#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xfi n MET 63 N 0.00 0.58 -1.84 3.44 2.81 -1.26 -4.76 117.12 116.09 2xfi n MET 63 Ca 0.00 0.07 -0.41 0.00 -1.81 0.00 0.00 57.70 55.55 2xfi n MET 63 Cb 0.00 -1.77 -0.01 0.00 -0.71 0.00 0.00 33.22 30.74 2xfi n MET 63 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2xfi s VAL 64 N -3.37 2.13 -1.35 2.03 1.01 -1.26 -2.69 120.40 116.90 2xfi s VAL 64 Ca -0.01 0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.09 2xfi s VAL 64 Cb 0.11 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2xfi s VAL 64 CO 0.80 0.03 0.09 0.47 0.00 0.00 0.00 175.10 176.50 2xfi n ASP 65 N 0.68 -4.87 -0.59 3.32 8.00 -1.21 -4.92 116.55 116.96 2xfi n ASP 65 Ca 0.02 -0.05 0.13 0.00 0.71 0.00 0.00 54.79 55.59 2xfi n ASP 65 Cb 0.39 -3.93 0.42 0.00 -0.02 0.00 0.00 41.12 37.98 2xfi n ASP 65 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2xfi n ASN 66 N -1.17 1.81 -4.65 -2.24 6.94 -0.98 -4.83 115.26 110.14 2xfi n ASN 66 Ca -0.17 -1.64 -0.31 0.00 -0.02 0.00 0.00 54.58 52.43 2xfi n ASN 66 Cb 0.64 -0.05 -0.09 0.00 -2.36 0.00 0.00 39.78 37.92 2xfi n ASN 66 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2xfi s LEU 67 N -1.83 3.37 0.31 -4.53 1.43 -0.36 -4.34 118.68 112.72 2xfi s LEU 67 Ca 0.35 -0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.35 2xfi s LEU 67 Cb 0.20 -2.00 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 2xfi s LEU 67 CO 0.31 0.24 0.11 -0.13 0.23 0.00 0.00 176.35 177.11 2xfi s ARG 68 N -1.81 1.61 -0.18 1.70 1.81 -0.63 -2.33 118.95 119.12 2xfi s ARG 68 Ca 0.21 -1.92 -0.36 0.00 -1.72 0.00 0.00 55.73 51.95 2xfi s ARG 68 Cb -0.11 -0.40 0.15 0.00 -0.45 0.00 0.00 34.95 34.14 2xfi s ARG 68 CO 0.12 -0.35 1.42 0.20 -0.68 0.00 0.00 175.30 176.01 2xfi s GLY 69 N -3.42 -0.37 -0.05 -3.53 0.00 -0.90 -0.28 107.32 98.76 2xfi s GLY 69 Ca 0.34 1.39 0.00 0.00 0.00 0.00 0.00 44.72 46.46 2xfi s GLY 69 CO 0.15 0.38 -0.02 0.54 0.00 0.00 0.00 173.10 174.16 2xfi s LYS 70 N -2.01 2.85 0.13 2.90 1.02 -1.25 -0.06 119.74 123.32 2xfi s LYS 70 Ca 0.14 -0.52 -0.35 0.00 0.02 0.00 0.00 55.97 55.26 2xfi s LYS 70 Cb 0.04 -2.70 -0.16 0.00 -0.52 0.00 0.00 37.83 34.50 2xfi s LYS 70 CO -0.05 0.67 1.37 0.45 -0.92 0.00 0.00 175.35 176.87 2xfi n SER 71 N 1.88 2.03 0.00 2.83 2.88 -1.26 -1.52 113.62 120.45 2xfi n SER 71 Ca -0.17 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.49 2xfi n SER 71 Cb 0.53 -1.27 0.00 0.00 -0.75 0.00 0.00 64.21 62.72 2xfi n SER 71 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2xfi n GLY 72 N 2.62 0.92 0.11 0.46 0.00 -1.26 -4.85 105.19 103.18 2xfi n GLY 72 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.25 2xfi n GLY 72 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2xfi n GLN 73 N -2.16 1.45 0.00 1.61 6.02 -0.58 -4.90 117.38 118.82 2xfi n GLN 73 Ca 0.00 -1.99 0.00 0.00 -0.01 0.00 0.00 57.00 55.00 2xfi n GLN 73 Cb 0.00 -1.19 0.00 0.00 1.02 0.00 0.00 30.24 30.07 2xfi n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2xfi n GLY 74 N -0.94 -1.43 3.56 1.08 0.00 -1.25 -4.77 105.19 101.45 2xfi n GLY 74 Ca 0.09 -1.58 -0.33 0.00 0.00 0.00 0.00 46.02 44.21 2xfi n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2xfi s TYR 75 N -2.29 2.86 0.06 1.61 1.51 -1.26 -3.80 117.35 116.03 2xfi s TYR 75 Ca 0.00 -0.05 0.03 0.00 -1.01 0.00 0.00 57.07 56.04 2xfi s TYR 75 Cb 0.00 -1.64 -0.03 0.00 -0.11 0.00 0.00 41.96 40.18 2xfi s TYR 75 CO 0.00 0.32 -0.09 1.52 -1.11 0.00 0.00 175.55 176.19 2xfi s TYR 76 N -0.89 0.86 0.10 2.71 -0.85 0.61 -0.90 117.35 119.00 2xfi s TYR 76 Ca 0.14 -0.55 0.09 0.00 -0.52 0.00 0.00 57.07 56.24 2xfi s TYR 76 Cb -0.11 -0.50 -0.04 0.00 0.38 0.00 0.00 41.96 41.70 2xfi s TYR 76 CO 0.04 -0.05 -0.22 0.54 -1.52 0.00 0.00 175.55 174.34 2xfi s VAL 77 N -1.68 2.55 0.12 -3.49 0.11 0.01 -1.60 120.40 116.42 2xfi s VAL 77 Ca -0.04 -1.54 -0.30 0.00 -2.93 0.00 0.00 61.98 57.16 2xfi s VAL 77 Cb -0.08 -2.13 -0.06 0.00 -1.53 0.00 0.00 36.38 32.58 2xfi s VAL 77 CO 0.00 0.15 1.03 -0.70 -3.33 0.00 0.00 175.10 172.26 2xfi s GLU 78 N -1.93 4.63 0.18 1.54 2.12 -1.26 -0.50 118.70 123.48 2xfi s GLU 78 Ca 0.15 1.56 0.03 0.00 0.36 0.00 0.00 54.97 57.07 2xfi s GLU 78 Cb -0.10 -3.35 -0.05 0.00 0.26 0.00 0.00 34.13 30.89 2xfi s GLU 78 CO 0.07 0.11 -0.01 -1.64 -0.54 0.00 0.00 175.26 173.24 2xfi s MET 79 N 0.06 1.16 0.09 4.30 -1.94 -0.06 -3.98 119.30 118.93 2xfi s MET 79 Ca 0.49 -1.56 0.09 0.00 -1.71 0.00 0.00 55.69 53.00 2xfi s MET 79 Cb -0.26 -0.41 -0.03 0.00 2.01 0.00 0.00 34.83 36.14 2xfi s MET 79 CO 0.31 -0.09 -0.22 0.95 -0.01 0.00 0.00 175.02 175.96 2xfi s THR 80 N -3.54 1.83 0.01 2.05 -4.23 -0.07 -1.12 115.64 110.56 2xfi s THR 80 Ca 0.24 -1.47 0.04 0.00 -1.18 0.00 0.00 61.69 59.33 2xfi s THR 80 Cb 0.05 -1.63 -0.01 0.00 1.34 0.00 0.00 72.50 72.25 2xfi s THR 80 CO 0.05 0.08 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.38 2xfi s VAL 81 N -1.01 1.08 0.00 2.29 1.01 -0.10 -1.46 120.40 122.21 2xfi s VAL 81 Ca 0.08 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.34 2xfi s VAL 81 Cb -0.10 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.36 2xfi s VAL 81 CO 0.04 0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.94 2xfi n GLY 82 N 2.45 -0.62 2.82 4.51 0.00 0.06 -0.46 105.19 113.95 2xfi n GLY 82 Ca -0.15 -1.73 -0.25 0.00 0.00 0.00 0.00 46.02 43.89 2xfi n GLY 82 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2xfi s SER 83 N -2.19 1.86 0.85 1.61 0.15 -1.26 -3.19 113.70 111.54 2xfi s SER 83 Ca 0.00 -0.19 -0.10 0.00 0.70 0.00 0.00 55.95 56.35 2xfi s SER 83 Cb 0.00 -0.59 0.11 0.00 -1.71 0.00 0.00 66.02 63.83 2xfi s SER 83 CO 0.00 -0.17 1.12 -2.16 1.20 0.00 0.00 173.24 173.23 2xfi s PRO 84 N 1.87 1.55 0.20 5.44 0.04 -1.26 -1.76 135.00 141.07 2xfi s PRO 84 Ca 0.05 1.37 -0.30 0.00 0.04 0.00 0.00 61.00 62.16 2xfi s PRO 84 Cb -0.13 -1.80 -0.09 0.00 0.04 0.00 0.00 34.50 32.53 2xfi s PRO 84 CO -0.06 -2.20 1.28 -2.14 0.04 0.00 0.00 177.00 173.91 2xfi s PRO 85 N -4.76 4.41 -0.25 0.56 0.02 -1.19 -4.90 135.00 128.89 2xfi s PRO 85 Ca 0.64 2.01 -0.07 0.00 0.02 0.00 0.00 61.00 63.60 2xfi s PRO 85 Cb -0.20 -3.21 -0.03 0.00 0.02 0.00 0.00 34.50 31.08 2xfi s PRO 85 CO 0.57 -0.21 0.08 -0.65 -0.33 0.00 0.00 177.00 176.46 2xfi s GLN 86 N -0.16 3.68 -0.00 5.54 -0.21 0.39 -4.90 119.66 123.99 2xfi s GLN 86 Ca 0.56 -0.47 -0.29 0.00 0.02 0.00 0.00 55.36 55.18 2xfi s GLN 86 Cb -0.35 -3.33 -0.03 0.00 1.00 0.00 0.00 33.01 30.29 2xfi s GLN 86 CO 0.38 -0.17 0.93 0.99 -2.12 0.00 0.00 175.29 175.30 2xfi s THR 87 N 1.57 4.87 0.02 -0.19 2.01 -1.26 -0.92 115.64 121.74 2xfi s THR 87 Ca 0.06 1.95 -0.00 0.00 0.31 0.00 0.00 61.69 64.01 2xfi s THR 87 Cb -0.15 -4.27 -0.02 0.00 0.01 0.00 0.00 72.50 68.07 2xfi s THR 87 CO 0.04 0.19 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.38 2xfi s LEU 88 N 0.88 2.17 -0.09 4.42 1.43 -0.28 -4.97 118.68 122.23 2xfi s LEU 88 Ca 0.49 -0.40 -0.17 0.00 -1.03 0.00 0.00 54.13 53.02 2xfi s LEU 88 Cb -0.21 0.11 -0.05 0.00 0.03 0.00 0.00 46.19 46.08 2xfi s LEU 88 CO 0.26 -0.25 0.43 0.20 0.23 0.00 0.00 176.35 177.22 2xfi s ASN 89 N -1.21 6.68 -0.11 2.29 0.02 -1.26 -0.88 114.94 120.47 2xfi s ASN 89 Ca -0.13 0.80 0.01 0.00 -1.02 0.00 0.00 52.86 52.52 2xfi s ASN 89 Cb -0.08 -2.26 0.02 0.00 0.02 0.00 0.00 41.25 38.95 2xfi s ASN 89 CO -0.01 0.10 -0.11 -0.63 0.02 0.00 0.00 177.10 176.47 2xfi s ILE 90 N 0.17 1.23 0.14 0.60 -1.09 0.34 -0.68 121.20 121.92 2xfi s ILE 90 Ca 0.24 -0.46 -0.31 0.00 -2.23 0.00 0.00 60.65 57.88 2xfi s ILE 90 Cb -0.15 -1.18 -0.09 0.00 -1.58 0.00 0.00 42.46 39.46 2xfi s ILE 90 CO 0.10 0.39 1.46 -0.22 -1.23 0.00 0.00 174.94 175.45 2xfi s LEU 91 N 1.26 4.37 -0.37 2.97 0.20 0.29 -0.81 118.68 126.59 2xfi s LEU 91 Ca -0.02 2.45 -0.20 0.00 0.69 0.00 0.00 54.13 57.05 2xfi s LEU 91 Cb -0.14 -3.59 0.01 0.00 -0.43 0.00 0.00 46.19 42.04 2xfi s LEU 91 CO -0.04 -0.72 0.60 0.68 -0.29 0.00 0.00 176.35 176.57 2xfi s VAL 92 N 1.09 4.92 -0.31 1.68 -7.23 -0.08 -0.04 120.40 120.43 2xfi s VAL 92 Ca 0.67 0.39 0.02 0.00 -1.81 0.00 0.00 61.98 61.25 2xfi s VAL 92 Cb -0.40 -4.07 0.09 0.00 0.56 0.00 0.00 36.38 32.56 2xfi s VAL 92 CO 0.31 -0.35 0.04 -0.62 -0.31 0.00 0.00 175.10 174.17 2xfi s ASP 93 N 1.83 4.39 0.00 4.85 2.15 -0.42 -4.24 116.67 125.22 2xfi s ASP 93 Ca 0.22 -1.80 0.27 0.00 0.43 0.00 0.00 52.55 51.66 2xfi s ASP 93 Cb -0.15 -1.33 1.43 0.00 -0.30 0.00 0.00 42.92 42.57 2xfi s ASP 93 CO 0.15 -0.35 1.92 0.35 -0.17 0.00 0.00 175.17 177.06 2xfi n THR 94 N 4.50 0.10 -0.19 1.71 -2.24 -1.26 -0.64 114.28 116.27 2xfi n THR 94 Ca -0.01 0.03 0.11 0.00 -2.27 0.00 0.00 64.05 61.90 2xfi n THR 94 Cb 0.42 -0.60 0.30 0.00 -2.10 0.00 0.00 70.33 68.36 2xfi n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2xfi n GLY 95 N 0.84 2.22 3.60 3.38 0.00 -1.26 -4.24 105.19 109.73 2xfi n GLY 95 Ca 0.15 -0.75 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 2xfi n GLY 95 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2xfi s SER 96 N -1.01 0.44 -0.01 1.61 1.04 -1.23 -5.01 113.70 109.54 2xfi s SER 96 Ca 0.46 -1.26 0.01 0.00 0.48 0.00 0.00 55.95 55.64 2xfi s SER 96 Cb 0.24 0.70 0.01 0.00 0.10 0.00 0.00 66.02 67.07 2xfi s SER 96 CO 0.31 -1.37 0.72 -1.20 0.98 0.00 0.00 173.24 172.68 2xfi n SER 97 N -1.17 0.59 -4.66 7.02 7.64 -1.26 -0.99 113.62 120.79 2xfi n SER 97 Ca -0.02 -1.47 -0.35 0.00 1.01 0.00 0.00 58.87 58.04 2xfi n SER 97 Cb 0.61 -0.05 -0.10 0.00 -1.01 0.00 0.00 64.21 63.67 2xfi n SER 97 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2xfi s ASN 98 N -0.51 5.42 -0.26 6.43 -0.87 -1.26 -4.51 114.94 119.38 2xfi s ASN 98 Ca 0.02 0.12 -0.14 0.00 -1.57 0.00 0.00 52.86 51.28 2xfi s ASN 98 Cb 0.01 -1.74 -0.04 0.00 -0.02 0.00 0.00 41.25 39.46 2xfi s ASN 98 CO 0.00 0.28 0.33 0.12 -2.57 0.00 0.00 177.10 175.27 2xfi s PHE 99 N -0.31 3.26 -0.02 2.20 5.99 -1.26 -1.46 117.98 126.39 2xfi s PHE 99 Ca 0.07 0.38 -0.05 0.00 0.00 0.00 0.00 56.93 57.33 2xfi s PHE 99 Cb -0.12 -2.52 0.00 0.00 0.00 0.00 0.00 43.02 40.39 2xfi s PHE 99 CO 0.02 -0.17 0.11 0.00 -0.00 0.00 0.00 175.22 175.18 2xfi s ALA 100 N 1.86 -0.27 0.01 11.12 0.00 -0.50 -1.20 121.76 132.77 2xfi s ALA 100 Ca 0.14 0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.16 2xfi s ALA 100 Cb -0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.92 2xfi s ALA 100 CO 0.09 -0.13 -0.05 0.14 0.00 0.00 0.00 175.76 175.81 2xfi s VAL 101 N -0.71 0.36 0.13 0.00 -7.23 -0.49 -0.35 120.40 112.11 2xfi s VAL 101 Ca -0.08 -0.36 -0.35 0.00 -1.81 0.00 0.00 61.98 59.38 2xfi s VAL 101 Cb -0.05 -0.34 -0.16 0.00 0.56 0.00 0.00 36.38 36.40 2xfi s VAL 101 CO 0.01 -0.01 1.34 0.61 -0.31 0.00 0.00 175.10 176.74 2xfi n GLY 102 N 2.67 0.50 0.34 2.32 0.00 0.34 -0.65 105.19 110.72 2xfi n GLY 102 Ca -0.15 0.64 0.02 0.00 0.00 0.00 0.00 46.02 46.53 2xfi n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xfi n ALA 103 N 2.39 1.92 -3.25 4.61 0.00 -0.59 -0.76 120.51 124.84 2xfi n ALA 103 Ca 0.17 -1.23 -0.12 0.00 0.00 0.00 0.00 53.44 52.25 2xfi n ALA 103 Cb 0.23 -0.40 -0.04 0.00 0.00 0.00 0.00 19.45 19.24 2xfi n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2xfi s ALA 104 N -0.56 -1.30 0.61 0.00 0.00 -1.23 -4.79 121.76 114.50 2xfi s ALA 104 Ca 0.06 0.36 -0.19 0.00 0.00 0.00 0.00 51.96 52.19 2xfi s ALA 104 Cb 0.05 0.66 -0.02 0.00 0.00 0.00 0.00 23.12 23.80 2xfi s ALA 104 CO 0.01 -0.64 1.29 -2.30 0.00 0.00 0.00 175.76 174.12 2xfi n PRO 105 N -0.07 1.28 -3.71 0.00 -0.02 -1.26 -4.93 135.00 126.29 2xfi n PRO 105 Ca -0.17 0.49 -0.14 0.00 -2.02 0.00 0.00 63.50 61.66 2xfi n PRO 105 Cb 0.63 -2.52 -0.09 0.00 -0.02 0.00 0.00 33.50 31.49 2xfi n PRO 105 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2xfi s HIS 106 N -1.36 -0.45 0.55 6.00 2.46 -1.26 -5.04 115.29 116.18 2xfi s HIS 106 Ca 0.79 1.05 0.27 0.00 0.47 0.00 0.00 55.06 57.64 2xfi s HIS 106 Cb -0.39 0.17 1.45 0.00 -0.13 0.00 0.00 32.58 33.68 2xfi s HIS 106 CO 0.43 -0.29 1.98 -1.35 -2.47 0.00 0.00 174.74 173.04 2xfi h PRO 107 N 5.01 0.00 -0.33 2.88 0.11 -2.02 -1.38 132.00 136.26 2xfi h PRO 107 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2xfi h PRO 107 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2xfi h PRO 107 CO 0.26 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.24 2xfi n PHE 108 N -4.19 0.41 -3.56 0.65 0.99 -1.26 -4.89 117.46 105.62 2xfi n PHE 108 Ca 0.09 -0.21 -0.37 0.00 -0.00 0.00 0.00 57.45 56.96 2xfi n PHE 108 Cb 0.62 0.00 -0.09 0.00 -1.00 0.00 0.00 39.48 39.01 2xfi n PHE 108 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2xfi s LEU 109 N -1.58 4.09 0.25 4.37 1.43 -0.52 -4.64 118.68 122.08 2xfi s LEU 109 Ca 0.37 0.19 0.08 0.00 -1.03 0.00 0.00 54.13 53.74 2xfi s LEU 109 Cb 0.22 -2.23 0.27 0.00 0.03 0.00 0.00 46.19 44.48 2xfi s LEU 109 CO 0.32 -0.02 1.56 0.45 0.23 0.00 0.00 176.35 178.89 2xfi h HIS 110 N 7.74 0.09 -3.18 0.29 3.86 -1.90 -3.43 115.15 118.62 2xfi h HIS 110 Ca -0.36 -0.04 0.01 0.00 -1.16 0.00 0.00 60.37 58.82 2xfi h HIS 110 Cb 1.17 -0.02 -0.08 0.00 1.06 0.00 0.00 27.41 29.54 2xfi h HIS 110 CO 0.70 0.70 0.12 -0.98 0.86 0.00 0.00 177.93 179.33 2xfi s ARG 111 N -3.56 1.53 0.19 2.45 1.70 -1.26 -5.15 118.95 114.84 2xfi s ARG 111 Ca -0.02 -0.89 -0.17 0.00 -0.47 0.00 0.00 55.73 54.18 2xfi s ARG 111 Cb 0.12 0.56 0.03 0.00 -0.57 0.00 0.00 34.95 35.09 2xfi s ARG 111 CO 0.78 -0.67 0.50 1.52 -1.08 0.00 0.00 175.30 176.34 2xfi s TYR 112 N -3.89 -0.08 -0.03 5.89 -0.85 -1.26 -4.91 117.35 112.22 2xfi s TYR 112 Ca 0.10 -0.27 -0.30 0.00 -0.52 0.00 0.00 57.07 56.08 2xfi s TYR 112 Cb -0.03 0.35 -0.05 0.00 0.38 0.00 0.00 41.96 42.61 2xfi s TYR 112 CO 0.00 -0.89 1.38 -0.47 -1.52 0.00 0.00 175.55 174.05 2xfi s TYR 113 N -3.88 2.82 -0.54 -3.49 5.04 0.06 -4.95 117.35 112.42 2xfi s TYR 113 Ca 0.10 0.84 -0.08 0.00 -2.44 0.00 0.00 57.07 55.49 2xfi s TYR 113 Cb -0.00 -3.63 0.14 0.00 0.35 0.00 0.00 41.96 38.81 2xfi s TYR 113 CO -0.03 -2.31 0.40 -0.65 -1.34 0.00 0.00 175.55 171.62 2xfi s GLN 114 N 2.66 2.58 0.31 4.97 -0.21 -1.26 -4.41 119.66 124.30 2xfi s GLN 114 Ca 0.62 -2.01 -0.00 0.00 0.02 0.00 0.00 55.36 53.99 2xfi s GLN 114 Cb -0.29 -3.91 0.49 0.00 1.00 0.00 0.00 33.01 30.29 2xfi s GLN 114 CO 0.25 -1.19 1.93 0.00 -2.12 0.00 0.00 175.29 174.16 2xfi h ARG 115 N 8.05 0.92 0.00 2.91 3.08 -1.94 -2.30 114.38 125.10 2xfi h ARG 115 Ca -0.13 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 2xfi h ARG 115 Cb 1.04 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.91 2xfi h ARG 115 CO 0.80 0.68 -0.01 -0.56 -1.07 0.00 0.00 179.97 179.81 2xfi h GLN 116 N 0.93 0.00 -0.01 0.04 -0.00 -2.00 -1.74 115.11 112.33 2xfi h GLN 116 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.89 2xfi h GLN 116 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.51 2xfi h GLN 116 CO -0.04 0.01 -0.20 1.28 -0.00 0.00 0.00 178.83 179.89 2xfi n LEU 117 N -3.23 0.85 -4.35 0.06 4.77 -0.87 -4.84 117.00 109.39 2xfi n LEU 117 Ca -0.02 -0.17 -0.37 0.00 -0.03 0.00 0.00 56.01 55.41 2xfi n LEU 117 Cb 0.13 -0.14 -0.13 0.00 -2.33 0.00 0.00 43.42 40.95 2xfi n LEU 117 CO 0.23 0.16 -0.28 -0.55 -1.33 0.00 0.00 177.39 175.62 2xfi s SER 118 N -2.48 5.08 0.33 -1.43 0.15 -0.66 -4.26 113.70 110.44 2xfi s SER 118 Ca 0.26 -0.65 0.26 0.00 0.70 0.00 0.00 55.95 56.53 2xfi s SER 118 Cb 0.20 -1.88 0.92 0.00 -1.71 0.00 0.00 66.02 63.55 2xfi s SER 118 CO 0.50 -0.17 1.77 0.77 1.20 0.00 0.00 173.24 177.31 2xfi h SER 119 N 8.23 0.00 0.12 5.45 4.64 -1.63 -3.00 113.55 127.34 2xfi h SER 119 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2xfi h SER 119 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2xfi h SER 119 CO 0.60 0.00 -0.52 0.35 -0.87 0.00 0.00 176.83 176.40 2xfi n THR 120 N -2.54 0.00 -1.80 2.95 -2.24 -1.26 -4.92 114.28 104.47 2xfi n THR 120 Ca 0.03 -0.14 -0.42 0.00 -2.27 0.00 0.00 64.05 61.25 2xfi n THR 120 Cb 0.35 0.85 -0.02 0.00 -2.10 0.00 0.00 70.33 69.41 2xfi n THR 120 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2xfi s TYR 121 N -2.64 2.87 -0.15 4.78 5.04 -1.14 -4.55 117.35 121.56 2xfi s TYR 121 Ca 0.17 0.62 0.00 0.00 -2.44 0.00 0.00 57.07 55.43 2xfi s TYR 121 Cb 0.18 -4.06 0.02 0.00 0.35 0.00 0.00 41.96 38.45 2xfi s TYR 121 CO 0.63 -3.76 -0.15 0.50 -1.34 0.00 0.00 175.55 171.43 2xfi s ARG 122 N 0.33 2.41 0.10 4.97 3.00 -0.32 -4.99 118.95 124.45 2xfi s ARG 122 Ca 0.68 -0.60 -0.30 0.00 -1.00 0.00 0.00 55.73 54.51 2xfi s ARG 122 Cb -0.47 -2.18 -0.06 0.00 0.00 0.00 0.00 34.95 32.23 2xfi s ARG 122 CO 0.40 -0.23 1.20 0.34 0.00 0.00 0.00 175.30 177.01 2xfi s ASP 123 N 1.45 7.08 0.00 -2.12 2.15 -1.26 -0.62 116.67 123.35 2xfi s ASP 123 Ca 0.05 2.09 0.27 0.00 0.43 0.00 0.00 52.55 55.39 2xfi s ASP 123 Cb -0.13 -2.59 0.78 0.00 -0.30 0.00 0.00 42.92 40.68 2xfi s ASP 123 CO -0.11 -0.44 1.59 0.18 -0.17 0.00 0.00 175.17 176.21 2xfi n LEU 124 N 3.49 1.66 -3.64 -1.34 4.77 -0.51 -4.93 117.00 116.50 2xfi n LEU 124 Ca 0.08 -0.54 -0.21 0.00 -0.03 0.00 0.00 56.01 55.30 2xfi n LEU 124 Cb 0.46 -0.03 0.05 0.00 -2.33 0.00 0.00 43.42 41.57 2xfi n LEU 124 CO 0.56 0.28 0.03 0.54 -1.33 0.00 0.00 177.39 177.47 2xfi n ARG 125 N 0.15 -5.72 -3.67 3.23 1.74 -1.25 -4.98 116.66 106.16 2xfi n ARG 125 Ca 0.16 0.70 -0.09 0.00 -0.77 0.00 0.00 57.85 57.85 2xfi n ARG 125 Cb 0.40 -5.47 -0.09 0.00 -1.02 0.00 0.00 32.46 26.28 2xfi n ARG 125 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2xfi s LYS 126 N -5.90 0.54 0.56 5.56 2.47 -1.26 -5.07 119.74 116.64 2xfi s LYS 126 Ca 0.12 0.97 -0.05 0.00 -1.56 0.00 0.00 55.97 55.45 2xfi s LYS 126 Cb -0.06 0.06 0.00 0.00 -1.46 0.00 0.00 37.83 36.38 2xfi s LYS 126 CO 0.78 -0.15 0.86 0.20 0.16 0.00 0.00 175.35 177.20 2xfi s GLY 127 N 1.44 1.59 -0.12 5.54 0.00 -1.26 -0.75 107.32 113.75 2xfi s GLY 127 Ca -0.09 -0.72 -0.12 0.00 0.00 0.00 0.00 44.72 43.79 2xfi s GLY 127 CO -0.15 -0.46 0.34 0.54 0.00 0.00 0.00 173.10 173.37 2xfi s VAL 128 N -2.91 0.00 -0.08 1.40 0.11 -0.15 -4.83 120.40 113.95 2xfi s VAL 128 Ca 0.52 -0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.60 2xfi s VAL 128 Cb -0.10 -0.48 0.00 0.00 -1.53 0.00 0.00 36.38 34.26 2xfi s VAL 128 CO 0.44 -0.01 -0.20 -0.47 -3.33 0.00 0.00 175.10 171.53 2xfi s TYR 129 N 0.14 2.17 -0.15 1.54 5.04 -1.26 -0.93 117.35 123.90 2xfi s TYR 129 Ca -0.00 -0.83 -0.01 0.00 -2.44 0.00 0.00 57.07 53.79 2xfi s TYR 129 Cb -0.02 -1.48 0.04 0.00 0.35 0.00 0.00 41.96 40.85 2xfi s TYR 129 CO 0.01 -0.34 -0.04 0.08 -1.34 0.00 0.00 175.55 173.92 2xfi s VAL 130 N 0.35 0.93 -0.18 3.14 1.01 -0.35 -4.90 120.40 120.41 2xfi s VAL 130 Ca -0.15 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 61.29 2xfi s VAL 130 Cb -0.16 -1.11 -0.05 0.00 0.00 0.00 0.00 36.38 35.06 2xfi s VAL 130 CO 0.06 0.16 0.11 -2.16 0.00 0.00 0.00 175.10 173.27 2xfi s PRO 131 N 1.72 4.03 0.49 2.72 0.04 -1.26 -1.52 135.00 141.22 2xfi s PRO 131 Ca 0.02 -0.25 0.07 0.00 0.04 0.00 0.00 61.00 60.88 2xfi s PRO 131 Cb -0.14 -3.32 0.02 0.00 0.04 0.00 0.00 34.50 31.10 2xfi s PRO 131 CO -0.07 0.35 0.48 0.71 0.04 0.00 0.00 177.00 178.50 2xfi s TYR 132 N 0.20 2.09 0.43 0.56 2.02 -0.18 -5.01 117.35 117.46 2xfi s TYR 132 Ca 0.07 -0.65 0.09 0.00 -0.37 0.00 0.00 57.07 56.21 2xfi s TYR 132 Cb -0.12 -2.10 0.94 0.00 -0.40 0.00 0.00 41.96 40.28 2xfi s TYR 132 CO -0.01 -0.46 2.08 1.79 -1.57 0.00 0.00 175.55 177.38 2xfi h THR 133 N 0.75 1.09 -3.13 -0.71 1.35 -1.99 -3.37 112.91 106.89 2xfi h THR 133 Ca -0.37 -0.16 -0.59 0.00 -0.55 0.00 0.00 66.41 64.73 2xfi h THR 133 Cb 1.28 0.60 -0.36 0.00 -1.73 0.00 0.00 68.15 67.94 2xfi h THR 133 CO 0.53 0.08 -0.83 -1.58 -0.25 0.00 0.00 175.52 173.48 2xfi s GLN 134 N -5.41 2.21 0.00 4.72 0.74 -1.26 -5.08 119.66 115.58 2xfi s GLN 134 Ca -0.08 -0.53 0.00 0.00 0.05 0.00 0.00 55.36 54.81 2xfi s GLN 134 Cb 0.17 -2.04 0.00 0.00 1.10 0.00 0.00 33.01 32.24 2xfi s GLN 134 CO 0.72 -0.23 0.00 0.41 -0.55 0.00 0.00 175.29 175.64 2xfi n GLY 135 N 4.77 -1.28 3.39 2.59 0.00 -1.23 -4.84 105.19 108.58 2xfi n GLY 135 Ca -0.17 -1.59 -0.12 0.00 0.00 0.00 0.00 46.02 44.15 2xfi n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2xfi s LYS 136 N -2.54 1.19 0.12 1.61 -2.85 -0.76 -1.01 119.74 115.50 2xfi s LYS 136 Ca 0.00 -0.50 -0.11 0.00 -1.00 0.00 0.00 55.97 54.35 2xfi s LYS 136 Cb 0.00 0.54 0.01 0.00 -2.06 0.00 0.00 37.83 36.32 2xfi s LYS 136 CO 0.00 -0.50 0.30 1.67 0.10 0.00 0.00 175.35 176.92 2xfi s TRP 137 N -3.59 0.09 0.07 1.78 1.48 -0.57 -0.86 118.94 117.34 2xfi s TRP 137 Ca 0.01 -0.47 0.05 0.00 -1.06 0.00 0.00 56.10 54.63 2xfi s TRP 137 Cb -0.00 0.06 -0.03 0.00 -1.16 0.00 0.00 33.47 32.34 2xfi s TRP 137 CO -0.11 -0.66 -0.14 -1.83 -4.06 0.00 0.00 176.95 170.15 2xfi s GLU 138 N -3.87 0.82 0.07 3.25 -1.05 -0.21 -1.21 118.70 116.50 2xfi s GLU 138 Ca 0.08 -0.96 -0.04 0.00 -0.15 0.00 0.00 54.97 53.89 2xfi s GLU 138 Cb 0.03 -0.82 0.02 0.00 -0.44 0.00 0.00 34.13 32.92 2xfi s GLU 138 CO -0.08 0.18 0.22 0.41 0.95 0.00 0.00 175.26 176.94 2xfi n GLY 139 N 1.27 1.44 3.42 -3.83 0.00 -0.10 -1.10 105.19 106.28 2xfi n GLY 139 Ca -0.21 -1.02 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 2xfi n GLY 139 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2xfi s GLU 140 N -2.02 3.49 0.32 1.61 2.56 -0.68 -0.97 118.70 123.02 2xfi s GLU 140 Ca 0.05 -0.62 -0.27 0.00 0.00 0.00 0.00 54.97 54.13 2xfi s GLU 140 Cb -0.01 -2.76 -0.09 0.00 2.00 0.00 0.00 34.13 33.27 2xfi s GLU 140 CO 0.02 0.20 0.99 -0.51 -0.56 0.00 0.00 175.26 175.41 2xfi s LEU 141 N 0.41 4.37 0.00 2.70 1.43 0.07 -0.82 118.68 126.85 2xfi s LEU 141 Ca -0.08 1.97 -0.11 0.00 -1.03 0.00 0.00 54.13 54.89 2xfi s LEU 141 Cb -0.15 -3.93 0.04 0.00 0.03 0.00 0.00 46.19 42.18 2xfi s LEU 141 CO 0.04 -0.15 0.59 0.61 0.23 0.00 0.00 176.35 177.68 2xfi n GLY 142 N 0.75 1.23 3.25 -3.19 0.00 -0.62 -1.42 105.19 105.19 2xfi n GLY 142 Ca 0.02 -1.19 -0.17 0.00 0.00 0.00 0.00 46.02 44.68 2xfi n GLY 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2xfi s THR 143 N -2.32 1.30 0.22 2.61 -4.23 0.21 -0.73 115.64 112.70 2xfi s THR 143 Ca 0.12 -1.87 -0.23 0.00 -1.18 0.00 0.00 61.69 58.53 2xfi s THR 143 Cb -0.04 -1.67 0.05 0.00 1.34 0.00 0.00 72.50 72.19 2xfi s THR 143 CO 0.09 -0.55 0.88 -0.62 -0.54 0.00 0.00 174.62 173.88 2xfi s ASP 144 N -2.76 -0.16 0.12 3.99 -1.08 -0.82 -1.18 116.67 114.77 2xfi s ASP 144 Ca 0.12 -0.58 -0.29 0.00 -0.52 0.00 0.00 52.55 51.29 2xfi s ASP 144 Cb -0.02 0.60 -0.06 0.00 -1.46 0.00 0.00 42.92 41.98 2xfi s ASP 144 CO 0.03 -1.13 0.92 -0.76 0.52 0.00 0.00 175.17 174.75 2xfi s LEU 145 N -3.00 4.51 -0.02 -1.34 1.43 -1.26 -1.11 118.68 117.89 2xfi s LEU 145 Ca 0.13 1.76 0.02 0.00 -1.03 0.00 0.00 54.13 55.01 2xfi s LEU 145 Cb -0.03 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.66 2xfi s LEU 145 CO 0.05 -0.02 -0.08 -0.69 0.23 0.00 0.00 176.35 175.84 2xfi s VAL 146 N -0.18 0.72 0.13 -1.59 1.01 0.11 -0.76 120.40 119.83 2xfi s VAL 146 Ca 0.45 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 62.12 2xfi s VAL 146 Cb -0.23 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 2xfi s VAL 146 CO 0.29 0.22 -0.06 -0.44 0.00 0.00 0.00 175.10 175.11 2xfi s SER 147 N 0.13 1.37 -0.37 3.32 0.01 -0.54 -1.50 113.70 116.12 2xfi s SER 147 Ca -0.02 -1.04 0.02 0.00 1.31 0.00 0.00 55.95 56.22 2xfi s SER 147 Cb -0.07 0.06 0.11 0.00 0.21 0.00 0.00 66.02 66.33 2xfi s SER 147 CO 0.00 -0.44 0.13 -0.63 0.41 0.00 0.00 173.24 172.71 2xfi s ILE 148 N -3.53 1.72 0.33 1.44 1.01 -1.26 -0.90 121.20 120.01 2xfi s ILE 148 Ca 0.16 -2.23 0.08 0.00 0.00 0.00 0.00 60.65 58.66 2xfi s ILE 148 Cb 0.05 -2.25 0.32 0.00 0.01 0.00 0.00 42.46 40.58 2xfi s ILE 148 CO -0.01 -0.71 1.82 -0.65 0.00 0.00 0.00 174.94 175.39 2xfi h PRO 149 N 7.44 0.72 -0.62 2.79 0.11 -1.88 -0.88 132.00 139.68 2xfi h PRO 149 Ca -0.07 -0.04 -0.35 0.00 0.11 0.00 0.00 66.00 65.65 2xfi h PRO 149 Cb 0.98 -0.16 -0.20 0.00 0.11 0.00 0.00 31.00 31.73 2xfi h PRO 149 CO 0.52 0.47 0.15 0.72 -0.21 0.00 0.00 178.00 179.66 2xfi n HIS 150 N -4.64 1.95 -2.08 0.65 8.25 -1.26 -4.94 115.22 113.15 2xfi n HIS 150 Ca 0.20 -1.86 0.00 0.00 -0.26 0.00 0.00 57.72 55.80 2xfi n HIS 150 Cb 0.53 -0.70 0.00 0.00 1.12 0.00 0.00 29.99 30.94 2xfi n HIS 150 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2xfi n GLY 151 N -1.09 5.29 3.76 -1.41 0.00 -0.33 -4.13 105.19 107.27 2xfi n GLY 151 Ca 0.44 -1.74 -0.39 0.00 0.00 0.00 0.00 46.02 44.33 2xfi n GLY 151 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2xfi s PRO 152 N 1.92 3.44 -1.27 1.61 0.02 -1.26 -4.88 135.00 134.58 2xfi s PRO 152 Ca 0.00 2.29 -0.09 0.00 0.02 0.00 0.00 61.00 63.21 2xfi s PRO 152 Cb 0.00 -2.46 0.17 0.00 0.02 0.00 0.00 34.50 32.24 2xfi s PRO 152 CO 0.00 -0.97 1.84 1.04 -0.33 0.00 0.00 177.00 178.59 2xfi n GLN 153 N -0.60 3.65 -4.09 5.54 1.13 -1.26 -4.48 117.38 117.26 2xfi n GLN 153 Ca 0.08 -3.58 -0.08 0.00 -1.94 0.00 0.00 57.00 51.48 2xfi n GLN 153 Cb 0.44 -2.91 -0.10 0.00 0.11 0.00 0.00 30.24 27.77 2xfi n GLN 153 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 2xfi s VAL 154 N 0.31 0.30 -0.04 5.09 -7.23 -1.26 -5.14 120.40 112.43 2xfi s VAL 154 Ca 0.39 -1.74 0.03 0.00 -1.81 0.00 0.00 61.98 58.85 2xfi s VAL 154 Cb 0.09 -1.43 0.00 0.00 0.56 0.00 0.00 36.38 35.61 2xfi s VAL 154 CO 0.01 -0.92 -0.14 -0.89 -0.31 0.00 0.00 175.10 172.85 2xfi s THR 155 N -3.61 1.19 0.08 5.32 2.01 -1.26 -4.37 115.64 115.01 2xfi s THR 155 Ca 0.06 -0.57 0.05 0.00 0.31 0.00 0.00 61.69 61.54 2xfi s THR 155 Cb 0.06 -1.05 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 