#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m4p s PRO 12 N 0.00 4.14 -0.74 -2.82 0.04 -1.26 -4.99 135.00 129.37 3m4p s PRO 12 Ca 0.00 0.83 -0.20 0.00 0.04 0.00 0.00 61.00 61.67 3m4p s PRO 12 Cb 0.00 -3.66 0.10 0.00 0.04 0.00 0.00 34.50 30.98 3m4p s PRO 12 CO 0.00 -0.53 0.96 0.42 0.04 0.00 0.00 177.00 177.88 3m4p s ILE 13 N 2.82 4.61 0.52 0.56 1.01 -1.26 -5.03 121.20 124.43 3m4p s ILE 13 Ca 0.33 -0.98 -0.21 0.00 0.00 0.00 0.00 60.65 59.80 3m4p s ILE 13 Cb -0.15 -4.67 -0.06 0.00 0.01 0.00 0.00 42.46 37.59 3m4p s ILE 13 CO 0.08 -1.39 1.17 -0.69 0.00 0.00 0.00 174.94 174.11 3m4p s VAL 14 N 3.18 2.98 0.10 2.92 1.01 -1.26 -4.99 120.40 124.33 3m4p s VAL 14 Ca 0.23 0.66 -0.24 0.00 0.00 0.00 0.00 61.98 62.64 3m4p s VAL 14 Cb -0.14 -3.30 -0.07 0.00 0.00 0.00 0.00 36.38 32.87 3m4p s VAL 14 CO 0.02 -0.08 0.72 0.00 0.00 0.00 0.00 175.10 175.76 3m4p s ASN 16 N -0.73 5.46 0.26 0.00 -0.87 -1.26 0.41 114.94 118.21 3m4p s ASN 16 Ca 0.35 -0.21 -0.11 0.00 -1.57 0.00 0.00 52.86 51.32 3m4p s ASN 16 Cb -0.21 -1.99 -0.00 0.00 -0.02 0.00 0.00 41.25 39.02 3m4p s ASN 16 CO 0.23 -0.07 0.47 0.27 -2.57 0.00 0.00 177.10 175.43 3m4p s ILE 17 N 1.66 0.00 0.17 0.60 -4.36 -1.06 -4.98 121.20 113.22 3m4p s ILE 17 Ca 0.06 -1.45 -0.01 0.00 -0.26 0.00 0.00 60.65 58.99 3m4p s ILE 17 Cb -0.16 -2.30 0.03 0.00 1.25 0.00 0.00 42.46 41.29 3m4p s ILE 17 CO 0.06 0.00 0.23 -2.11 0.24 0.00 0.00 174.94 173.36 3m4p n ARG 18 N -0.40 0.35 0.07 0.37 1.85 -1.26 -4.51 116.66 113.13 3m4p n ARG 18 Ca -0.01 -0.57 -0.19 0.00 -1.00 0.00 0.00 57.85 56.07 3m4p n ARG 18 Cb 0.62 -0.17 -0.15 0.00 -1.05 0.00 0.00 32.46 31.72 3m4p n ARG 18 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 3m4p h ASP 19 N -0.17 0.50 0.13 2.89 3.32 -1.93 -3.33 116.42 117.83 3m4p h ASP 19 Ca -0.08 -0.69 -0.01 0.00 0.02 0.00 0.00 57.03 56.28 3m4p h ASP 19 Cb 0.27 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 3m4p h ASP 19 CO 0.08 1.57 -0.03 0.00 -1.72 0.00 0.00 179.24 179.14 3m4p h ALA 20 N 0.35 1.28 -0.02 3.45 0.00 -1.95 -1.17 119.26 121.21 3m4p h ALA 20 Ca -0.27 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3m4p h ALA 20 Cb 2.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.84 3m4p h ALA 20 CO 0.18 0.03 -0.07 0.00 0.00 0.00 0.00 179.25 179.39 3m4p n ALA 21 N -2.23 2.66 -2.55 0.00 0.00 -1.25 -4.90 120.51 112.24 3m4p n ALA 21 Ca -0.03 -0.56 -0.43 0.00 0.00 0.00 0.00 53.44 52.43 3m4p n ALA 21 Cb 0.12 -0.98 -0.06 0.00 0.00 0.00 0.00 19.45 18.53 3m4p n ALA 21 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3m4p s GLY 22 N -2.09 1.66 -0.48 0.00 0.00 -0.44 -4.91 107.32 101.05 3m4p s GLY 22 Ca 0.31 -0.92 0.06 0.00 0.00 0.00 0.00 44.72 44.17 3m4p s GLY 22 CO 0.36 1.68 0.79 1.04 0.00 0.00 0.00 173.10 176.97 3m4p n LEU 23 N 6.44 -2.64 -4.18 0.66 4.77 -1.26 -4.93 117.00 115.86 3m4p n LEU 23 Ca 0.01 -3.39 -0.15 0.00 -0.03 0.00 0.00 56.01 52.45 3m4p n LEU 23 Cb 0.48 0.79 -0.07 0.00 -2.33 0.00 0.00 43.42 42.28 3m4p n LEU 23 CO 0.55 1.99 -0.06 -1.61 -1.33 0.00 0.00 177.39 176.92 3m4p s GLU 24 N 0.53 1.58 -0.15 3.23 2.02 -1.26 -5.05 118.70 119.61 3m4p s GLU 24 Ca 0.32 -1.74 0.15 0.00 0.02 0.00 0.00 54.97 53.72 3m4p s GLU 24 Cb 0.16 0.35 0.33 0.00 0.10 0.00 0.00 34.13 35.07 3m4p s GLU 24 CO -0.18 -0.60 1.17 0.41 0.02 0.00 0.00 175.26 176.08 3m4p n GLY 25 N -0.46 4.59 3.79 -1.39 0.00 -1.26 -4.76 105.19 105.69 3m4p n GLY 25 Ca 0.03 -1.13 -0.27 0.00 0.00 0.00 0.00 46.02 44.65 3m4p n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m4p s LYS 26 N -2.74 2.21 0.32 1.61 0.00 -1.26 -4.67 119.74 115.21 3m4p s LYS 26 Ca 0.32 -2.05 -0.29 0.00 0.00 0.00 0.00 55.97 53.95 3m4p s LYS 26 Cb 0.30 -1.88 -0.10 0.00 0.00 0.00 0.00 37.83 36.15 3m4p s LYS 26 CO -0.02 -0.32 1.31 -0.48 0.00 0.00 0.00 175.35 175.84 3m4p s LEU 27 N -4.00 4.43 -0.04 2.77 0.05 -1.26 -3.43 118.68 117.19 3m4p s LEU 27 Ca 0.29 2.66 -0.06 0.00 0.05 0.00 0.00 54.13 57.08 3m4p s LEU 27 Cb 0.02 -3.65 0.01 0.00 -2.05 0.00 0.00 46.19 40.52 3m4p s LEU 27 CO 0.17 -0.53 0.15 -0.69 -0.55 0.00 0.00 176.35 174.90 3m4p s VAL 28 N -1.03 0.02 -0.21 1.48 1.01 -0.02 -3.17 120.40 118.48 3m4p s VAL 28 Ca 0.50 -0.18 -0.03 0.00 0.00 0.00 0.00 61.98 62.27 3m4p s VAL 28 Cb -0.39 -0.27 -0.00 0.00 0.00 0.00 0.00 36.38 35.71 3m4p s VAL 28 CO 0.51 -0.10 -0.08 -0.89 0.00 0.00 0.00 175.10 174.55 3m4p s THR 29 N -0.29 3.08 0.04 3.92 2.01 0.16 -0.92 115.64 123.65 3m4p s THR 29 Ca -0.04 -0.59 0.02 0.00 0.31 0.00 0.00 61.69 61.39 3m4p s THR 29 Cb -0.03 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 3m4p s THR 29 CO 0.01 0.45 0.07 -0.36 -0.69 0.00 0.00 174.62 174.09 3m4p s PHE 30 N 1.41 3.20 -0.05 4.92 0.08 0.13 -2.57 117.98 125.10 3m4p s PHE 30 Ca 0.05 0.12 0.06 0.00 0.12 0.00 0.00 56.93 57.28 3m4p s PHE 30 Cb -0.14 -1.67 -0.01 0.00 -0.57 0.00 0.00 43.02 40.63 3m4p s PHE 30 CO -0.05 0.52 -0.23 0.15 -0.10 0.00 0.00 175.22 175.51 3m4p s LYS 31 N -2.02 2.35 0.00 0.44 1.02 -1.26 -0.84 119.74 119.44 3m4p s LYS 31 Ca 0.25 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.41 3m4p s LYS 31 Cb -0.12 -2.00 0.00 0.00 -0.52 0.00 0.00 37.83 35.19 3m4p s LYS 31 CO 0.17 0.35 0.00 0.41 -0.92 0.00 0.00 175.35 175.36 3m4p n GLY 32 N 2.99 -0.60 3.44 -3.33 0.00 -0.87 -4.66 105.19 102.15 3m4p n GLY 32 Ca -0.18 -0.65 -0.27 0.00 0.00 0.00 0.00 46.02 44.93 3m4p n GLY 32 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3m4p s TRP 33 N -3.44 2.32 -1.01 1.61 0.51 0.15 0.22 118.94 119.29 3m4p s TRP 33 Ca 0.00 -0.35 -0.17 0.00 -2.12 0.00 0.00 56.10 53.46 3m4p s TRP 33 Cb 0.00 -1.14 0.15 0.00 -0.81 0.00 0.00 33.47 31.67 3m4p s TRP 33 CO 0.00 0.52 1.20 0.00 -0.51 0.00 0.00 176.95 178.16 3m4p s ALA 34 N -1.74 3.60 0.26 0.98 0.00 -0.01 -0.55 121.76 124.29 3m4p s ALA 34 Ca 0.22 -2.98 -0.04 0.00 0.00 0.00 0.00 51.96 49.16 3m4p s ALA 34 Cb -0.08 -4.05 0.35 0.00 0.00 0.00 0.00 23.12 19.34 3m4p s ALA 34 CO 0.11 -2.89 1.89 -0.92 0.00 0.00 0.00 175.76 173.95 3m4p h TYR 35 N 8.27 1.17 -2.77 0.00 3.20 -1.73 0.46 116.97 125.58 3m4p h TYR 35 Ca 0.20 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.99 3m4p h TYR 35 Cb 0.98 -0.39 -0.22 0.00 1.54 0.00 0.00 36.73 38.64 3m4p h TYR 35 CO 1.14 0.64 -0.20 -1.58 -1.64 0.00 0.00 178.16 176.52 3m4p s HIS 36 N -6.07 -0.37 -0.06 -3.82 2.46 -1.24 -4.64 115.29 101.55 3m4p s HIS 36 Ca -0.13 0.78 -0.01 0.00 0.47 0.00 0.00 55.06 56.18 3m4p s HIS 36 Cb 0.19 0.16 0.03 0.00 -0.13 0.00 0.00 32.58 32.83 3m4p s HIS 36 CO 0.81 -0.33 -0.01 0.42 -2.47 0.00 0.00 174.74 173.16 3m4p s ILE 37 N -0.56 0.38 -0.38 0.89 1.01 -1.26 -2.11 121.20 119.17 3m4p s ILE 37 Ca -0.07 0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.65 3m4p s ILE 37 Cb -0.04 -0.51 0.11 0.00 0.01 0.00 0.00 42.46 42.03 3m4p s ILE 37 CO 0.03 0.24 0.15 -0.60 0.00 0.00 0.00 174.94 174.76 3m4p s ARG 38 N 1.67 1.83 -1.31 2.79 3.52 -0.79 -5.01 118.95 121.64 3m4p s ARG 38 Ca 0.00 -1.84 -0.16 0.00 -0.13 0.00 0.00 55.73 53.61 3m4p s ARG 38 Cb -0.13 -3.45 0.09 0.00 -1.56 0.00 0.00 34.95 29.90 3m4p s ARG 38 CO -0.04 -1.02 1.78 1.63 -0.81 0.00 0.00 175.30 176.84 3m4p n LYS 39 N 4.48 3.20 -0.18 5.12 5.02 -1.26 -0.95 118.16 133.59 3m4p n LYS 39 Ca -0.00 -3.29 -0.09 0.00 -2.02 0.00 0.00 58.31 52.90 3m4p n LYS 39 Cb 0.42 -3.31 0.01 0.00 -0.02 0.00 0.00 35.03 32.12 3m4p n LYS 39 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3m4p h ALA 40 N 7.02 0.67 -2.25 7.82 0.00 -1.92 -3.45 119.26 127.14 3m4p h ALA 40 Ca 0.44 -0.24 -0.41 0.00 0.00 0.00 0.00 54.91 54.70 3m4p h ALA 40 Cb 0.81 -0.19 -0.14 0.00 0.00 0.00 0.00 17.79 18.26 3m4p h ALA 40 CO 1.51 0.42 -0.58 1.03 0.00 0.00 0.00 179.25 181.63 3m4p s ARG 41 N -5.18 1.58 0.14 0.00 0.52 -0.74 -5.03 118.95 110.24 3m4p s ARG 41 Ca -0.13 -1.89 -0.18 0.00 -0.52 0.00 0.00 55.73 53.01 3m4p s ARG 41 Cb 0.12 -0.27 0.00 0.00 0.52 0.00 0.00 34.95 35.32 3m4p s ARG 41 CO 0.81 -0.38 1.75 0.87 0.02 0.00 0.00 175.30 178.37 3m4p h LYS 42 N 2.22 0.22 -0.53 3.54 1.57 -2.01 -3.04 116.57 118.53 3m4p h LYS 42 Ca -0.36 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 3m4p h LYS 42 Cb 1.25 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.51 3m4p h LYS 42 CO 0.57 0.14 0.00 0.25 -0.57 0.00 0.00 179.45 179.84 3m4p n THR 43 N -5.03 1.12 -3.75 -0.16 -2.24 -1.26 -4.84 114.28 98.12 3m4p n THR 43 Ca -0.01 -1.05 -0.28 0.00 -2.27 0.00 0.00 64.05 60.44 3m4p n THR 43 Cb 0.10 0.44 -0.16 0.00 -2.10 0.00 0.00 70.33 68.60 3m4p n THR 43 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3m4p s LEU 44 N -1.14 1.27 -0.07 3.22 2.96 -1.15 -0.11 118.68 123.66 3m4p s LEU 44 Ca 0.37 -0.84 0.05 0.00 -0.22 0.00 0.00 54.13 53.49 3m4p s LEU 44 Cb 0.20 -0.64 -0.01 0.00 0.50 0.00 0.00 46.19 46.25 3m4p s LEU 44 CO 0.23 -0.30 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.10 3m4p s ILE 45 N 1.83 1.99 -0.16 6.68 1.01 -0.90 -1.78 121.20 129.86 3m4p s ILE 45 Ca -0.01 -1.01 -0.11 0.00 0.00 0.00 0.00 60.65 59.51 3m4p s ILE 45 Cb -0.17 -1.70 -0.05 0.00 0.01 0.00 0.00 42.46 40.55 3m4p s ILE 45 CO -0.08 0.55 0.21 -0.36 0.00 0.00 0.00 174.94 175.27 3m4p s PHE 46 N 0.06 3.49 -0.11 3.97 0.08 -0.13 -0.42 117.98 124.92 3m4p s PHE 46 Ca -0.10 0.51 -0.00 0.00 0.12 0.00 0.00 56.93 57.46 3m4p s PHE 46 Cb -0.15 -2.20 0.02 0.00 -0.57 0.00 0.00 43.02 40.12 3m4p s PHE 46 CO 0.06 0.38 -0.07 0.08 -0.10 0.00 0.00 175.22 175.56 3m4p s VAL 47 N 0.05 1.01 -0.55 -0.44 1.01 0.87 -1.89 120.40 120.46 3m4p s VAL 47 Ca 0.14 -0.28 -0.14 0.00 0.00 0.00 0.00 61.98 61.70 3m4p s VAL 47 Cb -0.12 -1.03 0.14 0.00 0.00 0.00 0.00 36.38 35.37 3m4p s VAL 47 CO 0.02 0.36 0.49 -1.61 0.00 0.00 0.00 175.10 174.37 3m4p s GLU 48 N 1.69 2.93 0.28 2.72 2.02 -0.90 0.86 118.70 128.31 3m4p s GLU 48 Ca 0.04 -1.80 -0.25 0.00 0.02 0.00 0.00 54.97 52.98 3m4p s GLU 48 Cb -0.13 -4.22 -0.09 0.00 0.10 0.00 0.00 34.13 29.79 3m4p s GLU 48 CO -0.08 -1.30 0.89 -1.17 0.02 0.00 0.00 175.26 173.62 3m4p s LEU 49 N 1.40 4.38 0.01 1.80 2.96 0.27 -2.00 118.68 127.51 3m4p s LEU 49 Ca 0.05 1.75 0.07 0.00 -0.22 0.00 0.00 54.13 55.78 3m4p s LEU 49 Cb -0.27 -3.85 -0.02 0.00 0.50 0.00 0.00 46.19 42.55 3m4p s LEU 49 CO 0.01 -0.01 -0.22 -0.60 -1.32 0.00 0.00 176.35 174.21 3m4p s ARG 50 N -1.91 1.61 0.00 1.98 3.52 0.29 -1.69 118.95 122.76 3m4p s ARG 50 Ca 0.47 -0.86 0.00 0.00 -0.13 0.00 0.00 55.73 55.20 3m4p s ARG 50 Cb -0.19 -1.64 0.00 0.00 -1.56 0.00 0.00 34.95 31.55 3m4p s ARG 50 CO 0.24 0.44 0.81 -0.40 -0.81 0.00 0.00 175.30 175.58 3m4p n ASP 51 N 2.21 0.00 0.00 -2.12 5.68 -1.22 0.30 116.55 121.41 3m4p n ASP 51 Ca -0.16 -1.66 0.00 0.00 -0.50 0.00 0.00 54.79 52.47 3m4p n ASP 51 Cb 0.53 -0.13 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 3m4p n ASP 51 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3m4p n GLY 52 N 0.00 2.74 0.12 6.12 0.00 -1.26 -4.77 105.19 108.14 3m4p n GLY 52 Ca 0.00 -0.15 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 3m4p n GLY 52 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3m4p h SER 53 N 0.00 0.46 0.00 1.61 0.02 -1.98 -3.50 113.55 110.15 3m4p h SER 53 Ca 0.00 -0.61 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 3m4p h SER 53 Cb 0.00 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.39 3m4p h SER 53 CO 0.00 1.50 0.00 0.61 -1.14 0.00 0.00 176.83 177.80 3m4p n GLY 54 N 1.68 1.81 3.16 -3.77 0.00 -1.26 -4.59 105.19 102.22 3m4p n GLY 54 Ca -0.17 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.69 3m4p n GLY 54 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3m4p s TYR 55 N 0.20 0.53 -0.24 1.61 2.02 -0.06 -3.43 117.35 117.98 3m4p s TYR 55 Ca 0.00 -0.98 -0.13 0.00 -0.37 0.00 0.00 57.07 55.58 3m4p s TYR 55 Cb 0.00 -0.31 0.08 0.00 -0.40 0.00 0.00 41.96 41.33 3m4p s TYR 55 CO 0.00 -0.49 0.59 0.00 -1.57 0.00 0.00 175.55 174.07 3m4p s GLN 57 N 1.66 4.04 -0.24 0.00 0.74 -1.26 -0.57 119.66 124.03 3m4p s GLN 57 Ca -0.09 1.09 -0.04 0.00 0.05 0.00 0.00 55.36 56.37 3m4p s GLN 57 Cb -0.07 -3.76 0.00 0.00 1.10 0.00 0.00 33.01 30.28 3m4p s GLN 57 CO -0.17 -0.94 -0.02 0.00 -0.55 0.00 0.00 175.29 173.60 3m4p s VAL 59 N 1.45 5.02 -0.54 0.00 -7.23 -0.42 -0.09 120.40 118.59 3m4p s VAL 59 Ca 0.04 0.40 0.05 0.00 -1.81 0.00 0.00 61.98 60.65 3m4p s VAL 59 Cb -0.15 -3.64 0.17 0.00 0.56 0.00 0.00 36.38 33.32 3m4p s VAL 59 CO -0.02 0.07 0.42 -0.38 -0.31 0.00 0.00 175.10 174.87 3m4p n ILE 60 N 0.25 0.06 -3.58 -0.62 5.41 0.44 -2.37 119.36 118.95 3m4p n ILE 60 Ca -0.03 -4.08 -0.36 0.00 1.00 0.00 0.00 62.75 59.28 3m4p n ILE 60 Cb 0.52 -1.89 -0.08 0.00 -0.71 0.00 0.00 39.64 37.48 3m4p n ILE 60 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 3m4p s PHE 61 N -0.66 3.41 0.00 1.39 0.08 -1.26 -2.12 117.98 118.82 3m4p s PHE 61 Ca 0.30 0.47 0.00 0.00 0.12 0.00 0.00 56.93 57.82 3m4p s PHE 61 Cb 0.01 -2.31 0.00 0.00 -0.57 0.00 0.00 43.02 40.15 3m4p s PHE 61 CO -0.18 0.18 0.00 0.41 -0.10 0.00 0.00 175.22 175.53 3m4p n GLY 62 N 3.66 4.29 0.13 4.36 0.00 0.85 -4.87 105.19 113.60 3m4p n GLY 62 Ca -0.13 -1.49 -0.09 0.00 0.00 0.00 0.00 46.02 44.31 3m4p n GLY 62 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3m4p h LYS 63 N 0.00 0.22 0.19 1.61 2.10 -1.94 -3.24 116.57 115.51 3m4p h LYS 63 Ca 0.00 -0.24 -0.32 0.00 -2.00 0.00 0.00 60.65 58.09 3m4p h LYS 63 Cb 0.00 0.07 0.02 0.00 -0.90 0.00 0.00 32.23 31.42 3m4p h LYS 63 CO 0.00 0.97 -1.46 1.49 -2.00 0.00 0.00 179.45 178.45 3m4p h GLU 64 N 0.12 0.40 0.00 0.07 4.81 -1.96 -3.27 114.58 114.75 3m4p h GLU 64 Ca -0.05 -0.68 0.00 0.00 -0.13 0.00 0.00 59.36 58.50 3m4p h GLU 64 Cb 1.52 0.25 0.00 0.00 0.63 0.00 0.00 28.75 31.15 3m4p h GLU 64 CO 0.14 1.31 0.00 -0.07 -0.73 0.00 0.00 179.01 179.66 3m4p h LEU 65 N 0.11 0.00 -4.49 1.64 3.38 -1.90 -3.27 115.31 110.78 3m4p h LEU 65 Ca -0.23 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.10 3m4p h LEU 65 Cb 2.08 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 42.46 3m4p h LEU 65 CO 0.23 0.00 -0.15 0.00 0.09 0.00 0.00 178.44 178.60 3m4p n GLU 67 N -0.56 2.47 -0.14 0.00 -0.58 -1.24 -4.89 120.64 115.70 3m4p n GLU 67 Ca 0.45 0.87 0.00 0.00 -0.42 0.00 0.00 57.16 58.07 3m4p n GLU 67 Cb 0.60 -2.57 0.27 0.00 -0.57 0.00 0.00 31.44 29.16 3m4p n GLU 67 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 3m4p h PRO 68 N 3.62 0.84 -0.27 3.49 0.13 -1.95 -2.43 132.00 135.42 3m4p h PRO 68 Ca -0.48 -0.08 -0.10 0.00 -0.87 0.00 0.00 66.00 64.48 3m4p h PRO 68 Cb 1.25 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 3m4p h PRO 68 CO 0.70 0.61 -0.23 0.93 -0.23 0.00 0.00 178.00 179.78 3m4p h GLU 69 N 0.85 0.52 -0.17 0.86 4.39 -2.02 -3.08 114.58 115.93 3m4p h GLU 69 Ca 0.22 -0.19 -0.18 0.00 0.34 0.00 0.00 59.36 59.55 3m4p h GLU 69 Cb 0.01 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.62 3m4p h GLU 69 CO -0.04 0.72 -0.62 0.87 -1.16 0.00 0.00 179.01 178.78 3m4p h LYS 70 N 0.46 0.58 -0.34 2.33 1.57 -1.82 -3.33 116.57 116.03 3m4p h LYS 70 Ca 0.07 -0.41 -0.08 0.00 -1.87 0.00 0.00 60.65 58.36 3m4p h LYS 70 Cb 0.66 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 3m4p h LYS 70 CO 0.05 1.02 -0.14 0.28 -0.57 0.00 0.00 179.45 180.09 3m4p h VAL 71 N 0.43 1.25 0.00 0.50 2.07 -1.42 -1.88 116.25 117.20 3m4p h VAL 71 Ca -0.01 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 66.39 3m4p h VAL 71 Cb 1.19 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 3m4p h VAL 71 CO 0.12 0.37 0.00 0.29 0.02 0.00 0.00 177.57 178.37 3m4p n LYS 72 N -4.17 0.08 -0.05 1.57 5.02 -1.22 -2.08 118.16 117.32 3m4p n LYS 72 Ca 0.01 0.21 0.02 0.00 -2.02 0.00 0.00 58.31 56.52 3m4p n LYS 72 Cb 0.35 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.71 3m4p n LYS 72 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3m4p n LEU 73 N -1.42 0.00 -4.56 -0.35 4.77 -0.79 -4.82 117.00 109.84 3m4p n LEU 73 Ca 0.05 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.66 3m4p n LEU 73 Cb 0.15 0.20 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 3m4p n LEU 73 CO 0.13 0.20 1.40 -0.22 -1.33 0.00 0.00 177.39 177.57 3m4p s LEU 74 N -4.83 3.30 0.46 2.23 2.96 -0.78 -4.66 118.68 117.36 3m4p s LEU 74 Ca -0.08 -0.72 0.03 0.00 -0.22 0.00 0.00 54.13 53.14 3m4p s LEU 74 Cb 0.10 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 44.19 3m4p s LEU 74 CO 0.81 -2.06 0.02 0.42 -1.32 0.00 0.00 176.35 174.22 3m4p s THR 75 N 7.20 1.39 0.16 3.68 -4.23 -1.26 -4.95 115.64 117.64 3m4p s THR 75 Ca 0.54 -2.00 -0.32 0.00 -1.18 0.00 0.00 61.69 58.73 3m4p s THR 75 Cb -0.06 -2.50 -0.10 0.00 1.34 0.00 0.00 72.50 71.19 3m4p s THR 75 CO 0.03 0.00 1.57 -0.60 -0.54 0.00 0.00 174.62 175.09 3m4p s ARG 76 N -3.81 4.21 0.00 3.99 3.52 -1.26 -2.99 118.95 122.61 3m4p s ARG 76 Ca 0.19 2.37 0.00 0.00 -0.13 0.00 0.00 55.73 58.15 3m4p s ARG 76 Cb 0.05 -3.17 0.00 0.00 -1.56 0.00 0.00 34.95 30.27 3m4p s ARG 76 CO 0.10 -0.61 0.00 -1.91 -0.81 0.00 0.00 175.30 172.06 3m4p n GLU 77 N 4.02 0.00 -1.96 5.12 4.07 0.16 -4.87 120.64 127.18 3m4p n GLU 77 Ca 0.14 0.11 -0.31 0.00 -0.06 0.00 0.00 57.16 57.04 3m4p n GLU 77 Cb 0.38 -2.94 0.00 0.00 -0.06 0.00 0.00 31.44 28.83 3m4p n GLU 77 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3m4p s SER 79 N -3.97 6.60 0.26 0.00 1.04 -0.87 -0.83 113.70 115.93 3m4p s SER 79 Ca 0.56 0.70 0.05 0.00 0.48 0.00 0.00 55.95 57.75 3m4p s SER 79 Cb -0.11 -2.20 -0.06 0.00 0.10 0.00 0.00 66.02 63.75 3m4p s SER 79 CO 0.50 0.22 -0.03 -0.76 0.98 0.00 0.00 173.24 174.14 3m4p s LEU 80 N -0.30 2.37 -0.26 2.42 1.43 0.13 -0.83 118.68 123.64 3m4p s LEU 80 Ca 0.20 -1.21 -0.00 0.00 -1.03 0.00 0.00 54.13 52.09 3m4p s LEU 80 Cb -0.14 -0.50 0.08 0.00 0.03 0.00 0.00 46.19 45.66 3m4p s LEU 80 CO 0.08 -0.42 0.03 -0.70 0.23 0.00 0.00 176.35 175.57 3m4p s GLU 81 N -3.78 1.12 -0.16 1.70 2.12 -0.43 -2.05 118.70 117.22 3m4p s GLU 81 Ca 0.29 -1.02 -0.03 0.00 0.36 0.00 0.00 54.97 54.58 3m4p s GLU 81 Cb 0.05 -2.38 -0.02 0.00 0.26 0.00 0.00 34.13 32.04 3m4p s GLU 81 CO 0.11 -0.78 -0.07 0.42 -0.54 0.00 0.00 175.26 174.41 3m4p s ILE 82 N 1.49 3.57 -0.13 -3.70 1.01 -0.02 -2.25 121.20 121.18 3m4p s ILE 82 Ca 0.02 -0.47 0.02 0.00 0.00 0.00 0.00 60.65 60.22 3m4p s ILE 82 Cb -0.18 -2.55 0.01 0.00 0.01 0.00 0.00 42.46 39.75 3m4p s ILE 82 CO -0.13 0.49 -0.19 -0.89 0.00 0.00 0.00 174.94 174.22 3m4p s THR 83 N 0.52 1.83 0.28 2.92 2.01 0.28 -0.70 115.64 122.79 3m4p s THR 83 Ca -0.05 -0.83 -0.19 0.00 0.31 0.00 0.00 61.69 60.93 3m4p s THR 83 Cb -0.15 -1.64 0.07 0.00 0.01 0.00 0.00 72.50 70.79 3m4p s THR 83 CO 0.03 0.50 0.93 -0.83 -0.69 0.00 0.00 174.62 174.57 3m4p s GLY 84 N 0.98 0.28 -0.15 4.40 0.00 -0.09 -0.67 107.32 112.07 3m4p s GLY 84 Ca -0.05 -0.58 -0.08 0.00 0.00 0.00 0.00 44.72 44.01 3m4p s GLY 84 CO -0.04 1.38 0.11 -1.60 0.00 0.00 0.00 173.10 172.96 3m4p s ARG 85 N -2.07 3.74 -0.45 2.90 3.52 -0.05 -0.84 118.95 125.69 3m4p s ARG 85 Ca 0.20 -0.22 -0.21 0.00 -0.13 0.00 0.00 55.73 55.37 3m4p s ARG 85 Cb -0.04 -3.23 0.03 0.00 -1.56 0.00 0.00 34.95 30.14 3m4p s ARG 85 CO 0.09 0.53 0.66 -0.51 -0.81 0.00 0.00 175.30 175.26 3m4p s LEU 86 N -0.32 4.49 0.48 -0.88 1.43 -1.22 -0.62 118.68 122.03 3m4p s LEU 86 Ca 0.11 -0.35 0.08 0.00 -1.03 0.00 0.00 54.13 52.94 3m4p s LEU 86 Cb -0.12 -2.74 0.04 0.00 0.03 0.00 0.00 46.19 43.40 3m4p s LEU 86 CO 0.01 -0.81 0.65 0.20 0.23 0.00 0.00 176.35 176.63 3m4p s ASN 87 N 2.07 5.45 0.55 2.29 -0.87 -0.16 -4.29 114.94 119.99 3m4p s ASN 87 Ca 0.23 -0.55 0.05 0.00 -1.57 0.00 0.00 52.86 51.02 3m4p s ASN 87 Cb -0.14 -0.35 0.06 0.00 -0.02 0.00 0.00 41.25 40.79 3m4p s ASN 87 CO 0.19 -0.97 0.76 0.00 -2.57 0.00 0.00 177.10 174.51 3m4p s ALA 88 N -2.47 4.23 -0.08 0.60 0.00 -1.26 -1.82 121.76 120.95 3m4p s ALA 88 Ca 0.57 -1.68 -0.13 0.00 0.00 0.00 0.00 51.96 50.72 3m4p s ALA 88 Cb -0.09 -1.80 -0.05 0.00 0.00 0.00 0.00 23.12 21.19 3m4p s ALA 88 CO 0.35 -0.77 0.32 0.71 0.00 0.00 0.00 175.76 176.38 3m4p s TYR 89 N -2.69 3.61 -0.74 0.00 2.02 -1.26 -4.74 117.35 113.55 3m4p s TYR 89 Ca 0.59 0.78 0.04 0.00 -0.37 0.00 0.00 57.07 58.11 3m4p s TYR 89 Cb -0.08 -2.25 0.23 0.00 -0.40 0.00 0.00 41.96 39.46 3m4p s TYR 89 CO 0.38 0.52 0.77 0.00 -1.57 0.00 0.00 175.55 175.65 3m4p n ALA 90 N 2.48 3.99 -0.47 3.71 0.00 -1.26 -5.00 120.51 123.96 3m4p n ALA 90 Ca -0.14 -4.69 0.00 0.00 0.00 0.00 0.00 53.44 48.60 3m4p n ALA 90 Cb 0.53 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.77 3m4p n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m4p n GLY 91 N 1.39 1.36 0.01 0.00 0.00 -1.26 -4.40 105.19 102.29 3m4p n GLY 91 Ca 0.26 0.34 -0.00 0.00 0.00 0.00 0.00 46.02 46.62 3m4p n GLY 91 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3m4p h LYS 92 N 0.00 -0.01 -6.77 1.61 5.09 -2.05 -3.41 116.57 111.03 3m4p h LYS 92 Ca 0.00 0.00 -0.51 0.00 0.09 0.00 0.00 60.65 60.23 3m4p h LYS 92 Cb 0.00 0.00 0.03 0.00 0.10 0.00 0.00 32.23 32.36 3m4p h LYS 92 CO 0.00 -0.00 0.55 0.54 -2.09 0.00 0.00 179.45 178.45 3m4p s ASN 93 N -2.62 7.07 0.08 7.07 4.22 -1.26 -5.04 114.94 124.46 3m4p s ASN 93 Ca -0.00 2.37 0.05 0.00 -2.14 0.00 0.00 52.86 53.14 3m4p s ASN 93 Cb 0.00 -2.62 -0.04 0.00 1.28 0.00 0.00 41.25 39.87 3m4p s ASN 93 CO 0.01 -0.33 -0.03 -1.00 -2.04 0.00 0.00 177.10 173.70 3m4p s HIS 94 N -0.73 2.92 0.68 1.54 3.76 -1.26 -4.51 115.29 117.70 3m4p s HIS 94 Ca 0.49 -0.06 -0.16 0.00 -0.15 0.00 0.00 55.06 55.18 3m4p s HIS 94 Cb -0.34 -1.52 0.01 0.00 1.11 0.00 0.00 32.58 31.84 3m4p s HIS 94 CO 0.42 0.46 1.20 -2.14 -0.85 0.00 0.00 174.74 173.83 3m4p s PRO 95 N -2.17 2.45 0.68 8.40 0.02 -1.26 -5.00 135.00 138.12 3m4p s PRO 95 Ca 0.24 1.74 -0.12 0.00 0.02 0.00 0.00 61.00 62.88 3m4p s PRO 95 Cb -0.11 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.54 3m4p s PRO 95 CO 0.16 -1.59 1.07 -1.25 -0.33 0.00 0.00 177.00 175.06 3m4p s PRO 96 N -3.76 2.91 -1.30 5.54 0.04 -1.26 -4.92 135.00 132.24 3m4p s PRO 96 Ca 0.75 1.08 -0.18 0.00 0.04 0.00 0.00 61.00 62.69 3m4p s PRO 96 Cb -0.29 -1.98 0.06 0.00 0.04 0.00 0.00 34.50 32.33 3m4p s PRO 96 CO 0.41 -1.13 1.78 -1.91 0.04 0.00 0.00 177.00 176.19 3m4p n GLU 97 N -2.87 3.10 -3.93 4.56 4.07 -1.26 -4.91 120.64 119.40 3m4p n GLU 97 Ca 0.08 -3.20 -0.10 0.00 -0.06 0.00 0.00 57.16 53.88 3m4p n GLU 97 Cb 0.53 -3.50 -0.12 0.00 -0.06 0.00 0.00 31.44 28.29 3m4p n GLU 97 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 3m4p s ILE 98 N 4.47 0.06 0.43 6.31 1.01 -1.26 -5.14 121.20 127.08 3m4p s ILE 98 Ca 0.54 -0.54 -0.23 0.00 0.00 0.00 0.00 60.65 60.42 3m4p s ILE 98 Cb 0.04 -0.16 -0.08 0.00 0.01 0.00 0.00 42.46 42.27 3m4p s ILE 98 CO 0.07 -0.29 1.09 0.00 0.00 0.00 0.00 174.94 175.81 3m4p s ALA 99 N -0.86 3.03 -1.67 9.38 0.00 -1.26 -3.33 121.76 127.04 3m4p s ALA 99 Ca -0.09 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.64 3m4p s ALA 99 Cb -0.06 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.75 3m4p s ALA 99 CO -0.01 -0.37 0.00 -0.25 0.00 0.00 0.00 175.76 175.14 3m4p n ASP 100 N -0.28 -5.14 -4.69 0.00 8.00 -1.26 -4.52 116.55 108.66 3m4p n ASP 100 Ca 0.06 0.17 -0.42 0.00 0.71 0.00 0.00 54.79 55.31 3m4p n ASP 100 Cb 0.49 -4.39 -0.03 0.00 -0.02 0.00 0.00 41.12 37.18 3m4p n ASP 100 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3m4p s ILE 101 N -2.80 4.15 0.14 0.53 1.10 -1.21 -0.89 121.20 122.23 3m4p s ILE 101 Ca 0.00 1.49 -0.31 0.00 -0.51 0.00 0.00 60.65 61.32 3m4p s ILE 101 Cb 0.00 -3.96 -0.10 0.00 0.15 0.00 0.00 42.46 38.55 3m4p s ILE 101 CO 0.00 -0.00 1.63 -0.22 -2.11 0.00 0.00 174.94 174.24 3m4p s LEU 102 N 2.23 4.37 0.00 8.50 2.96 0.85 -4.86 118.68 132.73 3m4p s LEU 102 Ca 0.57 2.62 -0.01 0.00 -0.22 0.00 0.00 54.13 57.09 3m4p s LEU 102 Cb -0.26 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.80 3m4p s LEU 102 CO 0.23 -0.87 2.13 -3.20 -1.32 0.00 0.00 176.35 173.32 3m4p n ASN 103 N 4.56 4.97 -3.67 3.68 2.85 -1.26 -4.66 115.26 121.73 3m4p n ASN 103 Ca 0.15 -2.33 -0.08 0.00 -0.11 0.00 0.00 54.58 52.21 3m4p n ASN 103 Cb 0.39 -1.10 -0.09 0.00 1.24 0.00 0.00 39.78 40.22 3m4p n ASN 103 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 3m4p s LEU 104 N 0.00 -0.53 0.54 1.20 1.43 -1.26 -4.70 118.68 115.36 3m4p s LEU 104 Ca 0.11 1.13 -0.10 0.00 -1.03 0.00 0.00 54.13 54.23 3m4p s LEU 104 Cb 0.05 1.68 -0.05 0.00 0.03 0.00 0.00 46.19 47.90 3m4p s LEU 104 CO 0.00 -0.22 0.93 -0.70 0.23 0.00 0.00 176.35 176.59 3m4p s GLU 105 N 1.92 3.65 -0.18 1.70 2.12 -0.76 -4.63 118.70 122.52 3m4p s GLU 105 Ca -0.07 0.60 0.01 0.00 0.36 0.00 0.00 54.97 55.87 3m4p s GLU 105 Cb -0.09 -2.20 0.03 0.00 0.26 0.00 0.00 34.13 32.13 3m4p s GLU 105 CO -0.15 -0.37 -0.15 1.41 -0.54 0.00 0.00 175.26 175.46 3m4p s MET 106 N -4.77 2.49 -0.59 4.30 -2.45 -0.97 -0.99 119.30 116.32 3m4p s MET 106 Ca 0.53 -0.82 -0.27 0.00 -1.25 0.00 0.00 55.69 53.88 3m4p s MET 106 Cb -0.11 -2.44 0.03 0.00 1.25 0.00 0.00 34.83 33.57 3m4p s MET 106 CO 0.46 -0.31 1.16 -0.65 1.05 0.00 0.00 175.02 176.73 3m4p s GLN 107 N 1.35 3.45 -0.02 4.11 -1.52 0.21 -1.30 119.66 125.94 3m4p s GLN 107 Ca 0.02 0.11 -0.30 0.00 -1.95 0.00 0.00 55.36 53.24 3m4p s GLN 107 Cb -0.14 -4.04 -0.05 0.00 -0.22 0.00 0.00 33.01 28.55 3m4p s GLN 107 CO -0.10 -1.70 1.43 0.08 -0.25 0.00 0.00 175.29 174.75 3m4p s VAL 108 N 4.88 3.72 -0.10 1.09 1.01 -1.00 -0.87 120.40 129.13 3m4p s VAL 108 Ca 0.40 1.06 -0.01 0.00 0.00 0.00 0.00 61.98 63.43 3m4p s VAL 108 Cb -0.08 -3.68 -0.25 0.00 0.00 0.00 0.00 36.38 32.36 3m4p s VAL 108 CO 0.23 -0.02 0.43 0.35 0.00 0.00 0.00 175.10 176.09 3m4p n THR 109 N 4.85 1.72 -3.54 3.92 -2.24 0.16 -4.88 114.28 114.28 3m4p n THR 109 Ca 0.14 -0.70 -0.15 0.00 -2.27 0.00 0.00 64.05 61.08 3m4p n THR 109 Cb 0.43 -1.51 -0.05 0.00 -2.10 0.00 0.00 70.33 67.10 3m4p n THR 109 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3m4p s GLU 110 N -2.57 1.07 0.09 -0.78 -1.05 -0.45 -5.01 118.70 110.00 3m4p s GLU 110 Ca -0.18 -0.14 -0.17 0.00 -0.15 0.00 0.00 54.97 54.34 3m4p s GLU 110 Cb 0.07 0.49 0.03 0.00 -0.44 0.00 0.00 34.13 34.29 3m4p s GLU 110 CO 0.78 -0.39 0.40 1.67 0.95 0.00 0.00 175.26 178.67 3m4p s TRP 111 N -2.28 -0.22 -0.19 4.83 1.48 -1.26 -0.55 118.94 120.75 3m4p s TRP 111 Ca -0.06 0.01 -0.11 0.00 -1.06 0.00 0.00 56.10 54.89 3m4p s TRP 111 Cb -0.01 0.23 0.06 0.00 -1.16 0.00 0.00 33.47 32.59 3m4p s TRP 111 CO -0.00 -0.64 0.45 0.21 -4.06 0.00 0.00 176.95 172.91 3m4p s LYS 112 N -3.24 0.45 0.03 3.25 2.20 -0.95 -5.01 119.74 116.45 3m4p s LYS 112 Ca -0.00 0.84 -0.30 0.00 -0.36 0.00 0.00 55.97 56.14 3m4p s LYS 112 Cb 0.01 0.02 -0.04 0.00 -1.51 0.00 0.00 37.83 36.30 3m4p s LYS 112 CO -0.08 -0.15 1.11 0.08 -0.36 0.00 0.00 175.35 175.95 3m4p s VAL 113 N 1.36 4.39 -0.24 4.02 1.01 -1.26 -1.32 120.40 128.36 3m4p s VAL 113 Ca -0.09 1.72 -0.17 0.00 0.00 0.00 0.00 61.98 63.44 3m4p s VAL 113 Cb -0.08 -4.10 -0.16 0.00 0.00 0.00 0.00 36.38 32.04 3m4p s VAL 113 CO -0.13 0.13 -0.06 -0.38 0.00 0.00 0.00 175.10 174.66 3m4p n ILE 114 N 3.95 1.54 -4.41 2.22 5.41 -0.01 -4.93 119.36 123.13 3m4p n ILE 114 Ca 0.08 -0.23 -0.25 0.00 1.00 0.00 0.00 62.75 63.35 3m4p n ILE 114 Cb 0.48 -1.94 -0.17 0.00 -0.71 0.00 0.00 39.64 37.31 3m4p n ILE 114 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 3m4p s GLY 115 N -5.23 0.81 0.94 7.39 0.00 -1.19 -5.01 107.32 105.03 3m4p s GLY 115 Ca -0.33 -0.45 -0.12 0.00 0.00 0.00 0.00 44.72 43.81 3m4p s GLY 115 CO 0.55 0.29 1.10 -0.54 0.00 0.00 0.00 173.10 174.50 3m4p s GLU 116 N 0.92 0.88 -0.38 2.90 2.02 -1.26 -2.05 118.70 121.73 3m4p s GLU 116 Ca -0.10 0.53 0.04 0.00 