#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kei s THR 2 N 0.00 5.16 0.00 7.28 2.01 -1.26 -5.01 115.64 123.82 1kei s THR 2 Ca 0.00 1.03 0.00 0.00 0.31 0.00 0.00 61.69 63.03 1kei s THR 2 Cb 0.00 -3.85 0.00 0.00 0.01 0.00 0.00 72.50 68.66 1kei s THR 2 CO 0.00 0.32 0.00 0.61 -0.69 0.00 0.00 174.62 174.86 1kei n GLY 3 N 3.21 1.14 3.70 4.40 0.00 -1.26 -4.77 105.19 111.60 1kei n GLY 3 Ca -0.06 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 44.86 1kei n GLY 3 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kei s THR 4 N -2.29 5.35 0.18 2.61 2.01 -0.44 -4.84 115.64 118.22 1kei s THR 4 Ca 0.00 0.31 -0.30 0.00 0.31 0.00 0.00 61.69 62.01 1kei s THR 4 Cb 0.00 -3.54 -0.08 0.00 0.01 0.00 0.00 72.50 68.89 1kei s THR 4 CO 0.00 0.37 1.20 -0.44 -0.69 0.00 0.00 174.62 175.07 1kei s SER 5 N 0.73 7.08 0.19 3.53 0.01 -1.26 -0.03 113.70 123.94 1kei s SER 5 Ca 0.11 2.22 -0.01 0.00 1.31 0.00 0.00 55.95 59.58 1kei s SER 5 Cb -0.13 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.50 1kei s SER 5 CO 0.03 -0.39 0.26 1.07 0.41 0.00 0.00 173.24 174.62 1kei n THR 6 N 2.63 0.00 -4.49 1.44 5.66 -0.24 -4.92 114.28 114.36 1kei n THR 6 Ca 0.05 -0.94 -0.26 0.00 -3.05 0.00 0.00 64.05 59.84 1kei n THR 6 Cb 0.45 0.58 -0.17 0.00 -1.55 0.00 0.00 70.33 69.64 1kei n THR 6 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1kei s VAL 7 N -2.63 1.24 0.57 1.08 1.01 -1.26 -1.30 120.40 119.10 1kei s VAL 7 Ca 0.15 -0.51 0.06 0.00 0.00 0.00 0.00 61.98 61.68 1kei s VAL 7 Cb -0.01 -1.14 0.06 0.00 0.00 0.00 0.00 36.38 35.29 1kei s VAL 7 CO 0.11 0.38 0.48 -0.83 0.00 0.00 0.00 175.10 175.24 1kei s GLY 8 N 0.86 2.30 0.02 4.51 0.00 0.37 -4.94 107.32 110.44 1kei s GLY 8 Ca -0.10 -1.29 0.02 0.00 0.00 0.00 0.00 44.72 43.35 1kei s GLY 8 CO 0.01 -1.93 -0.08 0.54 0.00 0.00 0.00 173.10 171.64 1kei s VAL 9 N -2.80 0.58 0.22 1.40 0.11 -1.01 -1.58 120.40 117.32 1kei s VAL 9 Ca 0.36 -0.65 -0.07 0.00 -2.93 0.00 0.00 61.98 58.69 1kei s VAL 9 Cb -0.03 -0.55 0.03 0.00 -1.53 0.00 0.00 36.38 34.30 1kei s VAL 9 CO 0.23 -0.07 0.42 0.61 -3.33 0.00 0.00 175.10 172.96 1kei n GLY 10 N 2.27 1.58 3.14 6.54 0.00 -0.62 -0.06 105.19 118.03 1kei n GLY 10 Ca -0.17 -1.20 -0.27 0.00 0.00 0.00 0.00 46.02 44.38 1kei n GLY 10 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1kei s ARG 11 N -2.11 2.01 0.48 1.61 3.52 -0.51 -1.33 118.95 122.62 1kei s ARG 11 Ca 0.10 -0.64 -0.06 0.00 -0.13 0.00 0.00 55.73 55.00 1kei s ARG 11 Cb -0.02 -1.68 0.11 0.00 -1.56 0.00 0.00 34.95 31.79 1kei s ARG 11 CO 0.07 0.21 0.65 0.41 -0.81 0.00 0.00 175.30 175.84 1kei n GLY 12 N 3.29 -0.71 0.36 8.12 0.00 0.01 -4.11 105.19 112.16 1kei n GLY 12 Ca -0.19 -1.78 0.08 0.00 0.00 0.00 0.00 46.02 44.12 1kei n GLY 12 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1kei h VAL 13 N -1.13 0.97 -0.19 1.61 2.07 -1.90 -1.29 116.25 116.38 1kei h VAL 13 Ca -0.21 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1kei h VAL 13 Cb 0.63 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1kei h VAL 13 CO 0.17 0.15 0.00 0.18 0.02 0.00 0.00 177.57 178.09 1kei n LEU 14 N -4.51 1.44 0.00 2.57 4.77 -1.26 -4.91 117.00 115.10 1kei n LEU 14 Ca 0.14 -0.65 0.00 0.00 -0.03 0.00 0.00 56.01 55.47 1kei n LEU 14 Cb 0.30 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1kei n LEU 14 CO 0.32 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 1kei n GLY 15 N 1.03 0.68 3.81 -0.72 0.00 -0.49 -5.05 105.19 104.46 1kei n GLY 15 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1kei n GLY 15 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1kei s ASP 16 N -2.18 7.06 0.04 1.61 -4.77 -1.26 -4.77 116.67 112.41 1kei s ASP 16 Ca 0.00 1.33 -0.20 0.00 -3.30 0.00 0.00 52.55 50.38 1kei s ASP 16 Cb 0.00 -2.38 -0.06 0.00 -1.09 0.00 0.00 42.92 39.38 1kei s ASP 16 CO 0.00 0.16 0.59 -1.58 0.70 0.00 0.00 175.17 175.04 1kei s GLN 17 N -1.55 4.27 0.06 2.11 0.74 -1.26 -0.81 119.66 123.21 1kei s GLN 17 Ca 0.36 0.76 -0.14 0.00 0.05 0.00 0.00 55.36 56.39 1kei s GLN 17 Cb -0.18 -3.28 0.02 0.00 1.10 0.00 0.00 33.01 30.67 1kei s GLN 17 CO 0.21 0.52 0.32 -1.59 -0.55 0.00 0.00 175.29 174.20 1kei s LYS 18 N -0.72 0.85 0.03 1.67 -2.85 -0.44 -4.98 119.74 113.30 1kei s LYS 18 Ca 0.30 -0.56 -0.13 0.00 -1.00 0.00 0.00 55.97 54.58 1kei s LYS 18 Cb -0.19 0.37 -0.06 0.00 -2.06 0.00 0.00 37.83 35.89 1kei s LYS 18 CO 0.19 -0.28 0.41 -0.80 0.10 0.00 0.00 175.35 174.96 1kei s ASN 19 N -2.22 6.76 0.04 0.03 0.01 -1.26 -1.59 114.94 116.71 1kei s ASN 19 Ca -0.03 0.92 0.04 0.00 -0.71 0.00 0.00 52.86 53.08 1kei s ASN 19 Cb 0.00 -2.23 -0.02 0.00 0.41 0.00 0.00 41.25 39.41 1kei s ASN 19 CO -0.05 0.28 -0.12 0.27 -1.51 0.00 0.00 177.10 175.96 1kei s ILE 20 N -1.18 0.96 -0.11 0.60 -4.36 -0.61 -4.98 121.20 111.51 1kei s ILE 20 Ca 0.27 -0.94 -0.29 0.00 -0.26 0.00 0.00 60.65 59.43 1kei s ILE 20 Cb -0.16 -0.88 -0.01 0.00 1.25 0.00 0.00 42.46 42.65 1kei s ILE 20 CO 0.15 -0.05 0.97 0.20 0.24 0.00 0.00 174.94 176.45 1kei s ASN 21 N -1.12 7.19 0.39 4.36 -0.87 -1.26 -0.48 114.94 123.16 1kei s ASN 21 Ca -0.00 1.46 0.03 0.00 -1.57 0.00 0.00 52.86 52.79 1kei s ASN 21 Cb -0.08 -2.53 -0.04 0.00 -0.02 0.00 0.00 41.25 38.58 1kei s ASN 21 CO 0.01 -0.42 0.09 0.42 -2.57 0.00 0.00 177.10 174.63 1kei s THR 22 N 1.97 0.84 -0.05 1.60 -4.23 -0.42 -3.85 115.64 111.51 1kei s THR 22 Ca 0.46 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 59.00 1kei s THR 22 Cb -0.18 -2.47 0.01 0.00 1.34 0.00 0.00 72.50 71.20 1kei s THR 22 CO 0.17 0.00 -0.11 -0.89 -0.54 0.00 0.00 174.62 173.25 1kei s THR 23 N -3.20 1.03 -0.21 3.99 2.01 -0.53 -1.08 115.64 117.66 1kei s THR 23 Ca 0.26 -0.45 -0.08 0.00 0.31 0.00 0.00 61.69 61.73 1kei s THR 23 Cb 0.04 -0.93 -0.04 0.00 0.01 0.00 0.00 72.50 71.59 1kei s THR 23 CO 0.14 0.32 0.07 -0.47 -0.69 0.00 0.00 174.62 173.99 1kei s TYR 24 N 0.43 3.19 -0.44 4.92 5.04 0.95 0.09 117.35 131.53 1kei s TYR 24 Ca -0.09 -0.08 0.04 0.00 -2.44 0.00 0.00 57.07 54.50 1kei s TYR 24 Cb -0.13 -2.15 0.19 0.00 0.35 0.00 0.00 41.96 40.22 1kei s TYR 24 CO 0.02 -0.04 0.76 0.45 -1.34 0.00 0.00 175.55 175.41 1kei s SER 25 N 0.88 -1.26 0.00 4.32 0.15 -1.26 -1.32 113.70 115.20 1kei s SER 25 Ca 0.04 -1.11 0.00 0.00 0.70 0.00 0.00 55.95 55.58 1kei s SER 25 Cb -0.14 1.63 0.00 0.00 -1.71 0.00 0.00 66.02 65.81 1kei s SER 25 CO 0.03 -0.09 0.00 0.41 1.20 0.00 0.00 173.24 174.79 1kei n THR 26 N 3.50 0.00 -3.81 6.45 -1.04 -1.26 -4.77 114.28 113.35 1kei n THR 26 Ca 0.14 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.93 1kei n THR 26 Cb 0.58 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.04 1kei n THR 26 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1kei s TYR 27 N 0.00 2.71 -0.25 -1.42 2.02 -1.26 -4.99 117.35 114.16 1kei s TYR 27 Ca 0.00 -0.47 -0.09 0.00 -0.37 0.00 0.00 57.07 56.14 1kei s TYR 27 Cb 0.00 -1.99 -0.04 0.00 -0.40 0.00 0.00 41.96 39.53 1kei s TYR 27 CO 0.00 0.06 0.13 0.71 -1.57 0.00 0.00 175.55 174.88 1kei s TYR 28 N -2.47 3.20 0.11 2.71 1.51 0.69 -4.35 117.35 118.76 1kei s TYR 28 Ca 0.44 -0.02 0.04 0.00 -1.01 0.00 0.00 57.07 56.52 1kei s TYR 28 Cb -0.02 -2.27 -0.04 0.00 -0.11 0.00 0.00 41.96 39.52 1kei s TYR 28 CO 0.26 -0.13 0.09 0.71 -1.11 0.00 0.00 175.55 175.37 1kei s TYR 29 N 1.38 3.14 -1.32 2.71 1.51 0.11 -0.14 117.35 124.74 1kei s TYR 29 Ca 0.06 0.02 -0.16 0.00 -1.01 0.00 0.00 57.07 55.98 1kei s TYR 29 Cb -0.15 -1.56 0.08 0.00 -0.11 0.00 0.00 41.96 40.22 1kei s TYR 29 CO 0.06 0.52 1.81 1.28 -1.11 0.00 0.00 175.55 178.11 1kei n LEU 30 N 0.17 5.41 -3.70 -1.29 4.77 -0.43 -1.45 117.00 120.48 1kei n LEU 30 Ca -0.09 -4.05 -0.25 0.00 -0.03 0.00 0.00 56.01 51.60 1kei n LEU 30 Cb 0.53 -1.71 -0.17 0.00 -2.33 0.00 0.00 43.42 39.74 1kei n LEU 30 CO 0.43 0.44 -0.36 -1.58 -1.33 0.00 0.00 177.39 175.00 1kei s GLN 31 N 3.61 0.38 -0.43 3.23 0.74 -1.26 -1.80 119.66 124.13 1kei s GLN 31 Ca 0.51 -0.06 -0.16 0.00 0.05 0.00 0.00 55.36 55.71 1kei s GLN 31 Cb 0.05 -1.46 0.04 0.00 1.10 0.00 0.00 33.01 32.74 1kei s GLN 31 CO 0.04 -0.50 0.36 0.34 -0.55 0.00 0.00 175.29 174.98 1kei s ASP 32 N 2.01 6.14 0.00 6.67 -1.08 0.11 -3.03 116.67 127.49 1kei s ASP 32 Ca 0.02 -0.98 0.28 0.00 -0.52 0.00 0.00 52.55 51.35 1kei s ASP 32 Cb -0.15 -2.18 1.08 0.00 -1.46 0.00 0.00 42.92 40.21 1kei s ASP 32 CO -0.07 -0.55 1.76 0.59 0.52 0.00 0.00 175.17 177.43 1kei n ASN 33 N 5.29 1.45 0.02 -0.34 5.03 -1.26 -1.77 115.26 123.68 1kei n ASN 33 Ca -0.11 -1.48 0.13 0.00 0.87 0.00 0.00 54.58 53.99 1kei n ASN 33 Cb 0.46 -0.00 0.39 0.00 -1.02 0.00 0.00 39.78 39.61 1kei n ASN 33 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1kei n THR 34 N 0.13 0.14 -4.03 3.41 -2.24 -1.26 -4.74 114.28 105.69 1kei n THR 34 Ca 0.19 -0.08 -0.31 0.00 -2.27 0.00 0.00 64.05 61.57 1kei n THR 34 Cb 0.35 -0.20 -0.15 0.00 -2.10 0.00 0.00 70.33 68.22 1kei n THR 34 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1kei s ARG 35 N -3.04 2.12 4.02 -0.78 0.52 -1.26 -5.05 118.95 115.48 1kei s ARG 35 Ca 0.11 -1.13 0.00 0.00 -0.52 0.00 0.00 55.73 54.19 1kei s ARG 35 Cb 0.17 -2.71 0.00 0.00 0.52 0.00 0.00 34.95 32.93 1kei s ARG 35 CO 0.63 -0.52 0.00 0.41 0.02 0.00 0.00 175.30 175.84 1kei n GLY 36 N 4.55 2.48 0.17 -3.53 0.00 -1.26 -0.62 105.19 106.97 1kei n GLY 36 Ca -0.14 -0.30 0.01 0.00 0.00 0.00 0.00 46.02 45.59 1kei n GLY 36 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1kei n ASN 37 N 0.36 0.47 0.00 1.61 3.02 -0.70 -4.97 115.26 115.04 1kei n ASN 37 Ca 0.00 -2.00 0.00 0.00 -0.03 0.00 0.00 54.58 52.55 1kei n ASN 37 Cb 0.00 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 1kei n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1kei n GLY 38 N 0.60 2.65 3.15 7.41 0.00 0.21 -4.66 105.19 114.56 1kei n GLY 38 Ca 0.03 -1.88 -0.32 0.00 0.00 0.00 0.00 46.02 43.85 1kei n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kei s ILE 39 N -2.71 2.01 -0.07 -0.61 1.01 -0.73 -1.24 121.20 118.86 1kei s ILE 39 Ca 0.00 -0.94 0.05 0.00 0.00 0.00 0.00 60.65 59.75 1kei s ILE 39 Cb 0.00 -1.78 -0.00 0.00 0.01 0.00 0.00 42.46 40.68 1kei s ILE 39 CO 0.00 0.54 -0.23 -0.36 0.00 0.00 0.00 174.94 174.89 1kei s PHE 40 N 0.89 2.32 -0.11 3.97 0.08 0.74 -0.71 117.98 125.15 1kei s PHE 40 Ca -0.06 -0.82 0.04 0.00 0.12 0.00 0.00 56.93 56.22 1kei s PHE 40 Cb -0.15 -1.54 0.00 0.00 -0.57 0.00 0.00 43.02 40.75 1kei s PHE 40 CO -0.03 -0.30 -0.24 0.99 -0.10 0.00 0.00 175.22 175.54 1kei s THR 41 N 0.14 2.07 0.24 0.64 2.01 -0.74 -1.26 115.64 118.74 1kei s THR 41 Ca -0.11 -1.01 0.09 0.00 0.31 0.00 0.00 61.69 60.97 1kei s THR 41 Cb -0.15 -1.79 -0.04 0.00 0.01 0.00 0.00 72.50 70.52 1kei s THR 41 CO 0.06 0.56 -0.03 -0.31 -0.69 0.00 0.00 174.62 174.20 1kei s TYR 42 N 0.40 2.67 -0.31 4.92 1.51 0.17 -1.18 117.35 125.54 1kei s TYR 42 Ca -0.17 -0.22 -0.10 0.00 -1.01 0.00 0.00 57.07 55.57 1kei s TYR 42 Cb -0.18 -1.22 -0.01 0.00 -0.11 0.00 0.00 41.96 40.45 1kei s TYR 42 CO 0.08 0.60 0.15 0.34 -1.11 