#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wf3 n MET 63 N 0.00 0.65 -1.77 3.44 2.81 -1.26 -4.75 117.12 116.24 2wf3 n MET 63 Ca 0.00 0.11 -0.40 0.00 -1.81 0.00 0.00 57.70 55.59 2wf3 n MET 63 Cb 0.00 -1.68 0.02 0.00 -0.71 0.00 0.00 33.22 30.84 2wf3 n MET 63 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2wf3 n VAL 64 N -2.78 2.65 -2.68 2.03 0.31 -1.26 -2.17 118.33 114.44 2wf3 n VAL 64 Ca -0.16 -0.50 -0.19 0.00 -0.01 0.00 0.00 64.34 63.47 2wf3 n VAL 64 Cb 0.92 -1.87 0.00 0.00 -0.91 0.00 0.00 33.84 31.98 2wf3 n VAL 64 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2wf3 n ASP 65 N -0.07 -5.21 -0.31 4.52 2.03 -1.22 -4.91 116.55 111.37 2wf3 n ASP 65 Ca 0.04 -0.07 0.07 0.00 0.52 0.00 0.00 54.79 55.35 2wf3 n ASP 65 Cb 0.41 -4.32 0.31 0.00 -0.72 0.00 0.00 41.12 36.80 2wf3 n ASP 65 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2wf3 n ASN 66 N -2.12 0.92 -4.48 1.67 0.23 -0.92 -4.81 115.26 105.74 2wf3 n ASN 66 Ca -0.16 -1.74 -0.32 0.00 -0.53 0.00 0.00 54.58 51.82 2wf3 n ASN 66 Cb 0.64 -0.08 -0.13 0.00 -2.08 0.00 0.00 39.78 38.12 2wf3 n ASN 66 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2wf3 s LEU 67 N -1.34 2.76 0.40 -4.53 1.43 0.10 -4.37 118.68 113.13 2wf3 s LEU 67 Ca 0.23 -0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.14 2wf3 s LEU 67 Cb 0.12 -1.57 -0.03 0.00 0.03 0.00 0.00 46.19 44.73 2wf3 s LEU 67 CO 0.18 0.33 0.10 -0.13 0.23 0.00 0.00 176.35 177.05 2wf3 s ARG 68 N -0.89 1.91 0.00 1.70 1.81 -0.73 -1.76 118.95 120.98 2wf3 s ARG 68 Ca 0.12 -2.15 0.00 0.00 -1.72 0.00 0.00 55.73 51.98 2wf3 s ARG 68 Cb -0.11 -0.79 0.00 0.00 -0.45 0.00 0.00 34.95 33.60 2wf3 s ARG 68 CO 0.02 -0.40 0.00 0.41 -0.68 0.00 0.00 175.30 174.65 2wf3 n GLY 69 N -0.91 -0.14 3.42 -3.53 0.00 -0.70 -0.80 105.19 102.53 2wf3 n GLY 69 Ca -0.07 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 44.69 2wf3 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wf3 s LYS 70 N -2.00 2.18 0.21 1.61 1.02 -1.25 -1.31 119.74 120.20 2wf3 s LYS 70 Ca 0.00 -0.90 -0.30 0.00 0.02 0.00 0.00 55.97 54.79 2wf3 s LYS 70 Cb 0.00 -2.20 -0.16 0.00 -0.52 0.00 0.00 37.83 34.96 2wf3 s LYS 70 CO 0.00 0.57 0.90 0.45 -0.92 0.00 0.00 175.35 176.35 2wf3 n SER 71 N 1.97 0.43 0.00 2.83 2.88 -0.56 -1.78 113.62 119.39 2wf3 n SER 71 Ca -0.16 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.53 2wf3 n SER 71 Cb 0.52 -1.14 0.00 0.00 -0.75 0.00 0.00 64.21 62.84 2wf3 n SER 71 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wf3 n GLY 72 N 1.69 0.26 0.03 0.46 0.00 -1.26 -4.81 105.19 101.55 2wf3 n GLY 72 Ca 0.14 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.18 2wf3 n GLY 72 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wf3 n GLN 73 N -1.35 2.34 0.00 1.61 6.02 -0.73 -4.95 117.38 120.32 2wf3 n GLN 73 Ca 0.00 -1.62 0.00 0.00 -0.01 0.00 0.00 57.00 55.37 2wf3 n GLN 73 Cb 0.13 -1.05 0.00 0.00 1.02 0.00 0.00 30.24 30.34 2wf3 n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wf3 n GLY 74 N -0.63 -0.49 3.46 1.08 0.00 -1.25 -4.80 105.19 102.56 2wf3 n GLY 74 Ca 0.03 -1.69 -0.33 0.00 0.00 0.00 0.00 46.02 44.03 2wf3 n GLY 74 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wf3 s TYR 75 N -2.38 2.73 0.07 1.61 1.51 -1.26 -3.90 117.35 115.73 2wf3 s TYR 75 Ca 0.00 -0.23 0.05 0.00 -1.01 0.00 0.00 57.07 55.89 2wf3 s TYR 75 Cb 0.00 -1.67 -0.03 0.00 -0.11 0.00 0.00 41.96 40.15 2wf3 s TYR 75 CO 0.00 0.13 -0.15 1.52 -1.11 0.00 0.00 175.55 175.94 2wf3 s TYR 76 N -0.55 1.28 0.14 2.71 -0.85 0.02 -0.52 117.35 119.57 2wf3 s TYR 76 Ca 0.08 -0.44 0.09 0.00 -0.52 0.00 0.00 57.07 56.28 2wf3 s TYR 76 Cb -0.11 -0.72 -0.04 0.00 0.38 0.00 0.00 41.96 41.46 2wf3 s TYR 76 CO 0.01 0.07 -0.16 0.54 -1.52 0.00 0.00 175.55 174.50 2wf3 s VAL 77 N -1.21 2.93 0.10 -3.49 0.11 -0.01 -1.77 120.40 117.05 2wf3 s VAL 77 Ca -0.01 -1.59 -0.27 0.00 -2.93 0.00 0.00 61.98 57.18 2wf3 s VAL 77 Cb -0.10 -2.38 -0.06 0.00 -1.53 0.00 0.00 36.38 32.31 2wf3 s VAL 77 CO 0.02 0.01 0.83 -0.70 -3.33 0.00 0.00 175.10 171.94 2wf3 s GLU 78 N -2.41 4.59 0.19 1.54 2.12 -1.26 -0.75 118.70 122.71 2wf3 s GLU 78 Ca 0.21 1.21 0.02 0.00 0.36 0.00 0.00 54.97 56.77 2wf3 s GLU 78 Cb -0.10 -3.34 -0.05 0.00 0.26 0.00 0.00 34.13 30.90 2wf3 s GLU 78 CO 0.12 0.33 0.01 -1.64 -0.54 0.00 0.00 175.26 173.54 2wf3 s MET 79 N -0.32 1.17 0.07 4.30 -1.94 0.15 -3.93 119.30 118.81 2wf3 s MET 79 Ca 0.40 -1.58 0.08 0.00 -1.71 0.00 0.00 55.69 52.89 2wf3 s MET 79 Cb -0.22 -0.34 -0.03 0.00 2.01 0.00 0.00 34.83 36.25 2wf3 s MET 79 CO 0.26 -0.13 -0.21 0.95 -0.01 0.00 0.00 175.02 175.87 2wf3 s THR 80 N -3.62 1.73 -0.02 2.05 -4.23 -0.07 -1.03 115.64 110.46 2wf3 s THR 80 Ca 0.26 -1.38 0.04 0.00 -1.18 0.00 0.00 61.69 59.43 2wf3 s THR 80 Cb 0.06 -1.54 -0.01 0.00 1.34 0.00 0.00 72.50 72.36 2wf3 s THR 80 CO 0.05 0.09 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.38 2wf3 s VAL 81 N -0.97 1.19 0.00 2.29 1.01 -0.07 -1.65 120.40 122.20 2wf3 s VAL 81 Ca 0.07 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.43 2wf3 s VAL 81 Cb -0.09 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.29 2wf3 s VAL 81 CO 0.03 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.08 2wf3 n GLY 82 N 2.85 0.49 2.98 4.51 0.00 0.87 -1.20 105.19 115.69 2wf3 n GLY 82 Ca -0.15 -1.85 -0.30 0.00 0.00 0.00 0.00 46.02 43.72 2wf3 n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wf3 s SER 83 N -1.35 2.87 0.79 1.61 0.01 -1.26 -2.81 113.70 113.57 2wf3 s SER 83 Ca 0.00 -0.62 -0.11 0.00 1.31 0.00 0.00 55.95 56.53 2wf3 s SER 83 Cb 0.00 -1.12 0.07 0.00 0.21 0.00 0.00 66.02 65.17 2wf3 s SER 83 CO 0.00 -0.11 1.09 -2.16 0.41 0.00 0.00 173.24 172.48 2wf3 s PRO 84 N 1.50 2.12 0.10 12.44 0.04 -1.26 -1.11 135.00 148.83 2wf3 s PRO 84 Ca 0.02 0.68 -0.31 0.00 0.04 0.00 0.00 61.00 61.43 2wf3 s PRO 84 Cb -0.14 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.40 2wf3 s PRO 84 CO -0.09 -1.60 1.54 -1.25 0.04 0.00 0.00 177.00 175.63 2wf3 s PRO 85 N -5.14 4.24 -0.23 0.56 0.04 -1.12 -4.89 135.00 128.46 2wf3 s PRO 85 Ca 0.61 2.23 -0.08 0.00 0.04 0.00 0.00 61.00 63.79 2wf3 s PRO 85 Cb -0.15 -3.39 -0.04 0.00 0.04 0.00 0.00 34.50 30.96 2wf3 s PRO 85 CO 0.54 -0.61 0.10 -0.65 0.04 0.00 0.00 177.00 176.42 2wf3 s GLN 86 N 1.85 3.87 -0.08 4.56 -0.21 -0.34 -4.90 119.66 124.42 2wf3 s GLN 86 Ca 0.69 -0.38 -0.27 0.00 0.02 0.00 0.00 55.36 55.43 2wf3 s GLN 86 Cb -0.39 -3.37 -0.03 0.00 1.00 0.00 0.00 33.01 30.23 2wf3 s GLN 86 CO 0.31 0.01 0.85 0.99 -2.12 0.00 0.00 175.29 175.33 2wf3 s THR 87 N 1.11 4.92 0.04 -0.19 2.01 -1.26 -0.89 115.64 121.38 2wf3 s THR 87 Ca 0.05 1.74 0.02 0.00 0.31 0.00 0.00 61.69 63.81 2wf3 s THR 87 Cb -0.14 -4.18 -0.02 0.00 0.01 0.00 0.00 72.50 68.17 2wf3 s THR 87 CO 0.04 0.14 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.28 2wf3 s LEU 88 N 1.34 2.25 -0.16 4.42 1.43 -0.19 -4.96 118.68 122.81 2wf3 s LEU 88 Ca 0.43 -0.54 -0.17 0.00 -1.03 0.00 0.00 54.13 52.82 2wf3 s LEU 88 Cb -0.18 -0.11 -0.04 0.00 0.03 0.00 0.00 46.19 45.89 2wf3 s LEU 88 CO 0.20 -0.23 0.43 0.20 0.23 0.00 0.00 176.35 177.18 2wf3 s ASN 89 N -1.56 6.56 -0.10 2.29 0.02 -1.26 0.34 114.94 121.23 2wf3 s ASN 89 Ca -0.11 0.67 0.01 0.00 -1.02 0.00 0.00 52.86 52.41 2wf3 s ASN 89 Cb -0.10 -2.26 0.02 0.00 0.02 0.00 0.00 41.25 38.93 2wf3 s ASN 89 CO 0.00 -0.03 -0.11 -0.63 0.02 0.00 0.00 177.10 176.35 2wf3 s ILE 90 N 0.91 1.23 0.17 0.60 -1.09 0.07 -1.24 121.20 121.86 2wf3 s ILE 90 Ca 0.22 -0.46 -0.31 0.00 -2.23 0.00 0.00 60.65 57.87 2wf3 s ILE 90 Cb -0.15 -1.17 -0.09 0.00 -1.58 0.00 0.00 42.46 39.47 2wf3 s ILE 90 CO 0.08 0.39 1.40 -0.22 -1.23 0.00 0.00 174.94 175.37 2wf3 s LEU 91 N 1.24 4.39 -0.38 2.97 0.20 -0.16 -0.83 118.68 126.11 2wf3 s LEU 91 Ca -0.03 2.46 -0.18 0.00 0.69 0.00 0.00 54.13 57.07 2wf3 s LEU 91 Cb -0.14 -3.60 0.01 0.00 -0.43 0.00 0.00 46.19 42.02 2wf3 s LEU 91 CO -0.04 -0.65 0.47 0.68 -0.29 0.00 0.00 176.35 176.53 2wf3 s VAL 92 N 0.59 5.04 -0.34 1.68 -7.23 0.32 -0.56 120.40 119.90 2wf3 s VAL 92 Ca 0.62 0.04 0.03 0.00 -1.81 0.00 0.00 61.98 60.86 2wf3 s VAL 92 Cb -0.39 -3.99 0.10 0.00 0.56 0.00 0.00 36.38 32.66 2wf3 s VAL 92 CO 0.35 -0.30 0.05 -0.62 -0.31 0.00 0.00 175.10 174.27 2wf3 s ASP 93 N 1.80 4.78 0.00 4.85 2.15 -0.20 -4.26 116.67 125.80 2wf3 s ASP 93 Ca 0.16 -2.11 0.15 0.00 0.43 0.00 0.00 52.55 51.18 2wf3 s ASP 93 Cb -0.16 -1.64 0.77 0.00 -0.30 0.00 0.00 42.92 41.59 2wf3 s ASP 93 CO 0.14 -0.38 1.40 0.35 -0.17 0.00 0.00 175.17 176.51 2wf3 n THR 94 N 4.28 0.53 0.56 1.71 -2.24 -1.26 -0.63 114.28 117.23 2wf3 n THR 94 Ca 0.03 0.13 0.11 0.00 -2.27 0.00 0.00 64.05 62.05 2wf3 n THR 94 Cb 0.42 -0.89 0.15 0.00 -2.10 0.00 0.00 70.33 67.92 2wf3 n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wf3 n GLY 95 N -0.02 1.31 3.01 3.38 0.00 -1.26 -4.21 105.19 107.40 2wf3 n GLY 95 Ca 0.07 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.31 2wf3 n GLY 95 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wf3 n SER 96 N 1.33 -1.46 -0.18 1.61 3.41 -1.21 -5.00 113.62 112.12 2wf3 n SER 96 Ca 0.16 -2.53 0.00 0.00 -0.26 0.00 0.00 58.87 56.24 2wf3 n SER 96 Cb 0.57 2.58 0.00 0.00 -0.26 0.00 0.00 64.21 67.10 2wf3 n SER 96 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2wf3 n SER 97 N -1.60 0.00 -4.51 4.04 7.64 -1.26 -0.50 113.62 117.43 2wf3 n SER 97 Ca -0.02 -1.35 -0.34 0.00 1.01 0.00 0.00 58.87 58.17 2wf3 n SER 97 Cb 0.50 -0.07 -0.12 0.00 -1.01 0.00 0.00 64.21 63.52 2wf3 n SER 97 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2wf3 s ASN 98 N -0.35 4.79 -0.17 6.43 -0.87 -1.26 -4.54 114.94 118.97 2wf3 s ASN 98 Ca 0.00 -0.11 -0.21 0.00 -1.57 0.00 0.00 52.86 50.97 2wf3 s ASN 98 Cb 0.00 -1.72 -0.03 0.00 -0.02 0.00 0.00 41.25 39.48 2wf3 s ASN 98 CO 0.00 0.20 0.62 0.12 -2.57 0.00 0.00 177.10 175.47 2wf3 s PHE 99 N 0.20 3.41 -0.09 2.20 5.99 -1.26 -1.70 117.98 126.73 2wf3 s PHE 99 Ca -0.02 0.96 -0.14 0.00 0.00 0.00 0.00 56.93 57.73 2wf3 s PHE 99 Cb -0.14 -2.77 0.03 0.00 0.00 0.00 0.00 43.02 40.14 2wf3 s PHE 99 CO 0.03 -0.10 0.37 0.00 -0.00 0.00 0.00 175.22 175.51 2wf3 s ALA 100 N 1.63 -0.91 0.00 11.12 0.00 -0.68 -1.21 121.76 131.71 2wf3 s ALA 100 Ca 0.29 0.82 -0.01 0.00 0.00 0.00 0.00 51.96 53.06 2wf3 s ALA 100 Cb -0.16 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.60 2wf3 s ALA 100 CO 0.11 -0.21 0.02 0.14 0.00 0.00 0.00 175.76 175.82 2wf3 s VAL 101 N -0.39 0.05 0.17 0.00 -7.23 -0.46 -0.42 120.40 112.13 2wf3 s VAL 101 Ca -0.05 -0.44 -0.34 0.00 -1.81 0.00 0.00 61.98 59.34 2wf3 s VAL 101 Cb -0.03 -0.18 -0.15 0.00 0.56 0.00 0.00 36.38 36.58 2wf3 s VAL 101 CO 0.02 -0.24 1.43 0.61 -0.31 0.00 0.00 175.10 176.61 2wf3 n GLY 102 N 2.30 0.77 0.23 2.32 0.00 0.99 -1.05 105.19 110.75 2wf3 n GLY 102 Ca -0.18 0.61 0.02 0.00 0.00 0.00 0.00 46.02 46.46 2wf3 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wf3 n ALA 103 N 2.59 1.74 -3.22 4.61 0.00 -0.51 -0.70 120.51 125.03 2wf3 n ALA 103 Ca 0.16 -1.11 -0.13 0.00 0.00 0.00 0.00 53.44 52.35 2wf3 n ALA 103 Cb 0.27 -0.28 -0.06 0.00 0.00 0.00 0.00 19.45 19.38 2wf3 n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wf3 s ALA 104 N -0.57 -1.12 0.40 0.00 0.00 -1.22 -4.79 121.76 114.45 2wf3 s ALA 104 Ca 0.05 0.43 -0.26 0.00 0.00 0.00 0.00 51.96 52.18 2wf3 s ALA 104 Cb 0.04 0.34 -0.11 0.00 0.00 0.00 0.00 23.12 23.40 2wf3 s ALA 104 CO 0.00 -0.46 1.25 -2.30 0.00 0.00 0.00 175.76 174.25 2wf3 n PRO 105 N 0.51 1.92 -3.75 0.00 -0.02 -1.26 -4.95 135.00 127.44 2wf3 n PRO 105 Ca -0.19 0.68 -0.13 0.00 -2.02 0.00 0.00 63.50 61.84 2wf3 n PRO 105 Cb 0.60 -2.32 -0.09 0.00 -0.02 0.00 0.00 33.50 31.66 2wf3 n PRO 105 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2wf3 s HIS 106 N -1.17 -0.25 0.53 6.00 2.46 -1.26 -5.04 115.29 116.55 2wf3 s HIS 106 Ca 0.59 0.50 0.21 0.00 0.47 0.00 0.00 55.06 56.83 2wf3 s HIS 106 Cb -0.53 0.11 1.44 0.00 -0.13 0.00 0.00 32.58 33.47 2wf3 s HIS 106 CO 0.59 -0.33 2.16 -1.35 -2.47 0.00 0.00 174.74 173.35 2wf3 h PRO 107 N 4.42 0.00 -0.08 2.88 0.10 -2.02 -1.33 132.00 135.96 2wf3 h PRO 107 Ca -0.29 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.81 2wf3 h PRO 107 Cb 1.18 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.28 2wf3 h PRO 107 CO 0.36 0.03 0.00 1.19 0.10 0.00 0.00 178.00 179.69 2wf3 n PHE 108 N -4.21 0.08 -3.57 0.65 0.99 -1.26 -4.87 117.46 105.26 2wf3 n PHE 108 Ca -0.03 -0.04 -0.39 0.00 -0.00 0.00 0.00 57.45 57.00 2wf3 n PHE 108 Cb 0.12 0.00 -0.11 0.00 -1.00 0.00 0.00 39.48 38.49 2wf3 n PHE 108 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2wf3 s LEU 109 N -1.91 4.13 0.35 4.37 1.43 -0.50 -4.63 118.68 121.92 2wf3 s LEU 109 Ca 0.32 -0.09 0.17 0.00 -1.03 0.00 0.00 54.13 53.50 2wf3 s LEU 109 Cb 0.20 -2.13 0.60 0.00 0.03 0.00 0.00 46.19 44.89 2wf3 s LEU 109 CO 0.31 -0.09 1.70 0.45 0.23 