#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wfc s PRO 6 N 0.00 0.63 0.16 -0.14 0.04 -1.26 -5.05 135.00 129.38 1wfc s PRO 6 Ca 0.00 -0.17 -0.12 0.00 0.04 0.00 0.00 61.00 60.75 1wfc s PRO 6 Cb 0.00 -1.82 -0.07 0.00 0.04 0.00 0.00 34.50 32.65 1wfc s PRO 6 CO 0.00 -2.46 0.53 0.99 0.04 0.00 0.00 177.00 176.10 1wfc s THR 7 N -3.61 4.91 -0.02 1.26 2.01 -1.26 -5.01 115.64 113.92 1wfc s THR 7 Ca 0.70 0.67 0.08 0.00 0.31 0.00 0.00 61.69 63.45 1wfc s THR 7 Cb -0.08 -3.69 -0.02 0.00 0.01 0.00 0.00 72.50 68.73 1wfc s THR 7 CO 0.53 0.16 -0.25 -0.36 -0.69 0.00 0.00 174.62 174.01 1wfc s PHE 8 N -1.55 2.30 0.26 4.92 0.40 -1.26 -0.77 117.98 122.28 1wfc s PHE 8 Ca 0.40 -0.47 0.11 0.00 -0.60 0.00 0.00 56.93 56.37 1wfc s PHE 8 Cb -0.14 -1.48 -0.05 0.00 0.51 0.00 0.00 43.02 41.86 1wfc s PHE 8 CO 0.20 -0.06 -0.20 1.52 0.70 0.00 0.00 175.22 177.37 1wfc s TYR 9 N -0.54 2.22 -0.08 0.36 1.13 0.01 -4.87 117.35 115.59 1wfc s TYR 9 Ca 0.08 -0.36 0.02 0.00 -1.41 0.00 0.00 57.07 55.41 1wfc s TYR 9 Cb -0.10 -0.98 -0.02 0.00 -1.10 0.00 0.00 41.96 39.75 1wfc s TYR 9 CO -0.00 0.66 -0.15 1.03 -2.51 0.00 0.00 175.55 174.57 1wfc s ARG 10 N -3.43 2.82 0.02 -3.49 0.52 -1.26 -1.19 118.95 112.94 1wfc s ARG 10 Ca 0.28 -0.71 -0.12 0.00 -0.52 0.00 0.00 55.73 54.66 1wfc s ARG 10 Cb -0.05 -2.45 0.01 0.00 0.52 0.00 0.00 34.95 32.99 1wfc s ARG 10 CO 0.14 0.46 0.26 1.14 0.02 0.00 0.00 175.30 177.31 1wfc s GLN 11 N -0.30 0.70 -0.49 3.54 -2.07 0.70 -4.94 119.66 116.80 1wfc s GLN 11 Ca 0.02 -0.44 -0.18 0.00 -1.82 0.00 0.00 55.36 52.94 1wfc s GLN 11 Cb -0.13 0.30 0.06 0.00 -1.09 0.00 0.00 33.01 32.15 1wfc s GLN 11 CO 0.03 -0.20 0.55 -2.00 -1.32 0.00 0.00 175.29 172.34 1wfc s GLU 12 N -2.07 3.09 -0.10 9.60 2.12 -1.26 0.55 118.70 130.64 1wfc s GLU 12 Ca -0.09 -0.96 0.15 0.00 0.36 0.00 0.00 54.97 54.44 1wfc s GLU 12 Cb -0.03 -4.08 0.34 0.00 0.26 0.00 0.00 34.13 30.62 1wfc s GLU 12 CO -0.01 -1.12 1.16 1.28 -0.54 0.00 0.00 175.26 176.03 1wfc n LEU 13 N 5.88 1.73 -1.03 2.70 4.77 -1.26 -4.93 117.00 124.87 1wfc n LEU 13 Ca -0.08 -2.76 0.10 0.00 -0.03 0.00 0.00 56.01 53.24 1wfc n LEU 13 Cb 0.45 -0.27 -0.04 0.00 -2.33 0.00 0.00 43.42 41.23 1wfc n LEU 13 CO 0.51 0.84 -0.29 0.41 -1.33 0.00 0.00 177.39 177.53 1wfc n THR 16 N -0.52 -0.19 -3.22 -5.08 -1.04 -1.26 -5.01 114.28 97.96 1wfc n THR 16 Ca 0.12 0.36 -0.39 0.00 -2.04 0.00 0.00 64.05 62.10 1wfc n THR 16 Cb 0.82 -0.63 -0.06 0.00 -1.82 0.00 0.00 70.33 68.64 1wfc n THR 16 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1wfc s ILE 17 N -3.69 5.10 -0.16 12.58 1.01 -1.26 -4.93 121.20 129.86 1wfc s ILE 17 Ca 0.00 1.05 -0.07 0.00 0.00 0.00 0.00 60.65 61.63 1wfc s ILE 17 Cb 0.00 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 1wfc s ILE 17 CO 0.00 0.20 0.06 0.26 0.00 0.00 0.00 174.94 175.47 1wfc s TRP 18 N 1.40 3.29 -0.28 3.97 0.52 0.19 -4.90 118.94 123.13 1wfc s TRP 18 Ca 0.27 0.16 0.01 0.00 0.02 0.00 0.00 56.10 56.56 1wfc s TRP 18 Cb -0.16 -2.01 0.05 0.00 -1.15 0.00 0.00 33.47 30.21 1wfc s TRP 18 CO 0.11 0.29 -0.06 -2.00 0.02 0.00 0.00 176.95 175.31 1wfc s GLU 19 N -0.04 2.36 0.14 4.98 2.12 -1.26 -0.21 118.70 126.79 1wfc s GLU 19 Ca 0.06 -1.29 0.06 0.00 0.36 0.00 0.00 54.97 54.17 1wfc s GLU 19 Cb -0.12 -3.01 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 1wfc s GLU 19 CO 0.01 -0.58 -0.14 0.14 -0.54 0.00 0.00 175.26 174.15 1wfc s VAL 20 N 1.18 1.42 0.43 3.70 -7.23 -0.33 -4.64 120.40 114.93 1wfc s VAL 20 Ca -0.07 -1.86 -0.25 0.00 -1.81 0.00 0.00 61.98 57.99 1wfc s VAL 20 Cb -0.20 -1.69 -0.09 0.00 0.56 0.00 0.00 36.38 34.96 1wfc s VAL 20 CO -0.03 -0.48 1.23 -2.65 -0.31 0.00 0.00 175.10 172.86 1wfc n PRO 21 N 0.26 1.80 0.00 4.82 -0.02 -1.26 -0.80 135.00 139.80 1wfc n PRO 21 Ca -0.13 0.64 0.04 0.00 -2.02 0.00 0.00 63.50 62.03 1wfc n PRO 21 Cb 0.58 -2.34 0.20 0.00 -0.02 0.00 0.00 33.50 31.93 1wfc n PRO 21 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1wfc n GLU 22 N -0.04 0.11 0.30 -0.52 0.28 0.05 -1.64 120.64 119.18 1wfc n GLU 22 Ca 0.07 0.22 0.16 0.00 -0.16 0.00 0.00 57.16 57.45 1wfc n GLU 22 Cb 0.40 -1.50 0.93 0.00 1.43 0.00 0.00 31.44 32.70 1wfc n GLU 22 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 177.13 177.04 1wfc h ARG 23 N 0.00 0.00 -5.19 3.44 0.11 -1.90 -3.41 114.38 107.44 1wfc h ARG 23 Ca 0.00 0.00 -0.65 0.00 0.10 0.00 0.00 59.98 59.43 1wfc h ARG 23 Cb 0.08 0.00 -0.16 0.00 1.11 0.00 0.00 29.97 31.00 1wfc h ARG 23 CO 0.00 0.02 -0.07 0.71 0.10 0.00 0.00 179.97 180.73 1wfc s TYR 24 N -4.46 3.17 0.28 4.08 2.02 -0.65 -0.56 117.35 121.23 1wfc s TYR 24 Ca -0.04 0.07 0.11 0.00 -0.37 0.00 0.00 57.07 56.83 1wfc s TYR 24 Cb 0.14 -2.95 -0.05 0.00 -0.40 0.00 0.00 41.96 38.70 1wfc s TYR 24 CO 0.53 -0.59 -0.18 -0.65 -1.57 0.00 0.00 175.55 173.09 1wfc s GLN 25 N 2.38 1.66 -1.18 -0.62 -1.52 0.15 -4.77 119.66 115.76 1wfc s GLN 25 Ca 0.18 -1.77 -0.05 0.00 -1.95 0.00 0.00 55.36 51.77 1wfc s GLN 25 Cb -0.16 -1.68 -0.02 0.00 -0.22 0.00 0.00 33.01 30.93 1wfc s GLN 25 CO 0.14 0.29 0.85 0.09 -0.25 0.00 0.00 175.29 176.41 1wfc n ASN 26 N -0.62 -3.57 -4.74 5.90 3.02 -1.26 -1.18 115.26 112.81 1wfc n ASN 26 Ca -0.05 -0.77 -0.41 0.00 -0.03 0.00 0.00 54.58 53.32 1wfc n ASN 26 Cb 0.61 -4.57 -0.03 0.00 -0.61 0.00 0.00 39.78 35.17 1wfc n ASN 26 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wfc s LEU 27 N -6.19 4.46 -0.10 3.41 1.02 -1.26 -4.47 118.68 115.54 1wfc s LEU 27 Ca 0.20 2.34 -0.01 0.00 0.02 0.00 0.00 54.13 56.67 1wfc s LEU 27 Cb -0.04 -3.62 0.03 0.00 0.02 0.00 0.00 46.19 42.59 1wfc s LEU 27 CO 0.78 -0.39 -0.00 -0.55 0.02 0.00 0.00 176.35 176.20 1wfc s SER 28 N -0.06 1.97 0.12 2.29 0.15 0.24 -4.94 113.70 113.47 1wfc s SER 28 Ca 0.52 -0.28 -0.33 0.00 0.70 0.00 0.00 55.95 56.56 1wfc s SER 28 Cb -0.34 -0.54 -0.13 0.00 -1.71 0.00 0.00 66.02 63.30 1wfc s SER 28 CO 0.40 -0.21 1.71 -0.81 1.20 0.00 0.00 173.24 175.53 1wfc n PRO 29 N 5.09 2.39 0.00 5.44 -0.04 -1.26 -0.13 135.00 146.50 1wfc n PRO 29 Ca -0.08 0.87 0.00 0.00 -0.04 0.00 0.00 63.50 64.24 1wfc n PRO 29 Cb 0.49 -2.69 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 1wfc n PRO 29 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1wfc n VAL 30 N 4.06 0.00 -3.60 0.52 0.24 0.35 -4.83 118.33 115.07 1wfc n VAL 30 Ca 0.18 -0.08 -0.08 0.00 -2.04 0.00 0.00 64.34 62.32 1wfc n VAL 30 Cb 0.32 1.32 -0.02 0.00 -1.47 0.00 0.00 33.84 33.99 1wfc n VAL 30 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1wfc s GLY 31 N -0.10 -0.39 -0.08 7.63 0.00 -0.29 -4.93 107.32 109.16 1wfc s GLY 31 Ca 0.00 0.49 -0.31 0.00 0.00 0.00 0.00 44.72 44.91 1wfc s GLY 31 CO 0.00 0.15 1.36 -0.56 0.00 0.00 0.00 173.10 174.06 1wfc s SER 32 N -2.72 0.00 0.00 1.64 0.01 -1.25 0.12 113.70 111.50 1wfc s SER 32 Ca 0.07 -0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.28 1wfc s SER 32 Cb -0.02 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.25 1wfc s SER 32 CO -0.05 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.14 1wfc n GLY 33 N -0.92 3.47 0.05 3.44 0.00 -1.21 -4.85 105.19 105.16 1wfc n GLY 33 Ca 0.04 -1.76 0.02 0.00 0.00 0.00 0.00 46.02 44.32 1wfc n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wfc n ALA 34 N -1.71 0.52 0.12 4.61 0.00 -1.26 -0.61 120.51 122.19 1wfc n ALA 34 Ca 0.00 0.03 -0.24 0.00 0.00 0.00 0.00 53.44 53.23 1wfc n ALA 34 Cb 0.00 -0.56 -0.16 0.00 0.00 0.00 0.00 19.45 18.73 1wfc n ALA 34 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1wfc h TYR 35 N 0.00 0.89 0.00 0.00 0.05 -1.91 -3.41 116.97 112.60 1wfc h TYR 35 Ca 0.00 -0.65 0.00 0.00 0.05 0.00 0.00 58.73 58.13 1wfc h TYR 35 Cb 0.55 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.26 1wfc h TYR 35 CO 0.00 1.56 0.00 0.41 -1.05 0.00 0.00 178.16 179.08 1wfc n GLY 36 N 1.74 2.88 3.92 3.88 0.00 0.22 -0.33 105.19 117.49 1wfc n GLY 36 Ca -0.18 -0.85 -0.27 0.00 0.00 0.00 0.00 46.02 44.72 1wfc n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wfc s SER 37 N 0.00 6.38 -0.06 1.61 0.01 -0.51 -3.29 113.70 117.84 1wfc s SER 37 Ca 0.00 0.59 0.01 0.00 1.31 0.00 0.00 55.95 57.86 1wfc s SER 37 Cb 0.00 -2.09 0.02 0.00 0.21 0.00 0.00 66.02 64.16 1wfc s SER 37 CO 0.00 -0.22 -0.07 -0.69 0.41 0.00 0.00 173.24 172.67 1wfc s VAL 38 N -2.15 0.76 0.03 3.43 1.01 0.12 0.03 120.40 123.63 1wfc s VAL 38 Ca 0.42 -0.24 0.04 0.00 0.00 0.00 0.00 61.98 62.20 1wfc s VAL 38 Cb -0.10 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 1wfc s VAL 38 CO 0.32 0.28 -0.05 0.00 0.00 0.00 0.00 175.10 175.66 1wfc s ALA 40 N -1.09 3.35 0.19 0.00 0.00 0.82 -0.35 121.76 124.68 1wfc s ALA 40 Ca 0.19 0.26 -0.12 0.00 0.00 0.00 0.00 51.96 52.29 1wfc s ALA 40 Cb -0.11 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.09 1wfc s ALA 40 CO 0.10 0.28 0.39 0.00 0.00 0.00 0.00 175.76 176.54 1wfc s ALA 41 N -1.58 -0.36 -0.30 0.00 0.00 -0.08 -0.59 121.76 118.86 1wfc s ALA 41 Ca 0.46 -0.66 -0.09 0.00 0.00 0.00 0.00 51.96 51.67 1wfc s ALA 41 Cb -0.17 0.89 -0.01 0.00 0.00 0.00 0.00 23.12 23.83 1wfc s ALA 41 CO 0.21 -0.73 0.14 0.12 0.00 0.00 0.00 175.76 175.50 1wfc s PHE 42 N -3.94 3.16 -0.83 0.00 5.36 -0.32 -0.20 117.98 121.21 1wfc s PHE 42 Ca 0.15 -0.50 -0.26 0.00 -0.96 0.00 0.00 56.93 55.36 1wfc s PHE 42 Cb 0.01 -2.33 0.04 0.00 -0.34 0.00 0.00 43.02 40.40 1wfc s PHE 42 CO 0.00 -0.42 1.33 0.34 -1.46 0.00 0.00 175.22 175.02 1wfc s ASP 43 N 1.62 6.27 0.45 6.13 -1.08 0.03 -0.67 116.67 129.42 1wfc s ASP 43 Ca 0.05 -0.77 0.17 0.00 -0.52 0.00 0.00 52.55 51.48 1wfc s ASP 43 Cb -0.17 -2.56 1.12 0.00 -1.46 0.00 0.00 42.92 39.85 1wfc s ASP 43 CO 0.06 -1.73 1.97 0.71 0.52 0.00 0.00 175.17 176.70 1wfc h THR 44 N 6.27 0.84 0.00 1.71 1.35 -1.13 0.55 112.91 122.50 1wfc h THR 44 Ca -0.13 -0.11 -0.09 0.00 -0.55 0.00 0.00 66.41 65.53 1wfc h THR 44 Cb 1.04 0.49 -0.01 0.00 -1.73 0.00 0.00 68.15 67.94 1wfc h THR 44 CO 1.33 0.06 -0.41 0.50 -0.25 0.00 0.00 175.52 176.74 1wfc h LYS 45 N 0.32 0.00 -0.00 4.72 3.64 -1.89 -3.27 116.57 120.09 1wfc h LYS 45 Ca 0.29 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 1wfc h LYS 45 Cb 0.71 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1wfc h LYS 45 CO -0.07 0.41 -0.30 0.25 -2.27 0.00 0.00 179.45 177.47 1wfc n THR 46 N -3.32 0.00 -1.06 1.00 -2.24 -0.87 -4.95 114.28 102.85 1wfc n THR 46 Ca 0.01 -0.35 -0.02 0.00 -2.27 0.00 0.00 64.05 61.43 1wfc n THR 46 Cb 0.63 1.01 -0.01 0.00 -2.10 0.00 0.00 70.33 69.85 1wfc n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wfc n GLY 47 N 1.13 0.40 3.85 3.38 0.00 0.19 -4.97 105.19 109.16 1wfc n GLY 47 Ca 0.01 -0.