0.00 0.00 175.55 175.60 1kei s ASP 43 N -3.43 5.57 0.00 2.29 2.15 0.09 -1.40 116.67 121.95 1kei s ASP 43 Ca 0.30 -0.47 0.28 0.00 0.43 0.00 0.00 52.55 53.09 1kei s ASP 43 Cb -0.07 -2.01 1.06 0.00 -0.30 0.00 0.00 42.92 41.60 1kei s ASP 43 CO 0.19 -0.18 1.76 0.00 -0.17 0.00 0.00 175.17 176.77 1kei n ALA 44 N 4.99 2.86 -4.15 3.66 0.00 -0.24 -2.07 120.51 125.57 1kei n ALA 44 Ca -0.14 -0.31 -0.34 0.00 0.00 0.00 0.00 53.44 52.64 1kei n ALA 44 Cb 0.49 -1.26 -0.02 0.00 0.00 0.00 0.00 19.45 18.66 1kei n ALA 44 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1kei n LYS 45 N -0.84 -3.64 -0.99 0.00 5.02 -1.24 -1.04 118.16 115.42 1kei n LYS 45 Ca 0.14 0.42 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 1kei n LYS 45 Cb 0.30 -5.14 0.00 0.00 -0.02 0.00 0.00 35.03 30.17 1kei n LYS 45 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1kei n TYR 46 N -4.45 0.00 -3.23 2.13 4.01 0.11 -4.96 117.16 110.77 1kei n TYR 46 Ca 0.04 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.58 1kei n TYR 46 Cb 0.51 -1.11 0.03 0.00 -0.31 0.00 0.00 39.34 38.46 1kei n TYR 46 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1kei s ARG 47 N -1.10 2.42 0.00 -0.72 1.81 -0.21 -3.55 118.95 117.59 1kei s ARG 47 Ca 0.00 -1.62 0.13 0.00 -1.72 0.00 0.00 55.73 52.52 1kei s ARG 47 Cb 0.00 -2.55 0.19 0.00 -0.45 0.00 0.00 34.95 32.14 1kei s ARG 47 CO 0.00 -0.64 1.04 0.25 -0.68 0.00 0.00 175.30 175.27 1kei n THR 48 N -2.02 0.29 -2.68 0.02 -2.24 -1.26 -1.12 114.28 105.27 1kei n THR 48 Ca 0.10 -0.65 -0.42 0.00 -2.27 0.00 0.00 64.05 60.82 1kei n THR 48 Cb 0.62 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.87 1kei n THR 48 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1kei s THR 49 N -1.10 4.66 0.14 4.28 -4.23 -1.26 -5.02 115.64 113.11 1kei s THR 49 Ca 0.20 1.98 0.09 0.00 -1.18 0.00 0.00 61.69 62.77 1kei s THR 49 Cb 0.12 -4.27 -0.04 0.00 1.34 0.00 0.00 72.50 69.65 1kei s THR 49 CO 0.18 0.20 -0.14 -0.76 -0.54 0.00 0.00 174.62 173.55 1kei s LEU 50 N 0.73 2.84 0.06 4.79 1.43 -1.26 -3.85 118.68 123.42 1kei s LEU 50 Ca 0.51 -0.55 0.26 0.00 -1.03 0.00 0.00 54.13 53.32 1kei s LEU 50 Cb -0.23 -1.61 0.70 0.00 0.03 0.00 0.00 46.19 45.08 1kei s LEU 50 CO 0.29 0.15 1.58 -0.81 0.23 0.00 0.00 176.35 177.78 1kei n PRO 51 N 0.50 0.11 0.00 1.29 -0.04 -1.26 -5.11 135.00 130.49 1kei n PRO 51 Ca -0.13 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1kei n PRO 51 Cb 0.54 -1.59 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1kei n PRO 51 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1kei n GLY 52 N 1.43 -0.14 3.56 0.55 0.00 -1.25 -4.31 105.19 105.02 1kei n GLY 52 Ca 0.05 -1.87 -0.34 0.00 0.00 0.00 0.00 46.02 43.87 1kei n GLY 52 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1kei s SER 53 N -4.00 4.58 0.16 1.61 1.04 -0.88 -4.88 113.70 111.34 1kei s SER 53 Ca 0.00 -0.06 -0.34 0.00 0.48 0.00 0.00 55.95 56.03 1kei s SER 53 Cb 0.00 -1.22 -0.14 0.00 0.10 0.00 0.00 66.02 64.76 1kei s SER 53 CO 0.00 0.33 1.55 -0.11 0.98 0.00 0.00 173.24 176.00 1kei n LEU 54 N 2.42 3.01 -4.65 2.42 7.94 -1.26 -0.73 117.00 126.14 1kei n LEU 54 Ca -0.18 1.09 -0.42 0.00 -1.11 0.00 0.00 56.01 55.39 1kei n LEU 54 Cb 0.53 -1.41 -0.03 0.00 0.53 0.00 0.00 43.42 43.03 1kei n LEU 54 CO 0.27 -0.35 1.66 1.87 -1.11 0.00 0.00 177.39 179.74 1kei n TRP 55 N 3.26 2.40 -4.93 1.96 -0.00 -0.33 -4.80 117.44 115.00 1kei n TRP 55 Ca 0.17 -0.33 -0.33 0.00 -0.00 0.00 0.00 57.50 57.01 1kei n TRP 55 Cb 0.28 -2.79 -0.14 0.00 -0.00 0.00 0.00 31.31 28.67 1kei n TRP 55 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1kei s ALA 56 N 5.27 2.58 -0.00 5.87 0.00 -1.26 -1.32 121.76 132.90 1kei s ALA 56 Ca 0.92 -0.98 0.02 0.00 0.00 0.00 0.00 51.96 51.91 1kei s ALA 56 Cb -0.42 -0.95 -0.01 0.00 0.00 0.00 0.00 23.12 21.75 1kei s ALA 56 CO 0.41 0.50 -0.06 0.34 0.00 0.00 0.00 175.76 176.95 1kei s ASP 57 N -0.52 0.67 0.21 0.00 2.15 0.80 -4.95 116.67 115.03 1kei s ASP 57 Ca 0.07 -0.12 0.07 0.00 0.43 0.00 0.00 52.55 53.00 1kei s ASP 57 Cb -0.12 -0.07 0.13 0.00 -0.30 0.00 0.00 42.92 42.57 1kei s ASP 57 CO 0.01 0.06 1.48 0.00 -0.17 0.00 0.00 175.17 176.55 1kei h ALA 58 N 5.95 0.71 0.00 3.66 0.00 -1.94 0.20 119.26 127.84 1kei h ALA 58 Ca -0.28 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 53.96 1kei h ALA 58 Cb 1.19 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1kei h ALA 58 CO 0.50 0.89 0.00 -0.40 0.00 0.00 0.00 179.25 180.24 1kei n ASP 59 N -3.69 1.52 -1.03 0.00 5.68 -1.26 -4.73 116.55 113.04 1kei n ASP 59 Ca -0.02 -1.67 -0.13 0.00 -0.50 0.00 0.00 54.79 52.47 1kei n ASP 59 Cb 0.73 0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 40.65 1kei n ASP 59 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1kei n ASN 60 N -0.33 -4.62 -4.13 -1.12 5.15 -1.26 -4.99 115.26 103.96 1kei n ASN 60 Ca 0.00 0.33 -0.31 0.00 -0.60 0.00 0.00 54.58 54.00 1kei n ASN 60 Cb 0.23 -3.31 -0.16 0.00 -0.53 0.00 0.00 39.78 36.01 1kei n ASN 60 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1kei s GLN 61 N -3.15 2.78 -0.68 1.20 -0.21 -1.26 -2.39 119.66 115.95 1kei s GLN 61 Ca 0.00 -0.76 0.05 0.00 0.02 0.00 0.00 55.36 54.67 1kei s GLN 61 Cb 0.00 -2.31 0.26 0.00 1.00 0.00 0.00 33.01 31.97 1kei s GLN 61 CO 0.00 -0.07 0.85 1.19 -2.12 0.00 0.00 175.29 175.14 1kei n PHE 62 N 4.23 3.55 0.35 0.91 3.01 0.91 -4.81 117.46 125.61 1kei n PHE 62 Ca -0.20 -3.97 0.08 0.00 1.01 0.00 0.00 57.45 54.37 1kei n PHE 62 Cb 0.51 -0.63 0.12 0.00 -0.01 0.00 0.00 39.48 39.47 1kei n PHE 62 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1kei n PHE 63 N 0.78 0.23 -2.73 1.38 3.72 -1.26 -1.43 117.46 118.15 1kei n PHE 63 Ca 0.30 -0.17 -0.34 0.00 -0.05 0.00 0.00 57.45 57.18 1kei n PHE 63 Cb 0.40 -0.01 -0.06 0.00 -0.94 0.00 0.00 39.48 38.87 1kei n PHE 63 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1kei s ALA 64 N -1.22 3.03 0.34 4.37 0.00 -1.26 -4.91 121.76 122.12 1kei s ALA 64 Ca 0.24 0.49 0.04 0.00 0.00 0.00 0.00 51.96 52.73 1kei s ALA 64 Cb 0.15 -3.19 0.67 0.00 0.00 0.00 0.00 23.12 20.75 1kei s ALA 64 CO 0.21 0.01 1.95 0.66 0.00 0.00 0.00 175.76 178.59 1kei h SER 65 N 2.06 0.74 0.40 0.00 4.64 -1.96 -0.20 113.55 119.23 1kei h SER 65 Ca -0.49 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.81 1kei h SER 65 Cb 1.19 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1kei h SER 65 CO 0.61 0.48 -0.14 0.22 -0.87 0.00 0.00 176.83 177.14 1kei h TYR 66 N 0.84 0.00 0.00 4.77 3.20 -1.99 -2.85 116.97 120.93 1kei h TYR 66 Ca 0.33 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 62.01 1kei h TYR 66 Cb 0.22 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 1kei h TYR 66 CO -0.00 0.14 -0.89 -0.44 -1.64 0.00 0.00 178.16 175.33 1kei h ASP 67 N 0.00 0.00 -0.84 -2.11 3.32 -1.37 -3.39 116.42 112.03 1kei h ASP 67 Ca -0.00 0.00 0.14 0.00 0.02 0.00 0.00 57.03 57.19 1kei h ASP 67 Cb 0.37 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.78 1kei h ASP 67 CO 0.02 0.89 -0.36 0.00 -1.72 0.00 0.00 179.24 178.07 1kei h ALA 68 N 1.11 0.11 -0.43 3.45 0.00 -1.36 -0.46 119.26 121.68 1kei h ALA 68 Ca -0.01 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1kei h ALA 68 Cb 1.58 0.90 -0.02 0.00 0.00 0.00 0.00 17.79 20.26 1kei h ALA 68 CO 0.12 -0.63 0.23 -1.35 0.00 0.00 0.00 179.25 177.62 1kei h PRO 69 N -0.06 0.58 -0.30 0.00 0.11 -1.79 -2.32 132.00 128.22 1kei h PRO 69 Ca 0.31 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.26 1kei h PRO 69 Cb 0.58 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 1kei h PRO 69 CO -0.87 0.43 -0.21 0.00 -0.21 0.00 0.00 178.00 177.15 1kei h ALA 70 N 1.66 0.43 -0.21 -0.75 0.00 -1.38 -1.40 119.26 117.61 1kei h ALA 70 Ca 0.15 -0.36 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1kei h ALA 70 Cb 0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1kei h ALA 70 CO -0.03 0.38 -0.02 0.28 0.00 0.00 0.00 179.25 179.86 1kei h VAL 71 N 0.42 0.83 -0.33 0.00 2.07 -0.80 -0.98 116.25 117.46 1kei h VAL 71 Ca 0.06 -0.01 -0.16 0.00 0.82 0.00 0.00 66.70 67.40 1kei h VAL 71 Cb 0.76 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1kei h VAL 71 CO 0.06 0.01 -0.43 0.44 0.02 0.00 0.00 177.57 177.67 1kei h ASP 72 N 0.04 0.89 -0.75 0.57 3.32 -1.42 -0.40 116.42 118.67 1kei h ASP 72 Ca 0.10 -0.42 -0.04 0.00 0.02 0.00 0.00 57.03 56.69 1kei h ASP 72 Cb 0.14 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 1kei h ASP 72 CO -0.19 1.19 0.33 0.00 -1.72 0.00 0.00 179.24 178.85 1kei h ALA 73 N 0.84 0.97 -0.02 3.45 0.00 -1.07 0.76 119.26 124.19 1kei h ALA 73 Ca 0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1kei h ALA 73 Cb 1.00 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1kei h ALA 73 CO 0.10 0.57 -0.01 1.25 0.00 0.00 0.00 179.25 181.16 1kei h HIS 74 N 1.07 0.04 -0.22 0.00 -0.00 -1.09 -2.46 115.15 112.48 1kei h HIS 74 Ca 0.25 -0.01 -0.03 0.00 -0.00 0.00 0.00 60.37 60.59 1kei h HIS 74 Cb 0.17 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 27.56 1kei h HIS 74 CO 0.01 0.42 0.03 -0.92 -0.00 0.00 0.00 177.93 177.48 1kei h TYR 75 N -0.36 0.39 0.00 5.26 5.03 -0.95 -2.85 116.97 123.50 1kei h TYR 75 Ca 0.00 -0.06 -0.06 0.00 2.58 0.00 0.00 58.73 61.20 1kei h TYR 75 Cb 0.41 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.57 1kei h TYR 75 CO 0.06 0.50 -0.29 1.88 -1.32 0.00 0.00 178.16 178.99 1kei h TYR 76 N 0.17 0.00 -0.38 -3.82 0.05 -0.93 -1.78 116.97 110.28 1kei h TYR 76 Ca 0.07 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.75 1kei h TYR 76 Cb 0.32 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.05 1kei h TYR 76 CO 0.02 0.29 -0.18 0.00 -1.05 0.00 0.00 178.16 177.24 1kei h ALA 77 N 1.71 0.98 -0.39 3.88 0.00 -1.37 -1.23 119.26 122.84 1kei h ALA 77 Ca -0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 1kei h ALA 77 Cb 0.79 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1kei h ALA 77 CO 0.04 0.60 0.03 0.78 0.00 0.00 0.00 179.25 180.70 1kei h GLY 78 N 0.98 0.71 1.02 0.00 0.00 -1.12 -0.98 103.07 103.69 1kei h GLY 78 Ca 0.10 -0.50 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 1kei h GLY 78 CO 0.05 0.46 0.39 -2.08 0.00 0.00 0.00 176.54 175.36 1kei h VAL 79 N 0.49 1.24 -0.64 4.60 2.07 -1.14 -0.86 116.25 122.02 1kei h VAL 79 Ca 0.11 -0.66 -0.08 0.00 0.82 0.00 0.00 66.70 66.90 1kei h VAL 79 Cb 0.42 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1kei h VAL 79 CO 0.01 0.28 0.09 0.74 0.02 0.00 0.00 177.57 178.72 1kei h THR 80 N 1.08 1.26 -0.63 2.57 2.02 -1.07 -0.50 112.91 117.65 1kei h THR 80 Ca 0.27 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.41 1kei h THR 80 Cb 0.09 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 1kei h THR 80 CO -0.04 0.39 0.39 0.22 0.37 0.00 0.00 175.52 176.85 1kei h TYR 81 N 0.98 0.83 -0.79 3.16 5.03 -0.76 -2.11 116.97 123.31 1kei h TYR 81 Ca 0.19 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.48 1kei h TYR 81 Cb 0.45 -0.27 -0.04 