0.02 0.00 0.00 54.97 55.47 3m4p s GLU 116 Cb -0.15 -1.79 0.16 0.00 0.10 0.00 0.00 34.13 32.45 3m4p s GLU 116 CO 0.01 -2.43 0.43 0.45 0.02 0.00 0.00 175.26 173.74 3m4p s SER 117 N -3.62 0.54 0.63 -0.19 0.15 -1.26 -4.79 113.70 105.16 3m4p s SER 117 Ca 0.64 -1.38 -0.17 0.00 0.70 0.00 0.00 55.95 55.74 3m4p s SER 117 Cb -0.17 0.89 -0.08 0.00 -1.71 0.00 0.00 66.02 64.95 3m4p s SER 117 CO 0.56 -0.24 0.41 -2.65 1.20 0.00 0.00 173.24 172.52 3m4p n PRO 118 N 4.31 0.37 0.21 5.44 -0.02 -1.26 -4.69 135.00 139.36 3m4p n PRO 118 Ca 0.11 0.15 0.14 0.00 -2.02 0.00 0.00 63.50 61.88 3m4p n PRO 118 Cb 0.48 -1.65 0.47 0.00 -0.02 0.00 0.00 33.50 32.78 3m4p n PRO 118 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 3m4p h ILE 119 N -0.03 0.00 0.00 4.25 2.04 -2.00 -2.90 117.51 118.87 3m4p h ILE 119 Ca -0.45 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 64.82 3m4p h ILE 119 Cb 1.38 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.01 3m4p h ILE 119 CO 0.44 0.00 0.00 -0.90 0.00 0.00 0.00 178.15 177.69 3m4p n ASP 120 N -2.83 0.00 -0.23 1.72 5.68 -1.26 -1.54 116.55 118.08 3m4p n ASP 120 Ca 0.02 -0.27 -0.05 0.00 -0.50 0.00 0.00 54.79 53.99 3m4p n ASP 120 Cb 0.37 0.00 0.10 0.00 -1.14 0.00 0.00 41.12 40.45 3m4p n ASP 120 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 3m4p h LEU 121 N 0.00 1.00 -2.02 -2.12 5.85 -1.87 -3.16 115.31 112.99 3m4p h LEU 121 Ca 0.00 -0.18 0.09 0.00 0.84 0.00 0.00 57.88 58.63 3m4p h LEU 121 Cb 0.00 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 3m4p h LEU 121 CO 0.00 0.93 0.23 -0.33 -0.34 0.00 0.00 178.44 178.93 3m4p h GLU 122 N 1.04 0.00 -0.04 1.25 4.39 -1.56 -1.10 114.58 118.55 3m4p h GLU 122 Ca 0.23 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.81 3m4p h GLU 122 Cb 0.29 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 3m4p h GLU 122 CO -0.01 0.00 -0.53 -0.91 -1.16 0.00 0.00 179.01 176.40 3m4p h ASN 123 N 0.00 0.13 0.28 1.42 2.35 -1.75 -3.37 115.58 114.65 3m4p h ASN 123 Ca 0.14 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 3m4p h ASN 123 Cb 0.59 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.93 3m4p h ASN 123 CO -0.00 0.64 -0.14 0.40 -1.65 0.00 0.00 177.43 176.68 3m4p h ILE 124 N 0.09 0.75 -3.34 2.81 2.04 -1.30 -3.42 117.51 115.14 3m4p h ILE 124 Ca -0.00 -0.52 -0.59 0.00 1.00 0.00 0.00 64.86 64.74 3m4p h ILE 124 Cb 0.97 1.03 -0.34 0.00 -0.74 0.00 0.00 36.82 37.74 3m4p h ILE 124 CO 0.08 0.11 -0.84 -0.63 0.00 0.00 0.00 178.15 176.86 3m4p s ILE 125 N -4.92 1.57 0.39 -0.67 -1.09 -1.25 -4.89 121.20 110.34 3m4p s ILE 125 Ca -0.15 -0.72 -0.13 0.00 -2.23 0.00 0.00 60.65 57.43 3m4p s ILE 125 Cb 0.03 -1.40 0.05 0.00 -1.58 0.00 0.00 42.46 39.56 3m4p s ILE 125 CO 0.57 0.45 0.74 -0.46 -1.23 0.00 0.00 174.94 175.02 3m4p n ASN 126 N 3.84 -2.16 -0.29 3.58 0.23 -1.26 -4.79 115.26 114.41 3m4p n ASN 126 Ca -0.20 -2.64 -0.09 0.00 -0.53 0.00 0.00 54.58 51.11 3m4p n ASN 126 Cb 0.52 3.64 -0.06 0.00 -2.08 0.00 0.00 39.78 41.80 3m4p n ASN 126 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 3m4p h LYS 127 N 0.00 -0.15 -1.32 -3.83 2.10 -2.00 -2.84 116.57 108.54 3m4p h LYS 127 Ca -0.33 0.01 -0.36 0.00 -2.00 0.00 0.00 60.65 57.97 3m4p h LYS 127 Cb 1.23 0.03 -0.17 0.00 -0.90 0.00 0.00 32.23 32.43 3m4p h LYS 127 CO 0.42 -0.10 0.47 -0.25 -2.00 0.00 0.00 179.45 177.99 3m4p n ASP 128 N -5.36 5.87 -4.69 7.07 10.43 -1.26 -4.90 116.55 123.72 3m4p n ASP 128 Ca 0.02 -3.12 -0.36 0.00 2.57 0.00 0.00 54.79 53.90 3m4p n ASP 128 Cb 0.32 -0.96 -0.09 0.00 1.84 0.00 0.00 41.12 42.24 3m4p n ASP 128 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 3m4p s SER 129 N -0.21 6.10 0.83 -2.24 0.01 -1.07 -5.08 113.70 112.05 3m4p s SER 129 Ca 0.36 0.16 -0.11 0.00 1.31 0.00 0.00 55.95 57.67 3m4p s SER 129 Cb 0.29 -2.08 0.09 0.00 0.21 0.00 0.00 66.02 64.52 3m4p s SER 129 CO 0.01 0.13 1.10 -0.94 0.41 0.00 0.00 173.24 173.94 3m4p s SER 130 N 0.69 3.97 0.16 2.44 1.04 -1.26 -4.79 113.70 115.94 3m4p s SER 130 Ca 0.07 1.76 -0.16 0.00 0.48 0.00 0.00 55.95 58.11 3m4p s SER 130 Cb -0.12 -2.42 0.03 0.00 0.10 0.00 0.00 66.02 63.61 3m4p s SER 130 CO 0.01 -2.37 1.81 0.40 0.98 0.00 0.00 173.24 174.08 3m4p h ILE 131 N -1.36 1.09 -0.53 -1.02 2.04 -1.98 -0.81 117.51 114.95 3m4p h ILE 131 Ca -0.45 -0.19 0.08 0.00 1.00 0.00 0.00 64.86 65.30 3m4p h ILE 131 Cb 1.25 0.48 -0.07 0.00 -0.74 0.00 0.00 36.82 37.75 3m4p h ILE 131 CO 0.51 0.10 0.16 -0.65 0.00 0.00 0.00 178.15 178.27 3m4p h PRO 132 N 0.56 0.31 -0.94 2.37 0.11 -1.99 0.64 132.00 133.06 3m4p h PRO 132 Ca 0.16 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.28 3m4p h PRO 132 Cb -0.04 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 30.95 3m4p h PRO 132 CO -0.05 0.20 0.61 0.37 -0.21 0.00 0.00 178.00 178.93 3m4p h GLN 133 N 0.32 1.17 0.00 1.05 5.75 -1.84 0.19 115.11 121.76 3m4p h GLN 133 Ca 0.26 -0.07 -0.04 0.00 -0.15 0.00 0.00 58.65 58.65 3m4p h GLN 133 Cb 0.32 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 28.60 3m4p h GLN 133 CO -0.29 0.78 -0.18 0.87 -2.65 0.00 0.00 178.83 177.35 3m4p h LYS 134 N 1.21 0.00 0.08 1.69 1.57 -0.27 -1.40 116.57 119.45 3m4p h LYS 134 Ca 0.36 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.80 3m4p h LYS 134 Cb -0.05 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 3m4p h LYS 134 CO -0.11 0.18 -1.90 -1.33 -0.57 0.00 0.00 179.45 175.72 3m4p n MET 135 N -3.23 0.72 -0.07 3.15 2.81 0.13 -2.64 117.12 117.99 3m4p n MET 135 Ca 0.02 0.27 -0.07 0.00 -1.81 0.00 0.00 57.70 56.11 3m4p n MET 135 Cb 0.49 -1.74 -0.01 0.00 -0.71 0.00 0.00 33.22 31.26 3m4p n MET 135 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 3m4p h GLN 136 N 0.05 0.10 -1.05 0.03 5.75 -0.61 -3.01 115.11 116.37 3m4p h GLN 136 Ca -0.38 -0.01 -0.66 0.00 -0.15 0.00 0.00 58.65 57.45 3m4p h GLN 136 Cb 2.03 -0.02 -0.31 0.00 1.07 0.00 0.00 27.48 30.24 3m4p h GLN 136 CO 0.09 0.07 0.58 0.09 -2.65 0.00 0.00 178.83 177.00 3m4p n ASN 137 N -5.14 7.18 0.27 -0.69 3.02 -0.53 -4.48 115.26 114.89 3m4p n ASN 137 Ca -0.01 -3.79 0.13 0.00 -0.03 0.00 0.00 54.58 50.89 3m4p n ASN 137 Cb 0.14 -0.87 0.76 0.00 -0.61 0.00 0.00 39.78 39.20 3m4p n ASN 137 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 3m4p h ARG 138 N 2.12 0.00 -0.37 3.52 2.43 -1.36 -1.35 114.38 119.37 3m4p h ARG 138 Ca 0.56 0.00 0.08 0.00 -0.81 0.00 0.00 59.98 59.81 3m4p h ARG 138 Cb 0.87 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 3m4p h ARG 138 CO 1.43 0.10 0.26 1.12 -1.51 0.00 0.00 179.97 181.36 3m4p h HIS 139 N 0.00 0.13 0.23 2.20 2.07 -1.87 0.60 115.15 118.52 3m4p h HIS 139 Ca -0.00 0.00 -0.33 0.00 -2.85 0.00 0.00 60.37 57.19 3m4p h HIS 139 Cb 0.29 -0.04 0.04 0.00 2.57 0.00 0.00 27.41 30.26 3m4p h HIS 139 CO 0.00 0.07 -1.42 0.82 -3.07 0.00 0.00 177.93 174.32 3m4p h ILE 140 N 0.13 1.29 -0.51 6.12 1.08 -1.64 -3.34 117.51 120.63 3m4p h ILE 140 Ca 0.17 -2.65 -0.01 0.00 -0.39 0.00 0.00 64.86 61.98 3m4p h ILE 140 Cb 0.51 3.00 -0.03 0.00 -3.07 0.00 0.00 36.82 37.23 3m4p h ILE 140 CO -0.02 0.80 0.28 0.58 -0.69 0.00 0.00 178.15 179.10 3m4p h VAL 141 N 0.15 1.16 0.00 1.67 2.07 -1.09 -2.54 116.25 117.66 3m4p h VAL 141 Ca -0.24 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3m4p h VAL 141 Cb 2.12 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 3m4p h VAL 141 CO 0.27 0.17 0.00 2.30 0.02 0.00 0.00 177.57 180.33 3m4p n ILE 142 N -4.41 0.92 1.17 4.57 -5.35 0.12 -1.26 119.36 115.11 3m4p n ILE 142 Ca 0.04 0.26 0.14 0.00 -0.27 0.00 0.00 62.75 62.92 3m4p n ILE 142 Cb 0.09 -1.14 0.62 0.00 -1.74 0.00 0.00 39.64 37.48 3m4p n ILE 142 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3m4p n ARG 143 N -1.98 0.20 -2.25 6.28 1.74 -0.96 -3.47 116.66 116.22 3m4p n ARG 143 Ca 0.02 -0.03 -0.37 0.00 -0.77 0.00 0.00 57.85 56.71 3m4p n ARG 143 Cb 0.20 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.13 3m4p n ARG 143 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3m4p s SER 144 N -2.82 6.12 0.16 0.55 1.04 -0.39 -4.88 113.70 113.48 3m4p s SER 144 Ca 0.20 2.31 -0.24 0.00 0.48 0.00 0.00 55.95 58.69 3m4p s SER 144 Cb 0.19 -2.60 0.03 0.00 0.10 0.00 0.00 66.02 63.74 3m4p s SER 144 CO 0.52 -0.95 1.60 -0.08 0.98 0.00 0.00 173.24 175.31 3m4p h GLU 145 N 1.98 -0.29 -0.68 4.02 4.81 -1.89 -1.11 114.58 121.42 3m4p h GLU 145 Ca -0.49 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 3m4p h GLU 145 Cb 1.25 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.66 3m4p h GLU 145 CO 0.60 -0.20 0.43 1.25 -0.73 0.00 0.00 179.01 180.37 3m4p h HIS 146 N -0.30 0.87 -0.16 0.92 2.76 -1.93 0.08 115.15 117.39 3m4p h HIS 146 Ca 0.15 0.01 -0.22 0.00 -2.20 0.00 0.00 60.37 58.10 3m4p h HIS 146 Cb 0.55 -0.29 0.01 0.00 1.55 0.00 0.00 27.41 29.23 3m4p h HIS 146 CO -0.52 0.57 -0.77 1.15 -1.30 0.00 0.00 177.93 177.06 3m4p h THR 147 N 0.92 1.28 -0.36 6.26 2.02 -1.78 -2.10 112.91 119.16 3m4p h THR 147 Ca 0.25 -1.96 0.06 0.00 0.77 0.00 0.00 66.41 65.53 3m4p h THR 147 Cb -0.07 1.97 -0.06 0.00 -1.74 0.00 0.00 68.15 68.25 3m4p h THR 147 CO -0.05 0.62 0.01 -0.61 0.37 0.00 0.00 175.52 175.87 3m4p h GLN 148 N 0.54 0.11 -0.71 6.66 4.15 -0.92 -0.34 115.11 124.61 3m4p h GLN 148 Ca -0.05 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 3m4p h GLN 148 Cb 1.40 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 29.03 3m4p h GLN 148 CO 0.16 0.07 0.32 1.96 -1.93 0.00 0.00 178.83 179.41 3m4p h GLN 149 N 0.12 1.02 -0.47 1.69 1.08 -0.92 -1.07 115.11 116.56 3m4p h GLN 149 Ca 0.17 -0.15 -0.05 0.00 -1.45 0.00 0.00 58.65 57.17 3m4p h GLN 149 Cb 0.23 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.46 3m4p h GLN 149 CO -0.28 0.80 0.10 0.28 -0.95 0.00 0.00 178.83 178.79 3m4p h VAL 150 N 1.01 1.24 -0.18 -0.54 2.07 -0.79 0.36 116.25 119.42 3m4p h VAL 150 Ca 0.24 -0.85 -0.12 0.00 0.82 0.00 0.00 66.70 66.79 3m4p h VAL 150 Cb 0.14 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 3m4p h VAL 150 CO -0.03 0.30 -0.41 -0.07 0.02 0.00 0.00 177.57 177.38 3m4p h LEU 151 N 0.63 0.44 -0.10 2.57 3.38 -0.75 -0.61 115.31 120.85 3m4p h LEU 151 Ca 0.15 -0.19 -0.24 0.00 0.09 0.00 0.00 57.88 57.68 3m4p h LEU 151 Cb 0.34 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 40.98 3m4p h LEU 151 CO 0.00 0.80 -1.00 1.56 0.09 0.00 0.00 178.44 179.90 3m4p h GLN 152 N 0.34 0.47 -0.41 1.13 4.20 -1.06 -2.59 115.11 117.19 3m4p h GLN 152 Ca 0.03 -0.53 -0.10 0.00 0.06 0.00 0.00 58.65 58.11 3m4p h GLN 152 Cb 0.87 0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.79 3m4p h GLN 152 CO 0.07 1.17 -0.17 -0.07 -0.67 0.00 0.00 178.83 179.17 3m4p h LEU 153 N 0.26 0.78 -0.80 1.46 3.38 -0.86 -2.79 115.31 116.73 3m4p h LEU 153 Ca -0.10 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.64 3m4p h LEU 153 Cb 1.64 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 42.14 3m4p h LEU 153 CO 0.18 0.95 0.52 -0.09 0.09 0.00 0.00 178.44 180.08 3m4p h ARG 154 N 0.69 0.99 -0.48 1.13 2.43 -1.08 -0.74 114.38 117.33 3m4p h ARG 154 Ca 0.11 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.27 3m4p h ARG 154 Cb 0.66 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 29.94 3m4p h ARG 154 CO 0.05 0.65 0.20 1.03 -1.51 0.00 0.00 179.97 180.39 3m4p h SER 155 N 1.02 0.25 -0.53 -3.80 0.87 -1.28 -1.40 113.55 108.68 3m4p h SER 155 Ca 0.32 0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.88 3m4p h SER 155 Cb -0.02 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 3m4p h SER 155 CO -0.10 0.18 0.17 -0.33 -0.53 0.00 0.00 176.83 176.21 3m4p h GLU 156 N 0.40 0.82 -0.95 2.24 4.39 -1.16 -0.82 114.58 119.50 3m4p h GLU 156 Ca 0.22 -0.18 0.03 0.00 0.34 0.00 0.00 59.36 59.77 3m4p h GLU 156 Cb 0.19 -0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 28.66 3m4p h GLU 156 CO -0.19 0.75 0.62 0.82 -1.16 0.00 0.00 179.01 179.85 3m4p h ILE 157 N 0.73 1.18 -0.37 3.13 2.04 -0.80 -1.46 117.51 121.97 3m4p h ILE 157 Ca 0.17 -0.42 -0.10 0.00 1.00 0.00 0.00 64.86 65.52 3m4p h ILE 157 Cb 0.27 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.19 3m4p h ILE 157 CO -0.01 0.22 -0.18 1.56 0.00 0.00 0.00 178.15 179.75 3m4p h GLN 158 N 1.22 0.68 -0.72 2.37 4.20 -0.86 -2.43 115.11 119.58 3m4p h GLN 158 Ca 0.37 -0.24 0.01 0.00 0.06 0.00 0.00 58.65 58.85 3m4p h GLN 158 Cb -0.03 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.67 3m4p h GLN 158 CO -0.11 0.82 0.47 2.35 -0.67 0.00 0.00 178.83 181.68 3m4p h TRP 159 N 0.61 0.89 0.00 2.96 2.91 -0.30 -2.17 115.95 120.85 3m4p h TRP 159 Ca 0.10 0.02 -0.12 0.00 1.13 0.00 0.00 58.89 60.02 3m4p h TRP 159 Cb 0.64 -0.30 -0.02 0.00 -0.51 0.00 0.00 29.16 28.97 3m4p h TRP 159 CO 0.03 0.54 -0.56 1.88 -1.03 0.00 0.00 178.44 179.30 3m4p h TYR 160 N 0.95 0.00 0.08 2.65 0.05 -1.07 0.38 116.97 120.01 3m4p h TYR 160 Ca 0.27 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.05 3m4p h TYR 160 Cb -0.08 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.67 3m4p h TYR 160 CO -0.03 0.56 -0.04 0.74 -1.05 0.00 0.00 178.16 178.35 3m4p h PHE 161 N 0.00 -0.10 -0.33 4.88 0.04 -1.32 -2.00 116.94 118.11 3m4p h PHE 161 Ca -0.01 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3m4p h PHE 161 Cb 1.31 0.03 -0.02 0.00 2.20 0.00 0.00 35.95 39.48 3m4p h PHE 161 CO 0.00 0.17 0.21 0.00 -0.60 0.00 0.00 178.31 178.08 3m4p h ARG 162 N -0.37 0.44 -0.41 1.51 3.08 -1.17 -1.62 114.38 115.84 3m4p h ARG 162 Ca -0.01 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.88 3m4p h ARG 162 Cb 0.31 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3m4p h ARG 162 CO 0.02 0.30 -0.25 -0.22 -1.07 0.00 0.00 179.97 178.75 3m4p h LYS 163 N 0.45 0.84 -0.13 0.04 3.64 -0.83 -2.19 116.57 118.39 3m4p h LYS 163 Ca 0.12 -0.36 