0.00 0.00 176.35 178.95 2wf3 h HIS 110 N 8.39 0.00 -2.96 0.29 3.86 -1.89 -3.43 115.15 119.41 2wf3 h HIS 110 Ca -0.34 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 58.90 2wf3 h HIS 110 Cb 1.18 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.57 2wf3 h HIS 110 CO 0.74 0.44 0.23 -0.98 0.86 0.00 0.00 177.93 179.22 2wf3 s ARG 111 N -3.62 1.51 0.14 2.45 1.70 -1.26 -5.16 118.95 114.72 2wf3 s ARG 111 Ca -0.00 -0.72 -0.20 0.00 -0.47 0.00 0.00 55.73 54.34 2wf3 s ARG 111 Cb 0.11 0.59 0.05 0.00 -0.57 0.00 0.00 34.95 35.14 2wf3 s ARG 111 CO 0.71 -0.68 0.51 1.52 -1.08 0.00 0.00 175.30 176.27 2wf3 s TYR 112 N -3.80 -0.39 0.02 5.89 -0.85 -1.26 -4.89 117.35 112.06 2wf3 s TYR 112 Ca 0.06 0.13 -0.30 0.00 -0.52 0.00 0.00 57.07 56.44 2wf3 s TYR 112 Cb -0.03 0.42 -0.06 0.00 0.38 0.00 0.00 41.96 42.67 2wf3 s TYR 112 CO -0.03 -0.78 1.34 -0.47 -1.52 0.00 0.00 175.55 174.09 2wf3 s TYR 113 N -3.76 3.05 -0.42 -3.49 5.04 0.13 -4.94 117.35 112.97 2wf3 s TYR 113 Ca 0.02 0.97 -0.04 0.00 -2.44 0.00 0.00 57.07 55.57 2wf3 s TYR 113 Cb 0.00 -3.59 0.11 0.00 0.35 0.00 0.00 41.96 38.83 2wf3 s TYR 113 CO -0.12 -2.10 0.23 -0.65 -1.34 0.00 0.00 175.55 171.57 2wf3 s GLN 114 N 1.96 2.14 0.38 4.97 -0.21 -1.26 -4.38 119.66 123.27 2wf3 s GLN 114 Ca 0.62 -1.77 0.14 0.00 0.02 0.00 0.00 55.36 54.36 2wf3 s GLN 114 Cb -0.31 -3.65 0.77 0.00 1.00 0.00 0.00 33.01 30.82 2wf3 s GLN 114 CO 0.27 -1.08 1.84 0.00 -2.12 0.00 0.00 175.29 174.20 2wf3 h ARG 115 N 8.15 0.00 0.00 2.91 3.08 -1.94 -1.94 114.38 124.64 2wf3 h ARG 115 Ca -0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2wf3 h ARG 115 Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.10 2wf3 h ARG 115 CO 0.73 0.35 0.00 1.96 -1.07 0.00 0.00 179.97 181.94 2wf3 h GLN 116 N 0.00 0.00 -0.06 0.04 4.20 -2.01 -2.22 115.11 115.06 2wf3 h GLN 116 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2wf3 h GLN 116 Cb 0.63 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.41 2wf3 h GLN 116 CO 0.05 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.49 2wf3 n LEU 117 N -2.36 2.14 -4.37 1.46 4.77 -0.73 -4.84 117.00 113.06 2wf3 n LEU 117 Ca 0.02 -0.75 -0.36 0.00 -0.03 0.00 0.00 56.01 54.89 2wf3 n LEU 117 Cb 0.26 -0.03 -0.13 0.00 -2.33 0.00 0.00 43.42 41.18 2wf3 n LEU 117 CO 0.22 0.38 -0.34 -0.55 -1.33 0.00 0.00 177.39 175.77 2wf3 s SER 118 N -1.92 4.69 0.31 -1.43 0.15 -0.84 -4.12 113.70 110.54 2wf3 s SER 118 Ca 0.34 -0.30 0.26 0.00 0.70 0.00 0.00 55.95 56.94 2wf3 s SER 118 Cb 0.20 -1.82 0.81 0.00 -1.71 0.00 0.00 66.02 63.50 2wf3 s SER 118 CO 0.31 -0.03 1.75 0.77 1.20 0.00 0.00 173.24 177.25 2wf3 h SER 119 N 8.16 0.00 0.10 5.45 4.64 -1.42 -3.03 113.55 127.46 2wf3 h SER 119 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2wf3 h SER 119 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2wf3 h SER 119 CO 0.59 0.00 -0.50 0.35 -0.87 0.00 0.00 176.83 176.40 2wf3 n THR 120 N -2.52 0.00 -1.92 2.95 -2.24 -1.26 -4.93 114.28 104.36 2wf3 n THR 120 Ca 0.04 -0.16 -0.40 0.00 -2.27 0.00 0.00 64.05 61.27 2wf3 n THR 120 Cb 0.39 0.88 0.01 0.00 -2.10 0.00 0.00 70.33 69.51 2wf3 n THR 120 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2wf3 s TYR 121 N -2.62 2.64 -0.04 4.78 5.04 -1.15 -4.52 117.35 121.48 2wf3 s TYR 121 Ca 0.18 1.33 -0.00 0.00 -2.44 0.00 0.00 57.07 56.13 2wf3 s TYR 121 Cb 0.18 -3.81 0.03 0.00 0.35 0.00 0.00 41.96 38.71 2wf3 s TYR 121 CO 0.62 -2.54 0.00 0.50 -1.34 0.00 0.00 175.55 172.79 2wf3 s ARG 122 N -2.33 0.43 0.15 4.97 3.00 -0.21 -4.98 118.95 119.98 2wf3 s ARG 122 Ca 0.58 0.09 -0.30 0.00 -1.00 0.00 0.00 55.73 55.10 2wf3 s ARG 122 Cb -0.41 -0.68 -0.07 0.00 0.00 0.00 0.00 34.95 33.79 2wf3 s ARG 122 CO 0.53 -0.19 0.97 0.34 0.00 0.00 0.00 175.30 176.95 2wf3 s ASP 123 N 1.40 7.51 0.00 -2.12 -1.08 -1.26 -0.78 116.67 120.34 2wf3 s ASP 123 Ca -0.04 1.86 0.24 0.00 -0.52 0.00 0.00 52.55 54.09 2wf3 s ASP 123 Cb -0.13 -2.59 0.36 0.00 -1.46 0.00 0.00 42.92 39.09 2wf3 s ASP 123 CO -0.03 -0.03 1.31 0.18 0.52 0.00 0.00 175.17 177.13 2wf3 n LEU 124 N 2.44 1.22 -3.25 -1.34 4.77 0.11 -4.91 117.00 116.04 2wf3 n LEU 124 Ca 0.01 -0.39 -0.16 0.00 -0.03 0.00 0.00 56.01 55.45 2wf3 n LEU 124 Cb 0.48 -0.09 0.08 0.00 -2.33 0.00 0.00 43.42 41.56 2wf3 n LEU 124 CO 0.51 0.24 0.09 0.54 -1.33 0.00 0.00 177.39 177.44 2wf3 n ARG 125 N -0.74 -5.53 -3.64 3.23 1.74 -1.25 -5.00 116.66 105.48 2wf3 n ARG 125 Ca 0.09 0.80 -0.08 0.00 -0.77 0.00 0.00 57.85 57.89 2wf3 n ARG 125 Cb 0.38 -5.63 -0.07 0.00 -1.02 0.00 0.00 32.46 26.12 2wf3 n ARG 125 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2wf3 s LYS 126 N -5.11 0.67 0.53 5.56 2.47 -1.26 -5.06 119.74 117.53 2wf3 s LYS 126 Ca 0.07 1.04 -0.05 0.00 -1.56 0.00 0.00 55.97 55.47 2wf3 s LYS 126 Cb -0.01 0.20 -0.01 0.00 -1.46 0.00 0.00 37.83 36.55 2wf3 s LYS 126 CO 0.68 -0.12 0.83 0.20 0.16 0.00 0.00 175.35 177.10 2wf3 s GLY 127 N 1.21 1.56 -0.05 5.54 0.00 -1.26 -0.75 107.32 113.57 2wf3 s GLY 127 Ca -0.07 -0.69 -0.11 0.00 0.00 0.00 0.00 44.72 43.85 2wf3 s GLY 127 CO -0.14 -0.47 0.27 0.54 0.00 0.00 0.00 173.10 173.30 2wf3 s VAL 128 N -2.84 0.04 -0.10 1.40 0.11 0.56 -4.82 120.40 114.75 2wf3 s VAL 128 Ca 0.51 -0.29 0.02 0.00 -2.93 0.00 0.00 61.98 59.29 2wf3 s VAL 128 Cb -0.10 -0.49 0.01 0.00 -1.53 0.00 0.00 36.38 34.27 2wf3 s VAL 128 CO 0.44 -0.16 -0.16 -0.47 -3.33 0.00 0.00 175.10 171.42 2wf3 s TYR 129 N -0.65 2.01 -0.18 1.54 5.04 -1.26 -0.88 117.35 122.96 2wf3 s TYR 129 Ca -0.07 -0.91 -0.01 0.00 -2.44 0.00 0.00 57.07 53.63 2wf3 s TYR 129 Cb -0.04 -1.43 0.05 0.00 0.35 0.00 0.00 41.96 40.89 2wf3 s TYR 129 CO 0.02 -0.45 -0.02 0.08 -1.34 0.00 0.00 175.55 173.84 2wf3 s VAL 130 N 0.85 0.94 -0.18 3.14 1.01 -0.29 -4.94 120.40 120.95 2wf3 s VAL 130 Ca -0.09 -0.67 -0.09 0.00 0.00 0.00 0.00 61.98 61.13 2wf3 s VAL 130 Cb -0.15 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 2wf3 s VAL 130 CO 0.00 -0.02 0.12 -2.16 0.00 0.00 0.00 175.10 173.04 2wf3 s PRO 131 N 1.68 3.96 0.33 2.72 0.04 -1.26 -1.91 135.00 140.56 2wf3 s PRO 131 Ca -0.01 -0.22 0.04 0.00 0.04 0.00 0.00 61.00 60.85 2wf3 s PRO 131 Cb -0.16 -3.32 0.04 0.00 0.04 0.00 0.00 34.50 31.10 2wf3 s PRO 131 CO -0.07 0.41 0.35 0.66 0.04 0.00 0.00 177.00 178.39 2wf3 n TYR 132 N 3.14 -1.80 -0.13 0.56 4.01 0.61 -4.99 117.16 118.56 2wf3 n TYR 132 Ca -0.17 -1.28 -0.08 0.00 -0.16 0.00 0.00 57.90 56.20 2wf3 n TYR 132 Cb 0.53 -0.29 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 2wf3 n TYR 132 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2wf3 h THR 133 N 0.32 1.12 -3.35 -0.72 2.02 -2.01 -3.38 112.91 106.92 2wf3 h THR 133 Ca -0.18 -0.25 -0.67 0.00 0.77 0.00 0.00 66.41 66.08 2wf3 h THR 133 Cb 0.73 0.56 -0.33 0.00 -1.74 0.00 0.00 68.15 67.37 2wf3 h THR 133 CO 0.27 0.12 -0.79 -1.58 0.37 0.00 0.00 175.52 173.90 2wf3 s GLN 134 N -6.07 2.94 0.00 6.66 0.74 -1.26 -5.06 119.66 117.61 2wf3 s GLN 134 Ca -0.13 -0.89 0.00 0.00 0.05 0.00 0.00 55.36 54.39 2wf3 s GLN 134 Cb 0.11 -2.82 0.00 0.00 1.10 0.00 0.00 33.01 31.40 2wf3 s GLN 134 CO 0.73 -0.30 0.00 0.41 -0.55 0.00 0.00 175.29 175.57 2wf3 n GLY 135 N 4.65 -0.49 3.38 2.59 0.00 -1.25 -4.86 105.19 109.21 2wf3 n GLY 135 Ca -0.18 -1.67 -0.12 0.00 0.00 0.00 0.00 46.02 44.05 2wf3 n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wf3 s LYS 136 N -2.72 1.13 0.13 1.61 -2.85 -0.77 -0.29 119.74 115.99 2wf3 s LYS 136 Ca 0.00 -0.46 -0.12 0.00 -1.00 0.00 0.00 55.97 54.39 2wf3 s LYS 136 Cb 0.00 0.51 0.01 0.00 -2.06 0.00 0.00 37.83 36.30 2wf3 s LYS 136 CO 0.00 -0.45 0.33 1.67 0.10 0.00 0.00 175.35 176.99 2wf3 s TRP 137 N -3.31 0.06 0.16 1.78 1.48 -0.80 -0.86 118.94 117.45 2wf3 s TRP 137 Ca -0.01 -0.43 0.05 0.00 -1.06 0.00 0.00 56.10 54.66 2wf3 s TRP 137 Cb 0.00 0.11 -0.05 0.00 -1.16 0.00 0.00 33.47 32.37 2wf3 s TRP 137 CO -0.09 -0.69 -0.10 -1.83 -4.06 0.00 0.00 176.95 170.18 2wf3 s GLU 138 N -3.87 1.13 0.00 3.25 -1.05 0.80 -1.13 118.70 117.83 2wf3 s GLU 138 Ca 0.08 -1.49 0.00 0.00 -0.15 0.00 0.00 54.97 53.40 2wf3 s GLU 138 Cb 0.03 -0.71 0.00 0.00 -0.44 0.00 0.00 34.13 33.01 2wf3 s GLU 138 CO -0.07 0.08 0.00 0.41 0.95 0.00 0.00 175.26 176.62 2wf3 n GLY 139 N -0.25 0.78 3.18 -3.83 0.00 -0.06 -1.08 105.19 103.93 2wf3 n GLY 139 Ca -0.09 -0.49 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 2wf3 n GLY 139 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wf3 s GLU 140 N 1.29 2.85 0.34 1.61 2.56 -0.81 -0.32 118.70 126.21 2wf3 s GLU 140 Ca 0.00 -0.81 -0.27 0.00 0.00 0.00 0.00 54.97 53.89 2wf3 s GLU 140 Cb 0.00 -2.19 -0.09 0.00 2.00 0.00 0.00 34.13 33.84 2wf3 s GLU 140 CO 0.00 0.12 1.08 -0.51 -0.56 0.00 0.00 175.26 175.39 2wf3 s LEU 141 N 0.47 4.36 0.00 2.70 1.43 0.07 -0.72 118.68 126.99 2wf3 s LEU 141 Ca -0.16 2.17 -0.08 0.00 -1.03 0.00 0.00 54.13 55.03 2wf3 s LEU 141 Cb -0.17 -3.89 0.03 0.00 0.03 0.00 0.00 46.19 42.19 2wf3 s LEU 141 CO 0.06 -0.32 0.41 0.61 0.23 0.00 0.00 176.35 177.34 2wf3 n GLY 142 N 0.81 1.27 3.11 -3.19 0.00 -0.62 -0.71 105.19 105.85 2wf3 n GLY 142 Ca 0.02 -1.07 -0.08 0.00 0.00 0.00 0.00 46.02 44.89 2wf3 n GLY 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wf3 s THR 143 N -2.47 0.28 0.02 2.61 -4.23 0.04 -0.88 115.64 111.01 2wf3 s THR 143 Ca 0.09 -1.84 -0.29 0.00 -1.18 0.00 0.00 61.69 58.46 2wf3 s THR 143 Cb -0.02 -1.62 0.11 0.00 1.34 0.00 0.00 72.50 72.31 2wf3 s THR 143 CO 0.04 -0.90 1.20 -0.62 -0.54 0.00 0.00 174.62 173.80 2wf3 s ASP 144 N -2.96 -0.09 0.18 3.99 -1.08 -0.81 -1.04 116.67 114.86 2wf3 s ASP 144 Ca 0.10 -0.19 -0.28 0.00 -0.52 0.00 0.00 52.55 51.66 2wf3 s ASP 144 Cb 0.08 0.24 -0.08 0.00 -1.46 0.00 0.00 42.92 41.70 2wf3 s ASP 144 CO -0.07 -0.44 0.87 -0.76 0.52 0.00 0.00 175.17 175.28 2wf3 s LEU 145 N -2.93 4.59 -0.00 -1.34 1.43 -1.26 -1.02 118.68 118.14 2wf3 s LEU 145 Ca 0.13 1.78 0.02 0.00 -1.03 0.00 0.00 54.13 55.03 2wf3 s LEU 145 Cb 0.03 -3.47 -0.00 0.00 0.03 0.00 0.00 46.19 42.78 2wf3 s LEU 145 CO -0.03 0.14 -0.05 -0.69 0.23 0.00 0.00 176.35 175.95 2wf3 s VAL 146 N -0.92 0.41 0.12 -1.59 1.01 0.42 -0.09 120.40 119.76 2wf3 s VAL 146 Ca 0.40 -0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.12 2wf3 s VAL 146 Cb -0.24 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 2wf3 s VAL 146 CO 0.29 0.09 -0.01 -0.44 0.00 0.00 0.00 175.10 175.03 2wf3 s SER 147 N -0.20 0.85 -0.34 3.32 0.01 -0.66 -1.01 113.70 115.68 2wf3 s SER 147 Ca 0.01 -1.10 0.01 0.00 1.31 0.00 0.00 55.95 56.18 2wf3 s SER 147 Cb -0.02 0.17 0.10 0.00 0.21 0.00 0.00 66.02 66.48 2wf3 s SER 147 CO -0.00 -0.58 0.09 -0.63 0.41 0.00 0.00 173.24 172.53 2wf3 s ILE 148 N -3.79 1.49 0.39 1.44 1.01 -1.26 -0.90 121.20 119.58 2wf3 s ILE 148 Ca 0.17 -1.89 0.12 0.00 0.00 0.00 0.00 60.65 59.06 2wf3 s ILE 148 Cb 0.07 -2.11 0.34 0.00 0.01 0.00 0.00 42.46 40.77 2wf3 s ILE 148 CO -0.02 -0.67 1.89 -0.65 0.00 0.00 0.00 174.94 175.50 2wf3 h PRO 149 N 7.77 0.54 -0.63 2.79 0.11 -1.88 -0.76 132.00 139.94 2wf3 h PRO 149 Ca -0.09 -0.03 -0.39 0.00 0.11 0.00 0.00 66.00 65.60 2wf3 h PRO 149 Cb 1.01 -0.12 -0.23 0.00 0.11 0.00 0.00 31.00 31.76 2wf3 h PRO 149 CO 0.50 0.36 0.03 0.72 -0.21 0.00 0.00 178.00 179.39 2wf3 n HIS 150 N -4.52 2.07 -2.69 0.65 8.25 -1.26 -4.93 115.22 112.80 2wf3 n HIS 150 Ca 0.16 -2.04 0.00 0.00 -0.26 0.00 0.00 57.72 55.58 2wf3 n HIS 150 Cb 0.50 -0.70 0.00 0.00 1.12 0.00 0.00 29.99 30.91 2wf3 n HIS 150 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wf3 n GLY 151 N -1.01 6.58 3.73 -1.41 0.00 -0.29 -4.27 105.19 108.52 2wf3 n GLY 151 Ca 0.44 -1.82 -0.35 0.00 0.00 0.00 0.00 46.02 44.30 2wf3 n GLY 151 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wf3 s PRO 152 N 1.31 2.35 -1.20 1.61 0.02 -1.26 -4.89 135.00 132.94 2wf3 s PRO 152 Ca 0.00 1.81 -0.12 0.00 0.02 0.00 0.00 61.00 62.70 2wf3 s PRO 152 Cb 0.00 -1.85 0.19 0.00 0.02 0.00 0.00 34.50 32.86 2wf3 s PRO 152 CO 0.00 -1.68 1.44 1.04 -0.33 0.00 0.00 177.00 177.46 2wf3 n GLN 153 N -2.41 3.44 -4.17 5.54 1.13 -1.26 -4.51 117.38 115.15 2wf3 n GLN 153 Ca 0.14 -3.92 -0.10 0.00 -1.94 0.00 0.00 57.00 51.18 2wf3 n GLN 153 Cb 0.50 -2.95 -0.10 0.00 0.11 0.00 0.00 30.24 27.80 2wf3 n GLN 153 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 2wf3 s VAL 154 N 0.97 0.50 -0.06 5.09 -7.23 -1.26 -5.14 120.40 113.27 2wf3 s VAL 154 Ca 0.41 -1.92 0.01 0.00 -1.81 0.00 0.00 61.98 58.67 2wf3 s VAL 154 Cb -0.02 -1.82 0.02 0.00 0.56 0.00 0.00 36.38 35.12 2wf3 s VAL 154 CO -0.01 -0.73 -0.05 -0.89 -0.31 0.00 0.00 175.10 173.11 2wf3 s THR 155 N -3.76 0.62 0.10 5.32 2.01 -1.26 -4.41 115.64 114.26 2wf3 s THR 155 Ca 0.16 -0.14 0.06 0.00 0.31 0.00 0.00 61.69 62.08 2wf3 s THR 155 Cb 0.06 -0.66 -0.03 0.00 0.01 0.00 0.00 72.50 71.88 2wf3 s THR 155 CO -0.03 0.26 -0.14 0.68 -0.69 0.00 0.00 174.62 174.70 2wf3 s VAL 156 N 1.13 1.25 -0.16 3.82 -7.23 -0.18 -4.92 120.40 