#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kst s VAL 41 N 0.00 4.85 -0.12 -3.33 1.01 -1.26 -0.56 120.40 120.98 3kst s VAL 41 Ca 0.00 1.72 -0.06 0.00 0.00 0.00 0.00 61.98 63.64 3kst s VAL 41 Cb 0.00 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 32.16 3kst s VAL 41 CO 0.00 -0.00 0.07 -0.08 0.00 0.00 0.00 175.10 175.09 3kst h GLU 42 N 7.33 0.00 -3.71 2.72 4.81 -1.46 -3.47 114.58 120.81 3kst h GLU 42 Ca -0.28 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 58.75 3kst h GLU 42 Cb 1.12 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 30.25 3kst h GLU 42 CO 0.86 0.16 -0.66 0.95 -0.73 0.00 0.00 179.01 179.59 3kst s THR 43 N -1.79 0.04 -0.10 0.32 -4.23 -1.08 -5.02 115.64 103.78 3kst s THR 43 Ca -0.06 -0.29 0.01 0.00 -1.18 0.00 0.00 61.69 60.17 3kst s THR 43 Cb 0.00 -0.15 0.14 0.00 1.34 0.00 0.00 72.50 73.84 3kst s THR 43 CO 0.15 -0.16 1.25 0.59 -0.54 0.00 0.00 174.62 175.91 3kst n ASN 44 N 2.55 3.33 -3.98 3.99 3.02 -1.26 -1.28 115.26 121.63 3kst n ASN 44 Ca -0.16 -2.37 -0.09 0.00 -0.03 0.00 0.00 54.58 51.93 3kst n ASN 44 Cb 0.58 -0.61 -0.06 0.00 -0.61 0.00 0.00 39.78 39.09 3kst n ASN 44 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3kst s TYR 45 N -0.72 0.37 -0.42 3.10 1.51 -1.17 -4.68 117.35 115.33 3kst s TYR 45 Ca 0.12 -0.72 -0.10 0.00 -1.01 0.00 0.00 57.07 55.37 3kst s TYR 45 Cb 0.10 0.13 0.08 0.00 -0.11 0.00 0.00 41.96 42.16 3kst s TYR 45 CO 0.02 -0.93 0.27 -1.17 -1.11 0.00 0.00 175.55 172.64 3kst s LEU 46 N -3.01 5.21 0.00 -1.29 2.96 -1.23 -3.34 118.68 117.99 3kst s LEU 46 Ca 0.21 -1.50 -0.03 0.00 -0.22 0.00 0.00 54.13 52.60 3kst s LEU 46 Cb 0.00 -2.00 -0.11 0.00 0.50 0.00 0.00 46.19 44.58 3kst s LEU 46 CO 0.07 -0.55 2.45 -0.81 -1.32 0.00 0.00 176.35 176.19 3kst n PRO 47 N 4.94 1.29 -4.28 0.98 -0.04 -1.26 -1.23 135.00 135.39 3kst n PRO 47 Ca -0.10 -0.42 -0.19 0.00 -0.04 0.00 0.00 63.50 62.75 3kst n PRO 47 Cb 0.43 -1.48 -0.11 0.00 -0.04 0.00 0.00 33.50 32.29 3kst n PRO 47 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3kst s ILE 48 N 0.74 1.54 0.46 0.52 -4.36 -1.25 -2.99 121.20 115.86 3kst s ILE 48 Ca 0.28 -1.83 0.07 0.00 -0.26 0.00 0.00 60.65 58.91 3kst s ILE 48 Cb 0.13 -1.69 -0.01 0.00 1.25 0.00 0.00 42.46 42.14 3kst s ILE 48 CO 0.00 -0.40 0.33 0.00 0.24 0.00 0.00 174.94 175.11 3kst s ALA 49 N -2.18 4.04 -1.53 2.27 0.00 -0.04 -2.97 121.76 121.35 3kst s ALA 49 Ca 0.12 -1.74 -0.01 0.00 0.00 0.00 0.00 51.96 50.33 3kst s ALA 49 Cb -0.05 -0.73 0.01 0.00 0.00 0.00 0.00 23.12 22.35 3kst s ALA 49 CO 0.04 -0.28 0.14 -0.25 0.00 0.00 0.00 175.76 175.42 3kst n ASP 50 N -1.53 0.46 -4.77 0.00 8.00 -1.26 0.31 116.55 117.76 3kst n ASP 50 Ca 0.00 -1.20 -0.34 0.00 0.71 0.00 0.00 54.79 53.97 3kst n ASP 50 Cb 0.63 -2.00 0.03 0.00 -0.02 0.00 0.00 41.12 39.76 3kst n ASP 50 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3kst s PRO 51 N -7.15 3.00 -0.03 -0.24 0.04 -1.21 -4.32 135.00 125.10 3kst s PRO 51 Ca 0.04 1.46 -0.03 0.00 0.04 0.00 0.00 61.00 62.51 3kst s PRO 51 Cb -0.02 -1.97 0.01 0.00 0.04 0.00 0.00 34.50 32.55 3kst s PRO 51 CO 0.97 -1.10 0.07 -0.47 0.04 0.00 0.00 177.00 176.51 3kst s TYR 52 N -2.15 -0.07 0.00 0.56 5.04 -0.11 -3.97 117.35 116.65 3kst s TYR 52 Ca 0.69 0.18 0.00 0.00 -2.44 0.00 0.00 57.07 55.50 3kst s TYR 52 Cb -0.21 0.02 0.00 0.00 0.35 0.00 0.00 41.96 42.12 3kst s TYR 52 CO 0.36 -0.05 0.00 0.28 -1.34 0.00 0.00 175.55 174.81 3kst n VAL 53 N 2.98 0.00 -3.30 3.14 0.31 -1.26 -1.81 118.33 118.39 3kst n VAL 53 Ca -0.13 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.23 3kst n VAL 53 Cb 0.59 -0.01 -0.02 0.00 -0.91 0.00 0.00 33.84 33.50 3kst n VAL 53 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 3kst s PHE 55 N -0.68 -1.46 -0.18 3.52 5.36 -1.26 -4.84 117.98 118.44 3kst s PHE 55 Ca 0.00 1.83 -0.24 0.00 -0.96 0.00 0.00 56.93 57.56 3kst s PHE 55 Cb 0.00 0.62 0.06 0.00 -0.34 0.00 0.00 43.02 43.36 3kst s PHE 55 CO 0.00 -0.78 0.63 -0.47 -1.46 0.00 0.00 175.22 173.14 3kst s TYR 56 N 2.86 -0.65 -1.58 10.12 5.04 -0.37 -4.93 117.35 127.84 3kst s TYR 56 Ca 0.11 1.47 -0.04 0.00 -2.44 0.00 0.00 57.07 56.17 3kst s TYR 56 Cb -0.14 0.27 0.00 0.00 0.35 0.00 0.00 41.96 42.45 3kst s TYR 56 CO -0.20 -0.41 0.56 0.09 -1.34 0.00 0.00 175.55 174.25 3kst n ASN 57 N 2.18 -6.14 -1.48 4.32 4.13 -1.26 -1.72 115.26 115.29 3kst n ASN 57 Ca -0.16 -0.26 -0.17 0.00 1.68 0.00 0.00 54.58 55.67 3kst n ASN 57 Cb 0.56 -4.96 -0.07 0.00 -1.54 0.00 0.00 39.78 33.77 3kst n ASN 57 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3kst n ASN 58 N -2.46 -4.35 -4.29 6.41 3.02 -1.26 -4.96 115.26 107.36 3kst n ASN 58 Ca -0.13 0.41 -0.16 0.00 -0.03 0.00 0.00 54.58 54.67 3kst n ASN 58 Cb 0.63 -3.94 -0.10 0.00 -0.61 0.00 0.00 39.78 35.75 3kst n ASN 58 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3kst s LYS 59 N -3.41 1.19 -0.13 3.52 2.20 -0.70 -4.95 119.74 117.47 3kst s LYS 59 Ca 0.00 -1.53 -0.04 0.00 -0.36 0.00 0.00 55.97 54.03 3kst s LYS 59 Cb 0.00 -0.76 -0.03 0.00 -1.51 0.00 0.00 37.83 35.52 3kst s LYS 59 CO 0.00 0.07 0.02 0.71 -0.36 0.00 0.00 175.35 175.80 3kst s TYR 60 N -3.24 3.19 -0.14 4.03 2.02 -0.02 -1.23 117.35 121.95 3kst s TYR 60 Ca 0.20 0.09 0.02 0.00 -0.37 0.00 0.00 57.07 57.01 3kst s TYR 60 Cb 0.02 -1.92 0.01 0.00 -0.40 0.00 0.00 41.96 39.67 3kst s TYR 60 CO 0.04 0.30 -0.20 0.71 -1.57 0.00 0.00 175.55 174.82 3kst s TYR 61 N -0.29 2.69 0.01 2.71 2.02 -1.26 -1.25 117.35 121.99 3kst s TYR 61 Ca 0.07 -1.23 0.05 0.00 -0.37 0.00 0.00 57.07 55.59 3kst s TYR 61 Cb -0.12 -1.82 -0.03 0.00 -0.40 0.00 0.00 41.96 39.58 3kst s TYR 61 CO 0.02 -0.55 -0.13 0.00 -1.57 0.00 0.00 175.55 173.32 3kst s ALA 62 N 0.76 2.79 0.01 3.71 0.00 0.54 -4.24 121.76 125.33 3kst s ALA 62 Ca -0.08 -1.09 -0.07 0.00 0.00 0.00 0.00 51.96 50.72 3kst s ALA 62 Cb -0.16 -0.94 -0.00 0.00 0.00 0.00 0.00 23.12 22.03 3kst s ALA 62 CO -0.00 0.59 0.13 0.71 0.00 0.00 0.00 175.76 177.19 3kst s TYR 63 N -0.94 0.07 0.00 0.00 1.51 -0.75 -1.18 117.35 116.07 3kst s TYR 63 Ca 0.15 -0.22 0.00 0.00 -1.01 0.00 0.00 57.07 56.00 3kst s TYR 63 Cb -0.11 -0.06 0.00 0.00 -0.11 0.00 0.00 41.96 41.68 3kst s TYR 63 CO 0.06 -0.31 0.00 0.41 -1.11 0.00 0.00 175.55 174.60 3kst n GLY 64 N 1.26 1.38 3.71 0.71 0.00 -1.26 -0.93 105.19 110.06 3kst n GLY 64 Ca -0.22 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.51 3kst n GLY 64 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kst s THR 65 N -2.55 4.96 0.00 2.61 2.01 0.15 -4.66 115.64 118.16 3kst s THR 65 Ca 0.00 1.72 0.00 0.00 0.31 0.00 0.00 61.69 63.72 3kst s THR 65 Cb 0.00 -4.16 0.00 0.00 0.01 0.00 0.00 72.50 68.35 3kst s THR 65 CO 0.00 0.20 0.00 0.61 -0.69 0.00 0.00 174.62 174.74 3kst n GLY 66 N 3.03 -2.01 2.39 4.40 0.00 -1.26 -0.86 105.19 110.88 3kst n GLY 66 Ca 0.02 -1.43 -0.12 0.00 0.00 0.00 0.00 46.02 44.50 3kst n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kst n GLY 67 N 0.00 1.29 3.86 -0.02 0.00 -1.16 -4.63 105.19 104.52 3kst n GLY 67 Ca 0.00 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.31 3kst n GLY 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kst s THR 68 N -2.40 4.67 0.00 2.61 -4.23 -1.26 -4.81 115.64 110.22 3kst s THR 68 Ca 0.00 0.90 0.00 0.00 -1.18 0.00 0.00 61.69 61.41 3kst s THR 68 Cb 0.00 -3.71 0.00 0.00 1.34 0.00 0.00 72.50 70.13 3kst s THR 68 CO 0.00 -0.54 0.20 0.35 -0.54 0.00 0.00 174.62 174.09 3kst n THR 69 N -1.28 0.00 -2.77 3.99 -2.24 -1.26 -4.81 114.28 105.91 3kst n THR 69 Ca 0.04 -0.41 -0.24 0.00 -2.27 0.00 0.00 64.05 61.17 3kst n THR 69 Cb 0.54 1.09 -0.02 0.00 -2.10 0.00 0.00 70.33 69.84 3kst n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kst n ALA 70 N -0.42 4.39 -0.08 6.98 0.00 -1.26 -5.10 120.51 125.03 3kst n ALA 70 Ca 0.00 -4.25 0.01 0.00 0.00 0.00 0.00 53.44 49.19 3kst n ALA 70 Cb 0.02 -0.70 -0.00 0.00 0.00 0.00 0.00 19.45 18.77 3kst n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kst n GLY 71 N -0.25 -2.12 3.76 0.00 0.00 -1.26 -4.90 105.19 100.41 3kst n GLY 71 Ca 0.31 -1.45 -0.37 0.00 0.00 0.00 0.00 46.02 44.51 3kst n GLY 71 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kst s GLU 72 N -0.43 3.36 0.00 1.61 2.02 -1.26 -4.80 118.70 119.20 3kst s GLU 72 Ca 0.00 1.97 0.00 0.00 0.02 0.00 0.00 54.97 56.96 3kst s GLU 72 Cb 0.00 -2.26 0.00 0.00 0.10 0.00 0.00 34.13 31.97 3kst s GLU 72 CO 0.00 -0.93 0.00 0.41 0.02 0.00 0.00 175.26 174.76 3kst n GLY 73 N 0.57 0.45 2.95 -1.39 0.00 -1.26 -1.47 105.19 105.04 3kst n GLY 73 Ca 0.10 -1.25 -0.17 0.00 0.00 0.00 0.00 46.02 44.70 3kst n GLY 73 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kst s PHE 74 N -1.88 0.56 0.54 1.61 0.08 -0.65 -4.68 117.98 113.56 3kst s PHE 74 Ca 0.00 -0.11 -0.04 0.00 0.12 0.00 0.00 56.93 56.90 3kst s PHE 74 Cb 0.00 -0.40 -0.00 0.00 -0.57 0.00 0.00 43.02 42.05 3kst s PHE 74 CO 0.00 -0.04 0.82 0.00 -0.10 0.00 0.00 175.22 175.90 3kst s ALA 75 N 0.10 3.42 -0.10 5.36 0.00 -1.26 0.14 121.76 129.41 3kst s ALA 75 Ca -0.01 -0.74 0.03 0.00 0.00 0.00 0.00 51.96 51.24 3kst s ALA 75 Cb -0.05 -2.50 0.01 0.00 0.00 0.00 0.00 23.12 20.58 3kst s ALA 75 CO -0.00 -0.61 -0.19 0.00 0.00 0.00 0.00 175.76 174.96 3kst s PHE 77 N 0.68 2.69 0.11 0.00 0.40 -0.32 -0.10 117.98 121.44 3kst s PHE 77 Ca -0.12 -0.18 0.02 0.00 -0.60 0.00 0.00 56.93 56.04 3kst s PHE 77 Cb -0.16 -1.39 -0.04 0.00 0.51 0.00 0.00 43.02 41.93 3kst s PHE 77 CO 0.03 0.44 -0.05 -1.54 0.70 0.00 0.00 175.22 174.80 3kst s SER 78 N -2.33 1.14 -0.10 1.36 1.04 -0.17 -0.34 113.70 114.30 3kst s SER 78 Ca 0.22 -1.04 -0.30 0.00 0.48 0.00 0.00 55.95 55.31 3kst s SER 78 Cb -0.11 0.10 0.08 0.00 0.10 0.00 0.00 66.02 66.20 3kst s SER 78 CO 0.14 -0.49 0.76 -0.55 0.98 0.00 0.00 173.24 174.08 3kst s SER 79 N -3.07 -0.60 0.00 7.02 