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 3m4p h LYS 163 Cb -0.03 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 3m4p h LYS 163 CO -0.02 1.00 0.07 -0.92 -2.27 0.00 0.00 179.45 177.31 3m4p h TYR 164 N 0.72 0.17 -0.22 1.91 3.20 -0.54 0.60 116.97 122.82 3m4p h TYR 164 Ca 0.09 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 3m4p h TYR 164 Cb 0.79 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.99 3m4p h TYR 164 CO 0.04 0.16 -0.01 1.88 -1.64 0.00 0.00 178.16 178.60 3m4p h TYR 165 N 0.13 0.33 -0.11 -3.82 0.05 -1.33 0.14 116.97 112.35 3m4p h TYR 165 Ca 0.05 -0.02 -0.15 0.00 0.05 0.00 0.00 58.73 58.66 3m4p h TYR 165 Cb 0.04 -0.10 0.01 0.00 1.01 0.00 0.00 36.73 37.69 3m4p h TYR 165 CO -0.05 0.34 -0.50 1.25 -1.05 0.00 0.00 178.16 178.15 3m4p h HIS 166 N 0.32 0.72 0.00 4.88 2.76 -1.12 0.06 115.15 122.76 3m4p h HIS 166 Ca 0.07 -0.31 -0.05 0.00 -2.20 0.00 0.00 60.37 57.88 3m4p h HIS 166 Cb 0.23 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 3m4p h HIS 166 CO 0.00 1.09 -0.26 -0.44 -1.30 0.00 0.00 177.93 177.02 3m4p h ASP 167 N 0.14 0.00 -0.57 3.26 5.19 -0.37 -2.88 116.42 121.20 3m4p h ASP 167 Ca -0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 3m4p h ASP 167 Cb 1.14 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.65 3m4p h ASP 167 CO 0.10 0.26 0.00 0.59 -3.12 0.00 0.00 179.24 177.08 3m4p n ASN 168 N -4.12 5.35 -3.76 6.45 3.02 -0.01 -4.97 115.26 117.21 3m4p n ASN 168 Ca -0.02 -2.82 -0.24 0.00 -0.03 0.00 0.00 54.58 51.47 3m4p n ASN 168 Cb 0.32 -0.65 0.02 0.00 -0.61 0.00 0.00 39.78 38.86 3m4p n ASN 168 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3m4p n HIS 169 N 0.65 -1.84 -3.50 3.10 8.25 -0.99 -5.00 115.22 115.88 3m4p n HIS 169 Ca 0.27 0.73 -0.37 0.00 -0.26 0.00 0.00 57.72 58.09 3m4p n HIS 169 Cb 1.10 -3.99 -0.06 0.00 1.12 0.00 0.00 29.99 28.15 3m4p n HIS 169 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3m4p s PHE 170 N -3.71 3.61 -0.00 4.41 0.08 -0.03 -4.74 117.98 117.60 3m4p s PHE 170 Ca 0.11 0.84 -0.25 0.00 0.12 0.00 0.00 56.93 57.75 3m4p s PHE 170 Cb -0.04 -2.33 -0.04 0.00 -0.57 0.00 0.00 43.02 40.04 3m4p s PHE 170 CO 0.84 0.46 0.78 0.99 -0.10 0.00 0.00 175.22 178.19 3m4p s THR 171 N -0.35 4.87 0.16 0.64 2.01 -0.49 -4.65 115.64 117.83 3m4p s THR 171 Ca 0.22 1.63 -0.24 0.00 0.31 0.00 0.00 61.69 63.60 3m4p s THR 171 Cb -0.15 -4.12 -0.08 0.00 0.01 0.00 0.00 72.50 68.16 3m4p s THR 171 CO 0.10 0.29 0.76 -0.70 -0.69 0.00 0.00 174.62 174.37 3m4p s GLU 172 N 0.45 4.52 0.15 4.92 2.12 -1.26 -1.27 118.70 128.33 3m4p s GLU 172 Ca 0.40 1.11 0.07 0.00 0.36 0.00 0.00 54.97 56.91 3m4p s GLU 172 Cb -0.20 -3.24 -0.04 0.00 0.26 0.00 0.00 34.13 30.92 3m4p s GLU 172 CO 0.22 0.57 -0.16 0.96 -0.54 0.00 0.00 175.26 176.31 3m4p s ILE 173 N -1.17 1.56 -0.67 -3.70 -4.36 -0.77 -4.93 121.20 107.16 3m4p s ILE 173 Ca 0.36 -1.86 -0.01 0.00 -0.26 0.00 0.00 60.65 58.88 3m4p s ILE 173 Cb -0.22 -1.72 0.17 0.00 1.25 0.00 0.00 42.46 41.94 3m4p s ILE 173 CO 0.25 -0.41 0.48 -1.58 0.24 0.00 0.00 174.94 173.93 3m4p s GLN 174 N -2.86 2.60 0.79 0.37 2.00 -1.26 -4.61 119.66 116.69 3m4p s GLN 174 Ca 0.13 -2.79 -0.12 0.00 -2.00 0.00 0.00 55.36 50.58 3m4p s GLN 174 Cb -0.05 -3.67 0.06 0.00 0.80 0.00 0.00 33.01 30.16 3m4p s GLN 174 CO 0.05 -1.19 1.10 -1.25 -0.50 0.00 0.00 175.29 173.49 3m4p s PRO 175 N -0.53 2.17 0.59 1.67 0.04 -1.26 -5.03 135.00 132.65 3m4p s PRO 175 Ca 0.20 0.59 -0.17 0.00 0.04 0.00 0.00 61.00 61.66 3m4p s PRO 175 Cb -0.17 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 3m4p s PRO 175 CO -0.06 -1.55 1.08 -1.25 0.04 0.00 0.00 177.00 175.26 3m4p s PRO 176 N -5.20 3.25 0.00 0.56 0.04 -1.26 -4.97 135.00 127.43 3m4p s PRO 176 Ca 0.60 1.32 0.10 0.00 0.04 0.00 0.00 61.00 63.06 3m4p s PRO 176 Cb -0.14 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 3m4p s PRO 176 CO 0.54 -0.88 0.53 0.25 0.04 0.00 0.00 177.00 177.48 3m4p n THR 177 N -1.90 0.00 -3.71 1.26 -2.24 -1.26 -4.88 114.28 101.55 3m4p n THR 177 Ca 0.10 -0.35 -0.38 0.00 -2.27 0.00 0.00 64.05 61.14 3m4p n THR 177 Cb 0.52 1.07 -0.12 0.00 -2.10 0.00 0.00 70.33 69.70 3m4p n THR 177 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3m4p s ILE 178 N -1.55 4.00 0.35 2.28 1.01 -1.26 -0.29 121.20 125.73 3m4p s ILE 178 Ca 0.06 -1.05 0.08 0.00 0.00 0.00 0.00 60.65 59.74 3m4p s ILE 178 Cb 0.08 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.25 3m4p s ILE 178 CO 0.30 -0.19 0.13 0.68 0.00 0.00 0.00 174.94 175.86 3m4p s VAL 179 N 1.44 2.88 -0.41 2.92 -7.23 0.16 -4.91 120.40 115.26 3m4p s VAL 179 Ca -0.01 -1.73 0.04 0.00 -1.81 0.00 0.00 61.98 58.47 3m4p s VAL 179 Cb -0.19 -2.95 0.35 0.00 0.56 0.00 0.00 36.38 34.14 3m4p s VAL 179 CO 0.04 -0.16 1.27 2.29 -0.31 0.00 0.00 175.10 178.23 3m4p n LYS 180 N -1.13 2.15 -1.39 4.82 0.00 -1.26 -0.53 118.16 120.82 3m4p n LYS 180 Ca -0.03 -1.44 -0.29 0.00 -0.00 0.00 0.00 58.31 56.55 3m4p n LYS 180 Cb 0.62 -1.69 0.09 0.00 -0.00 0.00 0.00 35.03 34.05 3m4p n LYS 180 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3m4p n SER 187 N -0.01 6.22 -2.70 -5.58 2.88 -1.26 -4.74 113.62 108.42 3m4p n SER 187 Ca 0.21 -3.76 -0.24 0.00 -1.33 0.00 0.00 58.87 53.76 3m4p n SER 187 Cb 0.89 -0.82 -0.01 0.00 -0.75 0.00 0.00 64.21 63.52 3m4p n SER 187 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3m4p n THR 188 N -0.94 2.18 -4.12 2.46 -2.24 -1.26 -4.82 114.28 105.53 3m4p n THR 188 Ca 0.57 -4.84 -0.34 0.00 -2.27 0.00 0.00 64.05 57.17 3m4p n THR 188 Cb 0.90 -0.95 -0.15 0.00 -2.10 0.00 0.00 70.33 68.03 3m4p n THR 188 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3m4p s LEU 189 N -3.37 2.55 -0.03 3.22 1.43 -1.26 -1.67 118.68 119.54 3m4p s LEU 189 Ca 0.45 -0.49 -0.30 0.00 -1.03 0.00 0.00 54.13 52.75 3m4p s LEU 189 Cb 0.37 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.93 3m4p s LEU 189 CO -0.13 0.01 1.31 -0.36 0.23 0.00 0.00 176.35 177.40 3m4p s PHE 190 N 1.25 2.99 0.11 0.29 0.08 -1.26 -4.87 117.98 116.57 3m4p s PHE 190 Ca 0.03 1.00 -0.23 0.00 0.12 0.00 0.00 56.93 57.85 3m4p s PHE 190 Cb -0.14 -3.55 -0.07 0.00 -0.57 0.00 0.00 43.02 38.69 3m4p s PHE 190 CO -0.06 -1.91 0.69 -1.59 -0.10 0.00 0.00 175.22 172.25 3m4p s LYS 191 N 2.40 4.42 0.12 0.44 -2.85 -1.26 -1.00 119.74 122.00 3m4p s LYS 191 Ca 0.60 0.97 0.03 0.00 -1.00 0.00 0.00 55.97 56.57 3m4p s LYS 191 Cb -0.28 -3.27 -0.04 0.00 -2.06 0.00 0.00 37.83 32.18 3m4p s LYS 191 CO 0.24 0.54 -0.09 -0.48 0.10 0.00 0.00 175.35 175.66 3m4p s LEU 192 N -0.92 2.48 -0.53 2.77 2.34 0.42 -4.94 118.68 120.30 3m4p s LEU 192 Ca 0.33 -0.94 -0.21 0.00 0.06 0.00 0.00 54.13 53.37 3m4p s LEU 192 Cb -0.21 -0.26 0.06 0.00 -0.56 0.00 0.00 46.19 45.22 3m4p s LEU 192 CO 0.23 -0.34 0.74 -1.58 -1.06 0.00 0.00 176.35 174.33 3m4p s GLN 193 N -3.45 3.17 -0.76 1.48 2.00 -1.26 -1.92 119.66 118.92 3m4p s GLN 193 Ca 0.12 -0.75 -0.18 0.00 -2.00 0.00 0.00 55.36 52.54 3m4p s GLN 193 Cb 0.01 -4.11 0.13 0.00 0.80 0.00 0.00 33.01 29.85 3m4p s GLN 193 CO -0.01 -1.36 0.89 -0.47 -0.50 0.00 0.00 175.29 173.85 3m4p s TYR 194 N 3.09 3.13 0.00 1.67 5.04 -0.95 -4.89 117.35 124.43 3m4p s TYR 194 Ca 0.19 -1.23 0.00 0.00 -2.44 0.00 0.00 57.07 53.59 3m4p s TYR 194 Cb -0.18 -4.11 0.00 0.00 0.35 0.00 0.00 41.96 38.02 3m4p s TYR 194 CO 0.13 -1.36 0.00 1.19 -1.34 0.00 0.00 175.55 174.18 3m4p n PHE 195 N 6.18 0.00 -0.08 4.97 3.72 -1.26 -2.13 117.46 128.86 3m4p n PHE 195 Ca 0.07 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.50 3m4p n PHE 195 Cb 0.46 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.08 3m4p n PHE 195 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 3m4p n ASN 196 N 7.85 2.47 -3.83 4.37 0.23 -1.26 -4.99 115.26 120.09 3m4p n ASN 196 Ca 0.00 -1.96 -0.12 0.00 -0.53 0.00 0.00 54.58 51.97 3m4p n ASN 196 Cb 0.00 -0.12 -0.12 0.00 -2.08 0.00 0.00 39.78 37.45 3m4p n ASN 196 CO 0.00 0.00 0.00 -1.83 -0.93 0.00 0.00 177.26 174.50 3m4p s GLU 197 N -0.97 0.20 0.31 -3.83 -1.05 -0.91 -5.14 118.70 107.31 3m4p s GLU 197 Ca 0.13 0.11 -0.29 0.00 -0.15 0.00 0.00 54.97 54.77 3m4p s GLU 197 Cb 0.07 0.09 -0.10 0.00 -0.44 0.00 0.00 34.13 33.75 3m4p s GLU 197 CO 0.09 -0.03 1.28 -1.25 0.95 0.00 0.00 175.26 176.30 3m4p s PRO 198 N -0.13 4.39 0.23 -4.83 0.04 -1.26 -2.24 135.00 131.21 3m4p s PRO 198 Ca -0.02 2.15 -0.09 0.00 0.04 0.00 0.00 61.00 63.08 3m4p s PRO 198 Cb -0.02 -3.10 -0.02 0.00 0.04 0.00 0.00 34.50 31.40 3m4p s PRO 198 CO 0.00 -0.15 0.36 0.00 0.04 0.00 0.00 177.00 177.25 3m4p s ALA 199 N -0.96 0.24 0.08 8.56 0.00 -0.81 -4.89 121.76 123.98 3m4p s ALA 199 Ca 0.50 -1.16 0.06 0.00 0.00 0.00 0.00 51.96 51.36 3m4p s ALA 199 Cb -0.38 1.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.88 3m4p s ALA 199 CO 0.49 -0.76 -0.16 0.71 0.00 0.00 0.00 175.76 176.04 3m4p s TYR 200 N -4.07 1.37 0.02 0.00 2.02 0.31 -0.44 117.35 116.57 3m4p s TYR 200 Ca 0.28 -0.45 -0.30 0.00 -0.37 0.00 0.00 57.07 56.22 3m4p s TYR 200 Cb 0.02 -0.76 -0.05 0.00 -0.40 0.00 0.00 41.96 40.77 3m4p s TYR 200 CO 0.10 0.10 1.25 -0.51 -1.57 0.00 0.00 175.55 174.91 3m4p s LEU 201 N -1.82 4.34 0.60 -1.29 1.43 -0.17 0.39 118.68 122.16 3m4p s LEU 201 Ca 0.01 2.00 -0.18 0.00 -1.03 0.00 0.00 54.13 54.92 3m4p s LEU 201 Cb -0.10 -3.57 -0.05 0.00 0.03 0.00 0.00 46.19 42.50 3m4p s LEU 201 CO 0.03 -0.55 0.88 1.07 0.23 0.00 0.00 176.35 178.01 3m4p n THR 202 N 4.23 3.48 0.25 5.49 5.66 0.60 -4.41 114.28 129.58 3m4p n THR 202 Ca 0.10 -0.50 0.04 0.00 -3.05 0.00 0.00 64.05 60.64 3m4p n THR 202 Cb 0.46 -1.06 -0.05 0.00 -1.55 0.00 0.00 70.33 68.12 3m4p n THR 202 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3m4p n GLN 203 N -0.87 2.89 -3.64 1.09 10.64 -1.26 -1.79 117.38 124.44 3m4p n GLN 203 Ca 0.13 -0.03 -0.11 0.00 -1.83 0.00 0.00 57.00 55.17 3m4p n GLN 203 Cb 0.47 -0.99 -0.07 0.00 -0.86 0.00 0.00 30.24 28.79 3m4p n GLN 203 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 3m4p s SER 204 N -2.19 -0.56 -0.18 2.61 0.15 -1.26 -4.53 113.70 107.73 3m4p s SER 204 Ca 0.01 1.08 0.14 0.00 0.70 0.00 0.00 55.95 57.88 3m4p s SER 204 Cb 0.06 1.10 0.72 0.00 -1.71 0.00 0.00 66.02 66.19 3m4p s SER 204 CO 0.34 -0.19 1.61 -1.20 1.20 0.00 0.00 173.24 175.00 3m4p n SER 205 N 2.41 5.05 0.16 5.45 7.64 -1.26 -4.59 113.62 128.47 3m4p n SER 205 Ca -0.13 -2.72 -0.14 0.00 1.01 0.00 0.00 58.87 56.89 3m4p n SER 205 Cb 0.56 -0.64 -0.07 0.00 -1.01 0.00 0.00 64.21 63.05 3m4p n SER 205 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 3m4p h GLN 206 N 3.67 -0.39 -0.85 1.43 4.15 -1.97 -1.45 115.11 119.70 3m4p h GLN 206 Ca 0.00 0.03 0.08 0.00 0.77 0.00 0.00 58.65 59.52 3m4p h GLN 206 Cb 1.70 0.09 -0.07 0.00 0.21 0.00 0.00 27.48 29.42 3m4p h GLN 206 CO 0.38 -0.26 0.52 -0.07 -1.93 0.00 0.00 178.83 177.47 3m4p h LEU 207 N -0.40 0.79 -0.45 -2.39 4.07 -1.99 0.17 115.31 115.10 3m4p h LEU 207 Ca -0.02 0.03 -0.04 0.00 0.08 0.00 0.00 57.88 57.93 3m4p h LEU 207 Cb 0.34 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 41.93 3m4p h LEU 207 CO 0.01 0.48 0.13 1.88 -1.08 0.00 0.00 178.44 179.86 3m4p h TYR 208 N 0.91 0.73 -0.57 1.13 0.05 -1.80 -1.89 116.97 115.53 3m4p h TYR 208 Ca 0.39 -0.08 0.04 0.00 0.05 0.00 0.00 58.73 59.13 3m4p h TYR 208 Cb 0.25 -0.21 -0.04 0.00 1.01 0.00 0.00 36.73 37.74 3m4p h TYR 208 CO -0.04 0.66 0.32 -0.07 -1.05 0.00 0.00 178.16 177.98 3m4p h LEU 209 N 0.59 0.49 -1.95 3.88 3.38 -0.11 -1.64 115.31 119.95 3m4p h LEU 209 Ca 0.14 0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.24 3m4p h LEU 209 Cb 0.28 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3m4p h LEU 209 CO -0.00 0.33 0.28 -0.33 0.09 0.00 0.00 178.44 178.81 3m4p h GLU 210 N 0.62 0.05 -0.00 1.13 5.08 -0.29 -2.00 114.58 119.18 3m4p h GLU 210 Ca 0.25 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 3m4p h GLU 210 Cb 0.10 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3m4p h GLU 210 CO -0.14 0.04 -0.04 -1.13 -1.00 0.00 0.00 179.01 176.74 3m4p n SER 211 N -4.43 0.16 -0.00 1.42 3.41 -0.62 -3.96 113.62 109.59 3m4p n SER 211 Ca 0.06 -0.40 0.03 0.00 -0.26 0.00 0.00 58.87 58.30 3m4p n SER 211 Cb 0.44 -0.18 -0.05 0.00 -0.26 0.00 0.00 64.21 64.16 3m4p n SER 211 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3m4p n VAL 212 N -1.13 0.01 0.12 -3.33 0.31 -0.76 -4.68 118.33 108.86 3m4p n VAL 212 Ca 0.16 -0.15 0.01 0.00 -0.01 0.00 0.00 64.34 64.35 3m4p n VAL 212 Cb 0.24 0.34 0.33 0.00 -0.91 0.00 0.00 33.84 33.84 3m4p n VAL 212 CO 0.00 0.00 0.00 0.16 -1.32 0.00 0.00 176.83 175.67 3m4p h ILE 213 N 0.00 1.23 -0.44 2.52 3.07 -1.66 0.19 117.51 122.42 3m4p h ILE 213 Ca -0.00 -1.09 0.13 0.00 1.55 0.00 0.00 64.86 65.44 3m4p h ILE 213 Cb 0.31 1.44 -0.02 0.00 -0.27 0.00 0.00 36.82 38.28 3m4p h ILE 213 CO 0.00 0.33 0.36 0.00 -1.05 0.00 0.00 178.15 177.79 3m4p h ALA 214 N 1.56 2.31 0.00 0.16 0.00 -1.83 -1.57 119.26 119.88 3m4p h ALA 214 Ca 0.03 -0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.59 3m4p h ALA 214 Cb 0.56 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 3m4p h ALA 214 CO 0.04 -0.59 -2.07 0.45 0.00 0.00 0.00 179.25 177.08 3m4p n SER 215 N -4.15 1.65 0.04 0.00 2.88 -0.55 -4.74 113.62 108.74 3m4p n SER 215 Ca 0.08 0.28 0.01 0.00 -1.33 0.00 0.00 58.87 57.92 3m4p n SER 215 Cb 0.56 -0.68 -0.08 0.00 -0.75 0.00 0.00 64.21 63.26 3m4p n SER 215 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3m4p n LEU 216 N -4.08 0.82 0.00 2.46 4.77 0.57 -5.07 117.00 116.47 3m4p n LEU 216 Ca -0.40 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 3m4p n LEU 216 Cb 0.76 0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 3m4p n LEU 216 CO 0.05 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 3m4p n GLY 217 N 1.37 -1.19 3.37 -0.72 0.00 -0.59 -4.78 