114.12 2wf3 s VAL 156 Ca -0.07 -1.58 -0.17 0.00 -1.81 0.00 0.00 61.98 58.35 2wf3 s VAL 156 Cb -0.14 -1.38 -0.04 0.00 0.56 0.00 0.00 36.38 35.38 2wf3 s VAL 156 CO -0.01 -0.35 0.45 -0.60 -0.31 0.00 0.00 175.10 174.28 2wf3 s ARG 157 N -2.36 4.26 0.07 4.82 3.52 -1.26 -0.44 118.95 127.56 2wf3 s ARG 157 Ca 0.05 0.36 0.01 0.00 -0.13 0.00 0.00 55.73 56.02 2wf3 s ARG 157 Cb -0.07 -3.48 -0.04 0.00 -1.56 0.00 0.00 34.95 29.80 2wf3 s ARG 157 CO 0.03 0.05 -0.05 0.00 -0.81 0.00 0.00 175.30 174.52 2wf3 s ALA 158 N 0.98 0.70 0.21 6.12 0.00 -0.19 -4.92 121.76 124.66 2wf3 s ALA 158 Ca 0.23 -1.17 -0.31 0.00 0.00 0.00 0.00 51.96 50.72 2wf3 s ALA 158 Cb -0.15 0.18 -0.10 0.00 0.00 0.00 0.00 23.12 23.05 2wf3 s ALA 158 CO 0.09 -0.25 1.53 -0.80 0.00 0.00 0.00 175.76 176.33 2wf3 s ASN 159 N -2.69 6.57 -0.05 0.00 0.01 -1.26 -1.92 114.94 115.60 2wf3 s ASN 159 Ca 0.05 2.69 0.00 0.00 -0.71 0.00 0.00 52.86 54.89 2wf3 s ASN 159 Cb 0.03 -2.61 0.02 0.00 0.41 0.00 0.00 41.25 39.11 2wf3 s ASN 159 CO -0.06 -0.80 -0.03 -0.63 -1.51 0.00 0.00 177.10 174.08 2wf3 s ILE 160 N 0.58 0.45 -0.20 0.60 1.01 -0.06 -4.66 121.20 118.93 2wf3 s ILE 160 Ca 0.65 -0.03 -0.16 0.00 0.00 0.00 0.00 60.65 61.11 2wf3 s ILE 160 Cb -0.44 -0.52 -0.04 0.00 0.01 0.00 0.00 42.46 41.47 2wf3 s ILE 160 CO 0.38 0.22 0.40 0.00 0.00 0.00 0.00 174.94 175.94 2wf3 s ALA 161 N 1.20 3.55 -0.55 9.38 0.00 -0.35 -1.59 121.76 133.41 2wf3 s ALA 161 Ca -0.07 -0.50 -0.18 0.00 0.00 0.00 0.00 51.96 51.21 2wf3 s ALA 161 Cb -0.14 -2.63 0.10 0.00 0.00 0.00 0.00 23.12 20.46 2wf3 s ALA 161 CO -0.02 -0.27 0.60 0.00 0.00 0.00 0.00 175.76 176.07 2wf3 s ALA 162 N 1.24 3.49 -0.10 0.00 0.00 0.10 -1.35 121.76 125.15 2wf3 s ALA 162 Ca 0.19 -2.21 -0.30 0.00 0.00 0.00 0.00 51.96 49.64 2wf3 s ALA 162 Cb -0.15 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 2wf3 s ALA 162 CO 0.08 -2.12 1.35 0.42 0.00 0.00 0.00 175.76 175.49 2wf3 s ILE 163 N 2.25 4.04 -0.04 0.00 1.01 -0.21 -1.93 121.20 126.31 2wf3 s ILE 163 Ca 0.09 1.31 0.01 0.00 0.00 0.00 0.00 60.65 62.06 2wf3 s ILE 163 Cb -0.25 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.36 2wf3 s ILE 163 CO 0.06 -0.08 0.05 0.35 0.00 0.00 0.00 174.94 175.32 2wf3 n THR 164 N 5.16 0.00 -3.75 2.92 -2.24 -0.24 -1.43 114.28 114.70 2wf3 n THR 164 Ca 0.14 -0.29 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 2wf3 n THR 164 Cb 0.44 0.79 -0.11 0.00 -2.10 0.00 0.00 70.33 69.35 2wf3 n THR 164 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2wf3 s GLU 165 N -1.51 0.38 0.07 -0.78 2.12 -1.03 -4.91 118.70 113.04 2wf3 s GLU 165 Ca 0.00 0.52 -0.13 0.00 0.36 0.00 0.00 54.97 55.72 2wf3 s GLU 165 Cb 0.01 0.13 0.02 0.00 0.26 0.00 0.00 34.13 34.55 2wf3 s GLU 165 CO 0.06 -0.07 0.31 -1.54 -0.54 0.00 0.00 175.26 173.47 2wf3 s SER 166 N 0.45 -0.10 -0.17 -1.70 1.04 -1.26 -0.14 113.70 111.81 2wf3 s SER 166 Ca -0.02 -0.32 -0.03 0.00 0.48 0.00 0.00 55.95 56.06 2wf3 s SER 166 Cb -0.04 0.39 0.06 0.00 0.10 0.00 0.00 66.02 66.52 2wf3 s SER 166 CO -0.02 -0.70 0.04 -0.62 0.98 0.00 0.00 173.24 172.92 2wf3 s ASP 167 N -2.43 2.63 -1.63 7.02 2.15 -0.04 -4.85 116.67 119.52 2wf3 s ASP 167 Ca -0.01 -0.69 0.00 0.00 0.43 0.00 0.00 52.55 52.29 2wf3 s ASP 167 Cb 0.01 -0.50 0.00 0.00 -0.30 0.00 0.00 42.92 42.13 2wf3 s ASP 167 CO -0.07 -0.30 0.00 0.29 -0.17 0.00 0.00 175.17 174.92 2wf3 n LYS 168 N 5.11 -1.48 -0.05 4.34 5.02 -1.26 -1.85 118.16 127.98 2wf3 n LYS 168 Ca -0.08 0.93 -0.05 0.00 -2.02 0.00 0.00 58.31 57.09 2wf3 n LYS 168 Cb 0.48 -5.45 -0.02 0.00 -0.02 0.00 0.00 35.03 30.02 2wf3 n LYS 168 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2wf3 n PHE 169 N -3.91 0.19 -2.24 2.13 7.35 -1.26 -3.83 117.46 115.89 2wf3 n PHE 169 Ca -0.22 0.08 -0.36 0.00 -0.76 0.00 0.00 57.45 56.19 2wf3 n PHE 169 Cb 0.67 -0.39 -0.00 0.00 0.35 0.00 0.00 39.48 40.10 2wf3 n PHE 169 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2wf3 s PHE 170 N -2.02 2.78 -0.16 -5.13 0.40 -1.26 -4.98 117.98 107.61 2wf3 s PHE 170 Ca -0.15 1.54 0.00 0.00 -0.60 0.00 0.00 56.93 57.72 2wf3 s PHE 170 Cb 0.02 -3.36 0.00 0.00 0.51 0.00 0.00 43.02 40.19 2wf3 s PHE 170 CO 0.22 -1.57 -0.15 0.42 0.70 0.00 0.00 175.22 174.83 2wf3 s ILE 171 N -1.62 2.64 -0.19 0.64 1.01 -1.26 -5.02 121.20 117.39 2wf3 s ILE 171 Ca 0.67 -0.77 -0.33 0.00 0.00 0.00 0.00 60.65 60.22 2wf3 s ILE 171 Cb -0.27 -2.12 -0.10 0.00 0.01 0.00 0.00 42.46 39.98 2wf3 s ILE 171 CO 0.32 0.51 2.03 1.67 0.00 0.00 0.00 174.94 179.47 2wf3 n GLN 172 N 4.15 1.81 -1.70 2.79 7.27 -1.26 -2.19 117.38 128.25 2wf3 n GLN 172 Ca -0.19 0.60 -0.01 0.00 0.07 0.00 0.00 57.00 57.47 2wf3 n GLN 172 Cb 0.51 -2.70 -0.00 0.00 2.41 0.00 0.00 30.24 30.46 2wf3 n GLN 172 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2wf3 n GLY 173 N 5.26 0.37 0.13 1.69 0.00 -1.26 -4.95 105.19 106.42 2wf3 n GLY 173 Ca 0.29 -0.91 0.03 0.00 0.00 0.00 0.00 46.02 45.43 2wf3 n GLY 173 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wf3 h SER 174 N 0.00 0.00 0.00 1.61 4.64 -1.77 -3.48 113.55 114.55 2wf3 h SER 174 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2wf3 h SER 174 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2wf3 h SER 174 CO 0.03 0.45 0.00 0.59 -0.87 0.00 0.00 176.83 177.03 2wf3 n ASN 175 N -3.05 -3.19 -4.53 4.97 3.02 -1.26 -4.56 115.26 106.66 2wf3 n ASN 175 Ca -0.02 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.26 2wf3 n ASN 175 Cb 0.74 -1.44 -0.10 0.00 -0.61 0.00 0.00 39.78 38.37 2wf3 n ASN 175 CO 0.00 0.00 0.00 -1.66 -2.62 0.00 0.00 177.26 172.98 2wf3 s TRP 176 N -1.92 2.54 0.00 3.10 1.48 -1.26 -4.64 118.94 118.24 2wf3 s TRP 176 Ca 0.00 -0.26 0.00 0.00 -1.06 0.00 0.00 56.10 54.78 2wf3 s TRP 176 Cb 0.00 -1.24 0.00 0.00 -1.16 0.00 0.00 33.47 31.07 2wf3 s TRP 176 CO 0.00 0.52 0.37 0.39 -4.06 0.00 0.00 176.95 174.16 2wf3 n GLU 177 N 0.06 -0.70 -2.50 3.25 4.71 -0.37 -4.88 120.64 120.21 2wf3 n GLU 177 Ca -0.11 -0.37 -0.03 0.00 -0.01 0.00 0.00 57.16 56.64 2wf3 n GLU 177 Cb 0.56 -0.86 0.01 0.00 -1.01 0.00 0.00 31.44 30.14 2wf3 n GLU 177 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2wf3 n GLY 178 N -0.00 1.24 3.02 0.62 0.00 -1.17 -0.01 105.19 108.89 2wf3 n GLY 178 Ca 0.00 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 2wf3 n GLY 178 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2wf3 s ILE 179 N -2.44 0.00 -0.34 -0.61 2.07 0.44 -0.99 121.20 119.34 2wf3 s ILE 179 Ca 0.10 -0.02 0.01 0.00 -1.41 0.00 0.00 60.65 59.33 2wf3 s ILE 179 Cb -0.02 -0.20 0.09 0.00 0.13 0.00 0.00 42.46 42.45 2wf3 s ILE 179 CO 0.04 -0.01 0.05 -0.22 -1.91 0.00 0.00 174.94 172.90 2wf3 s LEU 180 N 0.04 4.52 -0.38 8.50 2.96 0.27 -1.68 118.68 132.91 2wf3 s LEU 180 Ca -0.00 -1.87 -0.28 0.00 -0.22 0.00 0.00 54.13 51.76 2wf3 s LEU 180 Cb -0.01 -1.67 0.02 0.00 0.50 0.00 0.00 46.19 45.02 2wf3 s LEU 180 CO 0.00 -0.37 1.04 -0.83 -1.32 0.00 0.00 176.35 174.87 2wf3 s GLY 181 N 1.20 1.50 0.00 7.98 0.00 -0.69 -1.03 107.32 116.28 2wf3 s GLY 181 Ca 0.04 -0.31 0.23 0.00 0.00 0.00 0.00 44.72 44.68 2wf3 s GLY 181 CO -0.06 2.21 1.43 1.04 0.00 0.00 0.00 173.10 177.72 2wf3 n LEU 182 N 7.07 3.58 0.00 0.66 4.77 0.20 -4.33 117.00 128.95 2wf3 n LEU 182 Ca 0.10 -1.64 0.00 0.00 -0.03 0.00 0.00 56.01 54.44 2wf3 n LEU 182 Cb 0.48 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2wf3 n LEU 182 CO 0.62 0.81 0.00 0.00 -1.33 0.00 0.00 177.39 177.49 2wf3 n ALA 183 N 1.51 0.00 -2.14 -1.18 0.00 0.35 -4.92 120.51 114.12 2wf3 n ALA 183 Ca 0.20 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.40 2wf3 n ALA 183 Cb 0.60 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.08 2wf3 n ALA 183 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2wf3 s TYR 184 N -0.18 3.16 0.54 0.00 1.51 -0.30 -4.69 117.35 117.39 2wf3 s TYR 184 Ca 0.00 0.39 0.19 0.00 -1.01 0.00 0.00 57.07 56.64 2wf3 s TYR 184 Cb 0.00 -2.63 1.39 0.00 -0.11 0.00 0.00 41.96 40.61 2wf3 s TYR 184 CO 0.00 -0.71 2.15 0.00 -1.11 0.00 0.00 175.55 175.88 2wf3 h ALA 185 N 0.03 1.95 -0.01 3.71 0.00 -1.88 -2.47 119.26 120.58 2wf3 h ALA 185 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2wf3 h ALA 185 Cb 1.27 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2wf3 h ALA 185 CO 0.58 -0.06 0.02 0.93 0.00 0.00 0.00 179.25 180.73 2wf3 h GLU 186 N 0.00 0.00 -0.32 0.00 3.07 -1.86 -0.98 114.58 114.49 2wf3 h GLU 186 Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 2wf3 h GLU 186 Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 2wf3 h GLU 186 CO -0.00 0.00 0.00 0.44 -1.40 0.00 0.00 179.01 178.05 2wf3 n ILE 187 N -3.46 1.16 -2.27 3.13 -5.35 -0.93 -4.73 119.36 106.90 2wf3 n ILE 187 Ca -0.03 -1.11 -0.39 0.00 -0.27 0.00 0.00 62.75 60.95 2wf3 n ILE 187 Cb 0.10 0.41 -0.02 0.00 -1.74 0.00 0.00 39.64 38.39 2wf3 n ILE 187 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wf3 s ALA 188 N -1.22 3.28 0.03 -1.28 0.00 -0.37 -4.64 121.76 117.56 2wf3 s ALA 188 Ca 0.24 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.25 2wf3 s ALA 188 Cb 0.14 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 2wf3 s ALA 188 CO 0.14 -0.52 0.13 1.03 0.00 0.00 0.00 175.76 176.54 2wf3 s ARG 189 N -2.05 3.16 0.31 0.00 1.81 -1.26 -2.69 118.95 118.23 2wf3 s ARG 189 Ca 0.53 -0.50 0.26 0.00 -1.72 0.00 0.00 55.73 54.30 2wf3 s ARG 189 Cb -0.33 -2.91 0.84 0.00 -0.45 0.00 0.00 34.95 32.10 2wf3 s ARG 189 CO 0.43 0.62 1.76 -1.00 -0.68 0.00 0.00 175.30 176.43 2wf3 h PRO 190 N 3.61 0.00 -2.68 3.54 0.13 -1.92 -3.47 132.00 131.22 2wf3 h PRO 190 Ca -0.48 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.76 2wf3 h PRO 190 Cb 1.17 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2wf3 h PRO 190 CO 0.67 0.00 0.47 0.16 -0.23 0.00 0.00 178.00 179.08 2wf3 s ASP 191 N -4.89 -0.01 0.00 1.44 3.84 -1.10 -5.04 116.67 110.91 2wf3 s ASP 191 Ca 0.07 -0.80 0.12 0.00 -0.00 0.00 0.00 52.55 51.94 2wf3 s ASP 191 Cb 0.10 0.62 0.68 0.00 -1.38 0.00 0.00 42.92 42.94 2wf3 s ASP 191 CO 0.55 -1.22 1.24 -0.90 -0.00 0.00 0.00 175.17 174.84 2wf3 n ASP 192 N -1.21 0.00 0.05 2.11 5.68 -1.25 -1.26 116.55 120.66 2wf3 n ASP 192 Ca -0.05 -0.13 0.14 0.00 -0.50 0.00 0.00 54.79 54.24 2wf3 n ASP 192 Cb 0.60 -0.15 0.53 0.00 -1.14 0.00 0.00 41.12 40.96 2wf3 n ASP 192 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2wf3 n SER 193 N -1.15 0.35 -4.49 -1.12 3.41 -1.26 -4.49 113.62 104.87 2wf3 n SER 193 Ca 0.08 0.53 -0.42 0.00 -0.26 0.00 0.00 58.87 58.79 2wf3 n SER 193 Cb 0.07 -0.63 -0.03 0.00 -0.26 0.00 0.00 64.21 63.36 2wf3 n SER 193 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2wf3 s LEU 194 N -3.66 4.01 0.02 1.04 2.96 -0.39 -4.96 118.68 117.70 2wf3 s LEU 194 Ca 0.13 -1.01 -0.30 0.00 -0.22 0.00 0.00 54.13 52.72 2wf3 s LEU 194 Cb 0.16 -2.47 -0.09 0.00 0.50 0.00 0.00 46.19 44.29 2wf3 s LEU 194 CO 0.56 -1.52 1.99 1.21 -1.32 0.00 0.00 176.35 177.27 2wf3 n GLU 195 N 8.18 2.82 -1.39 1.98 2.13 -1.26 -4.88 120.64 128.23 2wf3 n GLU 195 Ca 0.06 1.03 -0.33 0.00 0.66 0.00 0.00 57.16 58.58 2wf3 n GLU 195 Cb 0.47 -3.02 0.09 0.00 0.27 0.00 0.00 31.44 29.26 2wf3 n GLU 195 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 2wf3 s PRO 196 N 4.55 2.20 0.25 5.31 0.02 -1.26 -4.52 135.00 141.55 2wf3 s PRO 196 Ca 0.90 1.49 -0.03 0.00 0.02 0.00 0.00 61.00 63.38 2wf3 s PRO 196 Cb -0.44 -1.87 0.48 0.00 0.02 0.00 0.00 34.50 32.70 2wf3 s PRO 196 CO 0.42 -1.73 1.76 0.35 -0.33 0.00 0.00 177.00 177.46 2wf3 h PHE 197 N -0.60 0.68 -0.14 6.54 3.57 -1.84 -1.98 116.94 123.17 2wf3 h PHE 197 Ca -0.46 0.03 -0.18 0.00 3.53 0.00 0.00 57.97 60.89 2wf3 h PHE 197 Cb 1.26 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.82 2wf3 h PHE 197 CO 0.52 0.16 -0.67 0.35 -2.23 0.00 0.00 178.31 176.44 2wf3 h PHE 198 N 0.57 0.73 -0.83 0.41 3.57 -1.92 0.42 116.94 119.89 2wf3 h PHE 198 Ca 0.43 -0.30 0.01 0.00 3.53 0.00 0.00 57.97 61.65 2wf3 h PHE 198 Cb 0.60 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 2wf3 h PHE 198 CO -0.11 1.06 0.55 -0.44 -2.23 0.00 0.00 178.31 177.14 2wf3 h ASP 199 N 0.40 0.95 -0.39 0.41 3.32 -1.85 -1.28 116.42 117.97 2wf3 h ASP 199 Ca -0.02 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.86 2wf3 h ASP 199 Cb 1.24 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 2wf3 h ASP 199 CO 0.12 0.69 -0.32 0.28 -1.72 0.00 0.00 179.24 178.29 2wf3 h SER 200 N 1.12 0.96 -0.61 6.45 0.02 -0.52 -1.48 113.55 119.49 2wf3 h SER 200 Ca 0.30 -0.45 -0.02 0.00 -0.84 0.00 0.00 61.79 60.78 2wf3 h SER 200 Cb -0.13 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.11 2wf3 h SER 200 CO -0.07 1.21 0.29 0.25 -1.14 0.00 0.00 176.83 177.38 2wf3 h LEU 201 N 0.73 0.79 -0.18 5.07 5.85 -0.64 -0.65 115.31 126.29 2wf3 h LEU 201 Ca 0.07 -0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.60 2wf3 h LEU 201 Cb 0.91 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.73 2wf3 h LEU 201 CO 0.08 0.70 -0.11 0.58 -0.34 0.00 0.00 178.44 179.36 2wf3 h VAL 202 N 0.83 1.32 -0.74 1.05 2.07 -1.01 -2.06 116.25 117.70 2wf3 h VAL 202 Ca 0.21 -1.