0.15 -0.38 -0.60 113.70 116.23 3kst s SER 79 Ca 0.14 0.72 0.19 0.00 0.70 0.00 0.00 55.95 57.70 3kst s SER 79 Cb 0.05 0.58 -0.16 0.00 -1.71 0.00 0.00 66.02 64.78 3kst s SER 79 CO -0.03 -0.51 0.86 0.47 1.20 0.00 0.00 173.24 175.23 3kst n ASP 80 N 1.06 1.15 0.00 5.45 8.00 -1.26 -0.84 116.55 130.11 3kst n ASP 80 Ca -0.16 -1.07 0.00 0.00 0.71 0.00 0.00 54.79 54.26 3kst n ASP 80 Cb 0.57 0.87 0.00 0.00 -0.02 0.00 0.00 41.12 42.54 3kst n ASP 80 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3kst n ASP 81 N -1.11 0.24 0.00 -2.24 5.68 -1.26 -4.94 116.55 112.92 3kst n ASP 81 Ca 0.05 -1.06 0.00 0.00 -0.50 0.00 0.00 54.79 53.28 3kst n ASP 81 Cb 0.33 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.31 3kst n ASP 81 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3kst n LEU 82 N -0.03 0.00 -0.07 -2.12 4.77 -1.26 -4.75 117.00 113.54 3kst n LEU 82 Ca 0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.76 3kst n LEU 82 Cb 0.29 -0.10 -0.12 0.00 -2.33 0.00 0.00 43.42 41.15 3kst n LEU 82 CO 0.00 0.00 -0.96 1.17 -1.33 0.00 0.00 177.39 176.27 3kst n LYS 83 N -1.78 0.66 -3.83 3.23 3.00 -1.26 -4.64 118.16 113.54 3kst n LYS 83 Ca 0.00 0.32 -0.36 0.00 -0.00 0.00 0.00 58.31 58.27 3kst n LYS 83 Cb 0.00 -1.64 -0.13 0.00 0.00 0.00 0.00 35.03 33.26 3kst n LYS 83 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 3kst s ASN 84 N -6.96 4.77 0.27 3.14 0.01 -1.26 -0.93 114.94 113.98 3kst s ASN 84 Ca -0.29 -0.61 0.09 0.00 -0.71 0.00 0.00 52.86 51.33 3kst s ASN 84 Cb 0.08 -1.81 -0.04 0.00 0.41 0.00 0.00 41.25 39.89 3kst s ASN 84 CO 0.64 -0.12 0.05 0.26 -1.51 0.00 0.00 177.10 176.43 3kst s TRP 85 N 1.47 2.77 0.02 2.20 0.52 0.19 -4.36 118.94 121.75 3kst s TRP 85 Ca 0.03 -0.22 -0.02 0.00 0.02 0.00 0.00 56.10 55.91 3kst s TRP 85 Cb -0.16 -1.30 -0.02 0.00 -1.15 0.00 0.00 33.47 30.84 3kst s TRP 85 CO -0.00 0.56 0.00 -1.59 0.02 0.00 0.00 176.95 175.94 3kst s LYS 86 N -3.73 0.40 0.22 4.98 -2.85 0.23 0.07 119.74 119.06 3kst s LYS 86 Ca 0.33 -0.68 -0.30 0.00 -1.00 0.00 0.00 55.97 54.32 3kst s LYS 86 Cb -0.06 0.15 -0.09 0.00 -2.06 0.00 0.00 37.83 35.77 3kst s LYS 86 CO 0.21 -0.08 1.13 1.03 0.10 0.00 0.00 175.35 177.75 3kst s ARG 87 N -1.88 4.58 -0.31 1.78 0.52 -1.26 -1.00 118.95 121.38 3kst s ARG 87 Ca -0.12 1.81 0.07 0.00 -0.52 0.00 0.00 55.73 56.97 3kst s ARG 87 Cb -0.07 -3.23 0.46 0.00 0.52 0.00 0.00 34.95 32.63 3kst s ARG 87 CO -0.02 0.08 1.27 0.39 0.02 0.00 0.00 175.30 177.04 3kst n GLU 88 N 1.89 3.16 -0.06 3.54 -0.58 0.86 -4.89 120.64 124.56 3kst n GLU 88 Ca 0.02 -3.93 0.01 0.00 -0.42 0.00 0.00 57.16 52.84 3kst n GLU 88 Cb 0.45 -2.16 -0.00 0.00 -0.57 0.00 0.00 31.44 29.16 3kst n GLU 88 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3kst n GLY 89 N -0.81 -1.91 3.55 0.62 0.00 -1.25 -4.56 105.19 100.84 3kst n GLY 89 Ca 0.41 -1.35 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 3kst n GLY 89 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3kst s GLN 90 N -0.24 3.42 0.15 1.61 2.00 -1.26 -1.38 119.66 123.96 3kst s GLN 90 Ca 0.00 0.01 -0.14 0.00 -2.00 0.00 0.00 55.36 53.23 3kst s GLN 90 Cb 0.00 -4.04 0.03 0.00 0.80 0.00 0.00 33.01 29.80 3kst s GLN 90 CO 0.00 -1.64 1.71 0.00 -0.50 0.00 0.00 175.29 174.86 3kst h ALA 91 N 9.49 0.64 -3.42 1.58 0.00 -0.42 -3.44 119.26 123.70 3kst h ALA 91 Ca -0.26 -0.15 -0.47 0.00 0.00 0.00 0.00 54.91 54.04 3kst h ALA 91 Cb 1.06 -0.19 -0.34 0.00 0.00 0.00 0.00 17.79 18.32 3kst h ALA 91 CO 1.16 0.24 -0.80 -1.17 0.00 0.00 0.00 179.25 178.69 3kst s LEU 92 N -9.79 1.46 -0.15 0.00 2.96 -0.40 0.07 118.68 112.84 3kst s LEU 92 Ca -0.13 -0.22 -0.05 0.00 -0.22 0.00 0.00 54.13 53.51 3kst s LEU 92 Cb 0.11 -0.66 -0.03 0.00 0.50 0.00 0.00 46.19 46.11 3kst s LEU 92 CO 0.77 -0.02 0.02 -0.44 -1.32 0.00 0.00 176.35 175.36 3kst s SER 93 N 0.86 5.30 0.33 3.68 0.01 -1.26 -1.63 113.70 120.99 3kst s SER 93 Ca -0.11 0.04 0.12 0.00 1.31 0.00 0.00 55.95 57.31 3kst s SER 93 Cb -0.15 -1.80 1.02 0.00 0.21 0.00 0.00 66.02 65.31 3kst s SER 93 CO 0.01 0.23 1.63 0.00 0.41 0.00 0.00 173.24 175.52 3kst h ALA 94 N 6.27 1.76 -0.01 1.44 0.00 -1.59 -0.26 119.26 126.86 3kst h ALA 94 Ca -0.39 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3kst h ALA 94 Cb 1.18 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 3kst h ALA 94 CO 0.64 -0.64 0.01 1.79 0.00 0.00 0.00 179.25 181.06 3kst h THR 95 N 0.19 0.58 -0.29 0.00 1.35 -1.87 -0.88 112.91 111.99 3kst h THR 95 Ca 0.70 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.56 3kst h THR 95 Cb 1.63 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 3kst h THR 95 CO -0.69 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.05 3kst n ASP 96 N -3.93 2.29 -4.05 5.36 8.00 -0.11 -4.95 116.55 119.15 3kst n ASP 96 Ca -0.03 -2.18 -0.10 0.00 0.71 0.00 0.00 54.79 53.20 3kst n ASP 96 Cb 0.10 -0.38 -0.07 0.00 -0.02 0.00 0.00 41.12 40.75 3kst n ASP 96 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3kst s SER 97 N -0.70 -0.00 0.38 -2.24 1.04 -0.34 -1.96 113.70 109.89 3kst s SER 97 Ca 0.22 -1.06 -0.27 0.00 0.48 0.00 0.00 55.95 55.33 3kst s SER 97 Cb 0.14 0.50 -0.09 0.00 0.10 0.00 0.00 66.02 66.67 3kst s SER 97 CO 0.11 -1.02 1.29 -0.47 0.98 0.00 0.00 173.24 174.13 3kst s TYR 98 N -4.05 2.91 0.11 5.02 5.04 -1.26 -4.88 117.35 120.24 3kst s TYR 98 Ca 0.27 1.43 0.00 0.00 -2.44 0.00 0.00 57.07 56.33 3kst s TYR 98 Cb 0.02 -3.64 0.00 0.00 0.35 0.00 0.00 41.96 38.69 3kst s TYR 98 CO 0.09 -1.93 0.00 0.41 -1.34 0.00 0.00 175.55 172.78 3kst n GLY 99 N 0.70 -2.67 0.00 8.97 0.00 -1.26 -4.87 105.19 106.07 3kst n GLY 99 Ca 0.03 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.66 3kst n GLY 99 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kst n THR 100 N -2.48 0.00 -4.06 2.61 -2.24 -1.26 -4.76 114.28 102.09 3kst n THR 100 Ca -0.02 -0.43 -0.10 0.00 -2.27 0.00 0.00 64.05 61.23 3kst n THR 100 Cb 0.12 1.05 -0.07 0.00 -2.10 0.00 0.00 70.33 69.33 3kst n THR 100 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 3kst s TRP 101 N -0.55 0.64 -1.26 4.78 1.48 -1.26 -4.96 118.94 117.80 3kst s TRP 101 Ca 0.00 -0.96 -0.04 0.00 -1.06 0.00 0.00 56.10 54.04 3kst s TRP 101 Cb 0.00 -0.11 0.00 0.00 -1.16 0.00 0.00 33.47 32.20 3kst s TRP 101 CO 0.00 -0.82 1.08 0.41 -4.06 0.00 0.00 176.95 173.56 3kst n GLY 102 N -0.31 -0.44 3.58 3.67 0.00 -1.26 -0.70 105.19 109.73 3kst n GLY 102 Ca -0.01 0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3kst n GLY 102 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kst s PHE 103 N -3.34 2.36 0.10 1.61 0.08 -1.26 -3.49 117.98 114.04 3kst s PHE 103 Ca 0.25 0.44 0.07 0.00 0.12 0.00 0.00 56.93 57.81 3kst s PHE 103 Cb -0.11 -4.43 -0.03 0.00 -0.57 0.00 0.00 43.02 37.88 3kst s PHE 103 CO 0.73 -1.89 -0.17 -1.58 -0.10 0.00 0.00 175.22 172.21 3kst s TRP 104 N 5.79 1.50 -1.12 0.36 0.51 -0.30 -4.51 118.94 121.18 3kst s TRP 104 Ca 0.50 -0.46 -0.11 0.00 -2.12 0.00 0.00 56.10 53.91 3kst s TRP 104 Cb -0.10 -0.82 -0.04 0.00 -0.81 0.00 0.00 33.47 31.71 3kst s TRP 104 CO 0.25 0.14 0.85 0.00 -0.51 0.00 0.00 176.95 177.68 3kst n ALA 105 N 1.01 -2.45 -1.78 0.98 0.00 -1.26 -1.76 120.51 115.26 3kst n ALA 105 Ca -0.19 -0.05 -0.37 0.00 0.00 0.00 0.00 53.44 52.84 3kst n ALA 105 Cb 0.55 -4.64 -0.02 0.00 0.00 0.00 0.00 19.45 15.33 3kst n ALA 105 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3kst s PRO 106 N -5.20 3.92 -0.02 0.00 0.04 -1.26 -4.49 135.00 127.99 3kst s PRO 106 Ca 0.40 1.68 0.01 0.00 0.04 0.00 0.00 61.00 63.13 3kst s PRO 106 Cb -0.09 -2.46 0.01 0.00 0.04 0.00 0.00 34.50 31.99 3kst s PRO 106 CO 0.79 -0.39 -0.04 -1.21 0.04 0.00 0.00 177.00 176.19 3kst s GLU 107 N -2.61 0.50 -0.07 4.56 2.02 0.18 -4.44 118.70 118.83 3kst s GLU 107 Ca 0.61 -0.13 0.05 0.00 0.02 0.00 0.00 54.97 55.52 3kst s GLU 107 Cb -0.26 -0.51 -0.00 0.00 0.10 0.00 0.00 34.13 33.45 3kst s GLU 107 CO 0.32 0.04 -0.22 0.08 0.02 0.00 0.00 175.26 175.50 3kst s VAL 108 N 0.26 1.84 0.01 2.63 1.01 -1.26 -0.52 120.40 124.37 3kst s VAL 108 Ca -0.03 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.03 3kst s VAL 108 Cb -0.06 -1.58 -0.01 0.00 0.00 0.00 0.00 36.38 34.73 3kst s VAL 108 CO -0.00 0.51 -0.03 -0.31 0.00 0.00 0.00 175.10 175.27 3kst s TYR 109 N 0.09 0.25 -0.26 5.22 2.02 -0.31 -4.99 117.35 119.37 3kst s TYR 109 Ca -0.09 -0.20 -0.15 0.00 -0.37 0.00 0.00 57.07 56.26 3kst s TYR 109 Cb -0.15 -0.16 -0.04 0.00 -0.40 0.00 0.00 41.96 41.21 3kst s TYR 109 CO 0.05 -0.06 0.39 -0.47 -1.57 0.00 0.00 175.55 173.89 3kst s TYR 110 N -0.53 3.26 -0.41 2.71 5.04 -1.26 -1.05 117.35 125.11 3kst s TYR 110 Ca -0.04 0.45 -0.12 0.00 -2.44 0.00 0.00 57.07 54.91 3kst s TYR 110 Cb -0.04 -2.58 0.04 0.00 0.35 0.00 0.00 41.96 39.74 3kst s TYR 110 CO -0.00 -0.21 0.27 0.08 -1.34 0.00 0.00 175.55 174.35 3kst s VAL 111 N 2.01 4.76 0.18 3.14 1.01 -0.98 -4.99 120.40 125.53 3kst s VAL 111 Ca 0.16 -0.96 -0.13 0.00 0.00 0.00 0.00 61.98 61.04 3kst s VAL 111 Cb -0.16 -3.74 0.07 0.00 0.00 0.00 0.00 36.38 32.56 3kst s VAL 111 CO 0.10 -0.36 1.78 -0.08 0.00 0.00 0.00 175.10 176.53 3kst h GLU 112 N 8.53 0.44 -0.88 2.72 4.22 -1.96 -1.86 114.58 125.79 3kst h GLU 112 Ca -0.26 -0.03 0.18 0.00 0.08 0.00 0.00 59.36 59.34 3kst h GLU 112 Cb 1.10 -0.10 -0.11 0.00 0.50 0.00 0.00 28.75 30.15 3kst h GLU 112 CO 0.73 0.29 0.42 1.03 -2.18 0.00 0.00 179.01 179.31 3kst h SER 113 N 0.45 0.45 0.88 1.04 0.87 -1.97 -2.13 113.55 113.14 3kst h SER 113 Ca 0.22 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.90 3kst h SER 113 Cb 0.15 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 3kst h SER 113 CO -0.17 0.12 -0.50 0.29 -0.53 0.00 0.00 176.83 176.04 3kst n LYS 114 N -4.95 0.22 -3.75 2.24 4.76 -0.80 -4.98 118.16 110.91 3kst n LYS 114 Ca 0.20 0.08 -0.25 0.00 -2.87 0.00 0.00 58.31 55.46 3kst n LYS 114 Cb 0.54 -1.66 0.04 0.00 -1.84 0.00 0.00 35.03 32.12 3kst n LYS 114 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3kst n LYS 115 N -1.99 -5.98 -3.49 1.97 5.02 -0.77 -4.97 118.16 107.95 3kst n LYS 115 Ca 0.04 0.67 -0.12 0.00 -2.02 0.00 0.00 58.31 56.89 3kst n LYS 115 Cb 0.42 -5.52 -0.03 0.00 -0.02 0.00 0.00 35.03 29.87 3kst n LYS 115 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3kst s LYS 116 N -6.28 1.20 -0.10 1.97 2.20 -1.24 -4.99 119.74 112.50 3kst s LYS 116 Ca 0.42 -0.50 -0.09 0.00 -0.36 0.00 0.00 55.97 55.44 3kst s LYS 116 Cb -0.20 0.55 -0.04 0.00 -1.51 0.00 0.00 37.83 36.62 3kst s LYS 116 CO 0.80 -0.50 0.20 -0.06 -0.36 0.00 0.00 175.35 175.42 3kst s PHE 117 N -3.60 3.62 -0.13 4.03 0.40 -0.06 -2.31 117.98 119.93 3kst s PHE 117 Ca 0.01 0.62 0.02 0.00 -0.60 0.00 0.00 56.93 56.98 3kst s PHE 117 Cb -0.00 -2.03 0.01 0.00 0.51 0.00 0.00 43.02 41.50 3kst s PHE 117 CO -0.11 0.69 -0.21 0.71 0.70 0.00 0.00 175.22 176.99 3kst s TYR 118 N -0.95 2.67 -0.25 0.36 1.51 -0.21 -1.36 117.35 119.12 3kst s TYR 118 Ca 0.17 -1.24 -0.08 0.00 -1.01 0.00 0.00 57.07 54.90 3kst s TYR 118 Cb -0.13 -1.81 -0.03 0.00 -0.11 0.00 0.00 41.96 39.88 3kst s TYR 118 CO 0.06 -0.56 0.09 -1.17 -1.11 0.00 0.00 175.55 172.86 3kst s LEU 119 N 0.72 3.54 -0.13 -1.29 2.96 0.43 -1.16 118.68 123.75 3kst s LEU 119 Ca -0.09 -0.17 -0.03 0.00 -0.22 0.00 0.00 54.13 53.62 3kst s LEU 119 Cb -0.16 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 3kst s LEU 119 CO 0.00 -0.03 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.63 3kst s PHE 120 N 1.59 3.08 0.37 5.38 0.40 0.32 -0.58 117.98 128.54 3kst s PHE 120 Ca 0.06 -0.07 -0.16 0.00 -0.60 0.00 0.00 56.93 56.16 3kst s PHE 120 Cb -0.15 -1.89 0.05 0.00 0.51 0.00 0.00 43.02 41.54 3kst s PHE 120 CO 0.05 0.18 0.79 1.52 0.70 0.00 0.00 175.22 178.46 3kst s TYR 121 N -0.16 0.08 -0.04 0.36 1.13 -0.44 -0.65 117.35 117.64 3kst s TYR 121 Ca 0.04 -0.74 0.07 0.00 -1.41 0.00 0.00 57.07 55.03 3kst s TYR 121 Cb -0.13 0.83 -0.02 0.00 -1.10 0.00 0.00 41.96 41.54 3kst s TYR 121 CO 0.02 -1.53 -0.24 -1.12 -2.51 0.00 0.00 175.55 170.17 3kst s SER 122 N -3.06 3.18 -0.10 -0.18 0.01 -0.72 -0.29 113.70 112.53 3kst s SER 122 Ca 0.15 -0.46 -0.05 0.00 1.31 0.00 0.00 55.95 56.90 3kst s SER 122 Cb -0.05 -0.64 0.04 0.00 0.21 0.00 0.00 66.02 65.58 3kst s SER 122 CO 0.11 0.29 0.24 0.00 0.41 0.00 0.00 173.24 174.28 3kst s ALA 123 N -0.40 -0.54 -1.60 1.44 0.00 -0.53 -1.14 121.76 118.98 3kst s ALA 123 Ca 0.04 0.95 -0.16 0.00 0.00 0.00 0.00 51.96 52.78 3kst s ALA 123 Cb -0.12 -0.60 0.12 0.00 0.00 0.00 0.00 23.12 22.52 3kst s ALA 123 CO 0.01 -0.19 0.91 0.39 0.00 0.00 0.00 175.76 176.89 3kst n GLU 124 N 4.10 -4.61 -3.32 0.00 1.02 0.13 -0.85 120.64 117.10 3kst n GLU 124 Ca -0.24 0.51 -0.24 0.00 -0.02 0.00 0.00 57.16 57.17 3kst n GLU 124 Cb 0.53 -5.35 0.03 0.00 -0.02 0.00 0.00 31.44 26.63 3kst n GLU 124 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3kst n GLU 125 N -4.56 -4.81 -4.43 3.49 1.02 -1.26 -4.97 120.64 105.11 3kst n GLU 125 Ca 0.06 0.71 -0.20 0.00 -0.02 0.00 0.00 57.16 57.71 3kst n GLU 125 Cb 0.51 -5.55 -0.15 0.00 -0.02 0.00 0.00 31.44 26.23 3kst n GLU 125 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3kst s HIS 126 N -3.13 0.95 0.20 -0.32 3.76 -0.03 -1.16 115.29 115.55 3kst s HIS 126 Ca 0.42 -0.20 -0.30 0.00 -0.15 0.00 0.00 55.06 54.83 3kst s HIS 126 Cb -0.20 -0.63 -0.08 0.00 1.11 0.00 0.00 32.58 32.78 3kst s HIS 126 CO 0.52 -0.05 0.94 0.96 -0.85 0.00 0.00 174.74 176.26 3kst s ILE 127 N -0.09 4.22 0.05 0.60 -4.36 -1.17 -1.46 121.20 118.99 3kst s ILE 127 Ca 0.01 2.08 -0.02 0.00 -0.26 0.00 0.00 60.65 62.46 3kst s ILE 127 Cb -0.06 -4.32 -0.04 0.00 1.25 0.00 0.00 42.46 39.29 3kst s ILE 127 CO -0.00 0.44 -0.01 0.00 0.24 0.00 0.00 174.94 175.61 3kst s VAL 129 N -3.74 0.60 0.19 0.00 0.11 -1.26 -1.33 120.40 114.98 3kst s VAL 129 Ca 0.05 -0.37 0.04 0.00 -2.93 0.00 0.00 61.98 58.76 3kst s VAL 129 Cb 0.06 -0.51 -0.05 0.00 -1.53 0.00 0.00 36.38 34.35 3kst s VAL 129 CO -0.09 0.14 -0.04 0.00 -3.33 0.00 0.00 175.10 171.77 3kst s ALA 130 N -0.25 1.62 0.18 1.54 0.00 0.25 -4.74 121.76 120.37 3kst s ALA 130 Ca 0.02 -1.64 0.06 0.00 0.00 0.00 0.00 51.96 50.39 3kst s ALA 130 Cb -0.03 0.34 -0.05 0.00 0.00 0.00 0.00 23.12 23.38 3kst s ALA 130 CO -0.00 -0.20 -0.10 0.95 0.00 0.00 0.00 175.76 176.40 3kst s THR 131 N -3.41 1.37 0.03 0.00 -4.23 -0.37 -0.43 115.64 108.61 3kst s THR 131 Ca 0.24 -2.11 -0.15 0.00 -1.18 0.00 0.00 61.69 58.48 3kst s THR 131 Cb 0.05 -2.00 0.03 0.00 1.34 0.00 0.00 72.50 71.91 3kst s THR 131 CO 0.05 -0.63 0.34 -0.55 -0.54 0.00 0.00 174.62 173.30 3kst s SER 132 N -3.25 -0.19 0.01 3.99 0.15 -0.46 -1.01 113.70 112.94 3kst s SER 132 Ca 0.21 -0.08 0.25 0.00 0.70 0.00 0.00 55.95 57.03 3kst s SER 132 Cb 0.02 0.37 0.59 0.00 -1.71 0.00 0.00 66.02 65.29 3kst s SER 132 CO 0.04 -0.60 1.48 1.07 1.20 0.00 0.00 173.24 176.43 3kst n THR 133 N 0.67 0.03 -4.30 6.45 5.66 -1.26 -0.88 114.28 120.65 3kst n THR 133 Ca -0.19 -0.02 -0.20 0.00 -3.05 0.00 0.00 64.05 60.59 3kst n THR 133 Cb 0.59 0.11 -0.11 0.00 -1.55 0.00 0.00 70.33 69.37 3kst n THR 133 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3kst s THR 134 N -3.01 1.63 0.37 1.09 -4.23 -1.26 -4.85 115.64 105.37 3kst s THR 134 Ca 0.11 -1.92 0.04 0.00 -1.18 0.00 0.00 61.69 58.74 3kst s THR 134 Cb 0.17 -1.79 0.25 0.00 1.34 0.00 0.00 72.50 72.48 3kst s THR 134 CO 0.68 -0.41 2.01 -0.65 -0.54 0.00 0.00 174.62 175.70 3kst h PRO 135 N 3.18 0.72 0.00 3.99 0.11 -2.00 -3.12 132.00 134.89 3kst h PRO 135 Ca -0.40 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 3kst h PRO 135 Cb 1.21 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 3kst h PRO 135 CO 0.53 0.50 -0.21 1.05 -0.21 0.00 0.00 178.00 179.66 3kst h GLU 136 N 0.74 0.00 0.00 1.05 9.09 -1.97 -3.50 114.58 119.99 3kst h GLU 136 Ca 0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.61 3kst h GLU 136 Cb -0.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.06 3kst h GLU 136 CO -0.04 0.21 0.00 0.41 0.05 0.00 0.00 179.01 179.65 3kst n GLY 137 N 0.83 -1.71 3.75 1.06 0.00 -1.18 -3.90 105.19 104.04 3kst n GLY 137 Ca 0.02 -2.05 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 3kst n GLY 137 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kst s PRO 138 N 0.00 4.37 -0.04 1.61 0.05 -1.26 -4.73 135.00 135.00 3kst s PRO 138 Ca 0.00 2.14 -0.19 0.00 0.05 0.00 0.00 61.00 63.00 3kst s PRO 138 Cb 0.00 -3.14 -0.05 0.00 0.05 0.00 0.00 34.50 31.36 3kst s PRO 138 CO 0.00 -0.24 0.52 -0.06 0.05 0.00 0.00 177.00 177.27 3kst s PHE 139 N -0.36 3.64 0.05 0.56 0.40 0.11 -4.50 117.98 117.88 3kst s PHE 139 Ca 0.54 1.06 -0.06 0.00 -0.60 0.00 0.00 56.93 57.87 3kst s PHE 139 Cb -0.38 -2.53 -0.01 0.00 0.51 0.00 0.00 43.02 40.61 3kst s PHE 139 CO 0.44 0.35 0.11 1.03 0.70 0.00 0.00 175.22 177.84 3kst s ARG 140 N -0.11 0.66 -0.12 0.44 0.52 -0.18 -4.51 118.95 115.65 3kst s ARG 140 Ca 0.28 -0.86 -0.05 0.00 -0.52 0.00 0.00 55.73 54.58 3kst s ARG 140 Cb -0.17 0.26 -0.04 0.00 0.52 0.00 0.00 34.95 35.52 3kst s ARG 140 CO 0.14 -0.17 0.07 -0.65 0.02 0.00 0.00 175.30 174.70 3kst s GLN 141 N -3.09 3.38 0.00 3.54 -0.21 -0.83 -1.23 119.66 121.23 3kst s GLN 141 Ca -0.01 -0.29 -0.21 0.00 0.02 0.00 0.00 55.36 54.87 3kst s GLN 141 Cb 0.02 -3.03 -0.21 0.00 1.00 0.00 0.00 33.01 30.78 3kst s GLN 141 CO -0.07 0.63 1.15 0.93 -2.12 0.00 0.00 175.29 175.81 3kst h GLU 142 N 5.46 0.34 -5.17 2.91 5.08 -1.93 -3.42 114.58 117.84 3kst h GLU 142 Ca -0.49 -0.31 -0.66 0.00 -1.00 0.00 0.00 59.36 56.91 3kst h GLU 142 Cb 1.20 0.07 -0.28 0.00 0.50 0.00 0.00 28.75 30.24 3kst h GLU 142 CO 0.59 0.96 -0.76 0.08 -1.00 0.00 0.00 179.01 178.89 3kst s VAL 143 N -3.48 3.07 -1.37 3.13 1.01 -1.26 -5.05 120.40 116.44 3kst s VAL 143 Ca -0.14 -0.63 -0.12 0.00 0.00 0.00 0.00 61.98 61.09 3kst s VAL 143 Cb 0.03 -2.33 0.10 0.00 0.00 0.00 0.00 36.38 34.18 3kst s VAL 143 CO 0.78 0.49 2.04 0.29 0.00 0.00 0.00 175.10 178.70 3kst n LYS 144 N 4.11 3.18 -4.15 2.72 4.01 -1.26 -4.91 118.16 121.86 3kst n LYS 144 Ca -0.18 -3.03 -0.12 0.00 -0.51 0.00 0.00 58.31 54.46 3kst n LYS 144 Cb 0.52 -3.15 -0.10 0.00 -0.51 0.00 0.00 35.03 31.78 3kst n LYS 144 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 3kst s GLN 145 N 2.11 0.78 0.97 1.97 -1.52 -1.26 -4.26 119.66 118.46 3kst s GLN 145 Ca 0.44 -1.18 -0.16 0.00 -1.95 0.00 0.00 55.36 52.52 3kst s GLN 145 Cb 0.11 -0.32 0.19 0.00 -0.22 0.00 0.00 33.01 32.77 3kst s GLN 145 CO -0.04 0.02 1.25 -1.25 -0.25 0.00 0.00 175.29 175.02 3kst s PRO 146 N -3.11 0.58 0.10 2.91 0.04 -1.26 -4.76 135.00 129.50 3kst s PRO 146 Ca 0.06 -0.20 -0.16 0.00 0.04 0.00 0.00 61.00 60.74 3kst s PRO 146 Cb 0.00 -1.82 -0.06 0.00 0.04 0.00 0.00 34.50 32.66 3kst s PRO 146 CO -0.02 -2.48 1.50 0.82 0.04 0.00 0.00 177.00 176.85 3kst h ILE 147 N -1.70 1.28 -4.39 0.56 2.04 -1.01 -3.47 117.51 110.83 3kst h ILE 147 Ca -0.45 -1.13 -0.24 0.00 1.00 0.00 0.00 64.86 64.04 3kst h ILE 147 Cb 1.27 1.38 -0.13 0.00 -0.74 0.00 0.00 36.82 38.60 3kst h ILE 147 CO 0.44 0.36 -0.45 -1.66 0.00 0.00 0.00 178.15 176.84 3kst s TRP 148 N -4.76 1.07 0.17 1.37 1.48 -1.26 -4.62 118.94 112.39 3kst s TRP 148 Ca -0.13 -1.28 0.05 0.00 -1.06 0.00 0.00 56.10 53.68 3kst s TRP 148 Cb 0.09 -0.38 0.01 0.00 -1.16 0.00 0.00 33.47 32.03 3kst s TRP 148 CO 0.79 -0.80 1.39 0.77 -4.06 0.00 0.00 176.95 175.04 3kst h SER 149 N 2.42 0.15 -3.86 -2.66 0.02 -1.96 -3.44 113.55 104.22 3kst h SER 149 Ca -0.32 -0.12 -0.50 0.00 -0.84 0.00 0.00 61.79 60.02 3kst h SER 149 Cb 1.25 -0.04 0.02 0.00 0.14 0.00 0.00 62.40 63.76 3kst h SER 149 CO 0.46 0.94 0.45 -0.70 -1.14 0.00 0.00 176.83 176.84 3kst s GLU 150 N -3.15 4.48 0.19 3.45 2.12 -1.26 -4.97 118.70 119.55 3kst s GLU 150 Ca -0.02 1.71 -0.33 0.00 0.36 0.00 0.00 54.97 56.70 3kst s GLU 150 Cb 0.11 -2.98 -0.13 0.00 0.26 0.00 0.00 34.13 31.38 3kst s GLU 150 CO 0.81 0.09 1.57 1.63 -0.54 0.00 0.00 175.26 178.82 3kst n LYS 151 N 0.77 2.25 -3.46 4.30 5.02 -1.26 -4.69 118.16 121.09 3kst n LYS 151 Ca 0.01 0.81 -0.11 0.00 -2.02 0.00 0.00 58.31 57.00 3kst n LYS 151 Cb 0.46 -2.57 -0.02 0.00 -0.02 0.00 0.00 35.03 32.88 3kst n LYS 151 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3kst s SER 152 N 0.81 -0.48 0.33 4.39 1.04 -0.31 -4.49 113.70 114.99 3kst s SER 152 Ca 0.75 0.03 -0.02 0.00 0.48 0.00 0.00 55.95 57.19 3kst s SER 152 Cb -0.64 0.50 -0.00 0.00 0.10 0.00 0.00 66.02 65.98 3kst s SER 152 CO 0.40 -0.80 0.43 0.27 0.98 0.00 0.00 173.24 174.53 3kst s ILE 153 N -3.35 0.00 -1.30 -1.02 -4.36 -0.97 -2.59 121.20 107.61 3kst s ILE 153 Ca 0.02 -1.65 -0.07 0.00 -0.26 0.00 0.00 60.65 58.69 3kst s ILE 153 Cb -0.01 -2.59 0.01 0.00 1.25 0.00 0.00 42.46 41.12 3kst s ILE 153 CO -0.10 0.00 0.92 0.47 0.24 0.00 0.00 174.94 176.46 3kst n ASP 154 N -1.30 -5.93 -4.53 4.36 9.92 -1.26 -0.32 116.55 117.49 3kst n ASP 154 Ca 0.02 -0.42 -0.50 0.00 -0.53 0.00 0.00 54.79 53.35 3kst n ASP 154 Cb 0.62 -4.62 -0.04 0.00 -0.64 0.00 0.00 41.12 36.44 3kst n ASP 154 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 3kst n THR 155 N -4.67 0.97 -3.67 -3.53 -2.24 -1.26 -4.34 114.28 95.53 3kst n THR 155 Ca -0.03 -0.24 -0.14 0.00 -2.27 0.00 0.00 64.05 61.37 3kst n THR 155 Cb 0.57 -0.55 -0.13 0.00 -2.10 0.00 0.00 70.33 68.12 3kst n THR 155 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3kst s SER 156 N -0.20 0.30 0.07 3.42 0.15 0.59 -4.73 113.70 113.30 3kst s SER 156 Ca 0.74 0.56 -0.22 0.00 0.70 0.00 0.00 55.95 57.73 3kst s SER 156 Cb -0.94 0.61 -0.06 0.00 -1.71 0.00 0.00 66.02 63.92 3kst s SER 156 CO 0.54 -0.23 0.65 -0.22 1.20 0.00 0.00 173.24 175.19 3kst s LEU 157 N 2.22 4.50 -0.08 3.45 2.96 -1.26 -0.22 118.68 130.25 3kst s LEU 157 Ca -0.00 1.35 0.01 0.00 -0.22 0.00 0.00 54.13 55.27 3kst s LEU 157 Cb -0.12 -3.05 0.02 0.00 0.50 0.00 0.00 46.19 43.55 3kst s LEU 157 CO -0.08 0.17 -0.08 0.12 -1.32 0.00 0.00 176.35 175.16 3kst s PHE 158 N -0.70 1.24 -0.24 5.38 5.36 0.24 -4.87 117.98 124.39 3kst s PHE 158 Ca 0.33 -0.50 -0.05 0.00 -0.96 0.00 0.00 56.93 55.75 3kst s PHE 158 Cb -0.20 -1.01 -0.01 0.00 -0.34 0.00 0.00 43.02 41.46 3kst s PHE 158 CO 0.21 -0.34 0.01 0.42 -1.46 0.00 0.00 175.22 174.06 3kst s ILE 159 N 1.17 3.70 0.87 3.12 1.01 -1.26 -0.10 121.20 129.71 3kst s ILE 159 Ca -0.06 -0.48 -0.12 0.00 0.00 0.00 0.00 60.65 59.99 3kst s ILE 159 Cb -0.14 -2.75 0.11 0.00 0.01 0.00 0.00 42.46 39.69 3kst s ILE 159 CO -0.02 0.32 1.14 -0.62 0.00 0.00 0.00 174.94 175.76 3kst s ASP 160 N 1.51 3.90 0.46 3.58 -1.08 -0.34 -4.88 116.67 119.82 3kst s ASP 160 Ca 0.05 0.96 0.19 0.00 -0.52 0.00 0.00 52.55 53.23 3kst s ASP 160 Cb -0.15 -1.54 1.17 0.00 -1.46 0.00 0.00 42.92 40.94 3kst s ASP 160 CO -0.00 -2.31 1.96 0.44 0.52 0.00 0.00 175.17 175.77 3kst h ASP 161 N -1.33 0.25 -0.05 -0.34 3.32 -1.99 0.13 116.42 116.41 3kst h ASP 161 Ca -0.49 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.57 3kst h ASP 161 Cb 1.32 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.83 3kst h ASP 161 CO 0.63 0.13 0.00 -0.90 -1.72 0.00 0.00 179.24 177.38 3kst n ASP 162 N -4.44 0.46 0.00 6.45 5.68 -1.26 -4.89 116.55 118.54 3kst n ASP 162 Ca 0.12 -1.57 0.00 0.00 -0.50 0.00 0.00 54.79 52.84 3kst n ASP 162 Cb 0.53 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 3kst n ASP 162 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kst n GLY 163 N 0.85 0.67 3.69 6.12 0.00 0.47 -5.02 105.19 111.97 3kst n GLY 163 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3kst n GLY 163 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kst s THR 164 N -2.67 4.56 0.00 2.61 2.01 -1.25 -4.70 115.64 116.21 3kst s THR 164 Ca 0.00 1.85 -0.17 0.00 0.31 0.00 0.00 61.69 63.68 3kst s THR 164 Cb 0.00 -4.19 -0.06 0.00 0.01 0.00 0.00 72.50 68.27 3kst s THR 164 CO 0.00 0.04 0.47 -2.16 -0.69 0.00 0.00 174.62 172.28 3kst s PRO 165 N 1.79 4.07 -0.03 4.92 0.04 -1.26 -1.20 135.00 143.33 3kst s PRO 165 Ca 0.52 0.52 0.04 0.00 0.04 0.00 0.00 61.00 62.12 3kst s PRO 165 Cb -0.22 -3.26 -0.01 0.00 0.04 0.00 0.00 34.50 31.06 3kst s PRO 165 CO 0.22 0.60 -0.15 0.71 0.04 0.00 0.00 177.00 178.42 3kst s TYR 166 N -0.83 1.41 -0.14 0.56 2.02 0.86 -4.46 117.35 116.76 3kst s TYR 166 Ca 0.26 -0.34 0.01 0.00 -0.37 0.00 0.00 57.07 56.63 3kst s TYR 166 Cb -0.17 -0.94 -0.00 0.00 -0.40 0.00 0.00 41.96 40.44 3kst s TYR 166 CO 0.15 -0.09 -0.16 -1.17 -1.57 0.00 0.00 175.55 172.71 3kst s LEU 167 N -0.11 2.49 -0.12 -1.29 2.96 -0.18 -0.59 118.68 121.84 3kst s LEU 167 Ca 0.01 -0.45 -0.06 0.00 -0.22 0.00 0.00 54.13 53.41 3kst s LEU 167 Cb -0.08 -1.56 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 3kst s LEU 167 CO 0.01 0.11 0.12 -0.31 -1.32 0.00 0.00 176.35 174.95 3kst s TYR 168 N 0.67 3.53 0.16 5.38 1.51 0.69 -1.93 117.35 127.35 3kst s TYR 168 Ca -0.08 0.47 -0.25 0.00 -1.01 0.00 0.00 57.07 56.21 3kst s TYR 168 Cb -0.16 -1.92 0.06 0.00 -0.11 0.00 0.00 41.96 39.83 3kst s TYR 168 CO 0.02 0.69 0.86 -0.59 -1.11 0.00 0.00 175.55 175.42 3kst s PHE 169 N -0.97 -0.21 -0.15 2.71 -0.71 -0.41 -0.30 117.98 117.94 3kst s PHE 169 Ca 0.14 -0.09 -0.11 0.00 -1.04 0.00 0.00 56.93 55.84 3kst s PHE 169 Cb -0.12 0.63 -0.05 0.00 -1.21 0.00 0.00 43.02 42.28 3kst s PHE 169 CO 0.04 -0.88 0.20 0.08 -1.34 0.00 0.00 175.22 173.32 3kst s VAL 170 N -3.44 5.38 0.27 -2.49 1.01 0.57 0.08 120.40 121.77 3kst s VAL 170 Ca 0.10 0.35 0.10 0.00 0.00 0.00 0.00 61.98 62.52 3kst s VAL 170 Cb -0.02 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 3kst s VAL 170 CO 0.00 0.48 -0.00 -0.13 0.00 0.00 0.00 175.10 175.45 3kst s ARG 171 N -0.05 2.28 -0.88 2.72 0.52 -0.60 -2.29 118.95 120.65 3kst s ARG 171 Ca 0.13 -1.43 -0.01 0.00 -0.52 0.00 0.00 55.73 53.91 3kst s ARG 171 Cb -0.12 -2.15 0.34 0.00 0.52 0.00 0.00 34.95 33.54 3kst s ARG 171 CO 0.02 0.36 1.84 1.19 0.02 0.00 0.00 175.30 178.73 3kst n PHE 172 N -0.90 2.98 0.19 -0.53 3.72 -1.26 -1.46 117.46 120.19 3kst n PHE 172 Ca -0.06 -2.55 0.12 0.00 -0.05 0.00 0.00 57.45 54.90 3kst n PHE 172 Cb 0.59 -1.09 0.04 0.00 -0.94 0.00 0.00 39.48 38.07 3kst n PHE 172 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 3kst h THR 173 N 2.17 0.00 0.00 4.37 1.35 -1.95 -3.41 112.91 115.44 3kst h THR 173 Ca 0.52 -0.92 -0.15 0.00 -0.55 0.00 0.00 66.41 65.32 3kst h THR 173 Cb 0.22 1.45 -0.14 0.00 -1.73 0.00 0.00 68.15 67.96 3kst h THR 173 CO 1.27 0.00 -0.27 -0.67 -0.25 0.00 0.00 175.52 175.60 3kst n ASP 174 N -2.61 -2.10 -0.15 5.36 2.03 -1.26 -5.08 116.55 112.73 3kst n ASP 174 Ca 0.01 -2.58 0.00 0.00 0.52 0.00 0.00 54.79 52.74 3kst n ASP 174 Cb 0.53 1.30 0.00 0.00 -0.72 0.00 0.00 41.12 42.23 3kst n ASP 174 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3kst n GLY 175 N 1.53 -0.19 3.68 0.27 0.00 -1.26 -4.58 105.19 104.63 3kst n GLY 175 Ca 0.05 -1.02 -0.42 0.00 0.00 0.00 0.00 46.02 44.62 3kst n GLY 175 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kst s ASN 176 N -4.00 6.96 -0.04 1.61 -0.87 -0.26 -4.30 114.94 114.04 3kst s ASN 176 Ca 0.00 1.85 0.04 0.00 -1.57 0.00 0.00 52.86 53.18 3kst s ASN 176 Cb 0.00 -2.55 -0.00 0.00 -0.02 0.00 0.00 41.25 38.68 3kst s ASN 176 CO 0.00 -0.68 -0.16 -0.69 -2.57 0.00 0.00 177.10 173.00 3kst s VAL 177 N 2.75 1.33 -0.18 1.60 1.01 -0.54 -1.02 120.40 125.35 3kst s VAL 177 Ca 0.58 -0.65 -0.26 0.00 0.00 0.00 0.00 61.98 61.64 3kst s VAL 177 Cb -0.25 -1.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.97 3kst s VAL 177 CO 0.21 0.39 0.89 -0.63 0.00 0.00 0.00 175.10 175.95 3kst s ILE 178 N 0.11 4.83 0.34 2.22 1.01 0.10 -1.56 121.20 128.25 3kst s ILE 178 Ca -0.05 1.74 0.09 0.00 0.00 0.00 0.00 60.65 62.43 3kst s ILE 178 Cb -0.12 -4.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.12 3kst s ILE 178 CO 0.02 -0.03 0.03 0.26 0.00 0.00 0.00 174.94 175.22 3kst s TRP 179 N 2.44 2.56 0.02 3.97 0.52 0.11 0.14 118.94 128.70 3kst s TRP 179 Ca 0.40 -0.44 -0.00 0.00 0.02 0.00 0.00 56.10 56.08 3kst s TRP 179 Cb -0.16 -1.51 -0.02 0.00 -1.15 0.00 0.00 33.47 30.63 3kst s TRP 179 CO 0.11 0.46 -0.02 0.54 0.02 0.00 0.00 176.95 178.06 3kst s VAL 180 N -2.51 0.09 0.03 4.03 0.11 0.36 -1.29 120.40 121.21 3kst s VAL 180 Ca 0.35 -0.72 -0.06 0.00 -2.93 0.00 0.00 61.98 58.63 3kst s VAL 180 Cb -0.00 -0.21 -0.01 0.00 -1.53 0.00 0.00 36.38 34.63 3kst s VAL 180 CO 0.20 -0.40 0.10 0.00 -3.33 0.00 0.00 175.10 171.67 3kst s ALA 181 N -1.16 -0.11 1.00 1.54 0.00 -0.81 -0.90 121.76 121.32 3kst s ALA 181 Ca -0.13 -0.47 0.00 0.00 0.00 0.00 0.00 51.96 51.36 3kst s ALA 181 Cb -0.08 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.26 3kst s ALA 181 CO -0.01 -0.29 0.00 0.94 0.00 0.00 0.00 175.76 176.40 3kst n GLN 182 N 0.93 1.19 -3.99 0.00 7.27 -1.26 -1.01 117.38 120.51 3kst n GLN 182 Ca -0.20 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.66 3kst n GLN 182 Cb 0.58 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.20 3kst n GLN 182 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 3kst s THR 184 N 0.00 4.62 0.49 1.69 -4.23 -0.44 -0.56 115.64 117.21 3kst s THR 184 Ca 0.00 -1.22 0.23 0.00 -1.18 0.00 0.00 61.69 59.52 3kst s THR 184 Cb 0.00 -3.54 0.28 0.00 1.34 0.00 0.00 72.50 70.57 3kst s THR 184 CO 0.00 -0.31 2.11 0.44 -0.54 0.00 0.00 174.62 176.32 3kst h ASP 185 N 1.31 0.00 0.60 3.99 3.32 -1.97 -0.93 116.42 122.74 3kst h ASP 185 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 3kst h ASP 185 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 3kst h ASP 185 CO 0.60 