2xfi s THR 155 CO -0.08 0.36 -0.14 0.68 -0.69 0.00 0.00 174.62 174.75 2xfi s VAL 156 N 0.24 1.14 -0.15 3.82 -7.23 -0.56 -4.93 120.40 112.73 2xfi s VAL 156 Ca -0.06 -1.41 -0.20 0.00 -1.81 0.00 0.00 61.98 58.49 2xfi s VAL 156 Cb -0.12 -1.18 -0.03 0.00 0.56 0.00 0.00 36.38 35.61 2xfi s VAL 156 CO 0.02 -0.28 0.60 -0.60 -0.31 0.00 0.00 175.10 174.52 2xfi s ARG 157 N -2.00 4.29 0.05 4.82 3.52 -1.26 0.05 118.95 128.42 2xfi s ARG 157 Ca 0.01 0.61 0.00 0.00 -0.13 0.00 0.00 55.73 56.22 2xfi s ARG 157 Cb -0.08 -3.51 -0.03 0.00 -1.56 0.00 0.00 34.95 29.76 2xfi s ARG 157 CO 0.02 -0.07 -0.04 0.00 -0.81 0.00 0.00 175.30 174.40 2xfi s ALA 158 N 1.34 0.48 0.32 6.12 0.00 -0.26 -4.92 121.76 124.84 2xfi s ALA 158 Ca 0.29 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 50.97 2xfi s ALA 158 Cb -0.16 0.19 -0.11 0.00 0.00 0.00 0.00 23.12 23.04 2xfi s ALA 158 CO 0.12 -0.24 1.42 -0.80 0.00 0.00 0.00 175.76 176.25 2xfi s ASN 159 N -2.35 6.59 -0.03 0.00 0.01 -1.26 -1.95 114.94 115.95 2xfi s ASN 159 Ca -0.01 2.81 0.00 0.00 -0.71 0.00 0.00 52.86 54.95 2xfi s ASN 159 Cb 0.00 -2.65 0.03 0.00 0.41 0.00 0.00 41.25 39.04 2xfi s ASN 159 CO -0.05 -0.71 0.00 -0.63 -1.51 0.00 0.00 177.10 174.21 2xfi s ILE 160 N -0.73 0.13 -0.30 0.60 1.01 0.09 -4.67 121.20 117.33 2xfi s ILE 160 Ca 0.54 0.10 -0.17 0.00 0.00 0.00 0.00 60.65 61.12 2xfi s ILE 160 Cb -0.43 -0.23 -0.02 0.00 0.01 0.00 0.00 42.46 41.80 2xfi s ILE 160 CO 0.53 0.13 0.47 0.00 0.00 0.00 0.00 174.94 176.07 2xfi s ALA 161 N 0.95 3.54 -0.53 9.38 0.00 -0.34 -1.59 121.76 133.16 2xfi s ALA 161 Ca -0.09 -0.83 -0.22 0.00 0.00 0.00 0.00 51.96 50.81 2xfi s ALA 161 Cb -0.13 -2.89 0.05 0.00 0.00 0.00 0.00 23.12 20.15 2xfi s ALA 161 CO -0.02 -0.91 0.83 0.00 0.00 0.00 0.00 175.76 175.66 2xfi s ALA 162 N 2.27 3.24 -0.18 0.00 0.00 0.00 -1.40 121.76 125.69 2xfi s ALA 162 Ca 0.18 -1.38 -0.29 0.00 0.00 0.00 0.00 51.96 50.47 2xfi s ALA 162 Cb -0.16 -3.60 -0.02 0.00 0.00 0.00 0.00 23.12 19.35 2xfi s ALA 162 CO 0.11 -2.24 1.38 0.42 0.00 0.00 0.00 175.76 175.44 2xfi s ILE 163 N 3.49 4.06 -0.04 0.00 1.01 0.18 -1.68 121.20 128.22 2xfi s ILE 163 Ca 0.26 1.25 0.15 0.00 0.00 0.00 0.00 60.65 62.31 2xfi s ILE 163 Cb -0.15 -3.90 -0.24 0.00 0.01 0.00 0.00 42.46 38.19 2xfi s ILE 163 CO 0.17 -0.21 0.30 0.35 0.00 0.00 0.00 174.94 175.55 2xfi n THR 164 N 5.69 0.16 -3.83 2.92 -2.24 -0.26 -1.54 114.28 115.17 2xfi n THR 164 Ca 0.15 -0.40 -0.12 0.00 -2.27 0.00 0.00 64.05 61.41 2xfi n THR 164 Cb 0.45 0.02 -0.10 0.00 -2.10 0.00 0.00 70.33 68.60 2xfi n THR 164 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2xfi s GLU 165 N -2.98 0.47 0.14 -0.78 2.12 -1.08 -4.88 118.70 111.69 2xfi s GLU 165 Ca -0.06 -0.20 -0.16 0.00 0.36 0.00 0.00 54.97 54.91 2xfi s GLU 165 Cb 0.09 0.20 0.03 0.00 0.26 0.00 0.00 34.13 34.72 2xfi s GLU 165 CO 0.65 -0.11 0.41 -1.54 -0.54 0.00 0.00 175.26 174.14 2xfi s SER 166 N -1.04 -0.23 -0.15 -1.70 1.04 -1.26 -1.05 113.70 109.32 2xfi s SER 166 Ca -0.11 -0.35 -0.04 0.00 0.48 0.00 0.00 55.95 55.92 2xfi s SER 166 Cb -0.06 0.49 0.06 0.00 0.10 0.00 0.00 66.02 66.61 2xfi s SER 166 CO 0.02 -0.88 0.11 -0.62 0.98 0.00 0.00 173.24 172.85 2xfi s ASP 167 N -2.82 1.86 -1.45 7.02 2.15 -0.04 -4.88 116.67 118.50 2xfi s ASP 167 Ca 0.04 -0.36 -0.06 0.00 0.43 0.00 0.00 52.55 52.61 2xfi s ASP 167 Cb 0.01 -0.08 0.03 0.00 -0.30 0.00 0.00 42.92 42.58 2xfi s ASP 167 CO -0.10 -0.32 0.50 0.29 -0.17 0.00 0.00 175.17 175.36 2xfi n LYS 168 N 5.29 -4.09 -0.05 4.34 5.02 -1.26 -1.83 118.16 125.58 2xfi n LYS 168 Ca -0.06 0.76 -0.05 0.00 -2.02 0.00 0.00 58.31 56.94 2xfi n LYS 168 Cb 0.49 -5.55 -0.02 0.00 -0.02 0.00 0.00 35.03 29.94 2xfi n LYS 168 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2xfi n PHE 169 N -4.24 0.00 -2.11 2.13 7.35 -1.26 -3.52 117.46 115.81 2xfi n PHE 169 Ca -0.09 0.00 -0.38 0.00 -0.76 0.00 0.00 57.45 56.21 2xfi n PHE 169 Cb 0.60 -0.29 -0.00 0.00 0.35 0.00 0.00 39.48 40.14 2xfi n PHE 169 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2xfi s PHE 170 N -2.14 2.78 -0.10 -5.13 0.40 -1.26 -4.99 117.98 107.54 2xfi s PHE 170 Ca -0.17 1.47 0.01 0.00 -0.60 0.00 0.00 56.93 57.64 2xfi s PHE 170 Cb 0.02 -3.55 -0.02 0.00 0.51 0.00 0.00 43.02 39.98 2xfi s PHE 170 CO 0.25 -1.92 -0.13 0.42 0.70 0.00 0.00 175.22 174.54 2xfi s ILE 171 N -1.39 3.09 0.10 0.64 1.01 -1.26 -5.01 121.20 118.38 2xfi s ILE 171 Ca 0.62 -0.68 -0.31 0.00 0.00 0.00 0.00 60.65 60.28 2xfi s ILE 171 Cb -0.34 -2.26 -0.10 0.00 0.01 0.00 0.00 42.46 39.77 2xfi s ILE 171 CO 0.42 0.55 1.86 -1.58 0.00 0.00 0.00 174.94 176.20 2xfi s GLN 172 N -0.09 4.14 -1.14 2.79 0.74 -1.26 -2.93 119.66 121.90 2xfi s GLN 172 Ca -0.02 2.60 -0.10 0.00 0.05 0.00 0.00 55.36 57.89 2xfi s GLN 172 Cb -0.14 -3.75 -0.03 0.00 1.10 0.00 0.00 33.01 30.20 2xfi s GLN 172 CO 0.04 -0.87 0.83 0.41 -0.55 0.00 0.00 175.29 175.14 2xfi n GLY 173 N 4.32 -0.88 0.02 2.59 0.00 -1.26 -4.97 105.19 105.00 2xfi n GLY 173 Ca 0.18 0.42 0.05 0.00 0.00 0.00 0.00 46.02 46.67 2xfi n GLY 173 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2xfi n SER 174 N -2.98 1.48 -0.02 1.61 3.41 -1.15 -5.02 113.62 110.95 2xfi n SER 174 Ca -0.14 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.47 2xfi n SER 174 Cb 0.62 1.53 -0.00 0.00 -0.26 0.00 0.00 64.21 66.10 2xfi n SER 174 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2xfi n ASN 175 N -2.14 -3.99 -4.43 4.04 3.02 -1.26 -4.65 115.26 105.86 2xfi n ASN 175 Ca -0.07 0.01 -0.27 0.00 -0.03 0.00 0.00 54.58 54.21 2xfi n ASN 175 Cb 0.52 -1.52 -0.12 0.00 -0.61 0.00 0.00 39.78 38.05 2xfi n ASN 175 CO 0.00 0.00 0.00 -1.66 -2.62 0.00 0.00 177.26 172.98 2xfi s TRP 176 N -1.69 2.33 0.00 3.10 1.48 -1.26 -4.60 118.94 118.29 2xfi s TRP 176 Ca 0.00 -0.35 0.00 0.00 -1.06 0.00 0.00 56.10 54.69 2xfi s TRP 176 Cb 0.00 -1.18 0.00 0.00 -1.16 0.00 0.00 33.47 31.13 2xfi s TRP 176 CO 0.00 0.46 0.62 0.39 -4.06 0.00 0.00 176.95 174.36 2xfi n GLU 177 N 0.42 0.91 -3.51 3.25 4.71 0.14 -4.90 120.64 121.66 2xfi n GLU 177 Ca -0.14 -0.82 -0.03 0.00 -0.01 0.00 0.00 57.16 56.17 2xfi n GLU 177 Cb 0.55 -0.82 0.02 0.00 -1.01 0.00 0.00 31.44 30.18 2xfi n GLU 177 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2xfi n GLY 178 N -0.19 0.71 2.92 0.62 0.00 -1.14 -0.50 105.19 107.60 2xfi n GLY 178 Ca 0.00 -1.12 -0.12 0.00 0.00 0.00 0.00 46.02 44.78 2xfi n GLY 178 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2xfi s ILE 179 N -2.14 -0.01 -0.40 -0.61 2.07 0.53 -0.54 121.20 120.10 2xfi s ILE 179 Ca 0.19 0.03 -0.03 0.00 -1.41 0.00 0.00 60.65 59.44 2xfi s ILE 179 Cb -0.02 -0.10 0.11 0.00 0.13 0.00 0.00 42.46 42.57 2xfi s ILE 179 CO 0.05 0.01 0.19 -0.22 -1.91 0.00 0.00 174.94 173.06 2xfi s LEU 180 N 0.18 5.15 -0.40 8.50 2.96 0.94 -1.41 118.68 134.60 2xfi s LEU 180 Ca -0.01 -1.99 -0.29 0.00 -0.22 0.00 0.00 54.13 51.62 2xfi s LEU 180 Cb -0.02 -1.82 0.02 0.00 0.50 0.00 0.00 46.19 44.87 2xfi s LEU 180 CO -0.01 -0.52 1.24 -0.83 -1.32 0.00 0.00 176.35 174.91 2xfi s GLY 181 N 1.75 1.30 0.00 7.98 0.00 -0.53 -1.31 107.32 116.51 2xfi s GLY 181 Ca 0.08 -0.21 0.25 0.00 0.00 0.00 0.00 44.72 44.84 2xfi s GLY 181 CO -0.04 2.53 1.42 1.04 0.00 0.00 0.00 173.10 178.04 2xfi n LEU 182 N 7.92 2.63 0.00 0.66 4.77 0.19 -4.23 117.00 128.94 2xfi n LEU 182 Ca 0.14 -0.94 -0.11 0.00 -0.03 0.00 0.00 56.01 55.07 2xfi n LEU 182 Cb 0.48 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 41.60 2xfi n LEU 182 CO 0.68 0.47 0.33 0.00 -1.33 0.00 0.00 177.39 177.54 2xfi n ALA 183 N 1.03 -0.51 -2.15 -1.18 0.00 -0.16 -4.93 120.51 112.61 2xfi n ALA 183 Ca 0.16 -0.70 -0.26 0.00 0.00 0.00 0.00 53.44 52.64 2xfi n ALA 183 Cb 0.53 -0.01 0.02 0.00 0.00 0.00 0.00 19.45 19.99 2xfi n ALA 183 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2xfi s TYR 184 N -2.00 3.29 0.50 0.00 1.51 -0.58 -4.65 117.35 115.42 2xfi s TYR 184 Ca 0.29 0.60 0.18 0.00 -1.01 0.00 0.00 57.07 57.14 2xfi s TYR 184 Cb -0.01 -2.61 1.25 0.00 -0.11 0.00 0.00 41.96 40.49 2xfi s TYR 184 CO 0.20 -0.67 2.06 0.00 -1.11 0.00 0.00 175.55 176.04 2xfi h ALA 185 N -0.02 2.16 -0.85 3.71 0.00 -1.88 -2.62 119.26 119.76 2xfi h ALA 185 Ca -0.46 -0.01 0.25 0.00 0.00 0.00 0.00 54.91 54.69 2xfi h ALA 185 Cb 1.25 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 2xfi h ALA 185 CO 0.60 -0.24 0.65 1.49 0.00 0.00 0.00 179.25 181.76 2xfi h GLU 186 N 0.10 0.00 -0.41 0.00 4.81 -1.86 -0.09 114.58 117.12 2xfi h GLU 186 Ca 0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2xfi h GLU 186 Cb 0.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.82 2xfi h GLU 186 CO -0.01 0.00 0.00 0.44 -0.73 0.00 0.00 179.01 178.71 2xfi n ILE 187 N -4.13 1.01 -2.25 2.32 -5.35 -0.99 -4.69 119.36 105.29 2xfi n ILE 187 Ca 0.17 -1.01 -0.37 0.00 -0.27 0.00 0.00 62.75 61.28 2xfi n ILE 187 Cb 0.95 0.50 -0.01 0.00 -1.74 0.00 0.00 39.64 39.34 2xfi n ILE 187 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2xfi s ALA 188 N -1.01 2.98 -0.02 -1.28 0.00 -0.05 -4.61 121.76 117.77 2xfi s ALA 188 Ca 0.28 0.94 -0.00 0.00 0.00 0.00 0.00 51.96 53.17 2xfi s ALA 188 Cb 0.14 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 2xfi s ALA 188 CO 0.19 -0.66 0.06 1.03 0.00 0.00 0.00 175.76 176.37 2xfi s ARG 189 N -2.68 3.01 0.37 0.00 1.81 -1.26 -2.96 118.95 117.23 2xfi s ARG 189 Ca 0.63 -0.49 0.18 0.00 -1.72 0.00 0.00 55.73 54.34 2xfi s ARG 189 Cb -0.29 -2.82 0.67 0.00 -0.45 0.00 0.00 34.95 32.06 2xfi s ARG 189 CO 0.35 0.65 1.73 -1.35 -0.68 0.00 0.00 175.30 176.00 2xfi h PRO 190 N 4.31 0.00 0.00 3.54 0.11 -1.90 -3.47 132.00 134.59 2xfi h PRO 190 Ca -0.50 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2xfi h PRO 190 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2xfi h PRO 190 CO 0.60 0.38 0.27 -0.40 -0.21 0.00 0.00 178.00 178.64 2xfi n ASP 191 N -3.55 -1.96 0.00 -2.05 3.85 -1.16 -5.04 116.55 106.64 2xfi n ASP 191 Ca -0.00 -2.32 0.09 0.00 -0.71 0.00 0.00 54.79 51.84 2xfi n ASP 191 Cb 0.51 3.25 0.51 0.00 -1.35 0.00 0.00 41.12 44.05 2xfi n ASP 191 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 2xfi n ASP 192 N -1.44 0.00 -0.00 -1.12 5.68 -1.25 -2.22 116.55 116.20 2xfi n ASP 192 Ca -0.07 -0.54 0.14 0.00 -0.50 0.00 0.00 54.79 53.82 2xfi n ASP 192 Cb 0.52 -0.00 0.57 0.00 -1.14 0.00 0.00 41.12 41.06 2xfi n ASP 192 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2xfi n SER 193 N -1.00 0.09 -4.47 -1.12 3.41 -1.26 -4.61 113.62 104.65 2xfi n SER 193 Ca 0.13 0.34 -0.43 0.00 -0.26 0.00 0.00 58.87 58.66 2xfi n SER 193 Cb 0.06 -0.37 -0.03 0.00 -0.26 0.00 0.00 64.21 63.61 2xfi n SER 193 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2xfi s LEU 194 N -2.98 4.26 0.09 1.04 2.96 -0.94 -4.99 118.68 118.12 2xfi s LEU 194 Ca 0.14 -1.12 -0.31 0.00 -0.22 0.00 0.00 54.13 52.62 2xfi s LEU 194 Cb 0.19 -2.45 -0.11 0.00 0.50 0.00 0.00 46.19 44.33 2xfi s LEU 194 CO 0.55 -1.44 1.86 1.21 -1.32 0.00 0.00 176.35 177.21 2xfi n GLU 195 N 7.84 2.73 -1.31 1.98 2.13 -1.26 -4.88 120.64 127.86 2xfi n GLU 195 Ca 0.04 0.99 -0.31 0.00 0.66 0.00 0.00 57.16 58.54 2xfi n GLU 195 Cb 0.47 -2.89 0.09 0.00 0.27 0.00 0.00 31.44 29.38 2xfi n GLU 195 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 2xfi s PRO 196 N 3.11 2.25 0.17 5.31 0.02 -1.26 -4.56 135.00 140.04 2xfi s PRO 196 Ca 0.84 1.26 -0.15 0.00 0.02 0.00 0.00 61.00 62.97 2xfi s PRO 196 Cb -0.50 -1.89 0.13 0.00 0.02 0.00 0.00 34.50 32.26 2xfi s PRO 196 CO 0.40 -1.66 1.70 0.35 -0.33 0.00 0.00 177.00 177.46 2xfi h PHE 197 N -0.95 0.02 -0.51 6.54 3.57 -1.82 -2.24 116.94 121.56 2xfi h PHE 197 Ca -0.44 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.03 2xfi h PHE 197 Cb 1.24 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 40.01 2xfi h PHE 197 CO 0.56 -0.06 0.09 0.35 -2.23 0.00 0.00 178.31 177.02 2xfi h PHE 198 N 0.14 0.82 -0.77 0.41 3.57 -1.92 0.28 116.94 119.47 2xfi h PHE 198 Ca 0.21 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.63 2xfi h PHE 198 Cb 0.29 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 2xfi h PHE 198 CO -0.26 0.71 0.50 -0.44 -2.23 0.00 0.00 178.31 176.60 2xfi h ASP 199 N 0.76 0.89 -0.56 0.41 3.32 -1.83 -0.78 116.42 118.62 2xfi h ASP 199 Ca 0.16 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.11 2xfi h ASP 199 Cb 0.33 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 2xfi h ASP 199 CO 0.00 0.65 0.09 0.28 -1.72 0.00 0.00 179.24 178.54 2xfi h SER 200 N 1.05 0.90 -0.22 6.45 0.02 -0.75 -1.53 113.55 119.47 2xfi h SER 200 Ca 0.28 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2xfi h SER 200 Cb -0.11 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.18 2xfi h SER 200 CO -0.06 0.94 0.14 0.25 -1.14 0.00 0.00 176.83 176.96 2xfi h LEU 