0.00 1.55 0.00 0.00 36.73 38.42 1kei h TYR 81 CO 0.03 0.56 0.40 -0.44 -1.32 0.00 0.00 178.16 177.39 1kei h ASP 82 N 0.86 1.01 0.36 -2.11 3.32 -0.70 -1.29 116.42 117.87 1kei h ASP 82 Ca 0.23 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1kei h ASP 82 Cb -0.04 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 1kei h ASP 82 CO -0.04 0.85 -0.23 0.22 -1.72 0.00 0.00 179.24 178.32 1kei h TYR 83 N 1.10 -0.60 -0.60 4.55 3.20 -0.68 0.18 116.97 124.12 1kei h TYR 83 Ca 0.27 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.12 1kei h TYR 83 Cb 0.09 0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.55 1kei h TYR 83 CO 0.01 -0.36 0.29 1.88 -1.64 0.00 0.00 178.16 178.35 1kei h TYR 84 N -0.57 0.83 0.03 -3.82 0.05 -1.24 0.55 116.97 112.79 1kei h TYR 84 Ca -0.04 -0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.72 1kei h TYR 84 Cb 0.48 -0.26 0.00 0.00 1.01 0.00 0.00 36.73 37.95 1kei h TYR 84 CO -0.10 0.61 -0.01 -0.22 -1.05 0.00 0.00 178.16 177.38 1kei h LYS 85 N 0.84 -0.04 -0.13 4.88 3.64 -1.00 -0.70 116.57 124.07 1kei h LYS 85 Ca 0.21 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.39 1kei h LYS 85 Cb 0.08 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1kei h LYS 85 CO -0.03 0.54 -0.73 -0.91 -2.27 0.00 0.00 179.45 176.06 1kei h ASN 86 N -0.66 0.70 0.20 4.20 2.35 -0.58 -1.98 115.58 119.82 1kei h ASN 86 Ca -0.00 -0.45 -0.35 0.00 -0.55 0.00 0.00 56.30 54.95 1kei h ASN 86 Cb 0.60 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.74 1kei h ASN 86 CO 0.01 1.21 -1.94 0.52 -1.65 0.00 0.00 177.43 175.58 1kei n VAL 87 N -3.89 1.75 0.09 2.81 0.31 0.18 -4.54 118.33 115.03 1kei n VAL 87 Ca -0.05 -0.69 0.03 0.00 -0.01 0.00 0.00 64.34 63.62 1kei n VAL 87 Cb 0.71 -1.58 0.05 0.00 -0.91 0.00 0.00 33.84 32.11 1kei n VAL 87 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1kei n HIS 88 N -3.39 0.11 -3.86 3.52 8.25 -0.86 -5.00 115.22 114.00 1kei n HIS 88 Ca -0.29 -0.23 -0.29 0.00 -0.26 0.00 0.00 57.72 56.65 1kei n HIS 88 Cb 1.05 -0.02 0.04 0.00 1.12 0.00 0.00 29.99 32.18 1kei n HIS 88 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1kei n ASN 89 N 0.18 -5.07 -4.37 0.41 5.15 -0.74 -4.95 115.26 105.87 1kei n ASN 89 Ca 0.05 -0.74 -0.34 0.00 -0.60 0.00 0.00 54.58 52.95 1kei n ASN 89 Cb 0.23 -4.09 -0.14 0.00 -0.53 0.00 0.00 39.78 35.25 1kei n ASN 89 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1kei s ARG 90 N -6.56 3.42 -0.58 1.20 3.52 -0.34 -4.95 118.95 114.65 1kei s ARG 90 Ca 0.65 -0.64 -0.21 0.00 -0.13 0.00 0.00 55.73 55.40 1kei s ARG 90 Cb -0.32 -2.80 0.07 0.00 -1.56 0.00 0.00 34.95 30.35 1kei s ARG 90 CO 0.81 0.08 0.79 -0.51 -0.81 0.00 0.00 175.30 175.66 1kei s LEU 91 N 0.72 4.83 0.00 -0.88 1.43 -1.26 -2.65 118.68 120.87 1kei s LEU 91 Ca -0.04 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 52.02 1kei s LEU 91 Cb -0.15 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.63 1kei s LEU 91 CO 0.02 -1.17 0.00 -0.24 0.23 0.00 0.00 176.35 175.19 1kei n SER 92 N 6.83 -6.37 0.20 2.29 2.88 -1.26 -1.23 113.62 116.95 1kei n SER 92 Ca -0.06 0.69 0.06 0.00 -1.33 0.00 0.00 58.87 58.23 1kei n SER 92 Cb 0.45 -1.95 0.40 0.00 -0.75 0.00 0.00 64.21 62.36 1kei n SER 92 CO 0.00 0.00 0.00 0.10 -1.23 0.00 0.00 175.04 173.91 1kei h TYR 93 N -0.60 0.00 -0.02 0.66 -0.00 -1.92 -3.02 116.97 112.08 1kei h TYR 93 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.74 1kei h TYR 93 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.32 1kei h TYR 93 CO 0.00 0.34 -0.15 -0.40 -0.00 0.00 0.00 178.16 177.96 1kei n ASP 94 N -3.69 2.22 0.00 0.10 5.75 -1.26 -4.31 116.55 115.36 1kei n ASP 94 Ca -0.01 -1.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.12 1kei n ASP 94 Cb 0.44 0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.67 1kei n ASP 94 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1kei n GLY 95 N 1.33 0.86 1.37 6.12 0.00 -0.81 -4.86 105.19 109.20 1kei n GLY 95 Ca 0.14 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.17 1kei n GLY 95 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1kei n ASN 96 N 0.00 1.73 -2.83 1.61 5.15 -0.84 -4.35 115.26 115.72 1kei n ASN 96 Ca 0.00 -2.89 -0.21 0.00 -0.60 0.00 0.00 54.58 50.88 1kei n ASN 96 Cb 0.00 -0.41 0.04 0.00 -0.53 0.00 0.00 39.78 38.88 1kei n ASN 96 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1kei n ASN 97 N -0.35 -5.85 -4.74 1.20 5.03 -0.37 -4.92 115.26 105.26 1kei n ASN 97 Ca 0.15 -0.27 -0.41 0.00 0.87 0.00 0.00 54.58 54.92 1kei n ASN 97 Cb 0.92 -4.67 0.01 0.00 -1.02 0.00 0.00 39.78 35.03 1kei n ASN 97 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1kei n ALA 98 N -3.48 1.87 -1.78 5.41 0.00 -1.26 -1.73 120.51 119.54 1kei n ALA 98 Ca -0.10 0.29 -0.41 0.00 0.00 0.00 0.00 53.44 53.21 1kei n ALA 98 Cb 0.61 -2.36 -0.01 0.00 0.00 0.00 0.00 19.45 17.70 1kei n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kei s ALA 99 N -1.17 3.56 -0.24 0.00 0.00 -1.26 -4.61 121.76 118.03 1kei s ALA 99 Ca 0.59 1.49 -0.08 0.00 0.00 0.00 0.00 51.96 53.95 1kei s ALA 99 Cb -0.48 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.03 1kei s ALA 99 CO 0.60 -0.94 0.10 0.42 0.00 0.00 0.00 175.76 175.94 1kei s ILE 100 N -1.10 4.69 -0.04 0.00 1.01 -0.37 -5.01 121.20 120.37 1kei s ILE 100 Ca 0.52 -0.05 0.06 0.00 0.00 0.00 0.00 60.65 61.18 1kei s ILE 100 Cb -0.45 -3.19 -0.02 0.00 0.01 0.00 0.00 42.46 38.82 1kei s ILE 100 CO 0.60 0.34 -0.23 -0.13 0.00 0.00 0.00 174.94 175.52 1kei s ARG 101 N 1.37 2.41 0.01 2.79 0.52 -1.26 -0.19 118.95 124.60 1kei s ARG 101 Ca 0.06 -0.87 0.02 0.00 -0.52 0.00 0.00 55.73 54.42 1kei s ARG 101 Cb -0.15 -2.17 -0.01 0.00 0.52 0.00 0.00 34.95 33.14 1kei s ARG 101 CO 0.05 0.49 -0.07 -1.12 0.02 0.00 0.00 175.30 174.66 1kei s SER 102 N -0.41 0.82 -0.08 0.23 0.01 -0.39 -0.78 113.70 113.10 1kei s SER 102 Ca 0.04 -0.26 0.05 0.00 1.31 0.00 0.00 55.95 57.09 1kei s SER 102 Cb -0.12 -0.05 -0.00 0.00 0.21 0.00 0.00 66.02 66.06 1kei s SER 102 CO 0.01 -0.01 -0.23 -0.44 0.41 0.00 0.00 173.24 172.99 1kei s SER 103 N -0.62 2.86 0.44 2.44 0.01 -0.30 0.43 113.70 118.95 1kei s SER 103 Ca -0.01 -0.50 0.06 0.00 1.31 0.00 0.00 55.95 56.81 1kei s SER 103 Cb -0.05 -1.06 -0.04 0.00 0.21 0.00 0.00 66.02 65.08 1kei s SER 103 CO 0.00 0.18 0.16 0.68 0.41 0.00 0.00 173.24 174.67 1kei s VAL 104 N 0.15 2.08 -1.37 3.43 -7.23 -0.49 -0.96 120.40 116.00 1kei s VAL 104 Ca -0.11 -1.75 -0.09 0.00 -1.81 0.00 0.00 61.98 58.22 1kei s VAL 104 Cb -0.16 -2.82 0.01 0.00 0.56 0.00 0.00 36.38 33.98 1kei s VAL 104 CO 0.06 0.00 1.17 1.41 -0.31 0.00 0.00 175.10 177.43 1kei n HIS 105 N -1.26 -2.86 -2.59 2.82 8.25 -1.14 -1.08 115.22 117.36 1kei n HIS 105 Ca -0.04 1.01 -0.43 0.00 -0.26 0.00 0.00 57.72 58.01 1kei n HIS 105 Cb 0.65 -4.99 -0.02 0.00 1.12 0.00 0.00 29.99 26.75 1kei n HIS 105 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1kei s TYR 106 N -3.32 3.33 0.00 4.41 5.04 -0.95 0.04 117.35 125.91 1kei s TYR 106 Ca 0.59 1.41 0.00 0.00 -2.44 0.00 0.00 57.07 56.63 1kei s TYR 106 Cb -0.26 -3.30 0.00 0.00 0.35 0.00 0.00 41.96 38.75 1kei s TYR 106 CO 0.73 -0.72 0.00 0.45 -1.34 0.00 0.00 175.55 174.67 1kei n SER 107 N 5.39 -3.17 -4.09 4.32 2.88 -0.28 -4.37 113.62 114.30 1kei n SER 107 Ca 0.10 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.35 1kei n SER 107 Cb 0.47 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.77 1kei n SER 107 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1kei s GLN 108 N 0.00 2.40 -1.45 -1.46 -0.21 -1.26 -4.25 119.66 113.43 1kei s GLN 108 Ca 0.00 -0.63 -0.08 0.00 0.02 0.00 0.00 55.36 54.67 1kei s GLN 108 Cb 0.00 -1.99 0.04 0.00 1.00 0.00 0.00 33.01 32.06 1kei s GLN 108 CO 0.00 -0.02 0.69 0.41 -2.12 0.00 0.00 175.29 174.25 1kei n GLY 109 N 4.08 -0.51 3.63 3.09 0.00 -1.26 -4.92 105.19 109.30 1kei n GLY 109 Ca -0.20 0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 1kei n GLY 109 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1kei s TYR 110 N -3.14 3.15 -0.83 1.61 5.04 -1.26 -4.17 117.35 117.76 1kei s TYR 110 Ca 0.42 1.10 -0.04 0.00 -2.44 0.00 0.00 57.07 56.10 1kei s TYR 110 Cb -0.20 -3.62 0.11 0.00 0.35 0.00 0.00 41.96 38.60 1kei s TYR 110 CO 0.51 -0.75 2.55 0.09 -1.34 0.00 0.00 175.55 176.62 1kei n ASN 111 N 6.77 7.16 -3.57 4.32 3.02 -1.26 -1.07 115.26 130.63 1kei n ASN 111 Ca 0.10 -3.24 -0.04 0.00 -0.03 0.00 0.00 54.58 51.38 1kei n ASN 111 Cb 0.47 -1.27 -0.00 0.00 -0.61 0.00 0.00 39.78 38.37 1kei n ASN 111 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1kei s ASN 112 N 0.21 -0.10 -0.00 6.41 3.84 -1.26 -5.02 114.94 119.02 1kei s ASN 112 Ca 0.56 -0.55 -0.14 0.00 0.21 0.00 0.00 52.86 52.94 1kei s ASN 112 Cb 0.30 0.52 0.02 0.00 -0.55 0.00 0.00 41.25 41.54 1kei s ASN 112 CO -0.18 -0.99 0.28 0.00 -2.79 0.00 0.00 177.10 173.42 1kei s ALA 113 N -2.85 -0.70 0.12 1.71 0.00 -1.26 -1.48 121.76 117.30 1kei s ALA 113 Ca 0.16 0.19 -0.25 0.00 0.00 0.00 0.00 51.96 52.06 1kei s ALA 113 Cb -0.02 0.13 0.07 0.00 0.00 0.00 0.00 23.12 23.30 1kei s ALA 113 CO 0.04 -0.28 0.75 -0.59 0.00 0.00 0.00 175.76 175.68 1kei s PHE 114 N -1.59 -0.38 -0.22 0.00 -0.71 -0.19 -4.99 117.98 109.90 1kei s PHE 114 Ca -0.12 0.15 -0.09 0.00 -1.04 0.00 0.00 56.93 55.84 1kei s PHE 114 Cb -0.05 0.58 -0.04 0.00 -1.21 0.00 0.00 43.02 42.30 1kei s PHE 114 CO 0.02 -0.80 0.10 -0.46 -1.34 0.00 0.00 175.22 172.75 1kei s TRP 115 N -3.51 3.24 -0.82 3.49 -0.11 -1.26 -0.43 118.94 119.53 1kei s TRP 115 Ca 0.05 0.03 0.17 0.00 1.22 0.00 0.00 56.10 57.57 1kei s TRP 115 Cb -0.02 -2.18 0.69 0.00 -1.50 0.00 0.00 33.47 30.46 1kei s TRP 115 CO -0.07 0.01 1.61 0.27 -4.62 0.00 0.00 176.95 174.15 1kei n ASN 116 N 4.11 4.74 0.00 5.86 6.94 -0.46 -4.91 115.26 131.54 1kei n ASN 116 Ca -0.16 -2.58 0.00 0.00 -0.02 0.00 0.00 54.58 51.82 1kei n ASN 116 Cb 0.52 -0.57 0.00 0.00 -2.36 0.00 0.00 39.78 37.37 1kei n ASN 116 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1kei n GLY 117 N 0.78 1.37 0.00 4.83 0.00 -1.26 -4.74 105.19 106.18 1kei n GLY 117 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1kei n GLY 117 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1kei n SER 118 N 0.00 1.41 -3.38 1.61 7.64 -1.26 -5.13 113.62 114.51 1kei n SER 118 Ca 0.00 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.81 1kei n SER 118 Cb 0.00 0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 1kei n SER 118 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1kei s GLN 119 N -1.21 1.86 0.08 1.43 -2.07 -1.26 -4.75 119.66 113.74 1kei s GLN 119 Ca 0.00 -1.13 -0.14 0.00 -1.82 0.00 0.00 55.36 52.27 1kei s GLN 119 Cb 0.00 0.57 -0.06 0.00 -1.09 0.00 0.00 33.01 32.42 1kei s GLN 119 CO 0.00 -0.86 0.47 -1.64 -1.32 0.00 0.00 175.29 171.94 1kei s MET 120 N -2.94 3.93 -0.03 9.60 -1.94 0.04 -1.35 119.30 126.61 1kei s MET 120 Ca 0.14 0.42 0.01 0.00 -1.71 0.00 0.00 55.69 54.55 1kei s MET 120 Cb -0.05 -3.07 0.02 0.00 2.01 0.00 0.00 