105.19 102.65 3m4p n GLY 217 Ca -0.09 -1.31 -0.62 0.00 0.00 0.00 0.00 46.02 44.00 3m4p n GLY 217 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3m4p n LYS 218 N 0.00 0.00 -4.41 1.61 5.02 -1.26 -4.44 118.16 114.68 3m4p n LYS 218 Ca 0.00 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.08 3m4p n LYS 218 Cb 0.00 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.41 3m4p n LYS 218 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3m4p s SER 219 N 5.27 3.10 0.07 4.39 0.01 -0.91 -1.40 113.70 124.22 3m4p s SER 219 Ca 1.16 -1.04 -0.13 0.00 1.31 0.00 0.00 55.95 57.26 3m4p s SER 219 Cb -1.50 -0.22 0.02 0.00 0.21 0.00 0.00 66.02 64.53 3m4p s SER 219 CO 0.70 -0.08 0.30 0.72 0.41 0.00 0.00 173.24 175.29 3m4p s PHE 220 N -2.74 -0.06 0.08 2.43 -0.12 -0.40 -1.63 117.98 115.54 3m4p s PHE 220 Ca 0.27 -0.17 -0.12 0.00 -0.05 0.00 0.00 56.93 56.86 3m4p s PHE 220 Cb -0.02 0.09 0.01 0.00 -0.63 0.00 0.00 43.02 42.47 3m4p s PHE 220 CO 0.11 -0.55 0.27 0.00 -0.05 0.00 0.00 175.22 175.01 3m4p s MET 222 N -3.44 0.74 0.01 0.00 0.00 -1.26 0.04 119.30 115.39 3m4p s MET 222 Ca 0.01 -0.86 -0.00 0.00 0.00 0.00 0.00 55.69 54.84 3m4p s MET 222 Cb 0.02 -0.56 0.00 0.00 0.00 0.00 0.00 34.83 34.30 3m4p s MET 222 CO -0.09 -1.22 0.01 1.47 0.00 0.00 0.00 175.02 175.19 3m4p n LEU 223 N 4.05 0.00 -4.76 4.11 -0.00 -0.83 -4.91 117.00 114.67 3m4p n LEU 223 Ca 0.13 -0.09 -0.41 0.00 -0.00 0.00 0.00 56.01 55.65 3m4p n LEU 223 Cb 0.49 0.07 -0.03 0.00 -0.00 0.00 0.00 43.42 43.95 3m4p n LEU 223 CO 0.06 -0.02 0.89 -0.44 -0.00 0.00 0.00 177.39 177.89 3m4p s SER 224 N -1.07 7.02 0.16 1.45 0.01 -1.26 0.30 113.70 120.31 3m4p s SER 224 Ca 0.01 2.44 0.10 0.00 1.31 0.00 0.00 55.95 59.80 3m4p s SER 224 Cb -0.00 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.56 3m4p s SER 224 CO 0.01 -0.36 -0.16 -0.44 0.41 0.00 0.00 173.24 172.70 3m4p s SER 225 N -0.49 3.90 0.08 2.44 0.01 0.03 -4.79 113.70 114.90 3m4p s SER 225 Ca 0.48 -0.65 0.09 0.00 1.31 0.00 0.00 55.95 57.19 3m4p s SER 225 Cb -0.35 -0.53 -0.03 0.00 0.21 0.00 0.00 66.02 65.31 3m4p s SER 225 CO 0.45 0.14 -0.25 -0.31 0.41 0.00 0.00 173.24 173.67 3m4p s TYR 226 N -1.48 2.17 -0.17 2.43 2.02 -0.74 -1.38 117.35 120.20 3m4p s TYR 226 Ca 0.21 -0.40 -0.04 0.00 -0.37 0.00 0.00 57.07 56.47 3m4p s TYR 226 Cb -0.09 -1.24 0.07 0.00 -0.40 0.00 0.00 41.96 40.29 3m4p s TYR 226 CO 0.12 0.20 0.14 1.03 -1.57 0.00 0.00 175.55 175.47 3m4p s ARG 227 N -1.59 0.10 -0.20 -0.62 1.81 -0.42 -4.20 118.95 113.83 3m4p s ARG 227 Ca 0.11 0.07 0.05 0.00 -1.72 0.00 0.00 55.73 54.25 3m4p s ARG 227 Cb -0.10 -1.48 0.43 0.00 -0.45 0.00 0.00 34.95 33.36 3m4p s ARG 227 CO 0.04 -0.63 1.37 0.00 -0.68 0.00 0.00 175.30 175.40 3m4p n ALA 228 N 5.30 3.79 -1.70 2.13 0.00 -0.67 -4.36 120.51 125.00 3m4p n ALA 228 Ca -0.06 -1.38 -0.43 0.00 0.00 0.00 0.00 53.44 51.56 3m4p n ALA 228 Cb 0.49 -1.16 -0.03 0.00 0.00 0.00 0.00 19.45 18.75 3m4p n ALA 228 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3m4p n GLU 229 N -0.03 2.65 -2.77 0.00 0.28 -1.26 -4.77 120.64 114.74 3m4p n GLU 229 Ca 0.25 0.96 -0.43 0.00 -0.16 0.00 0.00 57.16 57.78 3m4p n GLU 229 Cb 0.99 -2.81 0.00 0.00 1.43 0.00 0.00 31.44 31.05 3m4p n GLU 229 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 3m4p n GLN 230 N 4.44 3.73 -3.63 3.44 7.27 -1.26 -4.89 117.38 126.48 3m4p n GLN 230 Ca 0.17 -3.96 -0.15 0.00 0.07 0.00 0.00 57.00 53.13 3m4p n GLN 230 Cb 0.34 -2.81 -0.07 0.00 2.41 0.00 0.00 30.24 30.10 3m4p n GLN 230 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 3m4p s SER 231 N 0.85 -0.66 -0.27 1.69 0.01 -1.26 -5.14 113.70 108.92 3m4p s SER 231 Ca 0.37 1.16 -0.10 0.00 1.31 0.00 0.00 55.95 58.69 3m4p s SER 231 Cb 0.03 1.14 -0.04 0.00 0.21 0.00 0.00 66.02 67.36 3m4p s SER 231 CO 0.01 -0.31 0.15 -0.60 0.41 0.00 0.00 173.24 172.91 3m4p s ARG 232 N -0.02 3.86 0.22 12.44 3.52 -1.26 -4.80 118.95 132.91 3m4p s ARG 232 Ca -0.03 -0.37 0.06 0.00 -0.13 0.00 0.00 55.73 55.27 3m4p s ARG 232 Cb -0.04 -3.56 -0.05 0.00 -1.56 0.00 0.00 34.95 29.75 3m4p s ARG 232 CO 0.03 -0.18 -0.08 0.99 -0.81 0.00 0.00 175.30 175.25 3m4p s THR 233 N 1.70 1.45 -2.14 4.11 2.01 -1.26 -5.03 115.64 116.48 3m4p s THR 233 Ca 0.07 -2.12 0.24 0.00 0.31 0.00 0.00 61.69 60.19 3m4p s THR 233 Cb -0.16 -2.19 0.63 0.00 0.01 0.00 0.00 72.50 70.79 3m4p s THR 233 CO 0.09 -0.48 1.84 1.33 -0.69 0.00 0.00 174.62 176.71 3m4p n VAL 234 N -0.41 0.04 -0.41 3.82 0.24 -1.26 -3.69 118.33 116.65 3m4p n VAL 234 Ca -0.07 -0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 3m4p n VAL 234 Cb 0.62 -0.09 0.00 0.00 -1.47 0.00 0.00 33.84 32.90 3m4p n VAL 234 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3m4p n ARG 235 N -0.48 0.78 -4.79 7.34 3.00 -1.26 -0.67 116.66 120.58 3m4p n ARG 235 Ca 0.18 -0.75 -0.25 0.00 -0.01 0.00 0.00 57.85 57.01 3m4p n ARG 235 Cb 0.18 -0.79 -0.16 0.00 0.00 0.00 0.00 32.46 31.68 3m4p n ARG 235 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 3m4p s HIS 236 N -0.34 1.62 0.15 -1.55 4.02 -1.24 -4.99 115.29 112.96 3m4p s HIS 236 Ca 0.00 -0.45 0.08 0.00 1.02 0.00 0.00 55.06 55.71 3m4p s HIS 236 Cb 0.00 -1.09 -0.04 0.00 -1.02 0.00 0.00 32.58 30.43 3m4p s HIS 236 CO 0.00 -0.15 -0.18 -0.51 1.02 0.00 0.00 174.74 174.92 3m4p s LEU 237 N 0.02 2.42 0.39 0.89 1.43 -1.26 -4.39 118.68 118.17 3m4p s LEU 237 Ca -0.03 -0.83 0.21 0.00 -1.03 0.00 0.00 54.13 52.44 3m4p s LEU 237 Cb -0.11 -0.82 0.57 0.00 0.03 0.00 0.00 46.19 45.86 3m4p s LEU 237 CO 0.02 -0.03 1.67 0.00 0.23 0.00 0.00 176.35 178.24 3m4p h ALA 238 N 3.38 0.90 -3.60 4.21 0.00 -0.93 -3.41 119.26 119.81 3m4p h ALA 238 Ca -0.43 -0.27 -0.34 0.00 0.00 0.00 0.00 54.91 53.87 3m4p h ALA 238 Cb 1.20 -0.05 -0.32 0.00 0.00 0.00 0.00 17.79 18.62 3m4p h ALA 238 CO 0.49 0.37 -0.75 -2.00 0.00 0.00 0.00 179.25 177.36 3m4p s GLU 239 N -3.37 0.42 0.00 0.00 2.12 -1.24 -1.30 118.70 115.33 3m4p s GLU 239 Ca 0.02 -0.03 -0.16 0.00 0.36 0.00 0.00 54.97 55.16 3m4p s GLU 239 Cb 0.09 -0.51 0.03 0.00 0.26 0.00 0.00 34.13 34.00 3m4p s GLU 239 CO 0.68 -0.06 0.35 1.52 -0.54 0.00 0.00 175.26 177.21 3m4p s TYR 240 N 0.66 -0.22 -0.55 5.30 -0.85 -0.48 -4.56 117.35 116.65 3m4p s TYR 240 Ca -0.07 0.27 -0.28 0.00 -0.52 0.00 0.00 57.07 56.47 3m4p s TYR 240 Cb -0.10 0.14 0.03 0.00 0.38 0.00 0.00 41.96 42.40 3m4p s TYR 240 CO -0.01 -0.46 1.21 -1.17 -1.52 0.00 0.00 175.55 173.61 3m4p s LEU 241 N -1.56 3.49 -0.28 -3.49 2.96 -1.26 -0.79 118.68 117.75 3m4p s LEU 241 Ca -0.10 0.24 -0.11 0.00 -0.22 0.00 0.00 54.13 53.94 3m4p s LEU 241 Cb -0.03 -3.26 -0.04 0.00 0.50 0.00 0.00 46.19 43.36 3m4p s LEU 241 CO 0.02 -1.46 0.18 -2.28 -1.32 0.00 0.00 176.35 171.49 3m4p s HIS 242 N 4.99 3.20 -0.26 5.38 5.65 0.15 -2.81 115.29 131.59 3m4p s HIS 242 Ca 0.46 0.01 -0.10 0.00 0.25 0.00 0.00 55.06 55.67 3m4p s HIS 242 Cb -0.08 -2.37 -0.05 0.00 -1.18 0.00 0.00 32.58 28.91 3m4p s HIS 242 CO 0.27 -0.21 0.16 -1.17 -0.65 0.00 0.00 174.74 173.14 3m4p s LEU 243 N 1.73 3.99 0.07 8.88 2.96 -0.67 -1.96 118.68 133.68 3m4p s LEU 243 Ca 0.07 0.02 0.05 0.00 -0.22 0.00 0.00 54.13 54.05 3m4p s LEU 243 Cb -0.16 -2.09 -0.03 0.00 0.50 0.00 0.00 46.19 44.42 3m4p s LEU 243 CO 0.10 0.01 -0.13 -1.61 -1.32 0.00 0.00 176.35 173.40 3m4p s GLU 244 N 1.40 0.78 -0.00 1.98 2.02 0.11 0.04 118.70 125.02 3m4p s GLU 244 Ca 0.07 -0.93 -0.11 0.00 0.02 0.00 0.00 54.97 54.02 3m4p s GLU 244 Cb -0.15 -0.74 0.01 0.00 0.10 0.00 0.00 34.13 33.35 3m4p s GLU 244 CO 0.07 0.16 0.22 0.00 0.02 0.00 0.00 175.26 175.74 3m4p s ALA 245 N -1.32 -0.55 -0.01 5.21 0.00 -0.79 -0.70 121.76 123.61 3m4p s ALA 245 Ca -0.03 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.01 3m4p s ALA 245 Cb -0.10 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.14 3m4p s ALA 245 CO 0.02 -0.24 0.01 -2.00 0.00 0.00 0.00 175.76 173.55 3m4p s GLU 246 N -1.42 0.02 -0.14 0.00 2.56 -0.65 -1.64 118.70 117.43 3m4p s GLU 246 Ca -0.14 0.07 0.02 0.00 0.00 0.00 0.00 54.97 54.92 3m4p s GLU 246 Cb -0.06 -0.15 0.01 0.00 2.00 0.00 0.00 34.13 35.93 3m4p s GLU 246 CO 0.03 -0.07 -0.19 -0.51 -0.56 0.00 0.00 175.26 173.95 3m4p s LEU 247 N 0.50 1.99 0.42 2.70 1.02 0.28 -2.15 118.68 123.43 3m4p s LEU 247 Ca -0.04 -0.56 -0.22 0.00 0.02 0.00 0.00 54.13 53.33 3m4p s LEU 247 Cb -0.06 -1.35 -0.11 0.00 0.02 0.00 0.00 46.19 44.69 3m4p s LEU 247 CO -0.01 0.04 0.95 -2.16 0.02 0.00 0.00 176.35 175.19 3m4p s PRO 248 N 0.99 4.27 -1.12 1.29 0.04 -1.26 -2.40 135.00 136.81 3m4p s PRO 248 Ca -0.04 1.14 -0.00 0.00 0.04 0.00 0.00 61.00 62.14 3m4p s PRO 248 Cb -0.15 -2.26 -0.01 0.00 0.04 0.00 0.00 34.50 32.13 3m4p s PRO 248 CO -0.04 0.01 0.94 1.19 0.04 0.00 0.00 177.00 179.13 3m4p n PHE 249 N -0.49 -2.09 -4.50 0.56 3.72 0.63 -4.95 117.46 110.34 3m4p n PHE 249 Ca 0.06 0.88 -0.24 0.00 -0.05 0.00 0.00 57.45 58.11 3m4p n PHE 249 Cb 0.54 -4.84 -0.10 0.00 -0.94 0.00 0.00 39.48 34.13 3m4p n PHE 249 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 3m4p s ILE 250 N -3.34 1.35 0.56 4.37 -4.36 -1.20 -5.04 121.20 113.53 3m4p s ILE 250 Ca 0.04 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.47 3m4p s ILE 250 Cb -0.00 -2.80 0.04 0.00 1.25 0.00 0.00 42.46 40.94 3m4p s ILE 250 CO 0.69 0.00 0.32 -0.94 0.24 0.00 0.00 174.94 175.25 3m4p s SER 251 N -3.56 4.50 0.03 4.36 1.04 -1.26 -4.52 113.70 114.29 3m4p s SER 251 Ca 0.35 -1.40 -0.25 0.00 0.48 0.00 0.00 55.95 55.12 3m4p s SER 251 Cb 0.09 0.60 -0.18 0.00 0.10 0.00 0.00 66.02 66.63 3m4p s SER 251 CO 0.16 -1.12 1.46 0.15 0.98 0.00 0.00 173.24 174.86 3m4p h PHE 252 N 0.83 -0.11 -0.75 5.02 3.57 -1.99 -1.92 116.94 121.59 3m4p h PHE 252 Ca -0.38 -0.00 0.16 0.00 3.53 0.00 0.00 57.97 61.27 3m4p h PHE 252 Cb 1.31 0.04 -0.14 0.00 2.79 0.00 0.00 35.95 39.95 3m4p h PHE 252 CO 1.20 0.16 -0.13 0.93 -2.23 0.00 0.00 178.31 178.24 3m4p h GLU 253 N -0.37 0.02 -0.38 1.11 4.39 -1.99 -0.30 114.58 117.06 3m4p h GLU 253 Ca -0.01 -0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.73 3m4p h GLU 253 Cb 0.32 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.92 3m4p h GLU 253 CO 0.02 0.02 0.12 -0.44 -1.16 0.00 0.00 179.01 177.56 3m4p h ASP 254 N 0.02 0.11 -0.18 1.42 3.32 -1.89 0.56 116.42 119.79 3m4p h ASP 254 Ca 0.37 0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.51 3m4p h ASP 254 Cb 0.60 0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.16 3m4p h ASP 254 CO -0.74 0.10 -0.04 0.25 -1.72 0.00 0.00 179.24 177.09 3m4p h LEU 255 N 0.27 -0.16 0.06 1.55 5.85 -0.31 0.73 115.31 123.29 3m4p h LEU 255 Ca 0.18 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 3m4p h LEU 255 Cb 0.17 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.31 3m4p h LEU 255 CO -0.19 -0.06 -0.03 -0.07 -0.34 0.00 0.00 178.44 177.75 3m4p h LEU 256 N 0.00 -0.07 -1.21 2.25 3.38 -0.74 -0.37 115.31 118.56 3m4p h LEU 256 Ca 0.09 -0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.09 3m4p h LEU 256 Cb 0.13 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 3m4p h LEU 256 CO -0.18 0.00 0.57 0.78 0.09 0.00 0.00 178.44 179.70 3m4p h ASN 257 N -0.14 0.82 0.62 -0.43 2.35 -0.60 0.27 115.58 118.47 3m4p h ASN 257 Ca -0.01 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 3m4p h ASN 257 Cb 0.11 -0.16 0.01 0.00 0.05 0.00 0.00 38.32 38.33 3m4p h ASN 257 CO 0.01 0.51 -0.30 -0.74 -1.65 0.00 0.00 177.43 175.26 3m4p h HIS 258 N 0.92 -0.78 -1.00 1.19 2.76 -0.52 -1.46 115.15 116.27 3m4p h HIS 258 Ca 0.39 -0.02 0.19 0.00 -2.20 0.00 0.00 60.37 58.73 3m4p h HIS 258 Cb 0.31 0.26 -0.10 0.00 1.55 0.00 0.00 27.41 29.42 3m4p h HIS 258 CO -0.00 -0.44 0.61 -0.07 -1.30 0.00 0.00 177.93 176.74 3m4p h LEU 259 N -1.00 0.77 -0.30 0.26 3.38 -0.34 0.35 115.31 118.43 3m4p h LEU 259 Ca -0.09 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3m4p h LEU 259 Cb 0.69 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3m4p h LEU 259 CO 0.14 0.28 0.13 -0.08 0.09 0.00 0.00 178.44 179.00 3m4p h GLU 260 N 0.75 0.44 -0.37 1.13 4.81 -0.43 -2.14 114.58 118.77 3m4p h GLU 260 Ca 0.57 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.61 3m4p h GLU 260 Cb 0.89 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 3m4p h GLU 260 CO -0.36 0.44 -0.22 0.22 -0.73 0.00 0.00 179.01 178.36 3m4p h ASP 261 N 0.34 0.73 0.73 1.04 3.58 0.06 -1.98 116.42 120.91 3m4p h ASP 261 Ca 0.10 -0.26 -0.03 0.00 0.42 0.00 0.00 57.03 57.26 3m4p h ASP 261 Cb 0.15 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 3m4p h ASP 261 CO -0.01 0.94 -0.47 0.25 -2.88 0.00 0.00 179.24 177.07 3m4p h LEU 262 N 0.63 -1.19 -0.41 2.28 5.85 -0.24 0.03 115.31 122.27 3m4p h LEU 262 Ca 0.09 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 3m4p h LEU 262 Cb 0.72 0.35 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 3m4p h LEU 262 CO 0.06 -0.71 -0.07 0.58 -0.34 0.00 0.00 178.44 177.96 3m4p h VAL 263 N -1.13 1.27 -0.44 1.05 2.07 -1.40 -0.25 116.25 117.43 3m4p h VAL 263 Ca -0.09 -1.14 -0.14 0.00 0.82 0.00 0.00 66.70 66.14 3m4p h VAL 263 Cb 0.92 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 3m4p h VAL 263 CO 0.08 0.38 -0.28 0.00 0.02 0.00 0.00 177.57 177.78 3m4p h THR 265 N 0.80 1.44 -0.15 0.00 2.02 -0.81 -1.41 112.91 114.80 3m4p h THR 265 Ca 0.09 -1.56 0.03 0.00 0.77 0.00 0.00 66.41 65.74 3m4p h THR 265 Cb 0.86 2.32 -0.03 0.00 -1.74 0.00 0.00 68.15 69.57 3m4p h THR 265 CO 0.08 0.43 -0.01 0.58 0.37 0.00 0.00 175.52 176.97 3m4p h VAL 266 N -0.31 0.88 -0.35 3.16 2.07 -1.11 -0.78 116.25 119.81 3m4p h VAL 266 Ca -0.01 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 3m4p h VAL 266 Cb 0.79 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 3m4p h VAL 266 CO 0.04 0.01 0.10 0.40 0.02 0.00 0.00 177.57 178.14 3m4p h ILE 267 N 0.03 1.21 -0.60 4.57 1.08 -1.42 -1.36 117.51 121.02 3m4p h ILE 267 Ca 0.07 -0.69 -0.01 0.00 -0.39 0.00 0.00 64.86 63.84 3m4p h ILE 267 Cb 0.09 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.82 3m4p h ILE 267 CO -0.13 0.24 0.35 0.44 -0.69 0.00 0.00 178.15 178.35 3m4p h ASP 268 N 0.41 0.72 -0.28 1.72 3.32 -1.12 0.31 116.42 121.49 3m4p h ASP 268 Ca 0.11 -0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 3m4p h ASP 268 Cb 0.26 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3m4p h ASP 268 CO -0.00 0.56 -0.19 0.78 -1.72 0.00 0.00 179.24 178.67 3m4p h ASN 269 N 0.82 0.65 -0.30 6.45 2.35 -0.84 -1.86 115.58 122.85 3m4p h ASN 269 Ca 0.21 -0.44 -0.02 0.00 -0.55 0.00 0.00 56.30 55.51 3m4p h ASN 269 Cb -0.01 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 3m4p h ASN 269 CO -0.04 0.95 0.13 0.58 -1.65 0.00 0.00 177.43 177.40 3m4p h VAL 270 N 0.36 1.17 0.00 2.81 2.07 -0.93 -2.60 116.25 119.13 3m4p h VAL 270 Ca 0.06 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 3m4p h VAL 270 Cb 0.73 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 31.45 3m4p h VAL 270 CO 0.05 0.18 -0.09 0.24 0.02 0.00 0.00 177.57 177.96 3m4p h MET 271 N 0.34 0.00 -0.10 1.57 2.86 -0.95 -1.41 114.93 117.23 3m4p h MET 271 Ca 0.10 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.66 3m4p h MET 271 Cb 0.16 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 3m4p h MET 271 CO -0.01 0.09 -0.30 0.00 1.06 0.00 0.00 176.91 177.75 3m4p h ALA 272 N 1.91 1.30 0.00 6.32 0.00 -0.92 -1.39 119.26 126.47 3m4p h ALA 272 Ca -0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 3m4p h ALA 272 Cb 0.34 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3m4p h ALA 272 CO 0.01 0.48 -1.83 0.28 0.00 0.00 0.00 179.25 178.19 3m4p n VAL 273 N -4.13 0.05 -1.89 0.00 0.31 -0.98 -4.72 118.33 106.97 3m4p n VAL 273 Ca -0.01 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 3m4p n VAL 273 Cb 0.39 0.06 0.01 0.00 -0.91 0.00 0.00 33.84 33.39 3m4p n VAL 273 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3m4p n HIS 274 N -2.14 0.00 -0.08 3.52 8.25 -0.57 -4.93 115.22 119.26 3m4p n HIS 274 Ca -0.04 -0.04 -0.10 0.00 -0.26 0.00 0.00 57.72 57.27 3m4p n HIS 274 Cb 0.49 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.52 3m4p n HIS 274 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 3m4p h GLY 275 N 0.00 0.43 0.83 -1.41 0.00 -1.42 -0.37 103.07 101.14 3m4p h GLY 275 Ca 0.00 -0.25 0.04 0.00 0.00 0.00 0.00 47.33 47.12 3m4p h GLY 275 CO 0.00 0.23 0.46 -0.55 0.00 0.00 0.00 176.54 176.68 3m4p h ASP 276 N 0.27 0.75 -0.12 0.19 3.32 -1.92 0.21 116.42 119.12 3m4p h ASP 276 Ca 0.09 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 3m4p h ASP 276 Cb 0.21 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 3m4p h ASP 276 CO -0.00 0.51 0.03 0.50 -1.72 0.00 0.00 179.24 178.55 3m4p h LYS 277 N 0.88 0.19 -0.30 3.56 3.64 -1.89 -2.11 116.57 120.54 3m4p h LYS 277 Ca 0.30 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.60 3m4p h LYS 277 Cb 0.06 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3m4p h LYS 277 CO -0.13 0.36 0.04 0.82 -2.27 0.00 0.00 179.45 178.27 3m4p h ILE 278 N -0.02 1.24 -0.06 2.00 2.04 -0.73 -2.45 117.51 119.53 3m4p h ILE 278 Ca 0.04 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 3m4p h ILE 278 Cb 0.26 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.54 3m4p h ILE 278 CO 0.00 0.27 0.01 0.03 0.00 0.00 0.00 178.15 178.46 3m4p h ARG 279 N 0.32 0.08 -0.19 2.37 3.08 -0.63 -0.10 114.38 119.31 3m4p h ARG 279 Ca 0.09 -0.01 -0.13 0.00 0.07 0.00 0.00 59.98 60.01 3m4p h ARG 279 Cb 0.36 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 3m4p h ARG 279 CO 0.01 0.09 -0.42 -0.22 -1.07 0.00 0.00 179.97 178.35 3m4p h LYS 280 N 0.08 0.45 -0.00 0.04 3.64 -0.90 -2.96 116.57 116.92 3m4p h LYS 280 Ca 0.02 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 3m4p h LYS 280 Cb 0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3m4p h LYS 280 CO -0.00 0.79 -0.76 0.00 -2.27 0.00 0.00 179.45 177.22 3m4p n MET 281 N -4.02 0.34 -3.39 1.90 0.00 -0.95 -4.58 117.12 106.42 3m4p n MET 281 Ca -0.02 -0.27 -0.27 0.00 0.00 0.00 0.00 57.70 57.15 3m4p n MET 281 Cb 0.51 -1.49 -0.10 0.00 0.00 0.00 0.00 33.22 32.14 3m4p n MET 281 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 3m4p s ASN 282 N -2.85 1.48 0.28 3.17 2.47 -0.09 -4.70 114.94 114.70 3m4p s ASN 282 Ca 0.12 -2.99 -0.04 0.00 0.42 0.00 0.00 52.86 50.37 3m4p s ASN 282 Cb 0.17 -0.41 0.36 0.00 -1.45 0.00 0.00 41.25 39.93 3m4p s ASN 282 CO 0.75 -0.18 1.93 -0.65 -3.72 0.00 0.00 177.10 175.23 3m4p h PRO 283 N 5.73 1.14 -0.95 0.43 0.11 -1.77 -3.00 132.00 133.69 3m4p h PRO 283 Ca 0.25 -0.10 -0.10 0.00 0.11 0.00 0.00 66.00 66.17 3m4p h PRO 283 Cb 0.92 -0.24 -0.06 0.00 0.11 0.00 0.00 31.00 31.73 3m4p h PRO 283 CO 0.36 0.79 0.13 0.72 -0.21 0.00 0.00 178.00 179.78 3m4p n HIS 284 N -4.38 0.86 -2.40 0.65 8.25 -1.26 -4.90 115.22 112.04 3m4p n HIS 284 Ca 0.09 -0.65 -0.43 0.00 -0.26 0.00 0.00 57.72 56.47 3m4p n HIS 284 Cb 0.06 -0.38 -0.02 0.00 1.12 0.00 0.00 29.99 30.77 3m4p n HIS 284 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3m4p s LEU 285 N -0.99 3.90 -0.42 2.41 2.96 -1.13 -4.99 118.68 120.42 3m4p s LEU 285 Ca 0.18 1.26 -0.15 0.00 -0.22 0.00 0.00 54.13 55.20 3m4p s LEU 285 Cb 0.15 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.32 3m4p s LEU 285 CO 0.04 -1.07 0.33 -1.59 -1.32 0.00 0.00 176.35 172.74 3m4p s LYS 286 N 4.16 2.99 0.58 1.98 -2.85 -1.26 -5.08 119.74 120.26 3m4p s LYS 286 Ca 0.57 -1.01 -0.19 0.00 -1.00 0.00 0.00 55.97 54.35 3m4p s LYS 286 Cb -0.17 -3.99 -0.04 0.00 -2.06 0.00 0.00 37.83 31.56 3m4p s LYS 286 CO 0.23 -0.80 1.15 -0.51 0.10 0.00 0.00 175.35 175.53 3m4p s LEU 287 N 1.76 3.67 0.26 2.77 1.43 -1.26 -4.96 118.68 122.34 3m4p s LEU 287 Ca 0.06 2.23 -0.29 0.00 -1.03 0.00 0.00 54.13 55.10 3m4p s LEU 287 Cb -0.19 -4.58 -0.09 0.00 0.03 0.00 0.00 46.19 41.35 3m4p s LEU 287 CO 0.10 -1.41 1.16 -2.16 0.23 0.00 0.00 176.35 174.28 3m4p s PRO 288 N -3.40 4.55 0.05 1.29 0.04 -1.26 -5.00 135.00 131.26 3m4p s PRO 288 Ca 0.74 1.89 0.09 0.00 0.04 0.00 0.00 61.00 63.76 3m4p s PRO 288 Cb -0.26 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.07 3m4p s PRO 288 CO 0.31 0.05 -0.25 -0.08 0.04 0.00 0.00 177.00 177.07 3m4p s THR 289 N -0.80 2.07 -0.08 1.26 -1.32 -1.26 -4.94 115.64 110.56 3m4p s THR 289 Ca 0.48 -1.37 -0.15 0.00 -1.21 0.00 0.00 61.69 59.44 3m4p s THR 289 Cb -0.33 -1.77 -0.05 0.00 -1.51 0.00 0.00 72.50 68.84 3m4p s THR 289 CO 0.41 0.33 0.38 -0.13 -2.21 0.00 0.00 174.62 173.41 3m4p s ARG 290 N -1.25 4.11 0.70 7.08 0.52 -1.26 -3.57 118.95 125.28 3m4p s ARG 290 Ca 0.11 0.30 -0.11 0.00 -0.52 0.00 0.00 55.73 55.51 3m4p s ARG 290 Cb -0.10 -3.34 0.01 0.00 0.52 0.00 0.00 34.95 32.05 3m4p s ARG 290 CO 0.02 0.42 1.08 -1.25 0.02 0.00 0.00 175.30 175.59 3m4p s PRO 291 N -0.16 2.88 0.26 3.54 0.04 -1.26 -5.14 135.00 135.17 3m4p s PRO 291 Ca 0.22 0.57 -0.26 0.00 0.04 0.00 0.00 61.00 61.57 3m4p s PRO 291 Cb -0.15 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 3m4p s PRO 291 CO 0.09 -1.04 0.89 -0.06 0.04 0.00 0.00 177.00 176.92 3m4p s PHE 292 N -3.28 3.81 0.51 0.56 0.40 -1.23 -5.03 117.98 113.71 3m4p s PHE 292 Ca 0.58 1.76 -0.23 0.00 -0.60 0.00 0.00 56.93 58.44 3m4p s PHE 292 Cb -0.12 -2.88 -0.06 0.00 0.51 0.00 0.00 43.02 40.47 3m4p s PHE 292 CO 0.53 0.34 1.37 0.21 0.70 0.00 0.00 175.22 178.37 3m4p s LYS 293 N -1.65 3.35 0.07 0.44 2.20 -1.24 -4.84 119.74 118.07 3m4p s LYS 293 Ca 0.44 2.28 0.08 0.00 -0.36 0.00 0.00 55.97 58.41 3m4p s LYS 293 Cb -0.21 -2.40 -0.03 0.00 -1.51 0.00 0.00 37.83 33.68 3m4p s LYS 293 CO 0.26 -1.03 -0.21 1.03 -0.36 0.00 0.00 175.35 175.04 3m4p s ARG 294 N -2.74 1.28 -0.19 4.03 0.52 -1.26 -0.41 118.95 120.18 3m4p s ARG 294 Ca 0.68 -1.05 -0.09 0.00 -0.52 0.00 0.00 55.73 54.74 3m4p s ARG 294 Cb -0.41 -1.48 0.07 0.00 0.52 0.00 0.00 34.95 33.66 3m4p s ARG 294 CO 0.50 0.36 0.44 1.41 0.02 0.00 0.00 175.30 178.03 3m4p s MET 295 N -1.52 0.40 0.61 3.54 1.75 0.71 -4.93 119.30 119.85 3m4p s MET 295 Ca 0.07 0.92 -0.12 0.00 -1.25 0.00 0.00 55.69 55.32 3m4p s MET 295 Cb -0.09 0.13 -0.04 0.00 2.84 0.00 0.00 34.83 37.67 3m4p s MET 295 CO 0.03 -0.19 1.03 0.95 -0.65 0.00 0.00 175.02 176.18 3m4p s THR 296 N 1.88 4.65 0.24 10.11 -4.23 -1.26 0.02 115.64 127.05 3m4p s THR 296 Ca -0.07 0.92 -0.05 0.00 -1.18 0.00 0.00 61.69 61.31 3m4p s THR 296 Cb -0.09 -3.83 0.20 0.00 1.34 0.00 0.00 72.50 70.12 3m4p s THR 296 CO -0.13 -1.07 1.74 0.22 -0.54 0.00 0.00 174.62 174.83 3m4p h TYR 297 N -0.16 0.50 -0.41 3.99 3.20 -1.51 0.84 116.97 123.42 3m4p h TYR 297 Ca -0.44 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.48 3m4p h TYR 297 Cb 1.19 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.33 3m4p h TYR 297 CO 0.65 0.08 0.28 0.00 -1.64 0.00 0.00 178.16 177.53 3m4p h ALA 298 N 1.52 1.75 -0.37 1.82 0.00 -1.88 -0.85 119.26 121.26 3m4p h ALA 298 Ca 0.39 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 3m4p h ALA 298 Cb 0.57 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3m4p h ALA 298 CO -0.38 0.21 -0.04 -0.44 0.00 0.00 0.00 179.25 178.61 3m4p h ASP 299 N 0.52 0.68 -0.06 0.00 3.32 -1.25 -2.26 116.42 117.37 3m4p h ASP 299 Ca 0.16 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 56.88 3m4p h ASP 299 Cb 0.01 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 3m4p h ASP 299 CO -0.04 0.85 0.04 0.00 -1.72 0.00 0.00 179.24 178.37 3m4p h ALA 300 N 0.85 0.08 -0.63 3.45 0.00 -0.42 0.28 119.26 122.88 3m4p h ALA 300 Ca 0.10 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.03 3m4p h ALA 300 Cb 0.52 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 3m4p h ALA 300 CO 0.03 -0.41 0.37 0.82 0.00 0.00 0.00 179.25 180.06 3m4p h ILE 301 N 0.06 1.03 0.00 0.00 2.04 -1.17 0.12 117.51 119.60 3m4p h ILE 301 Ca 0.02 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 3m4p h ILE 301 Cb 0.02 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.35 3m4p h ILE 301 CO -0.00 0.13 -0.00 0.50 0.00 0.00 0.00 178.15 178.78 3m4p h LYS 302 N 0.72 -0.00 -0.41 2.37 3.64 -1.10 -0.75 116.57 121.04 3m4p h LYS 302 Ca 0.26 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.73 3m4p h LYS 302 Cb 0.08 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.82 3m4p h LYS 302 CO -0.13 0.16 -0.15 -0.92 -2.27 0.00 0.00 179.45 176.14 3m4p h TYR 303 N -0.16 -0.34 -0.21 1.91 3.20 0.12 0.18 116.97 121.67 3m4p h TYR 303 Ca -0.00 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 3m4p h TYR 303 Cb 0.16 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 3m4p h TYR 303 CO -0.02 -0.23 0.07 0.00 -1.64 0.00 0.00 178.16 176.34 3m4p h ASN 305 N 0.17 0.79 0.78 0.00 2.35 -0.74 -0.10 115.58 118.83 3m4p h ASN 305 Ca 0.07 -0.01 -0.17 0.00 -0.55 0.00 0.00 56.30 55.64 3m4p h ASN 305 Cb 0.20 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 3m4p h ASN 305 CO -0.00 0.55 -0.81 0.44 -1.65 0.00 0.00 177.43 175.95 3m4p h ASP 306 N 0.92 0.02 -0.33 5.81 3.32 0.01 -3.21 116.42 122.97 3m4p h ASP 306 Ca 0.29 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.32 3m4p h ASP 306 Cb 0.03 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3m4p h ASP 306 CO -0.08 0.82 0.00 1.41 -1.72 0.00 0.00 179.24 179.67 3m4p n HIS 307 N -3.59 0.42 -2.25 4.55 8.25 -0.05 -4.98 115.22 117.58 3m4p n HIS 307 Ca -0.01 -0.26 -0.13 0.00 -0.26 0.00 0.00 57.72 57.07 3m4p n HIS 307 Cb 0.78 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.88 3m4p n HIS 307 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3m4p n GLY 308 N 1.19 -0.15 3.53 -1.41 0.00 -0.22 -4.95 105.19 103.19 3m4p n GLY 308 Ca 0.16 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 3m4p n GLY 308 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m4p s ILE 309 N -2.63 3.99 0.84 -0.61 1.01 -0.25 -5.00 121.20 118.55 3m4p s ILE 309 Ca 0.00 -0.48 -0.11 0.00 0.00 0.00 0.00 60.65 60.06 3m4p s ILE 309 Cb -0.00 -4.95 0.09 0.00 0.01 0.00 0.00 42.46 37.61 3m4p s ILE 309 CO 0.00 -1.82 1.09 -0.76 0.00 0.00 0.00 174.94 173.45 3m4p s LEU 310 N 4.85 2.61 0.10 2.97 1.43 -1.26 -4.56 118.68 124.82 3m4p s LEU 310 Ca 0.39 1.62 -0.16 0.00 -1.03 0.00 0.00 54.13 54.96 3m4p s LEU 310 Cb -0.04 -4.18 -0.06 0.00 0.03 0.00 0.00 46.19 41.94 3m4p s LEU 310 CO -0.01 -2.34 1.50 -1.13 0.23 0.00 0.00 176.35 174.60 3m4p h ASN 311 N -1.34 0.65 0.00 2.29 -0.00 0.78 -3.46 115.58 114.50 3m4p h ASN 311 Ca -0.47 -0.37 0.00 0.00 -0.00 0.00 0.00 56.30 55.46 3m4p h ASN 311 Cb 1.26 -0.18 0.00 0.00 -0.00 0.00 0.00 38.32 39.40 3m4p h ASN 311 CO 0.53 0.87 0.00 0.29 -0.00 0.00 0.00 177.43 179.13 3m4p n LYS 312 N -4.42 0.00 0.00 6.67 4.01 -1.26 -4.92 118.16 118.24 3m4p n LYS 312 Ca -0.02 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.78 3m4p n LYS 312 Cb 0.34 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.86 3m4p n LYS 312 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 3m4p n ASP 313 N -3.36 1.44 -4.10 4.39 5.75 -1.26 -5.08 116.55 114.33 3m4p n ASP 313 Ca 0.00 -1.54 -0.10 0.00 -0.01 0.00 0.00 54.79 53.13 3m4p n ASP 313 Cb 0.00 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 39.98 3m4p n ASP 313 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3m4p s LYS 314 N -0.54 0.64 0.70 0.11 1.02 -1.26 -5.11 119.74 115.30 3m4p s LYS 314 Ca 0.00 -1.05 -0.12 0.00 0.02 0.00 0.00 55.97 54.82 3m4p s LYS 314 Cb 0.00 -0.11 0.02 0.00 -0.52 0.00 0.00 37.83 37.21 3m4p s LYS 314 CO 0.00 -0.02 1.08 -1.25 -0.92 0.00 0.00 175.35 174.24 3m4p s PRO 315 N -2.89 2.76 0.99 -1.68 0.04 -1.26 0.13 135.00 133.08 3m4p s PRO 315 Ca 0.01 1.13 -0.12 0.00 0.04 0.00 0.00 61.00 62.06 