201 N 0.83 0.25 -0.50 5.07 5.85 -0.52 -0.86 115.31 125.43 2xfi h LEU 201 Ca 0.17 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 2xfi h LEU 201 Cb 0.42 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 2xfi h LEU 201 CO 0.01 0.19 0.12 0.58 -0.34 0.00 0.00 178.44 179.00 2xfi h VAL 202 N 0.29 1.24 -0.48 1.05 2.07 -1.03 -1.97 116.25 117.43 2xfi h VAL 202 Ca 0.08 -0.85 -0.07 0.00 0.82 0.00 0.00 66.70 66.68 2xfi h VAL 202 Cb -0.03 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2xfi h VAL 202 CO -0.02 0.31 0.02 0.11 0.02 0.00 0.00 177.57 178.01 2xfi h LYS 203 N 0.69 0.79 0.00 1.57 1.57 -0.98 -3.23 116.57 116.98 2xfi h LYS 203 Ca 0.16 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2xfi h LYS 203 Cb 0.33 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2xfi h LYS 203 CO 0.00 0.78 -1.01 1.04 -0.57 0.00 0.00 179.45 179.70 2xfi n GLN 204 N -4.23 0.31 -4.17 3.15 6.02 -0.35 -4.95 117.38 113.16 2xfi n GLN 204 Ca 0.03 0.01 -0.24 0.00 -0.01 0.00 0.00 57.00 56.79 2xfi n GLN 204 Cb 0.28 -1.61 -0.06 0.00 1.02 0.00 0.00 30.24 29.87 2xfi n GLN 204 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2xfi n THR 205 N -2.02 0.00 0.05 5.09 -2.24 -0.75 -5.04 114.28 109.37 2xfi n THR 205 Ca 0.02 -2.09 0.06 0.00 -2.27 0.00 0.00 64.05 59.76 2xfi n THR 205 Cb 0.45 0.66 0.24 0.00 -2.10 0.00 0.00 70.33 69.58 2xfi n THR 205 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2xfi n HIS 206 N -0.89 1.07 -2.00 4.78 8.25 -1.26 -4.79 115.22 120.38 2xfi n HIS 206 Ca -0.09 -0.41 -0.42 0.00 -0.26 0.00 0.00 57.72 56.54 2xfi n HIS 206 Cb 0.54 -0.22 -0.03 0.00 1.12 0.00 0.00 29.99 31.41 2xfi n HIS 206 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2xfi s VAL 207 N -1.82 3.03 0.68 1.59 1.01 -1.26 -4.96 120.40 118.66 2xfi s VAL 207 Ca 0.34 0.60 -0.17 0.00 0.00 0.00 0.00 61.98 62.76 2xfi s VAL 207 Cb 0.23 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 33.23 2xfi s VAL 207 CO 0.15 0.02 1.26 -2.84 0.00 0.00 0.00 175.10 173.69 2xfi s PRO 208 N 1.96 2.37 -1.46 2.72 0.02 -1.26 -4.73 135.00 134.63 2xfi s PRO 208 Ca 0.70 1.95 -0.12 0.00 0.02 0.00 0.00 61.00 63.55 2xfi s PRO 208 Cb -0.40 -1.84 0.04 0.00 0.02 0.00 0.00 34.50 32.32 2xfi s PRO 208 CO 0.31 -1.70 2.33 -1.71 -0.33 0.00 0.00 177.00 175.89 2xfi n ASN 209 N -2.23 5.15 -3.59 2.53 5.15 -1.26 -4.21 115.26 116.81 2xfi n ASN 209 Ca 0.15 -2.84 -0.15 0.00 -0.60 0.00 0.00 54.58 51.14 2xfi n ASN 209 Cb 0.49 -1.60 -0.07 0.00 -0.53 0.00 0.00 39.78 38.07 2xfi n ASN 209 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2xfi s LEU 210 N 1.29 -0.67 0.07 1.20 0.20 -1.26 -1.53 118.68 117.97 2xfi s LEU 210 Ca 0.51 1.08 -0.05 0.00 0.69 0.00 0.00 54.13 56.35 2xfi s LEU 210 Cb 0.14 2.41 -0.02 0.00 -0.43 0.00 0.00 46.19 48.29 2xfi s LEU 210 CO -0.07 -0.37 0.09 0.72 -0.29 0.00 0.00 176.35 176.43 2xfi s PHE 211 N -0.27 0.31 0.07 5.38 -0.71 -1.03 0.00 117.98 121.74 2xfi s PHE 211 Ca -0.04 -0.78 0.05 0.00 -1.04 0.00 0.00 56.93 55.12 2xfi s PHE 211 Cb -0.03 -0.20 -0.03 0.00 -1.21 0.00 0.00 43.02 41.55 2xfi s PHE 211 CO 0.04 -0.46 -0.14 -1.54 -1.34 0.00 0.00 175.22 171.78 2xfi s SER 212 N -2.82 1.62 -0.11 1.98 1.04 -0.18 0.08 113.70 115.32 2xfi s SER 212 Ca 0.05 -0.61 0.02 0.00 0.48 0.00 0.00 55.95 55.89 2xfi s SER 212 Cb 0.06 -0.04 0.01 0.00 0.10 0.00 0.00 66.02 66.14 2xfi s SER 212 CO -0.10 -0.09 -0.18 -0.76 0.98 0.00 0.00 173.24 173.10 2xfi s LEU 213 N -1.74 1.85 -0.38 2.42 1.43 0.41 -1.19 118.68 121.49 2xfi s LEU 213 Ca -0.02 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 2xfi s LEU 213 Cb -0.10 -1.18 0.11 0.00 0.03 0.00 0.00 46.19 45.05 2xfi s LEU 213 CO 0.02 0.06 0.14 -1.58 0.23 0.00 0.00 176.35 175.22 2xfi s GLN 214 N 0.79 1.77 -0.22 1.70 0.74 0.34 -1.40 119.66 123.39 2xfi s GLN 214 Ca -0.10 -1.86 -0.11 0.00 0.05 0.00 0.00 55.36 53.34 2xfi s GLN 214 Cb -0.16 -3.42 -0.05 0.00 1.10 0.00 0.00 33.01 30.49 2xfi s GLN 214 CO 0.01 -1.02 0.17 -0.51 -0.55 0.00 0.00 175.29 173.40 2xfi s LEU 215 N 1.02 4.16 0.00 3.68 1.43 -1.26 -0.70 118.68 127.01 2xfi s LEU 215 Ca 0.10 0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.40 2xfi s LEU 215 Cb -0.21 -2.14 0.00 0.00 0.03 0.00 0.00 46.19 43.87 2xfi s LEU 215 CO -0.06 0.10 0.00 0.00 0.23 0.00 0.00 176.35 176.63 2xfi n SER 230 N -1.02 0.00 -3.96 0.00 3.41 -1.26 -3.79 113.62 106.99 2xfi n SER 230 Ca 0.00 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.40 2xfi n SER 230 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 2xfi n SER 230 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2xfi s VAL 231 N 0.00 0.41 0.00 -3.33 -7.23 0.91 -4.90 120.40 106.26 2xfi s VAL 231 Ca 0.00 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 2xfi s VAL 231 Cb 0.00 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.47 2xfi s VAL 231 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 2xfi n GLY 232 N -0.70 2.94 0.00 2.32 0.00 -1.25 -2.13 105.19 106.37 2xfi n GLY 232 Ca -0.01 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.92 2xfi n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2xfi n GLY 233 N 0.00 -0.29 2.91 -0.02 0.00 -0.98 -0.90 105.19 105.91 2xfi n GLY 233 Ca 0.00 -1.31 -0.14 0.00 0.00 0.00 0.00 46.02 44.58 2xfi n GLY 233 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2xfi s SER 234 N -4.00 0.28 -0.25 1.61 0.01 0.12 -1.23 113.70 110.24 2xfi s SER 234 Ca 0.00 -0.04 -0.02 0.00 1.31 0.00 0.00 55.95 57.19 2xfi s SER 234 Cb 0.00 -0.04 0.02 0.00 0.21 0.00 0.00 66.02 66.22 2xfi s SER 234 CO 0.00 0.02 -0.04 -0.32 0.41 0.00 0.00 173.24 173.31 2xfi s MET 235 N -0.01 2.89 -0.32 12.44 1.75 -1.26 -0.50 119.30 134.28 2xfi s MET 235 Ca 0.00 -0.95 -0.10 0.00 -1.25 0.00 0.00 55.69 53.40 2xfi s MET 235 Cb -0.01 -3.04 -0.00 0.00 2.84 0.00 0.00 34.83 34.62 2xfi s MET 235 CO -0.00 -0.40 0.16 0.42 -0.65 0.00 0.00 175.02 174.55 2xfi s ILE 236 N 1.35 4.55 -0.15 10.11 -1.09 -0.33 -4.86 121.20 130.78 2xfi s ILE 236 Ca 0.01 -0.51 -0.13 0.00 -2.23 0.00 0.00 60.65 57.78 2xfi s ILE 236 Cb -0.17 -3.36 -0.05 0.00 -1.58 0.00 0.00 42.46 37.31 2xfi s ILE 236 CO -0.04 0.02 0.28 -0.63 -1.23 0.00 0.00 174.94 173.35 2xfi s ILE 237 N 1.60 5.30 0.00 2.92 1.01 -1.26 -1.01 121.20 129.76 2xfi s ILE 237 Ca 0.04 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.22 2xfi s ILE 237 Cb -0.17 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.68 2xfi s ILE 237 CO 0.06 0.42 0.00 0.61 0.00 0.00 0.00 174.94 176.03 2xfi n GLY 238 N 3.17 0.93 3.91 6.18 0.00 0.10 -4.83 105.19 114.65 2xfi n GLY 238 Ca -0.13 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.87 2xfi n GLY 238 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2xfi s GLY 239 N -1.65 0.11 -0.16 -0.02 0.00 -1.25 -4.36 107.32 99.99 2xfi s GLY 239 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 44.72 44.40 2xfi s GLY 239 CO 0.00 3.17 -0.17 -0.42 0.00 0.00 0.00 173.10 175.69 2xfi s ILE 240 N -2.07 2.46 -0.45 0.90 1.01 -1.26 -4.32 121.20 117.47 2xfi s ILE 240 Ca 0.24 -0.83 -0.16 0.00 0.00 0.00 0.00 60.65 59.91 2xfi s ILE 240 Cb -0.02 -2.04 0.05 0.00 0.01 0.00 0.00 42.46 40.46 2xfi s ILE 240 CO 0.05 0.52 0.37 -0.62 0.00 0.00 0.00 174.94 175.26 2xfi s ASP 241 N 1.00 6.14 0.58 3.58 3.68 -1.26 -4.96 116.67 125.43 2xfi s ASP 241 Ca -0.02 -1.12 0.36 0.00 2.13 0.00 0.00 52.55 53.90 2xfi s ASP 241 Cb -0.15 -2.18 1.66 0.00 -1.45 0.00 0.00 42.92 40.80 2xfi s ASP 241 CO -0.04 -0.58 2.09 0.45 0.13 0.00 0.00 175.17 177.22 2xfi h HIS 242 N 8.72 0.00 0.00 -5.34 3.86 -1.99 -1.49 115.15 118.91 2xfi h HIS 242 Ca -0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 2xfi h HIS 242 Cb 1.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.58 2xfi h HIS 242 CO 0.61 0.01 0.00 -1.13 0.86 0.00 0.00 177.93 178.28 2xfi n SER 243 N -3.12 0.33 -0.36 2.45 3.41 -1.26 -2.96 113.62 112.11 2xfi n SER 243 Ca -0.01 0.58 0.13 0.00 -0.26 0.00 0.00 58.87 59.31 2xfi n SER 243 Cb 0.24 -0.65 0.32 0.00 -0.26 0.00 0.00 64.21 63.86 2xfi n SER 243 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2xfi n LEU 244 N -1.86 1.36 -4.02 1.04 4.77 -0.56 -4.76 117.00 112.97 2xfi n LEU 244 Ca 0.03 -0.42 -0.09 0.00 -0.03 0.00 0.00 56.01 55.50 2xfi n LEU 244 Cb 0.21 -0.08 -0.08 0.00 -2.33 0.00 0.00 43.42 41.14 2xfi n LEU 244 CO 0.17 0.25 -0.16 -0.72 -1.33 0.00 0.00 177.39 175.60 2xfi s TYR 245 N -2.40 0.53 0.28 -1.77 1.13 -1.16 -1.23 117.35 112.73 2xfi s TYR 245 Ca 0.26 -0.92 0.09 0.00 -1.41 0.00 0.00 57.07 55.09 2xfi s TYR 245 Cb 0.19 -0.23 -0.05 0.00 -1.10 0.00 0.00 41.96 40.77 2xfi s TYR 245 CO 0.49 -0.59 -0.14 0.95 -2.51 0.00 0.00 175.55 173.75 2xfi s THR 246 N -3.97 2.08 0.00 -3.49 -4.23 -0.37 -4.79 115.64 100.87 2xfi s THR 246 Ca 0.17 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 2xfi s THR 246 Cb 0.05 -2.35 0.00 0.00 1.34 0.00 0.00 72.50 71.55 2xfi s THR 246 CO -0.02 -0.38 0.00 0.61 -0.54 0.00 0.00 174.62 174.29 2xfi n GLY 247 N -0.59 0.27 3.88 3.99 0.00 -1.26 -3.80 105.19 107.68 2xfi n GLY 247 Ca -0.06 -0.91 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 2xfi n GLY 247 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2xfi s SER 248 N -4.00 6.57 -0.12 1.61 0.01 -1.26 -4.97 113.70 111.54 2xfi s SER 248 Ca 0.00 0.70 -0.23 0.00 1.31 0.00 0.00 55.95 57.72 2xfi s SER 248 Cb 0.00 -2.14 -0.03 0.00 0.21 0.00 0.00 66.02 64.06 2xfi s SER 248 CO 0.00 0.13 0.73 -0.76 0.41 0.00 0.00 173.24 173.74 2xfi s LEU 249 N -2.21 4.24 -0.10 2.44 1.43 -1.26 -4.48 118.68 118.74 2xfi s LEU 249 Ca 0.36 1.12 -0.00 0.00 -1.03 0.00 0.00 54.13 54.57 2xfi s LEU 249 Cb -0.13 -3.09 -0.03 0.00 0.03 0.00 0.00 46.19 42.97 2xfi s LEU 249 CO 0.20 -0.23 -0.08 0.26 0.23 0.00 0.00 176.35 176.74 2xfi s TRP 250 N 1.40 2.91 -0.06 0.29 0.52 -0.28 -4.91 118.94 118.81 2xfi s TRP 250 Ca 0.36 -0.23 0.02 0.00 0.02 0.00 0.00 56.10 56.27 2xfi s TRP 250 Cb -0.17 -1.80 -0.03 0.00 -1.15 0.00 0.00 33.47 30.32 2xfi s TRP 250 CO 0.15 0.10 -0.10 0.71 0.02 0.00 0.00 176.95 177.83 2xfi s TYR 251 N -0.22 2.85 -0.03 -1.98 1.51 -1.26 -0.23 117.35 118.00 2xfi s TYR 251 Ca 0.02 -0.06 0.07 0.00 -1.01 0.00 0.00 57.07 56.10 2xfi s TYR 251 Cb -0.13 -1.69 -0.02 0.00 -0.11 0.00 0.00 41.96 40.02 2xfi s TYR 251 CO 0.03 0.26 -0.25 -0.08 -1.11 0.00 0.00 175.55 174.40 2xfi s THR 252 N -0.74 2.01 0.38 -0.71 -1.32 0.03 -3.87 115.64 111.42 2xfi s THR 252 Ca 0.11 -1.08 -0.26 0.00 -1.21 0.00 0.00 61.69 59.25 2xfi s THR 252 Cb -0.11 -1.67 -0.09 0.00 -1.51 0.00 0.00 72.50 69.12 2xfi s THR 252 CO 0.01 0.57 1.17 -2.84 -2.21 0.00 0.00 174.62 171.32 2xfi s PRO 253 N -0.50 4.16 -0.28 7.08 0.02 -1.26 -0.60 135.00 143.62 2xfi s PRO 253 Ca 0.07 1.87 -0.29 0.00 0.02 0.00 0.00 61.00 62.67 2xfi s PRO 253 Cb -0.11 -2.78 0.00 0.00 0.02 0.00 0.00 34.50 31.64 2xfi s PRO 253 CO -0.00 -0.23 1.25 0.42 -0.33 0.00 0.00 177.00 178.11 2xfi s ILE 254 N -1.36 4.24 0.24 2.83 1.01 -0.15 -4.59 121.20 123.41 2xfi s ILE 254 Ca 0.55 1.42 0.09 0.00 0.00 0.00 0.00 60.65 62.71 2xfi s ILE 254 Cb -0.32 -4.18 -0.06 0.00 0.01 0.00 0.00 42.46 37.91 2xfi s ILE 254 CO 0.40 -0.42 1.54 -0.09 0.00 0.00 0.00 174.94 176.38 2xfi h ARG 255 N 8.87 0.02 -2.15 2.79 2.43 -1.39 -3.45 114.38 121.50 2xfi h ARG 255 Ca -0.25 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 58.85 2xfi h ARG 255 Cb 1.09 0.00 -0.22 0.00 -0.42 0.00 0.00 29.97 30.43 2xfi h ARG 255 CO 1.02 0.71 0.03 0.50 -1.51 0.00 0.00 179.97 180.72 2xfi s ARG 256 N -3.45 0.74 -1.04 0.20 3.52 -1.26 -5.08 118.95 112.58 2xfi s ARG 256 Ca -0.01 0.95 -0.17 0.00 -0.13 0.00 0.00 55.73 56.37 2xfi s ARG 256 Cb 0.12 0.32 0.14 0.00 -1.56 0.00 0.00 34.95 33.97 2xfi s ARG 256 CO 0.78 -0.10 1.27 -1.21 -0.81 0.00 0.00 175.30 175.23 2xfi s GLU 257 N 0.59 3.78 0.00 5.12 2.02 -1.26 -3.96 118.70 124.99 2xfi s GLU 257 Ca -0.02 -2.01 0.00 0.00 0.02 0.00 0.00 54.97 52.96 2xfi s GLU 257 Cb -0.05 -5.01 0.00 0.00 0.10 0.00 0.00 34.13 29.17 2xfi s GLU 257 CO -0.03 -1.81 0.00 -2.67 0.02 0.00 0.00 175.26 170.77 2xfi n TRP 258 N 6.44 0.00 -0.96 1.61 4.27 -1.26 -4.61 117.44 122.94 2xfi n TRP 258 Ca 0.30 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.62 2xfi n TRP 258 Cb 0.47 0.00 0.22 0.00 -1.36 0.00 0.00 31.31 30.64 2xfi n TRP 258 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 2xfi s TYR 259 N 0.00 1.16 -1.26 -2.67 2.02 -1.26 -1.52 117.35 113.81 2xfi s TYR 259 Ca 0.00 0.80 -0.18 0.00 -0.37 0.00 0.00 57.07 57.32 2xfi s TYR 259 Cb 0.00 -3.27 0.08 0.00 -0.40 0.00 0.00 41.96 38.38 2xfi s TYR 259 CO 0.00 -3.63 1.66 0.71 -1.57 0.00 0.00 175.55 172.72 2xfi s TYR 260 N -2.83 2.87 -0.03 2.71 1.51 -1.26 -4.83 117.35 115.49 2xfi s TYR 260 Ca 0.68 -1.63 -0.26 0.00 -1.01 0.00 0.00 57.07 54.85 2xfi s TYR 260 Cb -0.16 -4.68 -0.04 