0.09 0.00 -0.90 -1.72 0.00 0.00 179.24 177.31 3kst n ASP 186 N -4.01 0.00 -2.80 6.45 5.68 -1.26 -5.07 116.55 115.55 3kst n ASP 186 Ca -0.02 0.48 -0.01 0.00 -0.50 0.00 0.00 54.79 54.73 3kst n ASP 186 Cb 0.18 -0.49 0.00 0.00 -1.14 0.00 0.00 41.12 39.67 3kst n ASP 186 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3kst n LEU 187 N -1.49 -6.18 -4.02 -2.12 4.77 -0.35 -5.18 117.00 102.43 3kst n LEU 187 Ca 0.05 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.66 3kst n LEU 187 Cb 0.21 -2.97 0.04 0.00 -2.33 0.00 0.00 43.42 38.37 3kst n LEU 187 CO 0.16 -1.08 -1.67 -1.54 -1.33 0.00 0.00 177.39 171.93 3kst n SER 189 N -1.49 -4.41 -4.78 -1.43 3.41 -1.26 -4.95 113.62 98.70 3kst n SER 189 Ca 0.01 0.09 -0.29 0.00 -0.26 0.00 0.00 58.87 58.42 3kst n SER 189 Cb 0.49 -0.65 -0.06 0.00 -0.26 0.00 0.00 64.21 63.72 3kst n SER 189 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3kst s ILE 190 N -2.02 4.52 -0.56 -1.33 -4.36 -1.26 -1.33 121.20 114.86 3kst s ILE 190 Ca 0.39 -0.88 -0.19 0.00 -0.26 0.00 0.00 60.65 59.71 3kst s ILE 190 Cb -0.04 -3.23 0.09 0.00 1.25 0.00 0.00 42.46 40.54 3kst s ILE 190 CO 0.74 0.04 0.65 -0.54 0.24 0.00 0.00 174.94 176.07 3kst s LYS 191 N -2.66 3.05 0.55 0.37 1.02 0.28 -4.85 119.74 117.50 3kst s LYS 191 Ca 0.30 -1.26 0.28 0.00 0.02 0.00 0.00 55.97 55.31 3kst s LYS 191 Cb -0.11 -4.22 1.58 0.00 -0.52 0.00 0.00 37.83 34.55 3kst s LYS 191 CO 0.23 -1.42 2.14 1.79 -0.92 0.00 0.00 175.35 177.16 3kst h THR 192 N 5.90 0.56 0.00 2.17 1.35 -1.98 -2.09 112.91 118.81 3kst h THR 192 Ca -0.29 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 3kst h THR 192 Cb 1.09 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 3kst h THR 192 CO 1.05 0.08 0.00 -1.84 -0.25 0.00 0.00 175.52 174.56 3kst n GLU 193 N -3.72 0.12 -0.27 4.72 0.00 -1.26 -1.62 120.64 118.61 3kst n GLU 193 Ca -0.02 0.49 0.11 0.00 0.00 0.00 0.00 57.16 57.74 3kst n GLU 193 Cb 0.18 -1.80 0.27 0.00 0.00 0.00 0.00 31.44 30.10 3kst n GLU 193 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 3kst n THR 194 N -2.03 0.70 -1.72 3.84 -2.24 -0.79 -5.00 114.28 107.04 3kst n THR 194 Ca 0.01 -0.80 -0.42 0.00 -2.27 0.00 0.00 64.05 60.56 3kst n THR 194 Cb 0.11 0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 68.96 3kst n THR 194 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3kst n LEU 195 N 1.40 4.00 -3.91 3.22 4.77 -0.64 -4.44 117.00 121.40 3kst n LEU 195 Ca 0.21 1.09 -0.12 0.00 -0.03 0.00 0.00 56.01 57.16 3kst n LEU 195 Cb 0.57 -1.56 -0.13 0.00 -2.33 0.00 0.00 43.42 39.96 3kst n LEU 195 CO 0.15 0.11 -0.37 0.20 -1.33 0.00 0.00 177.39 176.16 3kst s ASN 196 N 0.91 0.17 -0.15 -1.43 0.01 -0.08 -5.00 114.94 109.36 3kst s ASN 196 Ca 0.72 -0.13 -0.17 0.00 -0.71 0.00 0.00 52.86 52.57 3kst s ASN 196 Cb -0.52 0.01 -0.04 0.00 0.41 0.00 0.00 41.25 41.11 3kst s ASN 196 CO 0.38 -0.05 0.43 -1.58 -1.51 0.00 0.00 177.10 174.77 3kst s GLN 197 N -0.35 4.28 -0.09 -0.60 0.74 -1.26 -0.48 119.66 121.89 3kst s GLN 197 Ca -0.03 0.34 -0.10 0.00 0.05 0.00 0.00 55.36 55.62 3kst s GLN 197 Cb -0.03 -3.47 -0.03 0.00 1.10 0.00 0.00 33.01 30.58 3kst s GLN 197 CO -0.00 0.10 -0.19 0.00 -0.55 0.00 0.00 175.29 174.65 3kst s ILE 199 N -2.14 0.47 0.17 0.00 -1.09 -0.89 -4.75 121.20 112.98 3kst s ILE 199 Ca -0.16 -0.10 0.11 0.00 -2.23 0.00 0.00 60.65 58.27 3kst s ILE 199 Cb 0.02 -0.50 -0.04 0.00 -1.58 0.00 0.00 42.46 40.36 3kst s ILE 199 CO 0.23 0.20 -0.23 -0.75 -1.23 0.00 0.00 174.94 173.16 3kst s LYS 200 N 0.82 1.43 -0.24 2.79 2.20 -1.26 0.02 119.74 125.50 3kst s LYS 200 Ca -0.11 -1.46 -0.29 0.00 -0.36 0.00 0.00 55.97 53.76 3kst s LYS 200 Cb -0.13 -1.73 -0.00 0.00 -1.51 0.00 0.00 37.83 34.45 3kst s LYS 200 CO -0.00 0.38 1.25 0.00 -0.36 0.00 0.00 175.35 176.62 3kst s ALA 201 N -1.61 3.52 0.00 3.13 0.00 -1.26 -4.86 121.76 120.68 3kst s ALA 201 Ca 0.18 0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.39 3kst s ALA 201 Cb -0.08 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.35 3kst s ALA 201 CO 0.08 -1.45 0.00 0.39 0.00 0.00 0.00 175.76 174.78 3kst n GLU 202 N 6.92 0.57 -3.79 0.00 1.02 -1.26 -4.89 120.64 119.22 3kst n GLU 202 Ca 0.14 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 57.08 3kst n GLU 202 Cb 0.46 -0.60 -0.01 0.00 -0.02 0.00 0.00 31.44 31.26 3kst n GLU 202 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3kst s VAL 203 N -1.20 4.82 0.22 2.62 -7.23 -1.26 -4.97 120.40 113.39 3kst s VAL 203 Ca 0.00 -0.99 -0.17 0.00 -1.81 0.00 0.00 61.98 59.01 3kst s VAL 203 Cb 0.00 -3.69 0.23 0.00 0.56 0.00 0.00 36.38 33.48 3kst s VAL 203 CO 0.00 -0.27 1.58 -1.28 -0.31 0.00 0.00 175.10 174.82 3kst h SER 204 N 1.07 -1.12 0.04 4.85 0.87 -2.00 -1.17 113.55 116.09 3kst h SER 204 Ca -0.50 0.26 -0.02 0.00 -1.23 0.00 0.00 61.79 60.30 3kst h SER 204 Cb 1.24 0.61 -0.01 0.00 -0.44 0.00 0.00 62.40 63.80 3kst h SER 204 CO 0.58 -0.29 -0.07 4.11 -0.53 0.00 0.00 176.83 180.63 3kst h TRP 205 N -0.06 0.08 0.00 2.24 5.08 -1.96 -0.88 115.95 120.45 3kst h TRP 205 Ca 0.32 -0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.28 3kst h TRP 205 Cb 0.58 -0.03 0.00 0.00 -3.00 0.00 0.00 29.16 26.72 3kst h TRP 205 CO -0.71 0.16 0.00 0.39 -1.28 0.00 0.00 178.44 177.00 3kst n GLU 206 N -4.41 0.20 -2.07 0.12 1.02 -0.46 -4.12 120.64 110.92 3kst n GLU 206 Ca -0.02 0.02 -0.17 0.00 -0.02 0.00 0.00 57.16 56.97 3kst n GLU 206 Cb 0.18 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.13 3kst n GLU 206 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3kst n LEU 207 N -1.40 4.14 0.08 -4.62 4.77 -0.33 -3.94 117.00 115.71 3kst n LEU 207 Ca 0.10 -4.35 -0.10 0.00 -0.03 0.00 0.00 56.01 51.63 3kst n LEU 207 Cb 0.28 -0.20 -0.04 0.00 -2.33 0.00 0.00 43.42 41.12 3kst n LEU 207 CO 0.24 1.85 0.19 -0.07 -1.33 0.00 0.00 177.39 178.27 3kst h LEU 208 N 2.17 0.25 -7.06 2.23 3.38 -1.71 -3.46 115.31 111.10 3kst h LEU 208 Ca 0.25 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3kst h LEU 208 Cb 1.46 -0.08 -0.23 0.00 0.09 0.00 0.00 40.66 41.91 3kst h LEU 208 CO 0.60 1.06 -0.18 -1.58 0.09 0.00 0.00 178.44 178.43 3kst s GLN 209 N -3.06 0.52 1.96 1.13 0.74 -1.26 -5.05 119.66 114.63 3kst s GLN 209 Ca -0.03 1.21 0.00 0.00 0.05 0.00 0.00 55.36 56.59 3kst s GLN 209 Cb 0.10 0.46 0.00 0.00 1.10 0.00 0.00 33.01 34.66 3kst s GLN 209 CO 0.84 -0.20 0.00 0.41 -0.55 0.00 0.00 175.29 175.79 3kst n GLY 210 N 5.03 -0.89 2.70 2.59 0.00 -1.26 -1.69 105.19 111.67 3kst n GLY 210 Ca -0.14 -1.08 -0.29 0.00 0.00 0.00 0.00 46.02 44.50 3kst n GLY 210 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3kst s LYS 211 N 0.00 1.31 -0.08 1.61 2.20 -1.26 -4.73 119.74 118.79 3kst s LYS 211 Ca 0.00 -2.07 -0.01 0.00 -0.36 0.00 0.00 55.97 53.54 3kst s LYS 211 Cb 0.00 -2.31 0.03 0.00 -1.51 0.00 0.00 37.83 34.03 3kst s LYS 211 CO 0.00 -1.18 -0.03 0.08 -0.36 0.00 0.00 175.35 173.85 3kst s VAL 212 N 0.26 0.62 -0.13 4.02 1.01 -1.26 -1.10 120.40 123.83 3kst s VAL 212 Ca 0.19 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.11 3kst s VAL 212 Cb -0.21 -0.71 0.02 0.00 0.00 0.00 0.00 36.38 35.48 3kst s VAL 212 CO -0.02 0.29 -0.13 0.00 0.00 0.00 0.00 175.10 175.24 3kst s ALA 213 N 1.67 1.69 0.00 5.51 0.00 -0.19 -2.23 121.76 128.21 3kst s ALA 213 Ca 0.02 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.21 3kst s ALA 213 Cb -0.13 -0.94 0.00 0.00 0.00 0.00 0.00 23.12 22.06 3kst s ALA 213 CO -0.05 -0.26 0.00 -0.85 0.00 0.00 0.00 175.76 174.60 3kst n GLU 214 N 4.56 0.00 -3.89 0.00 0.28 0.28 -3.68 120.64 118.19 3kst n GLU 214 Ca -0.17 0.00 -0.27 0.00 -0.16 0.00 0.00 57.16 56.55 3kst n GLU 214 Cb 0.50 0.00 -0.00 0.00 1.43 0.00 0.00 31.44 33.37 3kst n GLU 214 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3kst n GLY 215 N 0.00 -0.42 3.76 -1.84 0.00 -1.26 -0.81 105.19 104.63 3kst n GLY 215 Ca 0.00 0.22 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 3kst n GLY 215 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kst s PRO 216 N -6.45 3.58 0.00 1.61 0.04 -1.26 -4.04 135.00 128.47 3kst s PRO 216 Ca 0.13 1.91 0.02 0.00 0.04 0.00 0.00 61.00 63.10 3kst s PRO 216 Cb -0.05 -2.37 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 3kst s PRO 216 CO 0.88 -0.74 -0.06 -1.12 0.04 0.00 0.00 177.00 176.00 3kst s SER 217 N -1.23 0.71 -0.14 6.66 0.01 0.22 -4.62 113.70 115.31 3kst s SER 217 Ca 0.66 -0.16 0.02 0.00 1.31 0.00 0.00 55.95 57.78 3kst s SER 217 Cb -0.32 -0.06 0.01 0.00 0.21 0.00 0.00 66.02 65.86 3kst s SER 217 CO 0.39 0.04 -0.21 -0.22 0.41 0.00 0.00 173.24 173.65 3kst s LEU 218 N -0.32 2.05 -0.02 2.44 1.98 -1.26 -0.82 118.68 122.74 3kst s LEU 218 Ca 0.01 -0.58 0.05 0.00 -2.89 0.00 0.00 54.13 50.71 3kst s LEU 218 Cb -0.03 -1.40 -0.01 0.00 0.66 0.00 0.00 46.19 45.41 3kst s LEU 218 CO -0.00 0.06 -0.16 -0.76 -1.89 0.00 0.00 176.35 173.60 3kst s LEU 219 N 0.90 2.00 -0.10 -0.68 1.43 -0.65 -4.95 118.68 116.64 3kst s LEU 219 Ca -0.05 -0.30 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 3kst s LEU 219 Cb -0.15 -0.85 -0.02 0.00 0.03 0.00 0.00 46.19 45.20 3kst s LEU 219 CO -0.03 0.19 -0.09 -0.75 0.23 0.00 0.00 176.35 175.89 3kst s LYS 220 N -0.30 3.05 -0.22 1.70 2.20 -1.26 0.09 119.74 125.00 3kst s LYS 220 Ca 0.04 -0.61 -0.12 0.00 -0.36 0.00 0.00 55.97 54.93 3kst s LYS 220 Cb -0.07 -2.62 0.07 0.00 -1.51 0.00 0.00 37.83 33.69 3kst s LYS 220 CO -0.00 0.45 0.53 0.21 -0.36 0.00 0.00 175.35 176.18 3kst s LYS 221 N -0.26 0.53 -1.65 4.03 2.20 -0.42 -4.95 119.74 119.22 3kst s LYS 221 Ca 0.03 0.98 -0.16 0.00 -0.36 0.00 0.00 55.97 56.46 3kst s LYS 221 Cb -0.13 0.05 0.13 0.00 -1.51 0.00 0.00 37.83 36.38 3kst s LYS 221 CO 0.03 -0.16 0.79 0.09 -0.36 0.00 0.00 175.35 175.74 3kst n ASN 222 N 4.30 -3.27 0.00 1.43 3.02 -1.26 -1.35 115.26 118.13 3kst