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 2wf3 h VAL 202 Cb 0.12 1.73 -0.04 0.00 -1.52 0.00 0.00 31.29 31.58 2wf3 h VAL 202 CO -0.03 0.36 0.40 0.11 0.02 0.00 0.00 177.57 178.43 2wf3 h LYS 203 N 0.06 1.03 0.00 1.57 1.57 -1.18 -3.07 116.57 116.55 2wf3 h LYS 203 Ca 0.04 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2wf3 h LYS 203 Cb 0.61 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2wf3 h LYS 203 CO 0.03 0.76 -0.85 1.04 -0.57 0.00 0.00 179.45 179.85 2wf3 n GLN 204 N -4.36 0.20 -4.10 3.15 6.02 -0.26 -4.96 117.38 113.08 2wf3 n GLN 204 Ca 0.07 0.01 -0.22 0.00 -0.01 0.00 0.00 57.00 56.86 2wf3 n GLN 204 Cb 0.10 -1.58 -0.06 0.00 1.02 0.00 0.00 30.24 29.72 2wf3 n GLN 204 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2wf3 n THR 205 N -1.84 0.00 -0.46 5.09 -2.24 -0.79 -5.04 114.28 109.00 2wf3 n THR 205 Ca 0.03 -2.10 0.07 0.00 -2.27 0.00 0.00 64.05 59.77 2wf3 n THR 205 Cb 0.41 0.80 0.33 0.00 -2.10 0.00 0.00 70.33 69.76 2wf3 n THR 205 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2wf3 n HIS 206 N -0.77 1.56 -1.77 4.78 8.25 -1.26 -4.79 115.22 121.22 2wf3 n HIS 206 Ca -0.03 -0.57 -0.42 0.00 -0.26 0.00 0.00 57.72 56.44 2wf3 n HIS 206 Cb 0.54 -0.36 -0.03 0.00 1.12 0.00 0.00 29.99 31.26 2wf3 n HIS 206 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2wf3 s VAL 207 N -2.21 2.74 0.58 1.59 1.01 -1.26 -4.97 120.40 117.88 2wf3 s VAL 207 Ca 0.45 0.17 -0.20 0.00 0.00 0.00 0.00 61.98 62.39 2wf3 s VAL 207 Cb 0.32 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 2wf3 s VAL 207 CO 0.16 -0.00 1.33 -2.84 0.00 0.00 0.00 175.10 173.75 2wf3 s PRO 208 N 2.94 2.93 -1.35 2.72 0.02 -1.26 -4.75 135.00 136.24 2wf3 s PRO 208 Ca 0.80 2.15 -0.12 0.00 0.02 0.00 0.00 61.00 63.84 2wf3 s PRO 208 Cb -0.44 -2.09 -0.05 0.00 0.02 0.00 0.00 34.50 31.94 2wf3 s PRO 208 CO 0.36 -1.33 2.44 -1.71 -0.33 0.00 0.00 177.00 176.43 2wf3 n ASN 209 N -1.36 5.62 -3.56 2.53 5.15 -1.26 -4.25 115.26 118.12 2wf3 n ASN 209 Ca 0.12 -2.65 -0.16 0.00 -0.60 0.00 0.00 54.58 51.30 2wf3 n ASN 209 Cb 0.46 -1.47 -0.06 0.00 -0.53 0.00 0.00 39.78 38.18 2wf3 n ASN 209 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2wf3 s LEU 210 N 1.03 -0.64 0.06 1.20 0.20 -1.26 -1.21 118.68 118.05 2wf3 s LEU 210 Ca 0.56 0.87 -0.04 0.00 0.69 0.00 0.00 54.13 56.20 2wf3 s LEU 210 Cb 0.15 2.41 -0.02 0.00 -0.43 0.00 0.00 46.19 48.30 2wf3 s LEU 210 CO -0.04 -0.47 0.07 0.72 -0.29 0.00 0.00 176.35 176.33 2wf3 s PHE 211 N -0.72 0.32 0.11 5.38 -0.71 -1.03 -0.69 117.98 120.64 2wf3 s PHE 211 Ca -0.06 -0.76 0.07 0.00 -1.04 0.00 0.00 56.93 55.13 2wf3 s PHE 211 Cb -0.02 -0.22 -0.03 0.00 -1.21 0.00 0.00 43.02 41.54 2wf3 s PHE 211 CO 0.06 -0.42 -0.17 -1.12 -1.34 0.00 0.00 175.22 172.23 2wf3 s SER 212 N -2.64 2.22 -0.05 1.98 0.01 0.76 -0.17 113.70 115.81 2wf3 s SER 212 Ca 0.02 -0.72 0.03 0.00 1.31 0.00 0.00 55.95 56.60 2wf3 s SER 212 Cb 0.04 -0.10 0.01 0.00 0.21 0.00 0.00 66.02 66.17 2wf3 s SER 212 CO -0.09 -0.03 -0.13 -0.76 0.41 0.00 0.00 173.24 172.64 2wf3 s LEU 213 N -2.08 1.74 -0.34 2.44 1.43 0.33 -0.73 118.68 121.47 2wf3 s LEU 213 Ca 0.06 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 52.89 2wf3 s LEU 213 Cb -0.08 -0.82 0.10 0.00 0.03 0.00 0.00 46.19 45.42 2wf3 s LEU 213 CO 0.04 0.07 0.08 -1.58 0.23 0.00 0.00 176.35 175.19 2wf3 s GLN 214 N 0.43 1.24 -0.16 1.70 0.74 0.89 -1.29 119.66 123.22 2wf3 s GLN 214 Ca -0.10 -1.65 -0.12 0.00 0.05 0.00 0.00 55.36 53.54 2wf3 s GLN 214 Cb -0.14 -2.79 -0.05 0.00 1.10 0.00 0.00 33.01 31.14 2wf3 s GLN 214 CO 0.03 -0.97 0.23 -0.51 -0.55 0.00 0.00 175.29 173.52 2wf3 s LEU 215 N 1.07 4.26 0.12 3.68 1.43 -1.26 -0.74 118.68 127.24 2wf3 s LEU 215 Ca 0.11 0.44 0.10 0.00 -1.03 0.00 0.00 54.13 53.75 2wf3 s LEU 215 Cb -0.19 -2.26 -0.04 0.00 0.03 0.00 0.00 46.19 43.73 2wf3 s LEU 215 CO -0.13 0.18 -0.22 0.00 0.23 0.00 0.00 176.35 176.41 2wf3 s GLY 217 N -2.04 1.98 0.20 0.00 0.00 -1.26 -4.01 107.32 102.19 2wf3 s GLY 217 Ca 0.16 -0.73 -0.13 0.00 0.00 0.00 0.00 44.72 44.02 2wf3 s GLY 217 CO 0.08 -0.39 1.66 0.00 0.00 0.00 0.00 173.10 174.45 2wf3 h ALA 229 N 5.34 0.49 -2.51 3.20 0.00 -1.99 -3.45 119.26 120.35 2wf3 h ALA 229 Ca -0.50 0.18 -0.48 0.00 0.00 0.00 0.00 54.91 54.11 2wf3 h ALA 229 Cb 1.20 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2wf3 h ALA 229 CO 0.58 -0.40 0.39 -1.54 0.00 0.00 0.00 179.25 178.29 2wf3 s SER 230 N -5.24 7.01 0.38 0.00 1.04 -1.26 -1.50 113.70 114.13 2wf3 s SER 230 Ca -0.14 1.99 0.04 0.00 0.48 0.00 0.00 55.95 58.32 2wf3 s SER 230 Cb 0.17 -2.59 -0.03 0.00 0.10 0.00 0.00 66.02 63.68 2wf3 s SER 230 CO 0.73 -0.31 0.14 0.68 0.98 0.00 0.00 173.24 175.45 2wf3 s VAL 231 N -1.60 0.58 0.12 5.02 -7.23 -0.43 -4.90 120.40 111.96 2wf3 s VAL 231 Ca 0.54 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.67 2wf3 s VAL 231 Cb -0.22 -2.42 0.02 0.00 0.56 0.00 0.00 36.38 34.32 2wf3 s VAL 231 CO 0.27 0.00 0.24 0.61 -0.31 0.00 0.00 175.10 175.91 2wf3 n GLY 232 N -0.83 1.89 0.00 2.32 0.00 -1.26 -1.72 105.19 105.60 2wf3 n GLY 232 Ca -0.04 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2wf3 n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wf3 n GLY 233 N -0.18 -0.86 2.87 -0.02 0.00 -0.72 -1.25 105.19 105.04 2wf3 n GLY 233 Ca -0.02 -1.28 -0.15 0.00 0.00 0.00 0.00 46.02 44.57 2wf3 n GLY 233 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wf3 s SER 234 N -4.00 0.37 -0.29 1.61 0.01 0.09 -0.72 113.70 110.78 2wf3 s SER 234 Ca 0.00 -0.04 -0.06 0.00 1.31 0.00 0.00 55.95 57.16 2wf3 s SER 234 Cb 0.00 -0.12 0.01 0.00 0.21 0.00 0.00 66.02 66.12 2wf3 s SER 234 CO 0.00 -0.03 0.06 -0.32 0.41 0.00 0.00 173.24 173.36 2wf3 s MET 235 N 0.42 3.07 -0.38 12.44 1.75 -1.26 -0.07 119.30 135.26 2wf3 s MET 235 Ca -0.04 -0.86 -0.12 0.00 -1.25 0.00 0.00 55.69 53.42 2wf3 s MET 235 Cb -0.07 -3.30 0.03 0.00 2.84 0.00 0.00 34.83 34.32 2wf3 s MET 235 CO -0.01 -0.43 0.22 0.42 -0.65 0.00 0.00 175.02 174.58 2wf3 s ILE 236 N 1.47 4.70 -0.13 10.11 -1.09 0.09 -4.84 121.20 131.50 2wf3 s ILE 236 Ca 0.02 -0.83 -0.19 0.00 -2.23 0.00 0.00 60.65 57.42 2wf3 s ILE 236 Cb -0.17 -3.62 -0.04 0.00 -1.58 0.00 0.00 42.46 37.05 2wf3 s ILE 236 CO 0.01 -0.25 0.53 -0.63 -1.23 0.00 0.00 174.94 173.37 2wf3 s ILE 237 N 1.58 5.14 0.00 2.92 1.01 -1.26 -0.17 121.20 130.42 2wf3 s ILE 237 Ca 0.03 1.04 0.00 0.00 0.00 0.00 0.00 60.65 61.71 2wf3 s ILE 237 Cb -0.19 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.42 2wf3 s ILE 237 CO 0.07 0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.90 2wf3 n GLY 238 N 3.39 0.80 0.00 6.18 0.00 0.14 -4.85 105.19 110.85 2wf3 n GLY 238 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2wf3 n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wf3 n GLY 239 N -2.00 1.62 2.94 -0.02 0.00 -1.26 -4.33 105.19 102.14 2wf3 n GLY 239 Ca 0.00 -0.51 -0.22 0.00 0.00 0.00 0.00 46.02 45.29 2wf3 n GLY 239 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wf3 s ILE 240 N -1.77 0.80 -0.42 -0.61 1.01 -1.26 -4.15 121.20 114.80 2wf3 s ILE 240 Ca 0.00 -0.26 -0.07 0.00 0.00 0.00 0.00 60.65 60.31 2wf3 s ILE 240 Cb 0.00 -0.79 0.09 0.00 0.01 0.00 0.00 42.46 41.78 2wf3 s ILE 240 CO 0.00 0.29 0.25 -0.62 0.00 0.00 0.00 174.94 174.86 2wf3 s ASP 241 N 0.94 5.52 0.62 3.58 3.68 -1.26 -4.94 116.67 124.81 2wf3 s ASP 241 Ca -0.10 -1.69 0.40 0.00 2.13 0.00 0.00 52.55 53.29 2wf3 s ASP 241 Cb -0.15 -1.94 2.17 0.00 -1.45 0.00 0.00 42.92 41.55 2wf3 s ASP 241 CO 0.00 -0.55 2.22 0.45 0.13 0.00 0.00 175.17 177.42 2wf3 h HIS 242 N 8.31 0.00 0.00 -5.34 3.86 -1.99 -0.26 115.15 119.74 2wf3 h HIS 242 Ca -0.20 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.01 2wf3 h HIS 242 Cb 1.07 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.54 2wf3 h HIS 242 CO 0.61 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 178.27 2wf3 n SER 243 N -2.94 0.00 -0.90 2.45 3.41 -1.26 -3.06 113.62 111.32 2wf3 n SER 243 Ca -0.03 -0.22 0.11 0.00 -0.26 0.00 0.00 58.87 58.48 2wf3 n SER 243 Cb 0.10 -0.25 0.09 0.00 -0.26 0.00 0.00 64.21 63.90 2wf3 n SER 243 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2wf3 n LEU 244 N -1.25 2.88 -3.75 1.04 4.77 -0.11 -4.77 117.00 115.82 2wf3 n LEU 244 Ca 0.14 -1.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.02 2wf3 n LEU 244 Cb 0.20 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.24 2wf3 n LEU 244 CO 0.21 0.49 0.06 -0.72 -1.33 0.00 0.00 177.39 176.09 2wf3 s TYR 245 N -1.88 -0.02 0.27 -1.77 1.13 -1.17 -1.03 117.35 112.88 2wf3 s TYR 245 Ca 0.26 -0.34 0.11 0.00 -1.41 0.00 0.00 57.07 55.69 2wf3 s TYR 245 Cb 0.19 0.13 -0.05 0.00 -1.10 0.00 0.00 41.96 41.13 2wf3 s TYR 245 CO 0.28 -0.66 -0.15 0.95 -2.51 0.00 0.00 175.55 173.46 2wf3 s THR 246 N -3.84 2.72 0.00 -3.49 -4.23 -0.71 -4.84 115.64 101.24 2wf3 s THR 246 Ca 0.05 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.31 2wf3 s THR 246 Cb 0.03 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.44 2wf3 s THR 246 CO -0.10 -0.37 0.00 0.61 -0.54 0.00 0.00 174.62 174.22 2wf3 n GLY 247 N -0.62 0.72 3.88 3.99 0.00 -1.26 -3.81 105.19 108.09 2wf3 n GLY 247 Ca -0.06 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.91 2wf3 n GLY 247 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wf3 s SER 248 N -4.00 6.59 -0.23 1.61 0.01 -1.26 -4.99 113.70 111.43 2wf3 s SER 248 Ca 0.00 0.81 -0.18 0.00 1.31 0.00 0.00 55.95 57.89 2wf3 s SER 248 Cb 0.00 -2.18 -0.03 0.00 0.21 0.00 0.00 66.02 64.02 2wf3 s SER 248 CO 0.00 -0.01 0.49 -0.76 0.41 0.00 0.00 173.24 173.37 2wf3 s LEU 249 N -2.69 4.10 -0.12 2.44 1.43 -1.26 -4.46 118.68 118.13 2wf3 s LEU 249 Ca 0.44 0.56 -0.01 0.00 -1.03 0.00 0.00 54.13 54.10 2wf3 s LEU 249 Cb -0.12 -2.64 -0.02 0.00 0.03 0.00 0.00 46.19 43.44 2wf3 s LEU 249 CO 0.22 -0.20 -0.09 0.26 0.23 0.00 0.00 176.35 176.77 2wf3 s TRP 250 N 1.87 2.90 -0.13 0.29 0.52 -0.32 -4.90 118.94 119.17 2wf3 s TRP 250 Ca 0.21 -0.33 -0.03 0.00 0.02 0.00 0.00 56.10 55.97 2wf3 s TRP 250 Cb -0.15 -1.83 -0.03 0.00 -1.15 0.00 0.00 33.47 30.30 2wf3 s TRP 250 CO 0.09 0.01 -0.01 0.71 0.02 0.00 0.00 176.95 177.77 2wf3 s TYR 251 N -0.02 3.10 -0.05 -1.98 1.51 -1.26 -0.19 117.35 118.46 2wf3 s TYR 251 Ca -0.01 -0.05 0.05 0.00 -1.01 0.00 0.00 57.07 56.05 2wf3 s TYR 251 Cb -0.14 -1.90 -0.02 0.00 -0.11 0.00 0.00 41.96 39.79 2wf3 s TYR 251 CO 0.03 0.19 -0.19 -0.08 -1.11 0.00 0.00 175.55 174.39 2wf3 s THR 252 N -0.15 2.62 0.45 -0.71 -1.32 0.65 -3.78 115.64 113.40 2wf3 s THR 252 Ca 0.04 -0.88 -0.23 0.00 -1.21 0.00 0.00 61.69 59.41 2wf3 s THR 252 Cb -0.13 -1.99 -0.07 0.00 -1.51 0.00 0.00 72.50 68.80 2wf3 s THR 252 CO 0.02 0.58 1.17 -2.84 -2.21 0.00 0.00 174.62 171.34 2wf3 s PRO 253 N -0.51 3.78 -0.38 7.08 0.02 -1.26 -0.29 135.00 143.45 2wf3 s PRO 253 Ca 0.07 1.78 -0.28 0.00 0.02 0.00 0.00 61.00 62.59 2wf3 s PRO 253 Cb -0.11 -2.43 0.02 0.00 0.02 0.00 0.00 34.50 31.99 2wf3 s PRO 253 CO 0.01 -0.53 1.05 0.42 -0.33 0.00 0.00 177.00 177.61 2wf3 s ILE 254 N -1.53 4.45 0.25 2.83 1.01 0.07 -4.59 121.20 123.69 2wf3 s ILE 254 Ca 0.63 1.44 -0.00 0.00 0.00 0.00 0.00 60.65 62.72 2wf3 s ILE 254 Cb -0.29 -4.44 0.04 0.00 0.01 0.00 0.00 42.46 37.78 2wf3 s ILE 254 CO 0.35 -0.64 1.67 -0.09 0.00 0.00 0.00 174.94 176.23 2wf3 h ARG 255 N 8.50 0.58 -2.35 2.79 2.43 -1.35 -3.44 114.38 121.54 2wf3 h ARG 255 Ca -0.22 -0.24 -0.05 0.00 -0.81 0.00 0.00 59.98 58.66 2wf3 h ARG 255 Cb 1.07 -0.02 -0.24 0.00 -0.42 0.00 0.00 29.97 30.35 2wf3 h ARG 255 CO 1.04 0.80 -0.17 0.50 -1.51 0.00 0.00 179.97 180.63 2wf3 s ARG 256 N -4.47 0.52 -1.17 0.20 3.52 -1.26 -5.08 118.95 111.22 2wf3 s ARG 256 Ca -0.08 1.01 -0.20 0.00 -0.13 0.00 0.00 55.73 56.33 2wf3 s ARG 256 Cb 0.13 0.10 0.06 0.00 -1.56 0.00 0.00 34.95 33.69 2wf3 s ARG 256 CO 0.81 -0.16 1.59 -1.21 -0.81 0.00 0.00 175.30 175.52 2wf3 s GLU 257 N 1.64 3.80 0.00 5.12 2.02 -1.26 -3.97 118.70 126.06 2wf3 s GLU 257 Ca -0.09 -1.60 0.00 0.00 0.02 0.00 0.00 54.97 53.30 2wf3 s GLU 257 Cb -0.07 -5.44 0.00 0.00 0.10 0.00 0.00 34.13 28.71 2wf3 s GLU 257 CO -0.16 -2.22 0.00 -2.67 0.02 0.00 0.00 175.26 170.23 2wf3 n TRP 258 N 8.55 0.00 -1.38 1.61 4.27 -1.26 -4.63 117.44 124.60 2wf3 n TRP 258 Ca 0.41 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.73 2wf3 n TRP 258 Cb 0.48 0.00 0.13 0.00 -1.36 0.00 0.00 31.31 30.57 2wf3 n TRP 258 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 2wf3 s TYR 259 N 0.00 2.45 -1.15 -2.67 2.02 -1.26 -1.15 117.35 115.59 2wf3 s TYR 259 Ca 0.00 1.05 -0.21 0.00 -0.37 0.00 0.00 57.07 57.53 2wf3 s TYR 259 Cb 0.00 -3.24 0.01 0.00 -0.40 0.00 0.00 41.96 38.32 2wf3 s TYR 259 CO 0.00 -2.35 