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1wfc n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wfc s LEU 48 N -0.43 3.95 -0.18 0.99 1.43 -1.22 -4.85 118.68 118.36 1wfc s LEU 48 Ca 0.00 1.34 -0.20 0.00 -1.03 0.00 0.00 54.13 54.25 1wfc s LEU 48 Cb 0.00 -4.18 -0.03 0.00 0.03 0.00 0.00 46.19 42.01 1wfc s LEU 48 CO 0.00 -0.31 0.58 -0.13 0.23 0.00 0.00 176.35 176.72 1wfc s ARG 49 N -3.30 4.23 0.21 1.70 1.81 -1.26 -0.79 118.95 121.56 1wfc s ARG 49 Ca 0.55 0.55 0.05 0.00 -1.72 0.00 0.00 55.73 55.17 1wfc s ARG 49 Cb -0.10 -3.55 -0.05 0.00 -0.45 0.00 0.00 34.95 30.80 1wfc s ARG 49 CO 0.21 -0.14 -0.08 0.14 -0.68 0.00 0.00 175.30 174.75 1wfc s VAL 50 N 1.60 1.37 -0.18 3.52 -7.23 0.72 -0.75 120.40 119.45 1wfc s VAL 50 Ca 0.27 -2.11 -0.05 0.00 -1.81 0.00 0.00 61.98 58.29 1wfc s VAL 50 Cb -0.16 -2.15 -0.03 0.00 0.56 0.00 0.00 36.38 34.60 1wfc s VAL 50 CO 0.11 -0.51 0.01 0.00 -0.31 0.00 0.00 175.10 174.40 1wfc s ALA 51 N -3.20 3.13 -0.23 1.32 0.00 0.13 -0.90 121.76 122.01 1wfc s ALA 51 Ca 0.24 -0.86 -0.03 0.00 0.00 0.00 0.00 51.96 51.31 1wfc s ALA 51 Cb 0.03 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.41 1wfc s ALA 51 CO 0.07 0.07 -0.05 0.08 0.00 0.00 0.00 175.76 175.93 1wfc s VAL 52 N 0.60 3.20 -0.21 0.00 1.01 0.53 -1.03 120.40 124.51 1wfc s VAL 52 Ca -0.00 -0.67 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 1wfc s VAL 52 Cb -0.14 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 1wfc s VAL 52 CO 0.02 0.35 0.04 -0.75 0.00 0.00 0.00 175.10 174.75 1wfc s LYS 53 N 1.43 3.73 -0.38 2.72 2.20 0.11 -0.64 119.74 128.92 1wfc s LYS 53 Ca 0.04 -0.46 -0.15 0.00 -0.36 0.00 0.00 55.97 55.05 1wfc s LYS 53 Cb -0.15 -3.18 0.00 0.00 -1.51 0.00 0.00 37.83 32.99 1wfc s LYS 53 CO -0.04 0.04 0.31 0.21 -0.36 0.00 0.00 175.35 175.50 1wfc s LYS 54 N 0.98 3.25 0.30 4.03 2.20 0.10 -0.86 119.74 129.75 1wfc s LYS 54 Ca 0.03 -0.77 -0.29 0.00 -0.36 0.00 0.00 55.97 54.57 1wfc s LYS 54 Cb -0.14 -3.89 -0.11 0.00 -1.51 0.00 0.00 37.83 32.18 1wfc s LYS 54 CO 0.02 -0.63 1.47 -0.51 -0.36 0.00 0.00 175.35 175.35 1wfc s LEU 55 N 1.80 4.37 -0.05 5.43 1.43 -0.68 -1.43 118.68 129.55 1wfc s LEU 55 Ca 0.07 2.83 -0.30 0.00 -1.03 0.00 0.00 54.13 55.70 1wfc s LEU 55 Cb -0.18 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.37 1wfc s LEU 55 CO 0.11 -0.77 1.13 -0.44 0.23 0.00 0.00 176.35 176.60 1wfc s SER 56 N 0.17 7.14 -1.60 2.29 0.01 0.55 -4.47 113.70 117.79 1wfc s SER 56 Ca 0.58 1.74 -0.06 0.00 1.31 0.00 0.00 55.95 59.52 1wfc s SER 56 Cb -0.44 -2.56 0.06 0.00 0.21 0.00 0.00 66.02 63.28 1wfc s SER 56 CO 0.50 -0.51 0.25 0.54 0.41 0.00 0.00 173.24 174.44 1wfc n ARG 57 N 4.91 -1.55 -0.33 12.44 1.74 -1.26 -4.83 116.66 127.79 1wfc n ARG 57 Ca 0.10 0.18 0.03 0.00 -0.77 0.00 0.00 57.85 57.39 1wfc n ARG 57 Cb 0.47 -4.10 0.17 0.00 -1.02 0.00 0.00 32.46 27.99 1wfc n ARG 57 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1wfc h PRO 58 N -1.61 0.94 -1.31 5.56 0.13 -1.86 -2.06 132.00 131.79 1wfc h PRO 58 Ca -0.64 -0.06 -0.65 0.00 -0.87 0.00 0.00 66.00 63.79 1wfc h PRO 58 Cb 1.39 -0.21 -0.35 0.00 0.13 0.00 0.00 31.00 31.96 1wfc h PRO 58 CO 0.73 0.62 0.10 1.19 -0.23 0.00 0.00 178.00 180.41 1wfc n PHE 59 N -4.63 3.10 0.69 1.56 3.72 -1.26 -1.68 117.46 118.96 1wfc n PHE 59 Ca 0.14 -2.67 0.13 0.00 -0.05 0.00 0.00 57.45 54.99 1wfc n PHE 59 Cb 0.23 -0.77 0.47 0.00 -0.94 0.00 0.00 39.48 38.48 1wfc n PHE 59 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 1wfc n GLN 60 N -0.66 0.15 -3.52 -1.08 7.27 -0.77 -4.75 117.38 114.01 1wfc n GLN 60 Ca 0.50 0.19 -0.13 0.00 0.07 0.00 0.00 57.00 57.62 1wfc n GLN 60 Cb 0.63 -1.70 -0.05 0.00 2.41 0.00 0.00 30.24 31.54 1wfc n GLN 60 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 1wfc s SER 61 N -3.89 -0.52 0.22 1.69 1.04 -1.26 -4.94 113.70 106.04 1wfc s SER 61 Ca 0.10 0.41 -0.17 0.00 0.48 0.00 0.00 55.95 56.78 1wfc s SER 61 Cb 0.14 0.46 0.23 0.00 0.10 0.00 0.00 66.02 66.94 1wfc s SER 61 CO 0.51 -0.59 1.58 0.40 0.98 0.00 0.00 173.24 176.12 1wfc h ILE 62 N 2.57 0.12 -0.26 -1.02 2.04 -1.93 0.39 117.51 119.42 1wfc h ILE 62 Ca -0.25 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.67 1wfc h ILE 62 Cb 1.19 0.12 -0.06 0.00 -0.74 0.00 0.00 36.82 37.32 1wfc h ILE 62 CO 0.35 0.00 -0.16 0.40 0.00 0.00 0.00 178.15 178.74 1wfc h ILE 63 N -0.07 0.53 -0.61 -0.67 2.04 -1.96 0.31 117.51 117.09 1wfc h ILE 63 Ca 0.31 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 66.10 1wfc h ILE 63 Cb 0.58 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 1wfc h ILE 63 CO -0.82 0.00 0.10 0.45 0.00 0.00 0.00 178.15 177.87 1wfc h HIS 64 N -0.14 1.07 -0.36 1.37 3.86 -1.27 0.15 115.15 119.83 1wfc h HIS 64 Ca 0.14 -0.15 0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1wfc h HIS 64 Cb 0.36 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.52 1wfc h HIS 64 CO -0.34 0.92 0.23 0.00 0.86 0.00 0.00 177.93 179.60 1wfc h ALA 65 N 1.02 0.45 -0.63 2.45 0.00 0.60 0.15 119.26 123.30 1wfc h ALA 65 Ca 0.18 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1wfc h ALA 65 Cb 0.43 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1wfc h ALA 65 CO 0.01 -0.10 0.16 -0.22 0.00 0.00 0.00 179.25 179.10 1wfc h LYS 66 N 0.47 0.97 -0.06 0.00 3.64 -0.02 -0.85 116.57 120.72 1wfc h LYS 66 Ca 0.13 -0.21 -0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1wfc h LYS 66 Cb -0.04 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.63 1wfc h LYS 66 CO -0.04 0.86 0.03 -0.09 -2.27 0.00 0.00 179.45 177.94 1wfc h ARG 67 N 0.93 0.08 -0.56 1.90 2.43 -0.19 0.12 114.38 119.09 1wfc h ARG 67 Ca 0.20 -0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.48 1wfc h ARG 67 Cb 0.32 -0.02 -0.10 0.00 -0.42 0.00 0.00 29.97 29.75 1wfc h ARG 67 CO -0.00 0.11 -0.08 1.15 -1.51 0.00 0.00 179.97 179.64 1wfc h THR 68 N 0.02 0.48 -0.39 0.20 2.02 -0.37 0.23 112.91 115.10 1wfc h THR 68 Ca 0.02 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 67.21 1wfc h THR 68 Cb 0.06 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 66.87 1wfc h THR 68 CO -0.00 0.01 0.19 0.22 0.37 0.00 0.00 175.52 176.31 1wfc h TYR 69 N 0.05 0.35 -0.22 3.16 3.20 -0.84 -1.11 116.97 121.55 1wfc h TYR 69 Ca 0.28 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.15 1wfc h TYR 69 Cb 0.43 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1wfc h TYR 69 CO -0.41 0.18 0.10 -0.09 -1.64 0.00 0.00 178.16 176.30 1wfc h ARG 70 N 0.39 0.32 -0.07 1.82 2.43 0.30 0.74 114.38 120.32 1wfc h ARG 70 Ca 0.16 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1wfc h ARG 70 Cb 0.07 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1wfc h ARG 70 CO -0.12 0.35 0.04 1.49 -1.51 0.00 0.00 179.97 180.22 1wfc h GLU 71 N 0.22 0.10 -0.50 0.20 4.81 -0.77 0.23 114.58 118.87 1wfc h GLU 71 Ca 0.08 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.34 1wfc h GLU 71 Cb 0.13 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1wfc h GLU 71 CO -0.01 0.12 0.26 1.25 -0.73 0.00 0.00 179.01 179.90 1wfc h LEU 72 N 0.05 0.38 -0.31 1.64 5.85 -1.03 0.28 115.31 122.17 1wfc h LEU 72 Ca 0.03 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1wfc h LEU 72 Cb 0.05 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1wfc h LEU 72 CO -0.00 0.26 0.18 0.03 -0.34 0.00 0.00 178.44 178.57 1wfc h ARG 73 N 0.51 0.36 0.94 1.25 2.47 -0.43 0.91 114.38 120.39 1wfc h ARG 73 Ca 0.22 -0.02 -0.05 0.00 -1.26 0.00 0.00 59.98 58.87 1wfc h ARG 73 Cb 0.12 -0.08 0.01 0.00 -1.65 0.00 0.00 29.97 28.37 1wfc h ARG 73 CO -0.15 0.24 -0.45 -0.07 0.56 0.00 0.00 179.97 180.10 1wfc h LEU 74 N 0.38 -1.08 -0.82 3.04 3.38 -0.03 -2.83 115.31 117.34 1wfc h LEU 74 Ca 0.12 0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.19 1wfc h LEU 74 Cb -0.01 0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 1wfc h LEU 74 CO -0.05 -0.77 0.50 -0.07 0.09 0.00 0.00 178.44 178.14 1wfc h LEU 75 N -1.26 0.76 -1.81 1.67 3.38 -0.34 0.13 115.31 117.84 1wfc h LEU 75 Ca -0.13 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1wfc h LEU 75 Cb 0.97 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1wfc h LEU 75 CO 0.21 0.48 0.00 0.11 0.09 0.00 0.00 178.44 179.33 1wfc h LYS 76 N 0.89 0.00 0.00 1.13 1.57 -0.81 -2.92 116.57 116.43 1wfc h LYS 76 Ca 0.37 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.97 1wfc h LYS 76 Cb 0.21 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 1wfc h LYS 76 CO -0.19 0.00 -0.93 1.25 -0.57 0.00 0.00 179.45 179.02 1wfc h HIS 77 N 0.00 0.00 -3.47 -1.35 2.76 -0.47 -3.46 115.15 109.15 1wfc h HIS 77 Ca 0.00 0.00 -0.60 0.00 -2.20 0.00 0.00 60.37 57.57 1wfc h HIS 77 Cb 0.18 0.00 -0.10 0.00 1.55 0.00 0.00 27.41 29.05 1wfc h HIS 77 CO 0.00 0.81 0.49 -1.64 -1.30 0.00 0.00 177.93 176.29 1wfc s MET 78 N -2.80 3.86 -0.45 5.26 -1.94 -1.10 -4.95 119.30 117.18 1wfc s MET 78 Ca 0.01 0.53 0.02 0.00 -1.71 0.00 0.00 55.69 54.54 1wfc s MET 78 Cb 0.09 -3.78 0.14 0.00 2.01 0.00 0.00 34.83 33.29 1wfc s MET 78 CO 0.80 -0.84 0.26 0.15 -0.01 0.00 0.00 175.02 175.37 1wfc s LYS 79 N 3.23 1.27 -0.27 2.03 1.02 -1.26 -4.43 119.74 121.33 1wfc s LYS 79 Ca 0.35 -2.04 -0.24 0.00 0.02 0.00 0.00 55.97 54.06 1wfc s LYS 79 Cb -0.13 -2.25 0.07 0.00 -0.52 0.00 0.00 37.83 35.00 1wfc s LYS 79 CO 0.16 -1.19 0.72 -1.58 -0.92 0.00 0.00 175.35 172.54 1wfc s HIS 80 N 0.29 -0.82 0.32 3.18 2.46 -1.26 -5.05 115.29 114.41 1wfc s HIS 80 Ca 0.19 1.95 0.09 0.00 0.47 0.00 0.00 55.06 57.75 1wfc s HIS 80 Cb -0.21 0.31 0.94 0.00 -0.13 0.00 0.00 32.58 33.49 1wfc s HIS 80 CO -0.02 -0.40 1.61 0.93 -2.47 0.00 0.00 174.74 174.40 1wfc h GLU 81 N 5.23 0.13 -0.69 2.88 5.08 -1.97 -1.49 114.58 123.73 1wfc h GLU 81 Ca -0.29 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.06 1wfc h GLU 81 Cb 1.17 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 1wfc h GLU 81 CO 0.06 0.08 0.00 0.09 -1.00 0.00 0.00 179.01 178.25 1wfc n ASN 82 N -5.27 4.50 -3.98 1.42 4.13 -1.26 -4.68 115.26 110.12 1wfc n ASN 82 Ca 0.28 -2.69 -0.17 0.00 1.68 0.00 0.00 54.58 53.67 1wfc n ASN 82 Cb 0.90 -0.64 -0.15 0.00 -1.54 0.00 0.00 39.78 38.35 1wfc n ASN 82 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1wfc s VAL 83 N -2.30 0.55 0.41 2.41 1.01 -0.56 -0.06 120.40 121.85 1wfc s VAL 83 Ca 0.40 -0.28 -0.27 0.00 0.00 0.00 0.00 61.98 61.84 1wfc s VAL 83 Cb 0.31 -0.47 -0.10 0.00 0.00 0.00 0.00 36.38 36.12 1wfc s VAL 83 CO 0.12 0.16 1.40 0.00 0.00 0.00 0.00 175.10 176.78 1wfc n ILE 84 N 3.02 2.37 -4.61 2.22 3.06 -0.41 -4.55 119.36 120.46 1wfc n ILE 84 Ca -0.14 -0.50 -0.28 0.00 -2.50 0.00 0.00 62.75 59.33 1wfc n ILE 84 Cb 0.57 -1.81 -0.09 0.00 0.54 0.00 0.00 39.64 38.85 1wfc n ILE 84 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 1wfc s GLY 85 N -0.34 2.59 -0.25 4.50 0.00 -1.26 -4.75 107.32 107.81 1wfc s GLY 85 Ca 0.58 -1.45 -0.20 0.00 0.00 0.00 0.00 44.72 43.64 1wfc s GLY 85 CO 0.60 -2.02 0.62 -2.27 0.00 0.00 0.00 173.10 170.03 1wfc s LEU 86 N -3.69 4.07 0.11 0.66 2.96 -1.22 -4.70 118.68 116.86 1wfc s LEU 86 Ca 0.24 0.70 0.04 0.00 -0.22 0.00 0.00 54.13 54.89 1wfc s LEU 86 Cb 0.06 -2.84 -0.22 0.00 0.50 0.00 0.00 46.19 43.69 1wfc s LEU 86 CO 0.12 -0.35 1.25 -0.07 -1.32 0.00 0.00 176.35 175.98 1wfc h LEU 87 N 8.86 0.10 -7.00 -0.68 3.38 -1.25 -3.44 115.31 115.28 1wfc h LEU 87 Ca -0.27 -0.11 0.08 0.00 0.09 0.00 0.00 57.88 57.67 1wfc h LEU 87 Cb 1.13 -0.03 -0.21 0.00 0.09 0.00 0.00 40.66 41.63 1wfc h LEU 87 CO 0.77 1.08 0.52 -0.62 0.09 0.00 0.00 178.44 180.28 1wfc s ASP 88 N -6.82 -0.38 0.01 -0.43 2.15 -1.17 -4.44 116.67 105.60 1wfc s ASP 88 Ca -0.00 0.35 0.00 0.00 0.43 0.00 0.00 52.55 53.33 1wfc s ASP 88 Cb 0.09 0.33 -0.01 0.00 -0.30 0.00 0.00 42.92 43.03 1wfc s ASP 88 CO 0.84 -0.40 -0.03 0.54 -0.17 0.00 0.00 175.17 175.95 1wfc s VAL 89 N -1.45 0.13 0.30 1.11 0.11 -1.26 -1.13 120.40 118.20 1wfc s VAL 89 Ca -0.01 -0.61 -0.15 0.00 -2.93 0.00 0.00 61.98 58.28 1wfc s VAL 89 Cb -0.01 -0.22 0.02 0.00 -1.53 0.00 0.00 36.38 34.64 1wfc s VAL 89 CO 0.00 -0.30 0.62 0.72 -3.33 0.00 0.00 175.10 172.81 1wfc s PHE 90 N -0.93 0.21 -0.08 1.54 -0.12 -0.92 -4.99 117.98 112.69 1wfc s PHE 90 Ca -0.10 -0.65 -0.10 0.00 -0.05 0.00 0.00 56.93 56.04 1wfc s PHE 90 Cb -0.07 0.46 0.02 0.00 -0.63 0.00 0.00 43.02 42.81 1wfc s PHE 90 CO -0.01 -1.20 0.26 -0.08 -0.05 0.00 0.00 175.22 174.15 1wfc s THR 91 N -3.56 0.02 -1.99 -4.49 -1.32 -1.26 -1.82 115.64 101.22 1wfc s THR 91 Ca 0.18 -0.14 0.15 0.00 -1.21 0.00 0.00 61.69 60.67 1wfc s THR 91 Cb -0.03 -0.42 0.42 0.00 -1.51 0.00 0.00 72.50 70.96 1wfc s THR 91 CO 0.10 -0.08 1.31 -0.81 -2.21 0.00 0.00 174.62 172.93 1wfc n PRO 92 N 2.54 0.46 -2.84 7.08 -0.04 -1.26 -4.86 135.00 136.07 1wfc n PRO 92 Ca -0.15 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.93 1wfc n PRO 92 Cb 0.58 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.47 1wfc n PRO 92 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wfc s ALA 93 N -2.01 3.32 -2.13 0.55 0.00 -1.26 -4.93 121.76 115.31 1wfc s ALA 93 Ca 0.22 0.49 0.24 0.00 0.00 0.00 0.00 51.96 52.91 1wfc s ALA 93 Cb 0.10 -3.11 0.34 0.00 0.00 0.00 0.00 23.12 20.45 1wfc s ALA 93 CO 0.17 0.23 1.31 0.54 0.00 0.00 0.00 175.76 178.01 1wfc n ARG 94 N 1.11 1.29 -3.62 0.00 1.74 -1.26 -4.95 116.66 110.97 1wfc n ARG 94 Ca -0.01 -0.97 -0.10 0.00 -0.77 0.00 0.00 57.85 55.99 1wfc n ARG 94 Cb 0.49 -1.48 -0.04 0.00 -1.02 0.00 0.00 32.46 30.41 1wfc n ARG 94 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1wfc s SER 95 N -2.38 -0.31 0.28 0.55 1.04 -1.26 -5.00 113.70 106.63 1wfc s SER 95 Ca 0.23 -0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.37 1wfc s SER 95 Cb 0.19 0.53 0.68 0.00 0.10 0.00 0.00 66.02 67.52 1wfc s SER 95 CO 0.50 -0.94 1.68 0.25 0.98 0.00 0.00 173.24 175.71 1wfc h LEU 96 N 2.24 0.17 -1.66 2.42 5.85 -1.97 -0.59 115.31 121.77 1wfc h LEU 96 Ca -0.32 0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.52 1wfc h LEU 96 Cb 1.27 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.48 1wfc h LEU 96 CO 0.42 -0.06 -0.20 -0.33 -0.34 0.00 0.00 178.44 177.94 1wfc h GLU 97 N 0.31 0.00 -0.00 1.25 3.07 -2.01 -0.80 114.58 116.40 1wfc h GLU 97 Ca 0.53 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.39 1wfc h GLU 97 Cb 1.