n ASN 222 Ca -0.22 -0.98 0.00 0.00 -0.03 0.00 0.00 54.58 53.35 3kst n ASN 222 Cb 0.57 -2.95 0.00 0.00 -0.61 0.00 0.00 39.78 36.79 3kst n ASN 222 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3kst n GLY 223 N -1.50 0.78 3.59 7.41 0.00 -1.26 -5.03 105.19 109.19 3kst n GLY 223 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 3kst n GLY 223 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kst s VAL 224 N -3.19 3.76 -0.21 1.61 1.01 -0.45 -4.74 120.40 118.19 3kst s VAL 224 Ca 0.00 -0.46 -0.09 0.00 0.00 0.00 0.00 61.98 61.43 3kst s VAL 224 Cb 0.00 -2.54 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 3kst s VAL 224 CO 0.00 0.60 0.12 -0.31 0.00 0.00 0.00 175.10 175.50 3kst s TYR 225 N -0.78 3.33 -0.29 5.22 1.51 -0.02 -1.30 117.35 125.03 3kst s TYR 225 Ca 0.12 0.21 -0.05 0.00 -1.01 0.00 0.00 57.07 56.34 3kst s TYR 225 Cb -0.11 -2.17 0.02 0.00 -0.11 0.00 0.00 41.96 39.59 3kst s TYR 225 CO 0.02 0.18 0.05 0.71 -1.11 0.00 0.00 175.55 175.39 3kst s TYR 226 N 0.57 3.15 -0.45 2.71 1.51 0.11 -2.04 117.35 122.92 3kst s TYR 226 Ca 0.06 -1.23 -0.15 0.00 -1.01 0.00 0.00 57.07 54.75 3kst s TYR 226 Cb -0.12 -2.21 0.05 0.00 -0.11 0.00 0.00 41.96 39.58 3kst s TYR 226 CO 0.00 -0.65 0.35 -1.17 -1.11 0.00 0.00 175.55 172.98 3kst s LEU 227 N 1.43 5.40 -0.22 -1.29 0.20 -0.58 -1.64 118.68 121.98 3kst s LEU 227 Ca 0.01 -1.16 -0.11 0.00 0.69 0.00 0.00 54.13 53.56 3kst s LEU 227 Cb -0.18 -2.17 -0.05 0.00 -0.43 0.00 0.00 46.19 43.37 3kst s LEU 227 CO 0.01 -0.56 0.17 -0.63 -0.29 0.00 0.00 176.35 175.04 3kst s ILE 228 N 1.65 5.37 0.17 6.68 1.01 -0.00 -1.25 121.20 134.83 3kst s ILE 228 Ca 0.04 0.24 -0.00 0.00 0.00 0.00 0.00 60.65 60.93 3kst s ILE 228 Cb -0.22 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 3kst s ILE 228 CO 0.08 0.38 0.07 -0.72 0.00 0.00 0.00 174.94 174.75 3kst s TYR 229 N 0.76 1.10 0.17 3.97 1.13 0.07 -0.61 117.35 123.95 3kst s TYR 229 Ca 0.09 -1.22 0.07 0.00 -1.41 0.00 0.00 57.07 54.60 3kst s TYR 229 Cb -0.13 -0.60 -0.04 0.00 -1.10 0.00 0.00 41.96 40.09 3kst s TYR 229 CO 0.02 -0.46 0.02 -1.12 -2.51 0.00 0.00 175.55 171.50 3kst s SER 230 N -3.14 4.89 0.04 -0.18 0.01 0.01 -0.91 113.70 114.43 3kst s SER 230 Ca 0.30 -0.35 -0.01 0.00 1.31 0.00 0.00 55.95 57.20 3kst s SER 230 Cb 0.07 -1.09 -0.03 0.00 0.21 0.00 0.00 66.02 65.18 3kst s SER 230 CO 0.06 0.09 -0.02 0.00 0.41 0.00 0.00 173.24 173.79 3kst s ALA 231 N -1.72 0.31 0.00 1.44 0.00 -0.08 -0.55 121.76 121.17 3kst s ALA 231 Ca 0.28 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.31 3kst s ALA 231 Cb -0.09 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.26 3kst s ALA 231 CO 0.19 -0.30 0.00 0.09 0.00 0.00 0.00 175.76 175.75 3kst n ASN 232 N 0.67 0.00 -4.75 0.00 3.02 -0.95 -2.35 115.26 110.90 3kst n ASN 232 Ca -0.18 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 53.96 3kst n ASN 232 Cb 0.59 0.26 -0.02 0.00 -0.61 0.00 0.00 39.78 40.00 3kst n ASN 232 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 3kst s HIS 233 N -3.18 2.77 0.62 3.10 5.65 -0.68 -4.80 115.29 118.77 3kst s HIS 233 Ca 0.00 0.80 0.32 0.00 0.25 0.00 0.00 55.06 56.43 3kst s HIS 233 Cb 0.00 -4.05 1.81 0.00 -1.18 0.00 0.00 32.58 29.16 3kst s HIS 233 CO 0.00 -3.52 2.13 0.10 -0.65 0.00 0.00 174.74 172.80 3kst h TYR 234 N 4.87 0.00 0.00 3.88 -0.00 -1.92 -0.29 116.97 123.51 3kst h TYR 234 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.26 3kst h TYR 234 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.95 3kst h TYR 234 CO 0.59 0.00 0.00 0.39 -0.00 0.00 0.00 178.16 179.14 3kst n GLU 235 N -3.52 0.24 -2.43 0.10 1.02 -1.26 -4.78 120.64 110.01 3kst n GLU 235 Ca -0.00 0.34 -0.40 0.00 -0.02 0.00 0.00 57.16 57.09 3kst n GLU 235 Cb 0.28 -1.86 -0.04 0.00 -0.02 0.00 0.00 31.44 29.80 3kst n GLU 235 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3kst s ASN 236 N -4.44 7.08 0.59 1.62 3.84 -0.12 -4.91 114.94 118.60 3kst s ASN 236 Ca 0.07 2.29 0.33 0.00 0.21 0.00 0.00 52.86 55.76 3kst s ASN 236 Cb 0.10 -2.62 1.88 0.00 -0.55 0.00 0.00 41.25 40.06 3kst s ASN 236 CO 0.49 -0.28 2.24 0.11 -2.79 0.00 0.00 177.10 176.86 3kst h LYS 237 N 3.48 0.00 -0.74 0.43 1.57 -1.88 -2.33 116.57 117.11 3kst h LYS 237 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 3kst h LYS 237 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 3kst h LYS 237 CO 0.66 0.03 0.00 0.41 -0.57 0.00 0.00 179.45 179.97 3kst n GLY 238 N -1.08 2.19 3.61 3.86 0.00 -1.26 -0.74 105.19 111.77 3kst n GLY 238 Ca -0.03 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 3kst n GLY 238 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3kst n TYR 239 N 0.38 1.27 -3.84 1.61 9.36 -0.87 -4.85 117.16 120.20 3kst n TYR 239 Ca 0.15 0.59 -0.07 0.00 3.32 0.00 0.00 57.90 61.90 3kst n TYR 239 Cb 0.74 -2.25 -0.02 0.00 -0.63 0.00 0.00 39.34 37.18 3kst n TYR 239 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 3kst s GLY 240 N -0.66 -0.11 -0.07 2.98 0.00 -0.99 -3.55 107.32 104.92 3kst s GLY 240 Ca 0.61 -0.25 0.05 0.00 0.00 0.00 0.00 44.72 45.13 3kst s GLY 240 CO 0.58 -0.08 -0.24 0.14 0.00 0.00 0.00 173.10 173.50 3kst s VAL 241 N -3.85 2.13 0.33 1.40 1.01 -0.11 -0.90 120.40 120.41 3kst s VAL 241 Ca 0.11 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.09 3kst s VAL 241 Cb -0.05 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.53 3kst s VAL 241 CO 0.06 0.57 0.35 -0.83 0.00 0.00 0.00 175.10 175.25 3kst s GLY 242 N -0.09 2.00 0.15 4.51 0.00 -0.08 0.43 107.32 114.23 3kst s GLY 242 Ca -0.06 -1.86 -0.07 0.00 0.00 0.00 0.00 44.72 42.73 3kst s GLY 242 CO 0.04 -1.29 0.21 -2.52 0.00 0.00 0.00 173.10 169.54 3kst s TYR 243 N -3.30 0.50 0.18 1.90 1.13 -1.26 -0.75 117.35 115.76 3kst s TYR 243 Ca 0.37 -0.88 0.03 0.00 -1.41 0.00 0.00 57.07 55.19 3kst s TYR 243 Cb 0.01 -0.17 -0.05 0.00 -1.10 0.00 0.00 41.96 40.66 3kst s TYR 243 CO 0.25 -0.65 -0.04 0.00 -2.51 0.00 0.00 175.55 172.60 3kst s ALA 244 N -3.98 1.56 0.11 9.51 0.00 -0.38 -0.66 121.76 127.92 3kst s ALA 244 Ca 0.18 -1.62 0.05 0.00 0.00 0.00 0.00 51.96 50.57 3kst s ALA 244 Cb 0.05 0.33 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 3kst s ALA 244 CO -0.00 -0.21 -0.12 0.95 0.00 0.00 0.00 175.76 176.38 3kst s THR 245 N -3.44 1.13 0.14 0.00 -4.23 -0.15 -1.53 115.64 107.56 3kst s THR 245 Ca 0.23 -1.70 -0.14 0.00 -1.18 0.00 0.00 61.69 58.90 3kst s THR 245 Cb 0.05 -1.47 0.02 0.00 1.34 0.00 0.00 72.50 72.43 3kst s THR 245 CO 0.04 -0.51 0.37 -0.55 -0.54 0.00 0.00 174.62 173.43 3kst s SER 246 N -2.50 -0.12 0.00 3.99 0.15 -0.87 -1.24 113.70 113.11 3kst s SER 246 Ca 0.08 -0.53 0.27 0.00 0.70 0.00 0.00 55.95 56.47 3kst s SER 246 Cb -0.03 0.47 0.89 0.00 -1.71 0.00 0.00 66.02 65.63 3kst s SER 246 CO 0.01 -0.89 1.65 0.47 1.20 0.00 0.00 173.24 175.69 3kst n ASP 247 N -0.22 1.29 -4.14 5.45 8.00 -1.26 -0.84 116.55 124.83 3kst n ASP 247 Ca -0.13 -1.21 -0.14 0.00 0.71 0.00 0.00 54.79 54.03 3kst n ASP 247 Cb 0.63 0.07 -0.11 0.00 -0.02 0.00 0.00 41.12 41.69 3kst n ASP 247 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3kst s THR 248 N -2.25 0.79 0.00 -3.53 -4.23 -1.26 -4.88 115.64 100.28 3kst s THR 248 Ca 0.31 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 59.38 3kst s THR 248 Cb 0.20 -1.10 0.00 0.00 1.34 0.00 0.00 72.50 72.94 3kst s THR 248 CO 0.43 -0.49 0.07 -0.81 -0.54 0.00 0.00 174.62 173.27 3kst n PRO 249 N 0.89 0.07 -3.85 3.99 -0.04 -1.26 -4.82 135.00 129.97 3kst n PRO 249 Ca -0.19 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.03 3kst n PRO 249 Cb 0.57 -1.47 -0.03 0.00 -0.04 0.00 0.00 33.50 32.53 3kst n PRO 249 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kst n GLY 251 N 1.02 3.17 3.81 0.55 0.00 -1.26 -5.05 105.19 107.43 3kst n GLY 251 Ca 0.00 -2.31 -0.32 0.00 0.00 0.00 0.00 46.02 43.39 3kst n GLY 251 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kst s PRO 252 N -3.77 3.27 0.01 1.61 0.04 -1.26 -4.84 135.00 130.06 3kst s PRO 252 Ca 0.15 1.09 0.01 0.00 0.04 0.00 0.00 61.00 62.29 3kst s PRO 252 Cb -0.01 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 3kst s PRO 252 CO 0.09 -0.84 0.05 -1.58 0.04 0.00 0.00 177.00 174.76 3kst s TRP 253 N -2.67 3.19 -0.17 0.56 0.52 -1.26 -4.34 118.94 114.77 3kst s TRP 253 Ca 0.61 0.13 0.00 0.00 0.02 0.00 0.00 56.10 56.86 3kst s TRP 253 Cb -0.15 -1.69 0.04 0.00 -1.15 0.00 0.00 33.47 30.53 3kst s TRP 253 CO 0.42 0.51 -0.08 0.08 0.02 0.00 0.00 176.95 177.91 3kst s VAL 254 N -1.19 1.32 0.37 4.03 1.01 -0.37 -4.93 120.40 120.63 3kst s VAL 254 Ca 0.23 -0.75 -0.27 0.00 0.00 0.00 0.00 61.98 61.20 3kst s VAL 254 Cb -0.12 -1.44 -0.09 0.00 0.00 0.00 0.00 36.38 34.73 3kst s VAL 254 CO 0.14 0.18 1.24 -0.54 0.00 0.00 0.00 175.10 176.12 3kst s LYS 255 N 1.54 4.15 0.23 2.72 1.02 -1.26 -0.98 119.74 127.16 3kst s LYS 255 Ca 0.01 2.03 -0.31 0.00 0.02 0.00 0.00 55.97 57.72 3kst s LYS 255 Cb -0.15 -2.84 -0.11 0.00 -0.52 0.00 0.00 37.83 34.20 3kst s LYS 255 CO -0.08 -0.30 1.61 -0.47 -0.92 0.00 0.00 175.35 175.19 3kst s TYR 256 N -1.27 2.91 0.47 3.18 5.04 0.16 -4.91 117.35 122.92 3kst s TYR 256 Ca 0.54 0.63 0.13 0.00 -2.44 0.00 0.00 57.07 55.93 3kst s TYR 256 Cb -0.35 -4.03 1.09 0.00 0.35 0.00 0.00 41.96 39.02 3kst s TYR 256 CO 0.46 -3.67 2.09 0.66 -1.34 0.00 0.00 175.55 173.74 3kst h SER 257 N 5.97 0.23 -0.61 4.32 4.64 -1.93 -2.85 113.55 123.32 3kst h SER 257 Ca -0.45 -0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.64 3kst h SER 257 Cb 1.21 -0.05 -0.14 0.00 -0.31 0.00 0.00 62.40 63.11 3kst h SER 257 CO 0.87 0.16 0.21 0.29 -0.87 0.00 0.00 176.83 177.49 3kst n LYS 258 N -4.50 2.75 -1.75 4.77 4.76 -1.26 -4.99 118.16 117.95 3kst n LYS 258 Ca 0.02 -3.06 -0.38 0.00 -2.87 0.00 0.00 58.31 52.02 3kst n LYS 258 Cb 0.14 -2.04 0.06 