1.76 0.71 -1.57 0.00 0.00 175.55 174.10 2wf3 s TYR 260 N -3.10 2.36 -0.06 2.71 1.51 -1.26 -4.83 117.35 114.69 2wf3 s TYR 260 Ca 0.63 -0.57 -0.23 0.00 -1.01 0.00 0.00 57.07 55.89 2wf3 s TYR 260 Cb -0.16 -4.44 -0.04 0.00 -0.11 0.00 0.00 41.96 37.21 2wf3 s TYR 260 CO 0.55 -1.66 0.69 -2.00 -1.11 0.00 0.00 175.55 172.02 2wf3 s GLU 261 N 5.39 4.43 0.36 -0.62 2.12 -1.25 -1.79 118.70 127.35 2wf3 s GLU 261 Ca 0.58 0.87 0.04 0.00 0.36 0.00 0.00 54.97 56.82 2wf3 s GLU 261 Cb 0.00 -3.44 -0.03 0.00 0.26 0.00 0.00 34.13 30.92 2wf3 s GLU 261 CO 0.04 0.09 0.13 0.14 -0.54 0.00 0.00 175.26 175.13 2wf3 s VAL 262 N 0.70 0.59 -0.15 3.70 -7.23 0.38 -0.93 120.40 117.46 2wf3 s VAL 262 Ca 0.37 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.56 2wf3 s VAL 262 Cb -0.18 -2.47 0.01 0.00 0.56 0.00 0.00 36.38 34.30 2wf3 s VAL 262 CO 0.18 0.00 -0.21 -0.63 -0.31 0.00 0.00 175.10 174.13 2wf3 s ILE 263 N -3.35 2.10 -0.17 -0.62 -1.09 -1.26 -4.01 121.20 112.80 2wf3 s ILE 263 Ca 0.30 -0.96 -0.16 0.00 -2.23 0.00 0.00 60.65 57.60 2wf3 s ILE 263 Cb 0.04 -1.85 -0.04 0.00 -1.58 0.00 0.00 42.46 39.03 2wf3 s ILE 263 CO 0.16 0.55 0.39 -0.63 -1.23 0.00 0.00 174.94 174.18 2wf3 s ILE 264 N 0.88 5.22 -0.35 2.92 1.01 -1.26 -1.03 121.20 128.60 2wf3 s ILE 264 Ca -0.05 0.73 0.12 0.00 0.00 0.00 0.00 60.65 61.45 2wf3 s ILE 264 Cb -0.15 -3.73 -0.16 0.00 0.01 0.00 0.00 42.46 38.43 2wf3 s ILE 264 CO -0.03 0.30 0.42 1.33 0.00 0.00 0.00 174.94 176.96 2wf3 n VAL 265 N 4.01 0.00 -3.57 2.92 0.24 0.26 -4.72 118.33 117.46 2wf3 n VAL 265 Ca -0.09 -0.24 -0.12 0.00 -2.04 0.00 0.00 64.34 61.85 2wf3 n VAL 265 Cb 0.51 0.67 -0.05 0.00 -1.47 0.00 0.00 33.84 33.50 2wf3 n VAL 265 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2wf3 s ARG 266 N -2.46 0.68 -0.07 7.34 3.52 -1.22 -4.78 118.95 121.95 2wf3 s ARG 266 Ca 0.01 0.22 0.01 0.00 -0.13 0.00 0.00 55.73 55.84 2wf3 s ARG 266 Cb 0.09 0.32 0.02 0.00 -1.56 0.00 0.00 34.95 33.82 2wf3 s ARG 266 CO 0.51 -0.20 -0.08 0.08 -0.81 0.00 0.00 175.30 174.81 2wf3 s VAL 267 N -0.98 0.84 0.00 7.11 1.01 -1.26 -0.81 120.40 126.31 2wf3 s VAL 267 Ca -0.03 -0.27 0.08 0.00 0.00 0.00 0.00 61.98 61.76 2wf3 s VAL 267 Cb -0.01 -0.83 -0.02 0.00 0.00 0.00 0.00 36.38 35.52 2wf3 s VAL 267 CO 0.03 0.30 -0.26 -1.61 0.00 0.00 0.00 175.10 173.56 2wf3 s GLU 268 N 1.06 1.96 -0.21 2.72 2.02 -0.44 -0.83 118.70 124.98 2wf3 s GLU 268 Ca -0.08 -0.98 -0.01 0.00 0.02 0.00 0.00 54.97 53.92 2wf3 s GLU 268 Cb -0.14 -1.98 0.02 0.00 0.10 0.00 0.00 34.13 32.12 2wf3 s GLU 268 CO -0.01 0.53 -0.12 0.42 0.02 0.00 0.00 175.26 176.11 2wf3 s ILE 269 N -0.67 2.63 -1.31 -1.63 -1.09 0.36 -0.60 121.20 118.89 2wf3 s ILE 269 Ca 0.10 -0.87 -0.16 0.00 -2.23 0.00 0.00 60.65 57.49 2wf3 s ILE 269 Cb -0.10 -2.21 0.01 0.00 -1.58 0.00 0.00 42.46 38.58 2wf3 s ILE 269 CO 0.00 0.40 0.51 -3.20 -1.23 0.00 0.00 174.94 171.42 2wf3 n ASN 270 N 4.67 -2.50 0.00 3.58 5.15 -0.10 -0.93 115.26 125.14 2wf3 n ASN 270 Ca -0.19 -1.16 0.00 0.00 -0.60 0.00 0.00 54.58 52.64 2wf3 n ASN 270 Cb 0.49 -2.41 0.00 0.00 -0.53 0.00 0.00 39.78 37.33 2wf3 n ASN 270 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2wf3 n GLY 271 N -2.06 2.73 3.58 8.20 0.00 -1.26 -4.97 105.19 111.41 2wf3 n GLY 271 Ca -0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 2wf3 n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wf3 s GLN 272 N 0.00 3.89 0.17 1.61 -1.52 -0.10 -4.99 119.66 118.71 2wf3 s GLN 272 Ca 0.00 -0.29 -0.33 0.00 -1.95 0.00 0.00 55.36 52.79 2wf3 s GLN 272 Cb 0.00 -3.69 -0.15 0.00 -0.22 0.00 0.00 33.01 28.95 2wf3 s GLN 272 CO 0.00 -0.25 1.32 -3.47 -0.25 0.00 0.00 175.29 172.63 2wf3 n ASP 273 N 5.15 1.98 0.00 5.90 -0.08 -1.26 -0.48 116.55 127.75 2wf3 n ASP 273 Ca -0.12 1.13 0.08 0.00 -1.51 0.00 0.00 54.79 54.36 2wf3 n ASP 273 Cb 0.51 -1.29 0.34 0.00 2.34 0.00 0.00 41.12 43.02 2wf3 n ASP 273 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2wf3 n LEU 274 N 2.36 0.00 -3.43 -2.67 4.77 -0.01 -4.87 117.00 113.14 2wf3 n LEU 274 Ca 0.15 0.49 -0.17 0.00 -0.03 0.00 0.00 56.01 56.45 2wf3 n LEU 274 Cb 0.25 -0.49 0.03 0.00 -2.33 0.00 0.00 43.42 40.88 2wf3 n LEU 274 CO 0.62 -0.23 0.05 0.29 -1.33 0.00 0.00 177.39 176.80 2wf3 n LYS 275 N -1.49 -1.46 -4.02 3.23 5.02 -1.26 -4.99 118.16 113.18 2wf3 n LYS 275 Ca 0.04 0.92 -0.12 0.00 -2.02 0.00 0.00 58.31 57.14 2wf3 n LYS 275 Cb 0.18 -4.59 -0.12 0.00 -0.02 0.00 0.00 35.03 30.49 2wf3 n LYS 275 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 2wf3 s MET 276 N -4.55 0.38 0.18 1.97 1.75 -1.26 -5.11 119.30 112.66 2wf3 s MET 276 Ca 0.23 -0.57 -0.33 0.00 -1.25 0.00 0.00 55.69 53.76 2wf3 s MET 276 Cb -0.07 -0.12 -0.13 0.00 2.84 0.00 0.00 34.83 37.36 2wf3 s MET 276 CO 0.81 0.01 1.65 -3.47 -0.65 0.00 0.00 175.02 173.38 2wf3 n ASP 277 N 1.81 3.54 0.29 1.11 -0.08 -1.26 -4.84 116.55 117.12 2wf3 n ASP 277 Ca -0.21 1.07 0.16 0.00 -1.51 0.00 0.00 54.79 54.30 2wf3 n ASP 277 Cb 0.56 -1.50 0.85 0.00 2.34 0.00 0.00 41.12 43.37 2wf3 n ASP 277 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2wf3 h LYS 279 N 0.00 0.00 0.00 0.00 1.57 -1.85 -0.55 116.57 115.74 2wf3 h LYS 279 Ca -0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2wf3 h LYS 279 Cb 0.27 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.57 2wf3 h LYS 279 CO 0.01 0.00 -0.15 0.93 -0.57 0.00 0.00 179.45 179.67 2wf3 h GLU 280 N 0.00 0.00 0.00 3.15 4.39 -1.24 -1.05 114.58 119.83 2wf3 h GLU 280 Ca 0.14 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.80 2wf3 h GLU 280 Cb 0.62 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 2wf3 h GLU 280 CO -0.00 0.15 -0.17 1.88 -1.16 0.00 0.00 179.01 179.71 2wf3 h TYR 281 N 0.00 0.00 -0.12 4.33 0.99 -1.26 -3.01 116.97 117.90 2wf3 h TYR 281 Ca -0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 2wf3 h TYR 281 Cb 0.28 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.01 2wf3 h TYR 281 CO 0.00 0.17 -0.02 0.09 -0.00 0.00 0.00 178.16 178.41 2wf3 n ASN 282 N -3.36 2.99 -4.57 3.88 3.02 -0.44 -4.46 115.26 112.32 2wf3 n ASN 282 Ca 0.00 -3.11 -0.43 0.00 -0.03 0.00 0.00 54.58 51.01 2wf3 n ASN 282 Cb 0.39 -0.49 -0.04 0.00 -0.61 0.00 0.00 39.78 39.03 2wf3 n ASN 282 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2wf3 s TYR 283 N -2.89 2.93 -0.76 3.10 6.04 -0.96 -0.53 117.35 124.27 2wf3 s TYR 283 Ca 0.37 0.41 0.08 0.00 0.04 0.00 0.00 57.07 57.97 2wf3 s TYR 283 Cb 0.31 -3.96 0.18 0.00 -1.04 0.00 0.00 41.96 37.46 2wf3 s TYR 283 CO 0.05 -1.09 1.08 -0.40 -1.54 0.00 0.00 175.55 173.65 2wf3 n ASP 284 N 7.15 2.42 -3.54 4.32 5.75 -1.26 -3.33 116.55 128.06 2wf3 n ASP 284 Ca 0.06 -1.83 -0.07 0.00 -0.01 0.00 0.00 54.79 52.94 2wf3 n ASP 284 Cb 0.48 -0.13 -0.02 0.00 -1.03 0.00 0.00 41.12 40.43 2wf3 n ASP 284 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2wf3 s LYS 285 N -0.92 0.77 -0.08 0.11 -2.85 0.30 -4.66 119.74 112.41 2wf3 s LYS 285 Ca 0.15 -0.30 0.02 0.00 -1.00 0.00 0.00 55.97 54.84 2wf3 s LYS 285 Cb 0.08 0.34 0.01 0.00 -2.06 0.00 0.00 37.83 36.21 2wf3 s LYS 285 CO 0.11 -0.34 -0.16 -1.12 0.10 0.00 0.00 175.35 173.95 2wf3 s SER 286 N -2.49 2.25 0.16 0.03 0.01 -1.26 -0.48 113.70 111.92 2wf3 s SER 286 Ca 0.06 -0.39 0.06 0.00 1.31 0.00 0.00 55.95 57.00 2wf3 s SER 286 Cb -0.01 -1.03 -0.04 0.00 0.21 0.00 0.00 66.02 65.15 2wf3 s SER 286 CO -0.07 0.06 -0.14 0.27 0.41 0.00 0.00 173.24 173.77 2wf3 s ILE 287 N 0.68 1.47 -0.33 1.44 -4.36 -0.63 -0.47 121.20 118.99 2wf3 s ILE 287 Ca -0.13 -1.98 -0.08 0.00 -0.26 0.00 0.00 60.65 58.20 2wf3 s ILE 287 Cb -0.16 -1.80 0.02 0.00 1.25 0.00 0.00 42.46 41.77 2wf3 s ILE 287 CO 0.04 -0.54 0.13 -0.69 0.24 0.00 0.00 174.94 174.11 2wf3 s VAL 288 N -2.68 4.14 -0.34 8.37 1.01 -0.74 -0.72 120.40 129.43 2wf3 s VAL 288 Ca 0.16 -0.85 -0.00 0.00 0.00 0.00 0.00 61.98 61.28 2wf3 s VAL 288 Cb -0.02 -3.25 0.11 0.00 0.00 0.00 0.00 36.38 33.23 2wf3 s VAL 288 CO 0.04 -0.09 0.14 -0.62 0.00 0.00 0.00 175.10 174.57 2wf3 s ASP 289 N 1.49 3.85 0.27 3.32 -1.08 -0.55 -4.44 116.67 119.53 2wf3 s ASP 289 Ca 0.01 -1.87 0.23 0.00 -0.52 0.00 0.00 52.55 50.41 2wf3 s ASP 289 Cb -0.18 -0.84 1.02 0.00 -1.46 0.00 0.00 42.92 41.46 2wf3 s ASP 289 CO 0.04 -0.38 1.70 -1.54 0.52 0.00 0.00 175.17 175.51 2wf3 n SER 290 N 4.54 0.65 -0.25 -0.34 3.41 -1.26 -2.72 113.62 117.65 2wf3 n SER 290 Ca 0.01 0.68 0.14 0.00 -0.26 0.00 0.00 58.87 59.44 2wf3 n SER 290 Cb 0.40 -0.81 0.48 0.00 -0.26 0.00 0.00 64.21 64.02 2wf3 n SER 290 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wf3 n GLY 291 N -0.25 -0.58 3.50 5.00 0.00 -1.26 -4.55 105.19 107.06 2wf3 n GLY 291 Ca 0.01 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.33 2wf3 n GLY 291 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wf3 s THR 292 N -2.38 3.47 -0.05 2.61 2.01 -1.10 -4.97 115.64 115.23 2wf3 s THR 292 Ca 0.29 -0.55 -0.26 0.00 0.31 0.00 0.00 61.69 61.48 2wf3 s THR 292 Cb 0.20 -2.43 -0.21 0.00 0.01 0.00 0.00 72.50 70.07 2wf3 s THR 292 CO 0.47 0.56 1.11 0.74 -0.69 0.00 0.00 174.62 176.81 2wf3 h THR 293 N 4.66 1.40 -3.15 -0.82 2.02 -1.87 0.16 112.91 115.31 2wf3 h THR 293 Ca -0.40 -1.39 -0.47 0.00 0.77 0.00 0.00 66.41 64.92 2wf3 h THR 293 Cb 1.18 2.33 0.04 0.00 -1.74 0.00 0.00 68.15 69.96 2wf3 h THR 293 CO 0.54 0.35 0.03 0.20 0.37 0.00 0.00 175.52 177.01 2wf3 s ASN 294 N -5.77 5.73 -0.27 4.18 0.01 -1.26 -1.77 114.94 115.79 2wf3 s ASN 294 Ca -0.16 0.48 -0.29 0.00 -0.71 0.00 0.00 52.86 52.18 2wf3 s ASN 294 Cb 0.00 -1.61 -0.01 0.00 0.41 0.00 0.00 41.25 40.05 2wf3 s ASN 294 CO 0.65 -0.86 1.34 -0.22 -1.51 0.00 0.00 177.10 176.51 2wf3 s LEU 295 N -4.75 3.93 -0.12 0.60 2.96 -0.45 -2.49 118.68 118.37 2wf3 s LEU 295 Ca 0.51 1.35 -0.03 0.00 -0.22 0.00 0.00 54.13 55.74 2wf3 s LEU 295 Cb -0.10 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.02 2wf3 s LEU 295 CO 0.41 -1.06 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.25 2wf3 s ARG 296 N 4.14 3.28 0.01 1.98 0.52 -0.39 -0.86 118.95 127.64 2wf3 s ARG 296 Ca 0.58 -0.44 0.06 0.00 -0.52 0.00 0.00 55.73 55.41 2wf3 s ARG 296 Cb -0.19 -2.87 -0.02 0.00 0.52 0.00 0.00 34.95 32.40 2wf3 s ARG 296 CO 0.23 0.52 -0.17 -0.51 0.02 0.00 0.00 175.30 175.39 2wf3 s LEU 297 N -0.39 2.10 0.43 2.53 1.43 0.13 -1.25 118.68 123.67 2wf3 s LEU 297 Ca 0.07 -0.39 -0.24 0.00 -1.03 0.00 0.00 54.13 52.54 2wf3 s LEU 297 Cb -0.12 -0.81 -0.10 0.00 0.03 0.00 0.00 46.19 45.19 2wf3 s LEU 297 CO 0.02 0.15 1.03 -2.65 0.23 0.00 0.00 176.35 175.13 2wf3 n PRO 298 N 2.28 1.38 -0.34 1.29 -0.02 -1.26 0.35 135.00 138.68 2wf3 n PRO 298 Ca -0.16 0.50 0.19 0.00 -2.02 0.00 0.00 63.50 62.00 2wf3 n PRO 298 Cb 0.54 -2.09 0.42 0.00 -0.02 0.00 0.00 33.50 32.36 2wf3 n PRO 298 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2wf3 h LYS 299 N 1.52 0.52 -0.17 -0.52 3.64 -1.94 0.96 116.57 120.59 2wf3 h LYS 299 Ca -0.45 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 58.71 2wf3 h LYS 299 Cb 1.33 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2wf3 h LYS 299 CO 0.57 0.34 -0.67 -0.22 -2.27 0.00 0.00 179.45 177.20 2wf3 h LYS 300 N 0.54 0.66 -0.14 1.90 3.64 -1.93 0.28 116.57 121.50 2wf3 h LYS 300 Ca 0.61 -0.48 -0.14 0.00 -1.27 0.00 0.00 60.65 59.38 2wf3 h LYS 300 Cb 1.28 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 2wf3 h LYS 300 CO -0.39 1.10 -0.44 0.28 -2.27 0.00 0.00 179.45 177.73 2wf3 h VAL 301 N 0.47 1.35 -0.43 2.00 2.07 -1.48 -2.56 116.25 117.67 2wf3 h VAL 301 Ca -0.02 -1.72 0.05 0.00 0.82 0.00 0.00 66.70 65.83 2wf3 h VAL 301 Cb 1.26 2.05 -0.05 0.00 -1.52 0.00 0.00 31.29 33.03 2wf3 h VAL 301 CO 0.13 0.52 0.17 0.15 0.02 0.00 0.00 177.57 178.56 2wf3 h PHE 302 N 0.19 0.30 -0.64 1.57 3.57 -0.62 0.14 116.94 121.44 2wf3 h PHE 302 Ca -0.01 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 2wf3 h PHE 302 Cb 1.07 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.71 2wf3 h PHE 302 CO 0.10 0.12 0.24 0.93 -2.23 0.00 0.00 178.31 177.47 2wf3 h GLU 303 N 0.34 0.97 -0.35 1.11 4.39 -0.95 -0.95 114.58 119.14 2wf3 h GLU 303 Ca 0.20 -0.19 -0.17 0.00 0.34 0.00 0.00 59.36 59.55 2wf3 h GLU 303 Cb 0.18 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.67 2wf3 h GLU 303 CO -0.19 0.83 -0.43 0.00 -1.16 0.00 0.00 179.01 178.05 2wf3 h ALA 304 N 1.09 0.56 0.15 3.43 0.00 -1.10 -2.31 119.26 121.08 2wf3 h ALA 304 Ca 0.21 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2wf3 h ALA 304 Cb 0.23 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2wf3 h ALA 304 CO -0.01 0.68 -0.07 0.00 0.00 0.00 0.00 179.25 179.84 2wf3 h ALA 305 N 0.77 -0.20 -0.89 0.00 0.00 -0.48 -2.61 119.26 115.85 2wf3 h ALA 305 Ca 0.05 -0.08 0.11 0.00 0.00 0.00 0.00 54.91 54.99 2wf3 h ALA 305 Cb 1.03 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 2wf3 h ALA 305 CO 0.10 -0.57 0.57 0.28 0.00 0.00 0.00 179.25 179.64 2wf3 h VAL 306 N -0.28 0.93 -0.45 0.00 2.07 -1.14 -0.86 116.25 116.53 2wf3 h VAL 306 Ca -0.02 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 2wf3 h VAL 306 Cb 0.22 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 2wf3 h VAL 306 CO 0.03 0.15 0.19 0.50 0.02 0.00 0.00 177.57 178.47 2wf3 h LYS 307 N 0.84 0.66 -0.37 1.57 3.64 -1.32 0.11 116.57 121.69 2wf3 h LYS 307 Ca 0.42 -0.11 -0.12 0.00 -1.27 0.00 0.00 60.65 59.57 2wf3 h LYS 307 Cb 0.48 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 2wf3 h LYS 307 CO -0.19 0.58 -0.26 1.03 -2.27 0.00 0.00 179.45 178.35 2wf3 h SER 308 N 0.58 0.78 0.19 4.20 0.87 -1.00 -0.64 113.55 118.53 2wf3 h SER 308 Ca 0.15 -0.30 -0.24 0.00 -1.23 0.00 0.00 61.79 60.17 2wf3 h SER 308 Cb 0.16 -0.22 0.01 0.00 -0.44 0.00 0.00 62.40 61.91 2wf3 h SER 308 CO -0.02 1.00 -0.97 0.40 -0.53 0.00 0.00 176.83 176.72 2wf3 h ILE 309 N 0.66 1.35 -0.07 2.23 2.04 -1.06 -1.05 117.51 121.60 2wf3 h ILE 309 Ca 0.08 -2.34 0.01 0.00 1.00 0.00 0.00 64.86 63.61 2wf3 h ILE 309 Cb 0.78 2.38 -0.01 0.00 -0.74 0.00 0.00 36.82 39.22 2wf3 h ILE 309 CO 0.06 0.71 -0.01 0.11 0.00 0.00 0.00 178.15 179.02 2wf3 h LYS 310 N 0.31 0.01 -0.32 2.37 1.57 -0.91 -0.43 116.57 119.16 2wf3 h LYS 310 Ca -0.10 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2wf3 h LYS 310 Cb 1.61 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.89 2wf3 h LYS 310 CO 0.18 0.00 0.13 0.00 -0.57 0.00 0.00 179.45 179.19 2wf3 h ALA 311 N 1.06 0.38 -0.07 3.86 0.00 -1.03 -1.76 119.26 121.70 2wf3 h ALA 311 Ca 0.03 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2wf3 h ALA 311 Cb 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2wf3 h ALA 311 CO -0.06 -0.26 -0.19 0.00 0.00 0.00 0.00 179.25 178.73 2wf3 h ALA 312 N 1.19 1.57 -0.64 0.00 0.00 -0.97 -2.90 119.26 117.51 2wf3 h ALA 312 Ca 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2wf3 h ALA 312 Cb 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2wf3 h ALA 312 CO -0.13 0.32 0.00 -1.13 0.00 0.00 0.00 179.25 178.31 2wf3 n SER 313 N -4.27 5.02 0.00 0.00 3.41 -0.19 -4.70 113.62 112.89 2wf3 n SER 313 Ca -0.02 -2.56 0.07 0.00 -0.26 0.00 0.00 58.87 56.10 2wf3 n SER 313 Cb 0.28 -0.61 0.34 0.00 -0.26 0.00 0.00 64.21 63.96 2wf3 n SER 313 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2wf3 n SER 314 N 1.02 0.00 0.29 4.04 3.41 -0.70 -1.30 113.62 120.39 2wf3 n SER 314 Ca 0.26 0.23 0.20 0.00 -0.26 0.00 0.00 58.87 59.30 2wf3 n SER 314 Cb 0.97 -0.36 1.00 0.00 -0.26 0.00 0.00 64.21 65.55 2wf3 n SER 314 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wf3 h THR 315 N 0.00 0.00 -3.84 6.66 1.03 -1.86 -3.41 112.91 111.49 2wf3 h THR 315 Ca 0.00 -0.11 -0.39 0.00 -0.01 0.00 0.00 66.41 65.90 2wf3 h THR 315 Cb 0.17 1.03 -0.20 0.00 -1.07 0.00 0.00 68.15 68.08 2wf3 h THR 315 CO 0.00 0.00 -0.76 -1.61 -0.01 0.00 0.00 175.52 173.14 2wf3 s GLU 316 N -3.93 0.84 -0.14 0.00 2.02 -0.42 -5.14 118.70 111.93 2wf3 s GLU 316 Ca -0.03 -1.03 0.02 0.00 0.02 0.00 0.00 54.97 53.95 2wf3 s GLU 316 Cb 0.11 -0.75 0.01 0.00 0.10 0.00 0.00 34.13 33.60 2wf3 s GLU 316 CO 0.41 0.15 -0.20 0.15 0.02 0.00 0.00 175.26 175.79 2wf3 s LYS 317 N -2.09 2.82 0.17 1.61 -0.14 -1.26 -4.93 119.74 115.92 2wf3 s LYS 317 Ca 0.01 -0.78 0.06 0.00 -1.36 0.00 0.00 55.97 53.90 2wf3 s LYS 317 Cb -0.08 -2.32 -0.04 0.00 -1.68 0.00 0.00 37.83 33.71 2wf3 s LYS 317 CO 0.02 -0.05 0.05 -0.06 -0.76 0.00 0.00 175.35 174.55 2wf3 s PHE 318 N 0.92 2.96 0.43 3.18 0.40 -1.26 -5.08 117.98 119.52 2wf3 s PHE 318 Ca -0.05 -0.09 -0.25 0.00 -0.60 0.00 0.00 56.93 55.93 2wf3 s PHE 318 Cb -0.15 -1.43 -0.10 0.00 0.51 0.00 0.00 43.02 41.86 2wf3 s PHE 318 CO -0.03 0.52 1.25 -0.35 0.70 0.00 0.00 175.22 177.31 2wf3 n PRO 319 N -0.20 1.86 -0.15 0.24 -0.05 -1.26 -4.87 135.00 130.57 2wf3 n PRO 319 Ca -0.09 0.66 0.14 0.00 -0.05 0.00 0.00 63.50 64.17 2wf3 n PRO 319 Cb 0.55 -2.36 0.49 0.00 -0.05 0.00 0.00 33.50 32.13 2wf3 n PRO 319 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 175.50 175.01 2wf3 h ASP 320 N 1.99 0.40 0.40 3.54 3.32 -2.01 0.14 116.42 124.21 2wf3 h ASP 320 Ca -0.48 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.56 2wf3 h ASP 320 Cb 1.30 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 2wf3 h ASP 320 CO 0.59 0.22 -0.17 1.23 -1.72 0.00 0.00 179.24 179.39 2wf3 h GLY 321 N 0.43 0.00 0.77 2.75 0.00 -1.96 -2.00 103.07 103.07 2wf3 h GLY 321 Ca 0.35 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.71 2wf3 h GLY 321 CO -0.11 0.00 0.13 -2.75 0.00 0.00 0.00 176.54 173.81 2wf3 h PHE 322 N 0.00 0.24 0.00 5.60 3.57 -0.90 0.67 116.94 126.12 2wf3 h PHE 322 Ca -0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2wf3 h PHE 322 Cb 0.41 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.09 2wf3 h PHE 322 CO 0.00 0.12 0.00 0.91 -2.23 0.00 0.00 178.31 177.11 2wf3 n TRP 323 N -4.99 0.77 0.41 0.41 7.02 -0.76 -1.34 117.44 118.95 2wf3 n TRP 323 Ca 0.00 0.28 0.09 0.00 -1.02 0.00 0.00 57.50 56.85 2wf3 n TRP 323 Cb 0.10 -0.95 0.14 0.00 -2.42 0.00 0.00 31.31 28.18 2wf3 n TRP 323 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2wf3 n LEU 324 N -2.18 2.89 -0.11 -0.99 4.77 -0.98 -4.95 117.00 115.45 2wf3 n LEU 324 Ca 0.03 -1.34 -0.01 0.00 -0.03 0.00 0.00 56.01 54.66 2wf3 n LEU 324 Cb 0.29 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 41.24 2wf3 n LEU 324 CO 0.23 0.60 -0.01 0.61 -1.33 0.00 0.00 177.39 177.48 2wf3 n GLY 325 N 1.09 0.52 1.06 -0.72 0.00 -0.45 -4.89 105.19 101.79 2wf3 n GLY 325 Ca 0.14 -0.57 0.12 0.00 0.00 0.00 0.00 46.02 45.71 2wf3 n GLY 325 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wf3 n GLU 326 N -2.77 2.41 -3.61 1.61 1.02 0.17 -4.95 120.64 114.52 2wf3 n GLU 326 Ca -0.01 -2.10 -0.13 0.00 -0.02 0.00 0.00 57.16 54.90 2wf3 n GLU 326 Cb 0.07 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 29.93 2wf3 n GLU 326 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2wf3 s GLN 327 N -1.71 0.76 0.63 3.49 0.74 -1.18 -4.91 119.66 117.48 2wf3 s GLN 327 Ca 0.35 0.72 -0.11 0.00 0.05 0.00 0.00 55.36 56.36 2wf3 s GLN 327 Cb 0.22 0.37 -0.03 0.00 1.10 0.00 0.00 33.01 34.66 2wf3 s GLN 327 CO 0.31 -0.13 1.04 -0.51 -0.55 0.00 0.00 175.29 175.45 2wf3 s LEU 328 N 0.01 3.22 -0.05 3.68 1.43 -1.26 -4.32 118.68 121.38 2wf3 s LEU 328 Ca -0.01 1.47 0.05 0.00 -1.03 0.00 0.00 54.13 54.61 2wf3 s LEU 328 Cb -0.04 -4.48 -0.02 0.00 0.03 0.00 0.00 46.19 41.68 2wf3 s LEU 328 CO 0.00 -0.99 -0.19 0.54 0.23 0.00 0.00 176.35 175.95 2wf3 s VAL 329 N -3.13 2.67 -0.01 -1.59 0.11 -0.44 -4.92 120.40 113.09 2wf3 s VAL 329 Ca 0.56 -0.86 0.04 0.00 -2.93 0.00 0.00 61.98 58.79 2wf3 s VAL 329 Cb -0.12 -2.02 -0.01 0.00 -1.53 0.00 0.00 36.38 32.70 2wf3 s VAL 329 CO 0.54 0.58 -0.14 0.00 -3.33 0.00 0.00 175.10 172.75 2wf3 s TRP 331 N -0.29 1.69 0.14 0.00 0.51 0.05 -4.97 118.94 116.07 2wf3 s TRP 331 Ca 0.05 -0.49 -0.34 0.00 -2.12 0.00 0.00 56.10 53.20 2wf3 s TRP 331 Cb -0.06 -0.86 -0.16 0.00 -0.81 0.00 0.00 33.47 31.58 2wf3 s TRP 331 CO -0.00 0.26 1.26 0.94 -0.51 0.00 0.00 176.95 178.89 2wf3 n GLN 332 N 0.48 1.24 -1.51 4.98 7.27 -1.26 -0.12 117.38 128.44 2wf3 n GLN 332 Ca -0.15 0.44 -0.59 0.00 0.07 0.00 0.00 57.00 56.77 2wf3 n GLN 332 Cb 0.57 -2.01 -0.08 0.00 2.41 0.00 0.00 30.24 31.12 2wf3 n GLN 332 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2wf3 n ALA 333 N 1.98 -3.49 -0.60 1.69 0.00 -0.69 -1.09 120.51 118.31 2wf3 n ALA 333 Ca 0.16 0.59 0.00 0.00 0.00 0.00 0.00 53.44 54.19 2wf3 n ALA 333 Cb 0.23 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 17.91 2wf3 n ALA 333 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wf3 n GLY 334 N 1.65 1.77 1.13 0.00 0.00 -1.26 -4.88 105.19 103.61 2wf3 n GLY 334 Ca 0.21 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.31 2wf3 n GLY 334 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wf3 n THR 335 N -2.00 2.32 -1.69 2.61 -2.24 -0.25 -5.01 114.28 108.02 2wf3 n THR 335 Ca 0.00 -1.70 -0.43 0.00 -2.27 0.00 0.00 64.05 59.64 2wf3 n THR 335 Cb 0.00 -0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 2wf3 n THR 335 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2wf3 n THR 336 N -0.14 0.36 -1.79 4.28 -1.04 -1.26 -4.84 114.28 109.85 2wf3 n THR 336 Ca 0.22 -0.07 -0.41 0.00 -2.04 0.00 0.00 64.05 61.76 2wf3 n THR 336 Cb 0.94 -2.06 -0.01 0.00 -1.82 0.00 0.00 70.33 67.39 2wf3 n THR 336 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2wf3 n PRO 337 N 5.59 3.35 -0.33 -2.82 -0.04 -1.26 -4.76 135.00 134.72 2wf3 n PRO 337 Ca 0.18 -2.78 0.20 0.00 -0.04 0.00 0.00 63.50 61.06 2wf3 n PRO 337 Cb 0.36 -3.05 0.41 0.00 -0.04 0.00 0.00 33.50 31.18 2wf3 n PRO 337 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2wf3 h TRP 338 N 5.61 0.88 0.00 0.54 4.06 -1.96 -1.11 115.95 123.97 2wf3 h TRP 338 Ca 0.61 0.04 0.00 0.00 2.06 0.00 0.00 58.89 61.60 2wf3 h TRP 338 Cb 0.53 -0.23 0.00 0.00 -1.00 0.00 0.00 29.16 28.46 2wf3 h TRP 338 CO 1.52 -0.09 0.00 -0.91 -3.56 0.00 0.00 178.44 175.40 2wf3 h ASN 339 N 0.40 0.00 0.77 -3.49 -0.26 -2.01 -2.07 115.58 108.92 2wf3 h ASN 339 Ca 0.67 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.41 2wf3 h ASN 339 Cb 1.43 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.69 2wf3 h ASN 339 CO -0.56 0.00 -0.29 2.30 -1.06 0.00 0.00 177.43 177.81 2wf3 n ILE 340 N -2.75 0.06 -3.72 2.81 -5.35 -0.42 -4.83 119.36 105.16 2wf3 n ILE 340 Ca -0.02 -0.03 -0.37 0.00 -0.27 0.00 0.00 62.75 62.06 2wf3 n ILE 340 Cb 0.11 -0.11 -0.06 0.00 -1.74 0.00 0.00 39.64 37.83 2wf3 n ILE 340 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2wf3 s PHE 341 N -3.02 3.59 0.71 4.28 0.08 -0.78 -3.31 117.98 119.53 2wf3 s PHE 341 Ca 0.12 0.63 -0.10 0.00 0.12 0.00 0.00 56.93 57.70 2wf3 s PHE 341 Cb 0.18 -2.11 0.03 0.00 -0.57 0.00 0.00 43.02 40.54 2wf3 s PHE 341 CO 0.63 0.59 1.07 -1.25 -0.10 0.00 0.00 175.22 176.16 2wf3 s PRO 342 N -0.64 2.58 0.10 0.24 0.04 -1.26 -4.81 135.00 131.24 2wf3 s PRO 342 Ca 0.17 0.22 -0.24 0.00 0.04 0.00 0.00 61.00 61.18 2wf3 s PRO 342 Cb -0.13 -2.06 -0.07 0.00 0.04 0.00 0.00 34.50 32.28 2wf3 s PRO 342 CO 0.06 -1.13 0.74 0.08 0.04 0.00 0.00 177.00 176.78 2wf3 s VAL 343 N -3.33 4.59 -0.21 -0.36 1.01 -1.26 -4.21 120.40 116.63 2wf3 s VAL 343 Ca 0.59 1.59 -0.06 0.00 0.00 0.00 0.00 61.98 64.09 2wf3 s VAL 343 Cb -0.11 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 2wf3 s VAL 343 CO 0.49 0.46 0.03 -0.63 0.00 0.00 0.00 175.10 175.45 2wf3 s ILE 344 N -0.65 4.24 -0.23 2.22 1.01 -0.23 -0.92 121.20 126.64 2wf3 s ILE 344 Ca 0.36 -0.22 -0.06 0.00 0.00 0.00 0.00 60.65 60.73 2wf3 s ILE 344 Cb -0.21 -2.93 -0.03 0.00 0.01 0.00 0.00 42.46 39.30 2wf3 s ILE 344 CO 0.24 0.42 0.04 -0.44 0.00 0.00 0.00 174.94 175.19 2wf3 s SER 345 N 0.97 4.98 -0.27 3.58 0.01 0.23 0.19 113.70 123.40 2wf3 s SER 345 Ca 0.03 -0.21 -0.09 0.00 1.31 0.00 0.00 55.95 56.98 2wf3 s SER 345 Cb -0.14 -1.88 -0.03 0.00 0.21 0.00 0.00 66.02 64.18 2wf3 s SER 345 CO 0.02 0.00 0.12 -0.76 0.41 0.00 0.00 173.24 173.03 2wf3 s LEU 346 N 1.39 3.72 -0.23 2.44 1.43 -0.47 -1.33 118.68 125.63 2wf3 s LEU 346 Ca 0.05 -0.19 -0.16 0.00 -1.03 0.00 0.00 54.13 52.80 2wf3 s LEU 346 Cb -0.15 -2.00 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 2wf3 s LEU 346 CO 0.02 -0.06 0.40 -0.31 0.23 0.00 0.00 176.35 176.63 2wf3 s TYR 347 N 1.66 3.33 -0.09 0.29 1.51 0.01 -0.92 117.35 123.14 2wf3 s TYR 347 Ca 0.06 0.56 -0.03 0.00 -1.01 0.00 0.00 57.07 56.65 2wf3 s TYR 347 Cb -0.16 -2.56 -0.04 0.00 -0.11 0.00 0.00 41.96 39.10 2wf3 s TYR 347 CO 0.06 -0.10 0.06 -0.51 -1.11 0.00 0.00 175.55 173.95 2wf3 s LEU 348 N 1.63 3.89 0.18 -1.29 1.43 0.16 -0.58 118.68 124.10 2wf3 s LEU 348 Ca 0.18 0.25 -0.33 0.00 -1.03 0.00 0.00 54.13 53.20 2wf3 s LEU 348 Cb -0.15 -1.96 -0.15 0.00 0.03 0.00 0.00 46.19 43.96 2wf3 s LEU 348 CO 0.09 0.38 1.35 0.80 0.23 0.00 0.00 176.35 179.19 2wf3 n MET 349 N 1.97 1.62 -2.22 1.70 0.00 -0.19 -2.13 117.12 117.86 2wf3 n MET 349 Ca -0.18 0.58 -0.27 0.00 -0.00 0.00 0.00 57.70 57.82 2wf3 n MET 349 Cb 0.54 -2.20 0.15 0.00 0.00 0.00 0.00 33.22 31.71 2wf3 n MET 349 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2wf3 s GLY 350 N 0.34 1.77 0.02 -5.12 0.00 0.67 -4.14 107.32 100.86 2wf3 s GLY 350 Ca 0.75 -1.44 0.28 0.00 0.00 0.00 0.00 44.72 44.30 2wf3 s GLY 350 CO 0.48 -0.76 1.81 1.18 0.00 0.00 0.00 173.10 175.81 2wf3 n GLU 351 N -3.36 0.03 -4.73 2.90 -0.58 -1.25 -4.59 120.64 109.06 2wf3 n GLU 351 Ca 0.15 0.02 -0.31 0.00 -0.42 0.00 0.00 57.16 56.60 2wf3 n GLU 351 Cb 0.60 -1.53 -0.13 0.00 -0.57 0.00 0.00 31.44 29.81 2wf3 n GLU 351 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2wf3 s VAL 352 N -3.01 2.79 0.14 2.62 1.01 -1.26 -5.07 120.40 117.61 2wf3 s VAL 352 Ca 0.13 -1.11 -0.34 0.00 0.00 0.00 0.00 61.98 60.66 2wf3 s VAL 352 Cb 0.18 -2.15 -0.16 0.00 0.00 0.00 0.00 36.38 