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.93 1wfc h GLU 97 CO -0.57 0.20 -0.27 0.39 -1.40 0.00 0.00 179.01 177.36 1wfc n GLU 98 N -3.87 0.06 -2.32 2.33 1.02 -0.28 -4.95 120.64 112.64 1wfc n GLU 98 Ca -0.02 -0.02 -0.41 0.00 -0.02 0.00 0.00 57.16 56.68 1wfc n GLU 98 Cb 0.29 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.18 1wfc n GLU 98 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1wfc s PHE 99 N -2.96 3.36 0.00 -0.32 5.36 -0.31 -4.81 117.98 118.30 1wfc s PHE 99 Ca 0.14 1.29 0.00 0.00 -0.96 0.00 0.00 56.93 57.39 1wfc s PHE 99 Cb 0.18 -3.50 0.00 0.00 -0.34 0.00 0.00 43.02 39.36 1wfc s PHE 99 CO 0.61 -1.54 0.00 0.09 -1.46 0.00 0.00 175.22 172.92 1wfc n ASN 100 N 3.00 0.00 -4.86 6.13 3.02 -1.26 -5.05 115.26 116.24 1wfc n ASN 100 Ca 0.07 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.26 1wfc n ASN 100 Cb 0.44 0.09 -0.06 0.00 -0.61 0.00 0.00 39.78 39.64 1wfc n ASN 100 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1wfc s ASP 101 N -2.59 6.20 -0.03 6.41 1.01 -1.26 -4.77 116.67 121.63 1wfc s ASP 101 Ca 0.00 0.38 0.05 0.00 0.71 0.00 0.00 52.55 53.70 1wfc s ASP 101 Cb 0.00 -1.96 -0.01 0.00 1.01 0.00 0.00 42.92 41.96 1wfc s ASP 101 CO 0.00 0.37 -0.20 -0.69 0.21 0.00 0.00 175.17 174.86 1wfc s VAL 102 N -1.09 1.62 -0.03 -1.27 1.01 -1.26 -4.43 120.40 114.95 1wfc s VAL 102 Ca 0.18 -0.84 0.04 0.00 0.00 0.00 0.00 61.98 61.36 1wfc s VAL 102 Cb -0.12 -1.37 -0.01 0.00 0.00 0.00 0.00 36.38 34.89 1wfc s VAL 102 CO 0.08 0.46 -0.15 -0.31 0.00 0.00 0.00 175.10 175.17 1wfc s TYR 103 N -0.21 1.48 -0.03 5.22 1.51 -0.76 -1.69 117.35 122.88 1wfc s TYR 103 Ca 0.01 -0.36 0.07 0.00 -1.01 0.00 0.00 57.07 55.78 1wfc s TYR 103 Cb -0.10 -0.99 -0.02 0.00 -0.11 0.00 0.00 41.96 40.74 1wfc s TYR 103 CO 0.01 -0.10 -0.24 -0.51 -1.11 0.00 0.00 175.55 173.61 1wfc s LEU 104 N -0.11 2.04 -0.11 -1.29 1.43 -0.04 -2.15 118.68 118.45 1wfc s LEU 104 Ca 0.00 -0.44 0.03 0.00 -1.03 0.00 0.00 54.13 52.69 1wfc s LEU 104 Cb -0.09 -1.25 0.00 0.00 0.03 0.00 0.00 46.19 44.89 1wfc s LEU 104 CO 0.01 0.28 -0.22 -0.69 0.23 0.00 0.00 176.35 175.96 1wfc s VAL 105 N -0.45 1.92 0.28 -1.59 1.01 -0.29 0.07 120.40 121.36 1wfc s VAL 105 Ca 0.06 -0.93 0.03 0.00 0.00 0.00 0.00 61.98 61.14 1wfc s VAL 105 Cb -0.10 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 1wfc s VAL 105 CO 0.00 0.53 0.16 0.42 0.00 0.00 0.00 175.10 176.21 1wfc s THR 106 N 0.54 0.24 0.23 3.92 -4.23 -0.20 -0.65 115.64 115.49 1wfc s THR 106 Ca -0.15 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.06 1wfc s THR 106 Cb -0.17 -2.52 -0.10 0.00 1.34 0.00 0.00 72.50 71.05 1wfc s THR 106 CO 0.05 0.00 1.52 -1.00 -0.54 0.00 0.00 174.62 174.65 1wfc s HIS 107 N -3.70 2.97 0.06 3.99 3.76 -1.26 0.18 115.29 121.28 1wfc s HIS 107 Ca 0.37 0.83 -0.30 0.00 -0.15 0.00 0.00 55.06 55.81 1wfc s HIS 107 Cb 0.05 -3.92 -0.09 0.00 1.11 0.00 0.00 32.58 29.74 1wfc s HIS 107 CO 0.17 -3.14 1.84 -1.17 -0.85 0.00 0.00 174.74 171.59 1wfc s LEU 108 N 0.09 4.40 -0.02 0.89 2.96 0.08 -4.34 118.68 122.73 1wfc s LEU 108 Ca 0.64 2.61 -0.14 0.00 -0.22 0.00 0.00 54.13 57.02 1wfc s LEU 108 Cb -0.44 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.65 1wfc s LEU 108 CO 0.40 -1.00 0.37 -0.04 -1.32 0.00 0.00 176.35 174.77 1wfc s MET 109 N 3.61 3.86 0.00 1.98 -1.94 -1.26 -4.89 119.30 120.65 1wfc s MET 109 Ca 0.82 0.34 0.00 0.00 -1.71 0.00 0.00 55.69 55.14 1wfc s MET 109 Cb -0.42 -3.22 0.00 0.00 2.01 0.00 0.00 34.83 33.20 1wfc s MET 109 CO 0.37 0.70 0.84 0.41 -0.01 0.00 0.00 175.02 177.33 1wfc n GLY 110 N 1.84 -2.29 3.44 -0.03 0.00 -1.26 -4.97 105.19 101.92 1wfc n GLY 110 Ca -0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 1wfc n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wfc s ALA 111 N -2.89 -1.60 0.57 4.61 0.00 -1.24 -5.03 121.76 116.17 1wfc s ALA 111 Ca 0.00 0.65 0.03 0.00 0.00 0.00 0.00 51.96 52.64 1wfc s ALA 111 Cb 0.00 0.68 0.06 0.00 0.00 0.00 0.00 23.12 23.86 1wfc s ALA 111 CO 0.00 -0.67 0.79 0.16 0.00 0.00 0.00 175.76 176.03 1wfc s ASP 112 N -2.40 5.12 0.19 0.00 1.47 -1.26 -0.25 116.67 119.55 1wfc s ASP 112 Ca -0.02 -0.27 -0.12 0.00 1.18 0.00 0.00 52.55 53.33 1wfc s ASP 112 Cb -0.01 -0.50 0.17 0.00 -0.34 0.00 0.00 42.92 42.25 1wfc s ASP 112 CO -0.08 -1.26 1.79 0.25 0.68 0.00 0.00 175.17 176.56 1wfc h LEU 113 N 0.06 0.43 -0.83 2.11 5.85 -1.09 0.52 115.31 122.36 1wfc h LEU 113 Ca -0.39 0.03 0.16 0.00 0.84 0.00 0.00 57.88 58.52 1wfc h LEU 113 Cb 1.29 -0.05 -0.10 0.00 0.37 0.00 0.00 40.66 42.16 1wfc h LEU 113 CO 0.47 0.29 0.38 0.78 -0.34 0.00 0.00 178.44 180.02 1wfc h ASN 114 N 0.57 0.40 -0.27 1.25 2.35 -1.88 -0.51 115.58 117.48 1wfc h ASN 114 Ca 0.25 0.11 -0.06 0.00 -0.55 0.00 0.00 56.30 56.05 1wfc h ASN 114 Cb 0.15 0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1wfc h ASN 114 CO -0.16 0.13 -0.08 0.78 -1.65 0.00 0.00 177.43 176.44 1wfc h ASN 115 N 0.51 0.54 -0.12 5.81 -0.26 -1.33 -0.04 115.58 120.69 1wfc h ASN 115 Ca 0.47 -0.38 0.03 0.00 -0.56 0.00 0.00 56.30 55.87 1wfc h ASN 115 Cb 0.75 -0.15 -0.06 0.00 -1.06 0.00 0.00 38.32 37.80 1wfc h ASN 115 CO -0.42 0.79 -0.51 0.40 -1.06 0.00 0.00 177.43 176.63 1wfc h ILE 116 N 0.28 0.03 -0.60 2.81 5.03 -0.52 -1.95 117.51 122.59 1wfc h ILE 116 Ca 0.07 0.00 0.10 0.00 -0.12 0.00 0.00 64.86 64.91 1wfc h ILE 116 Cb 0.56 0.03 -0.08 0.00 -3.03 0.00 0.00 36.82 34.31 1wfc h ILE 116 CO 0.03 0.00 0.18 0.58 -0.68 0.00 0.00 178.15 178.26 1wfc h VAL 117 N -0.57 0.70 -0.92 1.67 2.07 -0.77 0.11 116.25 118.53 1wfc h VAL 117 Ca 0.04 -0.11 0.16 0.00 0.82 0.00 0.00 66.70 67.61 1wfc h VAL 117 Cb 0.68 0.35 -0.08 0.00 -1.52 0.00 0.00 31.29 30.71 1wfc h VAL 117 CO -0.42 0.06 0.59 0.50 0.02 0.00 0.00 177.57 178.32 1wfc h LYS 118 N 0.33 0.64 -0.01 1.57 3.64 -0.43 -0.93 116.57 121.38 1wfc h LYS 118 Ca 0.31 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1wfc h LYS 118 Cb 0.43 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1wfc h LYS 118 CO -0.35 0.42 -0.13 0.00 -2.27 0.00 0.00 179.45 177.12 1wfc s GLN 120 N -2.23 1.06 -0.09 0.00 0.74 -0.35 -5.08 119.66 113.71 1wfc s GLN 120 Ca 0.31 0.13 -0.16 0.00 0.05 0.00 0.00 55.36 55.69 1wfc s GLN 120 Cb 0.20 0.50 -0.05 0.00 1.10 0.00 0.00 33.01 34.76 1wfc s GLN 120 CO 0.42 -0.35 0.43 0.21 -0.55 0.00 0.00 175.29 175.45 1wfc s LYS 121 N -1.53 4.20 0.53 1.67 2.20 -1.26 -4.52 119.74 121.02 1wfc s LYS 121 Ca -0.10 0.38 0.03 0.00 -0.36 0.00 0.00 55.97 55.93 1wfc s LYS 121 Cb -0.00 -3.37 0.04 0.00 -1.51 0.00 0.00 37.83 32.99 1wfc s LYS 121 CO 0.07 0.34 0.73 -0.51 -0.36 0.00 0.00 175.35 175.62 1wfc s LEU 122 N 0.05 3.35 0.11 5.43 1.43 -1.26 -5.10 118.68 122.69 1wfc s LEU 122 Ca 0.24 -0.18 0.08 0.00 -1.03 0.00 0.00 54.13 53.24 1wfc s LEU 122 Cb -0.15 -2.70 -0.04 0.00 0.03 0.00 0.00 46.19 43.33 1wfc s LEU 122 CO 0.10 -1.10 -0.20 0.42 0.23 0.00 0.00 176.35 175.81 1wfc s THR 123 N -2.67 1.69 0.48 5.49 -4.23 -1.26 -4.98 115.64 110.16 1wfc s THR 123 Ca 0.57 -1.62 0.33 0.00 -1.18 0.00 0.00 61.69 59.79 1wfc s THR 123 Cb -0.10 -1.59 0.53 0.00 1.34 0.00 0.00 72.50 72.68 1wfc s THR 123 CO 0.37 -0.14 1.72 -0.78 -0.54 0.00 0.00 174.62 175.25 1wfc h ASP 124 N 3.89 0.17 -0.24 3.99 3.58 -1.98 0.21 116.42 126.03 1wfc h ASP 124 Ca -0.45 0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.01 1wfc h ASP 124 Cb 1.19 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 42.26 1wfc h ASP 124 CO 0.42 -0.03 -0.04 0.44 -2.88 0.00 0.00 179.24 177.16 1wfc h ASP 125 N 0.12 0.45 -0.47 2.28 5.19 -1.99 0.26 116.42 122.26 1wfc h ASP 125 Ca 0.69 -0.35 0.04 0.00 -0.62 0.00 0.00 57.03 56.80 1wfc h ASP 125 Cb 2.40 -0.12 -0.04 0.00 0.18 0.00 0.00 39.33 41.74 1wfc h ASP 125 CO -0.18 0.70 0.22 0.45 -3.12 0.00 0.00 179.24 177.31 1wfc h HIS 126 N 0.20 0.41 -0.04 4.55 3.86 -1.22 -1.49 115.15 121.42 1wfc h HIS 126 Ca 0.06 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1wfc h HIS 126 Cb 0.49 -0.11 -0.00 0.00 1.06 0.00 0.00 27.41 28.84 1wfc h HIS 126 CO 0.05 0.19 0.02 0.28 0.86 0.00 0.00 177.93 179.33 1wfc h VAL 127 N 0.44 1.12 -0.68 2.45 2.07 -0.54 0.11 116.25 121.22 1wfc h VAL 127 Ca 0.21 -0.34 0.10 0.00 0.82 0.00 0.00 66.70 67.49 1wfc h VAL 127 Cb 0.14 1.28 -0.12 0.00 -1.52 0.00 0.00 31.29 31.07 1wfc h VAL 127 CO -0.16 0.09 -0.42 -0.61 0.02 0.00 0.00 177.57 176.49 1wfc h GLN 128 N -0.08 -0.16 -0.26 1.57 4.15 -0.32 -0.00 115.11 120.01 1wfc h GLN 128 Ca 0.01 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.42 1wfc h GLN 128 Cb 0.14 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 1wfc h GLN 128 CO -0.00 -0.10 0.07 0.35 -1.93 0.00 0.00 178.83 177.22 1wfc h PHE 129 N -0.16 0.43 -0.44 3.99 3.57 -0.92 -0.89 116.94 122.51 1wfc h PHE 129 Ca 0.21 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.59 1wfc h PHE 129 Cb 0.56 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 1wfc h PHE 129 CO -0.75 0.48 -0.02 -0.07 -2.23 0.00 0.00 178.31 175.72 1wfc h LEU 130 N 0.25 0.79 -0.23 0.59 3.38 -0.47 -2.10 115.31 117.53 1wfc h LEU 130 Ca 0.08 -0.32 -0.14 0.00 0.09 0.00 0.00 57.88 57.60 1wfc h LEU 130 Cb 0.26 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1wfc h LEU 130 CO -0.00 0.92 -0.40 0.40 0.09 0.00 0.00 178.44 179.45 1wfc h ILE 131 N 0.64 1.32 -0.86 1.22 1.08 -0.98 -2.68 117.51 117.25 1wfc h ILE 131 Ca 0.12 -1.61 0.12 0.00 -0.39 0.00 0.00 64.86 63.11 1wfc h ILE 131 Cb 0.53 1.78 -0.14 0.00 -3.07 0.00 0.00 36.82 35.92 1wfc h ILE 131 CO 0.03 0.50 -0.43 0.22 -0.69 0.00 0.00 178.15 177.78 1wfc h TYR 132 N 0.38 -1.28 -0.83 1.37 3.20 -1.09 -0.61 116.97 118.11 1wfc h TYR 132 Ca 0.01 0.10 0.03 0.00 3.14 0.00 0.00 58.73 62.02 1wfc h TYR 132 Cb 0.99 0.68 -0.05 0.00 1.54 0.00 0.00 36.73 39.89 1wfc h TYR 132 CO 0.08 -0.40 0.53 1.96 -1.64 0.00 0.00 178.16 178.70 1wfc h GLN 133 N -0.07 1.01 0.13 1.82 4.20 -1.29 0.19 115.11 121.09 1wfc h GLN 133 Ca 0.26 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.90 1wfc h GLN 133 Cb 0.55 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.10 1wfc h GLN 133 CO -0.88 0.67 -0.06 0.82 -0.67 0.00 0.00 178.83 178.70 1wfc h ILE 134 N 1.04 0.91 -0.33 2.54 2.04 -0.94 0.16 117.51 122.93 1wfc h ILE 134 Ca 0.33 -0.11 -0.03 0.00 1.00 0.00 0.00 64.86 66.05 1wfc h ILE 134 Cb 0.01 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1wfc h ILE 134 CO -0.11 0.03 0.09 -0.07 0.00 0.00 0.00 178.15 178.08 1wfc h LEU 135 N -0.22 0.43 0.00 1.44 3.38 -0.65 0.33 115.31 120.01 1wfc h LEU 135 Ca -0.02 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1wfc h LEU 135 Cb 0.17 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1wfc h LEU 135 CO 0.03 0.43 -0.00 -0.09 0.09 0.00 0.00 178.44 178.90 1wfc h ARG 136 N 0.47 -0.00 -0.34 1.13 2.43 -0.20 0.29 114.38 118.16 1wfc h ARG 136 Ca 0.11 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.33 1wfc h ARG 