3m4p s PRO 315 Cb -0.01 -1.96 0.18 0.00 0.04 0.00 0.00 34.50 32.76 3m4p s PRO 315 CO -0.04 -1.25 1.09 -0.06 0.04 0.00 0.00 177.00 176.78 3m4p s PHE 316 N -2.80 2.14 -0.03 0.56 0.08 -1.26 -4.64 117.98 112.02 3m4p s PHE 316 Ca 0.61 1.01 -0.07 0.00 0.12 0.00 0.00 56.93 58.60 3m4p s PHE 316 Cb -0.16 -3.26 0.01 0.00 -0.57 0.00 0.00 43.02 39.04 3m4p s PHE 316 CO 0.50 -2.83 0.16 -2.00 -0.10 0.00 0.00 175.22 170.95 3m4p s GLU 317 N -4.98 0.34 -0.05 0.44 2.56 -1.26 -5.00 118.70 110.76 3m4p s GLU 317 Ca 0.65 -0.06 -0.30 0.00 0.00 0.00 0.00 54.97 55.27 3m4p s GLU 317 Cb -0.18 0.15 -0.06 0.00 2.00 0.00 0.00 34.13 36.04 3m4p s GLU 317 CO 0.57 -0.07 1.66 -0.47 -0.56 0.00 0.00 175.26 176.40 3m4p s TYR 318 N -0.61 1.97 0.00 5.30 5.04 -1.26 -2.14 117.35 125.65 3m4p s TYR 318 Ca -0.07 0.17 0.00 0.00 -2.44 0.00 0.00 57.07 54.73 3m4p s TYR 318 Cb -0.04 -3.93 0.00 0.00 0.35 0.00 0.00 41.96 38.34 3m4p s TYR 318 CO 0.01 -3.91 0.00 0.41 -1.34 0.00 0.00 175.55 170.72 3m4p n GLY 319 N 4.14 1.04 3.82 8.97 0.00 -1.26 -5.12 105.19 116.79 3m4p n GLY 319 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 3m4p n GLY 319 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m4p s GLU 320 N 0.00 4.21 0.36 1.61 2.02 -0.91 -4.97 118.70 121.03 3m4p s GLU 320 Ca 0.00 0.99 -0.20 0.00 0.02 0.00 0.00 54.97 55.78 3m4p s GLU 320 Cb 0.00 -2.39 -0.10 0.00 0.10 0.00 0.00 34.13 31.74 3m4p s GLU 320 CO 0.00 0.10 0.87 0.34 0.02 0.00 0.00 175.26 176.59 3m4p s ASP 321 N -2.09 6.99 -0.37 -0.19 2.15 -1.26 -4.93 116.67 116.96 3m4p s ASP 321 Ca 0.57 1.59 -0.13 0.00 0.43 0.00 0.00 52.55 55.01 3m4p s ASP 321 Cb -0.11 -2.49 0.01 0.00 -0.30 0.00 0.00 42.92 40.03 3m4p s ASP 321 CO 0.16 -0.22 0.24 -0.63 -0.17 0.00 0.00 175.17 174.55 3m4p s ILE 322 N -1.95 4.97 0.13 4.11 1.01 -1.26 -5.09 121.20 123.12 3m4p s ILE 322 Ca 0.56 -0.59 -0.02 0.00 0.00 0.00 0.00 60.65 60.60 3m4p s ILE 322 Cb -0.12 -3.69 0.03 0.00 0.01 0.00 0.00 42.46 38.69 3m4p s ILE 322 CO 0.17 -0.17 0.17 -1.54 0.00 0.00 0.00 174.94 173.57 3m4p n SER 323 N 5.08 -0.03 0.36 3.58 3.41 -1.26 -4.74 113.62 120.01 3m4p n SER 323 Ca -0.12 -1.05 -0.18 0.00 -0.26 0.00 0.00 58.87 57.26 3m4p n SER 323 Cb 0.48 -0.13 -0.09 0.00 -0.26 0.00 0.00 64.21 64.20 3m4p n SER 323 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3m4p h GLU 324 N 0.00 -1.01 -0.58 4.33 4.81 -1.98 -2.41 114.58 117.73 3m4p h GLU 324 Ca -0.06 0.07 0.09 0.00 -0.13 0.00 0.00 59.36 59.33 3m4p h GLU 324 Cb 0.15 0.23 -0.07 0.00 0.63 0.00 0.00 28.75 29.70 3m4p h GLU 324 CO 0.04 -0.67 0.22 -0.22 -0.73 0.00 0.00 179.01 177.64 3m4p h LYS 325 N -1.05 0.39 -0.12 1.92 3.64 -1.98 0.60 116.57 119.98 3m4p h LYS 325 Ca -0.08 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 3m4p h LYS 325 Cb 0.87 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3m4p h LYS 325 CO 0.04 0.26 -0.03 -1.00 -2.27 0.00 0.00 179.45 176.44 3m4p h PRO 326 N 0.40 0.23 -0.81 1.90 0.13 -1.89 0.23 132.00 132.20 3m4p h PRO 326 Ca 0.29 -0.09 0.13 0.00 -0.87 0.00 0.00 66.00 65.46 3m4p h PRO 326 Cb 0.35 -0.01 -0.09 0.00 0.13 0.00 0.00 31.00 31.38 3m4p h PRO 326 CO -0.29 0.54 0.41 0.93 -0.23 0.00 0.00 178.00 179.36 3m4p h GLU 327 N -0.09 0.60 -0.31 0.86 5.08 -0.82 0.42 114.58 120.32 3m4p h GLU 327 Ca 0.03 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 3m4p h GLU 327 Cb 0.46 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 3m4p h GLU 327 CO 0.01 0.40 -0.23 -0.09 -1.00 0.00 0.00 179.01 178.10 3m4p h ARG 328 N 0.62 0.71 0.33 2.33 2.43 0.25 0.02 114.38 121.06 3m4p h ARG 328 Ca 0.43 -0.34 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 3m4p h ARG 328 Cb 0.55 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.10 3m4p h ARG 328 CO -0.33 0.95 -0.20 1.96 -1.51 0.00 0.00 179.97 180.84 3m4p h GLN 329 N 0.46 -0.49 0.23 0.20 4.20 0.19 0.98 115.11 120.89 3m4p h GLN 329 Ca 0.06 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.81 3m4p h GLN 329 Cb 0.79 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.66 3m4p h GLN 329 CO 0.06 -0.33 -0.23 1.98 -0.67 0.00 0.00 178.83 179.64 3m4p h MET 330 N -0.51 -0.48 -0.95 1.46 4.05 -0.19 0.83 114.93 119.15 3m4p h MET 330 Ca -0.03 0.03 0.05 0.00 -0.28 0.00 0.00 59.70 59.47 3m4p h MET 330 Cb 0.42 0.11 -0.06 0.00 -0.80 0.00 0.00 31.60 31.27 3m4p h MET 330 CO 0.04 -0.32 0.62 1.15 0.23 0.00 0.00 176.91 178.62 3m4p h THR 331 N -0.50 1.11 -0.60 -0.77 2.02 -0.97 -1.62 112.91 111.58 3m4p h THR 331 Ca -0.00 -0.39 -0.10 0.00 0.77 0.00 0.00 66.41 66.70 3m4p h THR 331 Cb 0.47 -0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 3m4p h THR 331 CO -0.05 0.21 0.00 0.44 0.37 0.00 0.00 175.52 176.48 3m4p h ASP 332 N 1.12 1.04 -0.45 4.18 5.19 -0.23 0.26 116.42 127.53 3m4p h ASP 332 Ca 0.40 -0.30 -0.12 0.00 -0.62 0.00 0.00 57.03 56.38 3m4p h ASP 332 Cb 0.12 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 3m4p h ASP 332 CO -0.14 1.09 -0.20 -0.33 -3.12 0.00 0.00 179.24 176.54 3m4p h GLU 333 N 0.96 0.93 0.00 3.56 5.08 -0.25 -2.87 114.58 122.01 3m4p h GLU 333 Ca 0.17 -0.40 -0.20 0.00 -1.00 0.00 0.00 59.36 57.93 3m4p h GLU 333 Cb 0.55 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 3m4p h GLU 333 CO 0.03 1.06 -0.89 0.82 -1.00 0.00 0.00 179.01 179.03 3m4p h ILE 334 N 0.77 1.49 -3.14 3.13 2.04 -1.30 -3.48 117.51 117.01 3m4p h ILE 334 Ca 0.10 -2.61 -0.24 0.00 1.00 0.00 0.00 64.86 63.11 3m4p h ILE 334 Cb 0.77 2.47 0.05 0.00 -0.74 0.00 0.00 36.82 39.37 3m4p h ILE 334 CO 0.06 0.76 -0.37 0.61 0.00 0.00 0.00 178.15 179.21 3m4p n GLY 335 N 0.89 -0.00 3.57 5.37 0.00 0.90 -5.01 105.19 110.91 3m4p n GLY 335 Ca -0.04 -0.21 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 3m4p n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m4p s PRO 337 N -3.89 3.42 -0.05 0.00 0.02 -1.26 -4.47 135.00 128.76 3m4p s PRO 337 Ca 0.10 2.35 -0.01 0.00 0.02 0.00 0.00 61.00 63.46 3m4p s PRO 337 Cb -0.02 -2.47 0.03 0.00 0.02 0.00 0.00 34.50 32.06 3m4p s PRO 337 CO -0.01 -1.01 0.01 0.42 -0.33 0.00 0.00 177.00 176.09 3m4p s ILE 338 N -1.24 0.24 -0.29 2.83 1.01 -0.77 -3.68 121.20 119.29 3m4p s ILE 338 Ca 0.66 0.17 -0.29 0.00 0.00 0.00 0.00 60.65 61.19 3m4p s ILE 338 Cb -0.43 -0.40 -0.00 0.00 0.01 0.00 0.00 42.46 41.64 3m4p s ILE 338 CO 0.53 0.22 1.31 -0.36 0.00 0.00 0.00 174.94 176.64 3m4p s PHE 339 N 1.78 2.67 -0.35 3.97 0.08 0.46 -0.91 117.98 125.67 3m4p s PHE 339 Ca 0.01 0.86 -0.12 0.00 0.12 0.00 0.00 56.93 57.81 3m4p s PHE 339 Cb -0.13 -3.90 0.00 0.00 -0.57 0.00 0.00 43.02 38.43 3m4p s PHE 339 CO -0.04 -1.75 0.21 1.41 -0.10 0.00 0.00 175.22 174.96 3m4p s MET 340 N 4.16 3.19 0.35 0.44 1.75 0.92 -0.20 119.30 129.91 3m4p s MET 340 Ca 0.57 -0.84 0.09 0.00 -1.25 0.00 0.00 55.69 54.26 3m4p s MET 340 Cb -0.17 -3.74 -0.07 0.00 2.84 0.00 0.00 34.83 33.70 3m4p s MET 340 CO 0.23 -0.55 -0.08 0.96 -0.65 0.00 0.00 175.02 174.93 3m4p s ILE 341 N 1.64 2.17 -1.11 10.11 -4.36 0.10 -0.77 121.20 128.98 3m4p s ILE 341 Ca 0.04 -2.18 -0.11 0.00 -0.26 0.00 0.00 60.65 58.14 3m4p s ILE 341 Cb -0.18 -2.67 -0.04 0.00 1.25 0.00 0.00 42.46 40.82 3m4p s ILE 341 CO 0.08 -0.19 0.86 1.41 0.24 0.00 0.00 174.94 177.34 3m4p n HIS 342 N -0.80 -2.21 -1.82 1.37 8.25 -0.66 -1.85 115.22 117.50 3m4p n HIS 342 Ca -0.05 0.71 -0.31 0.00 -0.26 0.00 0.00 57.72 57.81 3m4p n HIS 342 Cb 0.64 -3.92 0.02 0.00 1.12 0.00 0.00 29.99 27.85 3m4p n HIS 342 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3m4p s PHE 343 N -3.44 3.33 0.55 4.41 0.08 -1.25 -4.07 117.98 117.60 3m4p s PHE 343 Ca 0.42 1.39 -0.20 0.00 0.12 0.00 0.00 56.93 58.65 3m4p s PHE 343 Cb -0.09 -2.82 -0.05 0.00 -0.57 0.00 0.00 43.02 39.48 3m4p s PHE 343 CO 0.79 -0.92 1.21 -2.14 -0.10 0.00 0.00 175.22 174.05 3m4p s PRO 344 N -4.90 3.22 0.09 0.24 0.02 -1.26 0.05 135.00 132.47 3m4p s PRO 344 Ca 0.58 1.84 -0.23 0.00 0.02 0.00 0.00 61.00 63.20 3m4p s PRO 344 Cb -0.13 -2.08 -0.15 0.00 0.02 0.00 0.00 34.50 32.16 3m4p s PRO 344 CO 0.50 -1.01 1.74 0.77 -0.33 0.00 0.00 177.00 178.67 3m4p h SER 345 N 1.26 -0.01 0.00 2.53 0.02 -0.46 -2.23 113.55 114.64 3m4p h SER 345 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 3m4p h SER 345 Cb 1.28 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.83 3m4p h SER 345 CO 0.57 -0.01 0.36 0.11 -1.14 0.00 0.00 176.83 176.72 3m4p h LYS 346 N -0.01 0.00 -0.02 3.45 6.56 -1.93 -1.25 116.57 123.37 3m4p h LYS 346 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 3m4p h LYS 346 Cb 0.01 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.67 3m4p h LYS 346 CO -0.01 0.00 -0.05 -0.12 -2.06 0.00 0.00 179.45 177.22 3m4p n MET 347 N -2.38 1.51 -4.26 3.15 0.00 -0.84 -5.02 117.12 109.28 3m4p n MET 347 Ca -0.01 -1.47 -0.14 0.00 0.00 0.00 0.00 57.70 56.08 3m4p n MET 347 Cb 0.39 -1.34 -0.10 0.00 0.00 0.00 0.00 33.22 32.17 3m4p n MET 347 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 3m4p s LYS 348 N -1.56 1.24 0.72 2.12 -0.14 -0.47 -4.99 119.74 116.65 3m4p s LYS 348 Ca 0.20 -1.64 -0.16 0.00 -1.36 0.00 0.00 55.97 53.01 3m4p s LYS 348 Cb 0.15 -0.10 0.03 0.00 -1.68 0.00 0.00 37.83 36.23 3m4p s LYS 348 CO 0.25 -0.27 1.25 0.00 -0.76 0.00 0.00 175.35 175.82 3m4p s ALA 349 N -3.85 2.13 0.41 5.17 0.00 -1.26 -4.91 121.76 119.45 3m4p s ALA 349 Ca 0.33 1.03 0.09 0.00 0.00 0.00 0.00 51.96 53.41 3m4p s ALA 349 Cb 0.07 -3.52 0.89 0.00 0.00 0.00 0.00 23.12 20.56 3m4p s ALA 349 CO 0.10 -1.91 2.02 0.27 0.00 0.00 0.00 175.76 176.24 3m4p h PHE 350 N -0.12 0.54 0.00 0.00 -5.15 -1.94 -3.06 116.94 107.20 3m4p h PHE 350 Ca -0.49 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.30 3m4p h PHE 350 Cb 1.32 -0.18 0.00 0.00 0.22 0.00 0.00 35.95 37.31 3m4p h PHE 350 CO 0.44 0.31 0.00 2.48 -2.00 0.00 0.00 178.31 179.54 3m4p n TYR 351 N -4.47 0.00 -2.54 6.09 0.18 -1.26 -4.87 117.16 110.28 3m4p n TYR 351 Ca 0.06 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.43 3m4p n TYR 351 Cb 0.17 -0.49 -0.04 0.00 -0.38 0.00 0.00 39.34 38.61 3m4p n TYR 351 CO 0.00 0.00 0.00 -1.64 -2.08 0.00 0.00 176.86 173.14 3m4p s MET 352 N -2.98 4.58 0.51 -3.48 -1.94 -1.16 -0.22 119.30 114.60 3m4p s MET 352 Ca 0.13 1.66 -0.19 0.00 -1.71 0.00 0.00 55.69 55.58 3m4p s MET 352 Cb 0.17 -3.32 -0.08 0.00 2.01 0.00 0.00 34.83 33.61 3m4p s MET 352 CO 0.46 0.02 1.03 -1.54 -0.01 0.00 0.00 175.02 174.98 3m4p s SER 353 N 0.22 6.29 0.37 3.03 1.04 -0.69 -4.51 113.70 119.45 3m4p s SER 353 Ca 0.51 1.86 -0.04 0.00 0.48 0.00 0.00 55.95 58.76 3m4p s SER 353 Cb -0.28 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.25 3m4p s SER 353 CO 0.32 -0.82 0.64 -0.54 0.98 0.00 0.00 173.24 173.83 3m4p s LYS 354 N -3.46 3.57 0.03 4.02 -0.14 -1.26 -0.50 119.74 121.99 3m4p s LYS 354 Ca 0.66 -0.00 -0.30 0.00 -1.36 0.00 0.00 55.97 54.96 3m4p s LYS 354 Cb -0.15 -2.55 -0.05 0.00 -1.68 0.00 0.00 37.83 33.39 3m4p s LYS 354 CO 0.24 0.05 1.24 0.08 -0.76 0.00 0.00 175.35 176.20 3m4p s VAL 355 N -2.37 4.00 -0.01 3.17 1.01 -0.86 -4.64 120.40 120.70 3m4p s VAL 355 Ca 0.44 1.41 -0.30 0.00 0.00 0.00 0.00 61.98 63.53 3m4p s VAL 355 Cb -0.10 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 3m4p s VAL 355 CO 0.36 0.07 1.38 -2.16 0.00 0.00 0.00 175.10 174.75 3m4p s PRO 356 N 1.52 4.29 0.00 2.72 0.04 -1.26 -1.26 135.00 141.04 3m4p s PRO 356 Ca 0.59 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.56 3m4p s PRO 356 Cb -0.29 -3.59 0.00 0.00 0.04 0.00 0.00 34.50 30.66 3m4p s PRO 356 CO 0.27 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.15 3m4p n GLY 357 N 3.63 0.73 2.72 0.56 0.00 -1.26 -4.98 105.19 106.58 3m4p n GLY 357 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.05 3m4p n GLY 357 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3m4p s HIS 358 N -2.56 -0.91 0.50 1.61 3.76 -0.39 -5.02 115.29 112.29 3m4p s HIS 358 Ca 0.00 -0.91 0.23 0.00 -0.15 0.00 0.00 55.06 54.22 3m4p s HIS 358 Cb 0.00 -0.02 1.30 0.00 1.11 0.00 0.00 32.58 34.97 3m4p s HIS 358 CO 0.00 -1.14 1.97 -1.35 -0.85 0.00 0.00 174.74 173.37 3m4p h PRO 359 N 5.50 0.12 0.00 8.40 0.11 -1.94 -2.35 132.00 141.83 3m4p h PRO 359 Ca 0.11 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 3m4p h PRO 359 Cb 1.07 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 3m4p h PRO 359 CO 0.12 0.08 -0.03 0.38 -0.21 0.00 0.00 178.00 178.33 3m4p h ASP 360 N 0.12 0.00 -2.17 -2.05 2.03 -1.95 -3.45 116.42 108.95 3m4p h ASP 360 Ca 0.29 0.00 -0.50 0.00 -0.73 0.00 0.00 57.03 56.09 3m4p h ASP 360 Cb 0.98 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.43 3m4p h ASP 360 CO -0.03 0.03 -0.52 -0.76 -1.03 0.00 0.00 179.24 176.92 3m4p s LEU 361 N -6.31 3.80 0.24 0.15 1.43 -0.89 0.24 118.68 117.34 3m4p s LEU 361 Ca -0.00 -0.27 0.10 0.00 -1.03 0.00 0.00 54.13 52.93 3m4p s LEU 361 Cb 0.10 -2.34 -0.05 0.00 0.03 0.00 0.00 46.19 43.94 3m4p s LEU 361 CO 0.53 -0.06 -0.13 0.42 0.23 0.00 0.00 176.35 177.33 3m4p s THR 362 N -2.15 2.89 -1.33 5.49 -4.23 0.11 -2.02 115.64 114.39 3m4p s THR 362 Ca 0.34 -2.03 -0.08 0.00 -1.18 0.00 0.00 61.69 58.74 3m4p s THR 362 Cb -0.08 -2.48 0.12 0.00 1.34 0.00 0.00 72.50 71.40 3m4p s THR 362 CO 0.25 -0.27 2.18 -0.62 -0.54 0.00 0.00 174.62 175.62 3m4p n GLU 363 N -0.37 3.97 -4.63 3.99 1.02 0.34 -3.75 120.64 121.22 3m4p n GLU 363 Ca -0.08 -3.35 -0.31 0.00 -0.02 0.00 0.00 57.16 53.40 3m4p n GLU 363 Cb 0.58 -2.82 -0.13 0.00 -0.02 0.00 0.00 31.44 29.05 3m4p n GLU 363 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3m4p s SER 364 N 0.88 3.82 -0.03 1.62 1.04 -1.26 -1.29 113.70 118.48 3m4p s SER 364 Ca 0.48 -0.43 0.02 0.00 0.48 0.00 0.00 55.95 56.50 3m4p s SER 364 Cb 0.14 -0.61 0.01 0.00 0.10 0.00 0.00 66.02 65.65 3m4p s SER 364 CO -0.04 0.25 -0.07 0.54 0.98 0.00 0.00 173.24 174.90 3m4p s VAL 