404 N -2.23 2.99 -0.38 -0.99 1.01 -1.21 -1.57 120.40 118.02 1yq2 s VAL 404 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 61.98 62.65 1yq2 s VAL 404 Cb 0.00 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.95 1yq2 s VAL 404 CO 0.00 0.04 0.00 -0.62 0.00 0.00 0.00 175.10 174.52 1yq2 n GLU 405 N 4.24 -0.93 -1.64 2.72 1.02 -1.26 -4.96 120.64 119.84 1yq2 n GLU 405 Ca 0.13 0.46 -0.54 0.00 -0.02 0.00 0.00 57.16 57.20 1yq2 n GLU 405 Cb 0.40 -4.29 -0.07 0.00 -0.02 0.00 0.00 31.44 27.47 1yq2 n GLU 405 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1yq2 n ASN 406 N -0.25 2.60 -0.17 1.62 5.15 -0.61 -4.83 115.26 118.77 1yq2 n ASN 406 Ca -0.04 0.89 0.28 0.00 -0.60 0.00 0.00 54.58 55.12 1yq2 n ASN 406 Cb 0.29 -1.23 0.72 0.00 -0.53 0.00 0.00 39.78 39.04 1yq2 n ASN 406 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1yq2 h PRO 407 N 8.97 0.00 -0.00 1.20 0.11 -1.91 -0.98 132.00 139.39 1yq2 h PRO 407 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1yq2 h PRO 407 Cb 1.31 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 1yq2 h PRO 407 CO 0.97 0.00 0.00 0.77 -0.21 0.00 0.00 178.00 179.54 1yq2 h SER 408 N 0.00 0.00 0.00 -2.05 0.02 -1.88 -2.98 113.55 106.66 1yq2 h SER 408 Ca 0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.37 1yq2 h SER 408 Cb 1.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.24 1yq2 h SER 408 CO -0.00 0.00 -0.08 -0.67 -1.14 0.00 0.00 176.83 174.94 1yq2 n ASP 409 N -3.19 1.53 -4.45 3.07 2.03 -0.39 -1.60 116.55 113.56 1yq2 n ASP 409 Ca -0.03 -2.25 -0.37 0.00 0.52 0.00 0.00 54.79 52.66 1yq2 n ASP 409 Cb 0.08 -0.19 -0.12 0.00 -0.72 0.00 0.00 41.12 40.17 1yq2 n ASP 409 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1yq2 s VAL 410 N -1.38 4.37 0.48 5.18 1.01 -1.13 -4.81 120.40 124.12 1yq2 s VAL 410 Ca 0.12 -0.16 0.21 0.00 0.00 0.00 0.00 61.98 62.14 1yq2 s VAL 410 Cb 0.10 -3.05 0.38 0.00 0.00 0.00 0.00 36.38 33.81 1yq2 s VAL 410 CO 0.01 0.33 1.96 -0.65 0.00 0.00 0.00 175.10 176.74 1yq2 h PRO 411 N 8.25 0.20 -0.14 2.72 0.11 -1.94 -2.13 132.00 139.07 1yq2 h PRO 411 Ca -0.38 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.76 1yq2 h PRO 411 Cb 1.17 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1yq2 h PRO 411 CO 0.58 0.13 0.20 0.00 -0.21 0.00 0.00 178.00 178.70 1yq2 h ALA 412 N 1.68 1.64 -0.03 -0.75 0.00 -1.95 -1.43 119.26 118.43 1yq2 h ALA 412 Ca 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1yq2 h ALA 412 Cb 0.95 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1yq2 h ALA 412 CO -0.06 -0.27 -0.08 0.91 0.00 0.00 0.00 179.25 179.75 1yq2 n TRP 413 N -3.58 0.00 -0.11 0.00 7.02 -0.80 -4.54 117.44 115.43 1yq2 n TRP 413 Ca 0.01 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.41 1yq2 n TRP 413 Cb 0.30 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.20 1yq2 n TRP 413 CO 0.00 0.00 0.00 -0.09 -2.02 0.00 0.00 177.69 175.58 1yq2 h ARG 414 N 4.22 0.43 -0.57 -0.99 2.43 -1.33 -1.15 114.38 117.41 1yq2 h ARG 414 Ca 0.00 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1yq2 h ARG 414 Cb 0.94 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.37 1yq2 h ARG 414 CO 0.00 0.29 0.01 -0.44 -1.51 0.00 0.00 179.97 178.32 1yq2 h ASP 415 N 0.45 0.95 -0.30 -3.80 3.32 -1.83 -1.08 116.42 114.13 1yq2 h ASP 415 Ca 0.15 -0.25 0.03 0.00 0.02 0.00 0.00 57.03 56.97 1yq2 h ASP 415 Cb 0.00 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 1yq2 h ASP 415 CO -0.07 1.00 0.13 0.00 -1.72 0.00 0.00 179.24 178.58 1yq2 h ALA 416 N 1.10 0.35 -0.40 3.45 0.00 -1.68 -0.33 119.26 121.75 1yq2 h ALA 416 Ca 0.17 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1yq2 h ALA 416 Cb 0.51 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1yq2 h ALA 416 CO 0.02 -0.26 0.03 -0.07 0.00 0.00 0.00 179.25 178.97 1yq2 h LEU 417 N 0.28 0.66 -0.78 0.00 4.07 -0.74 -0.53 115.31 118.27 1yq2 h LEU 417 Ca 0.13 -0.28 -0.10 0.00 0.08 0.00 0.00 57.88 57.70 1yq2 h LEU 417 Cb 0.07 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.61 1yq2 h LEU 417 CO -0.11 0.78 -0.13 0.58 -1.08 0.00 0.00 178.44 178.48 1yq2 h VAL 418 N 0.52 1.26 -0.66 1.22 2.07 -1.15 -2.21 116.25 117.30 1yq2 h VAL 418 Ca 0.12 -1.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.40 1yq2 h VAL 418 Cb 0.42 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 1yq2 h VAL 418 CO 0.01 0.41 0.30 -0.78 0.02 0.00 0.00 177.57 177.53 1yq2 h ASP 419 N 0.70 0.88 -0.72 0.57 3.58 -0.84 -0.34 116.42 120.25 1yq2 h ASP 419 Ca 0.11 -0.15 0.09 0.00 0.42 0.00 0.00 57.03 57.51 1yq2 h ASP 419 Cb 0.62 -0.23 -0.07 0.00 1.72 0.00 0.00 39.33 41.37 1yq2 h ASP 419 CO 0.04 0.79 0.37 0.03 -2.88 0.00 0.00 179.24 177.59 1yq2 h ARG 420 N 0.92 0.61 -0.61 0.28 3.08 -0.82 -1.23 114.38 116.61 1yq2 h ARG 420 Ca 0.22 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 60.14 1yq2 h ARG 420 Cb 0.15 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1yq2 h ARG 420 CO -0.02 0.41 -0.01 1.98 -1.07 0.00 0.00 179.97 181.25 1yq2 h MET 421 N 0.63 1.08 -0.19 0.04 4.05 -0.77 -1.68 114.93 118.10 1yq2 h MET 421 Ca 0.35 -0.35 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1yq2 h MET 421 Cb 0.35 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 1yq2 h MET 421 CO -0.26 1.06 0.12 1.49 0.23 0.00 0.00 176.91 179.55 1yq2 h GLU 422 N 0.98 0.25 -0.37 0.39 4.81 -0.67 -0.93 114.58 119.05 1yq2 h GLU 422 Ca 0.17 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.31 1yq2 h GLU 422 Cb 0.58 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1yq2 h GLU 422 CO 0.03 0.19 -0.05 0.00 -0.73 0.00 0.00 179.01 178.45 1yq2 h ARG 423 N 0.23 0.61 0.11 1.92 3.08 -1.18 0.13 114.38 119.28 1yq2 h ARG 423 Ca 0.07 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1yq2 h ARG 423 Cb 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1yq2 h ARG 423 CO -0.01 0.67 -0.05 1.15 -1.07 0.00 0.00 179.97 180.65 1yq2 h THR 424 N 0.57 0.99 -0.04 2.04 2.02 -1.01 -2.59 112.91 114.89 1yq2 h THR 424 Ca 0.11 -0.39 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 1yq2 h THR 424 Cb 0.44 1.24 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1yq2 h THR 424 CO 0.02 0.09 -0.07 0.58 0.37 0.00 0.00 175.52 176.51 1yq2 h VAL 425 N -0.32 1.42 -0.57 3.16 2.07 -1.05 -3.24 116.25 117.72 1yq2 h VAL 425 Ca -0.01 -1.36 -0.03 0.00 0.82 0.00 0.00 66.70 66.12 1yq2 h VAL 425 Cb 0.27 2.23 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 1yq2 h VAL 425 CO 0.02 0.37 0.22 -0.33 0.02 0.00 0.00 177.57 177.87 1yq2 h GLU 426 N -0.38 0.82 -0.85 1.57 4.39 -0.82 -1.67 114.58 117.65 1yq2 h GLU 426 Ca 0.00 -0.13 -0.02 0.00 0.34 0.00 0.00 59.36 59.55 1yq2 h GLU 426 Cb 0.63 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 29.10 1yq2 h GLU 426 CO 0.02 0.68 0.44 -0.09 -1.16 0.00 0.00 179.01 178.90 1yq2 h ARG 427 N 0.81 1.20 -0.06 2.33 2.43 -1.47 -2.77 114.38 116.85 1yq2 h ARG 427 Ca 0.19 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1yq2 h ARG 427 Cb 0.17 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1yq2 h ARG 427 CO -0.02 0.90 0.00 -0.25 -1.51 0.00 0.00 179.97 179.09 1yq2 n ASP 428 N -4.35 1.91 0.20 -3.80 8.00 -1.09 -2.03 116.55 115.39 1yq2 n ASP 428 Ca 0.08 -1.49 0.18 0.00 0.71 0.00 0.00 54.79 54.27 1yq2 n ASP 428 Cb 0.11 -0.04 0.75 0.00 -0.02 0.00 0.00 41.12 41.93 1yq2 n ASP 428 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 1yq2 h LYS 429 N 1.63 0.00 -0.00 -1.24 2.10 -1.42 -1.84 116.57 115.80 1yq2 h LYS 429 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1yq2 h LYS 429 Cb 0.42 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 1yq2 h LYS 429 CO 0.00 0.00 -0.06 0.09 -2.00 0.00 0.00 179.45 177.48 1yq2 n ASN 430 N -3.29 0.07 -4.67 7.07 3.02 -1.26 -4.87 115.26 111.32 1yq2 n ASN 430 Ca 0.03 0.39 -0.41 0.00 -0.03 0.00 0.00 54.58 54.56 1yq2 n ASN 430 Cb 0.54 -0.40 -0.04 0.00 -0.61 0.00 0.00 39.78 39.27 1yq2 n ASN 430 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1yq2 s HIS 431 N -2.99 3.41 0.28 3.10 3.76 -0.69 -4.93 115.29 117.23 1yq2 s HIS 431 Ca 0.14 1.20 0.28 0.00 -0.15 0.00 0.00 55.06 56.53 1yq2 s HIS 431 Cb 0.19 -2.98 1.30 0.00 1.11 0.00 0.00 32.58 32.19 1yq2 s HIS 431 CO 0.55 -0.24 1.98 -1.00 -0.85 0.00 0.00 174.74 175.19 1yq2 h PRO 432 N 7.37 0.00 0.00 8.40 0.13 -1.89 -2.75 132.00 143.26 1yq2 h PRO 432 Ca -0.29 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.79 1yq2 h PRO 432 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1yq2 h PRO 432 CO 0.83 0.14 -0.21 0.66 -0.23 0.00 0.00 178.00 179.18 1yq2 h SER 433 N 0.00 0.00 -3.50 1.44 4.64 -1.90 -3.41 113.55 110.83 1yq2 h SER 433 Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1yq2 h SER 433 Cb 0.50 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.52 1yq2 h SER 433 CO 0.02 0.21 0.93 -0.63 -0.87 0.00 0.00 176.83 176.49 1yq2 s ILE 434 N -3.99 4.24 -0.58 0.95 1.01 -1.04 0.32 121.20 122.10 1yq2 s ILE 434 Ca -0.02 1.33 0.10 0.00 0.00 0.00 0.00 60.65 62.07 1yq2 s ILE 434 Cb 0.12 -4.46 -0.09 0.00 0.01 0.00 0.00 42.46 38.04 1yq2 s ILE 434 CO 0.63 -0.79 0.48 1.33 0.00 0.00 0.00 174.94 176.59 1yq2 n VAL 435 N 6.55 0.00 -3.82 2.92 0.24 -0.49 -4.92 118.33 118.82 1yq2 n VAL 435 Ca 0.13 -0.29 -0.12 0.00 -2.04 0.00 0.00 64.34 62.02 1yq2 n VAL 435 Cb 0.48 1.03 -0.10 0.00 -1.47 0.00 0.00 33.84 33.77 1yq2 n VAL 435 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 1yq2 s MET 436 N -1.85 0.45 -0.13 7.34 -2.45 -1.20 -3.93 119.30 117.53 1yq2 s MET 436 Ca 0.05 -0.11 -0.08 0.00 -1.25 0.00 0.00 55.69 54.30 1yq2 s MET 436 Cb 0.08 0.20 -0.04 0.00 1.25 0.00 0.00 34.83 36.31 1yq2 s MET 436 CO 0.39 -0.10 0.15 -1.58 1.05 0.00 0.00 175.02 174.93 1yq2 s TRP 437 N -0.85 3.57 0.01 4.11 0.23 -0.61 -1.95 118.94 123.44 1yq2 s TRP 437 Ca -0.09 0.52 0.06 0.00 -2.03 0.00 0.00 56.10 54.55 1yq2 s TRP 437 Cb -0.05 -2.01 -0.03 0.00 0.03 0.00 0.00 33.47 31.41 1yq2 s TRP 437 CO 0.02 0.64 -0.17 0.45 0.96 0.00 0.00 176.95 178.84 1yq2 s SER 438 N -0.73 3.82 0.39 2.95 0.15 -0.35 -0.38 113.70 119.55 1yq2 s SER 438 Ca 0.14 -0.37 0.21 0.00 0.70 0.00 0.00 55.95 56.64 1yq2 s SER 438 Cb -0.12 -0.66 0.49 0.00 -1.71 0.00 0.00 66.02 64.02 1yq2 s SER 438 CO 0.03 0.28 1.64 -0.07 1.20 0.00 0.00 173.24 176.33 1yq2 h LEU 439 N 4.80 0.00 0.00 3.45 3.38 -1.65 0.46 115.31 125.75 1yq2 h LEU 439 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1yq2 h LEU 439 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1yq2 h LEU 439 CO 0.48 0.25 0.00 0.61 0.09 0.00 0.00 178.44 179.87 1yq2 n GLY 440 N 0.79 0.39 3.05 0.83 0.00 -1.26 -4.44 105.19 104.55 1yq2 n GLY 440 Ca 0.02 -1.45 -0.13 0.00 0.00 0.00 0.00 46.02 44.46 1yq2 n GLY 440 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1yq2 s ASN 441 N -4.00 -0.22 -1.30 1.61 2.47 -0.55 -4.69 114.94 108.26 1yq2 s ASN 441 Ca 0.00 0.46 -0.13 0.00 0.42 0.00 0.00 52.86 53.60 1yq2 s ASN 441 Cb 0.00 0.38 0.01 0.00 -1.45 0.00 0.00 41.25 40.19 1yq2 s ASN 441 CO 0.00 -0.13 0.54 -0.62 -3.72 0.00 0.00 177.10 173.17 1yq2 n GLU 442 N 3.81 -1.77 -0.26 0.43 1.02 -1.26 -4.08 120.64 118.53 1yq2 n GLU 442 Ca -0.21 0.32 0.08 0.00 -0.02 0.00 0.00 57.16 57.33 1yq2 n GLU 442 Cb 0.55 -3.90 0.17 0.00 -0.02 0.00 0.00 31.44 28.23 1yq2 n GLU 442 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1yq2 n SER 443 N -2.71 2.28 0.00 1.62 7.64 -1.26 -1.78 113.62 119.40 1yq2 n SER 443 Ca -0.21 -3.32 0.00 0.00 1.01 0.00 0.00 58.87 56.35 1yq2 n SER 443 Cb 0.63 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 1yq2 n SER 443 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yq2 n GLY 444 N -1.29 0.75 3.24 0.23 0.00 -1.26 -4.63 105.19 102.23 1yq2 n GLY 444 Ca 0.18 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 1yq2 n GLY 444 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1yq2 s THR 445 N 0.00 0.24 0.00 2.61 -1.32 -1.26 -4.58 115.64 111.33 1yq2 s THR 445 Ca 0.00 -1.99 0.00 0.00 -1.21 0.00 0.00 61.69 58.49 1yq2 s THR 445 Cb 0.00 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.51 1yq2 s THR 445 CO 0.00 -0.07 0.00 0.61 -2.21 0.00 0.00 174.62 172.95 1yq2 n GLY 446 N -0.32 0.87 0.32 6.08 0.00 -1.26 -4.43 105.19 106.45 1yq2 n GLY 446 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1yq2 n GLY 446 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1yq2 h SER 447 N 0.00 0.74 0.07 1.61 0.87 -1.87 -2.69 113.55 112.28 1yq2 h SER 447 Ca 0.00 -0.06 -0.10 0.00 -1.23 0.00 0.00 61.79 60.40 1yq2 h SER 447 Cb 0.00 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 1yq2 h SER 447 CO 0.00 0.61 -0.31 0.78 -0.53 0.00 0.00 176.83 177.38 1yq2 h ASN 448 N 0.83 0.37 -0.31 6.23 2.35 -1.63 0.17 115.58 123.59 1yq2 h ASN 448 Ca 0.21 -0.14 -0.10 0.00 -0.55 0.00 0.00 56.30 55.73 1yq2 h ASN 448 Cb 0.05 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 1yq2 h ASN 448 CO -0.03 0.68 -0.18 -0.07 -1.65 0.00 0.00 177.43 176.17 1yq2 h LEU 449 N 0.32 0.71 -1.39 1.61 3.38 -1.55 -1.66 115.31 116.72 1yq2 h LEU 449 Ca 0.04 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1yq2 h LEU 449 Cb 0.72 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1yq2 h LEU 449 CO 0.05 0.97 0.15 0.00 0.09 0.00 0.00 178.44 179.71 1yq2 h ALA 450 N 0.75 1.52 -0.58 1.53 0.00 -1.19 -1.08 119.26 120.21 1yq2 h ALA 450 Ca 0.07 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1yq2 h ALA 450 Cb 0.72 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1yq2 h ALA 450 CO 0.05 0.37 -0.03 0.00 0.00 0.00 0.00 179.25 179.64 1yq2 h ALA 451 N 1.61 0.83 -0.34 0.00 0.00 -0.66 -0.13 119.26 120.57 1yq2 h ALA 451 Ca 0.14 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1yq2 h ALA 451 Cb 0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1yq2 h ALA 451 CO -0.01 0.67 0.20 0.52 0.00 0.00 0.00 179.25 180.62 1yq2 h MET 452 N 0.95 0.40 -0.68 0.00 2.07 -0.66 0.12 114.93 117.13 1yq2 h MET 452 Ca 0.16 -0.02 -0.02 0.00 -2.07 0.00 0.00 59.70 57.75 1yq2 h MET 452 Cb 0.59 -0.09 -0.03 0.00 -1.87 0.00 0.00 31.60 30.20 1yq2 h MET 452 CO 0.04 0.26 0.36 0.00 1.07 0.00 0.00 176.91 178.64 1yq2 h ALA 453 N 1.15 0.87 -0.54 6.32 0.00 -1.00 -1.26 119.26 124.80 1yq2 h ALA 453 Ca 0.13 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1yq2 h ALA 453 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1yq2 h ALA 453 CO -0.06 0.39 0.21 0.00 0.00 0.00 0.00 179.25 179.79 1yq2 h ALA 454 N 1.18 0.70 0.07 0.00 0.00 -0.77 -0.22 119.26 120.22 1yq2 h ALA 454 Ca 0.24 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1yq2 h ALA 454 Cb 0.06 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1yq2 h ALA 454 CO -0.04 0.32 -0.04 2.35 0.00 0.00 0.00 179.25 181.84 1yq2 h TRP 455 N 0.73 -0.09 -0.38 0.00 7.01 -0.74 -1.41 115.95 121.07 1yq2 h TRP 455 Ca 0.18 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.21 1yq2 h TRP 455 Cb 0.21 0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.27 1yq2 h TRP 455 CO 0.01 -0.06 0.16 0.00 -2.79 0.00 0.00 178.44 175.77 1yq2 h ALA 456 N 0.83 0.46 -0.80 2.65 0.00 -1.10 -0.29 119.26 121.01 1yq2 h ALA 456 Ca -0.01 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.04 1yq2 h ALA 456 Cb 0.08 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.76 1yq2 h ALA 456 CO 0.02 -0.21 0.42 0.45 0.00 0.00 0.00 179.25 179.92 1yq2 h HIS 457 N 0.34 0.75 -0.10 0.00 3.86 -0.89 0.48 115.15 119.60 1yq2 h HIS 457 Ca 0.17 0.03 -0.16 0.00 -1.16 0.00 0.00 60.37 59.25 1yq2 h HIS 457 Cb 0.11 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.35 1yq2 h HIS 457 CO -0.12 0.25 -0.63 0.00 0.86 0.00 0.00 177.93 178.29 1yq2 h ALA 458 N 1.49 0.74 0.08 2.45 0.00 -0.56 -3.33 119.26 120.14 1yq2 h ALA 458 Ca 0.41 -0.55 -0.14 0.00 0.00 0.00 0.00 54.91 54.62 1yq2 h ALA 458 Cb 0.47 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1yq2 h ALA 458 CO -0.30 0.73 -0.66 -0.09 0.00 0.00 0.00 179.25 178.93 1yq2 h ARG 459 N 0.26 0.17 -3.08 0.00 9.65 -0.68 -3.45 114.38 117.26 1yq2 h ARG 459 Ca -0.01 -0.30 -0.58 0.00 -1.10 0.00 0.00 59.98 57.99 1yq2 h ARG 459 Cb 1.16 0.11 -0.40 0.00 -1.39 0.00 0.00 29.97 29.45 1yq2 h ARG 459 CO 0.10 1.14 -0.77 0.34 2.80 0.00 0.00 179.97 183.58 1yq2 s ASP 460 N -6.72 3.63 0.00 -3.80 2.15 0.13 -4.96 116.67 107.09 1yq2 s ASP 460 Ca -0.17 -1.98 0.21 0.00 0.43 0.00 0.00 52.55 51.05 1yq2 s ASP 460 Cb 0.00 -0.74 1.13 0.00 -0.30 0.00 0.00 42.92 43.02 1yq2 s ASP 460 CO 0.76 -0.36 1.75 -1.54 -0.17 0.00 0.00 175.17 175.61 1yq2 n SER 461 N 4.38 0.47 0.06 -0.34 3.41 -1.25 -3.84 113.62 116.50 1yq2 n SER 461 Ca 0.03 -1.43 0.12 0.00 -0.26 0.00 0.00 58.87 57.33 1yq2 n SER 461 Cb 0.39 -0.02 0.28 0.00 -0.26 0.00 0.00 64.21 64.60 1yq2 n SER 461 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1yq2 n SER 462 N -0.51 0.64 -3.81 4.04 3.41 -1.26 -4.84 113.62 111.30 1yq2 n SER 462 Ca 0.16 0.22 -0.21 0.00 -0.26 0.00 0.00 58.87 58.79 1yq2 n SER 462 Cb 0.15 -0.13 -0.17 0.00 -0.26 0.00 0.00 64.21 63.79 1yq2 n SER 462 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1yq2 s ARG 463 N -3.11 0.56 0.75 4.33 0.52 -1.25 -4.42 118.95 116.32 1yq2 s ARG 463 Ca 0.09 0.06 -0.15 0.00 -0.52 0.00 0.00 55.73 55.21 1yq2 s ARG 463 Cb 0.14 -0.80 0.05 0.00 0.52 0.00 0.00 34.95 34.86 1yq2 s ARG 463 CO 0.67 -0.21 1.21 -2.14 0.02 0.00 0.00 175.30 174.85 1yq2 s PRO 464 N 1.49 2.02 -0.18 3.54 0.02 -1.25 -4.65 135.00 135.99 1yq2 s PRO 464 Ca -0.03 1.76 -0.10 0.00 0.02 0.00 0.00 61.00 62.65 1yq2 s PRO 464 Cb -0.13 -1.82 -0.05 0.00 0.02 0.00 0.00 34.50 32.52 1yq2 s PRO 464 CO -0.03 -1.92 0.16 0.08 -0.33 0.00 0.00 177.00 174.96 1yq2 s VAL 465 N -2.02 5.40 -0.04 3.83 1.01 -1.26 -1.58 120.40 125.75 1yq2 s VAL 465 Ca 0.74 0.26 0.06 0.00 0.00 0.00 0.00 61.98 63.04 1yq2 s VAL 465 Cb -0.29 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 1yq2 s VAL 465 CO 0.47 0.46 -0.22 -2.28 0.00 0.00 0.00 175.10 173.53 1yq2 s HIS 466 N 0.18 2.48 -0.30 5.22 5.04 0.49 -1.24 115.29 127.16 1yq2 s HIS 466 Ca 0.10 -0.40 -0.09 0.00 -1.54 0.00 0.00 55.06 53.13 1yq2 s HIS 466 Cb -0.12 -1.57 0.18 0.00 0.04 0.00 0.00 32.58 31.11 1yq2 s HIS 466 CO -0.00 -0.00 0.87 -0.47 -2.34 0.00 0.00 174.74 172.80 1yq2 s TYR 467 N -0.55 -0.96 0.06 3.88 5.04 -1.26 -1.71 117.35 121.86 1yq2 s TYR 467 Ca 0.08 1.16 0.31 0.00 -2.44 0.00 0.00 57.07 56.17 1yq2 s TYR 467 Cb -0.11 0.39 1.18 0.00 0.35 0.00 0.00 41.96 43.77 1yq2 s TYR 467 CO 0.00 -0.51 1.92 1.49 -1.34 0.00 0.00 175.55 177.11 1yq2 h GLU 468 N 7.91 0.00 0.00 4.97 4.22 -1.83 -2.77 114.58 127.08 1yq2 h GLU 468 Ca -0.17 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.27 1yq2 h GLU 468 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1yq2 h GLU 468 CO 0.06 0.05 0.00 0.41 -2.18 0.00 0.00 179.01 177.36 1yq2 n GLY 469 N 0.15 -1.17 2.69 1.92 0.00 -1.26 -4.12 105.19 103.41 1yq2 n GLY 469 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1yq2 n GLY 469 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1yq2 n ASP 470 N -1.84 5.08 -0.17 1.61 2.03 -1.05 -4.51 116.55 117.71 1yq2 n ASP 470 Ca 0.03 -2.89 0.01 0.00 0.52 0.00 0.00 54.79 52.46 1yq2 n ASP 470 Cb 0.21 -1.58 0.27 0.00 -0.72 0.00 0.00 41.12 39.30 1yq2 n ASP 470 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 1yq2 h TYR 471 N 5.72 0.85 -0.05 -0.67 0.99 -1.87 -2.11 116.97 119.83 1yq2 h TYR 471 Ca 0.58 0.01 0.00 0.00 2.00 0.00 0.00 58.73 61.31 1yq2 h TYR 471 Cb 0.57 -0.28 0.00 0.00 1.00 0.00 0.00 36.73 38.01 1yq2 h TYR 471 CO 1.47 0.56 0.00 0.25 -0.00 0.00 0.00 178.16 180.44 1yq2 n THR 472 N -4.41 0.05 -3.32 -2.88 -2.24 -1.26 -4.80 114.28 95.42 1yq2 n THR 472 Ca 0.07 -0.22 -0.18 0.00 -2.27 0.00 0.00 64.05 61.45 1yq2 n THR 472 Cb 0.06 0.28 0.07 0.00 -2.10 0.00 0.00 70.33 68.63 1yq2 n THR 472 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yq2 n GLY 473 N 1.12 -0.24 0.21 3.38 0.00 -0.80 -4.79 105.19 104.08 1yq2 n GLY 473 Ca 0.19 0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.39 1yq2 n GLY 473 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 h ALA 474 N 0.79 1.00 0.00 4.61 0.00 -1.93 -3.41 119.26 120.33 1yq2 h ALA 474 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1yq2 h ALA 474 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1yq2 h ALA 474 CO 0.44 0.00 -0.00 2.48 0.00 0.00 0.00 179.25 182.17 1yq2 n TYR 475 N -2.96 0.00 -4.22 0.00 0.18 -1.26 -5.10 117.16 103.80 1yq2 n TYR 475 Ca 0.03 0.00 -0.25 0.00 1.88 0.00 0.00 57.90 59.56 1yq2 n TYR 475 Cb 0.46 0.11 -0.07 0.00 -0.38 0.00 0.00 39.34 39.46 1yq2 n TYR 475 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1yq2 s THR 476 N 0.00 3.75 -0.15 -3.48 -4.23 -1.26 -4.88 115.64 105.39 1yq2 s THR 476 Ca 0.00 -1.54 0.21 0.00 -1.18 0.00 0.00 61.69 59.18 1yq2 s THR 476 Cb 0.00 -2.93 -0.14 0.00 1.34 0.00 0.00 72.50 70.77 1yq2 s THR 476 CO 0.00 -0.21 0.79 0.47 -0.54 0.00 0.00 174.62 175.13 1yq2 n ASP 477 N -0.45 0.54 -4.29 3.99 8.00 -0.37 -4.91 116.55 119.05 1yq2 n ASP 477 Ca -0.09 0.22 -0.23 0.00 0.71 0.00 0.00 54.79 55.40 1yq2 n ASP 477 Cb 0.56 0.93 -0.12 0.00 -0.02 0.00 0.00 41.12 42.47 1yq2 n ASP 477 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1yq2 s VAL 478 N -3.32 1.72 -0.22 2.53 -7.23 -1.24 -4.52 120.40 108.13 1yq2 s VAL 478 Ca -0.04 -1.63 -0.19 0.00 -1.81 0.00 0.00 61.98 58.31 1yq2 s VAL 478 Cb 0.11 -1.62 -0.03 0.00 0.56 0.00 0.00 36.38 35.40 1yq2 s VAL 478 CO 0.83 -0.13 0.55 -0.47 -0.31 0.00 0.00 175.10 175.58 1yq2 s TYR 479 N -1.39 3.33 -0.03 2.82 5.04 0.08 -4.73 117.35 122.47 1yq2 s TYR 479 Ca 0.08 0.77 0.06 0.00 -2.44 0.00 0.00 57.07 55.55 1yq2 s TYR 479 Cb -0.09 -2.73 -0.01 0.00 0.35 0.00 0.00 41.96 39.48 1yq2 s TYR 479 CO 0.05 -0.19 -0.22 0.45 -1.34 0.00 0.00 175.55 174.30 1yq2 s SER 480 N 1.30 2.62 0.19 4.32 0.15 -1.26 -1.65 113.70 119.37 1yq2 s SER 480 Ca 0.24 -0.42 0.03 0.00 0.70 0.00 0.00 55.95 56.51 1yq2 s SER 480 Cb -0.16 -0.51 -0.05 0.00 -1.71 0.00 0.00 66.02 63.59 1yq2 s SER 480 CO 0.09 0.24 -0.03 -0.13 1.20 0.00 0.00 173.24 174.61 1yq2 s ARG 481 N -0.29 1.18 -0.11 5.44 1.81 -0.79 -4.64 118.95 121.55 1yq2 s ARG 481 Ca 0.02 -1.56 0.03 0.00 -1.72 0.00 0.00 55.73 52.50 1yq2 s ARG 481 Cb -0.11 -0.51 0.01 0.00 -0.45 0.00 0.00 34.95 33.89 1yq2 s ARG 481 CO 0.01 -0.05 -0.18 -1.64 -0.68 0.00 0.00 175.30 172.76 1yq2 s MET 482 N -3.84 2.52 -1.61 3.54 -1.94 -1.26 -0.99 119.30 115.72 1yq2 s MET 482 Ca 0.23 -0.68 0.00 0.00 -1.71 0.00 0.00 55.69 53.53 1yq2 s MET 482 Cb 0.05 -2.04 0.00 0.00 2.01 0.00 0.00 34.83 34.85 1yq2 s MET 482 CO 0.05 0.02 0.00 0.66 -0.01 0.00 0.00 175.02 175.74 1yq2 n TYR 483 N 3.94 -0.71 -1.90 -0.03 4.02 -0.40 -4.94 117.16 117.14 1yq2 n TYR 483 Ca -0.20 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.28 1yq2 n TYR 483 Cb 0.52 -3.50 -0.01 0.00 -0.02 0.00 0.00 39.34 36.33 1yq2 n TYR 483 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1yq2 s SER 484 N -2.29 6.50 0.98 7.72 1.04 -1.26 -4.72 113.70 121.67 1yq2 s SER 484 Ca 0.00 2.87 -0.12 0.00 0.48 0.00 0.00 55.95 59.18 1yq2 s SER 484 Cb 0.00 -2.64 0.18 0.00 0.10 0.00 0.00 66.02 63.66 1yq2 s SER 484 CO 0.00 -0.79 1.08 -0.94 0.98 0.00 0.00 173.24 173.57 1yq2 s SER 485 N 0.13 2.64 0.14 7.02 1.04 -1.26 -4.73 113.70 118.68 1yq2 s SER 485 Ca 0.57 1.48 -0.18 0.00 0.48 0.00 0.00 55.95 58.30 1yq2 s SER 485 Cb -0.45 -2.15 -0.01 0.00 0.10 0.00 0.00 66.02 63.51 1yq2 s SER 485 CO 0.52 -3.16 1.78 0.40 0.98 0.00 0.00 173.24 173.76 1yq2 h ILE 486 N -1.91 1.03 -0.68 -1.02 1.08 -1.91 -1.02 117.51 113.08 1yq2 h ILE 486 Ca -0.53 -0.12 0.06 0.00 -0.39 0.00 0.00 64.86 63.88 1yq2 h ILE 486 Cb 1.31 0.64 -0.06 0.00 -3.07 0.00 0.00 36.82 35.63 1yq2 h ILE 486 CO 0.53 0.07 0.38 -0.65 -0.69 0.00 0.00 178.15 177.79 1yq2 h PRO 487 N 0.36 0.67 -0.39 2.37 0.11 -1.88 -0.77 132.00 132.47 1yq2 h PRO 487 Ca 0.12 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.09 1yq2 h PRO 487 Cb 0.00 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 30.95 1yq2 h PRO 487 CO -0.06 0.45 -0.13 1.49 -0.21 0.00 0.00 178.00 179.54 1yq2 h GLU 488 N 0.70 0.78 -0.46 1.05 4.81 -1.62 -1.76 114.58 118.08 1yq2 h GLU 488 Ca 0.31 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1yq2 h GLU 488 Cb 0.20 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1yq2 h GLU 488 CO -0.19 0.93 0.26 1.15 -0.73 0.00 0.00 179.01 180.43 1yq2 h THR 489 N 0.59 1.16 -0.43 0.32 2.02 -1.14 -0.48 112.91 114.96 1yq2 h THR 489 Ca 0.10 -0.40 0.09 0.00 0.77 0.00 0.00 66.41 66.96 1yq2 h THR 489 Cb 0.66 0.59 -0.08 0.00 -1.74 0.00 0.00 68.15 67.58 1yq2 h THR 489 CO 0.05 0.17 -0.10 -0.78 0.37 0.00 0.00 175.52 175.22 1yq2 h ASP 490 N 0.61 -0.38 0.23 4.18 1.82 -1.09 -1.01 116.42 120.78 1yq2 h ASP 490 Ca 0.16 0.13 -0.03 0.00 -0.39 0.00 0.00 57.03 56.90 1yq2 h ASP 490 Cb 0.04 0.26 -0.00 0.00 0.68 0.00 0.00 39.33 40.30 1yq2 h ASP 490 CO -0.03 -0.13 -0.16 0.77 -1.61 0.00 0.00 179.24 178.08 1yq2 h SER 491 N 0.01 0.00 -0.17 2.28 4.64 -0.62 -1.55 113.55 118.13 1yq2 h SER 491 Ca 0.21 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.32 1yq2 h SER 491 Cb 0.31 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1yq2 h SER 491 CO -0.43 0.16 -0.68 0.40 -0.87 0.00 0.00 176.83 175.40 1yq2 h ILE 492 N 0.00 1.29 -0.03 0.95 2.04 -0.41 -3.35 117.51 118.00 1yq2 h ILE 492 Ca -0.00 -1.89 -0.20 0.00 1.00 0.00 0.00 64.86 63.77 1yq2 h ILE 492 Cb 0.31 1.95 -0.00 0.00 -0.74 0.00 0.00 36.82 38.34 1yq2 h ILE 492 CO 0.02 0.60 -0.82 1.23 0.00 0.00 0.00 178.15 179.18 1yq2 h GLY 493 N 0.48 0.38 -1.91 5.37 0.00 -0.65 -3.47 103.07 103.28 1yq2 h GLY 493 Ca -0.04 -0.59 -0.46 0.00 0.00 0.00 0.00 47.33 46.23 1yq2 h GLY 493 CO 0.14 0.53 0.37 1.09 0.00 0.00 0.00 176.54 178.67 1yq2 s ARG 494 N -3.42 3.93 0.00 4.80 1.70 -0.64 -4.68 118.95 120.64 1yq2 s ARG 494 Ca -0.05 1.12 0.23 0.00 -0.47 0.00 0.00 55.73 56.56 1yq2 s ARG 494 Cb 0.10 -2.13 0.54 0.00 -0.57 0.00 0.00 34.95 32.89 1yq2 s ARG 494 CO 0.84 -0.29 1.48 0.09 -1.08 0.00 0.00 175.30 176.33 1yq2 n ASN 495 N -1.22 3.69 -0.52 -2.89 3.02 -1.26 -4.29 115.26 111.79 1yq2 n ASN 495 Ca 0.07 -2.00 0.07 0.00 -0.03 0.00 0.00 54.58 52.70 1yq2 n ASN 495 Cb 0.54 -0.37 0.17 0.00 -0.61 0.00 0.00 39.78 39.50 1yq2 n ASN 495 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1yq2 n ASP 496 N 1.57 1.76 -4.11 6.41 5.75 -1.26 -5.01 116.55 121.65 1yq2 n ASP 496 Ca 0.22 -3.43 -0.28 0.00 -0.01 0.00 0.00 54.79 51.28 1yq2 n ASP 496 Cb 0.61 -0.47 -0.17 0.00 -1.03 0.00 0.00 41.12 40.07 1yq2 n ASP 496 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1yq2 s SER 497 N -2.94 2.41 -0.07 -1.12 0.15 -1.26 -4.99 113.70 105.89 1yq2 s SER 497 Ca 0.34 -0.43 0.13 0.00 0.70 0.00 0.00 55.95 56.70 1yq2 s SER 497 Cb 0.33 -1.11 0.41 0.00 -1.71 0.00 0.00 66.02 63.95 1yq2 s SER 497 CO -0.05 0.09 1.34 1.41 1.20 0.00 0.00 173.24 177.23 1yq2 n HIS 498 N 3.72 0.70 -1.70 3.44 8.25 -1.26 -5.03 115.22 123.34 1yq2 n HIS 498 Ca -0.21 -0.65 -0.41 0.00 -0.26 0.00 0.00 57.72 56.19 1yq2 n HIS 498 Cb 0.52 -0.15 0.01 0.00 1.12 0.00 0.00 29.99 31.49 1yq2 n HIS 498 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yq2 n ALA 499 N 0.18 1.29 -1.77 -1.41 0.00 -1.26 -4.93 120.51 112.61 1yq2 n ALA 499 Ca 0.16 0.29 -0.39 0.00 0.00 0.00 0.00 53.44 53.50 1yq2 n ALA 499 Cb 0.63 -2.26 -0.01 0.00 0.00 0.00 0.00 19.45 17.80 1yq2 n ALA 499 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yq2 s LEU 500 N -1.47 4.24 0.29 0.00 1.02 -1.26 -4.95 118.68 116.55 1yq2 s LEU 500 Ca 0.59 2.57 0.07 0.00 0.02 0.00 0.00 54.13 57.38 1yq2 s LEU 500 Cb -0.53 -3.90 -0.03 0.00 0.02 0.00 0.00 46.19 41.76 1yq2 s LEU 500 CO 0.59 -0.75 0.30 -0.76 0.02 0.00 0.00 176.35 175.75 1yq2 s LEU 501 N -2.35 3.86 -0.07 1.79 1.43 -1.26 -5.03 118.68 117.05 1yq2 s LEU 501 Ca 0.56 -0.26 -0.38 0.00 -1.03 0.00 0.00 54.13 53.02 1yq2 s LEU 501 Cb -0.36 -2.46 -0.16 0.00 0.03 0.00 0.00 46.19 43.23 1yq2 s LEU 501 CO 0.46 -0.21 1.54 -0.11 0.23 0.00 0.00 176.35 178.26 1yq2 n LEU 502 N -1.36 2.06 -0.05 1.79 7.94 -1.26 -1.19 117.00 124.92 1yq2 n LEU 502 Ca -0.05 1.09 -0.01 0.00 -1.11 0.00 0.00 56.01 55.94 1yq2 n LEU 502 Cb 0.58 -1.18 -0.00 0.00 0.53 0.00 0.00 43.42 43.35 1yq2 n LEU 502 CO 0.43 -0.73 -0.01 0.61 -1.11 0.00 0.00 177.39 176.58 1yq2 n GLY 503 N 3.32 0.25 3.49 -3.96 0.00 -1.26 -4.77 105.19 102.27 1yq2 n GLY 503 Ca 0.22 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 1yq2 n GLY 503 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 n ASP 505 N 1.44 0.31 -0.04 0.00 3.85 -1.26 -4.42 116.55 116.43 1yq2 n ASP 505 Ca -0.16 -1.51 -0.01 0.00 -0.71 0.00 0.00 54.79 52.40 1yq2 n ASP 505 Cb 0.52 -0.76 0.27 0.00 -1.35 0.00 0.00 41.12 39.80 1yq2 n ASP 505 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 1yq2 h SER 506 N -1.21 0.58 -0.27 -1.12 4.64 -1.97 -0.57 113.55 113.63 1yq2 h SER 506 Ca -0.33 -0.10 -0.15 0.00 -0.47 0.00 0.00 61.79 60.74 1yq2 h SER 506 Cb 0.97 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1yq2 h SER 506 CO 0.26 0.61 -0.40 0.00 -0.87 0.00 0.00 176.83 176.43 1yq2 h ALA 507 N 1.46 0.41 -0.35 5.18 0.00 -1.97 -1.15 119.26 122.85 1yq2 h ALA 507 Ca 0.13 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 1yq2 h ALA 507 Cb 0.30 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1yq2 h ALA 507 CO 0.00 0.52 -0.20 0.93 0.00 0.00 0.00 179.25 180.50 1yq2 h GLU 508 N 0.49 0.67 -0.57 0.00 5.08 -1.84 -1.20 114.58 117.21 1yq2 h GLU 508 Ca 0.03 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1yq2 h GLU 508 Cb 0.99 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 1yq2 h GLU 508 CO 0.09 0.83 0.30 0.77 -1.00 0.00 0.00 179.01 180.00 1yq2 h SER 509 N 0.60 0.73 -0.56 1.42 0.02 -1.05 -1.91 113.55 112.79 1yq2 h SER 509 Ca 0.09 -0.11 -0.05 0.00 -0.84 0.00 0.00 61.79 60.88 1yq2 h SER 509 Cb 0.67 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1yq2 h SER 509 CO 0.05 0.63 0.15 0.00 -1.14 0.00 0.00 176.83 176.51 1yq2 h ALA 510 N 1.13 0.74 -0.35 3.77 0.00 -0.87 -2.75 119.26 120.93 1yq2 h ALA 510 Ca 0.20 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1yq2 h ALA 510 Cb 0.07 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 1yq2 h ALA 510 CO -0.03 0.43 -0.01 -0.09 0.00 0.00 0.00 179.25 179.56 1yq2 h ARG 511 N 0.80 0.09 0.00 0.00 2.43 -1.05 -2.23 114.38 114.41 1yq2 h ARG 511 Ca 0.18 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 1yq2 h ARG 511 Cb 0.33 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 1yq2 h ARG 511 CO 0.00 0.06 -0.18 1.96 -1.51 0.00 0.00 179.97 180.30 1yq2 h GLN 512 N 0.09 0.00 0.00 0.20 1.08 -1.20 -1.66 115.11 113.62 1yq2 h GLN 512 Ca 0.17 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.37 1yq2 h GLN 512 Cb 0.24 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.67 1yq2 h GLN 512 CO -0.29 0.18 0.00 0.54 -0.95 0.00 0.00 178.83 178.31 1yq2 n ARG 513 N -4.23 0.84 0.00 1.46 1.74 -0.84 -2.82 116.66 112.81 1yq2 n ARG 513 Ca -0.02 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.18 1yq2 n ARG 513 Cb 0.25 -1.50 0.25 0.00 -1.02 0.00 0.00 32.46 30.44 1yq2 n ARG 513 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1yq2 n THR 514 N -1.00 0.00 -4.24 0.55 -2.24 -0.62 -4.96 114.28 101.77 1yq2 n THR 514 Ca 0.20 -0.32 -0.23 0.00 -2.27 0.00 0.00 64.05 61.43 1yq2 n THR 514 Cb 0.09 0.98 -0.06 0.00 -2.10 0.00 0.00 70.33 69.24 1yq2 n THR 514 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1yq2 s LYS 515 N -2.17 2.47 0.46 -0.78 1.02 -1.13 -3.39 119.74 116.22 1yq2 s LYS 515 Ca 0.28 -1.31 -0.24 0.00 0.02 0.00 0.00 55.97 54.73 1yq2 s LYS 515 Cb 0.20 -2.28 -0.07 0.00 -0.52 0.00 0.00 37.83 35.16 1yq2 s LYS 515 CO 0.40 0.38 1.34 -2.14 -0.92 0.00 0.00 175.35 174.41 1yq2 s PRO 516 N -3.68 3.63 -0.08 -1.68 0.02 -1.23 -4.69 135.00 127.29 1yq2 s PRO 516 Ca 0.32 2.23 0.01 0.00 0.02 0.00 0.00 61.00 63.57 1yq2 s PRO 516 Cb -0.07 -2.55 -0.03 0.00 0.02 0.00 0.00 34.50 31.87 1yq2 s PRO 516 CO 0.21 -0.80 -0.07 0.12 -0.33 0.00 0.00 177.00 176.13 1yq2 s PHE 517 N -1.28 2.92 0.07 6.54 5.36 -0.43 -0.74 117.98 130.42 1yq2 s PHE 517 Ca 0.63 -0.06 0.03 0.00 -0.96 0.00 0.00 56.93 56.56 1yq2 s PHE 517 Cb -0.40 -1.74 -0.03 0.00 -0.34 0.00 0.00 43.02 40.52 1yq2 s PHE 517 CO 0.50 0.25 -0.09 0.96 -1.46 0.00 0.00 175.22 175.38 1yq2 s ILE 518 N -0.62 0.70 -0.43 3.12 -4.36 -0.66 -0.80 121.20 118.15 1yq2 s ILE 518 Ca 0.09 -1.39 -0.21 0.00 -0.26 0.00 0.00 60.65 58.89 1yq2 s ILE 518 Cb -0.12 -1.02 0.02 0.00 1.25 0.00 0.00 42.46 42.60 1yq2 s ILE 518 CO 0.02 -0.51 0.65 -0.76 0.24 0.00 0.00 174.94 174.58 1yq2 s LEU 519 N -2.07 4.48 0.50 0.37 1.43 -0.56 -1.88 118.68 120.95 1yq2 s LEU 519 Ca -0.02 -0.30 0.29 0.00 -1.03 0.00 0.00 54.13 53.07 1yq2 s LEU 519 Cb -0.05 -2.74 1.08 0.00 0.03 0.00 0.00 46.19 44.51 1yq2 s LEU 519 CO -0.01 -0.77 1.88 0.00 0.23 0.00 0.00 176.35 177.68 1yq2 s GLU 521 N -3.59 0.22 0.34 0.00 2.02 -1.24 -4.34 118.70 112.11 1yq2 s GLU 521 Ca 0.02 0.47 -0.14 0.00 0.02 0.00 0.00 54.97 55.34 1yq2 s GLU 521 Cb 0.09 -0.05 0.03 0.00 0.10 0.00 0.00 34.13 34.29 1yq2 s GLU 521 CO 0.59 -0.13 0.67 1.52 0.02 0.00 0.00 175.26 177.93 1yq2 s TYR 522 N 0.95 0.27 -0.92 1.61 -0.00 -0.86 -1.28 117.35 117.12 1yq2 s TYR 522 Ca -0.07 -0.78 -0.21 0.00 -0.00 0.00 0.00 57.07 56.02 1yq2 s TYR 522 Cb -0.08 0.55 0.03 0.00 -0.00 0.00 0.00 41.96 42.46 1yq2 s TYR 522 CO -0.06 -1.34 0.55 1.33 -0.00 0.00 0.00 175.55 176.02 1yq2 n VAL 523 N -0.50 -2.32 -1.71 -3.49 0.24 -1.26 -1.78 118.33 107.51 1yq2 n VAL 523 Ca -0.05 -0.35 -0.58 0.00 -2.04 0.00 0.00 64.34 61.32 1yq2 n VAL 523 Cb 0.60 -2.01 -0.07 0.00 -1.47 0.00 0.00 33.84 30.89 1yq2 n VAL 523 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1yq2 n HIS 524 N -3.80 2.00 1.00 6.34 -0.00 -1.26 -4.42 115.22 115.08 1yq2 n HIS 524 Ca -0.15 0.59 0.11 0.00 0.46 0.00 0.00 57.72 58.74 1yq2 n HIS 524 Cb 0.50 -2.43 0.33 0.00 -0.12 0.00 0.00 29.99 28.26 1yq2 n HIS 524 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1yq2 n ALA 525 N 5.11 2.49 -1.69 1.57 0.00 0.23 -4.39 120.51 123.83 1yq2 n ALA 525 Ca 0.26 -0.65 -0.44 0.00 0.00 0.00 0.00 53.44 52.61 1yq2 n ALA 525 Cb 0.12 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.52 1yq2 n ALA 525 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1yq2 n MET 526 N 0.69 2.21 0.00 0.00 0.00 -1.25 -4.55 117.12 114.21 1yq2 n MET 526 Ca 0.17 0.79 0.00 0.00 0.00 0.00 0.00 57.70 58.66 1yq2 n MET 526 Cb 0.42 -2.48 0.00 0.00 0.00 0.00 0.00 33.22 31.16 1yq2 n MET 526 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1yq2 n GLY 527 N 2.20 1.59 3.61 -5.12 0.00 -1.26 -4.43 105.19 101.78 1yq2 n GLY 527 Ca 0.11 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 45.17 1yq2 n GLY 527 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1yq2 s ASN 528 N -4.00 6.59 0.00 1.61 3.84 -1.26 -4.80 114.94 116.92 1yq2 s ASN 528 Ca 0.00 0.71 0.00 0.00 0.21 0.00 0.00 52.86 53.78 1yq2 s ASN 528 Cb 0.00 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.15 1yq2 s ASN 528 CO 0.00 -1.24 0.00 0.61 -2.79 0.00 0.00 177.10 173.68 1yq2 n GLY 529 N 4.74 -0.20 3.95 1.21 0.00 -1.26 -4.77 105.19 108.87 1yq2 n GLY 529 Ca 0.14 -1.73 -0.23 0.00 0.00 0.00 0.00 46.02 44.20 1yq2 n GLY 529 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1yq2 s PRO 530 N -1.49 3.47 0.83 1.61 0.04 -1.26 -4.43 135.00 133.76 1yq2 s PRO 530 Ca 0.00 -0.53 -0.09 0.00 0.04 0.00 0.00 61.00 60.41 1yq2 s PRO 530 Cb 0.00 -2.79 0.14 0.00 0.04 0.00 0.00 34.50 31.89 1yq2 s PRO 530 CO 0.00 0.31 1.15 0.20 0.04 0.00 0.00 177.00 178.70 1yq2 s GLY 531 N -3.92 1.74 0.00 0.56 0.00 0.02 -4.66 107.32 101.06 1yq2 s GLY 531 Ca 0.37 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.85 1yq2 s GLY 531 CO 0.32 -0.63 0.00 0.00 0.00 0.00 0.00 173.10 172.79 1yq2 n ALA 532 N -3.29 0.00 -0.34 3.20 0.00 -1.26 -4.70 120.51 114.12 1yq2 n ALA 532 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.66 1yq2 n ALA 532 Cb 0.60 0.00 0.28 0.00 0.00 0.00 0.00 19.45 20.33 1yq2 n ALA 532 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1yq2 h MET 533 N 3.02 0.87 -0.24 0.00 2.86 -1.88 -0.72 114.93 118.84 1yq2 h MET 533 Ca 0.00 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.50 1yq2 h MET 533 Cb 0.00 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.45 1yq2 h MET 533 CO 0.00 0.58 -0.23 0.38 1.06 0.00 0.00 176.91 178.69 1yq2 h ASP 534 N 0.90 0.44 -0.39 1.22 2.03 -1.92 -1.52 116.42 117.18 1yq2 h ASP 534 Ca 0.50 -0.14 -0.05 0.00 -0.73 0.00 0.00 57.03 56.61 1yq2 h ASP 534 Cb 0.60 -0.12 -0.01 0.00 -0.83 0.00 0.00 39.33 38.97 1yq2 h ASP 534 CO -0.27 0.68 0.05 1.56 -1.03 0.00 0.00 179.24 180.23 1yq2 h GLN 535 N 0.40 0.66 -0.78 4.15 4.20 -1.57 -1.15 115.11 121.02 1yq2 h GLN 535 Ca 0.06 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 1yq2 h GLN 535 Cb 0.63 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.30 1yq2 h GLN 535 CO 0.04 0.72 0.45 1.88 -0.67 0.00 0.00 178.83 181.26 1yq2 h TYR 536 N 0.50 1.05 -0.43 2.96 -1.99 -1.25 -2.64 116.97 115.16 1yq2 h TYR 536 Ca 0.12 -0.01 -0.09 0.00 2.00 0.00 0.00 58.73 60.74 1yq2 h TYR 536 Cb 0.40 -0.34 -0.02 0.00 2.00 0.00 0.00 36.73 38.77 1yq2 h TYR 536 CO 0.03 0.72 -0.11 1.49 -0.00 0.00 0.00 178.16 180.29 1yq2 h GLU 537 N 1.08 0.77 -0.07 4.88 4.57 -1.13 -2.21 114.58 122.46 1yq2 h GLU 537 Ca 0.28 -0.25 -0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1yq2 h GLU 537 Cb -0.01 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.51 1yq2 h GLU 537 CO -0.05 0.84 0.03 0.00 -1.18 0.00 0.00 179.01 178.66 1yq2 h ALA 538 N 1.19 1.92 -0.23 2.92 0.00 -0.95 -1.26 119.26 122.86 1yq2 h ALA 538 Ca 0.12 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 1yq2 h ALA 538 Cb 0.58 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1yq2 h ALA 538 CO 0.04 0.07 -0.49 -0.07 0.00 0.00 0.00 179.25 178.79 1yq2 h LEU 539 N 0.10 0.82 -0.84 0.00 3.38 -1.07 -2.17 115.31 115.53 1yq2 h LEU 539 Ca 0.03 -0.55 -0.02 0.00 0.09 0.00 0.00 57.88 57.42 1yq2 h LEU 539 Cb 0.01 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 1yq2 h LEU 539 CO -0.00 1.22 0.45 0.58 0.09 0.00 0.00 178.44 180.78 1yq2 h VAL 540 N 0.45 1.25 -0.81 1.22 2.07 -1.08 -0.46 116.25 118.90 1yq2 h VAL 540 Ca 0.00 -0.64 0.05 0.00 0.82 0.00 0.00 66.70 66.93 1yq2 h VAL 540 Cb 1.10 0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 1yq2 h VAL 540 CO 0.11 0.28 0.53 0.44 0.02 0.00 0.00 177.57 178.95 1yq2 h ASP 541 N 1.18 0.82 0.36 0.57 3.32 -1.13 -3.30 116.42 118.24 1yq2 h ASP 541 Ca 0.30 -0.00 -0.32 0.00 0.02 0.00 0.00 57.03 57.02 1yq2 h ASP 541 Cb 0.05 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 1yq2 h ASP 541 CO -0.05 0.55 -1.79 0.50 -1.72 0.00 0.00 179.24 176.74 1yq2 h LYS 542 N 0.95 0.13 -4.67 3.56 3.64 -0.83 -3.45 116.57 115.90 1yq2 h LYS 542 Ca 0.33 -0.23 -0.65 0.00 -1.27 0.00 0.00 60.65 58.84 1yq2 h LYS 542 Cb 0.12 0.08 -0.38 0.00 -0.41 0.00 0.00 32.23 31.65 1yq2 h LYS 542 CO -0.11 0.85 -0.79 0.71 -2.27 0.00 0.00 179.45 177.85 1yq2 s TYR 543 N -2.59 3.02 0.51 1.91 1.51 -0.23 -5.01 117.35 116.47 1yq2 s TYR 543 Ca -0.12 -2.21 0.28 0.00 -1.01 0.00 0.00 57.07 54.01 1yq2 s TYR 543 Cb 0.07 -1.91 1.38 0.00 -0.11 0.00 0.00 41.96 41.39 1yq2 s TYR 543 CO 0.81 -0.85 1.88 -1.35 -1.11 0.00 0.00 175.55 174.93 1yq2 h PRO 544 N 7.82 0.10 0.00 -1.71 0.11 -1.87 -1.33 132.00 135.12 1yq2 h PRO 544 Ca -0.17 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.90 1yq2 h PRO 544 Cb 1.05 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1yq2 h PRO 544 CO 0.45 0.06 -0.16 -0.09 -0.21 0.00 0.00 178.00 178.06 1yq2 h ARG 545 N 0.10 0.00 -5.90 1.05 2.43 -1.83 -3.42 114.38 106.81 1yq2 h ARG 545 Ca 0.43 0.00 -0.59 0.00 -0.81 0.00 0.00 59.98 59.02 1yq2 h ARG 545 Cb 1.55 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 31.03 1yq2 h ARG 545 CO -0.05 0.16 0.48 -0.51 -1.51 0.00 0.00 179.97 178.53 1yq2 s LEU 546 N -7.26 4.13 -0.11 3.80 1.43 -0.50 -1.31 118.68 118.86 1yq2 s LEU 546 Ca -0.02 1.15 0.15 0.00 -1.03 0.00 0.00 54.13 54.37 1yq2 s LEU 546 Cb 0.13 -3.26 0.49 0.00 0.03 0.00 0.00 46.19 43.58 1yq2 s LEU 546 CO 0.61 -0.48 1.41 1.41 0.23 0.00 0.00 176.35 179.52 1yq2 n HIS 547 N 5.68 0.90 -0.29 0.29 8.25 0.02 -4.78 115.22 125.29 1yq2 n HIS 547 Ca 0.06 -0.70 0.00 0.00 -0.26 0.00 0.00 57.72 56.82 1yq2 n HIS 547 Cb 0.48 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 31.38 1yq2 n HIS 547 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1yq2 n GLY 548 N 0.13 0.13 3.69 -1.41 0.00 -1.26 0.20 105.19 106.68 1yq2 n GLY 548 Ca 0.19 -1.74 0.01 0.00 0.00 0.00 0.00 46.02 44.48 1yq2 n GLY 548 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1yq2 s GLY 549 N 0.00 -0.33 -0.23 -0.02 0.00 -0.55 -1.49 107.32 104.69 1yq2 s GLY 549 Ca 0.00 0.49 -0.01 0.00 0.00 0.00 0.00 44.72 45.20 1yq2 s GLY 549 CO 0.00 0.83 -0.10 -1.36 0.00 0.00 0.00 173.10 172.48 1yq2 s PHE 550 N -2.49 3.01 0.33 1.90 0.40 0.03 -1.24 117.98 119.93 1yq2 s PHE 550 Ca 0.16 -1.60 -0.29 0.00 -0.60 0.00 0.00 56.93 54.60 1yq2 s PHE 550 Cb 0.03 -2.02 -0.11 0.00 0.51 0.00 0.00 43.02 41.43 1yq2 s PHE 550 CO -0.02 -0.75 1.54 0.28 0.70 0.00 0.00 175.22 176.98 1yq2 n VAL 551 N 4.64 1.43 -3.46 -0.44 0.31 0.03 -2.03 118.33 118.81 1yq2 n VAL 551 Ca -0.17 -0.36 -0.43 0.00 -0.01 0.00 0.00 64.34 63.37 1yq2 n VAL 551 Cb 0.48 -1.95 -0.10 0.00 -0.91 0.00 0.00 33.84 31.35 1yq2 n VAL 551 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 1yq2 s TRP 552 N -0.46 3.23 0.23 3.52 -0.11 -0.73 -1.17 118.94 123.45 1yq2 s TRP 552 Ca 0.60 -0.53 0.04 0.00 1.22 0.00 0.00 56.10 57.43 1yq2 s TRP 552 Cb -0.49 -2.60 -0.01 0.00 -1.50 0.00 0.00 33.47 28.87 1yq2 s TRP 552 CO 0.55 -0.57 0.23 -0.85 -4.62 0.00 0.00 176.95 171.69 1yq2 n GLU 553 N 5.18 0.33 0.19 5.86 0.28 -0.87 -0.60 120.64 131.01 1yq2 n GLU 553 Ca -0.11 -2.22 -0.14 0.00 -0.16 0.00 0.00 57.16 54.53 1yq2 n GLU 553 Cb 0.47 1.89 -0.08 0.00 1.43 0.00 0.00 31.44 35.15 1yq2 n GLU 553 CO 0.00 0.00 0.00 2.35 -0.16 0.00 0.00 177.13 179.32 1yq2 h TRP 554 N 1.73 -0.45 -4.28 -1.84 -0.00 -1.36 -0.75 115.95 108.99 1yq2 h TRP 554 Ca -0.17 -0.01 -0.53 0.00 -0.00 0.00 0.00 58.89 58.18 1yq2 h TRP 554 Cb 0.83 0.15 -0.29 0.00 -0.00 0.00 0.00 29.16 29.84 1yq2 h TRP 554 CO 0.00 -0.14 -0.83 1.03 -0.00 0.00 0.00 178.44 178.50 1yq2 s ARG 555 N -4.99 1.34 0.47 2.65 0.52 -1.26 -0.57 118.95 117.12 1yq2 s ARG 555 Ca -0.15 -0.61 -0.24 0.00 -0.52 0.00 0.00 55.73 54.22 1yq2 s ARG 555 Cb 0.03 -1.30 -0.07 0.00 0.52 0.00 0.00 34.95 34.12 1yq2 s ARG 555 CO 0.56 0.36 1.37 -0.51 0.02 0.00 0.00 175.30 177.10 1yq2 s ASP 556 N -0.43 5.77 -0.72 0.23 1.11 -0.61 -4.18 116.67 117.84 1yq2 s ASP 556 Ca 0.06 2.80 0.02 0.00 0.18 0.00 0.00 52.55 55.61 1yq2 s ASP 556 Cb -0.06 -2.64 0.35 0.00 1.07 0.00 0.00 42.92 41.63 1yq2 s ASP 556 CO -0.01 -1.23 1.35 1.41 1.18 0.00 0.00 175.17 177.88 1yq2 n HIS 557 N -0.42 3.46 -2.26 4.23 8.25 -0.79 -4.43 115.22 123.27 1yq2 n HIS 557 Ca 0.07 -3.25 -0.34 0.00 -0.26 0.00 0.00 57.72 53.93 1yq2 n HIS 557 Cb 0.43 -0.72 -0.00 0.00 1.12 0.00 0.00 29.99 30.82 1yq2 n HIS 557 