0.00 -0.11 0.00 0.00 41.96 36.97 2xfi s TYR 260 CO 0.58 -1.76 0.81 -2.00 -1.11 0.00 0.00 175.55 172.08 2xfi s GLU 261 N 3.88 4.49 0.40 -0.62 2.12 -1.25 -1.84 118.70 125.89 2xfi s GLU 261 Ca 0.51 1.10 0.03 0.00 0.36 0.00 0.00 54.97 56.98 2xfi s GLU 261 Cb 0.03 -3.44 -0.03 0.00 0.26 0.00 0.00 34.13 30.94 2xfi s GLU 261 CO 0.05 0.05 0.10 0.14 -0.54 0.00 0.00 175.26 175.06 2xfi s VAL 262 N 0.76 0.81 -0.14 3.70 -7.23 -0.03 -1.00 120.40 117.27 2xfi s VAL 262 Ca 0.43 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.61 2xfi s VAL 262 Cb -0.19 -2.43 0.02 0.00 0.56 0.00 0.00 36.38 34.34 2xfi s VAL 262 CO 0.22 0.00 -0.16 -0.63 -0.31 0.00 0.00 175.10 174.23 2xfi s ILE 263 N -3.18 1.66 -0.16 -0.62 -1.09 -1.26 -3.98 121.20 112.56 2xfi s ILE 263 Ca 0.24 -0.70 -0.19 0.00 -2.23 0.00 0.00 60.65 57.77 2xfi s ILE 263 Cb 0.04 -1.53 -0.04 0.00 -1.58 0.00 0.00 42.46 39.36 2xfi s ILE 263 CO 0.13 0.47 0.51 -0.63 -1.23 0.00 0.00 174.94 174.20 2xfi s ILE 264 N 1.28 5.14 -0.24 2.92 1.01 -1.26 -0.96 121.20 129.08 2xfi s ILE 264 Ca 0.01 0.99 0.18 0.00 0.00 0.00 0.00 60.65 61.82 2xfi s ILE 264 Cb -0.14 -3.84 -0.25 0.00 0.01 0.00 0.00 42.46 38.24 2xfi s ILE 264 CO -0.08 0.24 0.48 1.33 0.00 0.00 0.00 174.94 176.92 2xfi n VAL 265 N 4.12 0.00 -3.60 2.92 0.24 0.18 -4.73 118.33 117.46 2xfi n VAL 265 Ca -0.05 -0.32 -0.13 0.00 -2.04 0.00 0.00 64.34 61.79 2xfi n VAL 265 Cb 0.51 0.34 -0.07 0.00 -1.47 0.00 0.00 33.84 33.16 2xfi n VAL 265 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2xfi s ARG 266 N -3.06 0.78 -0.05 7.34 3.52 -1.23 -4.75 118.95 121.50 2xfi s ARG 266 Ca -0.03 0.63 0.02 0.00 -0.13 0.00 0.00 55.73 56.21 2xfi s ARG 266 Cb 0.12 0.38 0.02 0.00 -1.56 0.00 0.00 34.95 33.90 2xfi s ARG 266 CO 0.73 -0.16 -0.08 0.08 -0.81 0.00 0.00 175.30 175.06 2xfi s VAL 267 N -0.21 0.82 0.08 7.11 1.01 -1.26 -0.76 120.40 127.18 2xfi s VAL 267 Ca -0.02 -0.29 0.08 0.00 0.00 0.00 0.00 61.98 61.75 2xfi s VAL 267 Cb -0.03 -0.78 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 2xfi s VAL 267 CO 0.02 0.29 -0.21 -1.61 0.00 0.00 0.00 175.10 173.58 2xfi s GLU 268 N 0.80 1.25 -0.15 2.72 2.02 -0.52 -1.50 118.70 123.32 2xfi s GLU 268 Ca -0.13 -1.10 0.01 0.00 0.02 0.00 0.00 54.97 53.77 2xfi s GLU 268 Cb -0.15 -1.48 0.02 0.00 0.10 0.00 0.00 34.13 32.62 2xfi s GLU 268 CO 0.02 0.36 -0.16 0.42 0.02 0.00 0.00 175.26 175.92 2xfi s ILE 269 N -1.02 1.67 -1.52 -1.63 -1.09 -0.37 -0.67 121.20 116.57 2xfi s ILE 269 Ca 0.07 -0.71 -0.01 0.00 -2.23 0.00 0.00 60.65 57.77 2xfi s ILE 269 Cb -0.10 -1.55 0.01 0.00 -1.58 0.00 0.00 42.46 39.25 2xfi s ILE 269 CO 0.03 0.48 0.04 0.59 -1.23 0.00 0.00 174.94 174.85 2xfi n ASN 270 N 4.63 0.76 0.00 3.58 4.13 0.32 -1.35 115.26 127.33 2xfi n ASN 270 Ca -0.18 -1.24 0.00 0.00 1.68 0.00 0.00 54.58 54.84 2xfi n ASN 270 Cb 0.50 -1.54 0.00 0.00 -1.54 0.00 0.00 39.78 37.21 2xfi n ASN 270 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2xfi n GLY 271 N -2.44 2.62 3.60 7.41 0.00 -1.26 -4.99 105.19 110.13 2xfi n GLY 271 Ca -0.29 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.33 2xfi n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2xfi s GLN 272 N -0.02 3.94 0.27 1.61 -1.52 -0.46 -4.98 119.66 118.51 2xfi s GLN 272 Ca 0.00 0.12 -0.30 0.00 -1.95 0.00 0.00 55.36 53.23 2xfi s GLN 272 Cb 0.00 -3.69 -0.12 0.00 -0.22 0.00 0.00 33.01 28.98 2xfi s GLN 272 CO 0.00 -0.40 1.56 -3.47 -0.25 0.00 0.00 175.29 172.73 2xfi n ASP 273 N 5.53 3.59 0.24 5.90 2.03 -1.26 -1.24 116.55 131.34 2xfi n ASP 273 Ca -0.05 1.14 0.16 0.00 0.52 0.00 0.00 54.79 56.55 2xfi n ASP 273 Cb 0.50 -1.55 0.67 0.00 -0.72 0.00 0.00 41.12 40.02 2xfi n ASP 273 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2xfi h LEU 274 N 4.78 0.00 -1.82 -2.67 3.38 -1.65 -3.48 115.31 113.86 2xfi h LEU 274 Ca -0.46 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.20 2xfi h LEU 274 Cb 1.24 0.00 0.18 0.00 0.09 0.00 0.00 40.66 42.16 2xfi h LEU 274 CO 0.80 0.00 -0.79 0.29 0.09 0.00 0.00 178.44 178.83 2xfi n LYS 275 N -2.82 -5.69 -4.36 1.13 5.02 -1.26 -5.02 118.16 105.15 2xfi n LYS 275 Ca 0.01 0.85 -0.27 0.00 -2.02 0.00 0.00 58.31 56.88 2xfi n LYS 275 Cb 0.26 -5.85 -0.11 0.00 -0.02 0.00 0.00 35.03 29.31 2xfi n LYS 275 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2xfi s MET 276 N -5.15 1.76 0.11 1.97 -1.94 -1.26 -5.09 119.30 109.70 2xfi s MET 276 Ca 0.10 -1.41 -0.35 0.00 -1.71 0.00 0.00 55.69 52.31 2xfi s MET 276 Cb -0.01 -1.99 -0.14 0.00 2.01 0.00 0.00 34.83 34.70 2xfi s MET 276 CO 0.73 0.41 1.55 -3.47 -0.01 0.00 0.00 175.02 174.23 2xfi n ASP 277 N 0.16 2.73 0.31 3.03 -0.08 -1.26 -4.83 116.55 116.61 2xfi n ASP 277 Ca -0.12 1.08 0.20 0.00 -1.51 0.00 0.00 54.79 54.45 2xfi n ASP 277 Cb 0.56 -1.35 0.98 0.00 2.34 0.00 0.00 41.12 43.64 2xfi n ASP 277 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2xfi h LYS 279 N 0.00 0.00 -0.25 0.00 1.57 -1.86 -2.19 116.57 113.85 2xfi h LYS 279 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2xfi h LYS 279 Cb 0.23 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2xfi h LYS 279 CO 0.00 0.01 0.04 0.93 -0.57 0.00 0.00 179.45 179.86 2xfi h GLU 280 N 0.00 0.36 0.00 3.15 4.39 -1.40 -1.81 114.58 119.26 2xfi h GLU 280 Ca -0.00 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.65 2xfi h GLU 280 Cb 0.03 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 2xfi h GLU 280 CO 0.00 0.35 0.00 1.88 -1.16 0.00 0.00 179.01 180.09 2xfi h TYR 281 N 0.36 0.00 0.00 4.33 0.99 -1.55 -3.11 116.97 117.98 2xfi h TYR 281 Ca 0.09 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 2xfi h TYR 281 Cb 0.18 0.00 -0.03 0.00 1.00 0.00 0.00 36.73 37.87 2xfi h TYR 281 CO 0.00 0.00 -0.35 0.09 -0.00 0.00 0.00 178.16 177.91 2xfi n ASN 282 N -2.91 1.78 -4.56 3.88 3.02 -0.71 -4.49 115.26 111.28 2xfi n ASN 282 Ca 0.00 -3.29 -0.43 0.00 -0.03 0.00 0.00 54.58 50.83 2xfi n ASN 282 Cb 0.25 -0.45 -0.06 0.00 -0.61 0.00 0.00 39.78 38.91 2xfi n ASN 282 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2xfi s TYR 283 N -2.60 3.06 -2.30 3.10 6.04 -1.02 -1.32 117.35 122.32 2xfi s TYR 283 Ca 0.33 0.29 0.19 0.00 0.04 0.00 0.00 57.07 57.91 2xfi s TYR 283 Cb 0.31 -3.47 0.17 0.00 -1.04 0.00 0.00 41.96 37.93 2xfi s TYR 283 CO -0.03 -0.84 1.12 -0.40 -1.54 0.00 0.00 175.55 173.85 2xfi n ASP 284 N 6.48 2.64 -3.72 4.32 5.75 -1.26 -3.45 116.55 127.30 2xfi n ASP 284 Ca 0.02 -1.80 -0.07 0.00 -0.01 0.00 0.00 54.79 52.93 2xfi n ASP 284 Cb 0.48 -0.03 -0.02 0.00 -1.03 0.00 0.00 41.12 40.53 2xfi n ASP 284 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2xfi s LYS 285 N -1.53 1.46 -0.05 0.11 -2.85 -0.43 -4.72 119.74 111.73 2xfi s LYS 285 Ca 0.23 -0.75 0.03 0.00 -1.00 0.00 0.00 55.97 54.48 2xfi s LYS 285 Cb 0.16 0.53 0.01 0.00 -2.06 0.00 0.00 37.83 36.47 2xfi s LYS 285 CO 0.24 -0.66 -0.14 -1.12 0.10 0.00 0.00 175.35 173.76 2xfi s SER 286 N -2.86 1.88 0.09 0.03 0.01 -1.26 -1.20 113.70 110.41 2xfi s SER 286 Ca 0.09 -0.31 0.04 0.00 1.31 0.00 0.00 55.95 57.08 2xfi s SER 286 Cb -0.03 -0.69 -0.04 0.00 0.21 0.00 0.00 66.02 65.47 2xfi s SER 286 CO 0.01 0.09 -0.10 0.27 0.41 0.00 0.00 173.24 173.91 2xfi s ILE 287 N 0.36 0.95 -0.29 1.44 -4.36 -0.70 -0.85 121.20 117.75 2xfi s ILE 287 Ca -0.09 -1.60 -0.09 0.00 -0.26 0.00 0.00 60.65 58.60 2xfi s ILE 287 Cb -0.13 -1.32 -0.02 0.00 1.25 0.00 0.00 42.46 42.24 2xfi s ILE 287 CO 0.03 -0.53 0.13 -0.69 0.24 0.00 0.00 174.94 174.12 2xfi s VAL 288 N -2.32 4.58 -0.33 8.37 1.01 -0.76 -0.15 120.40 130.80 2xfi s VAL 288 Ca 0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 61.98 61.72 2xfi s VAL 288 Cb -0.04 -3.27 0.12 0.00 0.00 0.00 0.00 36.38 33.20 2xfi s VAL 288 CO 0.00 0.16 0.17 -0.62 0.00 0.00 0.00 175.10 174.82 2xfi s ASP 289 N 1.63 3.33 0.46 3.32 -1.08 -0.28 -4.42 116.67 119.62 2xfi s ASP 289 Ca 0.05 -1.85 0.31 0.00 -0.52 0.00 0.00 52.55 50.55 2xfi s ASP 289 Cb -0.16 -0.47 1.52 0.00 -1.46 0.00 0.00 42.92 42.34 2xfi s ASP 289 CO 0.06 -0.36 1.95 0.77 0.52 0.00 0.00 175.17 178.10 2xfi h SER 290 N 7.59 0.00 0.39 -0.34 4.64 -1.85 -2.75 113.55 121.23 2xfi h SER 290 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2xfi h SER 290 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 2xfi h SER 290 CO 0.36 0.00 -0.18 0.61 -0.87 0.00 0.00 176.83 176.75 2xfi n GLY 291 N -0.61 -0.93 3.53 -0.77 0.00 -1.26 -4.54 105.19 100.61 2xfi n GLY 291 Ca -0.01 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 2xfi n GLY 291 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2xfi s THR 292 N -2.58 3.89 -0.01 2.61 2.01 -1.04 -4.94 115.64 115.58 2xfi s THR 292 Ca 0.25 -0.37 -0.25 0.00 0.31 0.00 0.00 61.69 61.62 2xfi s THR 292 Cb 0.19 -2.67 -0.19 0.00 0.01 0.00 0.00 72.50 69.84 2xfi s THR 292 CO 0.52 0.52 1.30 0.74 -0.69 0.00 0.00 174.62 177.01 2xfi h THR 293 N 4.89 1.29 -3.51 -0.82 2.02 -1.87 0.16 112.91 115.07 2xfi h THR 293 Ca -0.36 -1.00 -0.47 0.00 0.77 0.00 0.00 66.41 65.35 2xfi h THR 293 Cb 1.19 1.95 0.06 0.00 -1.74 0.00 0.00 68.15 69.61 2xfi h THR 293 CO 0.60 0.25 0.14 0.20 0.37 0.00 0.00 175.52 177.08 2xfi s ASN 294 N -5.60 5.50 -0.34 4.18 -0.87 -1.26 -1.43 114.94 115.12 2xfi s ASN 294 Ca -0.15 0.59 -0.29 0.00 -1.57 0.00 0.00 52.86 51.44 2xfi s ASN 294 Cb 0.02 -1.56 0.02 0.00 -0.02 0.00 0.00 41.25 39.71 2xfi s ASN 294 CO 0.66 -1.10 1.08 -0.22 -2.57 0.00 0.00 177.10 174.95 2xfi s LEU 295 N -4.96 3.90 -0.10 0.60 2.96 -0.74 -2.09 118.68 118.24 2xfi s LEU 295 Ca 0.54 0.96 -0.02 0.00 -0.22 0.00 0.00 54.13 55.40 2xfi s LEU 295 Cb -0.10 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.02 2xfi s LEU 295 CO 0.44 -0.92 -0.03 -0.13 -1.32 0.00 0.00 176.35 174.38 2xfi s ARG 296 N 3.74 3.15 0.04 1.98 0.52 0.07 -1.48 118.95 126.97 2xfi s ARG 296 Ca 0.45 -0.49 0.06 0.00 -0.52 0.00 0.00 55.73 55.24 2xfi s ARG 296 Cb -0.12 -2.78 -0.02 0.00 0.52 0.00 0.00 34.95 32.56 2xfi s ARG 296 CO 0.17 0.53 -0.18 -0.51 0.02 0.00 0.00 175.30 175.34 2xfi s LEU 297 N -0.43 2.16 0.34 2.53 1.43 -0.03 -0.87 118.68 123.82 2xfi s LEU 297 Ca 0.07 -0.48 -0.27 0.00 -1.03 0.00 0.00 54.13 52.42 2xfi s LEU 297 Cb -0.12 -0.81 -0.13 0.00 0.03 0.00 0.00 46.19 45.16 2xfi s LEU 297 CO 0.02 0.11 1.09 -2.65 0.23 0.00 0.00 176.35 175.15 2xfi n PRO 298 N 1.91 1.58 -0.31 1.29 -0.02 -1.26 -0.55 135.00 137.63 2xfi n PRO 298 Ca -0.17 0.56 -0.02 0.00 -2.02 0.00 0.00 63.50 61.84 2xfi n PRO 298 Cb 0.54 -2.04 0.01 0.00 -0.02 0.00 0.00 33.50 32.00 2xfi n PRO 298 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2xfi n LYS 299 N 0.52 -0.22 -0.31 -0.52 4.81 -1.14 -0.19 118.16 121.11 2xfi n LYS 299 Ca 0.08 1.23 -0.03 0.00 -0.87 0.00 0.00 58.31 58.72 2xfi n LYS 299 Cb 0.35 -1.83 0.09 0.00 0.02 0.00 0.00 35.03 33.66 2xfi n LYS 299 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 2xfi h LYS 300 N 0.00 1.08 -0.21 1.64 3.64 -1.93 0.10 116.57 120.90 2xfi h LYS 300 Ca 0.26 -0.07 -0.13 0.00 -1.27 0.00 0.00 60.65 59.43 2xfi h LYS 300 Cb 0.46 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2xfi h LYS 300 CO -0.79 0.72 -0.40 0.28 -2.27 0.00 0.00 179.45 176.99 2xfi h VAL 301 N 1.12 1.32 -0.06 2.00 2.07 -1.29 -2.52 116.25 118.89 2xfi h VAL 301 Ca 0.32 -1.62 0.01 0.00 0.82 0.00 0.00 66.70 66.23 2xfi h VAL 301 Cb -0.08 1.