136 Cb 0.17 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.67 1wfc h ARG 136 CO -0.01 0.17 0.07 0.78 -1.51 0.00 0.00 179.97 179.47 1wfc h GLY 137 N -0.17 0.39 1.70 2.80 0.00 -0.06 -2.88 103.07 104.85 1wfc h GLY 137 Ca -0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.24 1wfc h GLY 137 CO 0.00 -0.02 -0.13 1.41 0.00 0.00 0.00 176.54 177.80 1wfc h LEU 138 N 0.19 0.35 -0.44 3.11 3.38 -0.04 0.07 115.31 121.94 1wfc h LEU 138 Ca 0.16 -0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.09 1wfc h LEU 138 Cb 0.17 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 1wfc h LEU 138 CO -0.21 0.52 0.18 0.50 0.09 0.00 0.00 178.44 179.52 1wfc h LYS 139 N 0.35 0.35 0.76 1.13 3.64 -0.23 0.42 116.57 122.99 1wfc h LYS 139 Ca 0.07 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1wfc h LYS 139 Cb 0.45 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1wfc h LYS 139 CO 0.03 0.23 -0.43 -0.92 -2.27 0.00 0.00 179.45 176.09 1wfc h TYR 140 N 0.36 -1.12 -0.65 1.91 3.20 -1.22 0.54 116.97 119.99 1wfc h TYR 140 Ca 0.20 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.17 1wfc h TYR 140 Cb 0.17 0.39 -0.12 0.00 1.54 0.00 0.00 36.73 38.70 1wfc h TYR 140 CO -0.14 -0.65 -0.30 0.82 -1.64 0.00 0.00 178.16 176.26 1wfc h ILE 141 N -1.10 0.19 -0.13 1.81 2.04 -0.73 -1.58 117.51 118.01 1wfc h ILE 141 Ca -0.10 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.68 1wfc h ILE 141 Cb 0.86 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1wfc h ILE 141 CO 0.13 0.00 -0.26 0.45 0.00 0.00 0.00 178.15 178.47 1wfc h HIS 142 N -0.11 0.26 -0.05 1.37 3.86 -0.03 -2.00 115.15 118.45 1wfc h HIS 142 Ca 0.27 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.42 1wfc h HIS 142 Cb 0.55 -0.07 -0.00 0.00 1.06 0.00 0.00 27.41 28.95 1wfc h HIS 142 CO -0.64 0.49 -0.02 0.66 0.86 0.00 0.00 177.93 179.28 1wfc h SER 143 N 0.21 0.07 -0.21 2.45 4.64 0.15 0.24 113.55 121.10 1wfc h SER 143 Ca 0.03 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1wfc h SER 143 Cb 0.58 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1wfc h SER 143 CO 0.04 0.10 0.00 0.00 -0.87 0.00 0.00 176.83 176.10 1wfc n ALA 144 N -2.52 2.79 -4.30 5.18 0.00 -0.85 -4.82 120.51 116.00 1wfc n ALA 144 Ca -0.02 -0.56 -0.33 0.00 0.00 0.00 0.00 53.44 52.53 1wfc n ALA 144 Cb 0.13 -1.02 -0.08 0.00 0.00 0.00 0.00 19.45 18.48 1wfc n ALA 144 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1wfc n ASP 145 N 0.21 -0.13 -4.84 0.00 8.00 0.86 -4.17 116.55 116.48 1wfc n ASP 145 Ca 0.09 -1.21 -0.34 0.00 0.71 0.00 0.00 54.79 54.04 1wfc n ASP 145 Cb 0.44 -1.92 -0.06 0.00 -0.02 0.00 0.00 41.12 39.56 1wfc n ASP 145 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1wfc s ILE 146 N -4.01 5.13 -0.12 0.53 1.01 -0.81 -5.01 121.20 117.93 1wfc s ILE 146 Ca 0.23 -0.13 0.01 0.00 0.00 0.00 0.00 60.65 60.75 1wfc s ILE 146 Cb -0.13 -3.31 -0.01 0.00 0.01 0.00 0.00 42.46 39.02 1wfc s ILE 146 CO 0.98 0.45 -0.15 -0.63 0.00 0.00 0.00 174.94 175.59 1wfc s ILE 147 N -1.15 2.90 -0.05 2.92 1.01 -1.26 -3.95 121.20 121.61 1wfc s ILE 147 Ca 0.21 -0.72 0.12 0.00 0.00 0.00 0.00 60.65 60.26 1wfc s ILE 147 Cb -0.12 -2.19 -0.05 0.00 0.01 0.00 0.00 42.46 40.10 1wfc s ILE 147 CO 0.11 0.54 1.33 -0.74 0.00 0.00 0.00 174.94 176.18 1wfc h HIS 148 N 6.56 0.00 -0.72 3.97 -0.00 -1.97 -3.47 115.15 119.52 1wfc h HIS 148 Ca -0.27 0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.02 1wfc h HIS 148 Cb 1.21 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.59 1wfc h HIS 148 CO 0.50 0.70 -0.07 -2.13 -0.00 0.00 0.00 177.93 176.92 1wfc n ARG 149 N -3.25 -1.63 -2.67 5.26 0.63 -1.26 -4.54 116.66 109.20 1wfc n ARG 149 Ca 0.00 0.35 -0.06 0.00 -0.92 0.00 0.00 57.85 57.22 1wfc n ARG 149 Cb 0.82 -4.06 0.08 0.00 0.45 0.00 0.00 32.46 29.75 1wfc n ARG 149 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1wfc n ASP 150 N 0.72 -1.65 -4.75 6.15 2.03 -1.26 -5.07 116.55 112.72 1wfc n ASP 150 Ca -0.04 -2.20 -0.40 0.00 0.52 0.00 0.00 54.79 52.67 1wfc n ASP 150 Cb 0.25 0.99 -0.05 0.00 -0.72 0.00 0.00 41.12 41.58 1wfc n ASP 150 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1wfc s LEU 151 N -2.91 4.51 0.05 -2.67 1.43 -1.26 -4.89 118.68 112.95 1wfc s LEU 151 Ca 0.16 1.58 -0.22 0.00 -1.03 0.00 0.00 54.13 54.62 1wfc s LEU 151 Cb 0.30 -3.31 0.05 0.00 0.03 0.00 0.00 46.19 43.26 1wfc s LEU 151 CO -0.07 0.08 0.52 -0.54 0.23 0.00 0.00 176.35 176.57 1wfc s LYS 152 N -0.47 1.03 0.55 1.70 1.02 -1.26 -4.83 119.74 117.49 1wfc s LYS 152 Ca 0.39 -0.24 0.28 0.00 0.02 0.00 0.00 55.97 56.42 1wfc s LYS 152 Cb -0.22 0.47 1.46 0.00 -0.52 0.00 0.00 37.83 39.02 1wfc s LYS 152 CO 0.25 -0.37 1.94 -1.35 -0.92 0.00 0.00 175.35 174.90 1wfc h PRO 153 N 2.78 0.00 0.00 -1.68 0.11 -1.95 -1.22 132.00 130.05 1wfc h PRO 153 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1wfc h PRO 153 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1wfc h PRO 153 CO 0.41 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.07 1wfc n SER 154 N -4.12 0.00 -1.11 -2.05 3.41 -1.26 -2.71 113.62 105.78 1wfc n SER 154 Ca 0.11 0.03 0.08 0.00 -0.26 0.00 0.00 58.87 58.83 1wfc n SER 154 Cb 0.71 -0.30 0.29 0.00 -0.26 0.00 0.00 64.21 64.64 1wfc n SER 154 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1wfc n ASN 155 N -1.30 4.22 -3.88 4.04 3.02 -0.46 -4.89 115.26 116.02 1wfc n ASN 155 Ca 0.09 -2.87 -0.24 0.00 -0.03 0.00 0.00 54.58 51.54 1wfc n ASN 155 Cb 0.17 -0.55 -0.17 0.00 -0.61 0.00 0.00 39.78 38.63 1wfc n ASN 155 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wfc s LEU 156 N -2.58 1.09 -0.13 3.41 1.43 -1.17 0.39 118.68 121.13 1wfc s LEU 156 Ca 0.43 -0.20 -0.03 0.00 -1.03 0.00 0.00 54.13 53.31 1wfc s LEU 156 Cb 0.33 -0.63 -0.03 0.00 0.03 0.00 0.00 46.19 45.89 1wfc s LEU 156 CO 0.12 -0.11 -0.04 0.00 0.23 0.00 0.00 176.35 176.55 1wfc s ALA 157 N 1.49 3.03 -0.07 4.21 0.00 -0.02 -1.61 121.76 128.79 1wfc s ALA 157 Ca -0.01 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.15 1wfc s ALA 157 Cb -0.13 -1.48 0.01 0.00 0.00 0.00 0.00 23.12 21.52 1wfc s ALA 157 CO -0.04 0.34 -0.16 0.08 0.00 0.00 0.00 175.76 175.97 1wfc s VAL 158 N -0.04 1.45 0.51 0.00 1.01 0.66 -0.95 120.40 123.04 1wfc s VAL 158 Ca 0.01 -0.67 0.06 0.00 0.00 0.00 0.00 61.98 61.38 1wfc s VAL 158 Cb -0.13 -1.29 0.05 0.00 0.00 0.00 0.00 36.38 35.01 1wfc s VAL 158 CO 0.03 0.42 0.71 0.54 0.00 0.00 0.00 175.10 176.80 1wfc s ASN 159 N 0.49 5.32 0.62 3.32 2.20 0.46 -3.64 114.94 123.70 1wfc s ASN 159 Ca -0.15 -0.45 0.23 0.00 -0.94 0.00 0.00 52.86 51.56 1wfc s ASN 159 Cb -0.16 -0.39 1.02 0.00 -2.00 0.00 0.00 41.25 39.72 1wfc s ASN 159 CO 0.05 -1.09 1.51 -0.08 -2.94 0.00 0.00 177.10 174.55 1wfc h GLU 160 N 0.30 0.00 -0.53 3.55 4.81 -1.98 0.60 114.58 121.34 1wfc h GLU 160 Ca -0.37 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.77 1wfc h GLU 160 Cb 1.28 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.61 1wfc h GLU 160 CO 0.45 0.00 0.09 -0.25 -0.73 0.00 0.00 179.01 178.57 1wfc n ASP 161 N -3.19 4.67 -1.66 1.04 8.00 -1.26 -4.91 116.55 119.24 1wfc n ASP 161 Ca 0.11 -3.12 -0.20 0.00 0.71 0.00 0.00 54.79 52.29 1wfc n ASP 161 Cb 1.03 -0.66 -0.07 0.00 -0.02 0.00 0.00 41.12 41.40 1wfc n ASP 161 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wfc s GLU 163 N -3.92 4.09 0.06 0.00 2.02 -1.25 -4.77 118.70 114.94 1wfc s GLU 163 Ca 0.00 0.62 0.07 0.00 0.02 0.00 0.00 54.97 55.68 1wfc s GLU 163 Cb 0.00 -3.23 -0.03 0.00 0.10 0.00 0.00 34.13 30.98 1wfc s GLU 163 CO 0.00 0.66 -0.19 -1.17 0.02 0.00 0.00 175.26 174.58 1wfc s LEU 164 N -1.11 2.21 -0.06 1.80 0.20 -1.26 -0.40 118.68 120.06 1wfc s LEU 164 Ca 0.27 -0.56 0.02 0.00 0.69 0.00 0.00 54.13 54.55 1wfc s LEU 164 Cb -0.18 -0.84 0.01 0.00 -0.43 0.00 0.00 46.19 44.74 1wfc s LEU 164 CO 0.17 0.09 -0.12 -0.54 -0.29 0.00 0.00 176.35 175.66 1wfc s LYS 165 N -1.42 1.59 0.12 1.98 1.02 -0.12 -4.27 119.74 118.64 1wfc s LYS 165 Ca 0.05 -0.41 -0.31 0.00 0.02 0.00 0.00 55.97 55.33 1wfc s LYS 165 Cb -0.09 -1.34 -0.08 0.00 -0.52 0.00 0.00 37.83 35.81 1wfc s LYS 165 CO 0.02 0.06 1.32 0.42 -0.92 0.00 0.00 175.35 176.25 1wfc s ILE 166 N 0.55 3.47 0.53 2.17 1.01 0.91 -0.84 121.20 129.00 1wfc s ILE 166 Ca -0.12 1.09 0.01 0.00 0.00 0.00 0.00 60.65 61.63 1wfc s ILE 166 Cb -0.14 -3.70 0.01 0.00 0.01 0.00 0.00 42.46 38.64 1wfc s ILE 166 CO 0.03 0.10 0.07 -0.76 0.00 0.00 0.00 174.94 174.38 1wfc s LEU 167 N 0.82 2.27 0.00 2.97 1.43 0.16 -1.29 118.68 125.04 1wfc s LEU 167 Ca 0.61 -1.63 0.00 0.00 -1.03 0.00 0.00 54.13 52.08 1wfc s LEU 167 Cb -0.35 -0.77 0.00 0.00 0.03 0.00 0.00 46.19 45.10 1wfc s LEU 167 CO 0.32 -0.96 0.00 0.47 0.23 0.00 0.00 176.35 176.41 1wfc n ASP 168 N -1.39 0.00 0.00 2.29 8.00 -1.26 -4.88 116.55 119.31 1wfc n ASP 168 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1wfc n ASP 168 Cb 0.67 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.77 1wfc n ASP 168 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1wfc n PHE 169 N 0.00 0.00 -4.20 1.24 3.01 -1.26 -5.07 117.46 111.18 1wfc n PHE 169 Ca 0.00 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.28 1wfc n PHE 169 Cb 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.36 1wfc n PHE 169 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1wfc s THR 175 N -1.68 1.20 0.24 4.37 -4.23 -1.26 -4.96 115.64 109.31 1wfc s THR 175 Ca 0.00 -1.51 -0.06 0.00 -1.18 0.00 0.00 61.69 58.94 1wfc s THR 175 Cb 0.00 -1.30 0.21 0.00 1.34 0.00 0.00 72.50 72.75 1wfc s THR 175 CO 0.00 -0.33 1.71 0.44 -0.54 0.00 0.00 174.62 175.90 1wfc h ASP 176 N 3.90 0.12 -0.76 3.99 5.19 -2.04 0.21 116.42 127.02 1wfc h ASP 176 Ca -0.40 0.12 0.11 0.00 -0.62 0.00 0.00 57.03 56.24 1wfc h ASP 176 Cb 1.19 0.14 -0.08 0.00 0.18 0.00 0.00 39.33 40.76 1wfc h ASP 176 CO 0.46 0.03 0.38 -0.78 -3.12 0.00 0.00 179.24 176.21 1wfc h ASP 177 N 0.34 0.47 0.29 6.45 3.58 -2.07 -0.45 116.42 125.03 1wfc h ASP 177 Ca 0.39 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.91 1wfc h ASP 177 Cb 0.61 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.66 1wfc h ASP 177 CO -0.44 0.24 0.00 -0.62 -2.88 0.00 0.00 179.24 175.54 1wfc n GLU 178 N -4.87 0.02 -0.61 0.28 1.02 0.71 -1.00 120.64 116.19 1wfc n GLU 178 Ca 0.13 0.32 0.02 0.00 -0.02 0.00 0.00 57.16 57.61 1wfc n GLU 178 Cb 0.34 -1.50 0.20 0.00 -0.02 0.00 0.00 31.44 30.46 1wfc n GLU 178 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1wfc n MET 179 N -1.47 1.78 -4.52 3.49 2.81 -0.20 -4.72 117.12 114.30 1wfc n MET 179 Ca 0.03 -3.12 -0.34 0.00 -1.81 0.00 0.00 57.70 52.45 1wfc n MET 179 Cb 0.10 -1.71 -0.11 0.00 -0.71 0.00 0.00 33.22 30.80 1wfc n MET 179 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1wfc s THR 180 N -3.16 3.94 0.00 2.03 -4.23 -0.17 -4.82 115.64 109.23 1wfc s THR 180 Ca 0.40 -0.