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1yq2 s GLY 558 N -2.59 2.46 -0.20 -1.41 0.00 -1.26 -4.89 107.32 99.44 1yq2 s GLY 558 Ca 0.46 0.66 -0.03 0.00 0.00 0.00 0.00 44.72 45.81 1yq2 s GLY 558 CO -0.17 1.00 -0.07 -0.42 0.00 0.00 0.00 173.10 173.44 1yq2 s ILE 559 N -2.00 3.28 0.14 0.90 -1.09 -0.91 -3.90 121.20 117.62 1yq2 s ILE 559 Ca 0.69 -0.54 -0.31 0.00 -2.23 0.00 0.00 60.65 58.26 1yq2 s ILE 559 Cb -0.20 -2.46 -0.09 0.00 -1.58 0.00 0.00 42.46 38.13 1yq2 s ILE 559 CO 0.28 0.45 1.51 -0.60 -1.23 0.00 0.00 174.94 175.35 1yq2 s ARG 560 N 1.16 4.25 0.25 2.79 3.52 -0.74 -0.41 118.95 129.78 1yq2 s ARG 560 Ca 0.02 2.26 -0.06 0.00 -0.13 0.00 0.00 55.73 57.82 1yq2 s ARG 560 Cb -0.14 -3.20 0.02 0.00 -1.56 0.00 0.00 34.95 30.07 1yq2 s ARG 560 CO -0.02 -0.55 0.44 -2.37 -0.81 0.00 0.00 175.30 171.99 1yq2 n THR 561 N 3.98 0.00 -4.21 4.11 5.66 -0.57 -4.93 114.28 118.32 1yq2 n THR 561 Ca 0.13 -0.93 -0.19 0.00 -3.05 0.00 0.00 64.05 60.01 1yq2 n THR 561 Cb 0.40 0.70 -0.12 0.00 -1.55 0.00 0.00 70.33 69.76 1yq2 n THR 561 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1yq2 s ARG 562 N -2.29 0.94 0.88 1.09 0.52 -1.26 -1.08 118.95 117.75 1yq2 s ARG 562 Ca 0.15 -1.08 -0.12 0.00 -0.52 0.00 0.00 55.73 54.16 1yq2 s ARG 562 Cb -0.02 -0.95 0.12 0.00 0.52 0.00 0.00 34.95 34.62 1yq2 s ARG 562 CO 0.11 0.20 1.10 0.95 0.02 0.00 0.00 175.30 177.68 1yq2 s THR 563 N -1.53 2.60 0.34 0.02 -4.23 0.16 -4.86 115.64 108.14 1yq2 s THR 563 Ca 0.03 0.19 0.12 0.00 -1.18 0.00 0.00 61.69 60.85 1yq2 s THR 563 Cb -0.08 -2.80 0.34 0.00 1.34 0.00 0.00 72.50 71.30 1yq2 s THR 563 CO 0.03 -0.25 1.76 0.00 -0.54 0.00 0.00 174.62 175.61 1yq2 h ALA 564 N -1.46 1.92 -0.32 3.99 0.00 -2.01 0.25 119.26 121.62 1yq2 h ALA 564 Ca -0.50 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 1yq2 h ALA 564 Cb 1.29 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1yq2 h ALA 564 CO 0.57 -0.35 0.06 -0.85 0.00 0.00 0.00 179.25 178.69 1yq2 n GLU 565 N -4.77 2.65 -1.01 0.00 0.00 -1.26 -4.91 120.64 111.34 1yq2 n GLU 565 Ca 0.26 -1.53 -0.00 0.00 0.00 0.00 0.00 57.16 55.89 1yq2 n GLU 565 Cb 0.75 -1.82 -0.00 0.00 0.00 0.00 0.00 31.44 30.37 1yq2 n GLU 565 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1yq2 n GLY 566 N 0.18 0.47 3.67 -1.84 0.00 0.87 -5.01 105.19 103.52 1yq2 n GLY 566 Ca 0.17 -0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1yq2 n GLY 566 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1yq2 s MET 567 N -0.46 4.31 0.23 1.61 0.00 -1.26 -4.70 119.30 119.04 1yq2 s MET 567 Ca 0.00 1.53 -0.30 0.00 0.00 0.00 0.00 55.69 56.93 1yq2 s MET 567 Cb 0.00 -3.63 -0.09 0.00 0.00 0.00 0.00 34.83 31.11 1yq2 s MET 567 CO 0.00 -0.54 1.07 -2.00 0.00 0.00 0.00 175.02 173.55 1yq2 s GLU 568 N 2.78 4.66 0.21 4.11 2.12 -1.26 0.36 118.70 131.69 1yq2 s GLU 568 Ca 0.51 1.71 -0.15 0.00 0.36 0.00 0.00 54.97 57.40 1yq2 s GLU 568 Cb -0.20 -3.24 0.01 0.00 0.26 0.00 0.00 34.13 30.96 1yq2 s GLU 568 CO 0.15 0.21 0.49 -0.59 -0.54 0.00 0.00 175.26 174.99 1yq2 s PHE 569 N -0.80 0.08 -0.39 5.30 -0.12 -0.24 -4.95 117.98 116.85 1yq2 s PHE 569 Ca 0.46 -0.44 -0.18 0.00 -0.05 0.00 0.00 56.93 56.72 1yq2 s PHE 569 Cb -0.30 0.30 0.01 0.00 -0.63 0.00 0.00 43.02 42.41 1yq2 s PHE 569 CO 0.37 -0.94 0.50 -0.06 -0.05 0.00 0.00 175.22 175.04 1yq2 s PHE 570 N -3.93 3.16 0.36 3.49 0.40 -1.26 -1.51 117.98 118.68 1yq2 s PHE 570 Ca 0.14 -0.09 -0.25 0.00 -0.60 0.00 0.00 56.93 56.13 1yq2 s PHE 570 Cb -0.01 -2.97 -0.09 0.00 0.51 0.00 0.00 43.02 40.46 1yq2 s PHE 570 CO 0.02 -0.65 1.01 0.00 0.70 0.00 0.00 175.22 176.30 1yq2 s ALA 571 N 2.35 3.16 0.09 5.36 0.00 0.46 -4.75 121.76 128.42 1yq2 s ALA 571 Ca 0.16 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.77 1yq2 s ALA 571 Cb -0.16 -3.24 -0.00 0.00 0.00 0.00 0.00 23.12 19.72 1yq2 s ALA 571 CO 0.14 -0.06 0.01 2.48 0.00 0.00 0.00 175.76 178.33 1yq2 n TYR 572 N 0.25 0.19 -1.61 0.00 0.18 -1.26 -2.15 117.16 112.76 1yq2 n TYR 572 Ca 0.03 -0.49 -0.48 0.00 1.88 0.00 0.00 57.90 58.85 1yq2 n TYR 572 Cb 0.49 -0.05 -0.04 0.00 -0.38 0.00 0.00 39.34 39.36 1yq2 n TYR 572 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1yq2 n GLY 573 N 3.39 0.32 1.37 -7.48 0.00 -0.03 -2.00 105.19 100.76 1yq2 n GLY 573 Ca -0.03 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.53 1yq2 n GLY 573 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 574 N 2.14 2.88 0.20 -0.02 0.00 -1.26 -3.80 105.19 105.33 1yq2 n GLY 574 Ca 0.14 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.31 1yq2 n GLY 574 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1yq2 h ASP 575 N 0.00 0.00 -0.47 1.61 3.32 -1.81 -3.04 116.42 116.03 1yq2 h ASP 575 Ca 0.00 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 1yq2 h ASP 575 Cb 0.00 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.43 1yq2 h ASP 575 CO 0.00 0.00 0.09 0.49 -1.72 0.00 0.00 179.24 178.10 1yq2 n PHE 576 N -2.63 1.51 -1.65 4.55 0.99 -1.26 -4.95 117.46 114.02 1yq2 n PHE 576 Ca 0.01 -1.43 -0.12 0.00 -0.00 0.00 0.00 57.45 55.92 1yq2 n PHE 576 Cb 0.25 -0.54 -0.03 0.00 -1.00 0.00 0.00 39.48 38.15 1yq2 n PHE 576 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yq2 n GLY 577 N -0.88 0.78 3.76 1.37 0.00 -1.15 -4.93 105.19 104.15 1yq2 n GLY 577 Ca 0.35 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1yq2 n GLY 577 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1yq2 n GLU 578 N -2.47 2.43 0.10 1.61 4.71 -1.26 -4.93 120.64 120.83 1yq2 n GLU 578 Ca -0.12 0.86 -0.13 0.00 -0.01 0.00 0.00 57.16 57.75 1yq2 n GLU 578 Cb 0.46 -2.62 -0.08 0.00 -1.01 0.00 0.00 31.44 28.19 1yq2 n GLU 578 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1yq2 h VAL 579 N 2.61 0.92 -4.40 2.62 2.07 -1.98 -3.44 116.25 114.66 1yq2 h VAL 579 Ca -0.50 -0.49 -0.69 0.00 0.82 0.00 0.00 66.70 65.84 1yq2 h VAL 579 Cb 1.26 1.22 -0.30 0.00 -1.52 0.00 0.00 31.29 31.94 1yq2 h VAL 579 CO 0.62 0.11 -0.89 0.68 0.02 0.00 0.00 177.57 178.12 1yq2 s VAL 580 N -5.17 2.01 0.29 2.57 -7.23 -1.26 -5.14 120.40 106.47 1yq2 s VAL 580 Ca -0.15 -1.07 -0.20 0.00 -1.81 0.00 0.00 61.98 58.75 1yq2 s VAL 580 Cb 0.03 -1.68 0.03 0.00 0.56 0.00 0.00 36.38 35.32 1yq2 s VAL 580 CO 0.62 0.57 0.76 -1.38 -0.31 0.00 0.00 175.10 175.36 1yq2 s HIS 581 N -0.45 -0.12 -0.20 2.82 -0.00 -1.26 -4.76 115.29 111.32 1yq2 s HIS 581 Ca 0.05 -0.37 0.12 0.00 -0.00 0.00 0.00 55.06 54.87 1yq2 s HIS 581 Cb -0.11 0.73 0.43 0.00 -0.00 0.00 0.00 32.58 33.62 1yq2 s HIS 581 CO 0.01 -1.26 1.21 -0.25 -0.00 0.00 0.00 174.74 174.45 1yq2 n ASP 582 N -0.66 1.95 0.00 7.38 8.00 -1.04 -4.93 116.55 127.25 1yq2 n ASP 582 Ca -0.05 -3.69 0.00 0.00 0.71 0.00 0.00 54.79 51.76 1yq2 n ASP 582 Cb 0.59 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.20 1yq2 n ASP 582 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1yq2 n SER 583 N -0.92 0.00 -0.93 -2.24 2.88 -1.25 -1.85 113.62 109.31 1yq2 n SER 583 Ca 0.20 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.78 1yq2 n SER 583 Cb 0.76 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 64.39 1yq2 n SER 583 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1yq2 n ASN 584 N 2.85 2.62 0.23 -3.46 2.04 -1.26 -0.85 115.26 117.43 1yq2 n ASN 584 Ca 0.00 -2.25 0.16 0.00 -0.44 0.00 0.00 54.58 52.05 1yq2 n ASN 584 Cb 0.00 -0.44 0.78 0.00 -2.53 0.00 0.00 39.78 37.59 1yq2 n ASN 584 CO 0.00 0.00 0.00 -0.26 -0.44 0.00 0.00 177.26 176.56 1yq2 h PHE 585 N 1.88 0.00 0.00 -2.53 -1.00 -1.77 0.35 116.94 113.87 1yq2 h PHE 585 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1yq2 h PHE 585 Cb 0.89 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.45 1yq2 h PHE 585 CO 0.39 0.00 0.00 1.55 -1.61 0.00 0.00 178.31 178.64 1yq2 n VAL 586 N -2.68 0.67 -3.15 -0.55 3.14 -1.25 -4.14 118.33 110.37 1yq2 n VAL 586 Ca -0.01 0.06 -0.43 0.00 -2.96 0.00 0.00 64.34 61.01 1yq2 n VAL 586 Cb 0.14 -0.87 -0.00 0.00 -1.06 0.00 0.00 33.84 32.05 1yq2 n VAL 586 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 1yq2 n MET 587 N -1.99 4.04 -2.04 1.45 2.81 0.11 -1.88 117.12 119.62 1yq2 n MET 587 Ca 0.04 -4.53 -0.06 0.00 -1.81 0.00 0.00 57.70 51.34 1yq2 n MET 587 Cb 0.29 -2.51 0.06 0.00 -0.71 0.00 0.00 33.22 30.35 1yq2 n MET 587 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1yq2 n ASP 588 N 1.72 2.56 -4.88 7.83 5.68 -1.26 -4.15 116.55 124.06 1yq2 n ASP 588 Ca 0.25 -2.83 -0.21 0.00 -0.50 0.00 0.00 54.79 51.50 1yq2 n ASP 588 Cb 0.35 -0.41 -0.03 0.00 -1.14 0.00 0.00 41.12 39.89 1yq2 n ASP 588 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1yq2 s GLY 589 N -3.36 1.76 0.45 6.12 0.00 -1.26 -2.04 107.32 108.99 1yq2 s GLY 589 Ca 0.37 -1.63 0.25 0.00 0.00 0.00 0.00 44.72 43.71 1yq2 s GLY 589 CO -0.04 -1.55 1.69 -0.33 0.00 0.00 0.00 173.10 172.87 1yq2 h MET 590 N 1.18 0.00 -5.55 2.90 2.86 0.60 -3.43 114.93 113.48 1yq2 h MET 590 Ca -0.45 0.00 -0.64 0.00 -2.06 0.00 0.00 59.70 56.55 1yq2 h MET 590 Cb 1.25 0.00 -0.32 0.00 0.06 0.00 0.00 31.60 32.60 1yq2 h MET 590 CO 0.57 0.04 -0.87 0.08 1.06 0.00 0.00 176.91 177.80 1yq2 s VAL 591 N -3.31 1.81 0.92 -2.22 1.01 0.27 -1.79 120.40 117.09 1yq2 s VAL 591 Ca 0.05 -0.92 -0.12 0.00 0.00 0.00 0.00 61.98 60.99 1yq2 s VAL 591 Cb 0.06 -1.56 0.14 0.00 0.00 0.00 0.00 36.38 35.03 1yq2 s VAL 591 CO 0.65 0.51 1.13 -0.76 0.00 0.00 0.00 175.10 176.62 1yq2 s LEU 592 N 0.07 1.97 0.59 3.92 1.43 -0.07 -1.58 118.68 125.01 1yq2 s LEU 592 Ca -0.08 1.03 0.34 0.00 -1.03 0.00 0.00 54.13 54.39 1yq2 s LEU 592 Cb -0.14 -3.34 1.87 0.00 0.03 0.00 0.00 46.19 44.61 1yq2 s LEU 592 CO 0.04 -2.63 2.22 0.28 0.23 0.00 0.00 176.35 176.49 1yq2 h SER 593 N -1.55 0.00 -0.50 2.29 0.02 -1.90 -0.97 113.55 110.94 1yq2 h SER 593 Ca -0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1yq2 h SER 593 Cb 1.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.87 1yq2 h SER 593 CO 0.61 0.04 0.00 -0.90 -1.14 0.00 0.00 176.83 175.44 1yq2 n ASP 594 N -3.46 4.45 0.00 3.07 3.85 -1.26 -4.75 116.55 118.46 1yq2 n ASP 594 Ca -0.02 -2.57 0.00 0.00 -0.71 0.00 0.00 54.79 51.49 1yq2 n ASP 594 Cb 0.15 -0.59 0.00 0.00 -1.35 0.00 0.00 41.12 39.33 1yq2 n ASP 594 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 1yq2 n SER 595 N 0.70 -2.96 -4.68 -1.12 7.64 -0.37 -5.03 113.62 107.80 1yq2 n SER 595 Ca 0.22 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.68 1yq2 n SER 595 Cb 0.89 -0.65 -0.03 0.00 -1.01 0.00 0.00 64.21 63.42 1yq2 n SER 595 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1yq2 s THR 596 N -2.07 4.78 0.22 0.44 2.01 -1.26 -4.78 115.64 114.98 1yq2 s THR 596 Ca 0.00 2.03 -0.31 0.00 0.31 0.00 0.00 61.69 63.72 1yq2 s THR 596 Cb 0.00 -4.31 -0.10 0.00 0.01 0.00 0.00 72.50 68.10 1yq2 s THR 596 CO 0.00 -0.01 1.55 -2.84 -0.69 0.00 0.00 174.62 172.62 1yq2 s PRO 597 N 2.12 4.21 0.64 4.92 0.02 -1.26 -0.90 135.00 144.75 1yq2 s PRO 597 Ca 0.48 2.40 -0.11 0.00 0.02 0.00 0.00 61.00 63.79 1yq2 s PRO 597 Cb -0.18 -3.11 -0.02 0.00 0.02 0.00 0.00 34.50 31.21 1yq2 s PRO 597 CO 0.17 -0.56 1.03 0.95 -0.33 0.00 0.00 177.00 178.25 1yq2 s THR 598 N 0.57 4.25 0.44 0.99 -4.23 -0.74 -4.92 115.64 112.01 1yq2 s THR 598 Ca 0.66 0.66 0.19 0.00 -1.18 0.00 0.00 61.69 62.01 1yq2 s THR 598 Cb -0.44 -3.72 0.38 0.00 1.34 0.00 0.00 72.50 70.06 1yq2 s THR 598 CO 0.38 -0.92 1.90 -0.65 -0.54 0.00 0.00 174.62 174.79 1yq2 h PRO 599 N -0.39 0.33 -0.62 3.99 0.11 -1.94 -1.24 132.00 132.22 1yq2 h PRO 599 Ca -0.45 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.69 1yq2 h PRO 599 Cb 1.22 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.22 1yq2 h PRO 599 CO 0.63 0.22 0.41 0.78 -0.21 0.00 0.00 178.00 179.82 1yq2 h GLY 600 N 0.34 0.81 1.62 -0.55 0.00 -1.90 -1.31 103.07 102.08 1yq2 h GLY 600 Ca 0.40 -0.27 -0.17 0.00 0.00 0.00 0.00 47.33 47.29 1yq2 h GLY 600 CO -0.12 0.23 -0.69 -2.00 0.00 0.00 0.00 176.54 173.96 1yq2 h LEU 601 N 0.69 0.44 -0.75 3.11 5.85 -1.44 -0.68 115.31 122.53 1yq2 h LEU 601 Ca 0.26 -0.28 -0.12 0.00 0.84 0.00 0.00 57.88 58.58 1yq2 h LEU 601 Cb 0.16 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1yq2 h LEU 601 CO -0.07 1.00 -0.35 1.88 -0.34 0.00 0.00 178.44 180.55 1yq2 h TYR 602 N 0.26 0.64 -0.31 1.25 -1.99 -1.36 -1.13 116.97 114.33 1yq2 h TYR 602 Ca -0.02 -0.17 -0.01 0.00 2.00 0.00 0.00 58.73 60.53 1yq2 h TYR 602 Cb 1.25 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 39.82 1yq2 h TYR 602 CO 0.04 0.83 0.16 1.49 -0.00 0.00 0.00 178.16 180.68 1yq2 h GLU 603 N 0.46 0.45 0.01 4.88 4.57 -1.01 -2.43 114.58 121.50 1yq2 h GLU 603 Ca 0.05 -0.06 0.03 0.00 -1.18 0.00 0.00 59.36 58.20 1yq2 h GLU 603 Cb 0.83 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 29.30 1yq2 h GLU 603 CO 0.07 0.40 -0.21 0.35 -1.18 0.00 0.00 179.01 178.44 1yq2 h PHE 604 N 0.38 -0.56 -0.46 0.92 3.57 -0.98 -2.02 116.94 117.78 1yq2 h PHE 604 Ca 0.11 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.72 1yq2 h PHE 604 Cb 0.10 0.25 -0.09 0.00 2.79 0.00 0.00 35.95 38.99 1yq2 h PHE 604 CO -0.02 -0.30 -0.16 -0.22 -2.23 0.00 0.00 178.31 175.38 1yq2 h LYS 605 N -0.34 -0.05 -0.43 1.11 3.64 -1.09 0.54 116.57 119.93 1yq2 h LYS 605 Ca 0.06 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1yq2 h LYS 605 Cb 0.42 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 1yq2 h LYS 605 CO -0.19 -0.04 0.24 0.37 -2.27 0.00 0.00 179.45 177.56 1yq2 h GLN 606 N -0.06 0.61 -0.17 1.90 5.75 -1.31 -2.52 115.11 119.31 1yq2 h GLN 606 Ca 0.22 -0.07 -0.15 0.00 -0.15 0.00 0.00 58.65 58.50 1yq2 h GLN 606 Cb 0.40 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1yq2 h GLN 606 CO -0.51 0.48 -0.52 0.82 -2.65 0.00 0.00 178.83 176.46 1yq2 h ILE 607 N 0.57 1.33 -0.49 2.39 2.04 -0.52 -2.92 117.51 119.91 1yq2 h ILE 607 Ca 0.15 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 64.25 1yq2 h ILE 607 Cb 0.05 1.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1yq2 h ILE 607 CO -0.02 0.54 0.00 1.33 0.00 0.00 0.00 178.15 180.00 1yq2 n VAL 608 N -3.96 1.38 -1.67 1.67 0.24 0.08 -5.00 118.33 111.07 1yq2 n VAL 608 Ca -0.03 -0.88 -0.45 0.00 -2.04 0.00 0.00 64.34 60.95 1yq2 n VAL 608 Cb 0.58 0.02 -0.03 0.00 -1.47 0.00 0.00 33.84 32.94 1yq2 n VAL 608 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1yq2 n SER 609 N 0.79 2.83 0.14 -1.34 2.88 -0.96 -4.86 113.62 113.11 1yq2 n SER 609 Ca 0.19 1.14 0.13 0.00 -1.33 0.00 0.00 58.87 59.00 1yq2 n SER 609 Cb 0.70 -1.44 0.50 0.00 -0.75 0.00 0.00 64.21 63.23 1yq2 n SER 609 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1yq2 h PRO 610 N 4.32 0.00 -4.71 -1.46 0.13 -1.90 -3.38 132.00 125.00 1yq2 h PRO 610 Ca -0.45 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 63.99 1yq2 h PRO 610 Cb 1.27 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 32.07 1yq2 h PRO 610 CO 0.76 0.00 -0.67 0.42 -0.23 0.00 0.00 178.00 178.29 1yq2 s ILE 611 N -3.33 3.09 -0.16 -3.56 -1.09 -1.26 -0.27 121.20 114.60 1yq2 s ILE 611 Ca 0.04 -1.51 -0.22 0.00 -2.23 0.00 0.00 60.65 56.74 1yq2 s ILE 611 Cb 0.09 -2.85 -0.03 0.00 -1.58 0.00 0.00 42.46 38.10 1yq2 s ILE 611 CO 0.43 -0.23 0.67 -0.60 -1.23 0.00 0.00 174.94 173.98 1yq2 s ARG 612 N 1.24 4.28 -0.04 2.79 6.06 0.22 -4.87 118.95 128.62 1yq2 s ARG 612 Ca -0.02 0.73 0.05 0.00 -2.50 0.00 0.00 55.73 53.99 1yq2 s ARG 612 Cb -0.20 -3.54 -0.02 0.00 0.06 0.00 0.00 34.95 31.24 1yq2 s ARG 612 CO -0.01 -0.17 -0.20 -0.51 -2.50 0.00 0.00 175.30 171.90 1yq2 s LEU 613 N 1.66 2.38 0.06 -0.88 1.43 -1.26 -1.08 118.68 120.99 1yq2 s LEU 613 Ca 0.32 -0.35 0.03 0.00 -1.03 0.00 0.00 54.13 53.10 1yq2 s LEU 613 Cb -0.16 -1.45 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 1yq2 s LEU 613 CO 0.12 0.31 -0.10 -0.83 0.23 0.00 0.00 176.35 176.09 1yq2 s GLY 614 N -0.55 0.66 -0.00 -3.19 0.00 -0.25 -4.86 107.32 99.13 1yq2 s GLY 614 Ca 0.08 -0.91 0.04 0.00 0.00 0.00 0.00 44.72 43.92 1yq2 s GLY 614 CO 0.01 -0.96 -0.12 1.08 0.00 0.00 0.00 173.10 173.10 1yq2 s LEU 615 N -1.80 2.05 0.11 0.66 1.43 -1.26 -0.58 118.68 119.30 1yq2 s LEU 615 Ca -0.05 -0.25 -0.13 0.00 -1.03 0.00 0.00 54.13 52.67 1yq2 s LEU 615 Cb -0.08 -0.60 0.02 0.00 0.03 0.00 0.00 46.19 45.56 1yq2 s LEU 615 CO 0.01 0.12 0.31 -0.94 0.23 0.00 0.00 176.35 176.08 1yq2 s SER 616 N -0.41 -0.08 -0.40 2.29 1.04 -0.88 -4.97 113.70 110.29 1yq2 s SER 616 Ca 0.04 -0.48 0.03 0.00 0.48 0.00 0.00 55.95 56.02 1yq2 s SER 616 Cb -0.05 0.42 0.11 0.00 0.10 0.00 0.00 66.02 66.60 1yq2 s SER 616 CO -0.00 -0.81 0.14 -0.22 0.98 0.00 0.00 173.24 173.33 1yq2 s LEU 617 N -2.84 4.04 0.34 2.42 2.96 -1.26 -0.85 118.68 123.49 1yq2 s LEU 617 Ca 0.05 -2.40 -0.29 0.00 -0.22 0.00 0.00 54.13 51.27 1yq2 s LEU 617 Cb 0.03 -1.46 -0.12 0.00 0.50 0.00 0.00 46.19 45.15 1yq2 s LEU 617 CO -0.11 -0.33 1.46 -0.81 -1.32 0.00 0.00 176.35 175.24 1yq2 n PRO 618 N 3.91 2.51 -1.51 0.98 -0.04 -1.26 -4.82 135.00 134.77 1yq2 n PRO 618 Ca 0.04 0.88 -0.50 0.00 -0.04 0.00 0.00 63.50 63.88 1yq2 n PRO 618 Cb 0.38 -2.59 -0.06 0.00 -0.04 0.00 0.00 33.50 31.19 1yq2 n PRO 618 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yq2 n ALA 619 N 0.84 1.03 -0.06 0.55 0.00 -1.26 0.40 120.51 122.00 1yq2 n ALA 619 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1yq2 n ALA 619 Cb 0.37 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.27 1yq2 n ALA 619 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 620 N 6.01 1.42 0.00 0.00 0.00 -1.26 -5.04 105.19 106.31 1yq2 n GLY 620 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1yq2 n GLY 620 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 621 N -2.00 0.98 3.88 -0.02 0.00 0.16 -5.13 105.19 103.06 1yq2 n GLY 621 Ca 0.00 -1.94 -0.21 0.00 0.00 0.00 0.00 46.02 43.87 1yq2 n GLY 621 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yq2 s LYS 622 N -0.07 3.00 0.21 1.61 1.02 -1.26 -4.83 119.74 119.41 1yq2 s LYS 622 Ca 0.00 -1.06 -0.32 0.00 0.02 0.00 0.00 55.97 54.61 1yq2 s LYS 622 Cb 0.00 -2.64 -0.13 0.00 -0.52 0.00 0.00 37.83 34.54 1yq2 s LYS 622 CO 0.00 0.28 1.56 -2.30 -0.92 0.00 0.00 175.35 173.96 1yq2 n PRO 623 N -1.34 2.28 -4.16 -1.68 -0.02 -1.26 -4.33 135.00 124.49 1yq2 n PRO 623 Ca -0.05 0.82 -0.34 0.00 -2.02 0.00 0.00 63.50 61.91 1yq2 n PRO 623 Cb 0.58 -2.57 -0.15 0.00 -0.02 0.00 0.00 33.50 31.34 1yq2 n PRO 623 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1yq2 s THR 624 N 0.57 2.72 -0.29 3.45 2.01 -0.03 -0.80 115.64 123.27 1yq2 s THR 624 Ca 0.74 -0.73 -0.13 0.00 0.31 0.00 0.00 61.69 61.88 1yq2 s THR 624 Cb -0.62 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 1yq2 s THR 624 CO 0.41 0.49 0.29 -0.22 -0.69 0.00 0.00 174.62 174.90 1yq2 s LEU 625 N 1.22 4.13 -0.09 4.42 2.96 0.92 -2.06 118.68 130.17 1yq2 s LEU 625 Ca 0.02 0.03 -0.16 0.00 -0.22 0.00 0.00 54.13 53.80 1yq2 s LEU 625 Cb -0.14 -2.27 -0.05 0.00 0.50 0.00 0.00 46.19 44.24 1yq2 s LEU 625 CO -0.06 -0.16 0.42 0.00 -1.32 0.00 0.00 176.35 175.24 1yq2 s ALA 626 N 1.91 3.56 -0.10 5.97 0.00 0.26 -0.51 121.76 132.85 1yq2 s ALA 626 Ca 0.11 -0.25 0.01 0.00 0.00 0.00 0.00 51.96 51.83 1yq2 s ALA 626 Cb -0.16 -2.52 0.02 0.00 0.00 0.00 0.00 23.12 20.45 1yq2 s ALA 626 CO 0.11 0.15 -0.13 0.08 0.00 0.00 0.00 175.76 175.97 1yq2 s VAL 627 N 0.11 1.34 -0.14 0.00 1.01 0.52 -1.09 120.40 122.15 1yq2 s VAL 627 Ca 0.23 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1yq2 s VAL 627 Cb -0.15 -1.25 0.01 0.00 0.00 0.00 0.00 36.38 35.00 1yq2 s VAL 627 CO 0.10 0.41 -0.21 0.00 0.00 0.00 0.00 175.10 175.40 1yq2 s ALA 628 N 1.03 2.19 -0.57 5.51 0.00 -0.24 -0.33 121.76 129.34 1yq2 s ALA 628 Ca -0.07 -1.06 -0.25 0.00 0.00 0.00 0.00 51.96 50.58 1yq2 s ALA 628 Cb -0.15 -1.00 0.04 0.00 0.00 0.00 0.00 23.12 22.01 1yq2 s ALA 628 CO -0.01 -0.08 1.00 1.21 0.00 0.00 0.00 175.76 177.88 1yq2 s ASN 629 N 0.91 6.34 -0.05 0.00 3.84 -0.14 -0.61 114.94 125.22 1yq2 s ASN 629 Ca -0.05 -0.32 0.15 0.00 0.21 0.00 0.00 52.86 52.84 1yq2 s ASN 629 Cb -0.15 -2.46 0.52 0.00 -0.55 0.00 0.00 41.25 38.61 1yq2 s ASN 629 CO -0.03 -1.32 1.41 0.18 -2.79 0.00 0.00 177.10 174.55 1yq2 n LEU 630 N 7.75 3.42 -4.74 3.21 4.77 0.62 -0.34 117.00 131.68 1yq2 n LEU 630 Ca 0.03 -1.72 -0.30 0.00 -0.03 0.00 0.00 56.01 53.99 1yq2 n LEU 630 Cb 0.48 -0.45 0.12 0.00 -2.33 0.00 0.00 43.42 41.23 1yq2 n LEU 630 CO 0.65 0.68 0.68 -0.13 -1.33 0.00 0.00 177.39 177.94 1yq2 s ARG 631 N -1.57 1.68 0.03 3.23 0.52 -1.24 -4.84 118.95 116.75 1yq2 s ARG 631 Ca 0.38 0.92 -0.18 0.00 -0.52 0.00 0.00 55.73 56.33 1yq2 s ARG 631 Cb 0.23 -1.85 -0.25 0.00 0.52 0.00 0.00 34.95 33.59 1yq2 s ARG 631 CO 0.21 -1.98 1.10 1.25 0.02 0.00 0.00 175.30 175.90 1yq2 h HIS 632 N -1.36 0.79 0.00 -0.53 -0.00 -1.93 -3.33 115.15 108.79 1yq2 h HIS 632 Ca -0.47 -0.46 0.00 0.00 -0.00 0.00 0.00 60.37 59.44 1yq2 h HIS 632 Cb 1.26 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 1yq2 h HIS 632 CO 0.48 1.30 -0.30 0.25 -0.00 0.00 0.00 177.93 179.66 1yq2 n THR 633 N -4.03 0.00 -2.35 6.26 -2.24 -1.26 -4.95 114.28 105.71 1yq2 n THR 633 Ca -0.12 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.26 1yq2 n THR 633 Cb 0.80 -0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.51 1yq2 n THR 633 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yq2 s ALA 634 N -1.66 3.44 0.98 6.98 0.00 -1.26 -4.34 121.76 125.89 1yq2 s ALA 634 Ca 0.00 1.02 -0.15 0.00 0.00 0.00 0.00 51.96 52.82 1yq2 s ALA 634 Cb 0.00 -3.39 0.19 0.00 0.00 0.00 0.00 23.12 19.92 1yq2 s ALA 634 CO 0.00 -0.34 1.23 0.16 0.00 0.00 0.00 175.76 176.80 1yq2 s ASP 635 N -0.55 2.98 -0.10 0.00 1.47 -1.26 -3.73 116.67 115.49 1yq2 s ASP 635 Ca 0.48 0.54 0.08 0.00 1.18 0.00 0.00 52.55 54.83 1yq2 s ASP 635 Cb -0.34 -0.79 0.41 0.00 -0.34 0.00 0.00 42.92 41.86 1yq2 s ASP 635 CO 0.43 -2.84 1.18 0.00 0.68 0.00 0.00 175.17 174.63 1yq2 n ALA 636 N -3.89 3.04 0.31 2.11 0.00 0.35 -4.39 120.51 118.04 1yq2 n ALA 636 Ca 0.12 -0.92 0.19 0.00 0.00 0.00 0.00 53.44 52.83 1yq2 n ALA 636 Cb 0.60 -1.04 0.99 0.00 0.00 0.00 0.00 19.45 19.99 1yq2 n ALA 636 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1yq2 h SER 637 N 2.13 0.00 0.07 0.00 4.64 -1.84 -1.03 113.55 117.52 1yq2 h SER 637 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yq2 h SER 637 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1yq2 h SER 637 CO 0.20 0.02 -0.03 -0.90 -0.87 0.00 0.00 176.83 175.25 1yq2 n ASP 638 N -3.29 0.76 -4.51 4.97 5.75 -1.26 -4.86 116.55 114.11 1yq2 n ASP 638 Ca -0.02 -1.13 -0.33 0.00 -0.01 0.00 0.00 54.79 53.30 1yq2 n ASP 638 Cb 0.15 -0.01 -0.12 0.00 -1.03 0.00 0.00 41.12 40.10 1yq2 n ASP 638 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1yq2 s VAL 639 N -2.10 3.23 0.07 2.12 1.01 -0.39 -0.81 120.40 123.53 1yq2 s VAL 639 Ca 0.39 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.72 1yq2 s VAL 639 Cb 0.21 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 1yq2 s VAL 639 CO 0.38 0.54 -0.21 0.54 0.00 0.00 0.00 175.10 176.35 1yq2 s VAL 640 N -0.80 1.71 -0.35 2.92 0.11 -0.14 -4.26 120.40 119.59 1yq2 s VAL 640 Ca 0.13 -1.38 -0.10 0.00 -2.93 0.00 0.00 61.98 57.70 1yq2 s VAL 640 Cb -0.11 -1.52 0.01 0.00 -1.53 0.00 0.00 36.38 33.24 1yq2 s VAL 640 CO 0.02 0.08 0.18 -0.76 -3.33 0.00 0.00 175.10 171.29 1yq2 s LEU 641 N -1.54 4.46 -0.15 2.54 1.43 -0.01 -1.18 118.68 124.23 1yq2 s LEU 641 Ca 0.07 -0.82 -0.06 0.00 -1.03 0.00 0.00 54.13 52.30 1yq2 s LEU 641 Cb -0.09 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1yq2 s LEU 641 CO 0.03 -0.31 0.06 -0.13 0.23 0.00 0.00 176.35 176.23 1yq2 s ARG 642 N 1.57 3.69 0.12 1.70 0.52 0.15 -0.23 118.95 126.48 1yq2 s ARG 642 Ca 0.03 -0.33 0.10 0.00 -0.52 0.00 0.00 55.73 55.00 1yq2 s ARG 642 Cb -0.18 -3.11 -0.04 0.00 0.52 0.00 0.00 34.95 32.14 1yq2 s ARG 642 CO 0.06 0.43 -0.24 1.67 0.02 0.00 0.00 175.30 177.25 1yq2 s TRP 643 N -0.08 2.05 0.01 -0.53 1.48 0.06 -0.62 118.94 121.31 1yq2 s TRP 643 Ca 0.06 -0.40 -0.04 0.00 -1.06 0.00 0.00 56.10 54.66 1yq2 s TRP 643 Cb -0.12 -1.10 -0.01 0.00 -1.16 0.00 0.00 33.47 31.08 1yq2 s TRP 643 CO 0.01 0.29 0.07 -0.98 -4.06 0.00 0.00 176.95 172.28 1yq2 s ARG 644 N -2.07 0.40 -0.10 3.25 1.70 -0.37 -1.51 118.95 120.25 1yq2 s ARG 644 Ca 0.11 -0.45 0.02 0.00 -0.47 0.00 0.00 55.73 54.94 1yq2 s ARG 644 Cb -0.10 0.16 -0.01 0.00 -0.57 0.00 0.00 34.95 34.43 1yq2 s ARG 644 CO 0.05 -0.09 -0.19 0.54 -1.08 0.00 0.00 175.30 174.54 1yq2 s VAL 645 N -1.34 2.54 -0.04 4.99 0.11 0.47 -1.38 120.40 125.75 1yq2 s VAL 645 Ca -0.14 -0.86 0.07 0.00 -2.93 0.00 0.00 61.98 58.11 1yq2 s VAL 645 Cb -0.08 -2.01 -0.02 0.00 -1.53 0.00 0.00 36.38 32.74 1yq2 s VAL 645 CO 0.01 0.55 -0.23 -1.61 -3.33 0.00 0.00 175.10 170.48 1yq2 s GLU 646 N 0.22 2.31 -0.33 1.54 2.02 0.18 -0.17 118.70 124.47 1yq2 s GLU 646 Ca -0.12 -0.88 -0.08 0.00 0.02 0.00 0.00 54.97 53.91 1yq2 s GLU 646 Cb -0.16 -2.14 0.03 0.00 0.10 0.00 0.00 34.13 31.95 1yq2 s GLU 646 CO 0.06 0.52 0.12 -1.58 0.02 0.00 0.00 175.26 174.41 1yq2 s HIS 647 N -0.50 3.22 -1.51 1.61 5.65 0.21 -1.38 115.29 122.58 1yq2 s HIS 647 Ca 0.07 -1.14 -0.14 0.00 0.25 0.00 0.00 55.06 54.10 1yq2 s HIS 647 Cb -0.11 -2.31 0.10 0.00 -1.18 0.00 0.00 32.58 29.08 1yq2 s HIS 647 CO 0.00 -0.65 0.78 -0.25 -0.65 0.00 0.00 174.74 173.97 1yq2 n ASP 648 N 4.88 -4.16 0.00 9.88 10.43 -0.19 -1.65 116.55 135.74 1yq2 n ASP 648 Ca -0.13 -0.71 0.00 0.00 2.57 0.00 0.00 54.79 56.52 1yq2 n ASP 648 Cb 0.46 -3.37 0.00 0.00 1.84 0.00 0.00 41.12 40.05 1yq2 n ASP 648 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1yq2 n GLY 649 N -1.45 2.47 3.75 0.44 0.00 -1.26 -4.76 105.19 104.37 1yq2 n GLY 649 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 1yq2 n GLY 649 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 650 N -2.43 3.63 0.02 4.61 0.00 -0.66 -4.61 121.76 122.33 1yq2 s ALA 650 Ca 0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 1yq2 s ALA 650 Cb 0.00 -2.34 -0.07 0.00 0.00 0.00 0.00 23.12 20.71 1yq2 s ALA 650 CO 0.00 0.17 1.68 0.08 0.00 0.00 0.00 175.76 177.69 1yq2 s VAL 651 N 0.21 3.25 -0.16 0.00 1.01 -1.26 -0.61 120.40 122.84 1yq2 s VAL 651 Ca 0.16 0.54 0.17 0.00 0.00 0.00 0.00 61.98 62.85 1yq2 s VAL 651 Cb -0.13 -3.35 -0.24 0.00 0.00 0.00 0.00 36.38 32.67 1yq2 s VAL 651 CO 0.04 -0.02 0.11 0.00 0.00 0.00 0.00 175.10 175.23 1yq2 n ALA 652 N 6.33 1.70 -3.48 5.51 0.00 0.76 -4.90 120.51 126.43 1yq2 n ALA 652 Ca 0.17 -1.11 -0.14 0.00 0.00 0.00 0.00 53.44 52.36 1yq2 n ALA 652 Cb 0.41 -0.21 -0.04 0.00 0.00 0.00 0.00 19.45 19.62 1yq2 n ALA 652 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yq2 s ALA 653 N -2.57 -1.72 0.23 0.00 0.00 -1.17 -5.00 121.76 111.53 1yq2 s ALA 653 Ca -0.09 0.97 -0.19 0.00 0.00 0.00 0.00 51.96 52.65 1yq2 s ALA 653 Cb 0.06 0.35 0.02 0.00 0.00 0.00 0.00 23.12 23.56 1yq2 s ALA 653 CO 0.76 -0.57 0.60 -1.54 0.00 0.00 0.00 175.76 175.01 1yq2 s SER 654 N -1.99 -0.27 0.00 0.00 1.04 -1.26 -0.40 113.70 110.83 1yq2 s SER 654 Ca -0.03 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 55.85 1yq2 s SER 654 Cb -0.01 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.76 1yq2 s SER 654 CO -0.03 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 173.63 1yq2 n GLY 655 N -0.40 0.72 3.32 7.32 0.00 -0.57 -4.99 105.19 110.60 1yq2 n GLY 655 Ca -0.07 -0.82 -0.14 0.00 0.00 0.00 0.00 46.02 44.98 1yq2 n GLY 655 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1yq2 s GLU 656 N -1.80 0.66 0.11 1.61 -1.05 -1.26 -0.76 118.70 116.21 1yq2 s GLU 656 Ca 0.00 0.24 0.07 0.00 -0.15 0.00 0.00 54.97 55.13 1yq2 s GLU 656 Cb 0.00 0.31 -0.04 0.00 -0.44 0.00 0.00 34.13 33.96 1yq2 s GLU 656 CO 0.00 -0.15 -0.18 0.14 0.95 0.00 0.00 175.26 176.02 1yq2 s VAL 657 N -0.60 1.55 0.52 1.83 -7.23 0.69 -4.98 120.40 112.19 1yq2 s VAL 657 Ca -0.07 -1.58 -0.18 0.00 -1.81 0.00 0.00 61.98 58.34 1yq2 s VAL 657 Cb -0.03 -1.50 -0.07 0.00 0.56 0.00 0.00 36.38 35.34 1yq2 s VAL 657 CO 0.03 -0.18 1.02 0.00 -0.31 0.00 0.00 175.10 175.66 1yq2 s ALA 658 N -1.46 2.91 -0.83 1.32 0.00 -1.26 -0.83 121.76 121.62 1yq2 s ALA 658 Ca 0.06 0.39 -0.19 0.00 0.00 0.00 0.00 51.96 52.22 1yq2 s ALA 658 Cb -0.09 -3.19 0.13 0.00 0.00 0.00 0.00 23.12 19.97 1yq2 s ALA 658 CO 0.04 -0.40 0.99 0.00 0.00 0.00 0.00 175.76 176.39 1yq2 s ALA 659 N -2.35 3.43 0.14 0.00 0.00 -1.26 -4.85 121.76 116.87 1yq2 s ALA 659 Ca 0.63 -2.63 0.11 0.00 0.00 0.00 0.00 51.96 50.07 1yq2 s ALA 659 Cb -0.13 -3.87 -0.04 0.00 0.00 0.00 0.00 23.12 19.07 1yq2 s ALA 659 CO 0.28 -2.76 -0.26 -1.21 0.00 0.00 0.00 175.76 171.80 1yq2 s GLU 660 N 2.54 1.42 0.00 0.00 2.02 -1.26 -1.14 118.70 122.28 1yq2 s GLU 660 Ca 0.26 -1.38 0.00 0.00 0.02 0.00 0.00 54.97 53.87 1yq2 s GLU 660 Cb -0.10 -1.89 0.00 0.00 0.10 0.00 0.00 34.13 32.24 1yq2 s GLU 660 CO -0.04 0.44 0.00 0.41 0.02 0.00 0.00 175.26 176.09 1yq2 n GLY 661 N 0.80 3.94 0.14 -1.39 0.00 0.07 -4.59 105.19 104.17 1yq2 n GLY 661 Ca -0.17 -1.83 0.13 0.00 0.00 0.00 0.00 46.02 44.15 1yq2 n GLY 661 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yq2 h SER 662 N 0.00 0.00 -1.29 1.61 4.64 -1.91 -3.37 113.55 113.23 1yq2 h SER 662 Ca 0.00 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.90 1yq2 h SER 662 Cb 0.00 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 61.78 1yq2 h SER 662 CO 0.00 0.00 -0.91 -0.67 -0.87 0.00 0.00 176.83 174.38 1yq2 n ASP 663 N -2.42 -0.69 0.00 4.97 4.64 -1.26 -5.12 116.55 116.67 1yq2 n ASP 663 Ca 0.03 -3.04 0.00 0.00 -1.38 0.00 0.00 54.79 50.41 1yq2 n ASP 663 Cb 0.34 0.26 0.00 0.00 -1.04 0.00 0.00 41.12 40.68 1yq2 n ASP 663 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1yq2 n GLY 664 N 1.06 -0.11 3.67 0.27 0.00 -1.26 -4.94 105.19 103.88 1yq2 n GLY 664 Ca 0.17 -1.29 -0.40 0.00 0.00 0.00 0.00 46.02 44.50 1yq2 n GLY 664 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1yq2 n PRO 665 N 1.84 1.63 -1.66 1.61 -0.02 -1.26 -0.75 135.00 136.39 1yq2 n PRO 665 Ca 0.00 0.59 -0.43 0.00 -2.02 0.00 0.00 63.50 61.63 1yq2 n PRO 665 Cb 0.00 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.15 1yq2 n PRO 665 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1yq2 n LEU 666 N 0.02 3.97 -4.84 2.45 7.94 -0.30 -4.33 117.00 121.91 1yq2 n LEU 666 Ca 0.09 0.84 -0.32 0.00 -1.11 0.00 0.00 56.01 55.51 1yq2 n LEU 666 Cb 0.41 -1.50 -0.02 0.00 0.53 0.00 0.00 43.42 42.83 1yq2 n LEU 666 CO 0.57 0.08 0.69 -0.13 -1.11 0.00 0.00 177.39 177.48 1yq2 s ARG 667 N 4.61 3.83 -0.16 1.96 0.52 -1.26 -0.50 118.95 127.95 1yq2 s ARG 667 Ca 0.91 0.95 -0.39 0.00 -0.52 0.00 0.00 55.73 56.69 1yq2 s ARG 667 Cb -0.47 -2.12 -0.16 0.00 0.52 0.00 0.00 34.95 32.73 1yq2 s ARG 667 CO 0.43 -0.37 1.64 0.00 0.02 0.00 0.00 175.30 177.02 1yq2 n ALA 668 N -1.79 -0.30 -0.62 2.13 0.00 -1.24 -0.84 120.51 117.85 1yq2 n ALA 668 Ca 0.07 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1yq2 n ALA 668 Cb 0.54 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1yq2 n ALA 668 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 669 N 3.75 0.80 3.91 0.00 0.00 0.54 -4.97 105.19 109.21 1yq2 n GLY 669 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 1yq2 n GLY 669 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yq2 s GLU 670 N -0.38 3.47 0.19 1.61 2.12 -0.02 -4.92 118.70 120.76 1yq2 s GLU 670 Ca 0.00 -0.37 0.11 0.00 0.36 0.00 0.00 54.97 55.07 1yq2 s GLU 670 Cb 0.00 -3.02 -0.04 0.00 0.26 0.00 0.00 34.13 31.33 1yq2 s GLU 670 CO 0.00 0.60 -0.24 -1.12 -0.54 0.00 0.00 175.26 173.96 1yq2 s SER 671 N -2.42 3.36 0.19 -1.70 0.01 -1.26 -0.97 113.70 110.92 1yq2 s SER 671 Ca 0.35 -0.86 -0.11 0.00 1.31 0.00 0.00 55.95 56.64 1yq2 s SER 671 Cb -0.13 -0.24 -0.00 0.00 0.21 0.00 0.00 66.02 65.85 1yq2 s SER 671 CO 0.26 0.11 0.36 0.00 0.41 0.00 0.00 173.24 174.39 1yq2 s ALA 672 N -1.65 -0.14 0.04 1.44 0.00 0.55 -4.88 121.76 117.11 1yq2 s ALA 672 Ca 0.20 -0.83 0.06 0.00 0.00 0.00 0.00 51.96 51.39 1yq2 s ALA 672 Cb -0.08 0.95 -0.02 0.00 0.00 0.00 0.00 23.12 23.96 1yq2 s ALA 672 CO 0.09 -0.72 -0.17 0.95 0.00 0.00 0.00 175.76 175.91 1yq2 s THR 673 N -3.98 1.34 -0.06 0.00 -4.23 -1.26 -0.36 115.64 107.10 1yq2 s THR 673 Ca 0.19 -1.07 0.01 0.00 -1.18 0.00 0.00 61.69 59.64 1yq2 s THR 673 Cb 0.02 -1.19 0.02 0.00 1.34 0.00 0.00 72.50 72.69 1yq2 s THR 673 CO 0.03 0.10 -0.06 -0.63 -0.54 0.00 0.00 174.62 173.51 1yq2 s ILE 674 N -0.81 0.69 -0.05 2.99 1.01 0.34 -4.97 121.20 120.39 1yq2 s ILE 674 Ca 0.04 -0.19 -0.25 0.00 0.00 0.00 0.00 60.65 60.25 1yq2 s ILE 674 Cb -0.08 -0.70 -0.03 0.00 0.01 0.00 0.00 42.46 41.66 1yq2 s ILE 674 CO 0.01 0.27 0.77 0.00 0.00 0.00 0.00 174.94 175.99 1yq2 s ALA 675 N 1.01 3.29 0.53 9.38 0.00 -1.26 -0.05 121.76 134.65 1yq2 s ALA 675 Ca -0.09 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.10 1yq2 s ALA 675 Cb -0.14 -3.06 0.02 0.00 0.00 0.00 0.00 23.12 19.94 1yq2 s ALA 675 CO -0.00 -0.15 0.76 -0.51 0.00 0.00 0.00 175.76 175.86 1yq2 s LEU 676 N 0.88 3.37 0.75 0.00 1.43 0.02 -4.97 118.68 120.15 1yq2 s LEU 676 Ca 0.41 0.14 -0.15 0.00 -1.03 0.00 0.00 54.13 53.50 1yq2 s LEU 676 Cb -0.19 -3.00 0.01 0.00 0.03 0.00 0.00 46.19 43.04 1yq2 s LEU 676 CO 0.21 -1.02 0.90 -2.65 0.23 0.00 0.00 176.35 174.01 1yq2 n PRO 677 N -2.30 0.38 -1.76 1.29 -0.02 -1.26 -4.36 135.00 126.97 1yq2 n PRO 677 Ca 0.06 0.19 -0.40 0.00 -2.02 0.00 0.00 63.50 61.32 1yq2 n PRO 677 Cb 0.59 -2.17 0.01 0.00 -0.02 0.00 0.00 33.50 31.92 1yq2 n PRO 677 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 n ALA 678 N -2.66 2.04 -3.39 3.55 0.00 -1.26 -4.52 120.51 114.26 1yq2 n ALA 678 Ca 0.12 0.27 -0.26 0.00 0.00 0.00 0.00 53.44 53.57 1yq2 n ALA 678 Cb 0.50 -2.39 -0.09 0.00 0.00 0.00 0.00 19.45 17.47 1yq2 n ALA 678 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1yq2 n MET 679 N -0.05 0.76 -1.66 0.00 2.81 -1.26 -5.07 117.12 112.65 1yq2 n MET 679 Ca 0.05 -3.48 -0.44 0.00 -1.81 0.00 0.00 57.70 52.02 1yq2 n MET 679 Cb 0.41 -1.65 -0.01 0.00 -0.71 0.00 0.00 33.22 31.25 1yq2 n MET 679 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1yq2 n PRO 680 N 2.11 1.90 -2.03 0.03 -0.04 -1.26 -4.90 135.00 130.81 1yq2 n PRO 680 Ca 0.26 0.67 -0.41 0.00 -0.04 0.00 0.00 63.50 63.98 1yq2 n PRO 680 Cb 0.47 -2.22 -0.02 0.00 -0.04 0.00 0.00 33.50 31.69 1yq2 n PRO 680 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yq2 s ALA 681 N -0.80 3.60 0.31 0.55 0.00 -1.26 -4.98 121.76 119.17 1yq2 s ALA 681 Ca 0.60 1.32 -0.30 0.00 0.00 0.00 0.00 51.96 53.58 1yq2 s ALA 681 Cb -0.63 -3.54 -0.12 0.00 0.00 0.00 0.00 23.12 18.83 1yq2 s ALA 681 CO 0.58 -0.73 1.56 0.00 0.00 0.00 0.00 175.76 177.17 1yq2 n ALA 682 N 2.05 2.39 -0.32 0.00 0.00 -1.26 -4.88 120.51 118.48 1yq2 n ALA 682 Ca 0.06 0.37 0.09 0.00 0.00 0.00 0.00 53.44 53.95 1yq2 n ALA 682 Cb 0.40 -2.44 0.29 0.00 0.00 0.00 0.00 19.45 17.71 1yq2 n ALA 682 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1yq2 h PRO 683 N 4.35 0.87 -6.41 0.00 0.11 -2.00 -3.38 132.00 125.54 1yq2 h PRO 683 Ca -0.47 -0.05 -0.63 0.00 0.11 0.00 0.00 66.00 64.95 1yq2 h PRO 683 Cb 1.23 -0.20 -0.16 0.00 0.11 0.00 0.00 31.00 31.99 1yq2 h PRO 683 CO 0.76 0.57 -0.79 -0.51 -0.21 0.00 0.00 178.00 177.82 1yq2 s LEU 684 N -10.06 2.53 0.00 2.35 1.43 -1.26 -4.90 118.68 108.77 1yq2 s LEU 684 Ca -0.11 -0.94 0.00 0.00 -1.03 0.00 0.00 54.13 52.05 1yq2 s LEU 684 Cb 0.22 -1.15 0.00 0.00 0.03 0.00 0.00 46.19 45.29 1yq2 s LEU 684 CO 0.80 0.08 0.00 0.61 0.23 0.00 0.00 176.35 178.07 1yq2 n GLY 685 N -0.18 -0.21 3.57 -3.19 0.00 -1.26 -4.90 105.19 99.03 1yq2 n GLY 685 Ca -0.09 -1.04 -0.31 0.00 0.00 0.00 0.00 46.02 44.59 1yq2 n GLY 685 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yq2 s GLU 686 N 0.00 2.24 -0.13 1.61 2.02 -1.26 -4.46 118.70 118.72 1yq2 s GLU 686 Ca 0.00 -0.93 -0.00 0.00 0.02 0.00 0.00 54.97 54.05 1yq2 s GLU 686 Cb 0.00 -2.35 0.03 0.00 0.10 0.00 0.00 34.13 31.91 1yq2 s GLU 686 CO 0.00 0.54 -0.09 0.99 0.02 0.00 0.00 175.26 176.72 1yq2 s THR 687 N -1.12 1.18 -0.08 3.63 2.01 -1.26 -1.03 115.64 118.97 1yq2 s THR 687 Ca 0.19 -0.43 0.03 0.00 0.31 0.00 0.00 61.69 61.79 1yq2 s THR 687 Cb -0.11 -1.19 0.01 0.00 0.01 0.00 0.00 72.50 71.21 1yq2 s THR 687 CO 0.11 0.35 -0.17 0.26 -0.69 0.00 0.00 174.62 174.48 1yq2 s TRP 688 N 1.64 1.91 -0.16 4.92 0.52 -0.48 -0.36 118.94 126.93 1yq2 s TRP 688 Ca 0.04 -0.76 -0.15 0.00 0.02 0.00 0.00 56.10 55.25 1yq2 s TRP 688 Cb -0.13 -1.34 -0.04 0.00 -1.15 0.00 0.00 33.47 30.81 1yq2 s TRP 688 CO -0.09 -0.35 0.33 -1.17 0.02 0.00 0.00 176.95 175.69 1yq2 s LEU 689 N 0.58 4.24 -0.05 2.99 2.96 -0.39 -0.64 118.68 128.36 1yq2 s LEU 689 Ca -0.15 0.55 0.06 0.00 -0.22 0.00 0.00 54.13 54.37 1yq2 s LEU 689 Cb -0.17 -2.43 -0.01 0.00 0.50 0.00 0.00 46.19 44.08 1yq2 s LEU 689 CO 0.05 0.06 -0.24 -0.89 -1.32 0.00 0.00 176.35 174.02 1yq2 s THR 690 N 0.59 1.94 -0.08 3.68 2.01 -0.48 -1.02 115.64 122.28 1yq2 s THR 690 Ca 0.18 -1.01 0.04 0.00 0.31 0.00 0.00 61.69 61.20 1yq2 s THR 690 Cb -0.13 -1.64 0.00 0.00 0.01 0.00 0.00 72.50 70.74 1yq2 s THR 690 CO 0.05 0.54 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.64 1yq2 s VAL 691 N -0.21 1.66 -0.07 3.82 1.01 -0.23 -1.23 120.40 125.14 1yq2 s VAL 691 Ca -0.01 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.21 1yq2 s VAL 691 Cb -0.13 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.81 1yq2 s VAL 691 CO 0.03 0.47 -0.19 -0.70 0.00 0.00 0.00 175.10 174.70 1yq2 s GLU 692 N 0.34 2.29 -0.17 2.72 2.12 0.21 -1.09 118.70 125.12 1yq2 s GLU 692 Ca -0.14 -0.69 -0.26 0.00 0.36 0.00 0.00 54.97 54.24 1yq2 s GLU 692 Cb -0.16 -1.85 -0.01 0.00 0.26 0.00 0.00 34.13 32.37 1yq2 s GLU 692 CO 0.06 0.19 0.87 0.00 -0.54 0.00 0.00 175.26 175.84 1yq2 s ALA 693 N 0.26 3.52 0.13 6.30 0.00 -0.67 -0.68 121.76 130.63 1yq2 s ALA 693 Ca -0.11 0.08 0.05 0.00 0.00 0.00 0.00 51.96 51.98 1yq2 s ALA 693 Cb -0.15 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 1yq2 s ALA 693 CO 0.05 -0.69 -0.12 0.14 0.00 0.00 0.00 175.76 175.14 1yq2 s VAL 694 N 2.26 1.21 0.06 0.00 -7.23 -0.32 -0.07 120.40 116.31 1yq2 s VAL 694 Ca 0.40 -1.87 -0.30 0.00 -1.81 0.00 0.00 61.98 58.40 1yq2 s VAL 694 Cb -0.17 -1.65 -0.05 0.00 0.56 0.00 0.00 36.38 35.07 1yq2 s VAL 694 CO 0.12 -0.59 1.10 -0.76 -0.31 0.00 0.00 175.10 174.66 1yq2 s LEU 695 N -2.79 4.40 0.15 1.32 1.43 -0.09 -0.97 118.68 122.13 1yq2 s LEU 695 Ca 0.12 1.90 -0.16 0.00 -1.03 0.00 0.00 54.13 54.96 1yq2 s LEU 695 Cb -0.01 -3.58 0.02 0.00 0.03 0.00 0.00 46.19 42.64 1yq2 s LEU 695 CO 0.02 -0.33 1.81 0.03 0.23 0.00 0.00 176.35 178.11 1yq2 h ARG 696 N 6.44 0.55 -6.36 1.70 3.08 -1.30 0.16 114.38 118.65 1yq2 h ARG 696 Ca -0.42 -0.03 -0.60 0.00 0.07 0.00 0.00 59.98 58.99 1yq2 h ARG 696 Cb 1.22 -0.12 -0.19 0.00 0.08 0.00 0.00 29.97 30.95 1yq2 h ARG 696 CO 0.77 0.37 -0.82 -0.51 -1.07 0.00 0.00 179.97 178.71 1yq2 s ASP 697 N -5.58 3.05 0.59 7.04 1.01 -1.26 -4.06 116.67 117.45 1yq2 s ASP 697 Ca -0.13 -0.82 -0.19 0.00 0.71 0.00 0.00 52.55 52.11 1yq2 s ASP 697 Cb 0.11 -0.20 -0.04 0.00 1.01 0.00 0.00 42.92 43.80 1yq2 s ASP 697 CO 0.73 0.07 1.23 0.00 0.21 0.00 0.00 175.17 177.40 1yq2 s ALA 698 N -1.64 2.58 0.40 5.23 0.00 -1.26 -4.37 121.76 122.69 1yq2 s ALA 698 Ca 0.16 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.19 1yq2 s ALA 698 Cb -0.08 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1yq2 s ALA 698 CO 0.08 -1.20 0.04 0.25 0.00 0.00 0.00 175.76 174.92 1yq2 n THR 699 N -1.50 0.00 0.73 0.00 -2.24 0.04 -4.87 114.28 106.44 1yq2 n THR 699 Ca 0.13 -1.84 0.08 0.00 -2.27 0.00 0.00 64.05 60.14 1yq2 n THR 699 Cb 0.49 0.31 0.39 0.00 -2.10 0.00 0.00 70.33 69.42 1yq2 n THR 699 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yq2 n GLY 700 N 0.24 -0.78 0.00 3.38 0.00 -1.26 -3.40 105.19 103.37 1yq2 n GLY 700 Ca -0.15 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1yq2 n GLY 700 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1yq2 n TRP 701 N -1.28 0.00 -3.78 1.61 4.27 -1.26 -5.06 117.44 111.95 1yq2 n TRP 701 Ca 0.07 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.57 1yq2 n TRP 701 Cb 0.12 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 29.99 1yq2 n TRP 701 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1yq2 s ALA 702 N -0.39 -0.62 0.73 -1.67 0.00 -1.22 -4.77 121.76 113.82 1yq2 s ALA 702 Ca 0.00 0.01 -0.11 0.00 0.00 0.00 0.00 51.96 51.86 1yq2 s ALA 702 Cb 0.00 0.25 0.03 0.00 0.00 0.00 0.00 23.12 23.40 1yq2 s ALA 702 CO 0.00 -0.36 1.07 -1.25 0.00 0.00 0.00 175.76 175.22 1yq2 s PRO 703 N -2.25 2.68 0.37 0.00 0.04 -1.26 -0.78 135.00 133.81 1yq2 s PRO 703 Ca -0.07 0.91 -0.27 0.00 0.04 0.00 0.00 61.00 61.61 1yq2 s PRO 703 Cb -0.02 -1.96 -0.11 0.00 0.04 0.00 0.00 34.50 32.44 1yq2 s PRO 703 CO -0.02 -1.27 1.26 0.00 0.04 0.00 0.00 177.00 177.01 1yq2 n ALA 704 N -3.24 1.17 -0.51 8.56 0.00 -1.26 -2.29 120.51 122.95 1yq2 n ALA 704 Ca 0.08 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1yq2 n ALA 704 Cb 0.54 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1yq2 n ALA 704 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 705 N 0.82 0.75 3.68 0.00 0.00 0.57 -4.88 105.19 106.13 1yq2 n GLY 705 Ca 0.06 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.63 1yq2 n GLY 705 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1yq2 n HIS 706 N -2.23 2.47 -2.58 1.61 -0.00 -0.97 -4.60 115.22 108.91 1yq2 n HIS 706 Ca 0.00 -0.12 -0.39 0.00 0.46 0.00 0.00 57.72 57.67 1yq2 n HIS 706 Cb 0.00 -2.71 -0.05 0.00 -0.12 0.00 0.00 29.99 27.11 1yq2 n HIS 706 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 1yq2 s PRO 707 N 3.39 4.55 -0.23 1.57 0.04 -1.26 -0.92 135.00 142.14 1yq2 s PRO 707 Ca 0.87 1.60 0.10 0.00 0.04 0.00 0.00 61.00 63.61 1yq2 s PRO 707 Cb -0.56 -2.98 -0.21 0.00 0.04 0.00 0.00 34.50 30.79 1yq2 s PRO 707 CO 0.43 0.18 -0.07 1.28 0.04 0.00 0.00 177.00 178.86 1yq2 n LEU 708 N 0.82 1.44 0.00 -3.56 4.77 0.89 -4.93 117.00 116.43 1yq2 n LEU 708 Ca 0.01 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1yq2 n LEU 708 Cb 0.47 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1yq2 n LEU 708 CO 0.50 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.88 1yq2 n GLY 709 N 2.00 1.05 3.41 -0.72 0.00 -1.22 -4.62 105.19 105.08 1yq2 n GLY 709 Ca -0.39 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 44.68 1yq2 n GLY 709 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 710 N -2.00 0.32 0.01 4.61 0.00 -1.26 -1.66 121.76 121.78 1yq2 s ALA 710 Ca 0.00 -1.19 -0.17 0.00 0.00 0.00 0.00 51.96 50.60 1yq2 s ALA 710 Cb 0.00 1.16 0.03 0.00 0.00 0.00 0.00 23.12 24.31 1yq2 s ALA 710 CO 0.00 -0.73 0.37 0.54 0.00 0.00 0.00 175.76 175.95 1yq2 s VAL 711 N -4.06 0.06 0.17 0.00 0.11 -0.25 -4.93 120.40 111.49 1yq2 s VAL 711 Ca 0.28 -0.46 0.08 0.00 -2.93 0.00 0.00 61.98 58.94 1yq2 s VAL 711 Cb 0.03 -0.81 -0.04 0.00 -1.53 0.00 0.00 36.38 34.03 1yq2 s VAL 711 CO 0.09 -0.25 -0.16 -1.10 -3.33 0.00 0.00 175.10 170.35 1yq2 s GLN 712 N -1.86 1.23 -0.04 1.54 -0.21 -1.26 -1.07 119.66 117.99 1yq2 s GLN 712 Ca -0.09 -1.43 -0.01 0.00 0.02 0.00 0.00 55.36 53.85 1yq2 s GLN 712 Cb -0.03 -1.16 0.03 0.00 1.00 0.00 0.00 33.01 32.85 1yq2 s GLN 