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 2xfi h VAL 301 CO -0.08 0.50 -0.01 0.15 0.02 0.00 0.00 177.57 178.15 2xfi h PHE 302 N 0.32 -0.03 -0.79 1.57 3.57 -0.03 0.18 116.94 121.73 2xfi h PHE 302 Ca 0.01 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2xfi h PHE 302 Cb 1.00 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.72 2xfi h PHE 302 CO 0.09 -0.02 0.45 0.93 -2.23 0.00 0.00 178.31 177.52 2xfi h GLU 303 N 0.00 1.08 -0.58 1.11 4.39 -0.85 0.15 114.58 119.89 2xfi h GLU 303 Ca 0.03 -0.12 -0.07 0.00 0.34 0.00 0.00 59.36 59.54 2xfi h GLU 303 Cb 0.04 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 2xfi h GLU 303 CO -0.06 0.79 0.08 0.00 -1.16 0.00 0.00 179.01 178.66 2xfi h ALA 304 N 1.24 0.77 -0.25 3.43 0.00 -1.19 -1.96 119.26 121.28 2xfi h ALA 304 Ca 0.28 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2xfi h ALA 304 Cb 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2xfi h ALA 304 CO -0.05 0.53 0.08 0.00 0.00 0.00 0.00 179.25 179.81 2xfi h ALA 305 N 1.00 0.33 -0.75 0.00 0.00 -0.45 -2.31 119.26 117.08 2xfi h ALA 305 Ca 0.17 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2xfi h ALA 305 Cb 0.43 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2xfi h ALA 305 CO 0.01 -0.04 0.48 0.28 0.00 0.00 0.00 179.25 179.99 2xfi h VAL 306 N 0.24 1.13 -0.87 0.00 2.07 -0.90 -0.09 116.25 117.83 2xfi h VAL 306 Ca 0.08 -0.33 0.03 0.00 0.82 0.00 0.00 66.70 67.30 2xfi h VAL 306 Cb 0.24 0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.05 2xfi h VAL 306 CO -0.00 0.17 0.56 0.11 0.02 0.00 0.00 177.57 178.44 2xfi h LYS 307 N 0.96 1.07 -0.19 1.57 1.57 -1.19 0.72 116.57 121.07 2xfi h LYS 307 Ca 0.29 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 58.82 2xfi h LYS 307 Cb -0.02 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.04 2xfi h LYS 307 CO -0.10 0.71 -0.64 1.03 -0.57 0.00 0.00 179.45 179.89 2xfi h SER 308 N 1.11 0.80 -0.34 0.86 0.87 -0.81 -1.41 113.55 114.64 2xfi h SER 308 Ca 0.34 -0.47 -0.09 0.00 -1.23 0.00 0.00 61.79 60.34 2xfi h SER 308 Cb -0.02 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 2xfi h SER 308 CO -0.11 1.24 -0.15 0.40 -0.53 0.00 0.00 176.83 177.69 2xfi h ILE 309 N 0.52 1.29 -0.46 2.23 2.04 -0.80 -1.67 117.51 120.65 2xfi h ILE 309 Ca -0.01 -1.25 0.07 0.00 1.00 0.00 0.00 64.86 64.66 2xfi h ILE 309 Cb 1.23 1.39 -0.06 0.00 -0.74 0.00 0.00 36.82 38.64 2xfi h ILE 309 CO 0.13 0.41 0.14 0.11 0.00 0.00 0.00 178.15 178.93 2xfi h LYS 310 N 0.47 0.29 -0.42 2.37 1.57 -0.81 -1.23 116.57 118.80 2xfi h LYS 310 Ca 0.08 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.86 2xfi h LYS 310 Cb 0.67 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.89 2xfi h LYS 310 CO 0.05 0.19 0.24 0.00 -0.57 0.00 0.00 179.45 179.35 2xfi h ALA 311 N 1.32 0.53 -0.71 3.86 0.00 -1.11 -1.77 119.26 121.38 2xfi h ALA 311 Ca 0.22 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 2xfi h ALA 311 Cb 0.25 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2xfi h ALA 311 CO -0.25 -0.10 0.31 0.00 0.00 0.00 0.00 179.25 179.22 2xfi h ALA 312 N 1.20 1.21 -0.54 0.00 0.00 -0.95 -3.00 119.26 117.18 2xfi h ALA 312 Ca 0.17 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2xfi h ALA 312 Cb 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2xfi h ALA 312 CO -0.09 0.59 0.00 -1.13 0.00 0.00 0.00 179.25 178.62 2xfi n SER 313 N -4.31 5.15 0.02 0.00 3.41 -0.50 -4.69 113.62 112.71 2xfi n SER 313 Ca 0.07 -2.76 0.07 0.00 -0.26 0.00 0.00 58.87 55.98 2xfi n SER 313 Cb 0.16 -0.65 0.31 0.00 -0.26 0.00 0.00 64.21 63.77 2xfi n SER 313 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2xfi n SER 314 N 0.66 0.11 0.30 4.04 3.41 -0.69 -1.61 113.62 119.85 2xfi n SER 314 Ca 0.25 0.53 0.18 0.00 -0.26 0.00 0.00 58.87 59.57 2xfi n SER 314 Cb 1.06 -0.55 0.96 0.00 -0.26 0.00 0.00 64.21 65.42 2xfi n SER 314 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2xfi h THR 315 N 0.00 0.21 -4.23 6.66 1.03 -1.87 -3.40 112.91 111.31 2xfi h THR 315 Ca 0.00 -0.23 -0.59 0.00 -0.01 0.00 0.00 66.41 65.59 2xfi h THR 315 Cb 0.24 1.18 -0.27 0.00 -1.07 0.00 0.00 68.15 68.23 2xfi h THR 315 CO 0.00 0.03 -0.84 -1.61 -0.01 0.00 0.00 175.52 173.08 2xfi s GLU 316 N -4.14 1.46 -0.11 0.00 2.02 -0.63 -5.14 118.70 112.16 2xfi s GLU 316 Ca -0.03 -0.90 -0.00 0.00 0.02 0.00 0.00 54.97 54.06 2xfi s GLU 316 Cb 0.13 -1.54 -0.02 0.00 0.10 0.00 0.00 34.13 32.79 2xfi s GLU 316 CO 0.50 0.40 -0.10 0.15 0.02 0.00 0.00 175.26 176.22 2xfi s LYS 317 N -1.02 3.22 0.20 1.61 -0.14 -1.26 -4.92 119.74 117.42 2xfi s LYS 317 Ca 0.08 -0.63 0.11 0.00 -1.36 0.00 0.00 55.97 54.17 2xfi s LYS 317 Cb -0.09 -2.65 -0.04 0.00 -1.68 0.00 0.00 37.83 33.37 2xfi s LYS 317 CO 0.01 0.35 -0.22 -0.06 -0.76 0.00 0.00 175.35 174.67 2xfi s PHE 318 N 0.01 2.35 0.64 3.18 0.40 -1.26 -5.12 117.98 118.18 2xfi s PHE 318 Ca -0.03 -0.34 -0.17 0.00 -0.60 0.00 0.00 56.93 55.80 2xfi s PHE 318 Cb -0.14 -1.15 -0.01 0.00 0.51 0.00 0.00 43.02 42.22 2xfi s PHE 318 CO 0.04 0.51 1.16 -1.25 0.70 0.00 0.00 175.22 176.38 2xfi s PRO 319 N -2.73 2.79 0.34 0.24 0.04 -1.26 -4.89 135.00 129.53 2xfi s PRO 319 Ca 0.22 1.64 0.10 0.00 0.04 0.00 0.00 61.00 62.99 2xfi s PRO 319 Cb -0.08 -1.93 0.85 0.00 0.04 0.00 0.00 34.50 33.38 2xfi s PRO 319 CO 0.11 -1.30 1.80 -0.44 0.04 0.00 0.00 177.00 177.20 2xfi h ASP 320 N 0.41 0.67 -0.54 6.66 3.32 -2.01 -0.91 116.42 124.01 2xfi h ASP 320 Ca -0.49 0.08 0.09 0.00 0.02 0.00 0.00 57.03 56.74 2xfi h ASP 320 Cb 1.28 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.75 2xfi h ASP 320 CO 0.54 0.24 0.37 1.23 -1.72 0.00 0.00 179.24 179.89 2xfi h GLY 321 N 0.65 0.48 0.92 2.75 0.00 -1.96 -1.95 103.07 103.97 2xfi h GLY 321 Ca 0.55 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.73 2xfi h GLY 321 CO -0.32 0.09 0.11 -2.75 0.00 0.00 0.00 176.54 173.66 2xfi h PHE 322 N 0.35 0.31 0.00 5.60 3.57 -1.35 -0.78 116.94 124.64 2xfi h PHE 322 Ca 0.25 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.73 2xfi h PHE 322 Cb 0.53 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.17 2xfi h PHE 322 CO -0.00 0.31 -0.05 -1.49 -2.23 0.00 0.00 178.31 174.85 2xfi h TRP 323 N 0.22 0.00 -0.01 0.41 4.06 -1.43 -0.92 115.95 118.28 2xfi h TRP 323 Ca 0.08 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.03 2xfi h TRP 323 Cb 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.27 2xfi h TRP 323 CO -0.03 0.05 -0.03 1.28 -3.56 0.00 0.00 178.44 176.15 2xfi n LEU 324 N -3.20 1.28 -0.71 -4.49 4.77 -1.03 -4.94 117.00 108.68 2xfi n LEU 324 Ca -0.00 -0.41 -0.09 0.00 -0.03 0.00 0.00 56.01 55.48 2xfi n LEU 324 Cb 0.29 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.33 2xfi n LEU 324 CO 0.28 0.22 -0.09 0.61 -1.33 0.00 0.00 177.39 177.08 2xfi n GLY 325 N 1.18 0.84 0.70 -0.72 0.00 -0.35 -4.90 105.19 101.94 2xfi n GLY 325 Ca 0.19 -0.63 0.09 0.00 0.00 0.00 0.00 46.02 45.67 2xfi n GLY 325 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2xfi n GLU 326 N -2.58 1.49 -3.70 1.61 1.02 -0.33 -4.92 120.64 113.23 2xfi n GLU 326 Ca -0.09 -1.53 -0.13 0.00 -0.02 0.00 0.00 57.16 55.39 2xfi n GLU 326 Cb 0.34 -1.34 -0.09 0.00 -0.02 0.00 0.00 31.44 30.32 2xfi n GLU 326 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2xfi s GLN 327 N -1.52 0.57 0.49 3.49 0.74 -1.17 -4.94 119.66 117.32 2xfi s GLN 327 Ca 0.20 0.69 -0.13 0.00 0.05 0.00 0.00 55.36 56.18 2xfi s GLN 327 Cb 0.15 0.27 -0.07 0.00 1.10 0.00 0.00 33.01 34.46 2xfi s GLN 327 CO 0.23 -0.07 0.91 -0.51 -0.55 0.00 0.00 175.29 175.30 2xfi s LEU 328 N 0.31 3.64 -0.09 3.68 1.43 -1.26 -4.33 118.68 122.06 2xfi s LEU 328 Ca -0.00 1.36 0.02 0.00 -1.03 0.00 0.00 54.13 54.48 2xfi s LEU 328 Cb -0.04 -4.29 -0.02 0.00 0.03 0.00 0.00 46.19 41.87 2xfi s LEU 328 CO 0.00 -0.56 -0.15 -0.69 0.23 0.00 0.00 176.35 175.18 2xfi s VAL 329 N -2.62 2.92 0.02 -1.59 1.01 -0.67 -4.94 120.40 114.54 2xfi s VAL 329 Ca 0.55 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.84 2xfi s VAL 329 Cb -0.10 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 2xfi s VAL 329 CO 0.35 0.56 -0.16 0.00 0.00 0.00 0.00 175.10 175.85 2xfi s TRP 331 N -0.66 1.18 0.15 0.00 0.51 -0.42 -4.98 118.94 114.72 2xfi s TRP 331 Ca 0.05 -0.52 -0.33 0.00 -2.12 0.00 0.00 56.10 53.18 2xfi s TRP 331 Cb -0.07 -0.65 -0.16 0.00 -0.81 0.00 0.00 33.47 31.77 2xfi s TRP 331 CO 0.01 0.05 1.10 0.94 -0.51 0.00 0.00 176.95 178.54 2xfi n GLN 332 N 1.01 0.94 -1.58 4.98 7.27 -1.26 -0.54 117.38 128.20 2xfi n GLN 332 Ca -0.19 0.33 -0.59 0.00 0.07 0.00 0.00 57.00 56.62 2xfi n GLN 332 Cb 0.55 -1.79 -0.08 0.00 2.41 0.00 0.00 30.24 31.33 2xfi n GLN 332 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2xfi n ALA 333 N 1.38 -2.49 -0.90 1.69 0.00 -0.56 -1.11 120.51 118.52 2xfi n ALA 333 Ca 0.16 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.15 2xfi n ALA 333 Cb 0.23 -1.88 0.00 0.00 0.00 0.00 0.00 19.45 17.80 2xfi n ALA 333 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2xfi n GLY 334 N 2.32 0.82 0.42 0.00 0.00 -1.26 -4.91 105.19 102.58 2xfi n GLY 334 Ca 0.22 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.28 2xfi n GLY 334 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2xfi n THR 335 N -2.29 1.08 -1.67 2.61 -2.24 -0.27 -5.02 114.28 106.49 2xfi n THR 335 Ca 0.00 -1.07 -0.54 0.00 -2.27 0.00 0.00 64.05 60.16 2xfi n THR 335 Cb 0.00 0.45 -0.06 0.00 -2.10 0.00 0.00 70.33 68.61 2xfi n THR 335 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2xfi n THR 336 N 0.08 0.22 -1.77 4.28 -1.04 -1.26 -4.83 114.28 109.95 2xfi n THR 336 Ca 0.08 -0.04 -0.41 0.00 -2.04 0.00 0.00 64.05 61.64 2xfi n THR 336 Cb 0.39 -1.17 -0.01 0.00 -1.82 0.00 0.00 70.33 67.73 2xfi n THR 336 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2xfi n PRO 337 N 4.49 3.27 -0.31 -2.82 -0.04 -1.26 -4.78 135.00 133.55 2xfi n PRO 337 Ca 0.23 -2.74 0.16 0.00 -0.04 0.00 0.00 63.50 61.11 2xfi n PRO 337 Cb 0.17 -3.09 0.41 0.00 -0.04 0.00 0.00 33.50 30.95 2xfi n PRO 337 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2xfi h TRP 338 N 5.67 0.84 0.00 0.54 4.06 -1.96 -2.30 115.95 122.80 2xfi h TRP 338 Ca 0.61 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 61.58 2xfi h TRP 338 Cb 0.55 -0.25 -0.00 0.00 -1.00 0.00 0.00 29.16 28.45 2xfi h TRP 338 CO 1.52 0.20 -0.01 -0.91 -3.56 0.00 0.00 178.44 175.68 2xfi h ASN 339 N 0.61 0.00 1.32 -3.49 -0.26 -2.01 -1.86 115.58 109.89 2xfi h ASN 339 Ca 0.54 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.28 2xfi h ASN 339 Cb 1.04 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.30 2xfi h ASN 339 CO -0.29 0.01 0.00 2.30 -1.06 0.00 0.00 177.43 178.38 2xfi n ILE 340 N -3.10 0.44 -3.73 2.81 -5.35 -0.86 -4.80 119.36 104.76 2xfi n ILE 340 Ca -0.00 -0.19 -0.37 0.00 -0.27 0.00 0.00 62.75 61.92 2xfi n ILE 340 Cb 0.25 -0.58 -0.06 0.00 -1.74 0.00 0.00 39.64 37.51 2xfi n ILE 340 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2xfi s PHE 341 N -3.08 3.64 0.62 4.28 0.08 -0.70 -3.24 117.98 119.58 2xfi s PHE 341 Ca 0.11 0.70 -0.08 0.00 0.12 0.00 0.00 56.93 57.78 2xfi s PHE 341 Cb 0.14 -2.07 0.00 0.00 -0.57 0.00 0.00 43.02 40.52 2xfi s PHE 341 CO 0.57 0.69 0.97 -1.25 -0.10 0.00 0.00 175.22 176.10 2xfi s PRO 342 N -1.16 3.02 0.23 0.24 0.04 -1.26 -4.80 135.00 131.31 2xfi s PRO 342 Ca 0.20 0.24 -0.17 0.00 0.04 0.00 0.00 61.00 61.31 2xfi s PRO 342 Cb -0.14 -2.18 -0.08 0.00 0.04 0.00 0.00 34.50 32.14 2xfi s PRO 342 CO 0.09 -0.75 0.69 0.14 0.04 0.00 0.00 177.00 177.20 2xfi s VAL 343 N -3.11 4.66 -0.15 -0.36 -7.23 -1.26 -4.29 120.40 108.66 2xfi s VAL 343 Ca 0.55 1.11 -0.03 0.00 -1.81 0.00 0.00 61.98 61.80 2xfi s VAL 343 Cb -0.11 -3.78 -0.02 0.00 0.56 0.00 0.00 36.38 33.03 2xfi s VAL 343 CO 0.48 0.13 -0.06 -0.63 -0.31 0.00 0.00 175.10 174.71 2xfi s ILE 344 N -1.60 3.62 -0.19 -0.62 1.01 -0.30 -0.52 121.20 122.60 2xfi s ILE 344 Ca 0.44 -0.45 -0.03 0.00 0.00 0.00 0.00 60.65 60.61 2xfi s ILE 344 Cb -0.15 -2.58 -0.01 0.00 0.01 0.00 0.00 42.46 39.73 2xfi s ILE 344 CO 0.20 0.49 -0.06 -0.44 0.00 0.00 0.00 174.94 175.13 2xfi s SER 345 N 0.47 4.33 -0.24 3.58 0.01 0.16 0.04 113.70 122.04 2xfi s SER 345 Ca -0.05 -0.33 -0.07 0.00 1.31 0.00 0.00 55.95 56.81 2xfi s SER 345 Cb -0.15 -1.72 -0.03 0.00 0.21 0.00 0.00 66.02 64.34 2xfi s SER 345 CO 0.03 0.05 0.05 -0.76 0.41 0.00 0.00 173.24 173.03 2xfi s LEU 346 N 1.05 3.36 -0.19 2.44 1.43 -0.34 -1.43 118.68 124.99 2xfi s LEU 346 Ca 0.01 -0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 52.73 2xfi s LEU 346 Cb -0.15 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 2xfi s LEU 346 CO -0.00 -0.02 0.34 -0.31 0.23 0.00 0.00 176.35 176.58 2xfi s TYR 347 N 1.55 3.40 -0.01 0.29 1.51 0.06 -1.19 117.35 122.95 2xfi s TYR 347 Ca 0.06 0.58 0.01 0.00 -1.01 0.00 0.00 57.07 56.70 2xfi s TYR 347 Cb -0.15 -2.44 -0.04 0.00 -0.11 0.00 0.00 41.96 39.22 2xfi s TYR 347 CO 0.03 0.08 0.02 -0.51 -1.11 0.00 0.00 175.55 174.06 2xfi s LEU 348 N 0.99 3.60 0.22 -1.29 1.43 0.53 -0.65 118.68 123.51 2xfi s LEU 348 Ca 0.17 0.03 -0.32 0.00 -1.03 0.00 0.00 54.13 52.99 2xfi s LEU 348 Cb -0.14 -2.06 -0.14 0.00 0.03 0.00 0.00 46.19 43.89 2xfi s LEU 348 CO 0.06 0.28 1.41 0.80 0.23 0.00 0.00 176.35 179.14 2xfi n MET 349 N 1.39 1.97 -1.39 1.70 0.00 -0.14 -2.31 117.12 118.34 2xfi n MET 349 Ca -0.14 0.70 -0.15 0.00 -0.00 0.00 0.00 57.70 58.11 2xfi n MET 349 Cb 0.53 -2.36 0.09 0.00 0.00 0.00 0.00 33.22 31.48 2xfi n MET 349 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2xfi n GLY 350 N 2.31 -0.37 0.41 -5.12 0.00 0.84 -4.17 105.19 99.09 2xfi n GLY 350 Ca 0.13 -1.84 0.14 0.00 0.00 0.00 0.00 46.02 44.44 2xfi n GLY 350 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2xfi n GLU 351 N -2.34 1.38 -4.60 1.61 1.02 -1.25 -4.57 120.64 111.89 2xfi n GLU 351 Ca 0.09 -0.83 -0.25 0.00 -0.02 0.00 0.00 57.16 56.16 2xfi n GLU 351 Cb 0.33 -1.48 -0.14 0.00 -0.02 0.00 0.00 31.44 30.13 2xfi n GLU 351 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2xfi s VAL 352 N -2.19 1.66 -0.00 2.62 1.01 -1.26 -5.09 120.40 117.15 2xfi s VAL 352 Ca 0.32 -1.23 -0.37 0.00 0.00 0.00 0.00 61.98 60.70 2xfi s VAL 352 Cb 0.20 -1.46 -0.15 0.00 0.00 0.00 0.00 36.38 34.97 2xfi s VAL 352 CO 0.40 0.17 