0.00 -1.84 0.00 0.00 35.03 31.35 3kst n LYS 258 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 3kst s ASN 259 N -1.67 4.86 0.42 4.39 0.01 -1.08 -4.48 114.94 117.40 3kst s ASN 259 Ca 0.50 2.70 -0.10 0.00 -0.71 0.00 0.00 52.86 55.26 3kst s ASN 259 Cb 0.42 -2.63 -0.06 0.00 0.41 0.00 0.00 41.25 39.40 3kst s ASN 259 CO 0.08 -1.84 0.79 -2.16 -1.51 0.00 0.00 177.10 172.46 3kst s PRO 260 N -3.18 3.75 0.11 -0.60 0.04 -1.26 -4.98 135.00 128.87 3kst s PRO 260 Ca 0.78 0.46 -0.10 0.00 0.04 0.00 0.00 61.00 62.18 3kst s PRO 260 Cb -0.39 -2.37 -0.14 0.00 0.04 0.00 0.00 34.50 31.64 3kst s PRO 260 CO 0.44 -0.08 1.29 -0.07 0.04 0.00 0.00 177.00 178.61 3kst h LEU 261 N 1.07 0.81 -7.29 -3.56 3.38 -0.25 -3.45 115.31 106.01 3kst h LEU 261 Ca -0.47 -0.59 -0.33 0.00 0.09 0.00 0.00 57.88 56.59 3kst h LEU 261 Cb 1.19 -0.24 -0.37 0.00 0.09 0.00 0.00 40.66 41.33 3kst h LEU 261 CO 0.63 1.38 -0.68 -0.22 0.09 0.00 0.00 178.44 179.64 3kst s LEU 262 N -8.15 0.06 -0.48 1.67 2.96 -1.08 -4.66 118.68 109.01 3kst s LEU 262 Ca -0.09 0.22 0.06 0.00 -0.22 0.00 0.00 54.13 54.10 3kst s LEU 262 Cb 0.08 0.09 0.20 0.00 0.50 0.00 0.00 46.19 47.06 3kst s LEU 262 CO 0.90 -0.24 0.64 1.67 -1.32 0.00 0.00 176.35 177.99 3kst n GLN 263 N 5.26 0.50 0.00 1.98 7.27 -1.26 -0.93 117.38 130.19 3kst n GLN 263 Ca -0.05 -2.37 0.00 0.00 0.07 0.00 0.00 57.00 54.65 3kst n GLN 263 Cb 0.50 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.65 3kst n GLN 263 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3kst n GLY 264 N 2.59 0.50 2.92 1.69 0.00 -1.26 -4.98 105.19 106.65 3kst n GLY 264 Ca 0.20 -1.81 -0.27 0.00 0.00 0.00 0.00 46.02 44.14 3kst n GLY 264 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kst s ASP 265 N -1.41 2.28 0.13 1.61 2.15 -0.72 -4.99 116.67 115.72 3kst s ASP 265 Ca 0.00 -0.34 -0.15 0.00 0.43 0.00 0.00 52.55 52.49 3kst s ASP 265 Cb 0.00 -0.90 -0.01 0.00 -0.30 0.00 0.00 42.92 41.71 3kst s ASP 265 CO 0.00 -0.11 1.64 0.00 -0.17 0.00 0.00 175.17 176.53 3kst h ALA 266 N 8.16 0.54 -0.34 3.66 0.00 -1.94 -0.81 119.26 128.53 3kst h ALA 266 Ca -0.31 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 3kst h ALA 266 Cb 1.13 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 3kst h ALA 266 CO 0.43 0.21 -0.02 0.00 0.00 0.00 0.00 179.25 179.87 3kst h ALA 267 N 0.96 1.33 0.00 0.00 0.00 -1.98 -3.24 119.26 116.33 3kst h ALA 267 Ca 0.13 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 3kst h ALA 267 Cb 0.30 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3kst h ALA 267 CO 0.00 0.46 -1.86 0.25 0.00 0.00 0.00 179.25 178.10 3kst n THR 268 N -4.26 0.28 -1.03 0.00 -2.24 -1.22 -4.99 114.28 100.82 3kst n THR 268 Ca 0.01 -0.55 -0.01 0.00 -2.27 0.00 0.00 64.05 61.23 3kst n THR 268 Cb 0.26 -0.13 -0.00 0.00 -2.10 0.00 0.00 70.33 68.36 3kst n THR 268 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kst n GLY 269 N 1.30 0.48 3.76 3.38 0.00 -0.33 -5.03 105.19 108.76 3kst n GLY 269 Ca -0.06 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 3kst n GLY 269 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kst s LEU 270 N -0.20 4.44 0.28 0.99 1.43 -1.12 -4.83 118.68 119.66 3kst s LEU 270 Ca 0.00 2.59 0.03 0.00 -1.03 0.00 0.00 54.13 55.72 3kst s LEU 270 Cb 0.00 -3.64 -0.06 0.00 0.03 0.00 0.00 46.19 42.53 3kst s LEU 270 CO 0.00 -0.49 0.04 0.68 0.23 0.00 0.00 176.35 176.81 3kst s VAL 271 N -0.87 0.99 -1.42 -1.59 -7.23 -1.26 -1.75 120.40 107.26 3kst s VAL 271 Ca 0.50 -2.01 -0.09 0.00 -1.81 0.00 0.00 61.98 58.56 3kst s VAL 271 Cb -0.38 -2.60 0.03 0.00 0.56 0.00 0.00 36.38 33.98 3kst s VAL 271 CO 0.48 -0.11 1.05 0.61 -0.31 0.00 0.00 175.10 176.82 3kst n GLY 272 N -0.54 -0.53 3.60 2.32 0.00 0.09 -1.20 105.19 108.93 3kst n GLY 272 Ca -0.03 0.22 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 3kst n GLY 272 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kst s THR 273 N -3.29 4.44 0.00 2.61 -4.23 -1.23 -4.15 115.64 109.79 3kst s THR 273 Ca 0.56 1.21 0.00 0.00 -1.18 0.00 0.00 61.69 62.28 3kst s THR 273 Cb -0.26 -4.45 0.00 0.00 1.34 0.00 0.00 72.50 69.14 3kst s THR 273 CO 0.69 -0.72 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 3kst n GLY 274 N 4.54 0.61 3.57 3.99 0.00 -0.77 -3.33 105.19 113.80 3kst n GLY 274 Ca 0.09 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 3kst n GLY 274 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3kst n HIS 275 N 0.00 -2.48 -3.23 1.61 -0.00 -1.26 -1.76 115.22 108.10 3kst n HIS 275 Ca 0.00 1.02 0.00 0.00 -0.00 0.00 0.00 57.72 58.74 3kst n HIS 275 Cb 0.00 -2.44 0.00 0.00 -0.00 0.00 0.00 29.99 27.55 3kst n HIS 275 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3kst n GLY 276 N -0.88 6.52 3.63 1.57 0.00 -1.26 -3.32 105.19 111.45 3kst n GLY 276 Ca -0.17 -2.08 -0.11 0.00 0.00 0.00 0.00 46.02 43.66 3kst n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kst s ALA 277 N -2.00 -1.83 0.42 4.61 0.00 -0.47 -4.82 121.76 117.66 3kst s ALA 277 Ca 0.00 2.16 -0.22 0.00 0.00 0.00 0.00 51.96 53.89 3kst s ALA 277 Cb 0.00 -1.28 -0.10 0.00 0.00 0.00 0.00 23.12 21.74 3kst s ALA 277 CO 0.00 -0.35 0.98 -1.25 0.00 0.00 0.00 175.76 175.15 3kst s PRO 278 N 0.80 4.19 -0.08 0.00 0.04 -1.26 -1.84 135.00 136.85 3kst s PRO 278 Ca -0.03 1.27 -0.14 0.00 0.04 0.00 0.00 61.00 62.14 3kst s PRO 278 Cb -0.05 -2.33 0.03 0.00 0.04 0.00 0.00 34.50 32.19 3kst s PRO 278 CO -0.06 -0.08 0.35 -0.59 0.04 0.00 0.00 177.00 176.65 3kst s PHE 279 N -1.95 -0.30 0.09 0.56 -0.71 0.30 -4.89 117.98 111.08 3kst s PHE 279 Ca 0.60 0.64 -0.20 0.00 -1.04 0.00 0.00 56.93 56.93 3kst s PHE 279 Cb -0.14 0.12 -0.07 0.00 -1.21 0.00 0.00 43.02 41.72 3kst s PHE 279 CO 0.19 -0.30 0.60 -1.14 -1.34 0.00 0.00 175.22 173.23 3kst s GLN 280 N -0.57 4.25 0.48 1.99 0.74 -1.26 -1.17 119.66 124.11 3kst s GLN 280 Ca -0.07 0.80 0.06 0.00 0.05 0.00 0.00 55.36 56.20 3kst s GLN 280 Cb -0.04 -3.23 0.03 0.00 1.10 0.00 0.00 33.01 30.87 3kst s GLN 280 CO 0.03 0.62 0.66 0.00 -0.55 0.00 0.00 175.29 176.05 3kst h LYS 282 N 0.40 0.93 0.00 0.00 1.57 -1.96 -1.63 116.57 115.88 3kst h LYS 282 Ca -0.40 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3kst h LYS 282 Cb 1.29 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.39 3kst h LYS 282 CO 0.47 0.62 0.00 -0.40 -0.57 0.00 0.00 179.45 179.57 3kst n ASP 283 N -4.60 0.00 0.00 0.86 5.68 -1.26 -4.91 116.55 112.32 3kst n ASP 283 Ca 0.18 -1.23 0.00 0.00 -0.50 0.00 0.00 54.79 53.25 3kst n ASP 283 Cb 0.36 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.34 3kst n ASP 283 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kst n GLY 284 N 0.61 3.21 3.80 6.12 0.00 -0.61 -5.04 105.19 113.27 3kst n GLY 284 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 3kst n GLY 284 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kst s SER 285 N -0.76 3.88 0.26 1.61 1.04 -1.26 -4.66 113.70 113.81 3kst s SER 285 Ca 0.00 1.06 0.10 0.00 0.48 0.00 0.00 55.95 57.59 3kst s SER 285 Cb 0.00 -1.68 -0.04 0.00 0.10 0.00 0.00 66.02 64.40 3kst s SER 285 CO 0.00 -2.33 -0.07 0.26 0.98 0.00 0.00 173.24 172.08 3kst s TRP 286 N -3.26 2.57 0.14 5.02 0.52 -1.26 -0.37 118.94 122.30 3kst s TRP 286 Ca 0.63 -0.25 -0.00 0.00 0.02 0.00 0.00 56.10 56.49 3kst s TRP 286 Cb -0.14 -1.15 -0.04 0.00 -1.15 0.00 0.00 33.47 30.99 3kst s TRP 286 CO 0.53 0.64 0.03 0.15 0.02 0.00 0.00 176.95 178.31 3kst s LYS 287 N -3.52 0.95 -0.12 4.98 -0.14 -0.32 -1.81 119.74 119.75 3kst s LYS 287 Ca 0.30 -1.45 0.01 0.00 -1.36 0.00 0.00 55.97 53.47 3kst s LYS 287 Cb -0.06 0.06 0.02 0.00 -1.68 0.00 0.00 37.83 36.17 3kst s LYS 287 CO 0.18 -0.20 -0.13 -0.47 -0.76 0.00 0.00 175.35 173.97 3kst s TYR 288 N -3.89 1.92 -0.02 3.18 5.04 0.60 -0.54 117.35 123.65 3kst s TYR 288 Ca 0.22 -0.99 -0.07 0.00 -2.44 0.00 0.00 57.07 53.79 3kst s TYR 288 Cb 0.07 -1.44 -0.05 0.00 0.35 0.00 0.00 41.96 40.90 3kst s TYR 288 CO 0.01 -0.56 0.25 -1.50 -1.34 0.00 0.00 175.55 172.41 3kst s ILE 289 N 1.35 5.32 0.18 3.14 2.07 -0.77 -1.15 121.20 131.34 3kst s ILE 289 Ca 0.01 0.22 -0.21 0.00 -1.41 0.00 0.00 60.65 59.25 3kst s ILE 289 Cb -0.13 -3.55 0.05 0.00 0.13 0.00 0.00 42.46 38.96 3kst s ILE 289 CO -0.07 0.43 0.59 0.72 -1.91 0.00 0.00 174.94 174.70 3kst s PHE 290 N -1.23 -0.40 0.42 3.50 -0.71 -0.42 -1.37 117.98 117.77 3kst s PHE 290 Ca 0.25 0.13 0.08 0.00 -1.04 0.00 0.00 56.93 56.35 3kst s PHE 290 Cb -0.13 0.53 0.01 0.00 -1.21 0.00 0.00 43.02 42.22 3kst s PHE 290 CO 0.14 -0.90 0.57 -3.38 -1.34 0.00 0.00 175.22 170.31 3kst s HIS 291 N -3.79 2.76 0.20 3.49 -3.43 -0.72 -0.79 115.29 113.00 3kst s HIS 291 Ca 0.04 -0.42 -0.10 0.00 -0.80 0.00 0.00 55.06 53.78 3kst s HIS 291 Cb -0.01 -2.36 -0.01 0.00 -1.43 0.00 0.00 32.58 28.76 3kst s HIS 291 CO -0.09 -0.43 0.36 0.00 -2.00 0.00 0.00 174.74 172.58 3kst s ALA 292 N -2.37 -0.02 0.72 -1.38 0.00 0.01 -1.86 121.76 116.86 3kst s ALA 292 Ca 0.55 -0.93 -0.15 0.00 0.00 0.00 0.00 51.96 51.42 3kst s ALA 292 Cb -0.10 1.01 0.03 0.00 0.00 0.00 0.00 23.12 24.07 3kst s ALA 292 CO 0.33 -0.73 1.20 -1.01 0.00 0.00 0.00 175.76 175.54 3kst s HIS 293 N -4.00 2.12 0.20 0.00 3.76 -0.34 -2.03 115.29 115.00 3kst s HIS 293 Ca 0.21 1.59 -0.10 0.00 -0.15 0.00 0.00 55.06 56.61 3kst s HIS 293 Cb 0.02 -3.44 0.24 0.00 1.11 0.00 0.00 32.58 30.51 3kst s HIS 293 CO 0.05 -2.50 1.75 2.35 -0.85 0.00 0.00 174.74 175.54 3kst h TRP 294 N -0.23 0.39 -3.08 1.40 2.91 -0.82 -3.43 115.95 113.08 3kst h TRP 294 Ca -0.48 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 59.56 3kst h TRP 294 Cb 1.29 -0.09 -0.02 0.00 -0.51 0.00 0.00 29.16 29.83 3kst h TRP 294 CO 0.48 0.12 0.22 -1.54 -1.03 0.00 0.00 178.44 176.69 3kst s SER 295 N -5.41 -0.03 0.48 2.65 1.04 -0.31 -4.99 113.70 107.14 3kst s SER 295 Ca -0.13 -1.00 0.22 0.00 0.48 0.00 0.00 55.95 55.52 3kst s SER 295 Cb 0.16 0.80 1.24 0.00 0.10 0.00 0.00 66.02 68.32 3kst s SER 295 CO 0.74 -1.55 2.02 0.00 0.98 0.00 0.00 173.24 175.43 3kst h ALA 296 N 2.01 1.41 0.00 5.32 0.00 -1.90 -3.07 119.26 123.03 3kst h ALA 296 Ca -0.28 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3kst h ALA 296 Cb 1.