34.25 2wf3 s VAL 352 CO 0.57 0.39 1.25 0.41 0.00 0.00 0.00 175.10 177.73 2wf3 n THR 353 N 1.72 0.49 -0.90 3.92 -1.04 -1.26 -1.86 114.28 115.34 2wf3 n THR 353 Ca -0.16 -0.12 -0.02 0.00 -2.04 0.00 0.00 64.05 61.70 2wf3 n THR 353 Cb 0.52 -0.86 -0.01 0.00 -1.82 0.00 0.00 70.33 68.16 2wf3 n THR 353 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wf3 n GLN 354 N 2.13 -1.91 -3.91 -2.82 1.13 -1.26 -4.96 117.38 105.79 2wf3 n GLN 354 Ca 0.16 0.49 -0.29 0.00 -1.94 0.00 0.00 57.00 55.43 2wf3 n GLN 354 Cb 0.22 -4.62 -0.04 0.00 0.11 0.00 0.00 30.24 25.92 2wf3 n GLN 354 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2wf3 s GLN 355 N -1.87 3.45 0.18 -1.09 -0.21 -0.78 -2.11 119.66 117.24 2wf3 s GLN 355 Ca 0.00 -0.49 -0.09 0.00 0.02 0.00 0.00 55.36 54.79 2wf3 s GLN 355 Cb 0.00 -2.99 -0.01 0.00 1.00 0.00 0.00 33.01 31.01 2wf3 s GLN 355 CO 0.00 0.55 0.31 -1.54 -2.12 0.00 0.00 175.29 172.50 2wf3 s SER 356 N -2.86 0.02 0.24 5.90 1.04 0.19 -0.24 113.70 117.98 2wf3 s SER 356 Ca 0.35 -0.92 0.02 0.00 0.48 0.00 0.00 55.95 55.89 2wf3 s SER 356 Cb -0.12 0.46 -0.05 0.00 0.10 0.00 0.00 66.02 66.41 2wf3 s SER 356 CO 0.28 -0.94 0.04 0.72 0.98 0.00 0.00 173.24 174.33 2wf3 s PHE 357 N -3.99 1.49 0.06 5.02 -0.12 -0.91 0.52 117.98 120.05 2wf3 s PHE 357 Ca 0.20 -1.06 0.07 0.00 -0.05 0.00 0.00 56.93 56.08 2wf3 s PHE 357 Cb 0.03 -0.88 -0.03 0.00 -0.63 0.00 0.00 43.02 41.51 2wf3 s PHE 357 CO 0.03 -0.20 -0.18 -0.98 -0.05 0.00 0.00 175.22 173.83 2wf3 s ARG 358 N -3.95 1.12 -0.07 1.99 1.70 -0.28 -0.66 118.95 118.80 2wf3 s ARG 358 Ca 0.32 -0.94 0.02 0.00 -0.47 0.00 0.00 55.73 54.66 2wf3 s ARG 358 Cb 0.07 -1.23 -0.03 0.00 -0.57 0.00 0.00 34.95 33.20 2wf3 s ARG 358 CO 0.10 0.30 -0.11 0.96 -1.08 0.00 0.00 175.30 175.47 2wf3 s ILE 359 N -0.96 3.31 -0.13 4.99 -4.36 -0.10 -1.47 121.20 122.48 2wf3 s ILE 359 Ca 0.04 -0.62 -0.02 0.00 -0.26 0.00 0.00 60.65 59.79 2wf3 s ILE 359 Cb -0.09 -2.34 -0.03 0.00 1.25 0.00 0.00 42.46 41.26 2wf3 s ILE 359 CO 0.02 0.58 -0.05 -0.89 0.24 0.00 0.00 174.94 174.84 2wf3 s THR 360 N -0.55 3.78 -0.18 8.37 2.01 -0.35 -1.37 115.64 127.35 2wf3 s THR 360 Ca 0.08 -0.41 -0.01 0.00 0.31 0.00 0.00 61.69 61.65 2wf3 s THR 360 Cb -0.12 -2.63 -0.00 0.00 0.01 0.00 0.00 72.50 69.76 2wf3 s THR 360 CO 0.02 0.52 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.73 2wf3 s ILE 361 N 0.10 2.95 0.42 1.82 -1.09 0.13 -3.83 121.20 121.71 2wf3 s ILE 361 Ca -0.01 -0.66 -0.02 0.00 -2.23 0.00 0.00 60.65 57.72 2wf3 s ILE 361 Cb -0.14 -2.28 -0.03 0.00 -1.58 0.00 0.00 42.46 38.43 2wf3 s ILE 361 CO 0.03 0.49 0.67 -0.76 -1.23 0.00 0.00 174.94 174.14 2wf3 s LEU 362 N 1.01 3.79 0.63 2.97 1.43 -1.26 -1.07 118.68 126.19 2wf3 s LEU 362 Ca -0.01 0.66 0.39 0.00 -1.03 0.00 0.00 54.13 54.13 2wf3 s LEU 362 Cb -0.15 -3.56 2.13 0.00 0.03 0.00 0.00 46.19 44.64 2wf3 s LEU 362 CO -0.02 -0.47 2.30 1.55 0.23 0.00 0.00 176.35 179.94 2wf3 h PRO 363 N 0.47 0.00 0.00 1.29 0.13 -1.88 0.12 132.00 132.13 2wf3 h PRO 363 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 2wf3 h PRO 363 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2wf3 h PRO 363 CO 0.61 0.01 -0.03 1.96 -0.23 0.00 0.00 178.00 180.32 2wf3 h GLN 364 N 0.00 0.00 0.03 0.86 7.50 -1.93 -1.29 115.11 120.28 2wf3 h GLN 364 Ca -0.00 0.00 -0.23 0.00 0.50 0.00 0.00 58.65 58.92 2wf3 h GLN 364 Cb 0.05 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.56 2wf3 h GLN 364 CO 0.00 0.03 -1.25 1.96 -1.50 0.00 0.00 178.83 178.07 2wf3 h GLN 365 N 0.00 0.07 -0.00 1.46 4.20 -1.08 -3.41 115.11 116.34 2wf3 h GLN 365 Ca -0.00 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2wf3 h GLN 365 Cb 0.15 0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.97 2wf3 h GLN 365 CO 0.00 1.06 -0.15 2.48 -0.67 0.00 0.00 178.83 181.55 2wf3 n TYR 366 N -4.26 0.00 -3.61 2.96 0.18 -1.14 -4.33 117.16 106.96 2wf3 n TYR 366 Ca -0.29 0.00 -0.40 0.00 1.88 0.00 0.00 57.90 59.09 2wf3 n TYR 366 Cb 0.74 -0.17 -0.10 0.00 -0.38 0.00 0.00 39.34 39.43 2wf3 n TYR 366 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2wf3 s LEU 367 N -2.49 5.32 -0.16 -3.48 1.43 -0.50 -0.29 118.68 118.50 2wf3 s LEU 367 Ca 0.27 -1.69 -0.21 0.00 -1.03 0.00 0.00 54.13 51.46 2wf3 s LEU 367 Cb 0.20 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 2wf3 s LEU 367 CO 0.49 -0.58 0.64 -0.60 0.23 0.00 0.00 176.35 176.53 2wf3 s ARG 368 N 1.37 4.27 0.40 1.70 3.52 0.64 -4.75 118.95 126.09 2wf3 s ARG 368 Ca 0.04 0.67 -0.25 0.00 -0.13 0.00 0.00 55.73 56.07 2wf3 s ARG 368 Cb -0.24 -3.54 -0.09 0.00 -1.56 0.00 0.00 34.95 29.53 2wf3 s ARG 368 CO 0.00 -0.15 1.12 -1.25 -0.81 0.00 0.00 175.30 174.22 2wf3 s PRO 369 N 1.59 4.11 -0.32 5.12 0.04 -1.26 -0.60 135.00 143.68 2wf3 s PRO 369 Ca 0.31 1.72 0.01 0.00 0.04 0.00 0.00 61.00 63.08 2wf3 s PRO 369 Cb -0.16 -2.64 0.08 0.00 0.04 0.00 0.00 34.50 31.82 2wf3 s PRO 369 CO 0.12 -0.24 0.02 0.08 0.04 0.00 0.00 177.00 177.01 2wf3 s VAL 370 N -1.49 2.56 0.06 -0.36 1.01 -0.04 -4.85 120.40 117.29 2wf3 s VAL 370 Ca 0.57 -1.90 -0.31 0.00 0.00 0.00 0.00 61.98 60.35 2wf3 s VAL 370 Cb -0.28 -2.67 -0.06 0.00 0.00 0.00 0.00 36.38 33.38 2wf3 s VAL 370 CO 0.35 -0.35 1.24 -1.61 0.00 0.00 0.00 175.10 174.73 2wf3 s GLU 371 N 1.07 4.40 -0.30 2.72 8.01 -1.26 -4.58 118.70 128.76 2wf3 s GLU 371 Ca 0.01 1.83 -0.12 0.00 0.01 0.00 0.00 54.97 56.70 2wf3 s GLU 371 Cb -0.20 -3.36 0.14 0.00 -4.31 0.00 0.00 34.13 26.40 2wf3 s GLU 371 CO -0.05 -0.32 0.76 0.34 0.01 0.00 0.00 175.26 176.00 2wf3 s ASP 372 N 1.14 -0.96 0.32 -0.19 2.15 -1.26 -5.03 116.67 112.84 2wf3 s ASP 372 Ca 0.60 1.32 0.04 0.00 0.43 0.00 0.00 52.55 54.94 2wf3 s ASP 372 Cb -0.30 2.09 0.65 0.00 -0.30 0.00 0.00 42.92 45.06 2wf3 s ASP 372 CO 0.29 -0.18 1.87 0.58 -0.17 0.00 0.00 175.17 177.55 2wf3 h VAL 373 N 5.83 0.92 -0.07 1.11 2.07 -1.99 -1.42 116.25 122.71 2wf3 h VAL 373 Ca -0.17 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.02 2wf3 h VAL 373 Cb 1.11 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 2wf3 h VAL 373 CO 0.09 0.16 -0.09 0.00 0.02 0.00 0.00 177.57 177.76 2wf3 h ALA 374 N 1.56 1.73 -0.63 1.67 0.00 -2.01 -1.67 119.26 119.91 2wf3 h ALA 374 Ca 0.45 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2wf3 h ALA 374 Cb 0.50 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2wf3 h ALA 374 CO -0.21 0.20 0.00 0.25 0.00 0.00 0.00 179.25 179.49 2wf3 n THR 375 N -4.38 1.94 1.92 0.00 -2.24 -0.55 -4.66 114.28 106.31 2wf3 n THR 375 Ca -0.02 -1.24 0.11 0.00 -2.27 0.00 0.00 64.05 60.64 2wf3 n THR 375 Cb 0.20 0.08 0.68 0.00 -2.10 0.00 0.00 70.33 69.19 2wf3 n THR 375 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2wf3 n SER 376 N 1.02 0.00 0.26 3.42 3.41 -0.63 -1.09 113.62 120.01 2wf3 n SER 376 Ca 0.26 -1.20 0.13 0.00 -0.26 0.00 0.00 58.87 57.80 2wf3 n SER 376 Cb 0.92 0.00 0.72 0.00 -0.26 0.00 0.00 64.21 65.59 2wf3 n SER 376 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 2wf3 h GLN 377 N 0.00 0.00 -6.21 4.33 3.07 -1.83 -3.45 115.11 111.02 2wf3 h GLN 377 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 58.65 58.20 2wf3 h GLN 377 Cb 0.00 0.00 -0.08 0.00 0.08 0.00 0.00 27.48 27.48 2wf3 h GLN 377 CO 0.00 0.12 -0.60 -0.51 0.09 0.00 0.00 178.83 177.93 2wf3 s ASP 378 N -6.11 4.93 -0.18 0.06 1.11 -0.25 -1.71 116.67 114.52 2wf3 s ASP 378 Ca -0.02 -0.48 -0.13 0.00 0.18 0.00 0.00 52.55 52.10 2wf3 s ASP 378 Cb 0.13 -1.07 -0.05 0.00 1.07 0.00 0.00 42.92 43.00 2wf3 s ASP 378 CO 0.58 -0.01 0.28 -1.81 1.18 0.00 0.00 175.17 175.39 2wf3 s ASP 379 N -3.68 6.37 0.08 0.27 -0.00 0.83 -4.67 116.67 115.87 2wf3 s ASP 379 Ca 0.32 0.42 0.09 0.00 -0.00 0.00 0.00 52.55 53.38 2wf3 s ASP 379 Cb -0.07 -2.17 -0.03 0.00 -0.00 0.00 0.00 42.92 40.64 2wf3 s ASP 379 CO 0.22 0.07 -0.23 0.00 -0.00 0.00 0.00 175.17 175.22 2wf3 s TYR 381 N -0.97 0.34 0.01 0.00 1.51 0.06 -0.86 117.35 117.43 2wf3 s TYR 381 Ca 0.10 -0.60 0.03 0.00 -1.01 0.00 0.00 57.07 55.59 2wf3 s TYR 381 Cb -0.10 -0.24 -0.03 0.00 -0.11 0.00 0.00 41.96 41.48 2wf3 s TYR 381 CO 0.04 -0.20 -0.07 0.15 -1.11 0.00 0.00 175.55 174.35 2wf3 s LYS 382 N -1.82 2.53 -0.30 -0.62 1.02 0.23 -1.33 119.74 119.45 2wf3 s LYS 382 Ca -0.12 -0.74 -0.29 0.00 0.02 0.00 0.00 55.97 54.84 2wf3 s LYS 382 Cb -0.07 -2.49 -0.01 0.00 -0.52 0.00 0.00 37.83 34.73 2wf3 s LYS 382 CO -0.02 0.60 1.52 0.12 -0.92 0.00 0.00 175.35 176.65 2wf3 s PHE 383 N -1.00 2.26 -0.53 3.18 5.36 -1.26 -0.26 117.98 125.73 2wf3 s PHE 383 Ca 0.17 0.66 0.00 0.00 -0.96 0.00 0.00 56.93 56.80 2wf3 s PHE 383 Cb -0.11 -4.07 0.48 0.00 -0.34 0.00 0.00 43.02 38.98 2wf3 s PHE 383 CO 0.08 -2.43 1.96 0.00 -1.46 0.00 0.00 175.22 173.36 2wf3 n ALA 384 N 8.64 5.80 -3.50 11.12 0.00 0.61 -4.67 120.51 138.50 2wf3 n ALA 384 Ca 0.18 -2.92 -0.25 0.00 0.00 0.00 0.00 53.44 50.45 2wf3 n ALA 384 Cb 0.46 -1.59 -0.17 0.00 0.00 0.00 0.00 19.45 18.16 2wf3 n ALA 384 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2wf3 s ILE 385 N -3.81 1.20 0.28 0.00 1.01 -1.26 -1.34 121.20 117.27 2wf3 s ILE 385 Ca 0.55 -0.50 -0.07 0.00 0.00 0.00 0.00 60.65 60.64 2wf3 s ILE 385 Cb 0.45 -1.10 -0.01 0.00 0.01 0.00 0.00 42.46 41.81 2wf3 s ILE 385 CO 0.03 0.37 0.41 -0.94 0.00 0.00 0.00 174.94 174.81 2wf3 s SER 386 N 0.75 0.35 0.10 3.58 1.04 -0.04 -4.86 113.70 114.62 2wf3 s SER 386 Ca -0.13 -1.23 -0.12 0.00 0.48 0.00 0.00 55.95 54.95 2wf3 s SER 386 Cb -0.16 0.58 -0.06 0.00 0.10 0.00 0.00 66.02 66.48 2wf3 s SER 386 CO 0.03 -1.15 0.46 -1.58 0.98 0.00 0.00 173.24 171.98 2wf3 s GLN 387 N -3.67 3.86 0.04 4.02 0.74 -1.26 0.22 119.66 123.60 2wf3 s GLN 387 Ca 0.29 0.31 0.04 0.00 0.05 0.00 0.00 55.36 56.05 2wf3 s GLN 387 Cb 0.01 -2.98 -0.02 0.00 1.10 0.00 0.00 33.01 31.11 2wf3 s GLN 387 CO 0.14 0.54 -0.12 0.45 -0.55 0.00 0.00 175.29 175.75 2wf3 s SER 388 N -1.70 1.36 -0.06 6.67 0.15 0.16 -4.72 113.70 115.55 2wf3 s SER 388 Ca 0.34 -0.47 0.12 0.00 0.70 0.00 0.00 55.95 56.65 2wf3 s SER 388 Cb -0.14 -0.06 0.36 0.00 -1.71 0.00 0.00 66.02 64.47 2wf3 s SER 388 CO 0.18 -0.04 1.29 -1.54 1.20 0.00 0.00 173.24 174.34 2wf3 n SER 389 N 1.81 3.19 -0.73 5.45 3.41 -1.26 -3.44 113.62 122.04 2wf3 n SER 389 Ca -0.19 -2.37 0.05 0.00 -0.26 0.00 0.00 58.87 56.10 2wf3 n SER 389 Cb 0.55 -0.33 0.10 0.00 -0.26 0.00 0.00 64.21 64.27 2wf3 n SER 389 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2wf3 n THR 390 N 0.06 1.12 0.00 6.66 -2.24 -1.26 -4.91 114.28 113.71 2wf3 n THR 390 Ca 0.14 -1.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.09 2wf3 n THR 390 Cb 0.58 0.25 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 2wf3 n THR 390 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wf3 n GLY 391 N -0.52 0.15 3.75 3.38 0.00 -1.21 -4.49 105.19 106.24 2wf3 n GLY 391 Ca 0.11 -2.02 -0.41 0.00 0.00 0.00 0.00 46.02 43.71 2wf3 n GLY 391 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wf3 s THR 392 N -1.02 3.93 -0.20 2.61 2.01 0.37 -4.31 115.64 119.03 2wf3 s THR 392 Ca 0.00 1.81 0.01 0.00 0.31 0.00 0.00 61.69 63.82 2wf3 s THR 392 Cb 0.00 -4.15 0.04 0.00 0.01 0.00 0.00 72.50 68.40 2wf3 s THR 392 CO 0.00 0.37 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.51 2wf3 s VAL 393 N -0.73 1.67 -0.82 3.82 1.01 -0.38 -1.61 120.40 123.36 2wf3 s VAL 393 Ca 0.45 -1.03 -0.20 0.00 0.00 0.00 0.00 61.98 61.20 2wf3 s VAL 393 Cb -0.28 -1.74 0.10 0.00 0.00 0.00 0.00 36.38 34.46 2wf3 s VAL 393 CO 0.35 0.17 1.07 -0.04 0.00 0.00 0.00 175.10 176.64 2wf3 s MET 394 N 1.38 3.40 0.00 2.72 1.00 0.10 -1.26 119.30 126.64 2wf3 s MET 394 Ca -0.01 -1.38 0.00 0.00 0.00 0.00 0.00 55.69 54.30 2wf3 s MET 394 Cb -0.16 -4.66 0.00 0.00 0.00 0.00 0.00 34.83 30.00 2wf3 s MET 394 CO -0.08 -1.80 0.00 0.41 0.00 0.00 0.00 175.02 173.55 2wf3 n GLY 395 N 5.49 -0.51 0.21 -0.03 0.00 -1.04 -1.48 105.19 107.83 2wf3 n GLY 395 Ca 0.13 -1.74 0.03 0.00 0.00 0.00 0.00 46.02 44.44 2wf3 n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wf3 h ALA 396 N -1.61 1.51 0.00 4.61 0.00 -0.42 -1.60 119.26 121.76 2wf3 h ALA 396 Ca 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2wf3 h ALA 396 Cb 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2wf3 h ALA 396 CO 0.00 0.36 -0.12 -0.39 0.00 0.00 0.00 179.25 179.10 2wf3 h VAL 397 N 0.05 0.29 0.22 0.00 -1.51 -1.61 -0.19 116.25 113.49 2wf3 h VAL 397 Ca 0.01 -0.92 -0.34 0.00 -1.23 0.00 0.00 66.70 64.21 2wf3 h VAL 397 Cb 0.49 1.73 0.02 0.00 -2.13 0.00 0.00 31.29 31.40 2wf3 h VAL 397 CO 0.04 0.12 -1.60 0.40 -1.23 0.00 0.00 177.57 175.30 2wf3 h ILE 398 N 0.00 1.11 0.00 7.19 1.08 -1.58 -3.35 117.51 121.96 2wf3 h ILE 398 Ca -0.00 -2.59 -0.08 0.00 -0.39 0.00 0.00 64.86 61.79 2wf3 h ILE 398 Cb 0.72 2.90 -0.01 0.00 -3.07 0.00 0.00 36.82 37.36 2wf3 h ILE 398 CO 0.02 0.83 -0.40 0.24 -0.69 0.00 0.00 178.15 178.15 2wf3 h MET 399 N 0.10 0.00 -6.87 2.37 2.86 -0.96 -3.43 114.93 