1.54 0.41 0.00 0.00 0.00 175.10 177.63 2xfi n THR 353 N 1.76 0.13 -1.45 3.92 -1.04 -1.26 -1.60 114.28 114.74 2xfi n THR 353 Ca -0.17 -0.02 -0.16 0.00 -2.04 0.00 0.00 64.05 61.66 2xfi n THR 353 Cb 0.53 -1.17 -0.07 0.00 -1.82 0.00 0.00 70.33 67.80 2xfi n THR 353 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2xfi n GLN 354 N 3.81 -1.60 -3.97 -2.82 1.13 -1.26 -4.98 117.38 107.69 2xfi n GLN 354 Ca 0.20 1.05 -0.28 0.00 -1.94 0.00 0.00 57.00 56.03 2xfi n GLN 354 Cb 0.21 -5.47 -0.04 0.00 0.11 0.00 0.00 30.24 25.05 2xfi n GLN 354 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2xfi s GLN 355 N -3.32 3.31 0.26 -1.09 -0.21 -0.63 -1.51 119.66 116.48 2xfi s GLN 355 Ca 0.00 -0.59 -0.09 0.00 0.02 0.00 0.00 55.36 54.70 2xfi s GLN 355 Cb 0.00 -2.92 -0.01 0.00 1.00 0.00 0.00 33.01 31.08 2xfi s GLN 355 CO 0.00 0.55 0.44 -1.54 -2.12 0.00 0.00 175.29 172.61 2xfi s SER 356 N -2.91 0.16 0.15 5.90 1.04 -0.14 -0.11 113.70 117.80 2xfi s SER 356 Ca 0.34 -1.12 0.00 0.00 0.48 0.00 0.00 55.95 55.65 2xfi s SER 356 Cb -0.12 0.58 -0.04 0.00 0.10 0.00 0.00 66.02 66.54 2xfi s SER 356 CO 0.27 -1.15 0.03 0.72 0.98 0.00 0.00 173.24 174.09 2xfi s PHE 357 N -3.78 1.05 0.10 5.02 -0.12 -0.98 -0.83 117.98 118.44 2xfi s PHE 357 Ca 0.26 -1.13 0.09 0.00 -0.05 0.00 0.00 56.93 56.11 2xfi s PHE 357 Cb 0.00 -0.60 -0.04 0.00 -0.63 0.00 0.00 43.02 41.76 2xfi s PHE 357 CO 0.12 -0.36 -0.24 -0.98 -0.05 0.00 0.00 175.22 173.71 2xfi s ARG 358 N -3.98 1.33 -0.06 1.99 1.70 0.25 -0.35 118.95 119.83 2xfi s ARG 358 Ca 0.24 -1.20 0.04 0.00 -0.47 0.00 0.00 55.73 54.34 2xfi s ARG 358 Cb 0.07 -1.66 -0.02 0.00 -0.57 0.00 0.00 34.95 32.77 2xfi s ARG 358 CO 0.03 0.40 -0.15 0.96 -1.08 0.00 0.00 175.30 175.46 2xfi s ILE 359 N -1.04 2.96 -0.10 4.99 -4.36 -0.34 -1.35 121.20 121.96 2xfi s ILE 359 Ca 0.10 -0.75 0.03 0.00 -0.26 0.00 0.00 60.65 59.77 2xfi s ILE 359 Cb -0.10 -2.16 -0.01 0.00 1.25 0.00 0.00 42.46 41.45 2xfi s ILE 359 CO 0.04 0.58 -0.21 -0.89 0.24 0.00 0.00 174.94 174.71 2xfi s THR 360 N -0.58 2.34 -0.20 8.37 2.01 -0.32 -1.20 115.64 126.06 2xfi s THR 360 Ca 0.08 -0.93 -0.03 0.00 0.31 0.00 0.00 61.69 61.12 2xfi s THR 360 Cb -0.11 -1.91 -0.01 0.00 0.01 0.00 0.00 72.50 70.48 2xfi s THR 360 CO 0.01 0.55 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.80 2xfi s ILE 361 N 0.21 3.23 0.50 1.82 -1.09 0.11 -3.66 121.20 122.31 2xfi s ILE 361 Ca -0.13 -0.55 -0.05 0.00 -2.23 0.00 0.00 60.65 57.69 2xfi s ILE 361 Cb -0.16 -2.45 -0.03 0.00 -1.58 0.00 0.00 42.46 38.24 2xfi s ILE 361 CO 0.07 0.45 0.80 -0.76 -1.23 0.00 0.00 174.94 174.27 2xfi s LEU 362 N 1.30 3.56 0.59 2.97 1.43 -1.26 -1.15 118.68 126.12 2xfi s LEU 362 Ca 0.04 0.88 0.31 0.00 -1.03 0.00 0.00 54.13 54.32 2xfi s LEU 362 Cb -0.14 -3.81 1.84 0.00 0.03 0.00 0.00 46.19 44.11 2xfi s LEU 362 CO -0.03 -0.66 2.25 1.55 0.23 0.00 0.00 176.35 179.69 2xfi h PRO 363 N 0.16 0.00 0.00 1.29 0.13 -1.87 0.01 132.00 131.73 2xfi h PRO 363 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2xfi h PRO 363 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2xfi h PRO 363 CO 0.61 0.01 -0.02 1.96 -0.23 0.00 0.00 178.00 180.34 2xfi h GLN 364 N 0.00 0.00 0.07 0.86 7.50 -1.94 0.20 115.11 121.80 2xfi h GLN 364 Ca -0.00 0.00 -0.21 0.00 0.50 0.00 0.00 58.65 58.94 2xfi h GLN 364 Cb 0.03 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.55 2xfi h GLN 364 CO 0.00 0.02 -1.07 1.96 -1.50 0.00 0.00 178.83 178.24 2xfi h GLN 365 N 0.00 0.15 -0.01 1.46 4.20 -1.31 -3.41 115.11 116.19 2xfi h GLN 365 Ca -0.00 -0.26 0.00 0.00 0.06 0.00 0.00 58.65 58.45 2xfi h GLN 365 Cb 0.12 0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.99 2xfi h GLN 365 CO 0.00 1.13 -0.45 2.48 -0.67 0.00 0.00 178.83 181.31 2xfi n TYR 366 N -4.17 0.00 -3.48 2.96 0.18 -0.97 -4.45 117.16 107.22 2xfi n TYR 366 Ca -0.23 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.13 2xfi n TYR 366 Cb 0.77 -0.13 -0.08 0.00 -0.38 0.00 0.00 39.34 39.52 2xfi n TYR 366 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2xfi s LEU 367 N -2.72 5.59 -0.16 -3.48 1.43 0.02 -0.59 118.68 118.77 2xfi s LEU 367 Ca 0.17 -1.60 -0.22 0.00 -1.03 0.00 0.00 54.13 51.45 2xfi s LEU 367 Cb 0.18 -2.09 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 2xfi s LEU 367 CO 0.63 -0.66 0.69 -0.60 0.23 0.00 0.00 176.35 176.64 2xfi s ARG 368 N 1.50 4.29 0.31 1.70 3.52 0.35 -4.77 118.95 125.85 2xfi s ARG 368 Ca 0.04 0.78 -0.29 0.00 -0.13 0.00 0.00 55.73 56.12 2xfi s ARG 368 Cb -0.25 -3.54 -0.10 0.00 -1.56 0.00 0.00 34.95 29.50 2xfi s ARG 368 CO 0.03 -0.17 1.32 -2.14 -0.81 0.00 0.00 175.30 173.52 2xfi s PRO 369 N 1.65 4.36 -0.34 5.12 0.02 -1.26 -0.52 135.00 144.03 2xfi s PRO 369 Ca 0.33 2.20 -0.01 0.00 0.02 0.00 0.00 61.00 63.54 2xfi s PRO 369 Cb -0.16 -3.09 0.08 0.00 0.02 0.00 0.00 34.50 31.34 2xfi s PRO 369 CO 0.13 -0.21 0.06 0.08 -0.33 0.00 0.00 177.00 176.73 2xfi s VAL 370 N -0.92 2.95 0.05 3.83 1.01 -0.44 -4.86 120.40 122.03 2xfi s VAL 370 Ca 0.51 -1.73 -0.31 0.00 0.00 0.00 0.00 61.98 60.45 2xfi s VAL 370 Cb -0.40 -2.86 -0.05 0.00 0.00 0.00 0.00 36.38 33.07 2xfi s VAL 370 CO 0.50 -0.35 1.19 -0.70 0.00 0.00 0.00 175.10 175.75 2xfi s GLU 371 N 1.17 4.43 -0.30 2.72 -6.30 -1.26 -4.58 118.70 114.57 2xfi s GLU 371 Ca 0.01 1.75 -0.07 0.00 -2.50 0.00 0.00 54.97 54.16 2xfi s GLU 371 Cb -0.21 -3.37 0.15 0.00 0.00 0.00 0.00 34.13 30.71 2xfi s GLU 371 CO -0.03 -0.26 0.65 0.34 0.02 0.00 0.00 175.26 175.98 2xfi s ASP 372 N 1.09 -1.20 0.33 -1.70 -1.08 -1.26 -5.04 116.67 107.81 2xfi s ASP 372 Ca 0.58 1.27 0.07 0.00 -0.52 0.00 0.00 52.55 53.96 2xfi s ASP 372 Cb -0.29 2.22 0.77 0.00 -1.46 0.00 0.00 42.92 44.16 2xfi s ASP 372 CO 0.29 -0.23 1.83 0.58 0.52 0.00 0.00 175.17 178.16 2xfi h VAL 373 N 5.97 0.79 -0.21 1.11 2.07 -1.99 -1.86 116.25 122.12 2xfi h VAL 373 Ca -0.20 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 2xfi h VAL 373 Cb 1.12 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2xfi h VAL 373 CO 0.15 0.14 0.06 0.00 0.02 0.00 0.00 177.57 177.94 2xfi h ALA 374 N 1.60 1.72 -0.70 1.67 0.00 -2.01 -2.15 119.26 119.39 2xfi h ALA 374 Ca 0.51 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2xfi h ALA 374 Cb 0.80 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2xfi h ALA 374 CO -0.28 0.22 0.00 0.25 0.00 0.00 0.00 179.25 179.45 2xfi n THR 375 N -4.43 1.02 1.66 0.00 -2.24 -0.72 -4.71 114.28 104.86 2xfi n THR 375 Ca 0.00 -0.96 0.12 0.00 -2.27 0.00 0.00 64.05 60.94 2xfi n THR 375 Cb 0.14 0.44 0.70 0.00 -2.10 0.00 0.00 70.33 69.51 2xfi n THR 375 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2xfi n SER 376 N 1.54 0.00 0.29 3.42 3.41 -0.81 -0.86 113.62 120.60 2xfi n SER 376 Ca 0.24 -0.91 0.17 0.00 -0.26 0.00 0.00 58.87 58.11 2xfi n SER 376 Cb 0.62 0.00 0.81 0.00 -0.26 0.00 0.00 64.21 65.38 2xfi n SER 376 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 2xfi h GLN 377 N 0.00 0.00 -5.93 4.33 3.07 -1.84 -3.45 115.11 111.29 2xfi h GLN 377 Ca 0.00 0.00 -0.58 0.00 0.09 0.00 0.00 58.65 58.16 2xfi h GLN 377 Cb 0.00 0.00 -0.10 0.00 0.08 0.00 0.00 27.48 27.46 2xfi h GLN 377 CO 0.00 0.05 -0.57 -0.51 0.09 0.00 0.00 178.83 177.89 2xfi s ASP 378 N -5.70 4.25 -0.21 0.06 1.11 -0.04 -1.49 116.67 114.65 2xfi s ASP 378 Ca -0.01 -1.07 -0.07 0.00 0.18 0.00 0.00 52.55 51.58 2xfi s ASP 378 Cb 0.11 -0.50 -0.04 0.00 1.07 0.00 0.00 42.92 43.56 2xfi s ASP 378 CO 0.53 -0.38 0.07 -1.81 1.18 0.00 0.00 175.17 174.75 2xfi s ASP 379 N -3.79 5.44 0.08 0.27 -0.00 0.30 -4.64 116.67 114.33 2xfi s ASP 379 Ca 0.37 -0.03 0.10 0.00 -0.00 0.00 0.00 52.55 52.99 2xfi s ASP 379 Cb 0.03 -1.95 -0.03 0.00 -0.00 0.00 0.00 42.92 40.97 2xfi s ASP 379 CO 0.20 0.09 -0.26 0.00 -0.00 0.00 0.00 175.17 175.21 2xfi s TYR 381 N -0.91 0.50 -0.09 0.00 1.51 -0.18 -1.33 117.35 116.85 2xfi s TYR 381 Ca 0.12 -0.60 -0.03 0.00 -1.01 0.00 0.00 57.07 55.55 2xfi s TYR 381 Cb -0.10 -0.32 -0.03 0.00 -0.11 0.00 0.00 41.96 41.40 2xfi s TYR 381 CO 0.03 -0.16 0.03 0.15 -1.11 0.00 0.00 175.55 174.49 2xfi s LYS 382 N -1.92 3.10 -0.12 -0.62 1.02 0.32 -1.66 119.74 119.85 2xfi s LYS 382 Ca -0.09 -0.35 -0.29 0.00 0.02 0.00 0.00 55.97 55.26 2xfi s LYS 382 Cb -0.07 -2.88 -0.03 0.00 -0.52 0.00 0.00 37.83 34.32 2xfi s LYS 382 CO -0.02 0.71 1.44 0.12 -0.92 0.00 0.00 175.35 176.68 2xfi s PHE 383 N -0.89 2.46 -0.40 3.18 5.36 -1.26 -0.50 117.98 125.94 2xfi s PHE 383 Ca 0.13 0.65 0.05 0.00 -0.96 0.00 0.00 56.93 56.81 2xfi s PHE 383 Cb -0.11 -3.69 0.56 0.00 -0.34 0.00 0.00 43.02 39.43 2xfi s PHE 383 CO 0.03 -2.64 1.69 0.00 -1.46 0.00 0.00 175.22 172.84 2xfi n ALA 384 N 6.88 5.11 -3.11 11.12 0.00 0.24 -4.55 120.51 136.19 2xfi n ALA 384 Ca 0.15 -3.14 -0.32 0.00 0.00 0.00 0.00 53.44 50.13 2xfi n ALA 384 Cb 0.44 -1.10 -0.16 0.00 0.00 0.00 0.00 19.45 18.62 2xfi n ALA 384 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2xfi s ILE 385 N -3.55 2.26 0.16 0.00 1.01 -1.26 -1.79 121.20 118.04 2xfi s ILE 385 Ca 0.52 -0.95 -0.09 0.00 0.00 0.00 0.00 60.65 60.13 2xfi s ILE 385 Cb 0.45 -1.87 -0.01 0.00 0.01 0.00 0.00 42.46 41.04 2xfi s ILE 385 CO 0.04 0.56 0.28 -0.94 0.00 0.00 0.00 174.94 174.88 2xfi s SER 386 N 0.25 0.04 0.39 3.58 1.04 -0.55 -4.83 113.70 113.62 2xfi s SER 386 Ca -0.15 -0.83 -0.12 0.00 0.48 0.00 0.00 55.95 55.33 2xfi s SER 386 Cb -0.17 0.43 -0.07 0.00 0.10 0.00 0.00 66.02 66.31 2xfi s SER 386 CO 0.08 -0.88 0.77 0.00 0.98 0.00 0.00 173.24 174.18 2xfi s GLN 387 N -3.95 3.83 0.02 4.02 -2.07 -1.26 -0.85 119.66 119.39 2xfi s GLN 387 Ca 0.16 0.52 0.01 0.00 -1.82 0.00 0.00 55.36 54.23 2xfi s GLN 387 Cb 0.03 -2.39 -0.02 0.00 -1.09 0.00 0.00 33.01 29.55 2xfi s GLN 387 CO -0.01 -0.01 -0.04 0.45 -1.32 0.00 0.00 175.29 174.36 2xfi s SER 388 N -2.99 0.35 0.00 12.60 0.15 0.29 -4.72 113.70 119.38 2xfi s SER 388 Ca 0.52 -0.40 0.12 0.00 0.70 0.00 0.00 55.95 56.90 2xfi s SER 388 Cb -0.10 0.06 0.34 0.00 -1.71 0.00 0.00 66.02 64.61 2xfi s SER 388 CO 0.29 -0.20 1.28 -1.54 1.20 0.00 0.00 173.24 174.26 2xfi n SER 389 N 1.92 3.03 -0.47 5.45 3.41 -1.26 -2.89 113.62 122.79 2xfi n SER 389 Ca -0.21 -1.98 0.06 0.00 -0.26 0.00 0.00 58.87 56.48 2xfi n SER 389 Cb 0.56 -0.26 0.10 0.00 -0.26 0.00 0.00 64.21 64.36 2xfi n SER 389 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2xfi n THR 390 N 0.68 1.24 0.00 6.66 -2.24 -1.26 -4.88 114.28 114.47 2xfi n THR 390 Ca 0.13 -1.74 0.00 0.00 -2.27 0.00 0.00 64.05 60.17 2xfi n THR 390 Cb 0.45 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 2xfi n THR 390 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2xfi n GLY 391 N -0.76 -4.38 3.76 3.38 0.00 -1.22 -4.48 105.19 101.49 2xfi n GLY 391 Ca 0.11 -2.12 -0.40 0.00 0.00 0.00 0.00 46.02 43.61 2xfi n GLY 391 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2xfi s THR 392 N -0.99 3.41 -0.21 2.61 2.01 -0.34 -4.39 115.64 117.75 2xfi s THR 392 Ca 0.00 1.39 0.01 0.00 0.31 0.00 0.00 61.69 63.40 2xfi s THR 392 Cb 0.00 -3.89 0.05 0.00 0.01 0.00 0.00 72.50 68.67 2xfi s THR 392 CO 0.00 0.32 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.47 2xfi s VAL 393 N -1.02 1.61 -0.85 3.82 1.01 -0.04 -1.72 120.40 123.21 2xfi s VAL 393 Ca 0.46 -1.05 -0.20 0.00 0.00 0.00 0.00 61.98 61.19 2xfi s VAL 393 Cb -0.33 -1.73 0.11 0.00 0.00 0.00 0.00 36.38 34.43 2xfi s VAL 393 CO 0.42 0.11 1.09 -0.04 0.00 0.00 0.00 175.10 176.68 2xfi s MET 394 N 1.40 3.45 0.00 2.72 -1.94 0.79 -0.75 119.30 124.97 2xfi s MET 394 Ca -0.02 -1.45 0.00 0.00 -1.71 0.00 0.00 55.69 52.51 2xfi s MET 394 Cb -0.17 -4.74 0.00 0.00 2.01 0.00 0.00 34.83 31.93 2xfi s MET 394 CO -0.08 -1.81 0.00 0.41 -0.01 0.00 0.00 175.02 173.53 2xfi n GLY 395 N 5.54 0.32 0.32 -0.03 0.00 -0.89 -1.13 105.19 109.32 2xfi n GLY 395 Ca 0.16 -1.84 0.05 0.00 0.00 0.00 0.00 46.02 44.38 2xfi n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xfi h ALA 396 N -1.20 1.71 0.00 4.61 0.00 -0.35 -1.01 119.26 123.02 2xfi h ALA 396 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2xfi h ALA 396 Cb 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2xfi h ALA 396 CO 0.00 0.24 -0.06 -0.39 0.00 0.00 0.00 179.25 179.04 2xfi h VAL 397 N 0.61 0.18 0.20 0.00 -1.51 -1.50 0.11 116.25 114.35 2xfi h VAL 397 Ca 0.20 -0.61 -0.32 0.00 -1.23 0.00 0.00 66.70 64.74 2xfi h VAL 397 Cb 0.03 1.51 0.02 0.00 -2.13 0.00 0.00 31.29 30.72 2xfi h VAL 397 CO -0.05 0.06 -1.50 0.40 -1.23 0.00 0.00 177.57 175.25 2xfi h ILE 398 N 0.00 1.15 -0.03 7.19 1.08 -1.49 -3.36 117.51 122.04 2xfi h ILE 398 Ca -0.00 -2.58 -0.13 0.00 -0.39 0.00 0.00 64.86 61.76 2xfi h ILE 398 Cb 0.50 2.93 -0.02 0.00 -3.07 0.00 0.00 36.82 37.17 2xfi h ILE 398 CO 0.01 0.81 -0.59 0.24 -0.69 0.00 0.00 178.15 177.92 2xfi h MET 399 N 0.02 0.11 -6.73 2.37 2.86 -0.92 -3.43 114.93 