712 CO 0.02 0.22 0.03 -1.17 -2.12 0.00 0.00 175.29 172.27 1yq2 s LEU 713 N -2.84 0.66 -0.25 2.90 2.96 -0.19 -4.83 118.68 117.09 1yq2 s LEU 713 Ca 0.16 0.02 -0.29 0.00 -0.22 0.00 0.00 54.13 53.81 1yq2 s LEU 713 Cb -0.04 -0.18 0.01 0.00 0.50 0.00 0.00 46.19 46.48 1yq2 s LEU 713 CO 0.06 -0.18 1.08 -0.62 -1.32 0.00 0.00 176.35 175.36 1yq2 s ASP 714 N 1.61 7.04 -0.13 3.68 3.68 -1.26 -1.26 116.67 130.02 1yq2 s ASP 714 Ca -0.02 1.33 0.15 0.00 2.13 0.00 0.00 52.55 56.14 1yq2 s ASP 714 Cb -0.13 -2.54 0.46 0.00 -1.45 0.00 0.00 42.92 39.26 1yq2 s ASP 714 CO -0.03 -0.74 1.36 0.18 0.13 0.00 0.00 175.17 176.08 1yq2 n LEU 715 N 6.50 3.55 -4.76 -1.34 4.77 0.51 -4.99 117.00 121.24 1yq2 n LEU 715 Ca 0.12 -2.77 -0.39 0.00 -0.03 0.00 0.00 56.01 52.95 1yq2 n LEU 715 Cb 0.46 -0.46 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1yq2 n LEU 715 CO 0.54 0.68 0.97 -0.44 -1.33 0.00 0.00 177.39 177.81 1yq2 s SER 716 N -1.75 5.82 0.70 -1.43 0.01 -1.07 -4.47 113.70 111.51 1yq2 s SER 716 Ca 0.36 2.68 -0.16 0.00 1.31 0.00 0.00 55.95 60.14 1yq2 s SER 716 Cb 0.28 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.89 1yq2 s SER 716 CO 0.10 -1.19 1.17 0.00 0.41 0.00 0.00 173.24 173.73 1yq2 n ALA 717 N -0.47 0.45 -1.56 1.44 0.00 -1.26 -4.90 120.51 114.20 1yq2 n ALA 717 Ca 0.07 -0.13 -0.51 0.00 0.00 0.00 0.00 53.44 52.87 1yq2 n ALA 717 Cb 0.45 -2.24 -0.05 0.00 0.00 0.00 0.00 19.45 17.60 1yq2 n ALA 717 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1yq2 n PRO 718 N -2.18 0.92 -1.73 0.00 -0.02 -1.26 -4.86 135.00 125.87 1yq2 n PRO 718 Ca 0.15 0.33 -0.42 0.00 -2.02 0.00 0.00 63.50 61.53 1yq2 n PRO 718 Cb 0.49 -1.84 -0.02 0.00 -0.02 0.00 0.00 33.50 32.11 1yq2 n PRO 718 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 n ALA 719 N 1.73 2.17 -3.08 3.55 0.00 -1.26 -4.99 120.51 118.63 1yq2 n ALA 719 Ca 0.17 0.38 -0.45 0.00 0.00 0.00 0.00 53.44 53.54 1yq2 n ALA 719 Cb 0.20 -2.41 -0.06 0.00 0.00 0.00 0.00 19.45 17.18 1yq2 n ALA 719 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1yq2 s VAL 720 N -0.09 5.21 0.40 0.00 1.01 -1.26 -5.07 120.40 120.60 1yq2 s VAL 720 Ca 0.64 -1.26 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 1yq2 s VAL 720 Cb -0.53 -4.24 -0.08 0.00 0.00 0.00 0.00 36.38 31.52 1yq2 s VAL 720 CO 0.50 -0.73 1.20 -2.16 0.00 0.00 0.00 175.10 173.90 1yq2 s PRO 721 N 1.66 4.04 0.48 2.72 0.04 -1.26 -4.98 135.00 137.71 1yq2 s PRO 721 Ca 0.04 1.92 -0.22 0.00 0.04 0.00 0.00 61.00 62.78 1yq2 s PRO 721 Cb -0.27 -2.70 -0.07 0.00 0.04 0.00 0.00 34.50 31.49 1yq2 s PRO 721 CO 0.05 -0.35 1.12 0.95 0.04 0.00 0.00 177.00 178.80 1yq2 s THR 722 N -1.37 3.32 -0.32 1.26 -4.23 -1.26 -4.98 115.64 108.06 1yq2 s THR 722 Ca 0.57 0.92 -0.21 0.00 -1.18 0.00 0.00 61.69 61.78 1yq2 s THR 722 Cb -0.32 -3.42 -0.00 0.00 1.34 0.00 0.00 72.50 70.09 1yq2 s THR 722 CO 0.41 -0.09 0.69 -0.13 -0.54 0.00 0.00 174.62 174.96 1yq2 s ARG 723 N -2.93 3.85 0.34 3.99 0.52 -1.26 -5.04 118.95 118.42 1yq2 s ARG 723 Ca 0.66 0.32 -0.13 0.00 -0.52 0.00 0.00 55.73 56.06 1yq2 s ARG 723 Cb -0.24 -3.75 -0.08 0.00 0.52 0.00 0.00 34.95 31.39 1yq2 s ARG 723 CO 0.29 -0.66 0.73 -1.12 0.02 0.00 0.00 175.30 174.56 1yq2 s SER 724 N 1.69 6.69 0.41 0.23 0.01 -1.26 -5.03 113.70 116.44 1yq2 s SER 724 Ca 0.27 1.21 -0.26 0.00 1.31 0.00 0.00 55.95 58.48 1yq2 s SER 724 Cb -0.14 -2.35 -0.10 0.00 0.21 0.00 0.00 66.02 63.64 1yq2 s SER 724 CO 0.13 -0.25 1.37 -2.65 0.41 0.00 0.00 173.24 172.25 1yq2 n PRO 725 N -0.62 2.23 -1.76 12.44 -0.02 -1.26 -4.95 135.00 141.06 1yq2 n PRO 725 Ca 0.03 0.79 -0.41 0.00 -2.02 0.00 0.00 63.50 61.88 1yq2 n PRO 725 Cb 0.53 -2.52 -0.01 0.00 -0.02 0.00 0.00 33.50 31.49 1yq2 n PRO 725 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1yq2 n ARG 726 N 0.14 2.73 -1.65 -0.52 0.63 -1.26 -4.94 116.66 111.79 1yq2 n ARG 726 Ca 0.05 0.96 -0.45 0.00 -0.92 0.00 0.00 57.85 57.49 1yq2 n ARG 726 Cb 0.39 -2.73 -0.02 0.00 0.45 0.00 0.00 32.46 30.55 1yq2 n ARG 726 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1yq2 n PRO 727 N 1.49 1.79 -4.99 -0.14 -0.02 -1.26 -4.98 135.00 126.89 1yq2 n PRO 727 Ca 0.06 0.63 -0.30 0.00 -2.02 0.00 0.00 63.50 61.86 1yq2 n PRO 727 Cb 0.38 -2.17 -0.15 0.00 -0.02 0.00 0.00 33.50 31.53 1yq2 n PRO 727 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 s ALA 728 N -0.62 2.24 0.07 3.55 0.00 -1.26 -5.11 121.76 120.63 1yq2 s ALA 728 Ca 0.63 -1.24 -0.30 0.00 0.00 0.00 0.00 51.96 51.04 1yq2 s ALA 728 Cb -0.66 -0.49 -0.06 0.00 0.00 0.00 0.00 23.12 21.90 1yq2 s ALA 728 CO 0.56 0.53 1.18 0.99 0.00 0.00 0.00 175.76 179.02 1yq2 s THR 729 N -0.77 4.05 0.72 0.00 2.01 -1.26 -5.02 115.64 115.37 1yq2 s THR 729 Ca 0.11 1.50 -0.16 0.00 0.31 0.00 0.00 61.69 63.45 1yq2 s THR 729 Cb -0.10 -3.96 0.02 0.00 0.01 0.00 0.00 72.50 68.48 1yq2 s THR 729 CO 0.01 0.13 1.21 -0.81 -0.69 0.00 0.00 174.62 174.47 1yq2 n PRO 730 N 3.74 0.69 -4.33 4.92 -0.04 -1.26 -4.66 135.00 134.07 1yq2 n PRO 730 Ca 0.08 0.30 -0.24 0.00 -0.04 0.00 0.00 63.50 63.60 1yq2 n PRO 730 Cb 0.47 -2.45 -0.08 0.00 -0.04 0.00 0.00 33.50 31.39 1yq2 n PRO 730 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1yq2 s LEU 731 N -4.58 3.01 0.46 1.53 1.43 0.41 -5.00 118.68 115.93 1yq2 s LEU 731 Ca 0.78 -0.70 -0.21 0.00 -1.03 0.00 0.00 54.13 52.97 1yq2 s LEU 731 Cb -0.34 -1.58 -0.09 0.00 0.03 0.00 0.00 46.19 44.20 1yq2 s LEU 731 CO 0.45 0.04 1.01 -1.81 0.23 0.00 0.00 176.35 176.28 1yq2 s ASP 732 N -3.38 6.58 0.00 2.29 1.01 -1.26 -3.75 116.67 118.15 1yq2 s ASP 732 Ca 0.29 1.87 0.00 0.00 0.71 0.00 0.00 52.55 55.42 1yq2 s ASP 732 Cb -0.07 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.30 1yq2 s ASP 732 CO 0.17 -0.61 0.00 0.61 0.21 0.00 0.00 175.17 175.55 1yq2 n GLY 733 N -0.29 0.03 3.76 0.21 0.00 -1.26 -4.95 105.19 102.69 1yq2 n GLY 733 Ca 0.08 -2.29 -0.39 0.00 0.00 0.00 0.00 46.02 43.42 1yq2 n GLY 733 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 734 N -1.25 3.12 0.38 4.61 0.00 -1.26 -4.55 121.76 122.81 1yq2 s ALA 734 Ca 0.00 1.24 -0.24 0.00 0.00 0.00 0.00 51.96 52.96 1yq2 s ALA 734 Cb 0.00 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.52 1yq2 s ALA 734 CO 0.00 -0.96 1.01 -0.51 0.00 0.00 0.00 175.76 175.30 1yq2 s LEU 735 N -2.79 4.18 0.63 0.00 1.43 -1.26 -4.72 118.68 116.15 1yq2 s LEU 735 Ca 0.61 1.94 -0.17 0.00 -1.03 0.00 0.00 54.13 55.48 1yq2 s LEU 735 Cb -0.38 -4.17 -0.01 0.00 0.03 0.00 0.00 46.19 41.65 1yq2 s LEU 735 CO 0.47 -0.35 1.17 -2.16 0.23 0.00 0.00 176.35 175.71 1yq2 s PRO 736 N -2.44 2.80 -0.13 1.29 0.04 -1.26 -4.96 135.00 130.34 1yq2 s PRO 736 Ca 0.56 1.66 -0.05 0.00 0.04 0.00 0.00 61.00 63.21 1yq2 s PRO 736 Cb -0.20 -1.93 -0.25 0.00 0.04 0.00 0.00 34.50 32.17 1yq2 s PRO 736 CO 0.25 -1.30 0.30 0.28 0.04 0.00 0.00 177.00 176.57 1yq2 n VAL 737 N -2.01 1.74 -4.06 -0.36 0.31 -1.26 -4.70 118.33 108.00 1yq2 n VAL 737 Ca 0.12 -0.65 -0.13 0.00 -0.01 0.00 0.00 64.34 63.67 1yq2 n VAL 737 Cb 0.51 -1.68 -0.12 0.00 -0.91 0.00 0.00 33.84 31.64 1yq2 n VAL 737 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1yq2 s SER 738 N -6.95 0.62 -0.27 4.52 1.04 -1.26 -0.07 113.70 111.33 1yq2 s SER 738 Ca -0.23 -0.37 -0.03 0.00 0.48 0.00 0.00 55.95 55.79 1yq2 s SER 738 Cb 0.07 0.01 0.09 0.00 0.10 0.00 0.00 66.02 66.29 1yq2 s SER 738 CO 0.75 -0.13 0.11 -0.76 0.98 0.00 0.00 173.24 174.19 1yq2 s LEU 739 N -1.02 0.97 0.00 2.42 1.43 0.12 -5.01 118.68 117.59 1yq2 s LEU 739 Ca -0.07 -1.25 0.00 0.00 -1.03 0.00 0.00 54.13 51.78 1yq2 s LEU 739 Cb -0.07 -0.48 0.00 0.00 0.03 0.00 0.00 46.19 45.67 1yq2 s LEU 739 CO -0.00 -0.41 0.00 0.61 0.23 0.00 0.00 176.35 176.78 1yq2 n GLY 740 N 5.14 3.58 0.00 -3.19 0.00 -1.26 -1.12 105.19 108.34 1yq2 n GLY 740 Ca -0.05 0.04 0.15 0.00 0.00 0.00 0.00 46.02 46.15 1yq2 n GLY 740 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1yq2 n PRO 741 N 14.00 0.62 -3.69 1.61 -0.04 -1.26 -4.82 135.00 141.41 1yq2 n PRO 741 Ca 0.00 0.01 -0.37 0.00 -0.04 0.00 0.00 63.50 63.10 1yq2 n PRO 741 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 1yq2 n PRO 741 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yq2 s ALA 742 N -2.35 3.78 -0.05 0.55 0.00 -0.28 -1.05 121.76 122.36 1yq2 s ALA 742 Ca 0.34 -0.46 0.06 0.00 0.00 0.00 0.00 51.96 51.91 1yq2 s ALA 742 Cb 0.20 -2.18 -0.01 0.00 0.00 0.00 0.00 23.12 21.13 1yq2 s ALA 742 CO 0.40 0.50 -0.24 0.99 0.00 0.00 0.00 175.76 177.41 1yq2 s THR 743 N -0.86 2.14 0.13 0.00 2.01 -0.63 -0.70 115.64 117.72 1yq2 s THR 743 Ca 0.18 -1.05 0.10 0.00 0.31 0.00 0.00 61.69 61.23 1yq2 s THR 743 Cb -0.14 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.56 1yq2 s THR 743 CO 0.07 0.57 -0.24 -0.36 -0.69 0.00 0.00 174.62 173.98 1yq2 s PHE 744 N -0.32 2.08 -0.24 4.92 0.40 0.90 -0.56 117.98 125.16 1yq2 s PHE 744 Ca 0.01 -0.40 0.02 0.00 -0.60 0.00 0.00 56.93 55.97 1yq2 s PHE 744 Cb -0.12 -1.11 0.06 0.00 0.51 0.00 0.00 43.02 42.35 1yq2 s PHE 744 CO 0.02 0.31 -0.10 0.34 0.70 0.00 0.00 175.22 176.49 1yq2 s ASP 745 N -2.14 4.11 -1.62 1.36 3.68 0.65 -4.70 116.67 118.00 1yq2 s ASP 745 Ca 0.12 -1.25 -0.13 0.00 2.13 0.00 0.00 52.55 53.43 1yq2 s ASP 745 Cb -0.09 -1.41 0.11 0.00 -1.45 0.00 0.00 42.92 40.07 1yq2 s ASP 745 CO 0.06 -0.19 0.63 0.00 0.13 0.00 0.00 175.17 175.80 1yq2 n ALA 746 N 4.53 -1.50 0.00 3.66 0.00 -1.26 -0.91 120.51 125.02 1yq2 n ALA 746 Ca -0.14 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1yq2 n ALA 746 Cb 0.43 -2.75 0.00 0.00 0.00 0.00 0.00 19.45 17.13 1yq2 n ALA 746 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 747 N -1.62 2.20 3.67 0.00 0.00 -1.26 -5.03 105.19 103.15 1yq2 n GLY 747 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 1yq2 n GLY 747 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yq2 s THR 748 N -2.50 4.97 0.17 2.61 2.01 -0.09 -5.01 115.64 117.80 1yq2 s THR 748 Ca 0.00 1.36 -0.32 0.00 0.31 0.00 0.00 61.69 63.03 1yq2 s THR 748 Cb 0.00 -4.02 -0.12 0.00 0.01 0.00 0.00 72.50 68.37 1yq2 s THR 748 CO 0.00 0.08 1.74 -0.11 -0.69 0.00 0.00 174.62 175.64 1yq2 n LEU 749 N 5.07 3.87 0.00 4.42 7.94 -1.26 -0.25 117.00 136.79 1yq2 n LEU 749 Ca 0.01 1.04 0.00 0.00 -1.11 0.00 0.00 56.01 55.95 1yq2 n LEU 749 Cb 0.49 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 42.90 1yq2 n LEU 749 CO 0.46 0.11 -0.50 1.33 -1.11 0.00 0.00 177.39 177.68 1yq2 n VAL 750 N 4.10 0.00 -3.68 1.96 0.24 0.28 -4.55 118.33 116.68 1yq2 n VAL 750 Ca 0.17 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.33 1yq2 n VAL 750 Cb 0.34 -0.18 -0.07 0.00 -1.47 0.00 0.00 33.84 32.46 1yq2 n VAL 750 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1yq2 s SER 751 N -2.44 -0.32 -0.07 -1.34 1.04 -1.15 -1.52 113.70 107.91 1yq2 s SER 751 Ca 0.00 0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.63 1yq2 s SER 751 Cb 0.00 0.39 0.02 0.00 0.10 0.00 0.00 66.02 66.53 1yq2 s SER 751 CO 0.00 -0.55 -0.06 -0.76 0.98 0.00 0.00 173.24 172.86 1yq2 s LEU 752 N -1.50 1.21 -1.43 2.42 1.43 -0.11 -1.61 118.68 119.10 1yq2 s LEU 752 Ca -0.11 -0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 52.78 1yq2 s LEU 752 Cb -0.03 -0.62 0.02 0.00 0.03 0.00 0.00 46.19 45.59 1yq2 s LEU 752 CO 0.04 -0.08 0.50 0.00 0.23 0.00 0.00 176.35 177.04 1yq2 n ALA 753 N 4.42 -1.92 -0.73 4.21 0.00 -0.22 -1.98 120.51 124.29 1yq2 n ALA 753 Ca -0.18 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1yq2 n ALA 753 Cb 0.51 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1yq2 n ALA 753 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 754 N -1.88 0.86 3.31 0.00 0.00 -1.26 -5.02 105.19 101.19 1yq2 n GLY 754 Ca -0.26 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 1yq2 n GLY 754 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yq2 s GLN 755 N -0.27 1.58 0.24 1.61 -1.52 -0.84 -5.11 119.66 115.36 1yq2 s GLN 755 Ca 0.00 -1.07 -0.30 0.00 -1.95 0.00 0.00 55.36 52.04 1yq2 s GLN 755 Cb 0.00 -1.77 -0.10 0.00 -0.22 0.00 0.00 33.01 30.92 1yq2 s GLN 755 CO 0.00 0.45 1.42 -1.25 -0.25 0.00 0.00 175.29 175.66 1yq2 s PRO 756 N -1.32 4.28 -0.15 2.91 0.04 -1.26 -0.93 135.00 138.57 1yq2 s PRO 756 Ca 0.10 2.27 -0.14 0.00 0.04 0.00 0.00 61.00 63.27 1yq2 s PRO 756 Cb -0.10 -3.12 0.04 0.00 0.04 0.00 0.00 34.50 31.36 1yq2 s PRO 756 CO 0.02 -0.39 0.40 0.08 0.04 0.00 0.00 177.00 177.15 1yq2 s VAL 757 N -0.01 -0.00 0.11 -0.36 1.01 -0.57 -4.11 120.40 116.47 1yq2 s VAL 757 Ca 0.59 0.00 0.10 0.00 0.00 0.00 0.00 61.98 62.67 1yq2 s VAL 757 Cb -0.41 -0.56 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 1yq2 s VAL 757 CO 0.43 0.00 -0.22 -0.44 0.00 0.00 0.00 175.10 174.87 1yq2 s SER 758 N 0.22 3.61 0.00 3.32 0.01 -0.78 -3.72 113.70 116.36 1yq2 s SER 758 Ca -0.00 -0.63 0.00 0.00 1.31 0.00 0.00 55.95 56.63 1yq2 s SER 758 Cb -0.03 -0.40 0.00 0.00 0.21 0.00 0.00 66.02 65.80 1yq2 s SER 758 CO 0.00 0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.45 1yq2 n GLY 759 N 0.94 0.74 3.81 3.44 0.00 -1.26 -0.59 105.19 112.27 1yq2 n GLY 759 Ca -0.17 -2.11 -0.34 0.00 0.00 0.00 0.00 46.02 43.41 1yq2 n GLY 759 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1yq2 s PRO 760 N -1.04 4.05 -0.10 1.61 0.04 -1.26 -4.50 135.00 133.81 1yq2 s PRO 760 Ca 0.00 1.25 0.03 0.00 0.04 0.00 0.00 61.00 62.32 1yq2 s PRO 760 Cb 0.00 -2.19 0.01 0.00 0.04 0.00 0.00 34.50 32.36 1yq2 s PRO 760 CO 0.00 -0.20 -0.19 0.50 0.04 0.00 0.00 177.00 177.16 1yq2 s ARG 761 N -3.12 2.50 0.31 4.56 3.52 -0.17 -4.90 118.95 121.65 1yq2 s ARG 761 Ca 0.64 -0.68 -0.30 0.00 -0.13 0.00 0.00 55.73 55.26 1yq2 s ARG 761 Cb -0.13 -1.98 -0.11 0.00 -1.56 0.00 0.00 34.95 31.17 1yq2 s ARG 761 CO 0.17 0.07 1.58 -1.17 -0.81 0.00 0.00 175.30 175.14 1yq2 s LEU 762 N 0.62 4.34 -0.05 -0.88 2.96 -1.26 -0.12 118.68 124.29 1yq2 s LEU 762 Ca -0.14 2.98 0.02 0.00 -0.22 0.00 0.00 54.13 56.77 1yq2 s LEU 762 Cb -0.16 -3.64 0.01 0.00 0.50 0.00 0.00 46.19 42.89 1yq2 s LEU 762 CO 0.04 -0.91 -0.10 -0.70 -1.32 0.00 0.00 176.35 173.36 1yq2 s GLU 763 N -0.83 1.32 -0.02 1.98 2.56 -0.22 -4.84 118.70 118.64 1yq2 s GLU 763 Ca 0.61 -0.34 0.10 0.00 0.00 0.00 0.00 54.97 55.35 1yq2 s GLU 763 Cb -0.48 -1.16 -0.16 0.00 2.00 0.00 0.00 34.13 34.34 1yq2 s GLU 763 CO 0.51 0.05 0.21 1.28 -0.56 0.00 0.00 175.26 176.76 1yq2 n LEU 764 N 3.63 0.00 -4.77 2.70 4.77 -1.26 -2.27 117.00 119.80 1yq2 n LEU 764 Ca -0.22 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.39 1yq2 n LEU 764 Cb 0.52 0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 41.58 1yq2 n LEU 764 CO 0.25 0.02 0.69 0.86 -1.33 0.00 0.00 177.39 177.88 1yq2 s TRP 765 N -2.68 3.60 0.14 -1.77 -0.11 -1.25 -2.84 118.94 114.03 1yq2 s TRP 765 Ca -0.04 1.75 0.07 0.00 1.22 0.00 0.00 56.10 59.10 1yq2 s TRP 765 Cb 0.06 -3.04 -0.04 0.00 -1.50 0.00 0.00 33.47 28.96 1yq2 s TRP 765 CO 0.43 -0.09 -0.16 -0.98 -4.62 0.00 0.00 176.95 171.53 1yq2 s ARG 766 N -1.99 1.14 -0.26 5.86 1.70 -1.26 -4.79 118.95 119.35 1yq2 s ARG 766 Ca 0.50 -1.33 -0.29 0.00 -0.47 0.00 0.00 55.73 54.14 1yq2 s ARG 766 Cb -0.22 -1.07 -0.03 0.00 -0.57 0.00 0.00 34.95 33.06 1yq2 s ARG 766 CO 0.28 0.21 1.83 0.00 -1.08 0.00 0.00 175.30 176.53 1yq2 s ALA 767 N -2.21 3.00 0.25 7.88 0.00 -1.26 -4.87 121.76 124.55 1yq2 s ALA 767 Ca 0.13 0.46 -0.31 0.00 0.00 0.00 0.00 51.96 52.24 1yq2 s ALA 767 Cb -0.05 -3.97 -0.13 0.00 0.00 0.00 0.00 23.12 18.98 1yq2 s ALA 767 CO 0.04 -2.41 1.50 -2.30 0.00 0.00 0.00 175.76 172.60 1yq2 n PRO 768 N 8.23 2.29 -1.26 0.00 -0.02 -1.26 -0.34 135.00 142.64 1yq2 n PRO 768 Ca 0.23 0.82 -0.30 0.00 -2.02 0.00 0.00 63.50 62.23 1yq2 n PRO 768 Cb 0.46 -2.53 0.14 0.00 -0.02 0.00 0.00 33.50 31.54 1yq2 n PRO 768 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1yq2 s THR 769 N 0.12 2.57 0.29 3.45 -4.23 -1.26 -4.51 115.64 112.06 1yq2 s THR 769 Ca 0.68 0.19 0.01 0.00 -1.18 0.00 0.00 61.69 61.38 1yq2 s THR 769 Cb -0.60 -2.72 0.28 0.00 1.34 0.00 0.00 72.50 70.81 1yq2 s THR 769 CO 0.47 -0.24 1.87 0.44 -0.54 0.00 0.00 174.62 176.62 1yq2 h ASP 770 N -1.55 0.94 -0.08 3.99 3.32 -1.88 -1.71 116.42 119.46 1yq2 h ASP 770 Ca -0.50 0.03 -0.10 0.00 0.02 0.00 0.00 57.03 56.48 1yq2 h ASP 770 Cb 1.29 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 1yq2 h ASP 770 CO 0.56 0.55 -0.24 0.78 -1.72 0.00 0.00 179.24 179.17 1yq2 h ASN 771 N 1.04 0.51 0.27 6.45 2.35 -1.86 -1.98 115.58 122.37 1yq2 h ASN 771 Ca 0.45 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 56.02 1yq2 h ASN 771 Cb 0.35 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 1yq2 h ASN 771 CO -0.21 0.75 -0.07 0.44 -1.65 0.00 0.00 177.43 176.69 1yq2 h ASP 772 N 0.45 0.00 0.28 5.81 3.32 -1.63 -2.02 116.42 122.63 1yq2 h ASP 772 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1yq2 h ASP 772 Cb 0.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1yq2 h ASP 772 CO 0.05 0.07 -0.32 0.54 -1.72 0.00 0.00 179.24 177.87 1yq2 n ARG 773 N -3.61 0.67 -2.87 3.56 1.74 -0.77 -1.09 116.66 114.28 1yq2 n ARG 773 Ca -0.02 -0.40 -0.32 0.00 -0.77 0.00 0.00 57.85 56.34 1yq2 n ARG 773 Cb 0.19 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.08 1yq2 n ARG 773 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1yq2 s GLY 774 N -2.61 2.26 0.00 -0.13 0.00 -0.76 -4.79 107.32 101.29 1yq2 s GLY 774 Ca 0.21 0.16 0.00 0.00 0.00 0.00 0.00 44.72 45.10 1yq2 s GLY 774 CO 0.56 0.41 0.64 0.00 0.00 0.00 0.00 173.10 174.70 1yq2 n ALA 775 N -0.78 1.45 0.09 3.20 0.00 -1.26 -4.21 120.51 119.00 1yq2 n ALA 775 Ca 0.05 -0.60 -0.04 0.00 0.00 0.00 0.00 53.44 52.86 1yq2 n ALA 775 Cb 0.54 -0.18 -0.02 0.00 0.00 0.00 0.00 19.45 19.79 1yq2 n ALA 775 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1yq2 h GLY 776 N 0.00 -0.25 -1.50 0.00 0.00 -1.88 -3.43 103.07 96.01 1yq2 h GLY 776 Ca 0.00 0.09 -0.53 0.00 0.00 0.00 0.00 47.33 46.90 1yq2 h GLY 776 CO 0.00 -0.09 0.31 -1.36 0.00 0.00 0.00 176.54 175.40 1yq2 s PHE 777 N -2.71 1.93 0.95 5.60 0.08 -1.26 -5.03 117.98 117.54 1yq2 s PHE 777 Ca -0.04 1.68 -0.15 0.00 0.12 0.00 0.00 56.93 58.55 1yq2 s PHE 777 Cb 0.00 -3.37 0.17 0.00 -0.57 0.00 0.00 43.02 39.26 1yq2 s PHE 777 CO 0.11 -2.59 1.22 0.20 -0.10 0.00 0.00 175.22 174.06 1yq2 s GLY 778 N -2.47 1.67 0.26 4.36 0.00 -0.49 -4.83 107.32 105.82 1yq2 s GLY 778 Ca 0.69 -0.90 -0.19 0.00 0.00 0.00 0.00 44.72 44.32 1yq2 s GLY 778 CO 0.52 -0.22 0.76 0.00 0.00 0.00 0.00 173.10 174.16 1yq2 s ALA 779 N -3.58 3.35 -0.40 3.20 0.00 0.14 -4.28 121.76 120.20 1yq2 s ALA 779 Ca 0.69 0.19 0.22 0.00 0.00 0.00 0.00 51.96 53.06 1yq2 s ALA 779 Cb -0.09 -2.86 0.28 0.00 0.00 0.00 0.00 23.12 20.46 1yq2 s ALA 779 CO 0.52 0.30 1.54 1.88 0.00 0.00 0.00 175.76 180.00 1yq2 h TYR 780 N 3.07 0.00 0.03 0.00 0.99 -1.87 0.83 116.97 120.02 1yq2 h TYR 780 Ca -0.48 0.00 0.03 0.00 2.00 0.00 0.00 58.73 60.28 1yq2 h TYR 780 Cb 1.19 0.00 -0.05 0.00 1.00 0.00 0.00 36.73 38.87 1yq2 h TYR 780 CO 0.63 0.04 -0.35 0.78 -0.00 0.00 0.00 178.16 179.26 1yq2 h GLY 781 N 3.96 -0.61 1.70 3.88 0.00 -1.94 -3.21 103.07 106.84 1yq2 h GLY 781 Ca -0.00 0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1yq2 h GLY 781 CO 0.00 -0.24 0.00 -1.05 0.00 0.00 0.00 176.54 175.25 1yq2 n PRO 782 N -5.43 0.09 -3.94 4.80 -0.02 -1.26 -4.85 135.00 124.40 1yq2 n PRO 782 Ca -0.05 0.24 -0.09 0.00 -2.02 0.00 0.00 63.50 61.58 1yq2 n PRO 782 Cb 0.34 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.29 1yq2 n PRO 782 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1yq2 s GLY 783 N -2.70 0.42 0.04 -1.23 0.00 -1.21 -5.07 107.32 97.56 1yq2 s GLY 783 Ca 0.08 -0.75 -0.30 0.00 0.00 0.00 0.00 44.72 43.74 1yq2 s GLY 783 CO 0.15 -0.46 1.88 -0.35 0.00 0.00 0.00 173.10 174.33 1yq2 s ASP 784 N -3.02 6.48 0.34 1.64 -1.08 -1.26 -4.85 116.67 114.92 1yq2 s ASP 784 Ca 0.19 2.61 0.24 0.00 -0.52 0.00 0.00 52.55 55.07 1yq2 s ASP 784 Cb -0.03 -2.54 1.21 0.00 -1.46 0.00 0.00 42.92 40.11 1yq2 s ASP 784 CO 0.10 -1.02 1.74 1.55 0.52 0.00 0.00 175.17 178.06 1yq2 h PRO 785 N 10.01 0.00 0.00 4.34 0.13 -1.96 -1.78 132.00 142.74 1yq2 h PRO 785 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1yq2 h PRO 785 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1yq2 h PRO 785 CO 0.94 0.00 -0.08 0.91 -0.23 0.00 0.00 178.00 179.54 1yq2 n TRP 786 N -2.34 0.81 -2.05 1.56 7.02 -1.26 -3.75 117.44 117.43 1yq2 n TRP 786 Ca -0.00 0.24 -0.28 0.00 -1.02 0.00 0.00 57.50 56.43 1yq2 n TRP 786 Cb 0.10 -0.87 0.05 0.00 -2.42 0.00 0.00 31.31 28.18 1yq2 n TRP 786 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1yq2 s LEU 787 N -4.37 2.89 -1.47 -0.99 1.02 -0.67 -4.12 118.68 110.98 1yq2 s LEU 787 Ca 0.10 0.87 -0.11 0.00 0.02 0.00 0.00 54.13 55.02 1yq2 s LEU 787 Cb 0.13 -3.60 0.05 0.00 0.02 0.00 0.00 46.19 42.79 1yq2 s LEU 787 CO 0.61 -1.42 0.92 -3.20 0.02 0.00 0.00 176.35 173.28 1yq2 n ASN 788 N -2.95 -5.35 -2.20 2.29 4.05 -1.26 -1.33 115.26 108.51 1yq2 n ASN 788 Ca 0.07 -0.59 -0.17 0.00 0.45 0.00 0.00 54.58 54.34 1yq2 n ASN 788 Cb 0.58 -4.27 -0.02 0.00 1.23 0.00 0.00 39.78 37.30 1yq2 n ASN 788 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 1yq2 n SER 789 N -2.77 -4.87 -1.30 1.20 7.64 -1.26 -1.02 113.62 111.25 1yq2 n SER 789 Ca 0.00 0.16 -0.16 0.00 1.01 0.00 0.00 58.87 59.89 1yq2 n SER 789 Cb 0.55 -4.15 -0.06 0.00 -1.01 0.00 0.00 64.21 59.54 1yq2 n SER 789 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yq2 n GLY 790 N -0.78 1.28 0.32 0.23 0.00 -0.44 -3.92 105.19 101.88 1yq2 n GLY 790 Ca -0.19 -0.27 0.14 0.00 0.00 0.00 0.00 46.02 45.70 1yq2 n GLY 790 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yq2 