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.53 1wfc s THR 180 Cb 0.37 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.58 1wfc s THR 180 CO -0.01 0.60 0.00 0.61 -0.54 0.00 0.00 174.62 175.27 1wfc n GLY 181 N 2.27 -1.59 3.31 3.99 0.00 -1.24 -4.58 105.19 107.34 1wfc n GLY 181 Ca -0.18 -2.06 -0.40 0.00 0.00 0.00 0.00 46.02 43.38 1wfc n GLY 181 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1wfc n TYR 182 N 0.00 3.57 -4.57 1.61 9.36 -0.81 -3.82 117.16 122.51 1wfc n TYR 182 Ca 0.00 -2.42 -0.23 0.00 3.32 0.00 0.00 57.90 58.56 1wfc n TYR 182 Cb 0.00 -2.48 -0.16 0.00 -0.63 0.00 0.00 39.34 36.07 1wfc n TYR 182 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1wfc s VAL 183 N 5.60 1.07 0.63 2.97 -7.23 -1.26 -5.02 120.40 117.16 1wfc s VAL 183 Ca 0.56 -0.49 0.35 0.00 -1.81 0.00 0.00 61.98 60.59 1wfc s VAL 183 Cb 0.07 -0.95 0.38 0.00 0.56 0.00 0.00 36.38 36.44 1wfc s VAL 183 CO 0.06 0.33 2.18 0.00 -0.31 0.00 0.00 175.10 177.36 1wfc h ALA 184 N 6.59 1.39 -0.01 1.32 0.00 -1.94 -1.92 119.26 124.69 1wfc h ALA 184 Ca -0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1wfc h ALA 184 Cb 1.18 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1wfc h ALA 184 CO 0.48 -0.16 0.11 1.79 0.00 0.00 0.00 179.25 181.46 1wfc h THR 185 N 0.00 0.06 0.00 0.00 1.35 -1.95 -3.07 112.91 109.29 1wfc h THR 185 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.89 1wfc h THR 185 Cb 0.30 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 1wfc h THR 185 CO -0.00 0.00 -1.09 -1.14 -0.25 0.00 0.00 175.52 173.04 1wfc n ARG 186 N -3.12 1.27 0.29 4.72 0.63 -0.73 -4.73 116.66 115.00 1wfc n ARG 186 Ca -0.02 -0.05 0.19 0.00 -0.92 0.00 0.00 57.85 57.05 1wfc n ARG 186 Cb 0.17 -1.09 0.89 0.00 0.45 0.00 0.00 32.46 32.88 1wfc n ARG 186 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 1wfc h TRP 187 N 0.00 0.00 -0.27 -0.14 6.55 -1.51 -1.45 115.95 119.13 1wfc h TRP 187 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1wfc h TRP 187 Cb 0.29 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.59 1wfc h TRP 187 CO 0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.05 1wfc n TYR 188 N -3.03 0.34 -2.79 0.49 4.01 -1.26 -4.64 117.16 110.28 1wfc n TYR 188 Ca -0.01 -0.19 -0.40 0.00 -0.16 0.00 0.00 57.90 57.14 1wfc n TYR 188 Cb 0.20 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.18 1wfc n TYR 188 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1wfc s ARG 189 N -1.49 4.71 0.31 -0.72 1.81 -0.55 -3.89 118.95 119.13 1wfc s ARG 189 Ca 0.32 1.39 -0.29 0.00 -1.72 0.00 0.00 55.73 55.44 1wfc s ARG 189 Cb 0.20 -3.34 -0.10 0.00 -0.45 0.00 0.00 34.95 31.26 1wfc s ARG 189 CO 0.28 0.34 1.36 0.00 -0.68 0.00 0.00 175.30 176.60 1wfc s ALA 190 N -0.45 3.54 0.21 2.13 0.00 -1.26 -4.78 121.76 121.14 1wfc s ALA 190 Ca 0.43 1.30 -0.10 0.00 0.00 0.00 0.00 51.96 53.59 1wfc s ALA 190 Cb -0.24 -3.51 0.31 0.00 0.00 0.00 0.00 23.12 19.68 1wfc s ALA 190 CO 0.29 -0.70 1.68 -1.00 0.00 0.00 0.00 175.76 176.04 1wfc h PRO 191 N 3.84 0.19 -0.86 0.00 0.13 -1.95 -0.20 132.00 133.16 1wfc h PRO 191 Ca -0.48 -0.01 0.16 0.00 -0.87 0.00 0.00 66.00 64.79 1wfc h PRO 191 Cb 1.22 -0.04 -0.07 0.00 0.13 0.00 0.00 31.00 32.25 1wfc h PRO 191 CO 0.69 0.13 0.56 1.05 -0.23 0.00 0.00 178.00 180.20 1wfc h GLU 192 N 0.19 0.56 0.06 0.86 9.09 -1.91 -0.61 114.58 122.83 1wfc h GLU 192 Ca 0.33 -0.03 -0.31 0.00 0.05 0.00 0.00 59.36 59.39 1wfc h GLU 192 Cb 0.51 -0.13 -0.03 0.00 -1.65 0.00 0.00 28.75 27.45 1wfc h GLU 192 CO -0.46 0.37 -1.73 -0.84 0.05 0.00 0.00 179.01 176.40 1wfc h ILE 193 N 0.58 0.87 -0.17 -1.06 3.07 -1.48 0.14 117.51 119.46 1wfc h ILE 193 Ca 0.44 -2.64 0.05 0.00 1.55 0.00 0.00 64.86 64.25 1wfc h ILE 193 Cb 0.83 2.52 -0.01 0.00 -0.27 0.00 0.00 36.82 39.89 1wfc h ILE 193 CO -0.18 0.69 0.14 -0.03 -1.05 0.00 0.00 178.15 177.71 1wfc h MET 194 N 0.03 0.00 0.00 0.16 4.05 0.11 -2.40 114.93 116.89 1wfc h MET 194 Ca -0.31 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.11 1wfc h MET 194 Cb 2.01 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.81 1wfc h MET 194 CO 0.10 0.00 -0.02 1.28 0.23 0.00 0.00 176.91 178.50 1wfc n LEU 195 N -4.25 1.89 -3.94 3.39 4.77 -0.36 -5.02 117.00 113.49 1wfc n LEU 195 Ca 0.01 -2.20 -0.27 0.00 -0.03 0.00 0.00 56.01 53.51 1wfc n LEU 195 Cb 0.27 -0.15 -0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1wfc n LEU 195 CO 0.32 0.53 -0.09 0.59 -1.33 0.00 0.00 177.39 177.41 1wfc n ASN 196 N -0.78 -1.96 -0.16 -1.43 3.02 -0.60 -4.88 115.26 108.48 1wfc n ASN 196 Ca 0.06 -0.92 -0.02 0.00 -0.03 0.00 0.00 54.58 53.67 1wfc n ASN 196 Cb 0.43 -3.40 0.21 0.00 -0.61 0.00 0.00 39.78 36.41 1wfc n ASN 196 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 1wfc h TRP 197 N -1.84 0.89 -2.30 3.10 6.55 -1.01 -3.45 115.95 117.90 1wfc h TRP 197 Ca -0.61 -0.04 0.19 0.00 0.95 0.00 0.00 58.89 59.38 1wfc h TRP 197 Cb 1.37 -0.28 -0.08 0.00 -0.86 0.00 0.00 29.16 29.32 1wfc h TRP 197 CO 0.53 0.67 0.51 0.00 -1.05 0.00 0.00 178.44 179.10 1wfc s MET 198 N -5.47 1.16 0.33 0.49 0.23 -1.26 -1.65 119.30 113.14 1wfc s MET 198 Ca -0.10 -0.65 -0.29 0.00 -1.03 0.00 0.00 55.69 53.62 1wfc s MET 198 Cb 0.16 0.39 -0.10 0.00 -1.53 0.00 0.00 34.83 33.75 1wfc s MET 198 CO 0.79 -0.53 1.30 -1.01 -2.03 0.00 0.00 175.02 173.54 1wfc s HIS 199 N -3.15 3.06 0.37 3.16 3.76 -1.26 -4.78 115.29 116.45 1wfc s HIS 199 Ca 0.13 1.43 0.07 0.00 -0.15 0.00 0.00 55.06 56.54 1wfc s HIS 199 Cb -0.01 -3.66 -0.00 0.00 1.11 0.00 0.00 32.58 30.02 1wfc s HIS 199 CO 0.02 -1.80 0.51 1.52 -0.85 0.00 0.00 174.74 174.14 1wfc s TYR 200 N -1.15 3.02 0.00 1.40 -0.85 -1.26 -5.08 117.35 113.43 1wfc s TYR 200 Ca 0.49 -0.26 0.00 0.00 -0.52 0.00 0.00 57.07 56.78 1wfc s TYR 200 Cb -0.39 -2.13 0.00 0.00 0.38 0.00 0.00 41.96 39.81 1wfc s TYR 200 CO 0.52 -0.16 0.00 0.27 -1.52 0.00 0.00 175.55 174.66 1wfc n ASN 201 N -1.73 0.00 0.30 -0.18 6.94 -1.26 -5.04 115.26 114.29 1wfc n ASN 201 Ca 0.03 -0.38 0.20 0.00 -0.02 0.00 0.00 54.58 54.41 1wfc n ASN 201 Cb 0.58 0.00 1.03 0.00 -2.36 0.00 0.00 39.78 39.03 1wfc n ASN 201 CO 0.00 0.00 0.00 0.06 -1.03 0.00 0.00 177.26 176.29 1wfc h GLN 202 N 0.00 0.00 0.00 -3.83 3.07 -1.99 -2.92 115.11 109.44 1wfc h GLN 202 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 1wfc h GLN 202 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.56 1wfc h GLN 202 CO 0.00 0.00 -0.07 1.79 0.09 0.00 0.00 178.83 180.64 1wfc h THR 203 N 0.00 0.67 -0.94 1.86 1.35 -1.96 0.27 112.91 114.17 1wfc h THR 203 Ca 0.00 -0.29 0.36 0.00 -0.55 0.00 0.00 66.41 65.94 1wfc h THR 203 Cb 0.09 1.18 -0.17 0.00 -1.73 0.00 0.00 68.15 67.51 1wfc h THR 203 CO 0.00 0.07 0.39 0.52 -0.25 0.00 0.00 175.52 176.25 1wfc n VAL 204 N -3.90 -0.40 0.07 6.82 0.31 -1.10 -1.45 118.33 118.68 1wfc n VAL 204 Ca -0.02 1.95 -0.11 0.00 -0.01 0.00 0.00 64.34 66.15 1wfc n VAL 204 Cb 0.16 -3.09 -0.02 0.00 -0.91 0.00 0.00 33.84 29.99 1wfc n VAL 204 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1wfc h ASP 205 N 0.00 0.41 -0.33 4.52 3.32 -1.19 -2.93 116.42 120.22 1wfc h ASP 205 Ca 0.75 -0.32 -0.05 0.00 0.02 0.00 0.00 57.03 57.43 1wfc h ASP 205 Cb 1.90 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 41.30 1wfc h ASP 205 CO -0.76 1.11 0.06 0.40 -1.72 0.00 0.00 179.24 178.32 1wfc h ILE 206 N 0.18 1.20 0.00 0.35 1.08 -1.39 -0.09 117.51 118.85 1wfc h ILE 206 Ca -0.06 -0.77 0.02 0.00 -0.39 0.00 0.00 64.86 63.66 1wfc h ILE 206 Cb 1.51 0.82 -0.03 0.00 -3.07 0.00 0.00 36.82 36.05 1wfc h ILE 206 CO 0.14 0.28 -0.14 -0.25 -0.69 0.00 0.00 178.15 177.49 1wfc h TRP 207 N 0.62 -0.36 -0.77 1.37 2.91 -1.43 0.12 115.95 118.42 1wfc h TRP 207 Ca 0.14 0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.23 1wfc h TRP 207 Cb 0.30 0.16 -0.06 0.00 -0.51 0.00 0.00 29.16 29.05 1wfc h TRP 207 CO 0.01 -0.21 0.46 0.77 -1.03 0.00 0.00 178.44 178.45 1wfc h SER 208 N -0.23 0.70 -0.71 2.65 0.02 -1.14 -1.44 113.55 113.40 1wfc h SER 208 Ca 0.05 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1wfc h SER 208 Cb 0.29 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.68 1wfc h SER 208 CO -0.13 0.45 0.43 0.58 -1.14 0.00 0.00 176.83 177.01 1wfc h VAL 209 N 0.84 1.20 -0.61 2.27 2.07 -0.74 0.71 116.25 121.98 1wfc h VAL 209 Ca 0.34 -0.44 0.06 0.00 0.82 0.00 0.00 66.70 67.49 1wfc h VAL 209 Cb 0.19 0.22 -0.06 0.00 -1.52 0.00 0.00 31.29 30.12 1wfc h VAL 209 CO -0.18 0.21 0.31 1.23 0.02 0.00 0.00 177.57 179.16 1wfc h GLY 210 N 0.96 0.88 0.98 2.17 0.00 -0.16 0.25 103.07 108.16 1wfc h GLY 210 Ca 0.25 -0.21 -0.04 0.00 0.00 0.00 0.00 47.33 47.33 1wfc h GLY 210 CO -0.05 0.11 0.15 0.00 0.00 0.00 0.00 176.54 176.75 1wfc h ILE 212 N 0.71 1.23 0.34 0.00 2.04 -0.38 -2.51 117.51 118.95 1wfc h ILE 212 Ca 0.17 -0.69 -0.00 0.00 1.00 0.00 0.00 64.86 65.34 1wfc h ILE 212 Cb 0.30 1.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 1wfc h ILE 212 CO -0.00 0.18 -0.38 -0.03 0.00 0.00 0.00 178.15 177.92 1wfc h MET 213 N -0.22 -0.73 -0.81 2.37 4.05 -0.38 -0.73 114.93 118.48 1wfc h MET 213 Ca 0.01 0.05 0.19 0.00 -0.28 0.00 0.00 59.70 59.67 1wfc h MET 213 Cb 0.29 0.17 -0.14 0.00 -0.80 0.00 0.00 31.60 31.12 1wfc h MET 213 CO 0.00 -0.49 0.01 0.00 0.23 0.00 0.00 176.91 176.67 1wfc h ALA 214 N -0.32 0.87 -0.67 0.39 0.00 -1.26 0.15 119.26 118.41 1wfc h ALA 214 Ca -0.02 0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1wfc h ALA 214 Cb 0.69 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1wfc h ALA 214 CO -0.09 -0.44 0.27 1.49 0.00 0.00 0.00 179.25 180.48 1wfc h GLU 215 N 0.09 0.98 -0.50 0.00 4.81 -0.94 0.43 114.58 119.46 1wfc h GLU 215 Ca 0.45 -0.16 -0.11 0.00 -0.13 0.00 0.00 59.36 59.41 1wfc h GLU 215 Cb 0.83 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 1wfc h GLU 215 CO -0.72 0.80 -0.14 -0.07 -0.73 0.00 0.00 179.01 178.16 1wfc h LEU 216 N 0.97 0.95 -0.86 1.64 3.38 0.50 0.52 115.31 122.41 1wfc h LEU 216 Ca 0.23 -0.32 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 1wfc h LEU 216 Cb 0.18 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1wfc h LEU 216 CO -0.02 1.08 -0.38 -0.07 0.09 0.00 0.00 178.44 179.14 1wfc h LEU 217 N 0.84 0.40 0.00 1.67 3.38 0.13 -3.33 115.31 118.40 1wfc h LEU 217 Ca 0.13 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1wfc h LEU 217 Cb 0.68 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1wfc h LEU 217 CO 0.05 0.75 -1.60 0.35 0.09 0.00 0.00 178.44 178.08 1wfc n THR 218 N -4.04 0.00 -1.07 0.22 -2.24 0.14 -4.95 114.28 102.34 1wfc n THR 218 Ca -0.01 -0.34 -0.02 0.00 -2.27 0.00 0.00 64.05 61.40 1wfc n THR 218 Cb 0.48 0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.99 1wfc n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wfc n GLY 219 N 1.46 0.56 3.01 3.38 0.00 0.18 -5.03 105.19 108.75 1wfc n GLY 219 Ca -0.02 -0.36 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 1wfc n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wfc s ARG 220 N -1.38 0.53 0.23 1.61 1.81 -1.20 -5.02 118.95 115.53 1wfc s ARG 220 Ca 0.00 -0.39 -0.32 0.00 -1.72 0.00 0.00 55.73 53.30 1wfc s ARG 220 Cb 0.00 -0.47 -0.13 0.00 -0.45 0.00 0.00 34.95 33.90 1wfc s ARG 220 CO 0.00 0.12 1.42 2.41 -0.68 0.00 0.00 175.30 178.57 1wfc n THR 221 N 2.49 0.84 0.01 0.02 -1.04 -1.26 -4.06 114.28 111.28 1wfc n THR 221 Ca -0.16 -0.21 -0.19 0.00 -2.04 0.00 0.00 64.05 61.46 1wfc n THR 221 Cb 0.57 -1.47 -0.09 0.00 -1.82 0.00 0.00 70.33 67.51 1wfc n THR 221 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1wfc h LEU 222 N 4.39 0.86 -6.29 -4.42 5.85 -1.92 -3.38 115.31 110.40 1wfc h LEU 222 Ca -0.45 -0.69 -0.59 0.00 0.84 0.00 0.00 57.88 56.99 1wfc h LEU 222 Cb 1.27 -0.26 -0.40 0.00 0.37 0.00 0.00 40.66 41.64 1wfc h LEU 222 CO 0.77 1.43 -0.86 0.49 -0.34 0.00 0.00 178.44 179.93 1wfc n PHE 223 N -3.96 1.17 -0.89 1.25 3.72 -1.26 -5.00 117.46 112.49 1wfc n PHE 223 Ca -0.09 -3.79 -0.28 0.00 -0.05 0.00 0.00 57.45 53.24 1wfc n PHE 223 Cb 0.79 -0.32 -0.02 0.00 -0.94 0.00 0.00 39.48 38.98 1wfc n PHE 223 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1wfc n PRO 224 N 1.63 2.10 -1.88 -1.08 -0.04 -1.26 -4.75 135.00 129.73 1wfc n PRO 224 Ca 0.25 -1.62 -0.40 0.00 -0.04 0.00 0.00 63.50 61.69 1wfc n PRO 224 Cb 0.46 -2.59 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 1wfc n PRO 224 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1wfc s GLY 225 N 3.64 2.94 0.13 0.55 0.00 -1.26 -4.88 107.32 108.43 1wfc s GLY 225 Ca 0.45 1.45 0.26 0.00 0.00 0.00 0.00 44.72 46.87 1wfc s GLY 225 CO -0.01 2.09 1.61 -1.30 0.00 0.00 0.00 173.10 175.49 1wfc n THR 226 N 0.21 0.38 -3.74 0.90 -2.24 -1.26 -4.10 114.28 104.42 1wfc n THR 226 Ca 0.03 -0.22 -0.05 0.00 -2.27 0.00 0.00 64.05 61.54 1wfc n THR 226 Cb 0.41 -0.34 -0.02 0.00 -2.10 0.00 0.00 70.33 68.29 1wfc n THR 226 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1wfc s ASP 227 N -4.07 -0.22 0.28 3.42 1.47 -1.25 -1.92 116.67 114.38 1wfc s ASP 227 Ca 0.10 -0.39 0.01 