109.21 2xfi h MET 399 Ca -0.28 -0.07 -0.53 0.00 -2.06 0.00 0.00 59.70 56.76 2xfi h MET 399 Cb 2.04 0.01 0.07 0.00 0.06 0.00 0.00 31.60 33.78 2xfi h MET 399 CO 0.20 0.67 0.88 -1.21 1.06 0.00 0.00 176.91 178.51 2xfi s GLU 400 N -3.72 4.17 0.00 1.72 2.02 -0.01 -1.37 118.70 121.50 2xfi s GLU 400 Ca -0.03 2.50 0.00 0.00 0.02 0.00 0.00 54.97 57.46 2xfi s GLU 400 Cb 0.12 -3.07 0.00 0.00 0.10 0.00 0.00 34.13 31.28 2xfi s GLU 400 CO 0.78 -0.61 0.00 0.41 0.02 0.00 0.00 175.26 175.86 2xfi n GLY 401 N 2.75 0.87 3.42 -1.39 0.00 -1.05 -5.00 105.19 104.80 2xfi n GLY 401 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 2xfi n GLY 401 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2xfi s PHE 402 N -3.43 2.31 -0.28 1.61 0.40 -0.47 -1.58 117.98 116.53 2xfi s PHE 402 Ca 0.00 -0.36 -0.14 0.00 -0.60 0.00 0.00 56.93 55.84 2xfi s PHE 402 Cb 0.00 -1.15 -0.04 0.00 0.51 0.00 0.00 43.02 42.34 2xfi s PHE 402 CO 0.00 0.49 0.31 -0.47 0.70 0.00 0.00 175.22 176.24 2xfi s TYR 403 N -1.62 3.23 -0.21 0.36 5.04 0.59 -4.26 117.35 120.48 2xfi s TYR 403 Ca 0.20 0.28 -0.01 0.00 -2.44 0.00 0.00 57.07 55.10 2xfi s TYR 403 Cb -0.08 -2.51 0.01 0.00 0.35 0.00 0.00 41.96 39.73 2xfi s TYR 403 CO 0.10 -0.22 -0.11 0.08 -1.34 0.00 0.00 175.55 174.05 2xfi s VAL 404 N 1.95 2.67 -0.29 3.14 1.01 -0.49 -1.57 120.40 126.82 2xfi s VAL 404 Ca 0.12 -0.85 -0.10 0.00 0.00 0.00 0.00 61.98 61.15 2xfi s VAL 404 Cb -0.16 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 2xfi s VAL 404 CO 0.10 0.40 0.14 -0.69 0.00 0.00 0.00 175.10 175.06 2xfi s VAL 405 N 1.35 4.75 -1.02 2.92 1.01 0.27 -0.44 120.40 129.23 2xfi s VAL 405 Ca 0.03 -0.18 -0.15 0.00 0.00 0.00 0.00 61.98 61.68 2xfi s VAL 405 Cb -0.15 -3.32 0.18 0.00 0.00 0.00 0.00 36.38 33.09 2xfi s VAL 405 CO -0.08 0.19 1.15 -0.36 0.00 0.00 0.00 175.10 176.01 2xfi s PHE 406 N 1.66 3.50 -1.24 5.22 0.08 0.11 -0.80 117.98 126.51 2xfi s PHE 406 Ca 0.06 -1.89 -0.14 0.00 0.12 0.00 0.00 56.93 55.07 2xfi s PHE 406 Cb -0.16 -4.15 0.15 0.00 -0.57 0.00 0.00 43.02 38.28 2xfi s PHE 406 CO 0.07 -1.30 1.54 -3.47 -0.10 0.00 0.00 175.22 171.96 2xfi n ASP 407 N 5.32 5.13 -0.25 1.36 -0.08 -0.33 -2.46 116.55 125.24 2xfi n ASP 407 Ca 0.26 -2.97 -0.05 0.00 -1.51 0.00 0.00 54.79 50.52 2xfi n ASP 407 Cb 0.46 -1.61 0.09 0.00 2.34 0.00 0.00 41.12 42.40 2xfi n ASP 407 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 2xfi h ARG 408 N 7.15 1.11 -0.99 -0.67 3.08 -1.73 -0.45 114.38 121.88 2xfi h ARG 408 Ca 0.36 -0.22 0.15 0.00 0.07 0.00 0.00 59.98 60.35 2xfi h ARG 408 Cb 0.86 -0.17 -0.10 0.00 0.08 0.00 0.00 29.97 30.64 2xfi h ARG 408 CO 1.32 0.92 0.60 0.00 -1.07 0.00 0.00 179.97 181.75 2xfi h ALA 409 N 1.20 1.56 -0.36 0.04 0.00 -1.59 -2.28 119.26 117.83 2xfi h ALA 409 Ca 0.24 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2xfi h ALA 409 Cb 0.26 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2xfi h ALA 409 CO -0.01 0.07 0.00 0.54 0.00 0.00 0.00 179.25 179.85 2xfi n ARG 410 N -4.71 2.98 -3.85 0.00 1.74 -0.99 -4.99 116.66 106.84 2xfi n ARG 410 Ca 0.21 -2.39 -0.24 0.00 -0.77 0.00 0.00 57.85 54.66 2xfi n ARG 410 Cb 0.46 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.39 2xfi n ARG 410 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2xfi n LYS 411 N 0.28 -4.02 -3.78 5.56 5.02 -0.25 -4.92 118.16 116.06 2xfi n LYS 411 Ca 0.16 0.50 -0.10 0.00 -2.02 0.00 0.00 58.31 56.85 2xfi n LYS 411 Cb 0.62 -4.83 -0.07 0.00 -0.02 0.00 0.00 35.03 30.74 2xfi n LYS 411 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2xfi s ARG 412 N -6.31 0.89 -0.10 1.97 1.70 -0.78 -0.98 118.95 115.34 2xfi s ARG 412 Ca 0.02 -0.79 0.03 0.00 -0.47 0.00 0.00 55.73 54.52 2xfi s ARG 412 Cb -0.01 0.38 0.00 0.00 -0.57 0.00 0.00 34.95 34.75 2xfi s ARG 412 CO 0.86 -0.30 -0.21 0.42 -1.08 0.00 0.00 175.30 174.99 2xfi s ILE 413 N -3.54 1.81 -0.07 4.99 1.01 0.23 -1.19 121.20 124.44 2xfi s ILE 413 Ca 0.02 -0.87 -0.03 0.00 0.00 0.00 0.00 60.65 59.78 2xfi s ILE 413 Cb 0.03 -1.59 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 2xfi s ILE 413 CO -0.10 0.50 0.07 -0.83 0.00 0.00 0.00 174.94 174.59 2xfi s GLY 414 N 0.49 2.00 -0.04 6.18 0.00 0.02 -0.79 107.32 115.19 2xfi s GLY 414 Ca -0.16 -0.78 0.06 0.00 0.00 0.00 0.00 44.72 43.83 2xfi s GLY 414 CO 0.06 -0.58 -0.21 -1.36 0.00 0.00 0.00 173.10 171.01 2xfi s PHE 415 N -1.04 1.99 0.06 1.90 0.40 0.69 -0.57 117.98 121.41 2xfi s PHE 415 Ca 0.17 -0.50 -0.06 0.00 -0.60 0.00 0.00 56.93 55.95 2xfi s PHE 415 Cb -0.12 -1.30 -0.01 0.00 0.51 0.00 0.00 43.02 42.10 2xfi s PHE 415 CO 0.07 -0.12 0.12 0.00 0.70 0.00 0.00 175.22 175.99 2xfi s ALA 416 N -0.24 -0.04 0.19 5.36 0.00 -0.61 -1.12 121.76 125.30 2xfi s ALA 416 Ca 0.01 -0.69 -0.31 0.00 0.00 0.00 0.00 51.96 50.97 2xfi s ALA 416 Cb -0.11 0.35 -0.10 0.00 0.00 0.00 0.00 23.12 23.27 2xfi s ALA 416 CO 0.01 -0.41 1.51 0.08 0.00 0.00 0.00 175.76 176.95 2xfi s VAL 417 N -3.39 2.68 0.36 0.00 1.01 -1.25 -0.30 120.40 119.51 2xfi s VAL 417 Ca 0.02 0.51 -0.18 0.00 0.00 0.00 0.00 61.98 62.32 2xfi s VAL 417 Cb 0.03 -3.33 -0.10 0.00 0.00 0.00 0.00 36.38 32.99 2xfi s VAL 417 CO -0.08 0.05 0.84 -0.55 0.00 0.00 0.00 175.10 175.36 2xfi s SER 418 N 0.87 6.89 0.56 3.32 0.15 -0.61 -1.24 113.70 123.65 2xfi s SER 418 Ca 0.66 1.49 0.26 0.00 0.70 0.00 0.00 55.95 59.06 2xfi s SER 418 Cb -0.43 -2.46 1.52 0.00 -1.71 0.00 0.00 66.02 62.94 2xfi s SER 418 CO 0.35 -0.25 2.07 0.00 1.20 0.00 0.00 173.24 176.61 2xfi h ALA 419 N 2.23 2.05 -2.54 5.45 0.00 -1.47 -3.34 119.26 121.64 2xfi h ALA 419 Ca -0.48 -0.01 -0.72 0.00 0.00 0.00 0.00 54.91 53.70 2xfi h ALA 419 Cb 1.18 0.02 -0.23 0.00 0.00 0.00 0.00 17.79 18.76 2xfi h ALA 419 CO 0.63 -0.37 -0.43 0.00 0.00 0.00 0.00 179.25 179.09 2xfi s HIS 421 N 1.62 0.29 -0.07 0.00 -0.00 -1.26 -3.94 115.29 111.94 2xfi s HIS 421 Ca 0.04 -0.61 -0.00 0.00 -0.00 0.00 0.00 55.06 54.49 2xfi s HIS 421 Cb -0.21 -0.21 -0.00 0.00 -0.00 0.00 0.00 32.58 32.16 2xfi s HIS 421 CO 0.08 -0.27 -0.01 -0.39 -0.00 0.00 0.00 174.74 174.15 2xfi h VAL 422 N 4.12 0.00 -0.81 -5.38 -1.51 -1.95 -3.51 116.25 107.21 2xfi h VAL 422 Ca -0.32 -0.63 0.00 0.00 -1.23 0.00 0.00 66.70 64.51 2xfi h VAL 422 Cb 1.19 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.35 2xfi h VAL 422 CO 0.48 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.82 2xfi n HIS 423 N -3.76 0.00 -3.17 5.19 -0.00 -1.26 -5.03 115.22 107.19 2xfi n HIS 423 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2xfi n HIS 423 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.00 2xfi n HIS 423 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2xfi n ASP 424 N -1.09 1.39 0.00 4.39 5.68 -1.08 -5.02 116.55 120.81 2xfi n ASP 424 Ca 0.00 -0.48 0.15 0.00 -0.50 0.00 0.00 54.79 53.96 2xfi n ASP 424 Cb 0.00 0.00 0.75 0.00 -1.14 0.00 0.00 41.12 40.73 2xfi n ASP 424 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2xfi n GLU 425 N -0.15 0.42 -0.07 0.11 0.00 -1.26 -3.95 120.64 115.75 2xfi n GLU 425 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 57.16 57.07 2xfi n GLU 425 Cb 0.00 -1.50 -0.08 0.00 0.00 0.00 0.00 31.44 29.86 2xfi n GLU 425 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2xfi n PHE 426 N -1.29 0.00 -4.10 -1.84 3.01 -1.26 -5.06 117.46 106.92 2xfi n PHE 426 Ca 0.14 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.46 2xfi n PHE 426 Cb 0.24 -0.62 -0.12 0.00 -0.01 0.00 0.00 39.48 38.97 2xfi n PHE 426 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2xfi s ARG 427 N -2.32 0.59 -0.02 -1.08 0.52 -1.25 -5.15 118.95 110.24 2xfi s ARG 427 Ca -0.16 -0.76 0.01 0.00 -0.52 0.00 0.00 55.73 54.30 2xfi s ARG 427 Cb 0.05 -0.43 0.01 0.00 0.52 0.00 0.00 34.95 35.11 2xfi s ARG 427 CO 0.43 0.09 -0.02 0.99 0.02 0.00 0.00 175.30 176.80 2xfi s THR 428 N -1.26 0.30 0.63 0.02 2.01 -1.26 -2.65 115.64 113.42 2xfi s THR 428 Ca -0.07 -0.06 -0.18 0.00 0.31 0.00 0.00 61.69 61.68 2xfi s THR 428 Cb -0.09 -0.32 -0.02 0.00 0.01 0.00 0.00 72.50 72.07 2xfi s THR 428 CO 0.01 0.13 1.21 0.00 -0.69 0.00 0.00 174.62 175.28 2xfi n ALA 429 N 3.61 0.93 -3.02 7.40 0.00 -1.26 -5.01 120.51 123.16 2xfi n ALA 429 Ca -0.21 0.01 -0.11 0.00 0.00 0.00 0.00 53.44 53.13 2xfi n ALA 429 Cb 0.54 -2.27 -0.08 0.00 0.00 0.00 0.00 19.45 17.63 2xfi n ALA 429 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2xfi s ALA 430 N -1.41 -0.52 -0.17 0.00 0.00 -1.24 -4.97 121.76 113.45 2xfi s ALA 430 Ca 0.80 -0.06 -0.00 0.00 0.00 0.00 0.00 51.96 52.70 2xfi s ALA 430 Cb -0.39 0.21 0.04 0.00 0.00 0.00 0.00 23.12 22.98 2xfi s ALA 430 CO 0.43 -0.32 -0.07 0.08 0.00 0.00 0.00 175.76 175.87 2xfi s VAL 431 N -2.09 1.27 0.06 0.00 1.01 -1.26 -1.17 120.40 118.21 2xfi s VAL 431 Ca -0.09 -0.71 -0.13 0.00 0.00 0.00 0.00 61.98 61.05 2xfi s VAL 431 Cb -0.03 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 34.97 2xfi s VAL 431 CO -0.01 0.17 0.30 -1.83 0.00 0.00 0.00 175.10 173.73 2xfi s GLU 432 N 1.57 0.84 0.00 2.72 -1.05 -0.46 -4.86 118.70 117.46 2xfi s GLU 432 Ca 0.01 -0.57 0.00 0.00 -0.15 0.00 0.00 54.97 54.26 2xfi s GLU 432 Cb -0.15 0.36 0.00 0.00 -0.44 0.00 0.00 34.13 33.90 2xfi s GLU 432 CO -0.08 -0.28 0.00 0.41 0.95 0.00 0.00 175.26 176.26 2xfi n GLY 433 N 0.44 -1.25 3.88 -3.83 0.00 -1.26 -0.58 105.19 102.59 2xfi n GLY 433 Ca -0.18 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.69 2xfi n GLY 433 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2xfi s PRO 434 N -0.33 3.76 0.07 1.61 0.04 -1.26 -5.09 135.00 133.80 2xfi s PRO 434 Ca 0.00 0.41 0.08 0.00 0.04 0.00 0.00 61.00 61.53 2xfi s PRO 434 Cb 0.00 -2.42 -0.03 0.00 0.04 0.00 0.00 34.50 32.09 2xfi s PRO 434 CO 0.00 -0.01 -0.19 -0.06 0.04 0.00 0.00 177.00 176.77 2xfi s PHE 435 N -2.35 2.52 0.02 0.56 0.40 -0.01 -4.96 117.98 114.16 2xfi s PHE 435 Ca 0.50 -0.28 0.07 0.00 -0.60 0.00 0.00 56.93 56.63 2xfi s PHE 435 Cb -0.10 -1.41 -0.03 0.00 0.51 0.00 0.00 43.02 41.99 2xfi s PHE 435 CO 0.32 0.29 -0.20 0.08 0.70 0.00 0.00 175.22 176.40 2xfi s VAL 436 N -0.99 2.61 -0.08 -0.44 1.01 -1.26 -0.97 120.40 120.28 2xfi s VAL 436 Ca 0.15 -1.15 0.04 0.00 0.00 0.00 0.00 61.98 61.03 2xfi s VAL 436 Cb -0.10 -2.05 -0.00 0.00 0.00 0.00 0.00 36.38 34.22 2xfi s VAL 436 CO 0.07 0.41 -0.23 -0.89 0.00 0.00 0.00 175.10 174.45 2xfi s THR 437 N -0.84 1.97 0.06 3.92 2.01 -0.57 -5.02 115.64 117.17 2xfi s THR 437 Ca 0.13 -0.99 -0.17 0.00 0.31 0.00 0.00 61.69 60.97 2xfi s THR 437 Cb -0.10 -1.70 -0.15 0.00 0.01 0.00 0.00 72.50 70.56 2xfi s THR 437 CO 0.03 0.54 1.30 0.17 -0.69 0.00 0.00 174.62 175.98 2xfi h LEU 438 N 6.53 0.61 -9.49 4.42 -0.00 -2.00 -3.44 115.31 111.94 2xfi h LEU 438 Ca -0.24 -0.56 -0.53 0.00 -0.00 0.00 0.00 57.88 56.55 2xfi h LEU 438 Cb 1.22 -0.18 0.03 0.00 -0.00 0.00 0.00 40.66 41.73 2xfi h LEU 438 CO 0.47 1.07 1.00 -0.62 -0.00 0.00 0.00 178.44 180.36 2xfi s ASP 439 N -6.54 6.56 -0.08 0.17 3.68 -1.26 -4.90 116.67 114.30 2xfi s ASP 439 Ca -0.13 2.57 0.13 0.00 2.13 0.00 0.00 52.55 57.25 2xfi s ASP 439 Cb 0.06 -2.57 0.51 0.00 -1.45 0.00 0.00 42.92 39.47 2xfi s ASP 439 CO 0.81 -0.90 1.37 0.23 0.13 0.00 0.00 175.17 176.81 2xfi n MET 440 N 5.34 2.89 -2.00 4.34 2.81 -1.26 -4.94 117.12 124.30 2xfi n MET 440 Ca 0.16 -2.00 -0.41 0.00 -1.81 0.00 0.00 57.70 53.64 2xfi n MET 440 Cb 0.40 -1.69 -0.02 0.00 -0.71 0.00 0.00 33.22 31.20 2xfi n MET 440 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2xfi s GLU 441 N -1.73 4.26 -0.05 0.03 2.12 -1.26 -4.98 118.70 117.09 2xfi s GLU 441 Ca 0.36 2.34 -0.30 0.00 0.36 0.00 0.00 54.97 57.73 2xfi s GLU 441 Cb 0.23 -3.06 -0.03 0.00 0.26 0.00 0.00 34.13 31.53 2xfi s GLU 441 CO 0.18 -0.36 1.07 0.34 -0.54 0.00 0.00 175.26 175.94 2xfi s ASP 442 N -0.08 7.21 0.00 -1.70 2.15 -1.26 -4.95 116.67 118.04 2xfi s ASP 442 Ca 0.54 1.68 0.28 0.00 0.43 0.00 0.00 52.55 55.48 2xfi s ASP 442 Cb -0.42 -2.56 0.98 0.00 -0.30 0.00 0.00 42.92 40.61 2xfi s ASP 442 CO 0.52 -0.43 1.70 0.00 -0.17 0.00 0.00 175.17 176.79 2xfi s GLY 444 N -2.38 2.81 0.10 0.00 0.00 -1.26 -3.80 107.32 102.78 2xfi s GLY 444 Ca 0.29 1.23 -0.13 0.00 0.00 0.00 0.00 44.72 46.11 2xfi s GLY 444 CO 0.47 1.97 1.28 -1.82 0.00 0.00 0.00 173.10 175.00 2xfi h TYR 445 N 3.96 1.07 -2.75 1.90 3.20 -1.83 -3.45 116.97 119.07 2xfi h TYR 445 Ca -0.48 -0.50 -0.51 0.00 3.14 0.00 0.00 58.73 60.39 2xfi h TYR 445 Cb 1.22 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.33 2xfi h TYR 445 CO 0.58 1.33 -0.31 -0.80 -1.64 0.00 0.00 178.16 177.32 2xfi s ASN 446 N -7.15 6.36 0.00 -2.11 0.01 -1.26 -5.10 114.94 105.68 2xfi s ASN 446 Ca -0.10 0.37 0.00 0.00 -0.71 0.00 0.00 52.86 52.42 2xfi s ASN 446 Cb 0.08 -2.00 0.00 0.00 0.41 0.00 0.00 41.25 39.75 2xfi s ASN 446 CO 0.91 -0.11 0.00 0.00 -1.51 0.00 0.00 177.10 176.39