n ARG 791 N -2.54 1.37 0.00 1.61 1.74 -0.19 -4.77 116.66 113.88 1yq2 n ARG 791 Ca -0.16 -0.64 0.00 0.00 -0.77 0.00 0.00 57.85 56.28 1yq2 n ARG 791 Cb 0.54 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.49 1yq2 n ARG 791 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yq2 n GLY 792 N 1.15 -1.18 3.32 -0.13 0.00 -1.26 -1.39 105.19 105.70 1yq2 n GLY 792 Ca 0.19 -1.21 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 1yq2 n GLY 792 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yq2 s VAL 793 N 0.00 3.11 0.10 1.61 1.01 0.29 -4.74 120.40 121.78 1yq2 s VAL 793 Ca 0.00 -0.61 -0.35 0.00 0.00 0.00 0.00 61.98 61.02 1yq2 s VAL 793 Cb 0.00 -2.36 -0.17 0.00 0.00 0.00 0.00 36.38 33.85 1yq2 s VAL 793 CO 0.00 0.48 1.15 -2.65 0.00 0.00 0.00 175.10 174.08 1yq2 n PRO 794 N 4.20 0.80 -3.53 2.72 -0.02 -1.26 -0.68 135.00 137.23 1yq2 n PRO 794 Ca -0.18 0.29 -0.12 0.00 -2.02 0.00 0.00 63.50 61.46 1yq2 n PRO 794 Cb 0.52 -1.79 -0.04 0.00 -0.02 0.00 0.00 33.50 32.16 1yq2 n PRO 794 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yq2 s ALA 795 N 0.02 -1.83 1.06 3.55 0.00 -1.26 -4.83 121.76 118.47 1yq2 s ALA 795 Ca 0.80 1.24 -0.12 0.00 0.00 0.00 0.00 51.96 53.88 1yq2 s ALA 795 Cb -0.99 -0.04 0.22 0.00 0.00 0.00 0.00 23.12 22.31 1yq2 s ALA 795 CO 0.52 -0.49 1.07 -1.25 0.00 0.00 0.00 175.76 175.61 1yq2 s PRO 796 N -2.01 -0.07 0.86 0.00 0.04 -1.26 -4.80 135.00 127.76 1yq2 s PRO 796 Ca -0.02 0.69 -0.11 0.00 0.04 0.00 0.00 61.00 61.61 1yq2 s PRO 796 Cb -0.01 -1.66 0.11 0.00 0.04 0.00 0.00 34.50 32.98 1yq2 s PRO 796 CO -0.01 -3.11 1.10 -1.54 0.04 0.00 0.00 177.00 173.48 1yq2 s SER 797 N -3.06 3.61 0.25 6.66 1.04 -1.26 -4.90 113.70 116.04 1yq2 s SER 797 Ca 0.66 1.85 -0.06 0.00 0.48 0.00 0.00 55.95 58.89 1yq2 s SER 797 Cb -0.21 -2.46 0.25 0.00 0.10 0.00 0.00 66.02 63.71 1yq2 s SER 797 CO 0.60 -2.61 1.91 0.28 0.98 0.00 0.00 173.24 174.40 1yq2 h SER 798 N -1.53 1.15 -0.72 7.02 0.02 -1.62 -2.58 113.55 115.28 1yq2 h SER 798 Ca -0.46 -0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.41 1yq2 h SER 798 Cb 1.26 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 63.48 1yq2 h SER 798 CO 0.49 0.85 0.31 -0.08 -1.14 0.00 0.00 176.83 177.26 1yq2 h GLU 799 N 1.33 1.08 -0.32 3.45 4.81 -1.47 -1.33 114.58 122.13 1yq2 h GLU 799 Ca 0.35 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1yq2 h GLU 799 Cb -0.11 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.07 1yq2 h GLU 799 CO -0.07 0.87 0.19 0.00 -0.73 0.00 0.00 179.01 179.27 1yq2 h ALA 800 N 1.27 0.41 -0.08 2.92 0.00 -1.75 -0.98 119.26 121.06 1yq2 h ALA 800 Ca 0.25 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 1yq2 h ALA 800 Cb 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1yq2 h ALA 800 CO -0.02 -0.08 -0.56 -0.39 0.00 0.00 0.00 179.25 178.20 1yq2 h VAL 801 N 0.41 1.37 -0.16 0.00 -1.51 -1.18 -1.79 116.25 113.39 1yq2 h VAL 801 Ca 0.12 -1.89 -0.03 0.00 -1.23 0.00 0.00 66.70 63.67 1yq2 h VAL 801 Cb 0.03 1.94 -0.01 0.00 -2.13 0.00 0.00 31.29 31.12 1yq2 h VAL 801 CO -0.02 0.56 -0.01 -0.50 -1.23 0.00 0.00 177.57 176.36 1yq2 h TRP 802 N 0.18 0.32 -0.80 5.19 6.55 -1.08 -1.30 115.95 125.01 1yq2 h TRP 802 Ca -0.00 -0.06 -0.03 0.00 0.95 0.00 0.00 58.89 59.75 1yq2 h TRP 802 Cb 1.05 -0.08 -0.04 0.00 -0.86 0.00 0.00 29.16 29.23 1yq2 h TRP 802 CO 0.02 0.53 0.40 0.87 -1.05 0.00 0.00 178.44 179.21 1yq2 h LYS 803 N 0.01 1.15 -0.52 0.49 1.79 -1.17 -1.37 116.57 116.95 1yq2 h LYS 803 Ca 0.04 -0.16 -0.06 0.00 -2.18 0.00 0.00 60.65 58.30 1yq2 h LYS 803 Cb 0.41 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 30.83 1yq2 h LYS 803 CO 0.01 0.88 0.10 0.37 -1.08 0.00 0.00 179.45 179.73 1yq2 h GLN 804 N 1.13 0.81 0.00 3.15 5.75 -1.22 -1.39 115.11 123.35 1yq2 h GLN 804 Ca 0.28 -0.18 0.00 0.00 -0.15 0.00 0.00 58.65 58.60 1yq2 h GLN 804 Cb 0.10 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.53 1yq2 h GLN 804 CO -0.04 0.76 0.00 0.00 -2.65 0.00 0.00 178.83 176.90 1yq2 n ALA 805 N -2.47 1.97 -1.53 3.38 0.00 -0.50 -4.93 120.51 116.44 1yq2 n ALA 805 Ca 0.03 -0.08 -0.08 0.00 0.00 0.00 0.00 53.44 53.31 1yq2 n ALA 805 Cb 0.24 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.34 1yq2 n ALA 805 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 806 N 0.52 0.70 0.27 0.00 0.00 -0.52 -4.78 105.19 101.38 1yq2 n GLY 806 Ca 0.07 -0.63 0.12 0.00 0.00 0.00 0.00 46.02 45.58 1yq2 n GLY 806 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1yq2 h LEU 807 N 0.00 0.00 0.00 0.99 3.38 -1.51 -1.34 115.31 116.84 1yq2 h LEU 807 Ca -0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1yq2 h LEU 807 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1yq2 h LEU 807 CO 0.24 0.07 0.00 -0.90 0.09 0.00 0.00 178.44 177.94 1yq2 n ASP 808 N -3.91 0.00 -2.71 -0.43 5.75 -1.26 -3.87 116.55 110.12 1yq2 n ASP 808 Ca -0.03 -0.05 -0.07 0.00 -0.01 0.00 0.00 54.79 54.64 1yq2 n ASP 808 Cb 0.16 -0.29 0.04 0.00 -1.03 0.00 0.00 41.12 39.99 1yq2 n ASP 808 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1yq2 n ARG 809 N -1.29 1.44 -2.12 0.11 1.85 -0.51 -4.93 116.66 111.21 1yq2 n ARG 809 Ca 0.12 -3.39 -0.41 0.00 -1.00 0.00 0.00 57.85 53.17 1yq2 n ARG 809 Cb 0.21 -1.41 -0.02 0.00 -1.05 0.00 0.00 32.46 30.18 1yq2 n ARG 809 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1yq2 s LEU 810 N -3.38 4.41 0.09 2.89 1.43 -1.22 -4.38 118.68 118.52 1yq2 s LEU 810 Ca 0.28 2.68 0.04 0.00 -1.03 0.00 0.00 54.13 56.09 1yq2 s LEU 810 Cb 0.41 -3.68 -0.04 0.00 0.03 0.00 0.00 46.19 42.91 1yq2 s LEU 810 CO 0.01 -0.56 0.06 0.42 0.23 0.00 0.00 176.35 176.50 1yq2 s THR 811 N -1.16 4.35 -0.21 5.49 -4.23 0.58 -4.89 115.64 115.56 1yq2 s THR 811 Ca 0.50 -0.87 -0.06 0.00 -1.18 0.00 0.00 61.69 60.08 1yq2 s THR 811 Cb -0.39 -3.10 -0.02 0.00 1.34 0.00 0.00 72.50 70.32 1yq2 s THR 811 CO 0.52 0.10 0.02 -0.60 -0.54 0.00 0.00 174.62 174.12 1yq2 s ARG 812 N -2.42 3.62 -0.12 3.99 3.52 -1.26 -2.13 118.95 124.15 1yq2 s ARG 812 Ca 0.28 -0.51 0.03 0.00 -0.13 0.00 0.00 55.73 55.40 1yq2 s ARG 812 Cb -0.12 -3.14 0.00 0.00 -1.56 0.00 0.00 34.95 30.14 1yq2 s ARG 812 CO 0.21 -0.04 -0.23 0.50 -0.81 0.00 0.00 175.30 174.93 1yq2 s ARG 813 N 1.15 3.06 -0.16 5.12 3.52 0.39 -4.98 118.95 127.06 1yq2 s ARG 813 Ca 0.03 -0.86 -0.27 0.00 -0.13 0.00 0.00 55.73 54.50 1yq2 s ARG 813 Cb -0.14 -2.36 -0.01 0.00 -1.56 0.00 0.00 34.95 30.87 1yq2 s ARG 813 CO 0.02 0.11 0.93 0.08 -0.81 0.00 0.00 175.30 175.63 1yq2 s VAL 814 N 0.50 4.81 -0.15 7.11 1.01 -1.26 -0.62 120.40 131.81 1yq2 s VAL 814 Ca -0.14 1.84 -0.20 0.00 0.00 0.00 0.00 61.98 63.48 1yq2 s VAL 814 Cb -0.17 -4.23 -0.24 0.00 0.00 0.00 0.00 36.38 31.74 1yq2 s VAL 814 CO 0.05 -0.01 0.45 -0.33 0.00 0.00 0.00 175.10 175.26 1yq2 h GLU 815 N 7.26 0.11 -2.28 2.72 5.08 -0.92 -3.48 114.58 123.07 1yq2 h GLU 815 Ca -0.28 -0.19 0.06 0.00 -1.00 0.00 0.00 59.36 57.95 1yq2 h GLU 815 Cb 1.13 0.07 -0.16 0.00 0.50 0.00 0.00 28.75 30.28 1yq2 h GLU 815 CO 0.87 1.09 0.41 0.16 -1.00 0.00 0.00 179.01 180.53 1yq2 s ASP 816 N -6.83 -0.44 -0.03 1.42 -4.77 -1.03 -5.02 116.67 99.97 1yq2 s ASP 816 Ca -0.23 0.15 0.01 0.00 -3.30 0.00 0.00 52.55 49.18 1yq2 s ASP 816 Cb 0.04 0.44 0.01 0.00 -1.09 0.00 0.00 42.92 42.32 1yq2 s ASP 816 CO 0.69 -0.65 -0.05 -0.69 0.70 0.00 0.00 175.17 175.17 1yq2 s VAL 817 N -2.70 0.47 -0.02 2.11 1.01 -1.26 -1.12 120.40 118.89 1yq2 s VAL 817 Ca 0.01 -0.15 -0.13 0.00 0.00 0.00 0.00 61.98 61.71 1yq2 s VAL 817 Cb -0.01 -0.46 0.02 0.00 0.00 0.00 0.00 36.38 35.93 1yq2 s VAL 817 CO -0.06 0.18 0.27 0.00 0.00 0.00 0.00 175.10 175.49 1yq2 s ALA 818 N 0.49 -0.68 0.46 5.51 0.00 -0.53 -5.02 121.76 122.00 1yq2 s ALA 818 Ca -0.06 0.28 -0.23 0.00 0.00 0.00 0.00 51.96 51.95 1yq2 s ALA 818 Cb -0.10 0.02 -0.07 0.00 0.00 0.00 0.00 23.12 22.97 1yq2 s ALA 818 CO -0.00 -0.24 1.17 0.00 0.00 0.00 0.00 175.76 176.69 1yq2 s ALA 819 N -1.18 2.96 0.30 0.00 0.00 -1.25 -0.91 121.76 121.69 1yq2 s ALA 819 Ca -0.12 0.95 0.10 0.00 0.00 0.00 0.00 51.96 52.88 1yq2 s ALA 819 Cb -0.05 -3.39 -0.05 0.00 0.00 0.00 0.00 23.12 19.63 1yq2 s ALA 819 CO 0.03 -0.68 -0.02 -0.51 0.00 0.00 0.00 175.76 174.58 1yq2 s LEU 820 N -3.06 3.02 -0.04 0.00 1.43 0.33 -0.45 118.68 119.91 1yq2 s LEU 820 Ca 0.64 -0.86 -0.32 0.00 -1.03 0.00 0.00 54.13 52.56 1yq2 s LEU 820 Cb -0.29 -1.47 -0.10 0.00 0.03 0.00 0.00 46.19 44.36 1yq2 s LEU 820 CO 0.35 -0.11 1.97 -2.65 0.23 0.00 0.00 176.35 176.13 1yq2 n PRO 821 N -0.90 2.50 -4.00 1.29 -0.02 -1.26 -1.70 135.00 130.91 1yq2 n PRO 821 Ca -0.05 0.90 -0.32 0.00 -2.02 0.00 0.00 63.50 62.01 1yq2 n PRO 821 Cb 0.61 -2.88 0.01 0.00 -0.02 0.00 0.00 33.50 31.22 1yq2 n PRO 821 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1yq2 n ASP 822 N 7.61 -4.02 -0.93 2.55 9.92 -1.26 -4.81 116.55 125.61 1yq2 n ASP 822 Ca 0.22 -0.86 0.00 0.00 -0.53 0.00 0.00 54.79 53.62 1yq2 n ASP 822 Cb 0.36 -3.52 0.00 0.00 -0.64 0.00 0.00 41.12 37.33 1yq2 n ASP 822 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1yq2 n GLY 823 N -1.61 0.97 3.15 0.44 0.00 -0.69 -0.60 105.19 106.85 1yq2 n GLY 823 Ca 0.02 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 45.06 1yq2 n GLY 823 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yq2 s ILE 824 N -2.34 -0.01 -0.13 -0.61 1.01 -0.21 -0.51 121.20 118.40 1yq2 s ILE 824 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.68 1yq2 s ILE 824 Cb 0.00 -0.40 -0.01 0.00 0.01 0.00 0.00 42.46 42.05 1yq2 s ILE 824 CO 0.00 0.01 -0.14 -0.60 0.00 0.00 0.00 174.94 174.21 1yq2 s ARG 825 N 0.42 3.34 -0.12 2.79 3.52 -0.09 -0.87 118.95 127.95 1yq2 s ARG 825 Ca -0.02 -0.71 0.02 0.00 -0.13 0.00 0.00 55.73 54.89 1yq2 s ARG 825 Cb -0.04 -2.61 0.01 0.00 -1.56 0.00 0.00 34.95 30.76 1yq2 s ARG 825 CO -0.02 0.18 -0.17 0.08 -0.81 0.00 0.00 175.30 174.56 1yq2 s VAL 826 N 0.42 1.69 -0.18 7.11 1.01 -0.30 -1.45 120.40 128.70 1yq2 s VAL 826 Ca -0.11 -0.75 -0.04 0.00 0.00 0.00 0.00 61.98 61.08 1yq2 s VAL 826 Cb -0.16 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 34.67 1yq2 s VAL 826 CO 0.05 0.48 -0.03 -0.13 0.00 0.00 0.00 175.10 175.47 1yq2 s ARG 827 N 0.99 3.61 0.22 2.72 0.52 -0.27 -0.75 118.95 125.99 1yq2 s ARG 827 Ca -0.05 -0.54 0.04 0.00 -0.52 0.00 0.00 55.73 54.66 1yq2 s ARG 827 Cb -0.15 -2.97 -0.05 0.00 0.52 0.00 0.00 34.95 32.30 1yq2 s ARG 827 CO -0.03 0.12 -0.03 0.95 0.02 0.00 0.00 175.30 176.33 1yq2 s THR 828 N 0.70 1.15 -0.02 0.02 -4.23 0.27 -0.21 115.64 113.32 1yq2 s THR 828 Ca -0.02 -2.05 0.01 0.00 -1.18 0.00 0.00 61.69 58.45 1yq2 s THR 828 Cb -0.14 -2.26 0.02 0.00 1.34 0.00 0.00 72.50 71.45 1yq2 s THR 828 CO 0.02 -0.40 -0.01 -0.60 -0.54 0.00 0.00 174.62 173.09 1yq2 s ARG 829 N -3.82 0.32 -0.05 3.99 6.06 0.21 -0.68 118.95 124.99 1yq2 s ARG 829 Ca 0.26 0.02 0.04 0.00 -2.50 0.00 0.00 55.73 53.56 1yq2 s ARG 829 Cb 0.05 -0.45 -0.02 0.00 0.06 0.00 0.00 34.95 34.58 1yq2 s ARG 829 CO 0.08 -0.09 -0.17 0.71 -2.50 0.00 0.00 175.30 173.33 1yq2 s TYR 830 N 0.78 2.62 -0.16 5.12 2.02 -0.25 -0.46 117.35 127.02 1yq2 s TYR 830 Ca -0.08 -0.26 -0.30 0.00 -0.37 0.00 0.00 57.07 56.07 1yq2 s TYR 830 Cb -0.11 -1.61 0.12 0.00 -0.40 0.00 0.00 41.96 39.96 1yq2 s TYR 830 CO -0.01 0.11 0.96 0.00 -1.57 0.00 0.00 175.55 175.04 1yq2 s ALA 831 N -0.64 -1.92 0.36 3.71 0.00 -0.90 -0.97 121.76 121.40 1yq2 s ALA 831 Ca 0.10 1.58 -0.18 0.00 0.00 0.00 0.00 51.96 53.46 1yq2 s ALA 831 Cb -0.11 -0.69 -0.10 0.00 0.00 0.00 0.00 23.12 22.22 1yq2 s ALA 831 CO 0.00 -0.31 0.82 0.00 0.00 0.00 0.00 175.76 176.28 1yq2 s ALA 832 N -1.01 3.21 0.20 0.00 0.00 -1.26 -0.31 121.76 122.60 1yq2 s ALA 832 Ca -0.02 0.19 -0.32 0.00 0.00 0.00 0.00 51.96 51.81 1yq2 s ALA 832 Cb -0.01 -2.92 -0.15 0.00 0.00 0.00 0.00 23.12 20.04 1yq2 s ALA 832 CO 0.02 0.25 1.22 0.00 0.00 0.00 0.00 175.76 177.25 1yq2 n ALA 833 N -0.45 -0.18 -1.08 0.00 0.00 -1.26 -1.95 120.51 115.60 1yq2 n ALA 833 Ca 0.05 0.44 -0.03 0.00 0.00 0.00 0.00 53.44 53.90 1yq2 n ALA 833 Cb 0.53 -2.10 -0.01 0.00 0.00 0.00 0.00 19.45 17.88 1yq2 n ALA 833 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1yq2 n ASP 834 N 1.97 -4.27 -4.71 0.00 4.64 -1.26 -4.99 116.55 107.93 1yq2 n ASP 834 Ca 0.13 0.06 -0.30 0.00 -1.38 0.00 0.00 54.79 53.30 1yq2 n ASP 834 Cb 0.27 -1.99 -0.08 0.00 -1.04 0.00 0.00 41.12 38.28 1yq2 n ASP 834 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 1yq2 s SER 835 N -2.25 5.18 0.00 1.67 0.15 -0.82 -5.02 113.70 112.61 1yq2 s SER 835 Ca 0.00 -0.11 0.23 0.00 0.70 0.00 0.00 55.95 56.77 1yq2 s SER 835 Cb 0.00 -1.29 0.12 0.00 -1.71 0.00 0.00 66.02 63.13 1yq2 s SER 835 CO 0.00 0.18 1.14 0.35 1.20 0.00 0.00 173.24 176.11 1yq2 n THR 836 N 0.61 0.00 -3.62 6.45 -2.24 -1.26 -4.83 114.28 109.39 1yq2 n THR 836 Ca -0.10 -0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.39 1yq2 n THR 836 Cb 0.52 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 1yq2 n THR 836 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1yq2 s HIS 837 N -3.00 3.48 0.27 4.78 3.76 -1.26 -5.01 115.29 118.31 1yq2 s HIS 837 Ca 0.09 0.41 -0.15 0.00 -0.15 0.00 0.00 55.06 55.27 1yq2 s HIS 837 Cb 0.17 -1.91 0.01 0.00 1.11 0.00 0.00 32.58 31.95 1yq2 s HIS 837 CO 0.79 0.34 0.57 -1.54 -0.85 0.00 0.00 174.74 174.04 1yq2 s SER 838 N -3.15 -0.06 -0.07 1.40 1.04 -1.26 -4.53 113.70 107.07 1yq2 s SER 838 Ca 0.40 -0.90 -0.02 0.00 0.48 0.00 0.00 55.95 55.91 1yq2 s SER 838 Cb -0.11 0.65 0.03 0.00 0.10 0.00 0.00 66.02 66.69 1yq2 s SER 838 CO 0.29 -1.25 0.02 -0.69 0.98 0.00 0.00 173.24 172.59 1yq2 s VAL 839 N -3.78 0.26 0.27 5.02 1.01 -0.14 -0.69 120.40 122.35 1yq2 s VAL 839 Ca 0.19 0.14 -0.24 0.00 0.00 0.00 0.00 61.98 62.08 1yq2 s VAL 839 Cb -0.02 -0.48 -0.09 0.00 0.00 0.00 0.00 36.38 35.79 1yq2 s VAL 839 CO 0.10 0.20 0.86 0.00 0.00 0.00 0.00 175.10 176.26 1yq2 s ALA 840 N 2.02 3.30 -0.02 5.51 0.00 -0.72 -1.09 121.76 130.75 1yq2 s ALA 840 Ca 0.05 0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.43 1yq2 s ALA 840 Cb -0.13 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1yq2 s ALA 840 CO -0.05 0.23 -0.08 0.08 0.00 0.00 0.00 175.76 175.94 1yq2 s VAL 841 N -1.52 0.69 -0.08 0.00 1.01 0.15 -0.85 120.40 119.80 1yq2 s VAL 841 Ca 0.46 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 62.14 1yq2 s VAL 841 Cb -0.19 -0.62 0.01 0.00 0.00 0.00 0.00 36.38 35.59 1yq2 s VAL 841 CO 0.24 0.22 -0.13 -0.70 0.00 0.00 0.00 175.10 174.73 1yq2 s GLU 842 N 0.17 1.86 -0.18 2.72 2.12 -0.43 -0.56 118.70 124.39 1yq2 s GLU 842 Ca -0.02 -0.45 -0.04 0.00 0.36 0.00 0.00 54.97 54.82 1yq2 s GLU 842 Cb -0.08 -1.58 -0.02 0.00 0.26 0.00 0.00 34.13 32.71 1yq2 s GLU 842 CO 0.00 -0.02 -0.03 -1.21 -0.54 0.00 0.00 175.26 173.47 1yq2 s GLU 843 N 0.84 3.60 -0.35 4.30 2.02 0.07 -0.92 118.70 128.27 1yq2 s GLU 843 Ca -0.11 -0.54 -0.00 0.00 0.02 0.00 0.00 54.97 54.34 1yq2 s GLU 843 Cb -0.15 -2.98 0.09 0.00 0.10 0.00 0.00 34.13 31.18 1yq2 s GLU 843 CO 0.01 0.09 0.08 -0.80 0.02 0.00 0.00 175.26 174.67 1yq2 s ASN 844 N 0.76 4.96 -0.24 -0.19 0.01 0.41 -1.15 114.94 119.50 1yq2 s ASN 844 Ca -0.01 -1.82 -0.18 0.00 -0.71 0.00 0.00 52.86 50.14 1yq2 s ASN 844 Cb -0.14 -1.72 -0.03 0.00 0.41 0.00 0.00 41.25 39.77 1yq2 s ASN 844 CO 0.02 -0.40 0.51 0.26 -1.51 0.00 0.00 177.10 175.98 1yq2 s TRP 845 N 1.10 3.30 -0.00 2.20 0.52 -0.05 -1.32 118.94 124.69 1yq2 s TRP 845 Ca 0.04 0.67 0.00 0.00 0.02 0.00 0.00 56.10 56.83 1yq2 s TRP 845 Cb -0.21 -2.70 0.00 0.00 -1.15 0.00 0.00 33.47 29.42 1yq2 s TRP 845 CO -0.05 -0.22 -0.00 -0.65 0.02 0.00 0.00 176.95 176.06 1yq2 s GLN 846 N 2.07 0.04 -0.13 4.98 -0.21 0.09 -1.05 119.66 125.46 1yq2 s GLN 846 Ca 0.22 0.00 -0.25 0.00 0.02 0.00 0.00 55.36 55.35 1yq2 s GLN 846 Cb -0.16 -0.06 -0.02 0.00 1.00 0.00 0.00 33.01 33.77 1yq2 s GLN 846 CO 0.09 -0.01 0.79 -0.51 -2.12 0.00 0.00 175.29 173.53 1yq2 s LEU 847 N 0.11 4.23 -0.23 2.90 1.43 0.23 -0.33 118.68 127.01 1yq2 s LEU 847 Ca -0.01 1.19 -0.02 0.00 -1.03 0.00 0.00 54.13 54.26 1yq2 s LEU 847 Cb -0.02 -3.19 0.07 0.00 0.03 0.00 0.00 46.19 43.09 1yq2 s LEU 847 CO -0.00 -0.29 0.05 -0.62 0.23 0.00 0.00 176.35 175.71 1yq2 s ASP 848 N 1.04 3.32 -1.28 2.29 -1.08 0.08 -4.81 116.67 116.23 1yq2 s ASP 848 Ca 0.38 -1.09 -0.01 0.00 -0.52 0.00 0.00 52.55 51.32 1yq2 s ASP 848 Cb -0.17 -0.71 0.00 0.00 -1.46 0.00 0.00 42.92 40.58 1yq2 s ASP 848 CO 0.15 -0.33 0.83 0.61 0.52 0.00 0.00 175.17 176.95 1yq2 n GLY 849 N 4.97 -0.33 3.81 2.66 0.00 -1.26 -2.33 105.19 112.70 1yq2 n GLY 849 Ca -0.07 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1yq2 n GLY 849 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yq2 n GLY 850 N -1.44 2.30 3.80 -0.02 0.00 -1.26 -4.99 105.19 103.58 1yq2 n GLY 850 Ca -0.27 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 1yq2 n GLY 850 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yq2 s GLU 851 N 0.00 4.28 -0.38 1.61 2.02 -0.99 -4.92 118.70 120.32 1yq2 s GLU 851 Ca 0.00 0.81 -0.27 0.00 0.02 0.00 0.00 54.97 55.53 1yq2 s GLU 851 Cb 0.00 -3.26 0.02 0.00 0.10 0.00 0.00 34.13 30.99 1yq2 s GLU 851 CO 0.00 0.58 0.97 -1.17 0.02 0.00 0.00 175.26 175.67 1yq2 s LEU 852 N -0.96 3.94 -0.07 1.80 2.96 -1.26 -0.75 118.68 124.35 1yq2 s LEU 852 Ca 0.30 0.60 -0.03 0.00 -0.22 0.00 0.00 54.13 54.78 1yq2 s LEU 852 Cb -0.20 -3.33 -0.04 0.00 0.50 0.00 0.00 46.19 43.12 1yq2 s LEU 852 CO 0.20 -0.92 0.08 0.00 -1.32 0.00 0.00 176.35 174.38 1yq2 s LEU 854 N -1.19 0.79 -0.19 0.00 2.96 0.05 -0.73 118.68 120.37 1yq2 s LEU 854 Ca 0.17 -0.60 -0.08 0.00 -0.22 0.00 0.00 54.13 53.40 1yq2 s LEU 854 Cb -0.12 -0.44 -0.04 0.00 0.50 0.00 0.00 46.19 46.09 1yq2 s LEU 854 CO 0.06 -0.30 0.09 -0.60 -1.32 0.00 0.00 176.35 174.28 1yq2 s ARG 855 N 1.97 4.04 -0.20 1.98 3.52 -0.43 -0.97 118.95 128.86 1yq2 s ARG 855 Ca 0.01 -0.30 0.01 0.00 -0.13 0.00 0.00 55.73 55.32 1yq2 s ARG 855 Cb -0.16 -3.29 0.04 0.00 -1.56 0.00 0.00 34.95 29.98 1yq2 s ARG 855 CO -0.08 0.27 -0.13 0.42 -0.81 0.00 0.00 175.30 174.98 1yq2 s ILE 856 N 0.39 1.85 -0.21 4.11 1.01 -0.29 -0.44 121.20 127.62 1yq2 s ILE 856 Ca 0.05 -1.10 -0.07 0.00 0.00 0.00 0.00 60.65 59.53 1yq2 s ILE 856 Cb -0.12 -1.85 -0.03 0.00 0.01 0.00 0.00 42.46 40.46 1yq2 s ILE 856 CO -0.00 0.24 0.04 -1.81 0.00 0.00 0.00 174.94 173.41 1yq2 s ASP 857 N 1.31 5.21 -0.22 3.58 1.01 -0.09 -0.64 116.67 126.83 1yq2 s ASP 857 Ca -0.01 -0.10 -0.02 0.00 0.71 0.00 0.00 52.55 53.13 1yq2 s ASP 857 Cb -0.16 -1.90 0.01 0.00 1.01 0.00 0.00 42.92 41.88 1yq2 s ASP 857 CO -0.09 0.08 -0.09 -0.63 0.21 0.00 0.00 175.17 174.65 1yq2 s ILE 858 N 0.94 2.87 -0.38 0.77 1.01 0.24 -1.32 121.20 125.33 1yq2 s ILE 858 Ca 0.03 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 59.92 1yq2 s ILE 858 Cb -0.14 -2.33 0.12 0.00 0.01 0.00 0.00 42.46 40.12 1yq2 s ILE 858 CO 0.02 0.39 0.17 0.42 0.00 0.00 0.00 174.94 175.95 1yq2 s THR 859 N 1.38 1.12 0.68 2.92 -4.23 -0.03 -2.00 115.64 115.49 1yq2 s THR 859 Ca 0.04 -2.02 -0.16 0.00 -1.18 0.00 0.00 61.69 58.37 1yq2 s THR 859 Cb -0.15 -1.81 0.01 0.00 1.34 0.00 0.00 72.50 71.89 1yq2 s THR 859 CO -0.06 -0.81 1.19 -2.84 -0.54 0.00 0.00 174.62 171.56 1yq2 s PRO 860 N 0.93 2.46 1.12 3.99 0.02 -1.26 -1.76 135.00 140.51 1yq2 s PRO 860 Ca 0.14 1.72 -0.13 0.00 0.02 0.00 0.00 61.00 62.75 1yq2 s PRO 860 Cb -0.21 -1.88 0.26 0.00 0.02 0.00 0.00 34.50 32.69 1yq2 s PRO 860 CO -0.10 -1.58 1.05 -1.54 -0.33 0.00 0.00 177.00 174.50 1yq2 s SER 861 N -2.01 1.43 0.34 2.53 1.04 0.14 -4.88 113.70 112.29 1yq2 s SER 861 Ca 0.74 1.31 0.15 0.00 0.48 0.00 0.00 55.95 58.63 1yq2 s SER 861 Cb -0.28 -2.04 0.61 0.00 0.10 0.00 0.00 66.02 64.41 1yq2 s SER 861 CO 0.42 -3.89 1.73 0.00 0.98 0.00 0.00 173.24 172.47 1yq2 h ALA 862 N -2.41 1.09 0.00 5.32 0.00 -1.96 -3.38 119.26 117.91 1yq2 h ALA 862 Ca -0.59 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 53.91 1yq2 h ALA 862 Cb 1.