0.00 1.18 0.00 0.00 52.55 53.44 1wfc s ASP 227 Cb 0.14 0.52 0.67 0.00 -0.34 0.00 0.00 42.92 43.92 1wfc s ASP 227 CO 0.64 -0.95 1.64 0.45 0.68 0.00 0.00 175.17 177.63 1wfc h HIS 228 N 2.00 0.28 0.17 2.11 3.86 -1.87 -0.08 115.15 121.62 1wfc h HIS 228 Ca -0.23 0.05 -0.31 0.00 -1.16 0.00 0.00 60.37 58.72 1wfc h HIS 228 Cb 1.24 0.01 0.03 0.00 1.06 0.00 0.00 27.41 29.75 1wfc h HIS 228 CO 0.37 -0.22 -1.33 0.82 0.86 0.00 0.00 177.93 178.44 1wfc h ILE 229 N 0.19 1.31 -0.25 2.45 1.08 -1.99 -0.78 117.51 119.52 1wfc h ILE 229 Ca 0.53 -2.61 0.03 0.00 -0.39 0.00 0.00 64.86 62.42 1wfc h ILE 229 Cb 1.06 2.84 -0.03 0.00 -3.07 0.00 0.00 36.82 37.62 1wfc h ILE 229 CO -0.66 0.79 0.06 -0.78 -0.69 0.00 0.00 178.15 176.86 1wfc h ASP 230 N 0.21 0.04 -0.65 1.72 3.58 -1.91 -1.05 116.42 118.36 1wfc h ASP 230 Ca -0.21 0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.29 1wfc h ASP 230 Cb 2.01 0.04 -0.03 0.00 1.72 0.00 0.00 39.33 43.07 1wfc h ASP 230 CO 0.25 0.05 0.43 -0.61 -2.88 0.00 0.00 179.24 176.48 1wfc h GLN 231 N 0.16 0.84 -0.87 0.28 4.15 -0.84 -0.94 115.11 117.89 1wfc h GLN 231 Ca 0.11 -0.05 0.08 0.00 0.77 0.00 0.00 58.65 59.57 1wfc h GLN 231 Cb 0.10 -0.19 -0.07 0.00 0.21 0.00 0.00 27.48 27.53 1wfc h GLN 231 CO -0.14 0.56 0.53 1.25 -1.93 0.00 0.00 178.83 179.09 1wfc h LEU 232 N 0.87 0.79 -0.45 -2.39 5.85 -0.82 -0.64 115.31 118.50 1wfc h LEU 232 Ca 0.24 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.99 1wfc h LEU 232 Cb -0.08 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1wfc h LEU 232 CO -0.06 0.47 0.27 0.11 -0.34 0.00 0.00 178.44 178.88 1wfc h LYS 233 N 0.90 0.62 -0.32 1.25 1.57 -0.17 0.15 116.57 120.57 1wfc h LYS 233 Ca 0.41 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 59.19 1wfc h LYS 233 Cb 0.30 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 32.43 1wfc h LYS 233 CO -0.22 0.47 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.02 1wfc h LEU 234 N 0.60 -0.22 0.18 2.94 3.38 -0.59 -0.33 115.31 121.28 1wfc h LEU 234 Ca 0.16 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1wfc h LEU 234 Cb 0.01 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1wfc h LEU 234 CO -0.03 -0.07 -0.19 0.40 0.09 0.00 0.00 178.44 178.64 1wfc h ILE 235 N 0.04 0.59 -0.22 1.22 2.04 -0.68 -2.52 117.51 117.99 1wfc h ILE 235 Ca 0.16 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.94 1wfc h ILE 235 Cb 0.23 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1wfc h ILE 235 CO -0.30 0.00 -0.18 -0.07 0.00 0.00 0.00 178.15 177.60 1wfc h LEU 236 N -0.40 0.37 -0.41 1.44 3.38 -0.37 0.85 115.31 120.16 1wfc h LEU 236 Ca 0.00 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.90 1wfc h LEU 236 Cb 0.38 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1wfc h LEU 236 CO -0.05 0.57 0.21 -0.09 0.09 0.00 0.00 178.44 179.17 1wfc h ARG 237 N 0.34 0.42 0.13 1.13 2.43 -0.97 0.38 114.38 118.25 1wfc h ARG 237 Ca 0.06 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1wfc h ARG 237 Cb 0.52 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1wfc h ARG 237 CO 0.03 0.28 -0.06 1.25 -1.51 0.00 0.00 179.97 179.96 1wfc h LEU 238 N 0.43 -0.15 -1.09 3.80 5.85 -0.77 -3.37 115.31 120.00 1wfc h LEU 238 Ca 0.17 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.54 1wfc h LEU 238 Cb 0.07 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1wfc h LEU 238 CO -0.11 0.31 -0.27 1.33 -0.34 0.00 0.00 178.44 179.36 1wfc n VAL 239 N -4.96 0.00 0.00 1.05 0.24 0.17 -1.15 118.33 113.68 1wfc n VAL 239 Ca -0.09 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 1wfc n VAL 239 Cb 0.25 1.03 0.00 0.00 -1.47 0.00 0.00 33.84 33.65 1wfc n VAL 239 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wfc n GLY 240 N 1.36 0.59 3.82 7.63 0.00 0.13 -4.13 105.19 114.59 1wfc n GLY 240 Ca 0.12 -1.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 1wfc n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wfc s THR 241 N -2.73 3.62 0.34 2.61 -4.23 -0.84 -4.70 115.64 109.71 1wfc s THR 241 Ca 0.00 0.53 -0.29 0.00 -1.18 0.00 0.00 61.69 60.75 1wfc s THR 241 Cb 0.00 -3.30 -0.11 0.00 1.34 0.00 0.00 72.50 70.43 1wfc s THR 241 CO 0.00 -0.69 1.54 -2.65 -0.54 0.00 0.00 174.62 172.28 1wfc n PRO 242 N -3.23 2.68 -2.33 3.99 -0.02 -1.26 -4.88 135.00 129.96 1wfc n PRO 242 Ca 0.07 0.95 -0.25 0.00 -2.02 0.00 0.00 63.50 62.25 1wfc n PRO 242 Cb 0.55 -2.70 0.14 0.00 -0.02 0.00 0.00 33.50 31.47 1wfc n PRO 242 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wfc n GLY 243 N 1.25 -0.02 0.38 -1.23 0.00 -1.26 -4.87 105.19 99.44 1wfc n GLY 243 Ca 0.05 -1.93 -0.01 0.00 0.00 0.00 0.00 46.02 44.12 1wfc n GLY 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wfc h ALA 244 N -0.98 1.30 0.15 4.61 0.00 -1.98 -1.37 119.26 120.99 1wfc h ALA 244 Ca -0.36 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.50 1wfc h ALA 244 Cb 1.19 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1wfc h ALA 244 CO 0.33 0.64 -0.20 0.93 0.00 0.00 0.00 179.25 180.95 1wfc h GLU 245 N 1.34 -0.40 -0.67 0.00 5.08 -2.00 -0.10 114.58 117.84 1wfc h GLU 245 Ca 0.38 0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.69 1wfc h GLU 245 Cb -0.12 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 1wfc h GLU 245 CO -0.09 -0.26 0.12 1.25 -1.00 0.00 0.00 179.01 179.03 1wfc h LEU 246 N -0.41 1.05 -0.43 1.33 5.85 -1.92 -2.60 115.31 118.18 1wfc h LEU 246 Ca 0.01 -0.25 0.08 0.00 0.84 0.00 0.00 57.88 58.56 1wfc h LEU 246 Cb 0.41 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.09 1wfc h LEU 246 CO -0.09 1.04 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.97 1wfc h LEU 247 N 1.02 -0.20 -1.92 2.25 3.38 -0.83 0.15 115.31 119.17 1wfc h LEU 247 Ca 0.20 0.10 0.30 0.00 0.09 0.00 0.00 57.88 58.58 1wfc h LEU 247 Cb 0.42 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 1wfc h LEU 247 CO 0.01 -0.06 0.75 0.11 0.09 0.00 0.00 178.44 179.33 1wfc h LYS 248 N 0.10 0.05 -0.01 1.13 1.57 -0.62 -0.52 116.57 118.27 1wfc h LYS 248 Ca 0.21 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1wfc h LYS 248 Cb 0.31 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1wfc h LYS 248 CO -0.36 0.03 -0.22 1.63 -0.57 0.00 0.00 179.45 179.95 1wfc n LYS 249 N -4.27 0.78 -2.96 3.15 5.02 0.51 -4.64 118.16 115.75 1wfc n LYS 249 Ca 0.23 -0.42 -0.42 0.00 -2.02 0.00 0.00 58.31 55.68 1wfc n LYS 249 Cb 1.08 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 34.55 1wfc n LYS 249 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1wfc s ILE 250 N -2.51 4.83 -0.41 -0.18 1.01 -0.21 -4.70 121.20 119.04 1wfc s ILE 250 Ca 0.25 1.26 0.24 0.00 0.00 0.00 0.00 60.65 62.40 1wfc s ILE 250 Cb 0.19 -4.10 0.34 0.00 0.01 0.00 0.00 42.46 38.90 1wfc s ILE 250 CO 0.51 -0.16 1.65 0.28 0.00 0.00 0.00 174.94 177.21 1wfc h SER 251 N 7.98 0.00 -3.38 3.58 0.02 -1.58 -3.44 113.55 116.74 1wfc h SER 251 Ca -0.24 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.12 1wfc h SER 251 Cb 1.10 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.56 1wfc h SER 251 CO 0.86 0.00 0.69 -0.55 -1.14 0.00 0.00 176.83 176.70 1wfc s SER 252 N -6.08 6.82 0.22 3.07 0.15 -1.26 -4.90 113.70 111.72 1wfc s SER 252 Ca 0.07 0.86 -0.09 0.00 0.70 0.00 0.00 55.95 57.49 1wfc s SER 252 Cb 0.06 -2.50 0.32 0.00 -1.71 0.00 0.00 66.02 62.19 1wfc s SER 252 CO 0.66 -0.82 1.72 -0.08 1.20 0.00 0.00 173.24 175.92 1wfc h GLU 253 N 8.18 0.32 -0.08 5.44 4.81 -1.98 0.34 114.58 131.61 1wfc h GLU 253 Ca -0.22 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1wfc h GLU 253 Cb 1.07 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.38 1wfc h GLU 253 CO 0.99 0.21 0.04 1.03 -0.73 0.00 0.00 179.01 180.55 1wfc h SER 254 N 0.33 0.11 0.03 1.04 0.87 -1.98 0.26 113.55 114.22 1wfc h SER 254 Ca 0.33 -0.11 0.02 0.00 -1.23 0.00 0.00 61.79 60.80 1wfc h SER 254 Cb 0.48 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.38 1wfc h SER 254 CO -0.38 0.19 -0.20 0.00 -0.53 0.00 0.00 176.83 175.91 1wfc h ALA 255 N 0.92 -0.28 -0.51 6.23 0.00 -1.81 0.53 119.26 124.34 1wfc h ALA 255 Ca 0.03 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.03 1wfc h ALA 255 Cb 0.11 0.34 -0.10 0.00 0.00 0.00 0.00 17.79 18.14 1wfc h ALA 255 CO -0.00 -0.71 -0.23 -0.09 0.00 0.00 0.00 179.25 178.22 1wfc h ARG 256 N -0.34 -0.11 -0.48 0.00 2.43 -0.14 0.15 114.38 115.88 1wfc h ARG 256 Ca 0.05 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.32 1wfc h ARG 256 Cb 0.40 0.02 -0.10 0.00 -0.42 0.00 0.00 29.97 29.88 1wfc h ARG 256 CO -0.16 -0.07 -0.18 -0.91 -1.51 0.00 0.00 179.97 177.13 1wfc h ASN 257 N -0.11 -0.63 0.08 -3.80 2.35 0.40 0.08 115.58 113.93 1wfc h ASN 257 Ca 0.23 0.16 -0.00 0.00 -0.55 0.00 0.00 56.30 56.14 1wfc h ASN 257 Cb 0.48 0.37 0.00 0.00 0.05 0.00 0.00 38.32 39.22 1wfc h ASN 257 CO -0.58 -0.21 -0.04 0.22 -1.65 0.00 0.00 177.43 175.17 1wfc h TYR 258 N -0.07 -0.09 -0.63 1.19 3.20 0.14 -1.83 116.97 118.87 1wfc h TYR 258 Ca 0.23 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.21 1wfc h TYR 258 Cb 0.43 0.03 -0.09 0.00 1.54 0.00 0.00 36.73 38.64 1wfc h TYR 258 CO -0.46 0.05 0.17 0.82 -1.64 0.00 0.00 178.16 177.10 1wfc h ILE 259 N -0.22 0.66 -0.38 1.81 2.04 -0.34 0.33 117.51 121.41 1wfc h ILE 259 Ca -0.01 -0.10 0.11 0.00 1.00 0.00 0.00 64.86 65.85 1wfc h ILE 259 Cb 0.19 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 1wfc h ILE 259 CO 0.02 0.06 0.39 1.56 0.00 0.00 0.00 178.15 180.17 1wfc h GLN 260 N 0.31 0.00 0.00 2.37 1.08 -0.55 0.47 115.11 118.79 1wfc h GLN 260 Ca 0.33 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.53 1wfc h GLN 260 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 1wfc h GLN 260 CO -0.39 0.00 0.00 -1.13 -0.95 0.00 0.00 178.83 176.36 1wfc n SER 261 N -3.78 0.00 -4.79 1.46 3.41 0.12 -4.80 113.62 105.23 1wfc n SER 261 Ca 0.06 0.48 -0.38 0.00 -0.26 0.00 0.00 58.87 58.78 1wfc n SER 261 Cb 0.56 -0.49 -0.06 0.00 -0.26 0.00 0.00 64.21 63.96 1wfc n SER 261 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1wfc s LEU 262 N -2.99 4.39 0.20 1.04 1.43 0.15 -5.00 118.68 117.91 1wfc s LEU 262 Ca 0.13 0.84 -0.32 0.00 -1.03 0.00 0.00 54.13 53.76 1wfc s LEU 262 Cb 0.17 -2.57 -0.12 0.00 0.03 0.00 0.00 46.19 43.71 1wfc s LEU 262 CO 0.48 0.21 1.75 0.41 0.23 0.00 0.00 176.35 179.43 1wfc n THR 263 N 2.54 0.06 -1.92 5.49 -1.04 -1.26 -4.89 114.28 113.26 1wfc n THR 263 Ca -0.12 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.46 1wfc n THR 263 Cb 0.52 -2.02 -0.02 0.00 -1.82 0.00 0.00 70.33 66.99 1wfc n THR 263 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1wfc s GLN 264 N 1.42 4.21 0.03 -2.82 -0.21 -1.26 -4.88 119.66 116.14 1wfc s GLN 264 Ca 0.76 2.41 0.05 0.00 0.02 0.00 0.00 55.36 58.60 1wfc s GLN 264 Cb -0.50 -3.08 -0.02 0.00 1.00 0.00 0.00 33.01 30.42 1wfc s GLN 264 CO 0.33 -0.50 -0.16 -1.64 -2.12 0.00 0.00 175.29 171.20 1wfc s MET 265 N -0.44 1.10 0.65 2.91 -1.94 -1.26 -4.97 119.30 115.36 1wfc s MET 265 Ca 0.61 -0.74 -0.10 0.00 -1.71 0.00 0.00 55.69 53.75 1wfc s MET 265 Cb -0.44 -1.12 -0.00 0.00 2.01 0.00 0.00 34.83 35.27 1wfc s MET 265 CO 0.45 0.29 1.03 -1.25 -0.01 0.00 0.00 175.02 175.53 1wfc s PRO 266 N -0.95 3.11 0.31 2.03 0.04 -1.26 -1.99 135.00 136.30 1wfc s PRO 266 Ca 0.04 0.46 -0.29 0.00 0.04 0.00 0.00 61.00 61.25 1wfc s PRO 266 Cb -0.07 -2.09 -0.12 0.00 0.04 0.00 0.00 34.50 32.25 1wfc s PRO 266 CO 0.01 -0.81 1.42 1.17 0.04 0.00 0.00 177.00 178.83 1wfc n LYS 267 N -2.83 2.33 -1.82 4.56 4.81 -1.26 -3.88 118.16 120.06 1wfc n LYS 267 Ca 0.06 0.82 -0.29 0.00 -0.87 0.00 0.00 58.31 58.03 1wfc n LYS 267 Cb 0.56 -2.49 0.08 0.00 0.02 0.00 0.00 35.03 33.20 1wfc n LYS 267 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1wfc s MET 268 N -1.25 2.13 -0.37 1.64 -1.94 -0.30 -4.91 119.30 114.31 1wfc s MET 268 Ca 0.60 0.28 -0.26 0.00 -1.71 0.00 0.00 55.69 54.60 1wfc s MET 268 Cb -0.56 -1.95 0.02 0.00 2.01 0.00 0.00 34.83 34.35 1wfc s MET 268 CO 0.56 -1.51 0.96 1.21 -0.01 0.00 0.00 175.02 176.23 1wfc s ASN 269 N -4.39 6.71 0.43 3.03 3.84 -1.26 -4.89 114.94 118.41 1wfc s ASN 269 Ca 0.61 0.64 0.23 0.00 0.21 0.00 0.00 52.86 54.54 1wfc s ASN 269 Cb -0.12 -2.48 0.95 0.00 -0.55 0.00 0.00 41.25 39.05 1wfc s ASN 269 CO 0.51 -0.89 1.85 -0.26 -2.79 0.00 0.00 177.10 175.52 1wfc h PHE 270 N 8.47 0.00 0.00 0.43 -1.00 -1.96 -1.91 116.94 120.97 1wfc h PHE 270 Ca -0.23 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.49 1wfc h PHE 270 Cb 1.07 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.63 1wfc h PHE 270 CO 0.84 0.26 -0.30 0.00 -1.61 0.00 0.00 178.31 177.50 1wfc h ALA 271 N 1.74 1.23 0.00 2.45 0.00 -1.90 0.22 119.26 123.00 1wfc h ALA 271 Ca -0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1wfc h ALA 271 Cb 0.70 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1wfc h ALA 271 CO 0.03 0.37 -0.61 0.09 0.00 0.00 0.00 179.25 179.14 1wfc n ASN 272 N -3.78 0.58 -0.02 0.00 4.13 -0.76 -3.81 115.26 111.60 1wfc n ASN 272 Ca -0.01 -0.11 -0.21 0.00 1.68 0.00 0.00 54.58 55.92 1wfc n ASN 272 Cb 0.39 0.28 -0.13 0.00 -1.54 0.00 0.00 39.78 38.78 1wfc n ASN 272 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1wfc h VAL 273 N 0.00 1.02 -2.64 2.41 2.07 -0.84 -3.38 116.25 114.89 1wfc h VAL 273 Ca 0.00 -2.35 -0.81 0.00 0.82 0.00 0.00 66.70 64.37 1wfc h VAL 273 Cb 0.61 2.64 -0.28 0.00 -1.52 0.00 0.00 31.29 32.74 1wfc h VAL 273 CO 0.00 0.64 0.86 0.49 0.02 0.00 0.00 177.57 179.58 1wfc n PHE 274 N -4.02 2.47 -1.70 1.57 3.72 0.67 -5.01 117.46 115.15 1wfc n PHE 274 Ca -0.26 -2.59 -0.43 0.00 -0.05 0.00 0.00 57.45 54.11 1wfc n PHE 274 Cb 0.84 -1.21 -0.03 0.00 -0.94 0.00 0.00 39.48 38.14 1wfc n PHE 274 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1wfc n ILE 275 N 0.75 0.03 -0.91 4.37 5.41 -1.25 -1.40 119.36 126.36 1wfc n ILE 275 Ca 0.34 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 64.08 1wfc n ILE 275 Cb 0.30 -1.85 0.00 0.00 -0.71 0.00 0.00 39.64 37.39 1wfc n ILE 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1wfc n GLY 276 N 3.74 0.66 3.79 7.39 0.00 -1.26 -5.00 105.19 114.51 1wfc n GLY 276 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1wfc n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wfc s ALA 277 N -2.89 2.28 0.11 4.61 0.00 -0.49 -4.93 121.76 120.45 1wfc s ALA 277 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 51.96 51.65 1wfc s ALA 277 Cb 0.00 -3.17 -0.10 0.00 0.00 0.00 0.00 23.12 19.85 1wfc s ALA 277 CO 0.00 -1.67 1.77 1.21 0.00 0.00 0.00 175.76 177.07 1wfc s ASN 278 N -3.69 6.48 0.55 0.00 3.84 -1.26 -4.84 114.94 116.02 1wfc s ASN 278 Ca 0.60 2.68 0.29 0.00 0.21 0.00 0.00 52.86 56.64 1wfc s ASN 278 Cb -0.15 -2.57 1.46 0.00 -0.55 0.00 0.00 41.25 39.44 1wfc s ASN 278 CO 0.55 -0.97 1.93 1.55 -2.79 0.00 0.00 177.10 177.37 1wfc h PRO 279 N 8.45 0.00 -0.02 0.43 0.13 -1.97 0.33 132.00 139.35 1wfc h PRO 279 Ca -0.45 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.58 1wfc h PRO 279 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1wfc h PRO 279 CO 0.94 0.00 -0.47 -0.07 -0.23 0.00 0.00 178.00 178.18 1wfc h LEU 280 N 0.00 0.05 -0.07 1.56 3.38 -1.98 0.19 115.31 118.43 1wfc h LEU 280 Ca 0.31 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.21 1wfc h LEU 280 Cb 1.32 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1wfc h LEU 280 CO -0.00 0.51 -0.15 0.00 0.09 0.00 0.00 178.44 178.88 1wfc h ALA 281 N 1.49 0.12 -0.14 1.53 0.00 -0.77 -1.26 119.26 120.24 1wfc h ALA 281 Ca -0.00 -0.35 0.04 0.00 0.00 0.00 0.00 54.91 54.60 1wfc h ALA 281 Cb 0.84 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 1wfc h ALA 281 CO 0.06 0.02 -0.13 0.28 0.00 0.00 0.00 179.25 179.49 1wfc h VAL 282 N -0.25 0.65 -0.71 0.00 2.07 -0.94 0.87 116.25 117.95 1wfc h VAL 282 Ca 0.00 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.62 1wfc h VAL 282 Cb 0.74 0.65 -0.07 0.00 -1.52 0.00 0.00 31.29 31.08 1wfc h VAL 282 CO 0.03 0.00 0.33 -0.78 0.02 0.00 0.00 177.57 177.18 1wfc h ASP 283 N -0.15 0.41 -0.23 0.57 3.58 -0.66 -2.08 116.42 117.86 1wfc h ASP 283 Ca 0.09 0.07 -0.02 0.00 0.42 0.00 0.00 57.03 57.59 1wfc h ASP 283 Cb 0.28 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 1wfc h ASP 283 CO -0.23 0.22 0.07 0.25 -2.88 0.00 0.00 179.24 176.68 1wfc h LEU 284 N 0.56 0.33 -0.59 2.28 5.85 -0.18 -2.73 115.31 120.82 1wfc h LEU 284 Ca 0.36 -0.20 0.12 0.00 0.84 0.00 0.00 57.88 58.99 1wfc h LEU 284 Cb 0.41 -0.09 -0.10 0.00 0.37 0.00 0.00 40.66 41.26 1wfc h LEU 284 CO -0.29 0.45 0.02 -0.07 -0.34 0.00 0.00 178.44 178.20 1wfc h LEU 285 N 0.20 -0.23 -2.21 2.25 3.38 -0.53 0.30 115.31 118.47 1wfc h LEU 285 Ca 0.07 0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.21 1wfc h LEU 285 Cb 0.23 0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1wfc h LEU 285 CO -0.00 -0.09 0.07 -0.33 0.09 0.00 0.00 178.44 178.17 1wfc h GLU 286 N 0.13 0.00 0.00 1.13 5.08 -1.19 0.18 114.58 119.91 1wfc h GLU 286 Ca 0.31 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.45 1wfc h GLU 286 Cb 0.49 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1wfc h GLU 286 CO -0.49 0.00 -1.11 0.87 -1.00 0.00 0.00 179.01 177.27 1wfc h LYS 287 N 0.00 0.00 0.08 2.33 1.79 -0.18 -3.33 116.57 117.26 1wfc h LYS 287 Ca 0.04 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.38 1wfc h LYS 287 Cb 0.17 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.82 1wfc h LYS 287 CO -0.00 0.82 -0.56 0.52 -1.08 0.00 0.00 179.45 179.15 1wfc h MET 288 N 0.00 0.17 -2.93 3.15 2.86 -0.63 -1.72 114.93 115.82 1wfc h MET 288 Ca -0.07 -0.29 -0.74 0.00 -2.06 0.00 0.00 59.70 56.54 1wfc h MET 288 Cb 1.78 0.11 -0.13 0.00 0.06 0.00 0.00 31.60 33.42 1wfc h MET 288 CO 0.11 1.14 2.36 1.28 1.06 0.00 0.00 176.91 182.86 1wfc n LEU 289 N -4.31 7.62 -4.64 1.22 4.77 0.58 -4.41 117.00 117.83 1wfc n LEU 289 Ca -0.14 -4.78 -0.35 0.00 -0.03 0.00 0.00 56.01 50.71 1wfc n LEU 289 Cb 0.69 -1.41 -0.10 0.00 -2.33 0.00 0.00 43.42 40.27 1wfc n LEU 289 CO 0.41 1.83 -0.27 -0.69 -1.33 0.00 0.00 177.39 177.35 1wfc s VAL 290 N -0.48 4.65 0.21 4.08 1.01 -1.26 -4.89 120.40 123.72 1wfc s VAL 290 Ca 0.50 -0.09 -0.11 0.00 0.00 0.00 0.00 61.98 62.28 1wfc s VAL 290 Cb 0.15 -3.07 0.15 0.00 0.00 0.00 0.00 36.38 33.62 1wfc s VAL 290 CO -0.06 0.49 1.88 0.25 0.00 0.00 0.00 175.10 177.66 1wfc h LEU 291 N 6.38 0.84 -8.76 3.92 5.85 -1.90 -3.39 115.31 118.26 1wfc h LEU 291 Ca -0.39 -0.02 -0.56 0.00 0.84 0.00 0.00 57.88 57.74 1wfc h LEU 291 Cb 1.18 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.93 1wfc h LEU 291 CO 0.67 0.61 0.89 -0.62 -0.34 0.00 0.00 178.44 179.65 1wfc s ASP 292 N -5.86 6.67 0.28 1.25 -1.08 -1.26 -4.91 116.67 111.77 1wfc s ASP 292 Ca -0.13 0.54 0.01 0.00 -0.52 0.00 0.00 52.55 52.46 1wfc s ASP 292 Cb 0.15 -2.54 0.55 0.00 -1.46 0.00 0.00 42.92 39.62 1wfc s ASP 292 CO 0.78 -1.18 1.84 0.77 0.52 0.00 0.00 175.17 177.89 1wfc h SER 293 N 9.03 0.94 -0.49 -0.34 4.64 -1.98 -0.03 113.55 125.31 1wfc h SER 293 Ca -0.23 0.05 0.14 0.00 -0.47 0.00 0.00 61.79 61.28 1wfc h SER 293 Cb 1.06 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.99 1wfc h SER 293 CO 1.11 0.50 0.60 0.44 -0.87 0.00 0.00 176.83 178.61 1wfc h ASP 294 N 1.00 0.00 -0.27 4.97 3.32 -1.94 -1.53 116.42 121.97 1wfc h ASP 294 Ca 0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.55 1wfc h ASP 294 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1wfc h ASP 294 CO -0.26 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.55 1wfc n LYS 295 N -3.51 2.05 -1.66 3.56 5.02 -0.03 -4.97 118.16 118.62 1wfc n LYS 295 Ca 0.10 -1.87 -0.32 0.00 -2.02 0.00 0.00 58.31 54.19 1wfc n LYS 295 Cb 0.79 -1.33 0.05 0.00 -0.02 0.00 0.00 35.03 34.52 1wfc n LYS 295 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1wfc s ARG 296 N -1.12 2.77 0.53 1.97 0.52 -0.58 -4.95 118.95 118.09 1wfc s ARG 296 Ca 0.25 1.25 -0.20 0.00 -0.52 0.00 0.00 55.73 56.52 1wfc s ARG 296 Cb 0.15 -1.96 -0.06 0.00 0.52 0.00 0.00 34.95 33.60 1wfc s ARG 296 CO 0.20 -1.26 1.13 -1.50 0.02 0.00 0.00 175.30 173.90 1wfc s ILE 297 N -2.58 3.17 0.38 1.52 2.07 -0.65 -5.03 121.20 120.07 1wfc s ILE 297 Ca 0.64 0.74 0.02 0.00 -1.41 0.00 0.00 60.65 60.64 1wfc s ILE 297 Cb -0.18 -3.31 -0.01 0.00 0.13 0.00 0.00 42.46 39.09 1wfc s ILE 297 CO 0.46 -0.14 0.56 0.42 -1.91 0.00 0.00 174.94 174.32 1wfc s THR 298 N -1.75 4.42 0.13 4.00 -4.23 -1.26 -4.90 115.64 112.05 1wfc s THR 298 Ca 0.72 -0.66 -0.19 0.00 -1.18 0.00 0.00 61.69 60.38 1wfc s THR 298 Cb -0.24 -3.60 -0.03 0.00 1.34 0.00 0.00 72.50 69.98 1wfc s THR 298 CO 0.27 -0.35 1.73 0.00 -0.54 0.00 0.00 174.62 175.73 1wfc h ALA 299 N 0.68 0.22 -0.17 3.99 0.00 -1.93 0.49 119.26 122.54 1wfc h ALA 299 Ca -0.48 0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.54 1wfc h ALA 299 Cb 1.24 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 1wfc h ALA 299 CO 0.58 -0.40 -0.22 0.00 0.00 0.00 0.00 179.25 179.20 1wfc h ALA 300 N 1.19 -0.16 -0.76 0.00 0.00 -1.94 0.43 119.26 118.03 1wfc h ALA 300 Ca 0.11 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1wfc h ALA 300 Cb 0.12 0.45 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1wfc h ALA 300 CO -0.17 -0.67 0.40 1.96 0.00 0.00 0.00 179.25 180.77 1wfc h GLN 301 N -0.26 1.06 -0.62 0.00 4.20 -1.80 -2.87 115.11 114.82 1wfc h GLN 301 Ca 0.11 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.63 1wfc h GLN 301 Cb 0.44 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 1wfc h GLN 301 CO -0.32 0.79 0.13 0.00 -0.67 0.00 0.00 178.83 178.76 1wfc h ALA 302 N 1.37 1.07 -0.10 3.87 0.00 0.90 -1.65 119.26 124.72 1wfc h ALA 302 Ca 0.27 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1wfc h ALA 302 Cb 0.05 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1wfc h ALA 302 CO -0.04 0.61 0.16 -0.07 0.00 0.00 0.00 179.25 179.92 1wfc h LEU 303 N 0.93 0.00 -0.92 0.00 3.38 -0.72 0.31 115.31 118.29 1wfc h LEU 303 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1wfc h LEU 303 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1wfc h LEU 303 CO 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 178.44 178.53 1wfc n ALA 304 N -2.20 2.58 -2.27 1.53 0.00 -0.63 -4.75 120.51 114.78 1wfc n ALA 304 Ca -0.00 -0.43 -0.42 0.00 0.00 0.00 0.00 53.44 52.58 1wfc n ALA 304 Cb 0.26 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 1wfc n ALA 304 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1wfc s HIS 305 N -2.00 3.03 0.22 0.00 5.04 0.11 -4.89 115.29 116.80 1wfc s HIS 305 Ca 0.38 0.95 0.16 0.00 -1.54 0.00 0.00 55.06 55.02 1wfc s HIS 305 Cb 0.21 -3.61 0.75 0.00 0.04 0.00 0.00 32.58 29.97 1wfc s HIS 305 CO 0.34 -2.15 0.78 0.00 -2.34 0.00 0.00 174.74 171.36 1wfc n ALA 306 N 4.94 0.69 0.33 1.58 0.00 -1.26 -0.33 120.51 126.47 1wfc n ALA 306 Ca 0.12 0.43 0.15 0.00 0.00 0.00 0.00 53.44 54.15 1wfc n ALA 306 Cb 0.44 -0.53 0.83 0.00 0.00 0.00 0.00 19.45 20.19 1wfc n ALA 306 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1wfc h TYR 307 N 0.00 0.00 -0.18 0.00 3.20 -1.90 -0.32 116.97 117.77 1wfc h TYR 307 Ca 0.44 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.27 1wfc h TYR 307 Cb 1.43 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.67 1wfc h TYR 307 CO -0.00 0.00 -0.06 1.19 -1.64 0.00 0.00 178.16 177.65 1wfc n PHE 308 N -2.88 0.62 -0.29 -3.82 3.72 0.56 -4.75 117.46 110.61 1wfc n PHE 308 Ca -0.02 -1.13 0.10 0.00 -0.05 0.00 0.00 57.45 56.35 1wfc n PHE 308 Cb 0.37 -0.30 0.26 0.00 -0.94 0.00 0.00 39.48 38.87 1wfc n PHE 308 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1wfc h ALA 309 N 1.03 1.28 0.00 4.37 0.00 -1.19 0.22 119.26 124.96 1wfc h ALA 309 Ca 0.05 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1wfc h ALA 309 Cb 1.33 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1wfc