34.83 33.74 1kei s MET 120 CO 0.08 0.58 -0.05 0.08 -0.01 0.00 0.00 175.02 175.70 1kei s VAL 121 N -1.30 0.52 -0.08 -6.03 1.01 0.43 -1.15 120.40 113.80 1kei s VAL 121 Ca 0.32 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.17 1kei s VAL 121 Cb -0.16 -0.52 0.01 0.00 0.00 0.00 0.00 36.38 35.71 1kei s VAL 121 CO 0.17 0.20 -0.15 -0.31 0.00 0.00 0.00 175.10 175.01 1kei s TYR 122 N 0.67 1.78 0.67 5.22 2.02 -0.13 -1.02 117.35 126.56 1kei s TYR 122 Ca -0.09 -0.71 -0.05 0.00 -0.37 0.00 0.00 57.07 55.85 1kei s TYR 122 Cb -0.12 -1.27 0.06 0.00 -0.40 0.00 0.00 41.96 40.23 1kei s TYR 122 CO 0.00 -0.34 0.96 0.20 -1.57 0.00 0.00 175.55 174.80 1kei s GLY 123 N 0.66 1.73 0.00 0.71 0.00 -0.55 -2.23 107.32 107.64 1kei s GLY 123 Ca -0.14 -1.05 0.24 0.00 0.00 0.00 0.00 44.72 43.77 1kei s GLY 123 CO 0.04 -0.66 1.25 1.22 0.00 0.00 0.00 173.10 174.95 1kei n ASP 124 N -2.79 0.98 -0.11 1.64 8.00 -1.21 -2.86 116.55 120.19 1kei n ASP 124 Ca 0.08 -0.79 0.01 0.00 0.71 0.00 0.00 54.79 54.81 1kei n ASP 124 Cb 0.60 0.47 -0.01 0.00 -0.02 0.00 0.00 41.12 42.17 1kei n ASP 124 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1kei n GLY 125 N 1.45 -1.96 0.95 0.44 0.00 -0.23 -1.32 105.19 104.52 1kei n GLY 125 Ca 0.07 -1.47 0.12 0.00 0.00 0.00 0.00 46.02 44.74 1kei n GLY 125 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1kei n ASP 126 N -2.57 2.88 0.00 1.61 5.68 -1.16 -4.05 116.55 118.94 1kei n ASP 126 Ca -0.00 -1.91 0.00 0.00 -0.50 0.00 0.00 54.79 52.38 1kei n ASP 126 Cb 0.05 -0.15 0.00 0.00 -1.14 0.00 0.00 41.12 39.88 1kei n ASP 126 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1kei n GLY 127 N 1.38 2.21 0.66 6.12 0.00 0.14 -4.78 105.19 110.92 1kei n GLY 127 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 1kei n GLY 127 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1kei n GLN 128 N -2.00 0.23 0.11 1.61 1.13 -1.26 -4.77 117.38 112.43 1kei n GLN 128 Ca 0.00 0.10 -0.24 0.00 -1.94 0.00 0.00 57.00 54.92 1kei n GLN 128 Cb 0.00 -0.88 -0.15 0.00 0.11 0.00 0.00 30.24 29.31 1kei n GLN 128 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1kei h THR 129 N -0.40 1.21 -3.87 5.09 2.02 -1.94 -3.36 112.91 111.66 1kei h THR 129 Ca -0.17 -2.62 -0.13 0.00 0.77 0.00 0.00 66.41 64.26 1kei h THR 129 Cb 0.90 2.98 -0.18 0.00 -1.74 0.00 0.00 68.15 70.12 1kei h THR 129 CO -0.10 0.81 -0.56 -0.36 0.37 0.00 0.00 175.52 175.68 1kei s PHE 130 N -2.57 0.24 0.44 3.16 0.08 -1.26 0.02 117.98 118.08 1kei s PHE 130 Ca -0.12 -0.57 0.07 0.00 0.12 0.00 0.00 56.93 56.43 1kei s PHE 130 Cb 0.04 -0.17 -0.03 0.00 -0.57 0.00 0.00 43.02 42.29 1kei s PHE 130 CO 0.90 -0.35 0.28 0.96 -0.10 0.00 0.00 175.22 176.92 1kei s ILE 131 N -2.67 2.32 -0.49 0.64 -4.36 -0.68 -0.68 121.20 115.27 1kei s ILE 131 Ca -0.04 -1.54 -0.45 0.00 -0.26 0.00 0.00 60.65 58.36 1kei s ILE 131 Cb -0.01 -2.86 -0.19 0.00 1.25 0.00 0.00 42.46 40.65 1kei s ILE 131 CO -0.05 0.00 1.72 -2.65 0.24 0.00 0.00 174.94 174.20 1kei n PRO 132 N -1.43 0.00 0.31 0.37 -0.02 -0.44 -4.45 135.00 129.34 1kei n PRO 132 Ca 0.00 0.00 0.18 0.00 -2.02 0.00 0.00 63.50 61.67 1kei n PRO 132 Cb 0.64 -1.47 1.03 0.00 -0.02 0.00 0.00 33.50 33.68 1kei n PRO 132 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1kei h LEU 133 N 6.03 0.00 0.00 2.45 4.07 -1.78 -1.91 115.31 124.18 1kei h LEU 133 Ca -0.33 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.63 1kei h LEU 133 Cb 1.36 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.10 1kei h LEU 133 CO 0.99 0.00 0.00 -1.54 -1.08 0.00 0.00 178.44 176.81 1kei n SER 134 N -3.51 0.00 0.00 -0.43 3.41 -1.26 -2.43 113.62 109.39 1kei n SER 134 Ca -0.03 0.17 0.11 0.00 -0.26 0.00 0.00 58.87 58.87 1kei n SER 134 Cb 0.10 -0.34 0.55 0.00 -0.26 0.00 0.00 64.21 64.27 1kei n SER 134 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1kei n GLY 135 N 0.04 -1.15 3.41 5.00 0.00 -0.72 -4.27 105.19 107.50 1kei n GLY 135 Ca 0.06 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 1kei n GLY 135 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kei s GLY 136 N -2.74 1.83 0.34 -0.02 0.00 -1.02 -4.82 107.32 100.89 1kei s GLY 136 Ca 0.18 -1.37 0.05 0.00 0.00 0.00 0.00 44.72 43.57 1kei s GLY 136 CO 0.38 0.66 1.88 1.19 0.00 0.00 0.00 173.10 177.21 1kei h ILE 137 N 5.70 1.20 0.00 0.90 2.10 -1.89 -1.66 117.51 123.86 1kei h ILE 137 Ca -0.33 -0.79 -0.09 0.00 1.08 0.00 0.00 64.86 64.74 1kei h ILE 137 Cb 1.14 0.96 -0.01 0.00 -1.09 0.00 0.00 36.82 37.82 1kei h ILE 137 CO 0.61 0.27 -0.42 -2.24 -1.08 0.00 0.00 178.15 175.28 1kei h ASP 138 N 0.49 0.00 -0.09 2.19 3.04 -1.94 -1.15 116.42 118.96 1kei h ASP 138 Ca 0.11 0.00 -0.04 0.00 -3.24 0.00 0.00 57.03 53.86 1kei h ASP 138 Cb 0.33 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.62 1kei h ASP 138 CO 0.01 0.42 -0.10 0.58 -2.04 0.00 0.00 179.24 178.12 1kei h VAL 139 N 0.00 1.37 -0.24 4.15 2.07 -1.68 0.20 116.25 122.13 1kei h VAL 139 Ca -0.00 -1.27 0.01 0.00 0.82 0.00 0.00 66.70 66.25 1kei h VAL 139 Cb 0.80 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1kei h VAL 139 CO 0.06 0.36 0.14 0.58 0.02 0.00 0.00 177.57 178.73 1kei h VAL 140 N -0.20 1.04 -0.23 2.57 2.07 -1.18 -1.18 116.25 119.14 1kei h VAL 140 Ca 0.01 -0.10 -0.08 0.00 0.82 0.00 0.00 66.70 67.35 1kei h VAL 140 Cb 0.62 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1kei h VAL 140 CO 0.02 0.05 -0.20 0.00 0.02 0.00 0.00 177.57 177.47 1kei h ALA 141 N 1.10 1.23 0.01 1.67 0.00 -1.23 -1.33 119.26 120.72 1kei h ALA 141 Ca 0.09 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1kei h ALA 141 Cb -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1kei h ALA 141 CO -0.04 0.50 -0.01 1.25 0.00 0.00 0.00 179.25 180.96 1kei h HIS 142 N 0.38 -0.02 -0.47 0.00 6.17 -0.44 -1.10 115.15 119.67 1kei h HIS 142 Ca 0.06 -0.00 -0.04 0.00 0.71 0.00 0.00 60.37 61.10 1kei h HIS 142 Cb 0.57 0.01 -0.02 0.00 2.52 0.00 0.00 27.41 30.48 1kei h HIS 142 CO 0.02 0.05 0.12 0.93 0.71 0.00 0.00 177.93 179.75 1kei h GLU 143 N -0.08 0.74 0.00 5.26 4.39 -0.97 -2.69 114.58 121.24 1kei h GLU 143 Ca -0.00 -0.18 -0.06 0.00 0.34 0.00 0.00 59.36 59.46 1kei h GLU 143 Cb 0.07 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 1kei h GLU 143 CO 0.00 0.73 -0.29 1.25 -1.16 0.00 0.00 179.01 179.55 1kei h LEU 144 N 0.63 0.00 -1.39 1.33 5.85 -1.18 -1.75 115.31 118.81 1kei h LEU 144 Ca 0.15 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.81 1kei h LEU 144 Cb 0.32 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1kei h LEU 144 CO 0.00 0.29 -0.26 0.74 -0.34 0.00 0.00 178.44 178.87 1kei h THR 145 N 0.00 0.80 -0.24 1.05 2.02 -0.87 -1.27 112.91 114.41 1kei h THR 145 Ca -0.00 -1.04 -0.04 0.00 0.77 0.00 0.00 66.41 66.09 1kei h THR 145 Cb 0.57 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 1kei h THR 145 CO 0.04 0.25 -0.03 0.45 0.37 0.00 0.00 175.52 176.60 1kei h HIS 146 N 0.00 0.36 -0.45 3.16 3.86 -1.13 -0.40 115.15 120.54 1kei h HIS 146 Ca -0.00 -0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.09 1kei h HIS 146 Cb 0.62 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 1kei h HIS 146 CO 0.00 0.40 -0.04 0.00 0.86 0.00 0.00 177.93 179.15 1kei h ALA 147 N 1.63 0.61 -0.34 2.45 0.00 -1.26 -0.48 119.26 121.88 1kei h ALA 147 Ca 0.08 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1kei h ALA 147 Cb 0.29 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1kei h ALA 147 CO 0.01 0.45 0.19 0.28 0.00 0.00 0.00 179.25 180.18 1kei h VAL 148 N 0.67 1.13 -0.65 0.00 2.07 -1.11 -2.36 116.25 116.00 1kei h VAL 148 Ca 0.12 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1kei h VAL 148 Cb 0.56 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1kei h VAL 148 CO 0.03 0.13 0.39 0.74 0.02 0.00 0.00 177.57 178.88 1kei h THR 149 N 0.43 1.19 -0.74 2.57 2.02 -0.92 -2.06 112.91 115.40 1kei h THR 149 Ca 0.12 -0.42 0.06 0.00 0.77 0.00 0.00 66.41 66.93 1kei h THR 149 Cb 0.04 0.30 -0.05 0.00 -1.74 0.00 0.00 68.15 66.70 1kei h THR 149 CO -0.02 0.20 0.49 0.44 0.37 0.00 0.00 175.52 176.99 1kei h ASP 150 N 0.88 0.71 0.37 4.18 3.32 -0.79 0.15 116.42 125.23 1kei h ASP 150 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1kei h ASP 150 Cb -0.02 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.38 1kei h ASP 150 CO -0.04 0.46 -0.21 -1.22 -1.72 0.00 0.00 179.24 176.51 1kei n TYR 151 N -4.47 0.00 0.00 4.55 4.02 -0.91 -4.27 117.16 116.07 1kei n TYR 151 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.99 1kei n TYR 151 Cb 0.20 -0.19 0.00 0.00 -0.02 0.00 0.00 39.34 39.33 1kei n TYR 151 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1kei n THR 152 N -0.94 0.00 -0.15 -0.72 -2.24 -0.69 -4.91 114.28 104.62 1kei n THR 152 Ca 0.12 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.95 1kei n THR 152 Cb 0.32 -0.00 0.34 0.00 -2.10 0.00 0.00 70.33 68.88 1kei n THR 152 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1kei h ALA 153 N 0.74 1.65 -1.72 6.98 0.00 -1.51 -3.47 119.26 121.93 1kei h ALA 153 Ca 0.00 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.64 1kei h ALA 153 Cb 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1kei h ALA 153 CO 0.00 0.27 -0.31 0.41 0.00 0.00 0.00 179.25 179.62 1kei n GLY 154 N -1.45 -0.13 3.68 0.00 0.00 0.45 -1.98 105.19 105.77 1kei n GLY 154 Ca 0.09 -0.38 -0.54 0.00 0.00 0.00 0.00 46.02 45.19 1kei n GLY 154 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1kei n LEU 155 N -1.74 2.49 -4.75 0.99 4.77 -1.26 -4.27 117.00 113.22 1kei n LEU 155 Ca -0.14 1.06 -0.41 0.00 -0.03 0.00 0.00 56.01 56.49 1kei n LEU 155 Cb 0.61 -1.22 -0.02 0.00 -2.33 0.00 0.00 43.42 40.46 1kei n LEU 155 CO 0.17 -0.48 1.11 -0.63 -1.33 0.00 0.00 177.39 176.23 1kei s ILE 156 N 2.80 2.53 -1.52 -0.08 1.01 -0.29 -4.84 121.20 120.80 1kei s ILE 156 Ca 0.93 0.47 -0.10 0.00 0.00 0.00 0.00 60.65 61.95 1kei s ILE 156 Cb -0.94 -3.30 -0.08 0.00 0.01 0.00 0.00 42.46 38.15 1kei s ILE 156 CO 0.57 0.08 2.81 -1.22 0.00 0.00 0.00 174.94 177.18 1kei n TYR 157 N 1.92 2.35 -3.61 3.97 4.02 -1.26 -1.58 117.16 122.97 1kei n TYR 157 Ca 0.05 -2.94 -0.16 0.00 -0.01 0.00 0.00 57.90 54.85 1kei n TYR 157 Cb 0.40 -2.39 -0.07 0.00 -0.02 0.00 0.00 39.34 37.26 1kei n TYR 157 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 1kei s GLN 158 N 2.40 0.88 2.65 -0.72 0.74 -1.26 -4.83 119.66 119.54 1kei s GLN 158 Ca 0.65 0.45 0.00 0.00 0.05 0.00 0.00 55.36 56.51 1kei s GLN 158 Cb 0.17 0.42 0.00 0.00 1.10 0.00 0.00 33.01 34.70 1kei s GLN 158 CO -0.06 -0.22 0.00 0.09 -0.55 0.00 0.00 175.29 174.56 1kei n ASN 159 N 1.68 0.00 -0.20 6.67 3.02 -0.45 -1.28 115.26 124.70 1kei n ASN 159 Ca -0.17 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.35 1kei n ASN 159 Cb 0.56 0.00 0.18 0.00 -0.61 0.00 0.00 39.78 39.91 1kei n ASN 159 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1kei h GLU 160 N 0.00 0.98 -0.80 3.52 5.08 -1.90 -1.21 114.58 120.25 1kei h GLU 160 