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1yq2 h ALA 862 CO 0.53 0.56 0.00 0.41 0.00 0.00 0.00 179.25 180.75 1yq2 n GLY 863 N 0.04 -1.00 3.68 0.00 0.00 -1.26 -4.88 105.19 101.77 1yq2 n GLY 863 Ca -0.01 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 1yq2 n GLY 863 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1yq2 s TRP 864 N -2.52 2.94 -0.40 1.61 0.52 -1.26 -4.93 118.94 114.90 1yq2 s TRP 864 Ca 0.23 1.02 0.11 0.00 0.02 0.00 0.00 56.10 57.47 1yq2 s TRP 864 Cb 0.15 -3.52 0.35 0.00 -1.15 0.00 0.00 33.47 29.31 1yq2 s TRP 864 CO 0.33 -1.77 0.78 -1.71 0.02 0.00 0.00 176.95 174.60 1yq2 n ASN 865 N 5.88 1.49 -3.64 2.95 5.15 -1.26 -4.84 115.26 120.99 1yq2 n ASN 865 Ca 0.13 -3.11 -0.12 0.00 -0.60 0.00 0.00 54.58 50.88 1yq2 n ASN 865 Cb 0.45 -0.60 -0.05 0.00 -0.53 0.00 0.00 39.78 39.04 1yq2 n ASN 865 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 1yq2 s LEU 866 N -2.64 0.35 0.21 1.20 2.34 -1.26 -5.13 118.68 113.74 1yq2 s LEU 866 Ca 0.41 -0.12 -0.32 0.00 0.06 0.00 0.00 54.13 54.16 1yq2 s LEU 866 Cb 0.34 1.83 -0.14 0.00 -0.56 0.00 0.00 46.19 47.66 1yq2 s LEU 866 CO -0.09 -0.75 1.42 0.52 -1.06 0.00 0.00 176.35 176.39 1yq2 n VAL 867 N 0.18 0.68 -3.87 1.48 0.31 -1.26 -4.20 118.33 111.66 1yq2 n VAL 867 Ca -0.17 -0.17 -0.36 0.00 -0.01 0.00 0.00 64.34 63.63 1yq2 n VAL 867 Cb 0.62 -1.39 -0.06 0.00 -0.91 0.00 0.00 33.84 32.10 1yq2 n VAL 867 CO 0.00 0.00 0.00 0.26 -1.32 0.00 0.00 176.83 175.77 1yq2 s TRP 868 N 0.17 3.58 0.12 3.52 0.51 -0.81 -4.90 118.94 121.13 1yq2 s TRP 868 Ca 0.72 0.49 -0.13 0.00 -2.12 0.00 0.00 56.10 55.06 1yq2 s TRP 868 Cb -0.69 -1.92 -0.08 0.00 -0.81 0.00 0.00 33.47 29.97 1yq2 s TRP 868 CO 0.47 0.69 1.42 -1.35 -0.51 0.00 0.00 176.95 177.67 1yq2 h PRO 869 N 4.48 0.83 -3.07 4.98 0.11 -1.88 -3.40 132.00 134.04 1yq2 h PRO 869 Ca -0.52 -0.49 0.01 0.00 0.11 0.00 0.00 66.00 65.12 1yq2 h PRO 869 Cb 1.21 0.04 -0.09 0.00 0.11 0.00 0.00 31.00 32.27 1yq2 h PRO 869 CO 0.63 1.12 0.17 -0.98 -0.21 0.00 0.00 178.00 178.73 1yq2 s ARG 870 N -4.24 1.50 -0.20 1.05 1.70 -1.13 -0.95 118.95 116.68 1yq2 s ARG 870 Ca -0.11 -0.76 -0.01 0.00 -0.47 0.00 0.00 55.73 54.37 1yq2 s ARG 870 Cb 0.10 0.58 0.06 0.00 -0.57 0.00 0.00 34.95 35.12 1yq2 s ARG 870 CO 0.87 -0.67 -0.00 0.42 -1.08 0.00 0.00 175.30 174.84 1yq2 s ILE 871 N -3.84 0.92 0.26 4.99 1.01 -0.30 -4.40 121.20 119.84 1yq2 s ILE 871 Ca 0.07 -0.78 -0.10 0.00 0.00 0.00 0.00 60.65 59.84 1yq2 s ILE 871 Cb -0.03 -1.31 0.04 0.00 0.01 0.00 0.00 42.46 41.17 1yq2 s ILE 871 CO -0.03 -0.13 0.52 0.61 0.00 0.00 0.00 174.94 175.91 1yq2 n GLY 872 N 4.90 1.33 3.25 6.18 0.00 -0.96 0.82 105.19 120.71 1yq2 n GLY 872 Ca -0.10 -1.17 -0.24 0.00 0.00 0.00 0.00 46.02 44.51 1yq2 n GLY 872 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yq2 s VAL 873 N -2.41 1.58 -0.08 1.61 -7.23 -0.12 -1.06 120.40 112.69 1yq2 s VAL 873 Ca 0.10 -1.35 -0.00 0.00 -1.81 0.00 0.00 61.98 58.92 1yq2 s VAL 873 Cb -0.03 -1.42 -0.03 0.00 0.56 0.00 0.00 36.38 35.46 1yq2 s VAL 873 CO 0.08 0.02 -0.06 -0.60 -0.31 0.00 0.00 175.10 174.23 1yq2 s ARG 874 N -1.57 2.89 -0.08 4.82 3.52 0.84 -0.32 118.95 129.05 1yq2 s ARG 874 Ca 0.05 -0.53 0.04 0.00 -0.13 0.00 0.00 55.73 55.16 1yq2 s ARG 874 Cb -0.09 -2.65 -0.02 0.00 -1.56 0.00 0.00 34.95 30.63 1yq2 s ARG 874 CO 0.03 0.62 -0.19 -1.58 -0.81 0.00 0.00 175.30 173.37 1yq2 s TRP 875 N -0.67 2.61 -0.26 5.12 0.52 0.11 -1.00 118.94 125.37 1yq2 s TRP 875 Ca 0.10 -0.55 -0.10 0.00 0.02 0.00 0.00 56.10 55.57 1yq2 s TRP 875 Cb -0.11 -1.67 -0.05 0.00 -1.15 0.00 0.00 33.47 30.48 1yq2 s TRP 875 CO 0.02 -0.10 0.16 -0.51 0.02 0.00 0.00 176.95 176.54 1yq2 s ASP 876 N -0.18 5.98 0.29 2.95 1.11 0.24 -1.51 116.67 125.55 1yq2 s ASP 876 Ca -0.02 0.03 0.07 0.00 0.18 0.00 0.00 52.55 52.82 1yq2 s ASP 876 Cb -0.13 -2.09 -0.06 0.00 1.07 0.00 0.00 42.92 41.70 1yq2 s ASP 876 CO 0.03 0.01 -0.06 -0.76 1.18 0.00 0.00 175.17 175.57 1yq2 s LEU 877 N 1.40 2.52 0.71 1.23 1.43 0.12 -1.86 118.68 124.22 1yq2 s LEU 877 Ca 0.07 -1.20 -0.16 0.00 -1.03 0.00 0.00 54.13 51.81 1yq2 s LEU 877 Cb -0.15 -0.69 0.02 0.00 0.03 0.00 0.00 46.19 45.40 1yq2 s LEU 877 CO 0.07 -0.32 1.24 -2.84 0.23 0.00 0.00 176.35 174.73 1yq2 s PRO 878 N -3.71 2.24 0.61 1.29 0.02 -1.26 -1.46 135.00 132.74 1yq2 s PRO 878 Ca 0.30 1.88 0.39 0.00 0.02 0.00 0.00 61.00 63.59 1yq2 s PRO 878 Cb 0.04 -1.83 1.98 0.00 0.02 0.00 0.00 34.50 34.70 1yq2 s PRO 878 CO 0.13 -1.79 2.22 1.79 -0.33 0.00 0.00 177.00 179.02 1yq2 h THR 879 N -0.03 0.07 0.00 0.99 1.35 -1.84 -2.30 112.91 111.15 1yq2 h THR 879 Ca -0.49 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 1yq2 h THR 879 Cb 1.31 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.93 1yq2 h THR 879 CO 0.51 0.01 0.00 -0.90 -0.25 0.00 0.00 175.52 174.89 1yq2 n ASP 880 N -3.16 0.00 -4.59 5.36 5.68 -1.26 -4.58 116.55 113.99 1yq2 n ASP 880 Ca -0.02 -0.59 -0.42 0.00 -0.50 0.00 0.00 54.79 53.26 1yq2 n ASP 880 Cb 0.16 -0.12 -0.02 0.00 -1.14 0.00 0.00 41.12 40.00 1yq2 n ASP 880 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1yq2 s VAL 881 N -2.25 3.74 -0.01 2.12 1.01 -0.87 -1.25 120.40 122.89 1yq2 s VAL 881 Ca 0.38 0.70 0.02 0.00 0.00 0.00 0.00 61.98 63.08 1yq2 s VAL 881 Cb 0.20 -4.13 0.03 0.00 0.00 0.00 0.00 36.38 32.48 1yq2 s VAL 881 CO 0.39 -0.81 0.80 -0.90 0.00 0.00 0.00 175.10 174.57 1yq2 n ASP 882 N 9.66 0.82 -3.62 3.32 3.85 -0.56 -4.83 116.55 125.18 1yq2 n ASP 882 Ca 0.17 -1.68 -0.02 0.00 -0.71 0.00 0.00 54.79 52.56 1yq2 n ASP 882 Cb 0.48 -0.08 -0.01 0.00 -1.35 0.00 0.00 41.12 40.16 1yq2 n ASP 882 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 1yq2 s GLY 883 N -0.76 -0.36 0.02 6.12 0.00 -1.23 -2.10 107.32 109.02 1yq2 s GLY 883 Ca 0.03 0.92 -0.08 0.00 0.00 0.00 0.00 44.72 45.59 1yq2 s GLY 883 CO 0.00 0.25 0.16 0.00 0.00 0.00 0.00 173.10 173.52 1yq2 s ALA 884 N -2.60 -0.34 0.14 3.20 0.00 0.06 -1.21 121.76 121.00 1yq2 s ALA 884 Ca 0.12 -0.20 0.11 0.00 0.00 0.00 0.00 51.96 51.99 1yq2 s ALA 884 Cb 0.02 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.27 1yq2 s ALA 884 CO -0.04 -0.27 -0.26 0.00 0.00 0.00 0.00 175.76 175.19 1yq2 s ALA 885 N -1.90 2.37 0.12 0.00 0.00 -0.07 -0.56 121.76 121.72 1yq2 s ALA 885 Ca -0.10 -1.48 -0.20 0.00 0.00 0.00 0.00 51.96 50.18 1yq2 s ALA 885 Cb -0.05 -0.37 0.05 0.00 0.00 0.00 0.00 23.12 22.76 1yq2 s ALA 885 CO -0.01 0.52 0.50 1.67 0.00 0.00 0.00 175.76 178.44 1yq2 s TRP 886 N -1.14 -0.38 -0.20 0.00 -2.14 -0.42 -0.33 118.94 114.33 1yq2 s TRP 886 Ca 0.14 0.19 -0.04 0.00 2.66 0.00 0.00 56.10 59.06 1yq2 s TRP 886 Cb -0.10 0.38 -0.02 0.00 -3.10 0.00 0.00 33.47 30.64 1yq2 s TRP 886 CO 0.06 -0.74 -0.03 0.12 -2.66 0.00 0.00 176.95 173.70 1yq2 s PHE 887 N -3.44 2.97 -5.00 1.66 5.36 -0.92 -1.08 117.98 117.54 1yq2 s PHE 887 Ca 0.00 -0.71 0.00 0.00 -0.96 0.00 0.00 56.93 55.26 1yq2 s PHE 887 Cb 0.00 -2.07 0.00 0.00 -0.34 0.00 0.00 43.02 40.61 1yq2 s PHE 887 CO -0.10 -0.39 0.00 0.41 -1.46 0.00 0.00 175.22 173.68 1yq2 n GLY 888 N 4.45 -0.41 3.75 13.12 0.00 -0.81 -0.75 105.19 124.55 1yq2 n GLY 888 Ca -0.18 -1.08 -0.40 0.00 0.00 0.00 0.00 46.02 44.35 1yq2 n GLY 888 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 889 N -1.00 3.40 0.00 4.61 0.00 -0.60 -2.21 121.76 125.96 1yq2 s ALA 889 Ca 0.00 0.88 0.00 0.00 0.00 0.00 0.00 51.96 52.84 1yq2 s ALA 889 Cb 0.00 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.78 1yq2 s ALA 889 CO 0.00 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 175.99 1yq2 n GLY 890 N 1.41 -1.16 0.14 0.00 0.00 -0.70 -4.28 105.19 100.60 1yq2 n GLY 890 Ca -0.00 -0.80 0.13 0.00 0.00 0.00 0.00 46.02 45.35 1yq2 n GLY 890 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yq2 h PRO 891 N 0.00 0.00 -6.80 1.61 0.13 -1.82 0.75 132.00 125.87 1yq2 h PRO 891 Ca 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.67 1yq2 h PRO 891 Cb 0.00 0.00 0.05 0.00 0.13 0.00 0.00 31.00 31.18 1yq2 h PRO 891 CO 0.00 0.00 -0.04 1.03 -0.23 0.00 0.00 178.00 178.76 1yq2 s ARG 892 N -3.14 2.23 0.53 0.86 0.52 -1.26 -4.97 118.95 113.72 1yq2 s ARG 892 Ca 0.09 -1.23 -0.23 0.00 -0.52 0.00 0.00 55.73 53.85 1yq2 s ARG 892 Cb 0.10 -2.53 -0.06 0.00 0.52 0.00 0.00 34.95 32.99 1yq2 s ARG 892 CO 0.62 -0.93 1.39 -1.83 0.02 0.00 0.00 175.30 174.57 1yq2 s GLU 893 N -4.79 3.24 0.02 3.54 -1.05 -1.26 -4.84 118.70 113.55 1yq2 s GLU 893 Ca 0.61 2.31 -0.06 0.00 -0.15 0.00 0.00 54.97 57.68 1yq2 s GLU 893 Cb -0.07 -2.34 -0.00 0.00 -0.44 0.00 0.00 34.13 31.27 1yq2 s GLU 893 CO 0.40 -1.14 0.12 -1.54 0.95 0.00 0.00 175.26 174.05 1yq2 s SER 894 N -0.82 0.11 0.12 0.83 1.04 -0.20 -4.98 113.70 109.80 1yq2 s SER 894 Ca 0.69 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.73 1yq2 s SER 894 Cb -0.42 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 65.88 1yq2 s SER 894 CO 0.51 -0.46 0.00 -0.31 0.98 0.00 0.00 173.24 173.96 1yq2 s TYR 895 N -2.12 0.89 0.35 5.02 1.51 -1.11 -4.44 117.35 117.45 1yq2 s TYR 895 Ca -0.09 -1.09 0.11 0.00 -1.01 0.00 0.00 57.07 54.99 1yq2 s TYR 895 Cb -0.04 -0.53 0.89 0.00 -0.11 0.00 0.00 41.96 42.17 1yq2 s TYR 895 CO -0.02 -0.34 1.81 -1.35 -1.11 0.00 0.00 175.55 174.53 1yq2 h PRO 896 N 2.90 0.60 -0.63 -1.71 0.11 -1.83 0.23 132.00 131.67 1yq2 h PRO 896 Ca -0.35 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1yq2 h PRO 896 Cb 1.18 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1yq2 h PRO 896 CO 0.62 0.40 0.00 -0.40 -0.21 0.00 0.00 178.00 178.41 1yq2 n ASP 897 N -4.65 3.54 -3.19 -2.05 5.75 -1.26 -4.55 116.55 110.15 1yq2 n ASP 897 Ca 0.22 -2.11 -0.24 0.00 -0.01 0.00 0.00 54.79 52.65 1yq2 n ASP 897 Cb 0.63 -0.45 -0.07 0.00 -1.03 0.00 0.00 41.12 40.20 1yq2 n ASP 897 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1yq2 n SER 898 N 1.20 0.18 -0.06 -1.12 2.88 0.82 -4.03 113.62 113.49 1yq2 n SER 898 Ca 0.21 -2.71 0.01 0.00 -1.33 0.00 0.00 58.87 55.05 1yq2 n SER 898 Cb 0.59 -0.62 -0.00 0.00 -0.75 0.00 0.00 64.21 63.43 1yq2 n SER 898 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1yq2 n MET 899 N 1.36 2.94 -0.12 -1.46 2.81 -1.23 -2.75 117.12 118.67 1yq2 n MET 899 Ca 0.21 -0.32 -0.02 0.00 -1.81 0.00 0.00 57.70 55.76 1yq2 n MET 899 Cb 0.54 -0.83 0.22 0.00 -0.71 0.00 0.00 33.22 32.43 1yq2 n MET 899 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1yq2 h HIS 900 N 0.27 0.82 -0.44 2.03 3.86 -1.93 -2.85 115.15 116.91 1yq2 h HIS 900 Ca 0.00 -0.06 -0.20 0.00 -1.16 0.00 0.00 60.37 58.95 1yq2 h HIS 900 Cb 0.09 -0.24 -0.12 0.00 1.06 0.00 0.00 27.41 28.20 1yq2 h HIS 900 CO 0.00 0.67 0.25 0.00 0.86 0.00 0.00 177.93 179.71 1yq2 n ALA 901 N -2.46 3.82 -2.71 2.45 0.00 -1.26 -4.87 120.51 115.48 1yq2 n ALA 901 Ca 0.04 -1.30 -0.28 0.00 0.00 0.00 0.00 53.44 51.91 1yq2 n ALA 901 Cb 0.20 -1.18 -0.07 0.00 0.00 0.00 0.00 19.45 18.40 1yq2 n ALA 901 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1yq2 s THR 902 N -1.64 4.06 0.01 0.00 -4.23 -1.08 -4.65 115.64 108.11 1yq2 s THR 902 Ca 0.27 -1.15 0.05 0.00 -1.18 0.00 0.00 61.69 59.69 1yq2 s THR 902 Cb 0.22 -3.01 -0.02 0.00 1.34 0.00 0.00 72.50 71.04 1yq2 s THR 902 CO 0.06 -0.02 -0.16 -0.04 -0.54 0.00 0.00 174.62 173.92 1yq2 s MET 903 N -2.73 1.22 -0.42 3.99 -1.94 0.26 -4.87 119.30 114.81 1yq2 s MET 903 Ca 0.28 -0.67 -0.29 0.00 -1.71 0.00 0.00 55.69 53.30 1yq2 s MET 903 Cb -0.10 -1.22 0.02 0.00 2.01 0.00 0.00 34.83 35.53 1yq2 s MET 903 CO 0.20 0.32 1.27 0.08 -0.01 0.00 0.00 175.02 176.88 1yq2 s VAL 904 N -0.54 4.09 0.21 -6.03 1.01 -1.26 -1.71 120.40 116.16 1yq2 s VAL 904 Ca 0.05 1.14 -0.11 0.00 0.00 0.00 0.00 61.98 63.06 1yq2 s VAL 904 Cb -0.07 -4.37 0.04 0.00 0.00 0.00 0.00 36.38 31.99 1yq2 s VAL 904 CO 0.00 -0.80 0.58 0.00 0.00 0.00 0.00 175.10 174.88 1yq2 n ALA 905 N 8.17 -1.40 -2.71 5.51 0.00 -0.94 -4.93 120.51 124.21 1yq2 n ALA 905 Ca 0.14 -0.77 -0.41 0.00 0.00 0.00 0.00 53.44 52.40 1yq2 n ALA 905 Cb 0.48 0.55 -0.04 0.00 0.00 0.00 0.00 19.45 20.45 1yq2 n ALA 905 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1yq2 s ARG 906 N -2.05 4.50 0.12 0.00 3.52 -1.26 -1.92 118.95 121.87 1yq2 s ARG 906 Ca 0.12 1.22 0.03 0.00 -0.13 0.00 0.00 55.73 56.98 1yq2 s ARG 906 Cb -0.03 -3.46 -0.04 0.00 -1.56 0.00 0.00 34.95 29.86 1yq2 s ARG 906 CO 0.06 -0.03 -0.09 -1.01 -0.81 0.00 0.00 175.30 173.42 1yq2 s HIS 907 N 1.03 1.10 -0.09 5.12 3.76 -0.24 -5.01 115.29 120.95 1yq2 s HIS 907 Ca 0.46 -0.79 -0.15 0.00 -0.15 0.00 0.00 55.06 54.43 1yq2 s HIS 907 Cb -0.20 -0.59 0.03 0.00 1.11 0.00 0.00 32.58 32.94 1yq2 s HIS 907 CO 0.24 -0.01 0.38 0.00 -0.85 0.00 0.00 174.74 174.50 1yq2 s ALA 908 N -3.24 -0.95 -0.16 -1.40 0.00 -1.26 -1.31 121.76 113.44 1yq2 s ALA 908 Ca 0.13 0.84 -0.23 0.00 0.00 0.00 0.00 51.96 52.69 1yq2 s ALA 908 Cb 0.02 -0.34 0.06 0.00 0.00 0.00 0.00 23.12 22.86 1yq2 s ALA 908 CO -0.01 -0.22 0.60 0.00 0.00 0.00 0.00 175.76 176.12 1yq2 s ALA 909 N -0.44 -1.50 0.95 0.00 0.00 0.27 -4.99 121.76 116.05 1yq2 s ALA 909 Ca -0.06 1.46 -0.14 0.00 0.00 0.00 0.00 51.96 53.22 1yq2 s ALA 909 Cb -0.03 -0.61 0.17 0.00 0.00 0.00 0.00 23.12 22.64 1yq2 s ALA 909 CO 0.02 -0.31 1.17 -1.54 0.00 0.00 0.00 175.76 175.11 1yq2 s SER 910 N -0.27 3.14 0.19 0.00 1.04 -1.26 -0.76 113.70 115.77 1yq2 s SER 910 Ca -0.05 0.78 -0.15 0.00 0.48 0.00 0.00 55.95 57.01 1yq2 s SER 910 Cb -0.03 -1.21 0.17 0.00 0.10 0.00 0.00 66.02 65.05 1yq2 s SER 910 CO 0.04 -2.76 1.65 -0.07 0.98 0.00 0.00 173.24 173.07 1yq2 h LEU 911 N -1.65 -0.48 -1.79 2.42 4.07 -1.80 0.76 115.31 116.84 1yq2 h LEU 911 Ca -0.48 0.16 -0.03 0.00 0.08 0.00 0.00 57.88 57.60 1yq2 h LEU 911 Cb 1.31 0.32 -0.00 0.00 1.08 0.00 0.00 40.66 43.37 1yq2 h LEU 911 CO 0.54 -0.17 -0.14 -0.33 -1.08 0.00 0.00 178.44 177.26 1yq2 h GLU 912 N -0.00 0.00 0.00 1.13 3.07 -1.88 -2.01 114.58 114.89 1yq2 h GLU 912 Ca 0.25 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.95 1yq2 h GLU 912 Cb 0.38 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.26 1yq2 h GLU 912 CO -0.53 0.14 -1.18 0.93 -1.40 0.00 0.00 179.01 176.97 1yq2 h GLU 913 N 0.00 0.00 -0.36 2.33 5.08 -1.74 -3.37 114.58 116.52 1yq2 h GLU 913 Ca -0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 1yq2 h GLU 913 Cb 0.40 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1yq2 h GLU 913 CO 0.02 0.39 -0.24 -0.07 -1.00 0.00 0.00 179.01 178.10 1yq2 h LEU 914 N 0.00 0.84 -8.82 1.33 3.38 -0.15 -3.45 115.31 108.43 1yq2 h LEU 914 Ca -0.12 -0.43 -0.67 0.00 0.09 0.00 0.00 57.88 56.75 1yq2 h LEU 914 Cb 1.56 -0.23 -0.24 0.00 0.09 0.00 0.00 40.66 41.85 1yq2 h LEU 914 CO 0.06 1.09 -0.74 0.20 0.09 0.00 0.00 178.44 179.14 1yq2 s ASN 915 N -6.58 4.24 -0.05 -0.43 0.01 -0.98 -4.18 114.94 106.97 1yq2 s ASN 915 Ca -0.12 -0.20 -0.24 0.00 -0.71 0.00 0.00 52.86 51.58 1yq2 s ASN 915 Cb 0.10 -1.33 -0.04 0.00 0.41 0.00 0.00 41.25 40.39 1yq2 s ASN 915 CO 0.84 0.26 0.73 -0.69 -1.51 0.00 0.00 177.10 176.73 1yq2 s VAL 916 N -0.18 5.00 -1.42 1.60 1.01 -1.26 -4.82 120.40 120.32 1yq2 s VAL 916 Ca 0.01 1.52 -0.14 0.00 0.00 0.00 0.00 61.98 63.37 1yq2 s VAL 916 Cb -0.13 -4.07 0.06 0.00 0.00 0.00 0.00 36.38 32.24 1yq2 s VAL 916 CO 0.03 0.26 2.12 -0.81 0.00 0.00 0.00 175.10 176.70 1yq2 n PRO 917 N 3.68 3.00 -1.82 2.72 -0.04 -1.26 -4.95 135.00 136.33 1yq2 n PRO 917 Ca -0.01 -2.81 -0.37 0.00 -0.04 0.00 0.00 63.50 60.27 1yq2 n PRO 917 Cb 0.51 -3.25 0.05 0.00 -0.04 0.00 0.00 33.50 30.77 1yq2 n PRO 917 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1yq2 s TYR 918 N 2.87 2.25 0.25 0.54 1.51 -1.26 -4.90 117.35 118.61 1yq2 s TYR 918 Ca 0.47 1.44 -0.03 0.00 -1.01 0.00 0.00 57.07 57.94 1yq2 s TYR 918 Cb 0.12 -3.70 0.44 0.00 -0.11 0.00 0.00 41.96 38.71 1yq2 s TYR 918 CO -0.06 -2.75 1.82 0.00 -1.11 0.00 0.00 175.55 173.44 1yq2 h ALA 919 N 1.07 1.26 -2.95 3.71 0.00 -1.93 -3.32 119.26 117.11 1yq2 h ALA 919 Ca -0.51 0.03 -0.65 0.00 0.00 0.00 0.00 54.91 53.78 1yq2 h ALA 919 Cb 1.31 -0.15 -0.23 0.00 0.00 0.00 0.00 17.79 18.72 1yq2 h ALA 919 CO 0.56 0.13 -0.63 0.50 0.00 0.00 0.00 179.25 179.81 1yq2 s ARG 920 N -6.01 3.62 0.21 0.00 3.52 -1.26 -4.44 118.95 114.58 1yq2 s ARG 920 Ca -0.12 -0.50 -0.32 0.00 -0.13 0.00 0.00 55.73 54.66 1yq2 s ARG 920 Cb 0.20 -3.32 -0.14 0.00 -1.56 0.00 0.00 34.95 30.13 1yq2 s ARG 920 CO 0.79 -0.20 1.36 -2.30 -0.81 0.00 0.00 175.30 174.14 1yq2 n PRO 921 N 4.92 1.81 -3.83 5.12 -0.02 -1.25 -4.96 135.00 136.79 1yq2 n PRO 921 Ca -0.16 0.64 -0.07 0.00 -2.02 0.00 0.00 63.50 61.89 1yq2 n PRO 921 Cb 0.51 -2.27 0.03 0.00 -0.02 0.00 0.00 33.50 31.74 1yq2 n PRO 921 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1yq2 s GLN 922 N -0.24 1.98 -0.06 -0.52 -2.07 -1.26 -4.66 119.66 112.82 1yq2 s GLN 922 Ca 0.71 -1.29 -0.38 0.00 -1.82 0.00 0.00 55.36 52.59 1yq2 s GLN 922 Cb -0.71 0.54 -0.16 0.00 -1.09 0.00 0.00 33.01 31.59 1yq2 s GLN 922 CO 0.49 -0.93 1.54 -1.91 -1.32 0.00 0.00 175.29 173.17 1yq2 n GLU 923 N -0.60 1.28 -3.58 9.60 4.07 0.54 -4.92 120.64 127.03 1yq2 n GLU 923 Ca -0.07 0.47 -0.14 0.00 -0.06 0.00 0.00 57.16 57.36 1yq2 n GLU 923 Cb 0.60 -2.14 -0.05 0.00 -0.06 0.00 0.00 31.44 29.78 1yq2 n GLU 923 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 1yq2 s THR 924 N 1.90 0.03 0.00 6.31 -1.32 -1.26 -4.75 115.64 116.55 1yq2 s THR 924 Ca 0.90 -0.27 0.00 0.00 -1.21 0.00 0.00 61.69 61.11 1yq2 s THR 924 Cb -0.96 -0.98 0.00 0.00 -1.51 0.00 0.00 72.50 69.04 1yq2 s THR 924 CO 0.54 -0.15 0.00 0.61 -2.21 0.00 0.00 174.62 173.41 1yq2 n GLY 925 N 0.35 0.48 3.69 6.08 0.00 -1.26 -4.89 105.19 109.65 1yq2 n GLY 925 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1yq2 n GLY 925 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1yq2 s HIS 926 N -2.18 2.31 -0.24 1.61 5.04 -1.26 -4.56 115.29 116.00 1yq2 s HIS 926 Ca 0.00 0.15 -0.07 0.00 -1.54 0.00 0.00 55.06 53.60 1yq2 s HIS 926 Cb 0.00 -4.08 -0.02 0.00 0.04 0.00 0.00 32.58 28.51 1yq2 s HIS 926 CO 0.00 -4.39 0.05 1.03 -2.34 0.00 0.00 174.74 169.08 1yq2 s ARG 927 N 2.60 3.61 0.43 2.88 1.81 0.16 -1.03 118.95 129.41 1yq2 s ARG 927 Ca 0.78 -0.50 0.00 0.00 -1.72 0.00 0.00 55.73 54.28 1yq2 s ARG 927 Cb -0.43 -3.25 -0.01 0.00 -0.45 0.00 0.00 34.95 30.80 1yq2 s ARG 927 CO 0.34 -0.17 0.66 -1.54 -0.68 0.00 0.00 175.30 173.91 1yq2 s SER 928 N 1.54 5.92 -1.27 0.23 1.04 -1.26 -1.50 113.70 118.41 1yq2 s SER 928 Ca 0.06 0.34 -0.04 0.00 0.48 0.00 0.00 55.95 56.79 1yq2 s SER 928 Cb -0.15 -1.64 0.00 0.00 0.10 0.00 0.00 66.02 64.34 1yq2 s SER 928 CO 0.02 -0.63 1.08 0.47 0.98 0.00 0.00 173.24 175.16 1yq2 n ASP 929 N -2.04 -3.88 -4.68 7.02 8.00 -1.08 -1.55 116.55 118.34 1yq2 n ASP 929 Ca 0.00 -0.59 -0.42 0.00 0.71 0.00 0.00 54.79 54.50 1yq2 n ASP 929 Cb 0.57 -5.08 -0.03 0.00 -0.02 0.00 0.00 41.12 36.56 1yq2 n ASP 929 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1yq2 s VAL 930 N -3.34 4.82 -0.07 2.53 1.01 -0.09 -3.78 120.40 121.47 1yq2 s VAL 930 Ca 0.25 1.84 -0.25 0.00 0.00 0.00 0.00 61.98 63.82 1yq2 s VAL 930 Cb -0.11 -4.23 -0.26 0.00 0.00 0.00 0.00 36.38 31.78 1yq2 s VAL 930 CO 0.73 0.00 0.92 0.03 0.00 0.00 0.00 175.10 176.79 1yq2 h ARG 931 N 7.23 0.16 -3.04 2.72 -0.00 -1.23 -3.39 114.38 116.83 1yq2 h ARG 931 Ca -0.29 -0.23 -0.06 0.00 -0.50 0.00 0.00 59.98 58.90 1yq2 h ARG 931 Cb 1.13 0.08 -0.15 0.00 0.00 0.00 0.00 29.97 31.03 1yq2 h ARG 931 CO 0.86 1.03 -0.02 1.67 0.00 0.00 0.00 179.97 183.51 1yq2 s TRP 932 N -2.69 -0.32 0.05 3.04 1.48 -1.23 -1.22 118.94 118.05 1yq2 s TRP 932 Ca -0.16 0.22 0.02 0.00 -1.06 0.00 0.00 56.10 55.12 1yq2 s TRP 932 Cb -0.00 0.30 -0.03 0.00 -1.16 0.00 0.00 33.47 32.58 1yq2 s TRP 932 CO 0.75 -0.65 -0.07 -0.48 -4.06 0.00 0.00 176.95 172.44 1yq2 s LEU 933 N -2.27 2.30 -0.09 -4.66 2.34 -0.24 -2.16 118.68 113.91 1yq2 s LEU 933 Ca -0.03 -0.64 -0.00 0.00 0.06 0.00 0.00 54.13 53.52 1yq2 s LEU 933 Cb -0.00 -0.12 0.02 0.00 -0.56 0.00 0.00 46.19 45.53 1yq2 s LEU 933 CO -0.06 -0.27 -0.05 -0.70 -1.06 0.00 0.00 176.35 174.22 1yq2 s GLU 934 N -2.02 1.14 -0.04 1.48 2.12 0.55 -0.66 118.70 121.28 1yq2 s GLU 934 Ca -0.06 -0.12 -0.19 0.00 0.36 0.00 0.00 54.97 54.95 1yq2 s GLU 934 Cb -0.07 -1.27 -0.05 0.00 0.26 0.00 0.00 34.13 33.00 1yq2 s GLU 934 CO -0.01 -0.23 0.55 -0.51 -0.54 0.00 0.00 175.26 174.52 1yq2 s LEU 935 N 1.61 4.38 -0.06 2.70 1.43 0.45 -0.89 118.68 128.31 1yq2 s LEU 935 Ca 0.01 1.05 -0.04 0.00 -1.03 0.00 0.00 54.13 54.13 1yq2 s LEU 935 Cb -0.13 -2.83 -0.04 0.00 0.03 0.00 0.00 46.19 43.22 1yq2 s LEU 935 CO -0.05 0.09 0.13 -0.62 0.23 0.00 0.00 176.35 176.12 1yq2 s ASP 936 N -0.03 6.11 -0.03 2.29 3.68 -0.35 0.15 116.67 128.49 1yq2 s ASP 936 Ca 0.29 0.33 -0.01 0.00 2.13 0.00 0.00 52.55 55.29 1yq2 s ASP 936 Cb -0.17 -1.89 0.03 0.00 -1.45 0.00 0.00 42.92 39.44 1yq2 s ASP 936 CO 0.15 0.33 0.06 0.00 0.13 0.00 0.00 175.17 175.84 1yq2 s ARG 937 N -1.46 -0.01 -1.39 4.34 1.70 0.10 -1.50 118.95 120.72 1yq2 s ARG 937 Ca 0.21 0.24 -0.07 0.00 -0.47 0.00 0.00 55.73 55.63 1yq2 s ARG 937 Cb -0.12 -0.24 0.01 0.00 -0.57 0.00 0.00 34.95 34.03 1yq2 s ARG 937 CO 0.11 -0.17 0.36 0.00 -1.08 0.00 0.00 175.30 174.52 1yq2 n ALA 938 N 4.20 -2.16 0.00 7.88 0.00 -0.38 -2.42 120.51 127.64 1yq2 n ALA 938 Ca -0.27 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 52.81 1yq2 n ALA 938 Cb 0.50 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1yq2 n ALA 938 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 939 N -2.16 2.94 3.52 0.00 0.00 -1.26 -5.02 105.19 103.21 1yq2 n GLY 939 Ca -0.27 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 1yq2 n GLY 939 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yq2 s ALA 940 N -1.41 2.77 0.15 4.61 0.00 -1.02 -5.02 121.76 121.84 1yq2 s ALA 940 Ca 0.00 -1.23 -0.34 0.00 0.00 0.00 0.00 51.96 50.38 1yq2 s ALA 940 Cb 0.00 -0.80 -0.15 0.00 0.00 0.00 0.00 23.12 22.17 1yq2 s ALA 940 CO 0.00 0.60 1.43 -2.30 0.00 0.00 0.00 175.76 175.49 1yq2 n PRO 941 N 1.10 1.69 0.03 0.00 -0.02 -1.26 0.02 135.00 136.55 1yq2 n PRO 941 Ca -0.15 0.61 -0.01 0.00 -2.02 0.00 0.00 63.50 61.93 1yq2 n PRO 941 Cb 0.52 -2.29 -0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1yq2 n PRO 941 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 1yq2 n TRP 942 N 2.69 0.00 -4.63 6.00 -0.00 0.12 -4.74 117.44 116.87 1yq2 n TRP 942 Ca 0.16 0.00 -0.24 0.00 -0.00 0.00 0.00 57.50 57.43 1yq2 n TRP 942 Cb 0.25 -0.05 -0.16 0.00 -0.00 0.00 0.00 31.31 31.36 1yq2 n TRP 942 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 177.69 176.52 1yq2 s LEU 943 N -6.82 1.84 -0.15 5.87 2.96 -1.00 -1.18 118.68 120.21 1yq2 s LEU 943 Ca -0.03 -0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 53.58 1yq2 s LEU 943 Cb 0.01 -0.79 -0.03 0.00 0.50 0.00 0.00 46.19 45.88 1yq2 s LEU 943 CO 0.04 0.11 -0.05 -0.60 -1.32 0.00 0.00 176.35 174.52 1yq2 s ARG 944 N 0.15 3.60 -0.18 1.98 6.06 0.53 -0.41 118.95 130.66 1yq2 s ARG 944 Ca -0.04 -0.55 -0.00 0.00 -2.50 0.00 0.00 55.73 52.64 1yq2 s ARG 944 Cb -0.11 -2.85 0.01 0.00 0.06 0.00 0.00 34.95 32.06 1yq2 s ARG 944 CO 0.02 0.25 -0.16 0.42 -2.50 0.00 0.00 175.30 173.33 1yq2 s ILE 945 N 0.31 2.45 -0.08 4.11 1.01 0.17 -1.21 121.20 127.95 1yq2 s ILE 945 Ca -0.05 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 59.67 1yq2 s