h ALA 309 CO 0.18 -0.29 0.00 1.04 0.00 0.00 0.00 179.25 180.17 1wfc n GLN 310 N -5.04 0.07 0.00 0.00 1.13 -1.26 -3.54 117.38 108.74 1wfc n GLN 310 Ca 0.19 0.28 0.00 0.00 -1.94 0.00 0.00 57.00 55.53 1wfc n GLN 310 Cb 0.56 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.41 1wfc n GLN 310 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1wfc n TYR 311 N -1.39 0.00 -1.69 1.08 4.01 0.52 -5.04 117.16 114.66 1wfc n TYR 311 Ca 0.03 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.35 1wfc n TYR 311 Cb 0.08 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.08 1wfc n TYR 311 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1wfc s HIS 312 N -1.43 1.30 -0.32 -0.72 2.46 0.23 -4.96 115.29 111.85 1wfc s HIS 312 Ca 0.00 0.70 0.03 0.00 0.47 0.00 0.00 55.06 56.25 1wfc s HIS 312 Cb 0.00 -3.93 0.09 0.00 -0.13 0.00 0.00 32.58 28.61 1wfc s HIS 312 CO 0.00 -3.61 0.04 0.34 -2.47 0.00 0.00 174.74 169.04 1wfc s ASP 313 N 8.34 4.51 0.42 9.88 2.15 -1.26 -4.98 116.67 135.73 1wfc s ASP 313 Ca 0.95 -1.91 0.22 0.00 0.43 0.00 0.00 52.55 52.24 1wfc s ASP 313 Cb -0.28 -1.42 1.18 0.00 -0.30 0.00 0.00 42.92 42.10 1wfc s ASP 313 CO 0.33 -0.36 1.62 1.55 -0.17 0.00 0.00 175.17 178.14 1wfc h PRO 314 N 7.76 0.00 -0.35 4.34 0.13 -1.97 0.34 132.00 142.25 1wfc h PRO 314 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1wfc h PRO 314 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1wfc h PRO 314 CO 0.50 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.02 1wfc n ASP 315 N -2.37 3.24 -2.46 1.44 8.00 -1.26 -4.16 116.55 118.98 1wfc n ASP 315 Ca -0.01 -1.93 -0.18 0.00 0.71 0.00 0.00 54.79 53.38 1wfc n ASP 315 Cb 0.23 -0.22 0.02 0.00 -0.02 0.00 0.00 41.12 41.13 1wfc n ASP 315 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1wfc n ASP 316 N 1.28 3.50 -3.28 -2.24 2.03 0.12 -4.88 116.55 113.07 1wfc n ASP 316 Ca 0.17 -3.21 -0.25 0.00 0.52 0.00 0.00 54.79 52.02 1wfc n ASP 316 Cb 0.55 -0.45 -0.08 0.00 -0.72 0.00 0.00 41.12 40.42 1wfc n ASP 316 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1wfc n GLU 317 N -0.47 0.79 -1.77 -0.67 1.02 -1.21 -4.85 120.64 113.48 1wfc n GLU 317 Ca 0.28 -3.39 -0.32 0.00 -0.02 0.00 0.00 57.16 53.72 1wfc n GLU 317 Cb 0.80 -1.46 0.03 0.00 -0.02 0.00 0.00 31.44 30.80 1wfc n GLU 317 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1wfc s PRO 318 N -1.01 3.11 0.36 3.49 0.04 -1.26 -4.94 135.00 134.78 1wfc s PRO 318 Ca 0.35 1.05 0.08 0.00 0.04 0.00 0.00 61.00 62.51 1wfc s PRO 318 Cb 0.13 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.63 1wfc s PRO 318 CO -0.12 -0.97 0.31 0.14 0.04 0.00 0.00 177.00 176.39 1wfc s VAL 319 N -2.80 3.30 0.38 -0.36 -7.23 -1.26 -4.03 120.40 108.40 1wfc s VAL 319 Ca 0.60 -1.38 -0.01 0.00 -1.81 0.00 0.00 61.98 59.39 1wfc s VAL 319 Cb -0.15 -3.13 -0.03 0.00 0.56 0.00 0.00 36.38 33.63 1wfc s VAL 319 CO 0.47 -0.13 0.60 0.00 -0.31 0.00 0.00 175.10 175.74 1wfc s ALA 320 N -2.35 3.64 0.55 1.32 0.00 -1.26 -5.01 121.76 118.64 1wfc s ALA 320 Ca 0.43 -0.83 -0.20 0.00 0.00 0.00 0.00 51.96 51.36 1wfc s ALA 320 Cb -0.05 -2.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.80 1wfc s ALA 320 CO 0.27 -0.11 1.19 -0.51 0.00 0.00 0.00 175.76 176.60 1wfc s ASP 321 N -4.06 5.53 0.23 0.00 1.01 -1.26 -4.71 116.67 113.41 1wfc s ASP 321 Ca 0.42 2.36 -0.30 0.00 0.71 0.00 0.00 52.55 55.73 1wfc s ASP 321 Cb -0.10 -2.60 -0.15 0.00 1.01 0.00 0.00 42.92 41.08 1wfc s ASP 321 CO 0.38 -1.36 1.03 -2.65 0.21 0.00 0.00 175.17 172.78 1wfc n PRO 322 N -1.24 1.14 -3.94 8.23 -0.02 -1.26 -4.71 135.00 133.21 1wfc n PRO 322 Ca 0.12 0.40 -0.35 0.00 -2.02 0.00 0.00 63.50 61.65 1wfc n PRO 322 Cb 0.49 -1.79 -0.14 0.00 -0.02 0.00 0.00 33.50 32.04 1wfc n PRO 322 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1wfc s TYR 323 N -0.70 3.02 -0.52 6.00 5.04 -1.26 -5.06 117.35 123.88 1wfc s TYR 323 Ca 0.65 -1.34 -0.24 0.00 -2.44 0.00 0.00 57.07 53.70 1wfc s TYR 323 Cb -0.79 -2.08 0.04 0.00 0.35 0.00 0.00 41.96 39.48 1wfc s TYR 323 CO 0.56 -0.67 0.90 0.34 -1.34 0.00 0.00 175.55 175.34 1wfc s ASP 324 N 1.38 6.37 -0.46 4.32 -1.08 -1.26 -4.90 116.67 121.04 1wfc s ASP 324 Ca 0.02 -0.26 0.04 0.00 -0.52 0.00 0.00 52.55 51.83 1wfc s ASP 324 Cb -0.16 -2.42 0.52 0.00 -1.46 0.00 0.00 42.92 39.40 1wfc s ASP 324 CO -0.04 -1.13 1.73 0.00 0.52 0.00 0.00 175.17 176.25 1wfc n GLN 325 N 7.23 2.53 0.20 4.34 10.64 -1.26 -4.66 117.38 136.39 1wfc n GLN 325 Ca 0.02 -3.35 0.11 0.00 -1.83 0.00 0.00 57.00 51.95 1wfc n GLN 325 Cb 0.48 -2.15 0.65 0.00 -0.86 0.00 0.00 30.24 28.36 1wfc n GLN 325 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1wfc h SER 326 N 1.55 0.01 -0.51 2.61 4.64 -2.01 -0.10 113.55 119.73 1wfc h SER 326 Ca 0.48 -0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.95 1wfc h SER 326 Cb 1.64 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.71 1wfc h SER 326 CO 1.05 0.00 0.42 2.19 -0.87 0.00 0.00 176.83 179.62 1wfc h PHE 327 N 0.01 0.00 -0.05 4.77 -0.00 -1.96 -0.29 116.94 119.42 1wfc h PHE 327 Ca 0.06 0.00 0.01 0.00 -0.00 0.00 0.00 57.97 58.04 1wfc h PHE 327 Cb 0.24 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.19 1wfc h PHE 327 CO -0.00 0.00 0.05 0.93 -0.00 0.00 0.00 178.31 179.29 1wfc h GLU 328 N 0.00 0.00 -0.55 6.09 4.39 -1.39 0.21 114.58 123.33 1wfc h GLU 328 Ca 0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.94 1wfc h GLU 328 Cb 1.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 1wfc h GLU 328 CO -0.00 0.00 0.00 0.43 -1.16 0.00 0.00 179.01 178.28 1wfc n SER 329 N -3.91 2.64 -4.46 1.42 7.64 -0.12 -4.92 113.62 111.91 1wfc n SER 329 Ca -0.02 -2.20 -0.33 0.00 1.01 0.00 0.00 58.87 57.33 1wfc n SER 329 Cb 0.14 -0.40 -0.13 0.00 -1.01 0.00 0.00 64.21 62.82 1wfc n SER 329 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1wfc s ARG 330 N -1.66 2.93 -0.18 1.43 3.52 0.73 -5.07 118.95 120.65 1wfc s ARG 330 Ca 0.27 -0.65 -0.09 0.00 -0.13 0.00 0.00 55.73 55.13 1wfc s ARG 330 Cb 0.17 -2.54 -0.05 0.00 -1.56 0.00 0.00 34.95 30.97 1wfc s ARG 330 CO 0.14 0.47 0.12 -0.51 -0.81 0.00 0.00 175.30 174.71 1wfc s ASP 331 N -0.31 6.13 0.08 -2.12 1.01 -1.26 -5.04 116.67 115.16 1wfc s ASP 331 Ca 0.03 0.24 -0.14 0.00 0.71 0.00 0.00 52.55 53.39 1wfc s ASP 331 Cb -0.13 -2.06 0.02 0.00 1.01 0.00 0.00 42.92 41.77 1wfc s ASP 331 CO 0.03 0.22 0.32 -0.76 0.21 0.00 0.00 175.17 175.18 1wfc s LEU 332 N 0.14 0.82 0.56 1.23 1.43 -1.26 -5.15 118.68 116.45 1wfc s LEU 332 Ca 0.08 -0.31 -0.15 0.00 -1.03 0.00 0.00 54.13 52.73 1wfc s LEU 332 Cb -0.11 1.45 -0.06 0.00 0.03 0.00 0.00 46.19 47.50 1wfc s LEU 332 CO -0.01 -0.71 1.01 -0.76 0.23 0.00 0.00 176.35 176.12 1wfc s LEU 333 N -2.43 3.50 0.15 1.79 1.43 -1.26 -4.85 118.68 117.01 1wfc s LEU 333 Ca -0.01 1.60 -0.20 0.00 -1.03 0.00 0.00 54.13 54.50 1wfc s LEU 333 Cb 0.01 -4.51 0.05 0.00 0.03 0.00 0.00 46.19 41.77 1wfc s LEU 333 CO -0.07 -0.81 1.21 -0.38 0.23 0.00 0.00 176.35 176.53 1wfc n ILE 334 N -1.96 -0.48 0.30 -0.59 5.41 -1.26 -0.54 119.36 120.24 1wfc n ILE 334 Ca 0.07 1.87 0.14 0.00 1.00 0.00 0.00 62.75 65.83 1wfc n ILE 334 Cb 0.54 -2.37 0.64 0.00 -0.71 0.00 0.00 39.64 37.73 1wfc n ILE 334 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 1wfc h ASP 335 N 0.00 0.00 0.10 4.38 5.19 -1.95 0.23 116.42 124.38 1wfc h ASP 335 Ca 0.19 0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 56.43 1wfc h ASP 335 Cb 0.38 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.90 1wfc h ASP 335 CO -0.75 0.00 -0.80 -0.33 -3.12 0.00 0.00 179.24 174.23 1wfc h GLU 336 N 0.00 0.21 -0.39 3.56 5.08 -1.18 -2.46 114.58 119.41 1wfc h GLU 336 Ca 0.00 -0.36 0.04 0.00 -1.00 0.00 0.00 59.36 58.04 1wfc h GLU 336 Cb 0.25 0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1wfc h GLU 336 CO 0.00 1.17 0.15 -1.49 -1.00 0.00 0.00 179.01 177.85 1wfc h TRP 337 N -0.52 0.27 -1.00 4.33 -0.00 -0.60 -0.11 115.95 118.33 1wfc h TRP 337 Ca -0.16 0.02 0.13 0.00 -0.00 0.00 0.00 58.89 58.88 1wfc h TRP 337 Cb 1.52 -0.07 -0.09 0.00 -0.00 0.00 0.00 29.16 30.53 1wfc h TRP 337 CO 0.19 0.12 0.62 -0.22 -0.00 0.00 0.00 178.44 179.16 1wfc h LYS 338 N 0.32 0.92 -0.09 0.49 3.64 -0.69 0.82 116.57 121.98 1wfc h LYS 338 Ca 0.18 -0.06 -0.24 0.00 -1.27 0.00 0.00 60.65 59.26 1wfc h LYS 338 Cb 0.14 -0.21 0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1wfc h LYS 338 CO -0.16 0.61 -0.89 1.03 -2.27 0.00 0.00 179.45 177.77 1wfc h SER 339 N 0.95 0.92 -0.54 4.20 0.87 -0.78 0.56 113.55 119.73 1wfc h SER 339 Ca 0.51 -0.66 0.03 0.00 -1.23 0.00 0.00 61.79 60.44 1wfc h SER 339 Cb 0.56 -0.28 -0.04 0.00 -0.44 0.00 0.00 62.40 62.20 1wfc h SER 339 CO -0.29 1.46 0.32 -0.07 -0.53 0.00 0.00 176.83 177.72 1wfc h LEU 340 N 0.48 0.50 -0.22 2.23 3.38 -0.58 0.21 115.31 121.31 1wfc h LEU 340 Ca -0.08 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.90 1wfc h LEU 340 Cb 1.52 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 1wfc h LEU 340 CO 0.18 0.35 0.12 0.74 0.09 0.00 0.00 178.44 179.92 1wfc h THR 341 N 0.62 1.02 -0.74 0.22 2.02 -0.52 -1.43 112.91 114.10 1wfc h THR 341 Ca 0.22 -0.09 0.11 0.00 0.77 0.00 0.00 66.41 67.42 1wfc h THR 341 Cb 0.05 0.74 -0.08 0.00 -1.74 0.00 0.00 68.15 67.12 1wfc h THR 341 CO -0.11 0.05 0.36 0.22 0.37 0.00 0.00 175.52 176.41 1wfc h TYR 342 N 0.25 0.63 -0.61 3.16 3.20 -0.50 0.64 116.97 123.75 1wfc h TYR 342 Ca 0.08 0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.06 1wfc h TYR 342 Cb -0.00 -0.17 -0.06 0.00 1.54 0.00 0.00 36.73 38.04 1wfc h TYR 342 CO -0.08 0.20 0.29 -0.44 -1.64 0.00 0.00 178.16 176.49 1wfc h ASP 343 N 0.58 0.39 0.17 -2.11 5.19 -0.58 -1.23 116.42 118.83 1wfc h ASP 343 Ca 0.37 0.05 -0.13 0.00 -0.62 0.00 0.00 57.03 56.70 1wfc h ASP 343 Cb 0.44 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.93 1wfc h ASP 343 CO -0.30 0.25 -0.48 -0.33 -3.12 0.00 0.00 179.24 175.25 1wfc h GLU 344 N 0.54 0.36 0.26 3.56 4.39 -0.15 -2.10 114.58 121.45 1wfc h GLU 344 Ca 0.29 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 59.78 1wfc h GLU 344 Cb 0.26 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 1wfc h GLU 344 CO -0.23 0.77 -0.23 0.28 -1.16 0.00 0.00 179.01 178.45 1wfc h VAL 345 N 0.29 0.51 0.00 3.13 2.07 -0.42 -3.16 116.25 118.68 1wfc h VAL 345 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1wfc h VAL 345 Cb 0.95 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1wfc h VAL 345 CO 0.08 0.00 0.00 0.16 0.02 0.00 0.00 177.57 177.83 1wfc h ILE 346 N -0.51 0.00 -0.01 4.57 3.07 -1.04 -2.47 117.51 121.11 1wfc h ILE 346 Ca -0.01 -0.72 0.00 0.00 1.55 0.00 0.00 64.86 65.68 1wfc h ILE 346 Cb 0.46 1.70 0.00 0.00 -0.27 0.00 0.00 36.82 38.70 1wfc h ILE 346 CO -0.03 0.00 -0.02 -1.54 -1.05 0.00 0.00 178.15 175.51 1wfc n SER 347 N -2.81 0.75 -4.60 2.16 3.41 -0.81 -4.89 113.62 106.83 1wfc n SER 347 Ca 0.04 -1.15 -0.46 0.00 -0.26 0.00 0.00 58.87 57.03 1wfc n SER 347 Cb 0.44 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.34 1wfc n SER 347 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1wfc n PHE 348 N -0.47 2.09 -3.25 7.33 7.35 -0.93 -4.92 117.46 124.65 1wfc n PHE 348 Ca 0.20 -0.05 -0.39 0.00 -0.76 0.00 0.00 57.45 56.45 1wfc n PHE 348 Cb 0.25 -2.68 -0.07 0.00 0.35 0.00 0.00 39.48 37.33 1wfc n PHE 348 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1wfc s VAL 349 N 6.26 5.10 0.69 -2.13 1.01 -1.26 -5.04 120.40 125.02 1wfc s VAL 349 Ca 0.98 0.93 -0.17 0.00 0.00 0.00 0.00 61.98 63.73 1wfc s VAL 349 Cb -0.57 -3.83 0.01 0.00 0.00 0.00 0.00 36.38 31.99 1wfc s VAL 349 CO 0.44 0.16 1.15 -2.65 0.00 0.00 0.00 175.10 174.20 1wfc n PRO 350 N 4.97 0.76 0.00 2.72 -0.02 -1.26 -5.06 135.00 137.10 1wfc n PRO 350 Ca -0.05 0.32 0.03 0.00 -2.02 0.00 0.00 63.50 61.78 1wfc n PRO 350 Cb 0.50 -2.39 0.15 0.00 -0.02 0.00 0.00 33.50 31.74 1wfc n PRO 350 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13