Ca 0.00 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 1kei h GLU 160 Cb 0.00 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.04 1kei h GLU 160 CO 0.00 0.77 0.37 0.77 -1.00 0.00 0.00 179.01 179.92 1kei h SER 161 N 0.97 1.05 -0.01 1.42 0.02 -1.56 -1.20 113.55 114.24 1kei h SER 161 Ca 0.23 -0.13 -0.12 0.00 -0.84 0.00 0.00 61.79 60.93 1kei h SER 161 Cb 0.13 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1kei h SER 161 CO -0.03 0.90 -0.38 1.23 -1.14 0.00 0.00 176.83 177.41 1kei h GLY 162 N 1.16 0.55 1.28 -3.77 0.00 -0.16 -1.22 103.07 100.92 1kei h GLY 162 Ca 0.27 -0.53 -0.10 0.00 0.00 0.00 0.00 47.33 46.97 1kei h GLY 162 CO -0.03 0.48 -0.10 0.00 0.00 0.00 0.00 176.54 176.89 1kei h ALA 163 N 1.16 0.94 -0.48 3.60 0.00 -0.70 -0.85 119.26 122.93 1kei h ALA 163 Ca 0.04 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 1kei h ALA 163 Cb 0.86 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1kei h ALA 163 CO 0.07 0.62 -0.02 0.82 0.00 0.00 0.00 179.25 180.75 1kei h ILE 164 N 0.77 1.26 -0.29 0.00 2.04 -0.97 -0.36 117.51 119.96 1kei h ILE 164 Ca 0.13 -1.10 0.05 0.00 1.00 0.00 0.00 64.86 64.94 1kei h ILE 164 Cb 0.61 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 1kei h ILE 164 CO 0.04 0.38 -0.01 -1.13 0.00 0.00 0.00 178.15 177.43 1kei h ASN 165 N 0.70 -0.13 -0.43 1.72 -0.73 -0.83 0.52 115.58 116.40 1kei h ASN 165 Ca 0.13 0.07 -0.02 0.00 1.87 0.00 0.00 56.30 58.35 1kei h ASN 165 Cb 0.53 0.12 -0.02 0.00 0.27 0.00 0.00 38.32 39.23 1kei h ASN 165 CO 0.03 -0.03 0.18 -0.33 -0.37 0.00 0.00 177.43 176.90 1kei h GLU 166 N 0.08 0.65 -0.62 6.67 4.39 -0.94 -2.66 114.58 122.14 1kei h GLU 166 Ca 0.14 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 1kei h GLU 166 Cb 0.19 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.70 1kei h GLU 166 CO -0.24 0.59 0.34 0.00 -1.16 0.00 0.00 179.01 178.54 1kei h ALA 167 N 1.02 0.79 -0.86 3.43 0.00 -0.59 -1.30 119.26 121.75 1kei h ALA 167 Ca 0.15 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1kei h ALA 167 Cb 0.18 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 1kei h ALA 167 CO -0.01 0.30 0.53 0.82 0.00 0.00 0.00 179.25 180.89 1kei h ILE 168 N 0.84 1.05 -0.38 0.00 1.08 -0.77 0.27 117.51 119.60 1kei h ILE 168 Ca 0.22 -0.33 -0.10 0.00 -0.39 0.00 0.00 64.86 64.26 1kei h ILE 168 Cb 0.04 -0.01 -0.02 0.00 -3.07 0.00 0.00 36.82 33.76 1kei h ILE 168 CO -0.04 0.18 -0.17 0.28 -0.69 0.00 0.00 178.15 177.72 1kei h SER 169 N 0.97 0.70 -0.32 1.72 0.02 -1.07 -1.16 113.55 114.41 1kei h SER 169 Ca 0.37 -0.22 -0.15 0.00 -0.84 0.00 0.00 61.79 60.95 1kei h SER 169 Cb 0.16 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.51 1kei h SER 169 CO -0.17 0.87 -0.40 0.44 -1.14 0.00 0.00 176.83 176.43 1kei h ASP 170 N 0.63 0.91 0.49 3.07 3.32 -0.22 0.07 116.42 124.69 1kei h ASP 170 Ca 0.10 -0.49 -0.02 0.00 0.02 0.00 0.00 57.03 56.64 1kei h ASP 170 Cb 0.63 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1kei h ASP 170 CO 0.04 1.22 -0.24 0.40 -1.72 0.00 0.00 179.24 178.95 1kei h ILE 171 N 0.62 0.52 0.00 0.35 2.04 -0.31 -0.87 117.51 119.86 1kei h ILE 171 Ca 0.04 -0.04 -0.08 0.00 1.00 0.00 0.00 64.86 65.79 1kei h ILE 171 Cb 0.99 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1kei h ILE 171 CO 0.10 0.01 -0.36 -0.26 0.00 0.00 0.00 178.15 177.63 1kei h PHE 172 N -0.68 0.00 -0.75 1.37 0.04 -1.28 -0.84 116.94 114.81 1kei h PHE 172 Ca -0.07 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.65 1kei h PHE 172 Cb 0.52 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.63 1kei h PHE 172 CO -0.04 0.36 0.24 0.78 -0.60 0.00 0.00 178.31 179.06 1kei h GLY 173 N 2.02 1.24 1.27 -1.45 0.00 -0.75 -0.83 103.07 104.57 1kei h GLY 173 Ca -0.00 -0.73 -0.19 0.00 0.00 0.00 0.00 47.33 46.41 1kei h GLY 173 CO 0.05 0.68 -0.60 -0.84 0.00 0.00 0.00 176.54 175.82 1kei h THR 174 N 1.10 1.29 -0.25 4.70 2.02 -0.75 -2.30 112.91 118.72 1kei h THR 174 Ca 0.24 -1.82 -0.07 0.00 0.77 0.00 0.00 66.41 65.54 1kei h THR 174 Cb 0.30 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.45 1kei h THR 174 CO -0.01 0.58 -0.13 -0.07 0.37 0.00 0.00 175.52 176.26 1kei h LEU 175 N 0.56 0.40 -0.63 2.58 3.38 -0.86 -1.44 115.31 119.30 1kei h LEU 175 Ca -0.00 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 1kei h LEU 175 Cb 1.20 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1kei h LEU 175 CO 0.13 0.56 -0.47 0.58 0.09 0.00 0.00 178.44 179.32 1kei h VAL 176 N 0.39 1.32 -0.75 1.22 2.07 -1.06 -0.08 116.25 119.36 1kei h VAL 176 Ca 0.07 -1.68 -0.03 0.00 0.82 0.00 0.00 66.70 65.88 1kei h VAL 176 Cb 0.46 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.88 1kei h VAL 176 CO 0.03 0.52 0.34 -0.08 0.02 0.00 0.00 177.57 178.40 1kei h GLU 177 N 0.41 1.08 -0.20 1.57 4.81 -0.79 -0.78 114.58 120.69 1kei h GLU 177 Ca 0.02 -0.16 -0.16 0.00 -0.13 0.00 0.00 59.36 58.92 1kei h GLU 177 Cb 0.98 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.17 1kei h GLU 177 CO 0.09 0.85 -0.55 0.74 -0.73 0.00 0.00 179.01 179.41 1kei h PHE 178 N 1.07 0.76 -0.73 0.92 0.04 -1.00 -2.10 116.94 115.89 1kei h PHE 178 Ca 0.26 -0.27 0.01 0.00 2.80 0.00 0.00 57.97 60.77 1kei h PHE 178 Cb 0.14 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 38.11 1kei h PHE 178 CO 0.01 1.02 0.48 -0.92 -0.60 0.00 0.00 178.31 178.30 1kei h TYR 179 N 0.46 0.91 -0.00 -0.55 3.20 -0.27 -1.28 116.97 119.43 1kei h TYR 179 Ca 0.01 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1kei h TYR 179 Cb 1.11 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.07 1kei h TYR 179 CO 0.05 0.56 -0.03 0.00 -1.64 0.00 0.00 178.16 177.10 1kei n ALA 180 N -2.30 2.44 -3.89 1.82 0.00 -0.37 -4.92 120.51 113.29 1kei n ALA 180 Ca 0.07 -0.13 -0.27 0.00 0.00 0.00 0.00 53.44 53.12 1kei n ALA 180 Cb 0.03 -1.45 0.01 0.00 0.00 0.00 0.00 19.45 18.04 1kei n ALA 180 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1kei n ASN 181 N -1.45 -2.34 -4.27 0.00 2.85 -0.49 -4.91 115.26 104.65 1kei n ASN 181 Ca 0.08 -0.87 -0.43 0.00 -0.11 0.00 0.00 54.58 53.25 1kei n ASN 181 Cb 0.32 -3.62 -0.03 0.00 1.24 0.00 0.00 39.78 37.69 1kei n ASN 181 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1kei s LYS 182 N -6.42 3.74 -1.27 1.20 2.36 -1.10 -4.71 119.74 113.54 1kei s LYS 182 Ca 0.29 -3.01 -0.25 0.00 -2.55 0.00 0.00 55.97 50.46 1kei s LYS 182 Cb -0.15 -4.33 0.03 0.00 -1.05 0.00 0.00 37.83 32.33 1kei s LYS 182 CO 0.85 -1.25 0.58 0.09 1.55 0.00 0.00 175.35 177.16 1kei n ASN 183 N 2.97 -3.28 -4.76 1.43 3.02 -1.26 -4.84 115.26 108.54 1kei n ASN 183 Ca 0.20 -1.23 -0.38 0.00 -0.03 0.00 0.00 54.58 53.13 1kei n ASN 183 Cb 0.40 -2.04 0.02 0.00 -0.61 0.00 0.00 39.78 37.56 1kei n ASN 183 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1kei s PRO 184 N -7.13 3.43 0.40 3.52 0.04 -1.26 -5.03 135.00 128.96 1kei s PRO 184 Ca 0.38 2.13 -0.14 0.00 0.04 0.00 0.00 61.00 63.41 1kei s PRO 184 Cb -0.19 -2.39 0.06 0.00 0.04 0.00 0.00 34.50 32.02 1kei s PRO 184 CO 0.95 -0.92 0.78 0.16 0.04 0.00 0.00 177.00 178.02 1kei s ASP 185 N -0.99 0.08 -0.38 6.66 1.47 -1.26 -5.05 116.67 117.21 1kei s ASP 185 Ca 0.67 -1.23 0.06 0.00 1.18 0.00 0.00 52.55 53.23 1kei s ASP 185 Cb -0.38 0.86 0.56 0.00 -0.34 0.00 0.00 42.92 43.63 1kei s ASP 185 CO 0.45 -1.71 1.66 0.79 0.68 0.00 0.00 175.17 177.04 1kei n TRP 186 N -0.54 2.04 -4.18 2.11 7.02 -1.26 -4.94 117.44 117.69 1kei n TRP 186 Ca -0.08 -1.83 -0.24 0.00 -1.02 0.00 0.00 57.50 54.32 1kei n TRP 186 Cb 0.60 -0.72 -0.06 0.00 -2.42 0.00 0.00 31.31 28.70 1kei n TRP 186 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 1kei s GLU 187 N -3.33 2.61 -0.18 -0.99 0.41 -1.26 -0.63 118.70 115.33 1kei s GLU 187 Ca 0.51 -1.12 -0.01 0.00 -0.41 0.00 0.00 54.97 53.94 1kei s GLU 187 Cb 0.44 -2.42 -0.00 0.00 -1.78 0.00 0.00 34.13 30.37 1kei s GLU 187 CO 0.04 0.43 -0.11 0.42 -0.49 0.00 0.00 175.26 175.54 1kei s ILE 188 N -1.97 2.95 -0.31 -1.63 -1.09 0.27 -4.69 121.20 114.73 1kei s ILE 188 Ca 0.30 -0.66 0.00 0.00 -2.23 0.00 0.00 60.65 58.06 1kei s ILE 188 Cb -0.08 -2.28 0.00 0.00 -1.58 0.00 0.00 42.46 38.51 1kei s ILE 188 CO 0.21 0.49 0.00 0.61 -1.23 0.00 0.00 174.94 175.02 1kei n GLY 189 N 4.26 0.60 0.32 6.18 0.00 -1.26 -1.17 105.19 114.12 1kei n GLY 189 Ca -0.19 -0.42 0.14 0.00 0.00 0.00 0.00 46.02 45.55 1kei n GLY 189 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1kei h GLU 190 N 0.35 0.00 0.00 1.61 9.09 -1.84 -1.89 114.58 121.91 1kei h GLU 190 Ca -0.06 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.32 1kei h GLU 190 Cb 0.31 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.41 1kei h GLU 190 CO 0.09 0.00 -0.15 -0.44 0.05 0.00 0.00 179.01 178.55 1kei h ASP 191 N 0.00 0.00 -0.00 3.06 3.32 -1.92 -3.32 116.42 117.56 1kei h ASP 191 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1kei h ASP 191 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1kei h ASP 191 CO -0.00 0.15 -0.01 1.33 -1.72 0.00 0.00 179.24 178.99 1kei n VAL 192 N -3.21 0.00 -3.35 -1.35 0.24 -0.93 -4.90 118.33 104.83 1kei n VAL 192 Ca 0.02 -0.50 -0.38 0.00 -2.04 0.00 0.00 64.34 61.44 1kei n VAL 192 Cb 0.47 1.02 -0.06 0.00 -1.47 0.00 0.00 33.84 33.80 1kei n VAL 192 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1kei s TYR 193 N -0.31 3.63 -0.49 6.34 5.04 -0.76 -1.68 117.35 129.13 1kei s TYR 193 Ca 0.01 1.00 -0.26 0.00 -2.44 0.00 0.00 57.07 55.38 1kei s TYR 193 Cb 0.01 -2.47 0.04 0.00 0.35 0.00 0.00 41.96 39.88 1kei s TYR 193 CO 0.02 0.38 0.58 0.25 -1.34 0.00 0.00 175.55 175.43 1kei n THR 194 N 2.80 -3.25 0.24 4.34 -2.24 0.10 -4.82 114.28 111.46 1kei n THR 194 Ca -0.09 0.04 0.17 0.00 -2.27 0.00 0.00 64.05 61.90 1kei n THR 194 Cb 0.52 -2.95 0.88 0.00 -2.10 0.00 0.00 70.33 66.67 1kei n THR 194 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1kei h PRO 195 N 1.33 0.00 -0.01 -0.78 0.13 -1.83 -0.39 132.00 130.46 1kei h PRO 195 Ca -0.53 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1kei h PRO 195 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1kei h PRO 195 CO 0.24 0.00 -0.04 0.41 -0.23 0.00 0.00 178.00 178.38 1kei n GLY 196 N -1.35 -0.44 2.90 1.56 0.00 -1.26 -4.74 105.19 101.85 1kei n GLY 196 Ca 0.00 -0.35 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 1kei n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kei s ILE 197 N -2.11 1.04 0.24 -0.61 1.01 -0.16 -5.14 121.20 115.48 1kei s ILE 197 Ca 0.38 -0.39 -0.04 0.00 0.00 0.00 0.00 60.65 60.60 1kei s ILE 197 Cb 0.21 -1.11 -0.05 0.00 0.01 0.00 0.00 42.46 41.51 1kei s ILE 197 CO 0.38 0.29 0.48 -0.94 0.00 0.00 0.00 174.94 175.15 1kei s SER 198 N 1.69 6.46 0.00 3.58 1.04 -1.26 -4.38 113.70 120.83 1kei s SER 198 Ca 0.04 0.64 0.00 0.00 0.48 0.00 0.00 55.95 57.11 1kei s SER 198 Cb -0.13 -2.11 0.00 0.00 0.10 0.00 0.00 66.02 63.87 1kei s SER 198 CO -0.08 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 174.65 1kei n GLY 199 N -0.60 1.12 3.83 7.32 0.00 -1.26 -5.04 105.19 110.56 1kei n GLY 199 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 1kei n GLY 199 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1kei n ASP 200 N 0.00 2.68 -3.19 1.61 5.75 -1.26 -5.15 116.55 116.99 1kei n ASP 200 Ca 0.00 -2.85 -0.07 0.00 -0.01 0.00 0.00 54.79 51.86 1kei n ASP 200 Cb 0.00 -0.10 0.02 0.00 -1.03 0.00 0.00 41.12 40.01 1kei n ASP 200 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1kei s SER 201 N -4.29 -0.03 -0.01 -1.12 1.04 -1.26 -4.56 113.70 103.46 1kei s SER 201 Ca 0.35 -0.92 -0.20 0.00 0.48 0.00 0.00 55.95 55.66 1kei s SER 201 Cb -0.03 0.72 -0.25 0.00 0.10 0.00 0.00 66.02 66.56 1kei s SER 201 CO 0.23 -1.41 1.06 0.25 0.98 0.00 0.00 173.24 174.34 1kei h LEU 202 N 2.00 0.50 -7.91 2.42 5.85 -1.41 -3.47 115.31 113.29 1kei h LEU 202 Ca -0.29 -0.80 -0.11 0.00 0.84 0.00 0.00 57.88 57.52 1kei h LEU 202 Cb 1.24 -0.15 -0.16 0.00 0.37 0.00 0.00 40.66 41.95 1kei h LEU 202 CO 0.37 1.24 -0.49 -0.13 -0.34 0.00 0.00 178.44 179.08 1kei s ARG 203 N -3.07 0.68 -0.08 1.25 0.52 -1.21 -5.00 118.95 112.04 1kei s ARG 203 Ca -0.13 -0.87 0.03 0.00 -0.52 0.00 0.00 55.73 54.23 1kei s ARG 203 Cb 0.03 0.27 0.01 0.00 0.52 0.00 0.00 34.95 35.77 1kei s ARG 203 CO 0.82 -0.18 -0.16 0.45 0.02 0.00 0.00 175.30 176.25 1kei s SER 204 N -2.46 2.19 0.00 0.23 0.15 -1.26 -0.57 113.70 111.98 1kei s SER 204 Ca -0.00 -0.38 0.04 0.00 0.70 0.00 0.00 55.95 56.31 1kei s SER 204 Cb 0.02 -1.01 -0.25 0.00 -1.71 0.00 0.00 66.02 63.08 1kei s SER 204 CO -0.07 0.07 0.84 0.24 1.20 0.00 0.00 173.24 175.51 1kei h MET 205 N 6.94 0.11 -0.07 5.44 0.00 -1.22 -2.60 114.93 123.54 1kei h MET 205 Ca -0.28 -0.19 -0.15 0.00 0.00 0.00 0.00 59.70 59.08 1kei h MET 205 Cb 1.20 0.07 -0.01 0.00 0.00 0.00 0.00 31.60 32.86 1kei h MET 205 CO 0.47 0.88 -0.62 0.66 0.00 0.00 0.00 176.91 178.30 1kei h SER 206 N 0.03 0.30 -1.55 1.22 4.64 -1.88 -3.32 113.55 113.00 1kei h SER 206 Ca -0.22 -0.18 -0.35 0.00 -0.47 0.00 0.00 61.79 60.57 1kei h SER 206 Cb 1.97 -0.09 -0.26 0.00 -0.31 0.00 0.00 62.40 63.71 1kei h SER 206 CO 0.12 0.85 -0.72 -0.67 -0.87 0.00 0.00 176.83 175.54 1kei n ASP 207 N -3.87 -2.08 -0.27 4.97 2.03 -1.26 -5.01 116.55 111.07 1kei n ASP 207 Ca -0.03 -2.70 0.16 0.00 0.52 0.00 0.00 54.79 52.74 1kei n ASP 207 Cb 0.63 0.72 0.44 0.00 -0.72 0.00 0.00 41.12 42.18 1kei n ASP 207 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1kei h PRO 208 N 5.17 0.54 0.00 -0.67 0.11 -1.67 -1.41 132.00 134.06 1kei h PRO 208 Ca 0.14 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1kei h PRO 208 Cb 1.01 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1kei h PRO 208 CO 0.19 0.36 0.00 0.00 -0.21 0.00 0.00 178.00 178.34 1kei h ALA 209 N 1.61 1.00 -0.59 -0.75 0.00 -1.73 -2.21 119.26 116.58 1kei h ALA 209 Ca 0.49 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.53 1kei h ALA 209 Cb 1.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1kei h ALA 209 CO -0.23 0.00 0.41 -0.22 0.00 0.00 0.00 179.25 179.21 1kei h LYS 210 N 0.00 0.21 -0.21 0.00 3.64 -1.54 -0.61 116.57 118.06 1kei h LYS 210 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1kei h LYS 210 Cb 0.06 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1kei h LYS 210 CO 0.00 0.14 0.00 0.66 -2.27 0.00 0.00 179.45 177.98 1kei n TYR 211 N -4.43 0.62 -0.61 1.91 4.01 -0.88 -4.96 117.16 112.81 1kei n TYR 211 Ca 0.11 -0.80 0.00 0.00 -0.16 0.00 0.00 57.90 57.05 1kei n TYR 211 Cb 0.51 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 1kei n TYR 211 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1kei n GLY 212 N -0.48 0.75 3.84 2.72 0.00 -0.24 -5.06 105.19 106.73 1kei n GLY 212 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1kei n GLY 212 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1kei s ASP 213 N -2.46 6.86 0.40 1.61 1.01 -0.90 -4.92 116.67 118.27 1kei s ASP 213 Ca 0.00 1.22 -0.26 0.00 0.71 0.00 0.00 52.55 54.22 1kei s ASP 213 Cb 0.00 -2.35 -0.09 0.00 1.01 0.00 0.00 42.92 41.49 1kei s ASP 213 CO 0.00 -0.03 1.34 -2.16 0.21 0.00 0.00 175.17 174.52 1kei s PRO 214 N -2.38 3.99 -0.09 8.23 0.04 -1.26 -2.18 135.00 141.35 1kei s PRO 214 Ca 0.46 2.24 0.13 0.00 0.04 0.00 0.00 61.00 63.86 1kei s PRO 214 Cb -0.14 -2.80 0.19 0.00 0.04 0.00 0.00 34.50 31.79 1kei s PRO 214 CO 0.20 -0.50 1.08 -0.40 0.04 0.00 0.00 177.00 177.41 1kei n ASP 215 N 0.20 1.97 -3.61 6.66 5.75 -1.26 -2.69 116.55 123.57 1kei n ASP 215 Ca 0.03 -2.69 -0.15 0.00 -0.01 0.00 0.00 54.79 51.97 1kei n ASP 215 Cb 0.43 -0.31 -0.07 0.00 -1.03 0.00 0.00 41.12 40.14 1kei n ASP 215 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 1kei s HIS 216 N -2.12 -0.68 0.52 2.11 5.04 -1.26 -4.72 115.29 114.18 1kei s HIS 216 Ca 0.21 1.50 0.20 0.00 -1.54 0.00 0.00 55.06 55.43 1kei s HIS 216 Cb 0.19 0.30 1.30 0.00 0.04 0.00 0.00 32.58 34.41 1kei s HIS 216 CO 0.02 -0.44 2.07 -0.92 -2.34 0.00 0.00 174.74 173.13 1kei h TYR 217 N 4.31 0.04 0.00 3.88 3.20 -0.57 -0.73 116.97 127.11 1kei h TYR 217 Ca -0.28 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.59 1kei h TYR 217 Cb 1.16 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.41 1kei h TYR 217 CO 0.39 0.02 0.00 0.66 -1.64 0.00 0.00 178.16 177.59 1kei h SER 218 N 0.04 0.00 -0.50 -2.11 4.64 -1.88 -2.34 113.55 111.39 1kei h SER 218 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1kei h SER 218 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1kei h SER 218 CO -0.01 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.24 1kei n LYS 219 N -2.64 3.30 -1.84 4.77 5.02 -0.28 -5.01 118.16 121.47 1kei n LYS 219 Ca 0.00 -2.65 -0.39 0.00 -2.02 0.00 0.00 58.31 53.26 1kei n LYS 219 Cb 0.20 -1.70 0.03 0.00 -0.02 0.00 0.00 35.03 33.55 1kei n LYS 219 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1kei s ARG 220 N -1.75 3.34 0.00 1.97 1.70 -0.88 -4.67 118.95 118.66 1kei s ARG 220 Ca 0.42 2.22 -0.28 0.00 -0.47 0.00 0.00 55.73 57.62 1kei s ARG 220 Cb 0.27 -2.37 -0.04 0.00 -0.57 0.00 0.00 34.95 32.24 1kei s ARG 220 CO 0.20 -1.02 0.90 -0.47 -1.08 0.00 0.00 175.30 173.82 1kei s TYR 221 N -1.30 3.66 -0.45 5.89 5.04 -1.26 -4.95 117.35 123.98 1kei s TYR 221 Ca 0.68 1.59 0.08 0.00 -2.44 0.00 0.00 57.07 56.98 1kei s TYR 221 Cb -0.40 -3.02 0.23 0.00 0.35 0.00 0.00 41.96 39.12 1kei s TYR 221 CO 0.48 0.06 1.18 0.25 -1.34 0.00 0.00 175.55 176.18 1kei n THR 222 N 3.66 1.23 -0.74 4.34 -2.24 -1.26 -4.83 114.28 114.45 1kei n THR 222 Ca 0.03 -1.22 0.00 0.00 -2.27 0.00 0.00 64.05 60.60 1kei n THR 222 Cb 0.51 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 1kei n THR 222 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1kei n GLY 223 N -0.12 -0.96 0.00 3.38 0.00 -1.26 -5.03 105.19 101.20 1kei n GLY 223 Ca 0.09 -1.67 0.06 0.00 0.00 0.00 0.00 46.02 44.51 1kei n GLY 223 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1kei n THR 224 N -1.38 0.00 -1.66 2.61 -2.24 -1.26 -4.30 114.28 106.05 1kei n THR 224 Ca 0.00 -0.21 -0.34 0.00 -2.27 0.00 0.00 64.05 61.23 1kei n THR 224 Cb 0.00 0.90 0.07 0.00 -2.10 0.00 0.00 70.33 69.19 1kei n THR 224 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1kei s GLN 225 N -2.32 2.52 -1.41 -0.78 -0.21 -1.26 -2.77 119.66 113.42 1kei s GLN 225 Ca 0.04 1.66 -0.08 0.00 0.02 0.00 0.00 55.36 57.00 1kei s GLN 225 Cb 0.10 -1.89 0.04 0.00 1.00 0.00 0.00 33.01 32.26 1kei s GLN 225 CO 0.54 -1.52 0.94 -3.47 -2.12 0.00 0.00 175.29 169.66 1kei n ASP 226 N -2.38 -3.79 -3.75 5.90 2.03 -1.26 -0.58 116.55 112.71 1kei n ASP 226 Ca 0.12 -0.74 -0.29 0.00 0.52 0.00 0.00 54.79 54.41 1kei n ASP 226 Cb 0.51 -4.24 0.02 0.00 -0.72 0.00 0.00 41.12 36.68 1kei n ASP 226 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1kei n ASN 227 N -2.96 -4.65 0.00 1.67 4.13 -1.22 -1.27 115.26 110.97 1kei n ASN 227 Ca -0.09 -0.68 0.00 0.00 1.68 0.00 0.00 54.58 55.49 1kei n ASN 227 Cb 0.59 -3.74 0.00 0.00 -1.54 0.00 0.00 39.78 35.09 1kei n ASN 227 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1kei n GLY 228 N -1.56 0.82 2.07 7.41 0.00 -0.54 -1.34 105.19 112.06 1kei n GLY 228 Ca 0.02 -0.58 -0.07 0.00 0.00 0.00 0.00 46.02 45.39 1kei n GLY 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kei n GLY 229 N -1.89 0.45 0.27 -0.02 0.00 0.25 -4.41 105.19 99.84 1kei n GLY 229 Ca 0.00 -0.38 0.01 0.00 0.00 0.00 0.00 46.02 45.65 1kei n GLY 229 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1kei h VAL 230 N -0.78 1.18 -0.01 1.61 -1.51 -1.41 0.96 116.25 116.29 1kei h VAL 230 Ca -0.17 -0.70 0.00 0.00 -1.23 0.00 0.00 66.70 64.60 1kei h VAL 230 Cb 1.11 0.95 0.00 0.00 -2.13 0.00 0.00 31.29 31.22 1kei h VAL 230 CO 0.17 0.24 -0.38 1.41 -1.23 0.00 0.00 177.57 177.78 1kei n HIS 231 N -4.31 0.00 -0.09 5.19 8.25 -1.26 -3.66 115.22 119.34 1kei n HIS 231 Ca 0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.36 1kei n HIS 231 Cb 0.22 -0.14 -0.04 0.00 1.12 0.00 0.00 29.99 31.15 1kei n HIS 231 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1kei n ILE 232 N -0.88 1.48 0.42 1.59 5.41 -0.82 -4.43 119.36 122.12 1kei n ILE 232 Ca 0.10 0.09 0.06 0.00 1.00 0.00 0.00 62.75 63.99 1kei n ILE 232 Cb 0.35 -2.28 0.25 0.00 -0.71 0.00 0.00 39.64 37.25 1kei n ILE 232 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1kei n ASN 233 N -4.48 0.00 0.27 4.38 3.02 0.27 -1.95 115.26 116.78 1kei n ASN 233 Ca -0.18 0.45 0.14 0.00 -0.03 0.00 0.00 54.58 54.95 1kei n ASN 233 Cb 0.50 -0.47 0.78 0.00 -0.61 0.00 0.00 39.78 39.98 1kei n ASN 233 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1kei h SER 234 N 0.00 0.00 -0.17 6.41 4.64 -1.75 -2.25 113.55 120.44 1kei h SER 234 Ca 0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1kei h SER 234 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1kei h SER 234 CO 0.00 0.09 0.12 1.23 -0.87 0.00 0.00 176.83 177.40 1kei h GLY 235 N 0.82 0.13 1.01 -0.77 0.00 -1.58 0.16 103.07 102.83 1kei h GLY 235 Ca -0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 47.33 47.20 1kei h GLY 235 CO 0.01 0.04 -0.00 -2.22 0.00 0.00 0.00 176.54 174.37 1kei h ILE 236 N 0.12 1.26 0.05 2.60 2.04 -1.18 -0.96 117.51 121.44 1kei h ILE 236 Ca 0.07 -1.08 -0.28 0.00 1.00 0.00 0.00 64.86 64.57 1kei h ILE 236 Cb 0.15 0.98 0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1kei h ILE 236 CO -0.01 0.38 -1.13 0.40 0.00 0.00 0.00 178.15 177.79 1kei h ILE 237 N 0.73 1.29 -0.81 -0.67 1.08 -1.47 -2.83 117.51 114.82 1kei h ILE 237 Ca 0.14 -2.35 0.03 0.00 -0.39 0.00 0.00 64.86 62.28 1kei h ILE 237 Cb 0.52 2.52 -0.05 0.00 -3.07 0.00 0.00 36.82 36.74 1kei h ILE 237 CO 0.03 0.72 0.52 0.78 -0.69 0.00 0.00 178.15 179.51 1kei h ASN 238 N 0.34 0.88 -0.57 1.72 2.35 -0.65 -0.12 115.58 119.53 1kei h ASN 238 Ca -0.15 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.55 1kei h ASN 238 Cb 1.79 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.93 1kei h ASN 238 CO 0.22 0.61 0.22 0.50 -1.65 0.00 0.00 177.43 177.33 1kei h LYS 