ILE 945 Cb -0.14 -2.05 -0.05 0.00 0.01 0.00 0.00 42.46 40.23 1yq2 s ILE 945 CO 0.03 0.51 0.27 -1.81 0.00 0.00 0.00 174.94 173.95 1yq2 s ASP 946 N 1.25 6.56 -0.07 3.58 1.01 0.38 -1.08 116.67 128.29 1yq2 s ASP 946 Ca 0.03 0.66 0.05 0.00 0.71 0.00 0.00 52.55 54.01 1yq2 s ASP 946 Cb -0.14 -2.16 -0.01 0.00 1.01 0.00 0.00 42.92 41.63 1yq2 s ASP 946 CO -0.09 0.31 -0.25 0.00 0.21 0.00 0.00 175.17 175.36 1yq2 s ALA 947 N -0.74 2.16 -0.05 5.23 0.00 -0.36 -0.43 121.76 127.58 1yq2 s ALA 947 Ca 0.18 -1.01 -0.04 0.00 0.00 0.00 0.00 51.96 51.10 1yq2 s ALA 947 Cb -0.14 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 22.21 1yq2 s ALA 947 CO 0.07 0.36 0.14 -1.21 0.00 0.00 0.00 175.76 175.13 1yq2 s GLU 948 N 0.05 3.34 0.63 0.00 2.02 -0.14 -4.74 118.70 119.85 1yq2 s GLU 948 Ca -0.10 -0.30 -0.16 0.00 0.02 0.00 0.00 54.97 54.43 1yq2 s GLU 948 Cb -0.15 -3.06 -0.01 0.00 0.10 0.00 0.00 34.13 31.00 1yq2 s GLU 948 CO 0.06 0.71 1.13 -2.14 0.02 0.00 0.00 175.26 175.04 1yq2 s PRO 949 N -1.54 2.88 0.48 0.39 0.02 -1.26 -4.39 135.00 131.58 1yq2 s PRO 949 Ca 0.22 1.52 -0.08 0.00 0.02 0.00 0.00 61.00 62.68 1yq2 s PRO 949 Cb -0.12 -1.95 0.11 0.00 0.02 0.00 0.00 34.50 32.56 1yq2 s PRO 949 CO 0.12 -1.21 0.65 -0.40 -0.33 0.00 0.00 177.00 175.83 1yq2 n ASP 950 N -2.11 0.09 -0.18 2.53 5.68 -0.44 -4.81 116.55 117.32 1yq2 n ASP 950 Ca 0.11 -1.26 0.19 0.00 -0.50 0.00 0.00 54.79 53.33 1yq2 n ASP 950 Cb 0.51 -0.49 0.55 0.00 -1.14 0.00 0.00 41.12 40.55 1yq2 n ASP 950 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1yq2 h ALA 951 N -1.81 2.27 -0.31 2.12 0.00 -1.95 0.24 119.26 119.83 1yq2 h ALA 951 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1yq2 h ALA 951 Cb 0.59 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1yq2 h ALA 951 CO 0.15 -0.51 0.00 0.00 0.00 0.00 0.00 179.25 178.89 1yq2 n ALA 952 N -2.55 2.46 -1.00 0.00 0.00 -1.26 -4.91 120.51 113.25 1yq2 n ALA 952 Ca 0.16 -0.64 -0.00 0.00 0.00 0.00 0.00 53.44 52.97 1yq2 n ALA 952 Cb 0.65 -1.01 -0.00 0.00 0.00 0.00 0.00 19.45 19.10 1yq2 n ALA 952 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yq2 n GLY 953 N 1.13 0.49 3.77 0.00 0.00 0.07 -5.03 105.19 105.63 1yq2 n GLY 953 Ca 0.14 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1yq2 n GLY 953 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yq2 s ARG 954 N -0.09 4.58 0.06 1.61 0.52 -1.26 -4.70 118.95 119.68 1yq2 s ARG 954 Ca 0.00 1.18 0.03 0.00 -0.52 0.00 0.00 55.73 56.42 1yq2 s ARG 954 Cb 0.00 -3.28 -0.04 0.00 0.52 0.00 0.00 34.95 32.15 1yq2 s ARG 954 CO 0.00 0.51 0.02 1.03 0.02 0.00 0.00 175.30 176.88 1yq2 s ARG 955 N -0.94 2.69 0.96 3.54 0.52 -1.26 -1.33 118.95 123.14 1yq2 s ARG 955 Ca 0.37 -0.74 -0.16 0.00 -0.52 0.00 0.00 55.73 54.68 1yq2 s ARG 955 Cb -0.23 -2.62 0.22 0.00 0.52 0.00 0.00 34.95 32.84 1yq2 s ARG 955 CO 0.26 0.57 1.31 -0.35 0.02 0.00 0.00 175.30 177.11 1yq2 n PRO 956 N 0.77 -1.27 -4.53 3.54 -0.04 -1.26 -4.41 135.00 127.80 1yq2 n PRO 956 Ca -0.11 -2.03 -0.26 0.00 -0.04 0.00 0.00 63.50 61.05 1yq2 n PRO 956 Cb 0.52 -1.34 -0.08 0.00 -0.04 0.00 0.00 33.50 32.56 1yq2 n PRO 956 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1yq2 s GLY 957 N -5.85 2.68 0.08 0.55 0.00 0.10 -0.92 107.32 103.96 1yq2 s GLY 957 Ca 0.74 -1.14 -0.10 0.00 0.00 0.00 0.00 44.72 44.22 1yq2 s GLY 957 CO 0.52 -1.85 0.21 -0.11 0.00 0.00 0.00 173.10 171.87 1yq2 s PHE 958 N -3.17 0.09 0.03 1.90 -0.12 -0.56 -0.76 117.98 115.39 1yq2 s PHE 958 Ca 0.22 -0.45 0.02 0.00 -0.05 0.00 0.00 56.93 56.66 1yq2 s PHE 958 Cb 0.02 -0.02 -0.02 0.00 -0.63 0.00 0.00 43.02 42.37 1yq2 s PHE 958 CO 0.14 -0.53 -0.06 -1.12 -0.05 0.00 0.00 175.22 173.60 1yq2 s SER 959 N -2.65 0.67 -0.10 1.98 0.01 -0.27 -0.67 113.70 112.68 1yq2 s SER 959 Ca 0.02 -0.52 0.02 0.00 1.31 0.00 0.00 55.95 56.78 1yq2 s SER 959 Cb 0.03 0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.32 1yq2 s SER 959 CO -0.09 -0.22 -0.16 -0.22 0.41 0.00 0.00 173.24 172.96 1yq2 s LEU 960 N -1.50 1.76 0.09 2.44 2.96 -1.26 -1.05 118.68 122.13 1yq2 s LEU 960 Ca -0.11 -0.42 0.02 0.00 -0.22 0.00 0.00 54.13 53.40 1yq2 s LEU 960 Cb -0.10 -1.08 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 1yq2 s LEU 960 CO -0.00 0.04 -0.06 0.00 -1.32 0.00 0.00 176.35 175.01 1yq2 s ALA 961 N 0.82 0.95 -1.79 5.97 0.00 0.25 -4.87 121.76 123.10 1yq2 s ALA 961 Ca -0.10 -1.33 0.26 0.00 0.00 0.00 0.00 51.96 50.79 1yq2 s ALA 961 Cb -0.16 0.16 0.63 0.00 0.00 0.00 0.00 23.12 23.75 1yq2 s ALA 961 CO 0.01 -0.23 1.49 0.54 0.00 0.00 0.00 175.76 177.57 1yq2 n ARG 962 N 0.01 0.88 -3.94 0.00 1.74 -1.26 0.04 116.66 114.14 1yq2 n ARG 962 Ca -0.13 -0.57 -0.09 0.00 -0.77 0.00 0.00 57.85 56.30 1yq2 n ARG 962 Cb 0.61 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 30.48 1yq2 n ARG 962 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1yq2 s HIS 963 N -2.51 0.34 0.70 -1.55 3.76 -1.26 -4.56 115.29 110.21 1yq2 s HIS 963 Ca 0.23 -0.75 -0.11 0.00 -0.15 0.00 0.00 55.06 54.28 1yq2 s HIS 963 Cb 0.19 -0.13 0.01 0.00 1.11 0.00 0.00 32.58 33.76 1yq2 s HIS 963 CO 0.53 -0.58 1.06 0.95 -0.85 0.00 0.00 174.74 175.85 1yq2 s THR 964 N -3.92 3.95 0.43 1.30 -4.23 -1.26 -4.82 115.64 107.09 1yq2 s THR 964 Ca 0.11 0.63 0.10 0.00 -1.18 0.00 0.00 61.69 61.36 1yq2 s THR 964 Cb 0.05 -3.45 0.28 0.00 1.34 0.00 0.00 72.50 70.72 1yq2 s THR 964 CO -0.06 -0.83 2.05 0.00 -0.54 0.00 0.00 174.62 175.24 1yq2 h ALA 965 N -0.69 1.84 -0.38 3.99 0.00 -1.98 -1.28 119.26 120.76 1yq2 h ALA 965 Ca -0.44 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 1yq2 h ALA 965 Cb 1.22 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1yq2 h ALA 965 CO 0.59 0.12 0.10 1.96 0.00 0.00 0.00 179.25 182.01 1yq2 h GLN 966 N 0.43 0.60 -0.53 0.00 7.50 -1.92 -1.37 115.11 119.82 1yq2 h GLN 966 Ca 0.16 -0.14 -0.08 0.00 0.50 0.00 0.00 58.65 59.09 1yq2 h GLN 966 Cb 0.10 -0.08 -0.02 0.00 0.05 0.00 0.00 27.48 27.53 1yq2 h GLN 966 CO -0.04 0.63 0.03 0.93 -1.50 0.00 0.00 178.83 178.89 1yq2 h GLU 967 N 0.47 0.91 -0.55 1.46 5.08 -1.73 -2.45 114.58 117.77 1yq2 h GLU 967 Ca 0.12 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1yq2 h GLU 967 Cb 0.30 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1yq2 h GLU 967 CO 0.00 0.92 0.28 0.82 -1.00 0.00 0.00 179.01 180.03 1yq2 h ILE 968 N 0.79 1.19 -0.23 3.13 2.04 -1.25 -2.47 117.51 120.71 1yq2 h ILE 968 Ca 0.15 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 1yq2 h ILE 968 Cb 0.48 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1yq2 h ILE 968 CO 0.02 0.21 0.05 0.00 0.00 0.00 0.00 178.15 178.43 1yq2 h ALA 969 N 1.12 1.66 0.00 1.87 0.00 -1.01 -2.10 119.26 120.80 1yq2 h ALA 969 Ca 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1yq2 h ALA 969 Cb 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1yq2 h ALA 969 CO -0.03 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.49 1yq2 h ALA 970 N 1.73 1.00 -2.94 0.00 0.00 -0.98 -3.45 119.26 114.63 1yq2 h ALA 970 Ca 0.08 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.41 1yq2 h ALA 970 Cb 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.85 1yq2 h ALA 970 CO -0.00 0.00 -0.17 0.00 0.00 0.00 0.00 179.25 179.08 1yq2 s ALA 971 N -3.44 3.50 0.14 0.00 0.00 -0.79 -4.97 121.76 116.20 1yq2 s ALA 971 Ca 0.04 -0.26 0.05 0.00 0.00 0.00 0.00 51.96 51.79 1yq2 s ALA 971 Cb 0.08 -2.61 -0.13 0.00 0.00 0.00 0.00 23.12 20.46 1yq2 s ALA 971 CO 0.56 -0.02 1.31 0.78 0.00 0.00 0.00 175.76 178.39 1yq2 h GLY 972 N 6.81 0.09 -4.13 0.00 0.00 -1.87 -3.37 103.07 100.60 1yq2 h GLY 972 Ca -0.40 -0.20 -0.24 0.00 0.00 0.00 0.00 47.33 46.49 1yq2 h GLY 972 CO 0.75 0.18 -0.72 0.30 0.00 0.00 0.00 176.54 177.05 1yq2 s HIS 973 N -2.88 0.70 0.31 5.60 3.76 -1.26 -4.37 115.29 117.15 1yq2 s HIS 973 Ca -0.01 -0.67 0.07 0.00 -0.15 0.00 0.00 55.06 54.30 1yq2 s HIS 973 Cb 0.10 -0.42 0.79 0.00 1.11 0.00 0.00 32.58 34.15 1yq2 s HIS 973 CO 0.83 -0.13 1.74 -1.35 -0.85 0.00 0.00 174.74 174.98 1yq2 h PRO 974 N 3.93 0.59 0.00 8.40 0.11 -1.87 -1.24 132.00 141.92 1yq2 h PRO 974 Ca -0.35 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1yq2 h PRO 974 Cb 1.19 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1yq2 h PRO 974 CO 0.50 0.39 0.00 -2.39 -0.21 0.00 0.00 178.00 176.29 1yq2 n HIS 975 N -4.88 0.19 1.55 0.65 1.44 -1.26 -1.99 115.22 110.93 1yq2 n HIS 975 Ca 0.24 0.08 0.14 0.00 -2.01 0.00 0.00 57.72 56.17 1yq2 n HIS 975 Cb 0.66 -0.63 0.57 0.00 0.12 0.00 0.00 29.99 30.71 1yq2 n HIS 975 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1yq2 n GLU 976 N -1.68 1.56 -2.67 -1.40 1.02 -0.47 -4.90 120.64 112.10 1yq2 n GLU 976 Ca 0.03 -0.83 -0.40 0.00 -0.02 0.00 0.00 57.16 55.94 1yq2 n GLU 976 Cb 0.16 -1.48 -0.06 0.00 -0.02 0.00 0.00 31.44 30.05 1yq2 n GLU 976 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1yq2 s LEU 977 N -2.01 4.59 0.89 -4.62 1.43 -0.84 -4.92 118.68 113.21 1yq2 s LEU 977 Ca 0.39 2.03 -0.11 0.00 -1.03 0.00 0.00 54.13 55.42 1yq2 s LEU 977 Cb 0.21 -3.65 0.13 0.00 0.03 0.00 0.00 46.19 42.91 1yq2 s LEU 977 CO 0.34 0.05 1.11 -2.16 0.23 0.00 0.00 176.35 175.92 1yq2 s PRO 978 N -1.33 1.24 0.21 1.29 0.04 -1.26 -4.94 135.00 130.24 1yq2 s PRO 978 Ca 0.43 1.21 -0.31 0.00 0.04 0.00 0.00 61.00 62.37 1yq2 s PRO 978 Cb -0.27 -1.78 -0.11 0.00 0.04 0.00 0.00 34.50 32.38 1yq2 s PRO 978 CO 0.34 -2.37 1.63 -0.08 0.04 0.00 0.00 177.00 176.57 1yq2 s THR 979 N -2.77 2.28 0.39 1.26 -1.32 -1.26 -4.92 115.64 109.30 1yq2 s THR 979 Ca 0.64 0.21 -0.27 0.00 -1.21 0.00 0.00 61.69 61.07 1yq2 s THR 979 Cb -0.20 -3.13 -0.11 0.00 -1.51 0.00 0.00 72.50 67.55 1yq2 s THR 979 CO 0.58 0.02 1.27 -2.65 -2.21 0.00 0.00 174.62 171.63 1yq2 n PRO 980 N 3.61 2.01 -0.00 7.08 -0.02 -1.26 -4.95 135.00 141.47 1yq2 n PRO 980 Ca 0.13 0.71 0.04 0.00 -2.02 0.00 0.00 63.50 62.36 1yq2 n PRO 980 Cb 0.37 -2.35 -0.05 0.00 -0.02 0.00 0.00 33.50 31.45 1yq2 n PRO 980 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1yq2 n SER 981 N 0.47 2.01 -4.04 2.55 3.41 -1.26 -5.03 113.62 111.73 1yq2 n SER 981 Ca 0.06 -0.29 -0.10 0.00 -0.26 0.00 0.00 58.87 58.28 1yq2 n SER 981 Cb 0.38 1.19 -0.08 0.00 -0.26 0.00 0.00 64.21 65.44 1yq2 n SER 981 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1yq2 s HIS 982 N -2.15 0.59 0.00 7.33 3.76 -1.26 -4.52 115.29 119.04 1yq2 s HIS 982 Ca -0.00 -0.95 -0.02 0.00 -0.15 0.00 0.00 55.06 53.93 1yq2 s HIS 982 Cb 0.05 -0.23 -0.04 0.00 1.11 0.00 0.00 32.58 33.47 1yq2 s HIS 982 CO 0.30 -0.64 0.16 -1.12 -0.85 0.00 0.00 174.74 172.60 1yq2 s SER 983 N -3.00 6.22 -0.11 1.40 0.01 -0.54 -4.52 113.70 113.17 1yq2 s SER 983 Ca 0.20 0.29 0.03 0.00 1.31 0.00 0.00 55.95 57.79 1yq2 s SER 983 Cb 0.05 -1.92 0.00 0.00 0.21 0.00 0.00 66.02 64.37 1yq2 s SER 983 CO 0.01 0.25 -0.22 -0.31 0.41 0.00 0.00 173.24 173.38 1yq2 s TYR 984 N -1.32 2.46 -0.26 2.43 1.51 0.11 0.16 117.35 122.43 1yq2 s TYR 984 Ca 0.27 -1.08 -0.09 0.00 -1.01 0.00 0.00 57.07 55.16 1yq2 s TYR 984 Cb -0.13 -1.67 -0.04 0.00 -0.11 0.00 0.00 41.96 40.02 1yq2 s TYR 984 CO 0.19 -0.46 0.13 -1.17 -1.11 0.00 0.00 175.55 173.12 1yq2 s LEU 985 N 0.54 3.76 -0.25 -1.29 2.96 -0.57 -0.58 118.68 123.25 1yq2 s LEU 985 Ca -0.15 -0.08 -0.10 0.00 -0.22 0.00 0.00 54.13 53.59 1yq2 s LEU 985 Cb -0.17 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 1yq2 s LEU 985 CO 0.05 -0.02 0.14 -0.31 -1.32 0.00 0.00 176.35 174.89 1yq2 s TYR 986 N 1.55 3.22 -0.33 5.38 1.51 -0.21 0.04 117.35 128.51 1yq2 s TYR 986 Ca 0.06 0.03 -0.10 0.00 -1.01 0.00 0.00 57.07 56.05 1yq2 s TYR 986 Cb -0.15 -2.28 0.01 0.00 -0.11 0.00 0.00 41.96 39.43 1yq2 s TYR 986 CO 0.07 -0.09 0.17 0.08 -1.11 0.00 0.00 175.55 174.66 1yq2 s VAL 987 N 1.34 4.59 -0.22 0.71 1.01 0.56 -1.11 120.40 127.27 1yq2 s VAL 987 Ca 0.06 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.40 1yq2 s VAL 987 Cb -0.15 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 1yq2 s VAL 987 CO 0.06 -0.05 0.03 -1.81 0.00 0.00 0.00 175.10 173.33 1yq2 s ASP 988 N 1.59 4.92 0.34 3.32 1.01 0.06 -0.95 116.67 126.97 1yq2 s ASP 988 Ca 0.04 -0.22 0.09 0.00 0.71 0.00 0.00 52.55 53.17 1yq2 s ASP 988 Cb -0.18 -1.86 0.63 0.00 1.01 0.00 0.00 42.92 42.52 1yq2 s ASP 988 CO 0.06 0.01 1.80 0.00 0.21 0.00 0.00 175.17 177.26 1yq2 h ALA 989 N 7.88 1.31 -2.28 5.23 0.00 0.12 0.32 119.26 131.84 1yq2 h ALA 989 Ca -0.38 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.12 1yq2 h ALA 989 Cb 1.17 -0.08 -0.20 0.00 0.00 0.00 0.00 17.79 18.68 1yq2 h ALA 989 CO 0.60 0.48 -0.03 0.00 0.00 0.00 0.00 179.25 180.30 1yq2 s ALA 990 N -4.34 -1.34 0.03 0.00 0.00 -0.80 -4.76 121.76 110.56 1yq2 s ALA 990 Ca -0.04 1.07 0.05 0.00 0.00 0.00 0.00 51.96 53.04 1yq2 s ALA 990 Cb 0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 1yq2 s ALA 990 CO 0.75 -0.30 -0.16 -0.65 0.00 0.00 0.00 175.76 175.40 1yq2 s GLN 991 N -0.81 1.07 0.54 0.00 -1.52 -1.26 -1.15 119.66 116.53 1yq2 s GLN 991 Ca -0.09 -0.75 -0.20 0.00 -1.95 0.00 0.00 55.36 52.37 1yq2 s GLN 991 Cb -0.03 -1.09 -0.06 0.00 -0.22 0.00 0.00 33.01 31.61 1yq2 s GLN 991 CO 0.06 0.28 1.14 -1.58 -0.25 0.00 0.00 175.29 174.93 1yq2 s HIS 992 N -0.75 2.67 1.31 0.91 5.65 -0.12 -4.67 115.29 120.28 1yq2 s HIS 992 Ca 0.03 1.54 -0.22 0.00 0.25 0.00 0.00 55.06 56.67 1yq2 s HIS 992 Cb -0.08 -3.32 0.33 0.00 -1.18 0.00 0.00 32.58 28.34 1yq2 s HIS 992 CO 0.01 -1.63 0.88 0.41 -0.65 0.00 0.00 174.74 173.77 1yq2 n GLY 993 N 0.22 -3.57 0.20 1.59 0.00 -0.80 -4.69 105.19 98.15 1yq2 n GLY 993 Ca 0.11 -1.35 -0.17 0.00 0.00 0.00 0.00 46.02 44.61 1yq2 n GLY 993 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yq2 n LEU 994 N 0.00 2.35 0.00 0.99 4.77 -1.26 -4.98 117.00 118.87 1yq2 n LEU 994 Ca 0.13 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 1yq2 n LEU 994 Cb 0.56 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1yq2 n LEU 994 CO 0.37 0.67 0.00 0.61 -1.33 0.00 0.00 177.39 177.71 1yq2 n GLY 995 N 2.20 0.99 2.73 -0.72 0.00 -1.26 -4.57 105.19 104.55 1yq2 n GLY 995 Ca -0.37 -0.61 -0.02 0.00 0.00 0.00 0.00 46.02 45.01 1yq2 n GLY 995 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1yq2 n SER 996 N -3.22 -0.40 0.08 1.61 3.41 -0.53 -0.80 113.62 113.76 1yq2 n SER 996 Ca 0.00 -2.19 0.08 0.00 -0.26 0.00 0.00 58.87 56.50 1yq2 n SER 996 Cb 0.00 0.29 0.38 0.00 -0.26 0.00 0.00 64.21 64.61 1yq2 n SER 996 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1yq2 n ARG 997 N -1.12 0.10 0.05 4.33 0.63 -1.02 -1.35 116.66 118.29 1yq2 n ARG 997 Ca -0.08 0.43 0.13 0.00 -0.92 0.00 0.00 57.85 57.41 1yq2 n ARG 997 Cb 0.85 -1.72 0.60 0.00 0.45 0.00 0.00 32.46 32.64 1yq2 n ARG 997 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1yq2 h ALA 998 N 2.24 2.14 -0.81 5.13 0.00 -1.76 -3.36 119.26 122.84 1yq2 h ALA 998 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1yq2 h ALA 998 Cb 0.20 -0.03 -0.18 0.00 0.00 0.00 0.00 17.79 17.78 1yq2 h ALA 998 CO 0.00 -0.23 -0.37 0.00 0.00 0.00 0.00 179.25 178.64 1yq2 n GLY 1000N 3.96 0.89 3.67 0.00 0.00 -0.87 -4.34 105.19 108.50 1yq2 n GLY 1000Ca 0.11 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.85 1yq2 n GLY 1000CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1yq2 n PRO 1001N -0.45 1.32 -0.87 1.61 -0.02 -1.26 -3.83 135.00 131.50 1yq2 n PRO 1001Ca 0.00 0.49 -0.28 0.00 -2.02 0.00 0.00 63.50 61.69 1yq2 n PRO 1001Cb 0.00 -2.33 0.21 0.00 -0.02 0.00 0.00 33.50 31.36 1yq2 n PRO 1001CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1yq2 s ASP 1002N -1.02 1.78 0.05 2.55 3.68 -1.26 -1.46 116.67 121.00 1yq2 s ASP 1002Ca 0.72 1.33 -0.36 0.00 2.13 0.00 0.00 52.55 56.37 1yq2 s ASP 1002Cb -0.44 -2.06 -0.15 0.00 -1.45 0.00 0.00 42.92 38.82 1yq2 s ASP 1002CO 0.49 -3.68 1.51 0.52 0.13 0.00 0.00 175.17 174.15 1yq2 n VAL 1003N -4.55 0.09 -1.96 1.11 0.31 -1.26 -4.56 118.33 107.50 1yq2 n VAL 1003Ca 0.04 -0.02 -0.41 0.00 -0.01 0.00 0.00 64.34 63.94 1yq2 n VAL 1003Cb 0.56 -1.20 -0.02 0.00 -0.91 0.00 0.00 33.84 32.27 1yq2 n VAL 1003CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 1yq2 s TRP 1004N 1.29 2.96 0.54 3.52 -0.11 -1.26 -4.76 118.94 121.13 1yq2 s TRP 1004Ca 0.85 0.98 0.30 0.00 1.22 0.00 0.00 56.10 59.45 1yq2 s TRP 1004Cb -0.85 -3.87 1.46 0.00 -1.50 0.00 0.00 33.47 28.71 1yq2 s TRP 1004CO 0.46 -2.84 1.91 -1.35 -4.62 0.00 0.00 176.95 170.51 1yq2 h PRO 1005N 4.95 0.00 0.00 5.86 0.11 -1.93 0.10 132.00 141.09 1yq2 h PRO 1005Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1yq2 h PRO 1005Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1yq2 h PRO 1005CO 0.78 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 178.13 1yq2 h ASP 1006N 0.00 0.00 -0.06 -2.05 5.19 -2.03 -2.58 116.42 114.89 1yq2 h ASP 1006Ca 0.37 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.78 1yq2 h ASP 1006Cb 1.51 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.02 1yq2 h ASP 1006CO -0.00 0.00 0.00 0.49 -3.12 0.00 0.00 179.24 176.61 1yq2 n PHE 1007N -2.92 0.08 -3.46 4.55 3.01 0.35 -5.01 117.46 114.05 1yq2 n PHE 1007Ca -0.02 -0.44 -0.38 0.00 1.01 0.00 0.00 57.45 57.63 1yq2 n PHE 1007Cb 0.12 -0.04 -0.06 0.00 -0.01 0.00 0.00 39.48 39.48 1yq2 n PHE 1007CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1yq2 s ALA 1008N -0.90 3.64 -0.30 4.37 0.00 -0.98 -1.90 121.76 125.69 1yq2 s ALA 1008Ca 0.04 -0.24 -0.20 0.00 0.00 0.00 0.00 51.96 51.56 1yq2 s ALA 1008Cb 0.02 -2.44 -0.01 0.00 0.00 0.00 0.00 23.12 20.69 1yq2 s ALA 1008CO 0.03 0.33 0.62 -1.17 0.00 0.00 0.00 175.76 175.56 1yq2 s LEU 1009N -0.51 4.15 0.25 0.00 2.96 -1.26 -4.94 118.68 119.32 1yq2 s LEU 1009Ca 0.23 0.42 0.09 0.00 -0.22 0.00 0.00 54.13 54.65 1yq2 s LEU 1009Cb -0.16 -2.79 -0.04 0.00 0.50 0.00 0.00 46.19 43.70 1yq2 s LEU 1009CO 0.11 -0.46 0.02 -0.13 -1.32 0.00 0.00 176.35 174.57 1yq2 s ARG 1010N 2.57 2.37 0.21 1.98 1.81 -1.26 -1.92 118.95 124.71 1yq2 s ARG 1010Ca 0.25 -1.33 -0.31 0.00 -1.72 0.00 0.00 55.73 52.61 1yq2 s ARG 1010Cb -0.15 -2.23 -0.15 0.00 -0.45 0.00 0.00 34.95 31.97 1yq2 s ARG 1010CO 0.12 0.38 1.09 -2.30 -0.68 0.00 0.00 175.30 173.91 1yq2 n PRO 1011N -0.80 1.17 -3.48 3.54 -0.02 -1.26 -4.86 135.00 129.30 1yq2 n PRO 1011Ca -0.07 0.42 -0.15 0.00 -2.02 0.00 0.00 63.50 61.67 1yq2 n PRO 1011Cb 0.58 -1.86 -0.04 0.00 -0.02 0.00 0.00 33.50 32.16 1yq2 n PRO 1011CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1yq2 s GLU 1012N -0.74 1.14 0.27 -0.52 -1.05 -1.26 -5.13 118.70 111.41 1yq2 s GLU 1012Ca 0.69 -0.05 -0.29 0.00 -0.15 0.00 0.00 54.97 55.17 1yq2 s GLU 1012Cb -0.81 0.53 -0.09 0.00 -0.44 0.00 0.00 34.13 33.32 1yq2 s GLU 1012CO 0.55 -0.42 0.94 0.00 0.95 0.00 0.00 175.26 177.27 1yq2 s ALA 1013N -2.27 3.30 0.04 -0.84 0.00 -1.26 -4.70 121.76 116.02 1yq2 s ALA 1013Ca -0.06 0.58 -0.02 0.00 0.00 0.00 0.00 51.96 52.46 1yq2 s ALA 1013Cb -0.00 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.90 1yq2 s ALA 1013CO 0.00 0.20 0.01 1.03 0.00 0.00 0.00 175.76 177.00 1yq2 s ARG 1014N -1.48 0.50 -0.04 0.00 1.81 -0.85 -5.00 118.95 113.88 1yq2 s ARG 1014Ca 0.44 -0.85 0.04 0.00 -1.72 0.00 0.00 55.73 53.65 1yq2 s ARG 1014Cb -0.23 0.18 -0.00 0.00 -0.45 0.00 0.00 34.95 34.44 1yq2 s ARG 1014CO 0.29 -0.10 -0.17 0.99 -0.68 0.00 0.00 175.30 175.63 1yq2 s THR 1015N -2.61 1.42 -0.10 0.02 2.01 -1.26 -0.59 115.64 114.52 1yq2 s THR 1015Ca -0.05 -0.71 -0.01 0.00 0.31 0.00 0.00 61.69 61.23 1yq2 s THR 1015Cb -0.01 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 1yq2 s THR 1015CO -0.05 0.41 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.47 1yq2 s LEU 1016N 0.02 3.20 -0.28 4.42 1.43 0.18 -4.81 118.68 122.84 1yq2 s LEU 1016Ca -0.03 -0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.02 1yq2 s LEU 1016Cb -0.11 -1.72 0.08 0.00 0.03 0.00 0.00 46.19 44.46 1yq2 s LEU 1016CO 0.02 0.29 -0.00 -0.54 0.23 0.00 0.00 176.35 176.35 1yq2 s LYS 1017N -0.37 1.47 0.13 1.70 1.02 -1.26 -1.14 119.74 121.28 1yq2 s LYS 1017Ca 0.06 -1.26 0.11 0.00 0.02 0.00 0.00 55.97 54.89 1yq2 s LYS 1017Cb -0.12 -2.66 -0.04 0.00 -0.52 0.00 0.00 37.83 34.48 1yq2 s LYS 1017CO 0.02 -0.76 -0.27 -0.51 -0.92 0.00 0.00 175.35 172.92 1yq2 s LEU 1018N 1.28 2.34 -0.08 3.17 1.43 -0.15 -0.97 118.68 125.71 1yq2 s LEU 1018Ca 0.01 -0.75 0.04 0.00 -1.03 0.00 0.00 54.13 52.40 1yq2 s LEU 1018Cb -0.19 -1.23 0.00 0.00 0.03 0.00 0.00 46.19 44.81 1yq2 s LEU 1018CO -0.10 0.18 -0.20 -0.13 0.23 0.00 0.00 176.35 176.33 1yq2 s ARG 1019N -2.11 2.46 -0.14 1.70 0.52 0.43 -0.77 118.95 121.05 1yq2 s ARG 1019Ca 0.15 -0.71 0.02 0.00 -0.52 0.00 0.00 55.73 54.66 1yq2 s ARG 1019Cb -0.10 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.43 1yq2 s ARG 1019CO 0.06 0.16 -0.19 0.42 0.02 0.00 0.00 175.30 175.77 1yq2 s ILE 1020N 0.36 2.36 0.04 1.52 1.01 -0.58 -0.47 121.20 125.43 1yq2 s ILE 1020Ca -0.15 -0.88 -0.05 0.00 0.00 0.00 0.00 60.65 59.57 1yq2 s ILE 1020Cb -0.16 -1.96 -0.01 0.00 0.01 0.00 0.00 42.46 40.33 1yq2 s ILE 1020CO 0.06 0.54 0.10 -0.94 0.00 0.00 0.00 174.94 174.69 1yq2 s SER 1021N 0.72 0.18 0.45 3.58 1.04 -0.35 -4.15 113.70 115.16 1yq2 s SER 1021Ca -0.08 -0.53 -0.25 0.00 0.48 0.00 0.00 55.95 55.56 1yq2 s SER 1021Cb -0.16 0.23 -0.08 0.00 0.10 0.00 0.00 66.02 66.11 1yq2 s SER 1021CO 0.01 -0.51 1.36 -2.84 0.98 0.00 0.00 173.24 172.24 1yq2 s PRO 1022N -2.61 3.72 0.00 4.02 0.02 -1.26 -0.35 135.00 138.54 1yq2 s PRO 1022Ca -0.05 2.27 0.30 0.00 0.02 0.00 0.00 61.00 63.54 1yq2 s PRO 1022Cb -0.01 -2.63 1.79 0.00 0.02 0.00 0.00 34.50 33.67 1yq2 s PRO 1022CO -0.05 -0.73 2.12 0.00 -0.33 0.00 0.00 177.00 178.01