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3kst h ALA 296 CO 0.35 0.21 -0.91 0.00 0.00 0.00 0.00 179.25 178.90 3kst n ALA 297 N -2.36 2.97 -3.56 0.00 0.00 -1.26 -4.96 120.51 111.34 3kst n ALA 297 Ca -0.02 -0.31 -0.11 0.00 0.00 0.00 0.00 53.44 53.00 3kst n ALA 297 Cb 0.26 -1.07 -0.10 0.00 0.00 0.00 0.00 19.45 18.54 3kst n ALA 297 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3kst s GLU 298 N -3.24 0.49 -0.00 0.00 2.56 -1.16 -5.07 118.70 112.27 3kst s GLU 298 Ca 0.03 0.78 -0.24 0.00 0.00 0.00 0.00 54.97 55.54 3kst s GLU 298 Cb 0.13 0.11 -0.19 0.00 2.00 0.00 0.00 34.13 36.18 3kst s GLU 298 CO 0.77 -0.12 1.30 0.82 -0.56 0.00 0.00 175.26 177.47 3kst h ILE 299 N 5.05 1.37 -3.04 -3.70 2.04 -1.93 -0.79 117.51 116.50 3kst h ILE 299 Ca -0.32 -1.16 -0.60 0.00 1.00 0.00 0.00 64.86 63.77 3kst h ILE 299 Cb 1.19 2.07 -0.05 0.00 -0.74 0.00 0.00 36.82 39.29 3kst h ILE 299 CO 0.25 0.31 -0.28 -1.10 0.00 0.00 0.00 178.15 177.33 3kst s GLN 300 N -4.31 3.73 0.15 2.37 -0.21 -1.26 -0.76 119.66 119.38 3kst s GLN 300 Ca -0.15 0.14 -0.27 0.00 0.02 0.00 0.00 55.36 55.10 3kst s GLN 300 Cb 0.03 -3.05 -0.07 0.00 1.00 0.00 0.00 33.01 30.92 3kst s GLN 300 CO 0.69 0.60 0.85 -1.25 -2.12 0.00 0.00 175.29 174.06 3kst s PRO 301 N -1.76 4.65 0.59 2.91 0.04 -1.26 -4.74 135.00 135.43 3kst s PRO 301 Ca 0.30 1.27 -0.18 0.00 0.04 0.00 0.00 61.00 62.44 3kst s PRO 301 Cb -0.14 -3.31 -0.03 0.00 0.04 0.00 0.00 34.50 31.06 3kst s PRO 301 CO 0.17 0.44 1.15 1.03 0.04 0.00 0.00 177.00 179.83 3kst s ARG 302 N -0.74 3.04 0.13 4.56 0.52 -1.22 -3.61 118.95 121.64 3kst s ARG 302 Ca 0.40 1.64 0.00 0.00 -0.52 0.00 0.00 55.73 57.25 3kst s ARG 302 Cb -0.23 -1.96 -0.04 0.00 0.52 0.00 0.00 34.95 33.23 3kst s ARG 302 CO 0.28 -1.10 0.01 0.95 0.02 0.00 0.00 175.30 175.45 3kst s THR 303 N -1.85 0.43 0.07 0.02 -4.23 -0.86 -3.83 115.64 105.40 3kst s THR 303 Ca 0.73 -1.93 0.04 0.00 -1.18 0.00 0.00 61.69 59.35 3kst s THR 303 Cb -0.25 -1.96 -0.04 0.00 1.34 0.00 0.00 72.50 71.59 3kst s THR 303 CO 0.33 -0.60 -0.01 -0.44 -0.54 0.00 0.00 174.62 173.36 3kst s SER 304 N -3.08 4.97 0.09 3.99 0.01 -0.36 -0.81 113.70 118.50 3kst s SER 304 Ca 0.20 -0.16 -0.03 0.00 1.31 0.00 0.00 55.95 57.28 3kst s SER 304 Cb 0.07 -1.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.08 3kst s SER 304 CO 0.00 0.20 0.06 -0.31 0.41 0.00 0.00 173.24 173.60 3kst s TYR 305 N -1.24 0.57 -0.05 2.43 2.02 0.03 -4.24 117.35 116.87 3kst s TYR 305 Ca 0.24 -1.03 0.01 0.00 -0.37 0.00 0.00 57.07 55.92 3kst s TYR 305 Cb -0.12 -0.34 0.02 0.00 -0.40 0.00 0.00 41.96 41.12 3kst s TYR 305 CO 0.16 -0.48 -0.06 0.42 -1.57 0.00 0.00 175.55 174.01 3kst s ILE 306 N -3.96 0.68 0.36 2.71 1.01 -1.01 -1.30 121.20 119.70 3kst s ILE 306 Ca 0.13 -0.21 0.06 0.00 0.00 0.00 0.00 60.65 60.63 3kst s ILE 306 Cb 0.07 -0.67 -0.07 0.00 0.01 0.00 0.00 42.46 41.79 3kst s ILE 306 CO -0.05 0.25 -0.00 -0.54 0.00 0.00 0.00 174.94 174.60 3kst s LYS 307 N 0.82 1.80 0.49 2.79 1.02 -0.30 -0.85 119.74 125.50 3kst s LYS 307 Ca -0.12 -1.99 -0.20 0.00 0.02 0.00 0.00 55.97 53.67 3kst s LYS 307 Cb -0.15 -1.38 -0.08 0.00 -0.52 0.00 0.00 37.83 35.70 3kst s LYS 307 CO 0.01 -0.05 1.05 -0.51 -0.92 0.00 0.00 175.35 174.93 3kst s ASP 308 N -3.60 6.31 0.05 2.83 1.01 0.51 -0.29 116.67 123.48 3kst s ASP 308 Ca 0.34 1.96 0.04 0.00 0.71 0.00 0.00 52.55 55.60 3kst s ASP 308 Cb 0.08 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.42 3kst s ASP 308 CO 0.16 -0.80 -0.12 0.12 0.21 0.00 0.00 175.17 174.74 3kst s PHE 309 N -1.94 1.05 -0.16 4.23 5.36 -0.75 -1.73 117.98 124.03 3kst s PHE 309 Ca 0.67 -0.40 -0.28 0.00 -0.96 0.00 0.00 56.93 55.96 3kst s PHE 309 Cb -0.17 -0.61 0.08 0.00 -0.34 0.00 0.00 43.02 41.97 3kst s PHE 309 CO 0.21 0.01 0.74 0.00 -1.46 0.00 0.00 175.22 174.72 3kst s ALA 310 N -1.05 -1.80 -0.21 11.12 0.00 -1.03 -4.01 121.76 124.78 3kst s ALA 310 Ca -0.02 1.67 0.01 0.00 0.00 0.00 0.00 51.96 53.62 3kst s ALA 310 Cb -0.09 -0.63 0.05 0.00 0.00 0.00 0.00 23.12 22.45 3kst s ALA 310 CO 0.01 -0.34 -0.10 0.42 0.00 0.00 0.00 175.76 175.75 3kst s ILE 311 N -0.44 1.67 0.95 0.00 1.01 -1.26 -1.51 121.20 121.61 3kst s ILE 311 Ca -0.05 -1.08 -0.12 0.00 0.00 0.00 0.00 60.65 59.41 3kst s ILE 311 Cb -0.02 -1.77 0.16 0.00 0.01 0.00 0.00 42.46 40.84 3kst s ILE 311 CO 0.05 0.13 1.09 -0.44 0.00 0.00 0.00 174.94 175.76 3kst s SER 312 N 1.37 2.99 0.58 3.58 0.01 -0.95 -4.87 113.70 116.42 3kst s SER 312 Ca -0.02 1.51 0.29 0.00 1.31 0.00 0.00 55.95 59.04 3kst s SER 312 Cb -0.17 -2.18 1.77 0.00 0.21 0.00 0.00 66.02 65.66 3kst s SER 312 CO -0.08 -2.94 2.23 -2.24 0.41 0.00 0.00 173.24 170.62 3kst h ASP 313 N -1.76 0.00 0.16 2.44 3.04 -2.01 -0.33 116.42 117.96 3kst h ASP 313 Ca -0.51 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.28 3kst h ASP 313 Cb 1.29 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.58 3kst h ASP 313 CO 0.53 0.02 -0.07 0.00 -2.04 0.00 0.00 179.24 177.68 3kst n GLN 314 N -3.82 1.07 -1.77 4.15 3.00 -1.26 -4.96 117.38 113.78 3kst n GLN 314 Ca -0.03 -0.44 0.00 0.00 -0.01 0.00 0.00 57.00 56.52 3kst n GLN 314 Cb 0.10 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 28.85 3kst n GLN 314 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3kst n GLY 315 N 1.20 0.47 3.54 1.08 0.00 -0.13 -5.06 105.19 106.29 3kst n GLY 315 Ca 0.18 -0.85 -0.37 0.00 0.00 0.00 0.00 46.02 44.97 3kst n GLY 315 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kst s VAL 316 N -2.00 4.92 0.01 1.61 1.01 -1.26 -4.86 120.40 119.84 3kst s VAL 316 Ca 0.00 0.04 -0.20 0.00 0.00 0.00 0.00 61.98 61.82 3kst s VAL 316 Cb 0.00 -3.33 -0.06 0.00 0.00 0.00 0.00 36.38 32.99 3kst s VAL 316 CO 0.00 0.29 0.57 -0.69 0.00 0.00 0.00 175.10 175.27 3kst s VAL 317 N 1.68 4.88 0.07 2.92 1.01 -1.26 -2.24 120.40 127.45 3kst s VAL 317 Ca 0.07 1.19 0.06 0.00 0.00 0.00 0.00 61.98 63.30 3kst s VAL 317 Cb -0.16 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 3kst s VAL 317 CO 0.08 0.47 -0.16 0.42 0.00 0.00 0.00 175.10 175.91 3kst s THR 318 N -0.48 1.27 -0.17 3.92 -4.23 -0.57 -5.01 115.64 110.36 3kst s THR 318 Ca 0.30 -1.26 0.00 0.00 -1.18 0.00 0.00 61.69 59.54 3kst s THR 318 Cb -0.18 -1.18 0.04 0.00 1.34 0.00 0.00 72.50 72.52 3kst s THR 318 CO 0.17 -0.10 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.43 3kst s ILE 319 N -1.11 1.37 0.32 2.99 1.01 -1.26 -2.47 121.20 122.05 3kst s ILE 319 Ca 0.01 -0.73 -0.05 0.00 0.00 0.00 0.00 60.65 59.88 3kst s ILE 319 Cb -0.09 -1.45 0.00 0.00 0.01 0.00 0.00 42.46 40.93 3kst s ILE 319 CO 0.02 0.22 0.48 -0.94 0.00 0.00 0.00 174.94 174.72 3kst s SER 320 N 1.53 0.61 0.00 3.58 1.04 -0.71 -4.87 113.70 114.89 3kst s SER 320 Ca 0.01 -1.34 0.00 0.00 0.48 0.00 0.00 55.95 55.10 3kst s SER 320 Cb -0.15 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.62 3kst s SER 320 CO -0.08 -1.27 0.00 0.61 0.98 0.00 0.00 173.24 173.48 3kst n GLY 321 N -0.51 -0.24 3.71 7.32 0.00 -1.26 -0.37 105.19 113.84 3kst n GLY 321 Ca -0.00 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 3kst n GLY 321 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kst s THR 322 N -2.45 2.67 0.34 2.61 2.01 -1.26 -4.73 115.64 114.84 3kst s THR 322 Ca 0.00 0.37 -0.29 0.00 0.31 0.00 0.00 61.69 62.08 3kst s THR 322 Cb 0.00 -3.23 -0.11 0.00 0.01 0.00 0.00 72.50 69.17 3kst s THR 322 CO 0.00 0.02 1.51 -0.69 -0.69 0.00 0.00 174.62 174.76 3kst s VAL 323 N 1.80 2.14 -0.18 3.82 1.01 -1.26 -4.78 120.40 122.95 3kst s VAL 323 Ca 0.73 0.13 -0.17 0.00 0.00 0.00 0.00 61.98 62.67 3kst s VAL 323 Cb -0.43 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 3kst s VAL 323 CO 0.32 0.03 0.45 -0.63 0.00 0.00 0.00 175.10 175.27 3kst s ILE 324 N -0.70 5.17 -0.75 2.22 1.01 -0.03 -4.97 121.20 123.15 3kst s ILE 324 Ca 0.56 0.83 -0.11 0.00 0.00 0.00 0.00 60.65 61.93 3kst s ILE 324 Cb -0.46 -3.78 0.20 0.00 0.01 0.00 0.00 42.46 38.43 3kst s ILE 324 CO 0.56 0.26 0.66 -0.54 0.00 0.00 0.00 174.94 175.88 3kst s LYS 325 N 1.19 3.29 0.71 2.79 1.02 -1.26 -2.40 119.74 125.07 3kst s LYS 325 Ca 0.22 -2.42 -0.12 0.00 0.02 0.00 0.00 55.97 53.67 3kst s LYS 325 Cb -0.15 -4.24 0.02 0.00 -0.52 0.00 0.00 37.83 32.94 3kst s LYS 325 CO 0.09 -1.26 1.09 -1.25 -0.92 0.00 0.00 175.35 173.09 3kst s PRO 326 N 0.22 2.65 0.13 -1.68 0.04 -1.26 -4.93 135.00 130.17 3kst s PRO 326 Ca 0.16 1.18 0.04 0.00 0.04 0.00 0.00 61.00 62.43 3kst s PRO 326 Cb -0.14 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 3kst s PRO 326 CO -0.07 -1.34 -0.09 -0.98 0.04 0.00 0.00 177.00 174.56 3kst s ARG 327 N -4.63 1.00 -0.24 4.56 1.70 -0.11 -3.07 118.95 118.15 3kst s ARG 327 Ca 0.62 -1.40 -0.06 0.00 -0.47 0.00 0.00 55.73 54.42 3kst s ARG 327 Cb -0.17 -0.54 -0.02 0.00 -0.57 0.00 0.00 34.95 33.65 3kst s ARG 327 CO 0.50 0.06 0.04 0.08 -1.08 0.00 0.00 175.30 174.90 3kst s VAL 328 N -3.30 4.06 0.28 4.99 1.01 -0.41 -0.64 120.40 126.40 3kst s VAL 328 Ca 0.15 -0.26 0.06 0.00 0.00 0.00 0.00 61.98 61.92 3kst s VAL 328 Cb 0.03 -2.89 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 3kst s VAL 328 CO -0.01 0.36 0.39 -0.76 0.00 0.00 0.00 175.10 175.08 3kst s LEU 329 N 1.58 4.12 0.00 3.92 1.43 0.11 -1.20 118.68 128.63 3kst s LEU 329 Ca 0.06 -0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.08 3kst s LEU 329 Cb -0.15 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.32 3kst s LEU 329 CO 0.02 -0.22 0.05 2.29 0.23 0.00 0.00 176.35 178.72