239 N 1.03 0.85 -0.66 0.81 1.63 -1.20 -0.35 116.57 118.69 1kei h LYS 239 Ca 0.32 -0.16 0.01 0.00 -0.85 0.00 0.00 60.65 59.97 1kei h LYS 239 Cb -0.02 -0.14 -0.04 0.00 -0.60 0.00 0.00 32.23 31.43 1kei h LYS 239 CO -0.10 0.74 0.43 0.00 -3.45 0.00 0.00 179.45 177.07 1kei h ALA 240 N 1.07 0.84 -0.60 5.00 0.00 -1.11 -0.29 119.26 124.17 1kei h ALA 240 Ca 0.19 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1kei h ALA 240 Cb 0.22 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1kei h ALA 240 CO -0.01 0.24 0.21 0.00 0.00 0.00 0.00 179.25 179.68 1kei h ALA 241 N 1.25 0.78 -0.58 0.00 0.00 -0.68 -0.60 119.26 119.43 1kei h ALA 241 Ca 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1kei h ALA 241 Cb -0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1kei h ALA 241 CO -0.07 0.43 0.33 -0.92 0.00 0.00 0.00 179.25 179.02 1kei h TYR 242 N 0.84 0.78 -0.59 0.00 3.20 -0.55 -2.13 116.97 118.53 1kei h TYR 242 Ca 0.20 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.99 1kei h TYR 242 Cb 0.26 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 1kei h TYR 242 CO 0.02 0.56 0.14 -0.07 -1.64 0.00 0.00 178.16 177.16 1kei h LEU 243 N 0.78 0.90 -0.68 2.82 3.38 -0.74 0.19 115.31 121.96 1kei h LEU 243 Ca 0.21 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 57.97 1kei h LEU 243 Cb 0.02 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 1kei h LEU 243 CO -0.04 0.90 0.42 0.40 0.09 0.00 0.00 178.44 180.22 1kei h ILE 244 N 0.86 1.08 0.04 1.22 2.04 -0.85 0.43 117.51 122.32 1kei h ILE 244 Ca 0.18 -0.28 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 1kei h ILE 244 Cb 0.36 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1kei h ILE 244 CO 0.00 0.15 -0.02 -1.28 0.00 0.00 0.00 178.15 177.00 1kei h SER 245 N 0.82 -0.05 0.56 1.72 0.87 -1.15 0.36 113.55 116.68 1kei h SER 245 Ca 0.28 -0.61 -0.08 0.00 -1.23 0.00 0.00 61.79 60.15 1kei h SER 245 Cb 0.04 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 1kei h SER 245 CO -0.12 0.69 -1.51 0.00 -0.53 0.00 0.00 176.83 175.37 1kei n GLN 246 N -4.75 0.63 -0.03 2.24 1.13 0.64 -1.16 117.38 116.08 1kei n GLN 246 Ca -0.08 0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 1kei n GLN 246 Cb 0.32 -1.71 -0.00 0.00 0.11 0.00 0.00 30.24 28.96 1kei n GLN 246 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1kei n GLY 247 N 1.31 -1.56 0.00 1.08 0.00 0.15 -4.33 105.19 101.84 1kei n GLY 247 Ca -0.07 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1kei n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kei n GLY 248 N -1.66 1.92 3.29 -0.02 0.00 -0.28 -4.75 105.19 103.69 1kei n GLY 248 Ca -0.00 -1.87 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 1kei n GLY 248 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kei s THR 249 N -1.41 2.89 -0.10 2.61 2.01 -1.26 -0.21 115.64 120.16 1kei s THR 249 Ca 0.00 -0.69 -0.00 0.00 0.31 0.00 0.00 61.69 61.31 1kei s THR 249 Cb 0.00 -2.24 0.02 0.00 0.01 0.00 0.00 72.50 70.29 1kei s THR 249 CO 0.00 0.50 -0.07 -2.28 -0.69 0.00 0.00 174.62 172.08 1kei s HIS 250 N 0.87 1.38 -1.49 4.92 5.04 -0.23 -4.76 115.29 121.01 1kei s HIS 250 Ca -0.03 -0.64 -0.11 0.00 -1.54 0.00 0.00 55.06 52.73 1kei s HIS 250 Cb -0.15 -1.15 0.07 0.00 0.04 0.00 0.00 32.58 31.39 1kei s HIS 250 CO -0.00 -0.46 0.90 0.66 -2.34 0.00 0.00 174.74 173.50 1kei n TYR 251 N 4.79 -2.18 -0.91 3.88 4.01 -1.26 -1.44 117.16 124.05 1kei n TYR 251 Ca -0.14 0.88 0.00 0.00 -0.16 0.00 0.00 57.90 58.49 1kei n TYR 251 Cb 0.50 -4.00 0.00 0.00 -0.31 0.00 0.00 39.34 35.53 1kei n TYR 251 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1kei n GLY 252 N -1.67 1.05 3.49 2.72 0.00 -1.26 -5.01 105.19 104.51 1kei n GLY 252 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 1kei n GLY 252 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kei s VAL 253 N -3.75 4.39 -0.04 1.61 1.01 -0.52 -5.09 120.40 118.01 1kei s VAL 253 Ca 0.00 -0.15 -0.17 0.00 0.00 0.00 0.00 61.98 61.65 1kei s VAL 253 Cb 0.00 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.30 1kei s VAL 253 CO 0.00 0.37 0.48 -0.44 0.00 0.00 0.00 175.10 175.51 1kei s SER 254 N 1.27 6.80 -0.07 3.32 0.01 -1.26 -1.07 113.70 122.70 1kei s SER 254 Ca 0.05 0.95 0.03 0.00 1.31 0.00 0.00 55.95 58.29 1kei s SER 254 Cb -0.15 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.80 1kei s SER 254 CO 0.03 0.15 -0.18 -0.69 0.41 0.00 0.00 173.24 172.97 1kei s VAL 255 N -0.24 1.53 -0.27 3.43 1.01 0.71 -4.90 120.40 121.67 1kei s VAL 255 Ca 0.26 -0.73 -0.20 0.00 0.00 0.00 0.00 61.98 61.31 1kei s VAL 255 Cb -0.16 -1.34 -0.02 0.00 0.00 0.00 0.00 36.38 34.85 1kei s VAL 255 CO 0.13 0.44 0.60 -0.69 0.00 0.00 0.00 175.10 175.58 1kei s VAL 256 N 0.37 5.00 0.39 2.92 1.01 -1.26 -1.13 120.40 127.69 1kei s VAL 256 Ca -0.13 1.00 -0.26 0.00 0.00 0.00 0.00 61.98 62.60 1kei s VAL 256 Cb -0.15 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.22 1kei s VAL 256 CO 0.05 0.01 1.25 -0.83 0.00 0.00 0.00 175.10 175.58 1kei s GLY 257 N 1.53 2.92 0.00 4.51 0.00 -1.26 -4.75 107.32 110.27 1kei s GLY 257 Ca 0.25 1.13 0.06 0.00 0.00 0.00 0.00 44.72 46.16 1kei s GLY 257 CO 0.09 1.70 0.80 0.29 0.00 0.00 0.00 173.10 175.98 1kei n ILE 258 N 0.21 0.22 0.00 0.90 -5.35 0.12 -4.86 119.36 110.60 1kei n ILE 258 Ca 0.03 -0.61 0.00 0.00 -0.27 0.00 0.00 62.75 61.91 1kei n ILE 258 Cb 0.44 1.00 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 1kei n ILE 258 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1kei n GLY 259 N 0.30 1.23 0.29 3.28 0.00 -0.31 -4.51 105.19 105.47 1kei n GLY 259 Ca 0.04 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.18 1kei n GLY 259 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1kei h ARG 260 N 0.00 0.96 -0.35 1.61 3.08 -1.94 -2.48 114.38 115.27 1kei h ARG 260 Ca 0.00 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.69 1kei h ARG 260 Cb 0.00 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1kei h ARG 260 CO 0.00 1.04 0.23 -0.44 -1.07 0.00 0.00 179.97 179.73 1kei h ASP 261 N 0.85 0.40 0.10 7.04 3.32 -1.98 -0.55 116.42 125.60 1kei h ASP 261 Ca 0.13 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.04 1kei h ASP 261 Cb 0.70 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1kei h ASP 261 CO 0.05 0.29 -0.43 0.11 -1.72 0.00 0.00 179.24 177.55 1kei h LYS 262 N 0.48 0.41 -0.34 3.56 1.57 -1.78 -1.76 116.57 118.71 1kei h LYS 262 Ca 0.13 -0.21 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1kei h LYS 262 Cb -0.05 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1kei h LYS 262 CO -0.03 0.77 0.20 1.25 -0.57 0.00 0.00 179.45 181.07 1kei h LEU 263 N 0.34 0.32 -0.58 2.94 5.85 -1.01 -0.17 115.31 122.99 1kei h LEU 263 Ca 0.03 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1kei h LEU 263 Cb 0.89 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 1kei h LEU 263 CO 0.07 0.23 0.31 1.23 -0.34 0.00 0.00 178.44 179.95 1kei h GLY 264 N 0.40 0.88 0.98 3.75 0.00 -0.85 -1.35 103.07 106.88 1kei h GLY 264 Ca 0.13 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 1kei h GLY 264 CO -0.06 0.39 0.16 0.50 0.00 0.00 0.00 176.54 177.53 1kei h LYS 265 N 0.79 0.80 -0.17 4.80 1.57 -0.97 -0.39 116.57 123.00 1kei h LYS 265 Ca 0.20 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1kei h LYS 265 Cb 0.07 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1kei h LYS 265 CO -0.03 0.74 0.04 0.82 -0.57 0.00 0.00 179.45 180.46 1kei h ILE 266 N 0.70 1.20 -0.01 1.86 2.04 -0.85 -2.28 117.51 120.17 1kei h ILE 266 Ca 0.17 -0.63 -0.13 0.00 1.00 0.00 0.00 64.86 65.26 1kei h ILE 266 Cb 0.28 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 1kei h ILE 266 CO -0.00 0.19 -0.60 -0.26 0.00 0.00 0.00 178.15 177.48 1kei h PHE 267 N 0.09 0.06 -0.43 1.37 -1.00 -1.19 -1.70 116.94 114.15 1kei h PHE 267 Ca 0.06 -0.02 -0.12 0.00 2.81 0.00 0.00 57.97 60.69 1kei h PHE 267 Cb 0.26 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.80 1kei h PHE 267 CO 0.01 0.64 -0.22 -0.92 -1.61 0.00 0.00 178.31 176.20 1kei h TYR 268 N 0.04 1.04 -0.54 -0.55 3.20 -1.03 -0.57 116.97 118.55 1kei h TYR 268 Ca -0.01 -0.26 -0.10 0.00 3.14 0.00 0.00 58.73 61.51 1kei h TYR 268 Cb 1.07 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 39.08 1kei h TYR 268 CO 0.00 1.06 -0.03 -0.09 -1.64 0.00 0.00 178.16 177.46 1kei h ARG 269 N 0.73 0.98 -0.45 1.82 2.43 -1.30 -1.11 114.38 117.47 1kei h ARG 269 Ca 0.09 -0.33 -0.01 0.00 -0.81 0.00 0.00 59.98 58.93 1kei h ARG 269 Cb 0.79 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.24 1kei h ARG 269 CO 0.06 1.00 0.26 0.00 -1.51 0.00 0.00 179.97 179.78 1kei h ALA 270 N 0.94 0.58 -0.56 2.80 0.00 -1.15 0.39 119.26 122.27 1kei h ALA 270 Ca 0.15 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1kei h ALA 270 Cb 0.58 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1kei h ALA 270 CO 0.03 0.09 0.24 1.25 0.00 0.00 0.00 179.25 180.87 1kei h LEU 271 N 0.59 0.76 0.00 0.00 5.85 -0.90 -0.88 115.31 120.73 1kei h LEU 271 Ca 0.16 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1kei h LEU 271 Cb 0.04 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.87 1kei h LEU 271 CO -0.03 0.70 -0.77 0.35 -0.34 0.00 0.00 178.44 178.36 1kei n THR 272 N -4.52 0.29 0.00 1.05 -2.24 -0.44 -3.33 114.28 105.10 1kei n THR 272 Ca 0.03 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1kei n THR 272 Cb 0.15 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1kei n THR 272 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1kei n GLN 273 N -2.06 3.95 -0.01 -0.78 -0.06 0.12 -4.91 117.38 113.62 1kei n GLN 273 Ca 0.03 0.00 -0.01 0.00 -2.00 0.00 0.00 57.00 55.01 1kei n GLN 273 Cb 0.44 -1.00 -0.02 0.00 -4.06 0.00 0.00 30.24 25.60 1kei n GLN 273 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 1kei n TYR 274 N -2.00 0.00 -2.54 3.69 4.01 -0.67 -5.05 117.16 114.60 1kei n TYR 274 Ca 0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.40 1kei n TYR 274 Cb 0.50 -0.14 -0.03 0.00 -0.31 0.00 0.00 39.34 39.35 1kei n TYR 274 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1kei s LEU 275 N -4.16 3.85 0.38 7.72 1.43 -0.43 -5.01 118.68 122.46 1kei s LEU 275 Ca -0.01 1.93 0.04 0.00 -1.03 0.00 0.00 54.13 55.05 1kei s LEU 275 Cb 0.01 -4.56 -0.05 0.00 0.03 0.00 0.00 46.19 41.62 1kei s LEU 275 CO 0.12 -0.79 0.07 0.42 0.23 0.00 0.00 176.35 176.40 1kei s THR 276 N -1.98 1.07 0.50 5.49 -4.23 -1.26 -4.53 115.64 110.70 1kei s THR 276 Ca 0.67 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.39 1kei s THR 276 Cb -0.16 -2.59 0.37 0.00 1.34 0.00 0.00 72.50 71.45 1kei s THR 276 CO 0.20 0.00 2.00 -0.65 -0.54 0.00 0.00 174.62 175.63 1kei h PRO 277 N 1.89 0.12 -0.29 3.99 0.11 -1.58 -2.78 132.00 133.45 1kei h PRO 277 Ca -0.40 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1kei h PRO 277 Cb 1.26 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1kei h PRO 277 CO 0.67 0.08 0.00 