109.00 2wf3 h MET 399 Ca -0.30 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 56.81 2wf3 h MET 399 Cb 2.11 0.00 0.07 0.00 0.06 0.00 0.00 31.60 33.85 2wf3 h MET 399 CO 0.22 0.40 0.71 -1.83 1.06 0.00 0.00 176.91 177.47 2wf3 s GLU 400 N -4.02 4.27 0.00 1.72 -1.05 -0.12 -1.26 118.70 118.24 2wf3 s GLU 400 Ca -0.02 2.34 0.00 0.00 -0.15 0.00 0.00 54.97 57.14 2wf3 s GLU 400 Cb 0.14 -3.05 0.00 0.00 -0.44 0.00 0.00 34.13 30.78 2wf3 s GLU 400 CO 0.72 -0.34 0.00 0.41 0.95 0.00 0.00 175.26 177.00 2wf3 n GLY 401 N 1.04 1.91 3.63 -3.83 0.00 -0.93 -4.86 105.19 102.15 2wf3 n GLY 401 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 2wf3 n GLY 401 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wf3 s PHE 402 N -3.53 2.83 -0.30 1.61 0.40 -0.39 -1.54 117.98 117.06 2wf3 s PHE 402 Ca 0.00 -0.12 -0.18 0.00 -0.60 0.00 0.00 56.93 56.04 2wf3 s PHE 402 Cb 0.00 -1.45 -0.02 0.00 0.51 0.00 0.00 43.02 42.06 2wf3 s PHE 402 CO 0.00 0.46 0.50 -0.47 0.70 0.00 0.00 175.22 176.41 2wf3 s TYR 403 N -1.36 3.23 -0.14 0.36 5.04 0.12 -4.27 117.35 120.32 2wf3 s TYR 403 Ca 0.24 0.43 0.00 0.00 -2.44 0.00 0.00 57.07 55.30 2wf3 s TYR 403 Cb -0.11 -2.80 -0.01 0.00 0.35 0.00 0.00 41.96 39.40 2wf3 s TYR 403 CO 0.16 -0.39 -0.14 0.08 -1.34 0.00 0.00 175.55 173.92 2wf3 s VAL 404 N 2.33 2.82 -0.24 3.14 1.01 -0.41 -1.94 120.40 127.10 2wf3 s VAL 404 Ca 0.20 -0.73 -0.05 0.00 0.00 0.00 0.00 61.98 61.40 2wf3 s VAL 404 Cb -0.16 -2.19 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 2wf3 s VAL 404 CO 0.11 0.52 0.00 -0.69 0.00 0.00 0.00 175.10 175.04 2wf3 s VAL 405 N 0.64 3.63 -0.92 2.92 1.01 0.75 -0.51 120.40 127.91 2wf3 s VAL 405 Ca -0.08 -0.52 -0.15 0.00 0.00 0.00 0.00 61.98 61.24 2wf3 s VAL 405 Cb -0.16 -2.72 0.20 0.00 0.00 0.00 0.00 36.38 33.70 2wf3 s VAL 405 CO 0.03 0.32 0.96 -0.36 0.00 0.00 0.00 175.10 176.04 2wf3 s PHE 406 N 1.50 3.62 -1.14 5.22 0.08 0.77 -1.23 117.98 126.78 2wf3 s PHE 406 Ca 0.05 -1.90 -0.14 0.00 0.12 0.00 0.00 56.93 55.05 2wf3 s PHE 406 Cb -0.15 -3.99 0.18 0.00 -0.57 0.00 0.00 43.02 38.49 2wf3 s PHE 406 CO -0.01 -1.16 1.33 0.34 -0.10 0.00 0.00 175.22 175.62 2wf3 s ASP 407 N 2.54 7.03 0.21 1.36 -1.08 -0.30 -2.46 116.67 123.98 2wf3 s ASP 407 Ca 0.25 -2.93 -0.07 0.00 -0.52 0.00 0.00 52.55 49.29 2wf3 s ASP 407 Cb -0.08 -2.37 0.17 0.00 -1.46 0.00 0.00 42.92 39.18 2wf3 s ASP 407 CO -0.08 -0.73 1.72 0.03 0.52 0.00 0.00 175.17 176.63 2wf3 h ARG 408 N 7.35 1.06 -0.52 4.34 3.08 -1.70 -0.32 114.38 127.67 2wf3 h ARG 408 Ca 0.27 -0.27 0.06 0.00 0.07 0.00 0.00 59.98 60.11 2wf3 h ARG 408 Cb 0.90 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 2wf3 h ARG 408 CO 1.18 0.96 0.35 0.00 -1.07 0.00 0.00 179.97 181.39 2wf3 h ALA 409 N 1.12 1.87 -0.12 0.04 0.00 -1.47 -2.09 119.26 118.61 2wf3 h ALA 409 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2wf3 h ALA 409 Cb 0.41 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2wf3 h ALA 409 CO 0.01 0.05 0.00 0.54 0.00 0.00 0.00 179.25 179.85 2wf3 n ARG 410 N -4.47 2.25 -3.83 0.00 1.74 -0.94 -4.97 116.66 106.44 2wf3 n ARG 410 Ca 0.07 -2.41 -0.25 0.00 -0.77 0.00 0.00 57.85 54.49 2wf3 n ARG 410 Cb 0.23 -1.49 0.02 0.00 -1.02 0.00 0.00 32.46 30.20 2wf3 n ARG 410 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2wf3 n LYS 411 N -0.77 -4.70 -3.82 5.56 5.02 -0.19 -4.93 118.16 114.32 2wf3 n LYS 411 Ca 0.14 0.56 -0.09 0.00 -2.02 0.00 0.00 58.31 56.90 2wf3 n LYS 411 Cb 0.62 -5.13 -0.07 0.00 -0.02 0.00 0.00 35.03 30.43 2wf3 n LYS 411 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2wf3 s ARG 412 N -6.29 0.85 -0.09 1.97 1.70 -0.82 -0.75 118.95 115.52 2wf3 s ARG 412 Ca 0.20 -0.85 0.04 0.00 -0.47 0.00 0.00 55.73 54.65 2wf3 s ARG 412 Cb -0.10 0.35 -0.00 0.00 -0.57 0.00 0.00 34.95 34.63 2wf3 s ARG 412 CO 0.84 -0.28 -0.23 0.42 -1.08 0.00 0.00 175.30 174.97 2wf3 s ILE 413 N -3.60 1.99 -0.06 4.99 1.01 0.60 -1.15 121.20 124.98 2wf3 s ILE 413 Ca 0.03 -0.98 -0.01 0.00 0.00 0.00 0.00 60.65 59.68 2wf3 s ILE 413 Cb 0.03 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 2wf3 s ILE 413 CO -0.10 0.55 0.02 -0.83 0.00 0.00 0.00 174.94 174.58 2wf3 s GLY 414 N 0.30 1.90 -0.06 6.18 0.00 -0.37 -0.26 107.32 115.02 2wf3 s GLY 414 Ca -0.17 -0.83 0.05 0.00 0.00 0.00 0.00 44.72 43.77 2wf3 s GLY 414 CO 0.08 -0.62 -0.21 -1.36 0.00 0.00 0.00 173.10 170.99 2wf3 s PHE 415 N -0.97 2.06 0.07 1.90 0.40 0.74 -0.18 117.98 121.99 2wf3 s PHE 415 Ca 0.16 -0.64 -0.08 0.00 -0.60 0.00 0.00 56.93 55.76 2wf3 s PHE 415 Cb -0.11 -1.38 -0.00 0.00 0.51 0.00 0.00 43.02 42.04 2wf3 s PHE 415 CO 0.05 -0.22 0.18 0.00 0.70 0.00 0.00 175.22 175.93 2wf3 s ALA 416 N 0.04 -0.23 0.13 5.36 0.00 -0.82 -1.18 121.76 125.06 2wf3 s ALA 416 Ca -0.06 -0.53 -0.31 0.00 0.00 0.00 0.00 51.96 51.06 2wf3 s ALA 416 Cb -0.13 0.39 -0.09 0.00 0.00 0.00 0.00 23.12 23.29 2wf3 s ALA 416 CO 0.04 -0.44 1.53 0.08 0.00 0.00 0.00 175.76 176.97 2wf3 s VAL 417 N -3.36 2.92 0.38 0.00 1.01 -1.25 0.13 120.40 120.23 2wf3 s VAL 417 Ca 0.01 0.61 0.01 0.00 0.00 0.00 0.00 61.98 62.60 2wf3 s VAL 417 Cb 0.03 -3.39 -0.02 0.00 0.00 0.00 0.00 36.38 33.00 2wf3 s VAL 417 CO -0.08 0.04 0.59 -0.94 0.00 0.00 0.00 175.10 174.70 2wf3 s SER 418 N 1.41 6.14 0.59 3.32 1.04 -0.59 -1.74 113.70 123.87 2wf3 s SER 418 Ca 0.69 0.37 0.29 0.00 0.48 0.00 0.00 55.95 57.79 2wf3 s SER 418 Cb -0.41 -1.84 1.35 0.00 0.10 0.00 0.00 66.02 65.22 2wf3 s SER 418 CO 0.31 -0.43 1.74 0.00 0.98 0.00 0.00 173.24 175.84 2wf3 h ALA 419 N 0.64 2.43 -1.27 5.32 0.00 -1.38 -1.68 119.26 123.32 2wf3 h ALA 419 Ca -0.48 -0.02 -0.67 0.00 0.00 0.00 0.00 54.91 53.73 2wf3 h ALA 419 Cb 1.23 0.05 -0.35 0.00 0.00 0.00 0.00 17.79 18.72 2wf3 h ALA 419 CO 0.60 -1.03 0.11 0.00 0.00 0.00 0.00 179.25 178.92 2wf3 s HIS 421 N -3.79 3.12 0.07 0.00 -0.00 -0.63 -4.24 115.29 109.82 2wf3 s HIS 421 Ca 0.50 1.53 -0.19 0.00 -0.00 0.00 0.00 55.06 56.90 2wf3 s HIS 421 Cb 0.42 -2.96 -0.07 0.00 -0.00 0.00 0.00 32.58 29.97 2wf3 s HIS 421 CO -0.29 -0.78 0.56 0.08 -0.00 0.00 0.00 174.74 174.31 2wf3 s VAL 422 N -2.33 4.76 0.00 -5.38 1.01 -1.26 -5.02 120.40 112.18 2wf3 s VAL 422 Ca 0.63 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.79 2wf3 s VAL 422 Cb -0.14 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.36 2wf3 s VAL 422 CO 0.29 0.54 0.00 0.00 0.00 0.00 0.00 175.10 175.93 2wf3 n HIS 423 N 1.69 0.00 -2.65 5.22 1.44 -1.26 -1.99 115.22 117.67 2wf3 n HIS 423 Ca -0.10 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.61 2wf3 n HIS 423 Cb 0.51 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.62 2wf3 n HIS 423 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 2wf3 n ASP 424 N 0.00 1.36 -0.14 4.39 5.68 -0.69 -5.02 116.55 122.13 2wf3 n ASP 424 Ca 0.00 0.00 0.15 0.00 -0.50 0.00 0.00 54.79 54.44 2wf3 n ASP 424 Cb 0.00 0.00 0.68 0.00 -1.14 0.00 0.00 41.12 40.66 2wf3 n ASP 424 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2wf3 n GLU 425 N 0.00 0.87 -0.04 0.11 0.00 -1.26 -4.03 120.64 116.29 2wf3 n GLU 425 Ca 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 57.16 56.84 2wf3 n GLU 425 Cb 0.00 -1.49 -0.06 0.00 0.00 0.00 0.00 31.44 29.89 2wf3 n GLU 425 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2wf3 n PHE 426 N -0.82 0.00 -3.95 -1.84 3.01 -1.26 -5.08 117.46 107.51 2wf3 n PHE 426 Ca 0.17 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.54 2wf3 n PHE 426 Cb 0.25 -0.37 -0.09 0.00 -0.01 0.00 0.00 39.48 39.26 2wf3 n PHE 426 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2wf3 s ARG 427 N -2.18 0.59 0.03 -1.08 0.52 -1.26 -5.17 118.95 110.40 2wf3 s ARG 427 Ca -0.05 -0.83 -0.03 0.00 -0.52 0.00 0.00 55.73 54.29 2wf3 s ARG 427 Cb 0.02 0.23 -0.02 0.00 0.52 0.00 0.00 34.95 35.70 2wf3 s ARG 427 CO 0.29 -0.14 0.05 -0.08 0.02 0.00 0.00 175.30 175.44 2wf3 s THR 428 N -2.82 0.14 0.50 0.02 -1.32 -1.26 -1.70 115.64 109.19 2wf3 s THR 428 Ca -0.03 -1.13 -0.23 0.00 -1.21 0.00 0.00 61.69 59.09 2wf3 s THR 428 Cb 0.00 -0.79 -0.06 0.00 -1.51 0.00 0.00 72.50 70.14 2wf3 s THR 428 CO -0.06 -0.62 1.29 0.00 -2.21 0.00 0.00 174.62 173.03 2wf3 s ALA 429 N -2.41 2.94 0.06 11.08 0.00 -0.84 -4.97 121.76 127.63 2wf3 s ALA 429 Ca -0.07 1.20 -0.10 0.00 0.00 0.00 0.00 51.96 53.00 2wf3 s ALA 429 Cb -0.03 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.60 2wf3 s ALA 429 CO -0.04 -1.07 0.21 0.00 0.00 0.00 0.00 175.76 174.86 2wf3 s ALA 430 N -1.37 -0.36 -0.15 0.00 0.00 -1.25 -4.95 121.76 113.67 2wf3 s ALA 430 Ca 0.67 -0.38 -0.00 0.00 0.00 0.00 0.00 51.96 52.24 2wf3 s ALA 430 Cb -0.37 0.39 0.04 0.00 0.00 0.00 0.00 23.12 23.18 2wf3 s ALA 430 CO 0.44 -0.44 -0.06 0.08 0.00 0.00 0.00 175.76 175.77 2wf3 s VAL 431 N -3.18 1.13 -0.02 0.00 1.01 -1.26 -1.21 120.40 116.87 2wf3 s VAL 431 Ca -0.00 -0.57 -0.05 0.00 0.00 0.00 0.00 61.98 61.36 2wf3 s VAL 431 Cb 0.02 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 35.14 2wf3 s VAL 431 CO -0.07 0.20 0.12 -1.61 0.00 0.00 0.00 175.10 173.73 2wf3 s GLU 432 N 1.63 0.32 0.03 2.72 2.02 -0.54 -4.90 118.70 119.98 2wf3 s GLU 432 Ca 0.02 -0.17 -0.24 0.00 0.02 0.00 0.00 54.97 54.60 2wf3 s GLU 432 Cb -0.15 0.14 0.08 0.00 0.10 0.00 0.00 34.13 34.30 2wf3 s GLU 432 CO -0.08 -0.07 1.10 0.41 0.02 0.00 0.00 175.26 176.64 2wf3 n GLY 433 N 2.14 0.36 3.88 -1.39 0.00 -1.26 -1.12 105.19 107.80 2wf3 n GLY 433 Ca -0.18 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.49 2wf3 n GLY 433 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wf3 s PRO 434 N -2.02 3.74 0.02 1.61 0.04 -1.26 -5.09 135.00 132.03 2wf3 s PRO 434 Ca 0.25 0.30 0.07 0.00 0.04 0.00 0.00 61.00 61.67 2wf3 s PRO 434 Cb -0.01 -2.50 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 2wf3 s PRO 434 CO 0.01 0.08 -0.21 -0.06 0.04 0.00 0.00 177.00 176.86 2wf3 s PHE 435 N -2.23 2.49 0.30 0.56 0.40 0.18 -4.95 117.98 114.73 2wf3 s PHE 435 Ca 0.49 -0.31 0.11 0.00 -0.60 0.00 0.00 56.93 56.62 2wf3 s PHE 435 Cb -0.10 -1.48 -0.05 0.00 0.51 0.00 0.00 43.02 41.89 2wf3 s PHE 435 CO 0.30 0.16 -0.17 0.08 0.70 0.00 0.00 175.22 176.29 2wf3 s VAL 436 N -0.81 2.45 -0.15 -0.44 1.01 -1.26 -0.64 120.40 120.56 2wf3 s VAL 436 Ca 0.13 -2.35 -0.15 0.00 0.00 0.00 0.00 61.98 59.61 2wf3 s VAL 436 Cb -0.10 -2.40 0.04 0.00 0.00 0.00 0.00 36.38 33.92 2wf3 s VAL 436 CO 0.03 -0.35 0.42 0.28 0.00 0.00 0.00 175.10 175.48 2wf3 s THR 437 N -2.53 0.00 0.06 3.92 -1.32 -0.90 -4.99 115.64 109.89 2wf3 s THR 437 Ca 0.31 -0.01 -0.02 0.00 -1.21 0.00 0.00 61.69 60.76 2wf3 s THR 437 Cb -0.03 -0.59 -0.27 0.00 -1.51 0.00 0.00 72.50 70.09 2wf3 s THR 437 CO 0.16 -0.01 1.09 0.17 -2.21 0.00 0.00 174.62 173.82 2wf3 h LEU 438 N 5.42 0.34 -9.45 9.08 -0.00 -2.01 -3.45 115.31 115.24 2wf3 h LEU 438 Ca -0.27 -0.39 -0.54 0.00 -0.00 0.00 0.00 57.88 56.69 2wf3 h LEU 438 Cb 1.18 -0.11 0.02 0.00 -0.00 0.00 0.00 40.66 41.75 2wf3 h LEU 438 CO 0.25 1.31 0.89 -0.62 -0.00 0.00 0.00 178.44 180.27 2wf3 s ASP 439 N -7.01 6.72 -0.04 0.17 3.68 -1.26 -4.89 116.67 114.04 2wf3 s ASP 439 Ca -0.04 2.34 0.20 0.00 2.13 0.00 0.00 52.55 57.18 2wf3 s ASP 439 Cb 0.07 -2.57 0.63 0.00 -1.45 0.00 0.00 42.92 39.61 2wf3 s ASP 439 CO 0.87 -0.79 1.54 0.23 0.13 0.00 0.00 175.17 177.14 2wf3 n MET 440 N 5.16 3.08 -2.14 4.34 2.81 -1.26 -4.95 117.12 124.16 2wf3 n MET 440 Ca 0.14 -2.68 -0.41 0.00 -1.81 0.00 0.00 57.70 52.94 2wf3 n MET 440 Cb 0.42 -1.65 -0.03 0.00 -0.71 0.00 0.00 33.22 31.25 2wf3 n MET 440 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2wf3 s GLU 441 N -1.32 4.35 0.17 0.03 2.12 -1.26 -5.00 118.70 117.80 2wf3 s GLU 441 Ca 0.47 2.16 -0.30 0.00 0.36 0.00 0.00 54.97 57.66 2wf3 s GLU 441 Cb 0.27 -3.13 -0.07 0.00 0.26 0.00 0.00 34.13 31.45 2wf3 s GLU 441 CO 0.28 -0.27 0.97 0.34 -0.54 0.00 0.00 175.26 176.04 2wf3 s ASP 442 N 0.07 7.54 0.00 -1.70 2.15 -1.26 -4.94 116.67 118.53 2wf3 s ASP 442 Ca 0.55 1.89 0.25 0.00 0.43 0.00 0.00 52.55 55.67 2wf3 s ASP 442 Cb -0.39 -2.60 0.40 0.00 -0.30 0.00 0.00 42.92 40.03 2wf3 s ASP 442 CO 0.44 0.01 1.34 0.00 -0.17 0.00 0.00 175.17 176.79 2wf3 s GLY 444 N -2.50 2.95 -0.09 0.00 0.00 -1.26 -3.68 107.32 102.74 2wf3 s GLY 444 Ca 0.21 0.98 -0.01 0.00 0.00 0.00 0.00 44.72 45.91 2wf3 s GLY 444 CO 0.55 1.55 -0.03 -1.82 0.00 0.00 0.00 173.10 173.35 2wf3 h TYR 445 N 3.18 0.00 -4.16 1.90 3.20 -1.84 -3.45 116.97 115.80 2wf3 h TYR 445 Ca -0.48 0.00 -0.51 0.00 3.14 0.00 0.00 58.73 60.88 2wf3 h TYR 445 Cb 1.22 0.00 0.11 0.00 1.54 0.00 0.00 36.73 39.60 2wf3 h TYR 445 CO 0.57 0.00 0.40 -0.80 -1.64 0.00 0.00 178.16 176.68 2wf3 s ASN 446 N -5.30 5.08 0.00 -2.11 0.01 -1.26 -5.10 114.94 106.26 2wf3 s ASN 446 Ca -0.02 2.13 0.00 0.00 -0.71 0.00 0.00 52.86 54.26 2wf3 s ASN 446 Cb 0.00 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 39.10 2wf3 s ASN 446 CO 0.03 -1.65 0.00 0.00 -1.51 0.00 0.00 177.10 173.97