0.25 -0.21 0.00 0.00 178.00 178.79 1kei n THR 278 N -4.42 2.26 -1.75 -1.15 -2.24 -1.26 -1.14 114.28 104.57 1kei n THR 278 Ca 0.09 -1.79 -0.42 0.00 -2.27 0.00 0.00 64.05 59.66 1kei n THR 278 Cb 0.49 -0.21 -0.01 0.00 -2.10 0.00 0.00 70.33 68.50 1kei n THR 278 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1kei n SER 279 N -0.35 3.74 -4.30 3.42 7.64 -1.05 -4.84 113.62 117.88 1kei n SER 279 Ca 0.21 1.18 -0.19 0.00 1.01 0.00 0.00 58.87 61.09 1kei n SER 279 Cb 0.89 -1.59 0.02 0.00 -1.01 0.00 0.00 64.21 62.52 1kei n SER 279 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1kei n ASN 280 N 1.38 2.16 -0.21 6.43 0.23 -1.26 -3.49 115.26 120.49 1kei n ASN 280 Ca 0.05 -2.42 -0.03 0.00 -0.53 0.00 0.00 54.58 51.66 1kei n ASN 280 Cb 0.37 -0.14 0.08 0.00 -2.08 0.00 0.00 39.78 38.01 1kei n ASN 280 CO 0.00 0.00 0.00 -0.26 -0.93 0.00 0.00 177.26 176.07 1kei h PHE 281 N 0.44 0.64 -0.86 -2.53 -1.00 -1.95 -0.88 116.94 110.79 1kei h PHE 281 Ca -0.26 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.54 1kei h PHE 281 Cb 1.01 -0.20 -0.04 0.00 3.61 0.00 0.00 35.95 40.33 1kei h PHE 281 CO 0.00 0.32 0.53 1.03 -1.61 0.00 0.00 178.31 178.58 1kei h SER 282 N 0.66 1.02 0.63 2.17 0.87 -1.94 -1.29 113.55 115.67 1kei h SER 282 Ca 0.27 -0.05 -0.12 0.00 -1.23 0.00 0.00 61.79 60.66 1kei h SER 282 Cb 0.14 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 1kei h SER 282 CO -0.16 0.78 -0.59 1.56 -0.53 0.00 0.00 176.83 177.89 1kei h GLN 283 N 1.19 0.00 -0.53 2.24 4.20 -1.79 -2.37 115.11 118.04 1kei h GLN 283 Ca 0.31 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.91 1kei h GLN 283 Cb -0.07 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1kei h GLN 283 CO -0.06 0.59 -0.10 1.25 -0.67 0.00 0.00 178.83 179.84 1kei h LEU 284 N 0.00 1.01 -0.26 1.46 5.85 -0.38 0.11 115.31 123.09 1kei h LEU 284 Ca -0.01 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.38 1kei h LEU 284 Cb 1.07 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 1kei h LEU 284 CO 0.08 1.12 0.15 -0.09 -0.34 0.00 0.00 178.44 179.36 1kei h ARG 285 N 0.88 0.30 -0.87 1.25 2.43 -1.01 0.12 114.38 117.49 1kei h ARG 285 Ca 0.14 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 1kei h ARG 285 Cb 0.66 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.10 1kei h ARG 285 CO 0.05 0.20 0.49 0.00 -1.51 0.00 0.00 179.97 179.19 1kei h ALA 286 N 1.12 1.11 -0.55 2.80 0.00 -1.19 -0.51 119.26 122.03 1kei h ALA 286 Ca 0.10 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1kei h ALA 286 Cb -0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1kei h ALA 286 CO -0.05 0.61 0.09 0.00 0.00 0.00 0.00 179.25 179.90 1kei h ALA 287 N 1.26 0.74 -0.52 0.00 0.00 -0.46 -0.63 119.26 119.65 1kei h ALA 287 Ca 0.31 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1kei h ALA 287 Cb 0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1kei h ALA 287 CO -0.05 0.48 -0.05 0.00 0.00 0.00 0.00 179.25 179.63 1kei h ALA 288 N 0.99 0.71 -0.48 0.00 0.00 -0.40 -0.50 119.26 119.58 1kei h ALA 288 Ca 0.17 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1kei h ALA 288 Cb 0.42 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1kei h ALA 288 CO 0.01 0.57 0.07 0.28 0.00 0.00 0.00 179.25 180.18 1kei h VAL 289 N 0.82 1.25 -0.63 0.00 2.07 -0.97 -0.96 116.25 117.83 1kei h VAL 289 Ca 0.14 -0.93 -0.08 0.00 0.82 0.00 0.00 66.70 66.65 1kei h VAL 289 Cb 0.60 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1kei h VAL 289 CO 0.04 0.33 0.09 -0.61 0.02 0.00 0.00 177.57 177.44 1kei h GLN 290 N 0.67 1.04 -0.36 1.57 5.75 -0.97 -0.61 115.11 122.20 1kei h GLN 290 Ca 0.14 -0.27 -0.03 0.00 -0.15 0.00 0.00 58.65 58.34 1kei h GLN 290 Cb 0.40 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.81 1kei h GLN 290 CO 0.01 0.96 0.10 0.77 -2.65 0.00 0.00 178.83 178.02 1kei h SER 291 N 0.97 0.54 -0.25 -0.69 0.02 -0.85 0.55 113.55 113.84 1kei h SER 291 Ca 0.19 -0.22 -0.06 0.00 -0.84 0.00 0.00 61.79 60.86 1kei h SER 291 Cb 0.44 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1kei h SER 291 CO 0.01 0.62 -0.02 0.00 -1.14 0.00 0.00 176.83 176.30 1kei h ALA 292 N 0.94 1.30 -0.26 3.77 0.00 -1.01 -1.81 119.26 122.19 1kei h ALA 292 Ca 0.11 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1kei h ALA 292 Cb 0.28 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1kei h ALA 292 CO -0.00 0.47 0.01 1.15 0.00 0.00 0.00 179.25 180.89 1kei h THR 293 N 0.54 1.25 -0.69 0.00 2.02 -0.62 0.21 112.91 115.62 1kei h THR 293 Ca 0.11 -0.87 0.04 0.00 0.77 0.00 0.00 66.41 66.47 1kei h THR 293 Cb 0.38 1.31 -0.05 0.00 -1.74 0.00 0.00 68.15 68.05 1kei h THR 293 CO 0.01 0.27 0.41 0.44 0.37 0.00 0.00 175.52 177.03 1kei h ASP 294 N 0.24 0.65 0.49 4.18 3.32 -0.55 -0.20 116.42 124.55 1kei h ASP 294 Ca 0.08 0.01 -0.30 0.00 0.02 0.00 0.00 57.03 56.84 1kei h ASP 294 Cb 0.39 -0.12 0.01 0.00 0.22 0.00 0.00 39.33 39.82 1kei h ASP 294 CO 0.01 0.44 -1.41 -0.07 -1.72 0.00 0.00 179.24 176.49 1kei h LEU 295 N 0.78 0.48 -0.39 1.55 3.38 -1.21 -3.41 115.31 116.49 1kei h LEU 295 Ca 0.29 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1kei h LEU 295 Cb 0.10 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1kei h LEU 295 CO -0.14 1.46 0.00 -1.22 0.09 0.00 0.00 178.44 178.63 1kei n TYR 296 N -3.53 0.00 0.00 1.13 4.01 0.73 -5.10 117.16 114.40 1kei n TYR 296 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1kei n TYR 296 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 1kei n TYR 296 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1kei n GLY 297 N 0.41 1.95 0.29 2.72 0.00 -0.09 -4.41 105.19 106.07 1kei n GLY 297 Ca 0.00 -1.64 0.13 0.00 0.00 0.00 0.00 46.02 44.52 1kei n GLY 297 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1kei h SER 298 N 0.00 0.00 -0.52 1.61 4.64 -1.89 -2.15 113.55 115.25 1kei h SER 298 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1kei h SER 298 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1kei h SER 298 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 1kei n THR 299 N -4.03 2.32 -1.83 2.95 -2.24 -1.26 -4.86 114.28 105.33 1kei n THR 299 Ca -0.03 -1.44 -0.31 0.00 -2.27 0.00 0.00 64.05 60.01 1kei n THR 299 Cb 0.09 -0.12 0.02 0.00 -2.10 0.00 0.00 70.33 68.22 1kei n THR 299 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1kei s SER 300 N -1.09 5.94 0.32 3.42 1.04 -0.81 -4.96 113.70 117.56 1kei s SER 300 Ca 0.50 1.39 0.08 0.00 0.48 0.00 0.00 55.95 58.39 1kei s SER 300 Cb 0.36 -2.36 0.53 0.00 0.10 0.00 0.00 66.02 64.65 1kei s SER 300 CO 0.17 -1.05 1.74 -0.61 0.98 0.00 0.00 173.24 174.47 1kei h GLN 301 N -0.45 0.20 -0.43 4.02 5.75 -1.91 -2.74 115.11 119.56 1kei h GLN 301 Ca -0.44 -0.09 0.01 0.00 -0.15 0.00 0.00 58.65 57.98 1kei h GLN 301 Cb 1.21 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.73 1kei h GLN 301 CO 0.62 0.55 0.28 0.93 -2.65 0.00 0.00 178.83 178.56 1kei h GLU 302 N 0.17 0.55 -0.57 1.69 3.07 -1.92 -0.15 114.58 117.41 1kei h GLU 302 Ca 0.02 -0.03 -0.09 0.00 -0.50 0.00 0.00 59.36 58.75 1kei h GLU 302 Cb 0.75 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.52 1kei h GLU 302 CO 0.06 0.36 -0.01 0.28 -1.40 0.00 0.00 179.01 178.30 1kei h VAL 303 N 0.57 1.27 -0.64 3.13 2.07 -1.80 -2.29 116.25 118.55 1kei h VAL 303 Ca 0.16 -1.15 0.01 0.00 0.82 0.00 0.00 66.70 66.54 1kei h VAL 303 Cb -0.05 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1kei h VAL 303 CO -0.05 0.41 0.42 0.00 0.02 0.00 0.00 177.57 178.38 1kei h ALA 304 N 0.96 0.81 -0.29 1.67 0.00 -1.15 -1.94 119.26 119.34 1kei h ALA 304 Ca 0.16 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1kei h ALA 304 Cb 0.57 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1kei h ALA 304 CO 0.03 0.25 -0.23 0.77 0.00 0.00 0.00 179.25 180.07 1kei h SER 305 N 0.87 0.54 -0.40 0.00 0.02 -0.89 -0.85 113.55 112.84 1kei h SER 305 Ca 0.23 -0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1kei h SER 305 Cb -0.10 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 1kei h SER 305 CO -0.05 0.77 0.05 0.58 -1.14 0.00 0.00 176.83 177.04 1kei h VAL 306 N 0.48 1.25 -0.42 2.27 2.07 -1.07 -0.87 116.25 119.97 1kei h VAL 306 Ca 0.07 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 1kei h VAL 306 Cb 0.66 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1kei h VAL 306 CO 0.05 0.31 0.18 0.11 0.02 0.00 0.00 177.57 178.24 1kei h LYS 307 N 0.52 0.61 -0.87 1.57 1.57 -1.11 -2.41 116.57 116.44 1kei h LYS 307 Ca 0.12 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1kei h LYS 307 Cb 0.40 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 1kei h LYS 307 CO 0.01 0.56 0.45 1.96 -0.57 0.00 0.00 179.45 181.86 1kei h GLN 308 N 0.53 1.24 -0.31 3.15 1.08 -1.02 -0.94 115.11 118.84 1kei h GLN 308 Ca 0.14 -0.17 -0.02 0.00 -1.45 0.00 0.00 58.65 57.15 1kei h GLN 308 Cb 0.16 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.35 1kei h GLN 308 CO -0.01 0.93 0.10 0.00 -0.95 0.00 0.00 178.83 178.90 1kei h ALA 309 N 1.24 0.41 -0.12 3.87 0.00 -0.98 0.20 119.26 123.89 1kei h ALA 309 Ca 0.30 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 1kei h ALA 309 Cb 0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1kei h ALA 309 CO -0.04 0.04 -0.40 0.74 0.00 0.00 0.00 179.25 179.58 1kei h PHE 310 N 0.35 0.30 -0.69 0.00 0.04 -1.28 -2.50 116.94 113.16 1kei h PHE 310 Ca 0.10 -0.08 -0.08 0.00 2.80 0.00 0.00 57.97 60.71 1kei h PHE 310 Cb 0.24 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.29 1kei h PHE 310 CO 0.00 0.63 0.13 -0.44 -0.60 0.00 0.00 178.31 178.03 1kei h ASP 311 N 0.22 1.07 -0.44 2.17 3.32 -0.85 -0.13 116.42 121.79 1kei h ASP 311 Ca 0.02 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.82 1kei h ASP 311 Cb 0.81 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 1kei h ASP 311 CO 0.06 1.05 0.28 0.00 -1.72 0.00 0.00 179.24 178.91 1kei h ALA 312 N 1.06 1.64 -0.55 3.45 0.00 -0.54 -1.65 119.26 122.68 1kei h ALA 312 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1kei h ALA 312 Cb 0.42 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1kei h ALA 312 CO 0.01 0.32 0.00 1.33 0.00 0.00 0.00 179.25 180.91 1kei n VAL 313 N -4.45 0.74 -1.37 0.00 0.24 -1.02 -4.72 118.33 107.76 1kei n VAL 313 Ca 0.04 -0.78 -0.06 0.00 -2.04 0.00 0.00 64.34 61.50 1kei n VAL 313 Cb 0.07 0.49 -0.02 0.00 -1.47 0.00 0.00 33.84 32.91 1kei n VAL 313 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1kei n GLY 314 N 1.46 0.69 3.47 7.63 0.00 -0.62 0.15 105.19 117.97 1kei n GLY 314 Ca 0.20 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 1kei n GLY 314 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kei s VAL 315 N -2.24 5.07 -2.57 1.61 1.01 -0.12 -4.66 120.40 118.51 1kei s VAL 315 Ca 0.00 -0.47 0.21 0.00 0.00 0.00 0.00 61.98 61.72 1kei s VAL 315 Cb 0.00 -3.70 0.16 0.00 0.00 0.00 0.00 36.38 32.84 1kei s VAL 315 CO 0.00 -0.12 1.15 0.29 0.00 0.00 0.00 175.10 176.42