365 N -0.94 0.64 -0.11 5.02 0.11 0.02 -1.66 120.40 123.48 3m4p s VAL 365 Ca 0.15 -0.26 0.02 0.00 -2.93 0.00 0.00 61.98 58.96 3m4p s VAL 365 Cb -0.10 -0.59 0.01 0.00 -1.53 0.00 0.00 36.38 34.17 3m4p s VAL 365 CO 0.06 0.21 -0.17 -1.81 -3.33 0.00 0.00 175.10 170.06 3m4p s ASP 366 N 0.34 2.58 -0.45 3.54 1.01 0.05 -0.86 116.67 122.89 3m4p s ASP 366 Ca -0.05 -0.46 -0.19 0.00 0.71 0.00 0.00 52.55 52.55 3m4p s ASP 366 Cb -0.09 -1.17 0.03 0.00 1.01 0.00 0.00 42.92 42.70 3m4p s ASP 366 CO 0.00 0.04 0.58 -0.22 0.21 0.00 0.00 175.17 175.79 3m4p s LEU 367 N 0.86 4.72 0.06 1.23 2.96 0.17 -0.05 118.68 128.63 3m4p s LEU 367 Ca -0.09 -0.58 -0.05 0.00 -0.22 0.00 0.00 54.13 53.19 3m4p s LEU 367 Cb -0.15 -2.56 -0.05 0.00 0.50 0.00 0.00 46.19 43.93 3m4p s LEU 367 CO -0.00 -0.76 0.30 -0.76 -1.32 0.00 0.00 176.35 173.81 3m4p s LEU 368 N 2.59 4.34 -0.05 -0.68 1.43 -0.09 -1.34 118.68 124.88 3m4p s LEU 368 Ca 0.18 0.53 0.02 0.00 -1.03 0.00 0.00 54.13 53.82 3m4p s LEU 368 Cb -0.16 -2.94 0.02 0.00 0.03 0.00 0.00 46.19 43.14 3m4p s LEU 368 CO 0.16 0.17 -0.08 -0.32 0.23 0.00 0.00 176.35 176.51 3m4p s MET 369 N -2.18 1.09 0.08 1.70 1.75 0.14 -1.86 119.30 120.03 3m4p s MET 369 Ca 0.33 -0.23 -0.35 0.00 -1.25 0.00 0.00 55.69 54.19 3m4p s MET 369 Cb -0.13 -1.00 -0.15 0.00 2.84 0.00 0.00 34.83 36.40 3m4p s MET 369 CO 0.21 -0.01 1.55 -2.30 -0.65 0.00 0.00 175.02 173.82 3m4p n PRO 370 N 3.80 1.80 0.00 4.11 -0.02 -1.26 -0.77 135.00 142.67 3m4p n PRO 370 Ca -0.23 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 3m4p n PRO 370 Cb 0.52 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 3m4p n PRO 370 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m4p n GLY 371 N 3.31 3.03 0.00 -1.23 0.00 -1.26 -4.69 105.19 104.35 3m4p n GLY 371 Ca 0.19 -0.82 0.05 0.00 0.00 0.00 0.00 46.02 45.43 3m4p n GLY 371 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3m4p n VAL 372 N 0.00 0.00 -1.60 1.61 0.24 -1.11 -5.08 118.33 112.39 3m4p n VAL 372 Ca 0.00 -0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 3m4p n VAL 372 Cb 0.00 0.31 0.00 0.00 -1.47 0.00 0.00 33.84 32.68 3m4p n VAL 372 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3m4p n GLY 373 N 1.93 0.67 3.62 7.63 0.00 0.05 -4.84 105.19 114.25 3m4p n GLY 373 Ca -0.02 -1.20 -0.43 0.00 0.00 0.00 0.00 46.02 44.38 3m4p n GLY 373 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3m4p s GLU 374 N 0.00 3.62 -0.05 1.61 2.12 -1.26 0.27 118.70 125.02 3m4p s GLU 374 Ca 0.00 1.62 0.21 0.00 0.36 0.00 0.00 54.97 57.17 3m4p s GLU 374 Cb 0.00 -4.11 -0.33 0.00 0.26 0.00 0.00 34.13 29.96 3m4p s GLU 374 CO 0.00 -1.51 0.43 0.44 -0.54 0.00 0.00 175.26 174.09 3m4p n ILE 375 N 6.79 0.13 -3.78 -3.70 -5.35 -0.45 -4.93 119.36 108.07 3m4p n ILE 375 Ca 0.21 -0.52 -0.14 0.00 -0.27 0.00 0.00 62.75 62.02 3m4p n ILE 375 Cb 0.46 -0.04 -0.15 0.00 -1.74 0.00 0.00 39.64 38.17 3m4p n ILE 375 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 3m4p s VAL 376 N -3.39 -0.05 -0.05 7.28 1.01 -1.20 -1.78 120.40 122.23 3m4p s VAL 376 Ca -0.08 0.18 0.06 0.00 0.00 0.00 0.00 61.98 62.14 3m4p s VAL 376 Cb 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 36.38 36.37 3m4p s VAL 376 CO 0.89 0.07 -0.24 -0.83 0.00 0.00 0.00 175.10 174.99 3m4p s GLY 377 N 0.96 1.22 0.37 4.51 0.00 -0.56 -0.65 107.32 113.16 3m4p s GLY 377 Ca -0.08 -1.00 -0.16 0.00 0.00 0.00 0.00 44.72 43.49 3m4p s GLY 377 CO -0.03 -0.67 0.76 -0.32 0.00 0.00 0.00 173.10 172.84 3m4p s GLY 378 N -0.24 0.38 0.05 0.20 0.00 -0.03 -0.06 107.32 107.62 3m4p s GLY 378 Ca -0.00 -0.74 -0.28 0.00 0.00 0.00 0.00 44.72 43.69 3m4p s GLY 378 CO 0.02 -0.33 1.11 -1.35 0.00 0.00 0.00 173.10 172.55 3m4p s SER 379 N -3.06 -0.14 0.50 1.64 1.04 -0.76 -0.80 113.70 112.12 3m4p s SER 379 Ca 0.16 -0.24 -0.10 0.00 0.48 0.00 0.00 55.95 56.24 3m4p s SER 379 Cb -0.05 0.33 -0.05 0.00 0.10 0.00 0.00 66.02 66.34 3m4p s SER 379 CO 0.11 -0.59 0.88 -0.04 0.98 0.00 0.00 173.24 174.58 3m4p s MET 380 N -2.87 3.71 0.10 4.02 -1.94 -0.41 -1.91 119.30 119.99 3m4p s MET 380 Ca 0.12 0.56 0.07 0.00 -1.71 0.00 0.00 55.69 54.74 3m4p s MET 380 Cb 0.01 -2.26 -0.04 0.00 2.01 0.00 0.00 34.83 34.55 3m4p s MET 380 CO -0.01 -0.25 -0.12 1.03 -0.01 0.00 0.00 175.02 175.65 3m4p s ARG 381 N -4.43 2.07 0.05 2.03 1.81 -0.47 -1.70 118.95 118.32 3m4p s ARG 381 Ca 0.53 -1.04 -0.32 0.00 -1.72 0.00 0.00 55.73 53.18 3m4p s ARG 381 Cb -0.10 -2.26 -0.11 0.00 -0.45 0.00 0.00 34.95 32.02 3m4p s ARG 381 CO 0.40 0.51 1.85 -0.89 -0.68 0.00 0.00 175.30 176.49 3m4p n ILE 382 N 0.84 0.48 -0.04 1.52 5.41 0.69 -4.45 119.36 123.81 3m4p n ILE 382 Ca -0.14 -0.09 0.02 0.00 1.00 0.00 0.00 62.75 63.54 3m4p n ILE 382 Cb 0.52 -2.04 0.05 0.00 -0.71 0.00 0.00 39.64 37.46 3m4p n ILE 382 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 176.55 173.88 3m4p n TRP 383 N 6.09 0.14 -3.63 1.39 4.27 -1.26 -4.93 117.44 119.51 3m4p n TRP 383 Ca 0.20 -0.45 -0.38 0.00 -3.89 0.00 0.00 57.50 52.98 3m4p n TRP 383 Cb 0.35 -0.04 -0.11 0.00 -1.36 0.00 0.00 31.31 30.15 3m4p n TRP 383 CO 0.00 0.00 0.00 1.21 -2.29 0.00 0.00 177.69 176.61 3m4p s ASN 384 N -0.93 5.94 0.17 -0.67 3.84 -1.26 -4.74 114.94 117.28 3m4p s ASN 384 Ca 0.07 -0.01 -0.19 0.00 0.21 0.00 0.00 52.86 52.95 3m4p s ASN 384 Cb 0.04 -2.09 0.09 0.00 -0.55 0.00 0.00 41.25 38.74 3m4p s ASN 384 CO 0.05 -0.02 1.64 0.22 -2.79 0.00 0.00 177.10 176.20 3m4p h TYR 385 N 8.18 -0.44 -0.51 0.43 3.20 -1.93 -0.74 116.97 125.17 3m4p h TYR 385 Ca -0.36 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.49 3m4p h TYR 385 Cb 1.18 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.69 3m4p h TYR 385 CO 0.73 -0.26 0.08 -0.44 -1.64 0.00 0.00 178.16 176.64 3m4p h ASP 386 N -0.11 0.81 -0.76 -2.11 3.32 -1.95 -1.70 116.42 113.92 3m4p h ASP 386 Ca 0.19 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 3m4p h ASP 386 Cb 0.40 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.70 3m4p h ASP 386 CO -0.45 0.86 0.38 -0.08 -1.72 0.00 0.00 179.24 178.23 3m4p h GLU 387 N 0.72 1.09 -0.35 3.56 4.81 -1.87 -0.73 114.58 121.80 3m4p h GLU 387 Ca 0.15 -0.15 -0.13 0.00 -0.13 0.00 0.00 59.36 59.11 3m4p h GLU 387 Cb 0.40 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 3m4p h GLU 387 CO 0.01 0.83 -0.31 1.25 -0.73 0.00 0.00 179.01 180.07 3m4p h LEU 388 N 1.09 0.79 -0.55 1.64 5.85 -0.97 -1.54 115.31 121.62 3m4p h LEU 388 Ca 0.27 -0.32 -0.16 0.00 0.84 0.00 0.00 57.88 58.51 3m4p h LEU 388 Cb 0.09 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 3m4p h LEU 388 CO -0.04 1.04 -0.62 -0.03 -0.34 0.00 0.00 178.44 178.45 3m4p h MET 389 N 0.65 0.36 -0.22 1.25 4.05 -0.89 -1.68 114.93 118.45 3m4p h MET 389 Ca 0.07 -0.25 -0.06 0.00 -0.28 0.00 0.00 59.70 59.18 3m4p h MET 389 Cb 0.84 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.66 3m4p h MET 389 CO 0.07 0.87 -0.11 0.78 0.23 0.00 0.00 176.91 178.75 3m4p h GLY 390 N 1.32 0.38 2.00 1.39 0.00 -1.06 -2.45 103.07 104.65 3m4p h GLY 390 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3m4p h GLY 390 CO 0.10 0.22 0.00 0.00 0.00 0.00 0.00 176.54 176.87 3m4p h ALA 391 N 1.56 1.00 0.12 3.60 0.00 -0.37 -0.12 119.26 125.05 3m4p h ALA 391 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.76 3m4p h ALA 391 Cb 0.40 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.20 3m4p h ALA 391 CO 0.02 0.00 -1.08 1.88 0.00 0.00 0.00 179.25 180.08 3m4p h TYR 392 N 0.00 0.46 0.15 0.00 0.05 -0.97 -3.36 116.97 113.29 3m4p h TYR 392 Ca 0.00 -0.33 -0.01 0.00 0.05 0.00 0.00 58.73 58.44 3m4p h TYR 392 Cb 0.46 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.18 3m4p h TYR 392 CO 0.00 1.42 -0.07 -0.22 -1.05 0.00 0.00 178.16 178.24 3m4p h LYS 393 N -0.39 -0.19 -0.74 4.88 3.64 -1.15 0.78 116.57 123.41 3m4p h LYS 393 Ca -0.22 0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.33 3m4p h LYS 393 Cb 1.66 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.48 3m4p h LYS 393 CO 0.09 0.10 0.50 0.00 -2.27 0.00 0.00 179.45 177.86 3m4p h ALA 394 N 0.33 2.16 0.00 5.00 0.00 -1.24 0.05 119.26 125.56 3m4p h ALA 394 Ca -0.02 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.64 3m4p h ALA 394 Cb 0.37 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 3m4p h ALA 394 CO 0.03 -0.36 -1.71 0.09 0.00 0.00 0.00 179.25 177.30 3m4p n ASN 395 N -4.47 0.71 -0.74 0.00 3.02 -1.20 -5.03 115.26 107.56 3m4p n ASN 395 Ca 0.14 0.33 0.00 0.00 -0.03 0.00 0.00 54.58 55.02 3m4p n ASN 395 Cb 0.55 0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.95 3m4p n ASN 395 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3m4p n GLY 396 N 1.52 0.58 3.66 7.41 0.00 0.26 -5.08 105.19 113.53 3m4p n GLY 396 Ca -0.16 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.07 3m4p n GLY 396 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m4p s LEU 397 N -1.49 3.44 -0.36 0.99 1.43 -0.16 -5.01 118.68 117.52 3m4p s LEU 397 Ca 0.00 0.03 -0.29 0.00 -1.03 0.00 0.00 54.13 52.84 3m4p s LEU 397 Cb 0.00 -1.87 0.01 0.00 0.03 0.00 0.00 46.19 44.35 3m4p s LEU 397 CO 0.00 0.33 1.37 0.21 0.23 0.00 0.00 176.35 178.49 3m4p s ASN 398 N -1.18 6.47 0.00 2.29 3.84 -1.26 -4.63 114.94 120.46 3m4p s ASN 398 Ca 0.16 1.00 0.29 0.00 0.21 0.00 0.00 52.86 54.51 3m4p s ASN 398 Cb -0.11 -2.54 1.22 0.00 -0.55 0.00 0.00 41.25 39.26 3m4p s ASN 398 CO 0.06 -1.29 1.87 -0.81 -2.79 0.00 0.00 177.10 174.14 3m4p n PRO 399 N 7.76 0.44 -0.02 0.43 -0.04 -1.26 -4.23 135.00 138.08 3m4p n PRO 399 Ca 0.16 -0.12 -0.11 0.00 -0.04 0.00 0.00 63.50 63.39 3m4p n PRO 399 Cb 0.47 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.39 3m4p n PRO 399 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3m4p h ASP 400 N 0.28 0.16 0.34 3.54 3.32 -2.02 -2.62 116.42 119.42 3m4p h ASP 400 Ca 0.00 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.99 3m4p h ASP 400 Cb 0.38 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3m4p h ASP 400 CO 0.00 0.18 0.00 -0.65 -1.72 0.00 0.00 179.24 177.05 3m4p h PRO 401 N 0.13 0.00 -0.61 3.56 0.11 -2.02 -2.39 132.00 130.78 3m4p h PRO 401 Ca 0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.16 3m4p h PRO 401 Cb 0.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.16 3m4p h PRO 401 CO -0.01 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.44 3m4p n TYR 402 N -2.51 1.87 -0.29 0.65 4.01 -0.99 -4.62 117.16 115.28 3m4p n TYR 402 Ca -0.00 -0.67 0.12 0.00 -0.16 0.00 0.00 57.90 57.18 3m4p n TYR 402 Cb 0.13 -0.43 0.23 0.00 -0.31 0.00 0.00 39.34 38.96 3m4p n TYR 402 CO 0.00 0.00 0.00 2.48 -0.46 0.00 0.00 176.86 178.88 3m4p n TYR 403 N 0.73 0.51 0.25 -0.72 0.18 -0.90 0.22 117.16 117.42 3m4p n TYR 403 Ca 0.26 1.02 0.13 0.00 1.88 0.00 0.00 57.90 61.20 3m4p n TYR 403 Cb 1.09 -1.12 0.54 0.00 -0.38 0.00 0.00 39.34 39.48 3m4p n TYR 403 CO 0.00 0.00 0.00 0.11 -2.08 0.00 0.00 176.86 174.89 3m4p h TRP 404 N 0.00 0.00 0.08 -3.48 5.08 -1.88 0.84 115.95 116.59 3m4p h TRP 404 Ca 0.50 0.00 -0.27 0.00 1.08 0.00 0.00 58.89 60.20 3m4p h TRP 404 Cb 1.00 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.15 3m4p h TRP 404 CO -0.46 0.11 -1.45 -0.92 -1.28 0.00 0.00 178.44 174.44 3m4p h TYR 405 N 0.00 0.32 -0.61 0.12 3.20 -0.58 -3.37 116.97 116.05 3m4p h TYR 405 Ca -0.00 -0.23 -0.08 0.00 3.14 0.00 0.00 58.73 61.55 3m4p h TYR 405 Cb 0.66 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 3m4p h TYR 405 CO 0.00 1.57 0.06 1.15 -1.64 0.00 0.00 178.16 179.29 3m4p h THR 406 N -0.43 1.26 0.00 1.81 2.02 -0.62 -3.03 112.91 113.92 3m4p h THR 406 Ca -0.33 -1.06 0.00 0.00 0.77 0.00 0.00 66.41 65.79 3m4p h THR 406 Cb 1.67 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 3m4p h THR 406 CO -0.01 0.39 0.00 1.56 0.37 0.00 0.00 175.52 177.83 3m4p h GLN 407 N 0.95 0.00 0.00 6.66 4.20 -1.00 0.20 115.11 126.12 3m4p h GLN 407 Ca 0.18 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 3m4p h GLN 407 Cb 0.47 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.25 3m4p h GLN 407 CO 0.02 0.00 -0.09 1.96 -0.67 0.00 0.00 178.83 180.05 3m4p h GLN 408 N 0.00 0.00 0.00 1.46 1.08 -1.69 -1.69 115.11 114.28 3m4p h GLN 408 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3m4p h GLN 408 Cb 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 3m4p h GLN 408 CO 0.00 0.09 -0.47 0.00 -0.95 0.00 0.00 178.83 177.49 3m4p h ARG 409 N 0.00 0.00 0.13 1.46 -0.00 -1.14 -3.26 114.38 111.57 3m4p h ARG 409 Ca -0.00 0.00 -0.33 0.00 -0.50 0.00 0.00 59.98 59.14 3m4p h ARG 409 Cb 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.21 3m4p h ARG 409 CO 0.01 0.00 -1.77 -0.22 0.00 0.00 0.00 179.97 177.99 3m4p h LYS 410 N 0.00 0.27 -3.99 0.04 3.64 -1.39 -3.37 116.57 111.77 3m4p h LYS 410 Ca 0.00 -0.46 -0.71 0.00 -1.27 0.00 0.00 60.65 58.22 3m4p h LYS 410 Cb 0.86 0.17 -0.33 0.00 -0.41 0.00 0.00 32.23 32.51 3m4p h LYS 410 CO 0.00 1.22 -0.39 0.71 -2.27 0.00 0.00 179.45 178.72 3m4p s TYR 411 N -2.53 3.49 -0.96 1.91 2.02 -0.71 -4.77 117.35 115.80 3m4p s TYR 411 Ca -0.21 -2.44 -0.05 0.00 -0.37 0.00 0.00 57.07 54.00 3m4p s TYR 411 Cb 0.06 -3.30 -0.06 0.00 -0.40 0.00 0.00 41.96 38.26 3m4p s TYR 411 CO 0.77 -0.92 0.84 0.41 -1.57 0.00 0.00 175.55 175.09 3m4p n GLY 412 N 4.08 -0.92 3.80 0.71 0.00 -1.26 -4.82 105.19 106.78 3m4p n GLY 412 Ca 0.03 0.47 -0.34 0.00 0.00 0.00 0.00 46.02 46.18 3m4p n GLY 412 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3m4p s SER 413 N -3.42 6.14 0.10 1.61 0.15 -1.23 -4.97 113.70 112.08 3m4p s SER 413 Ca 0.38 1.91 0.03 0.00 0.70 0.00 0.00 55.95 58.98 3m4p s SER 413 Cb -0.05 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 61.67 3m4p s SER 413 CO 0.67 -0.92 -0.09 0.00 1.20 0.00 0.00 173.24 174.10 3m4p s PRO 415 N -3.04 4.30 -0.06 0.00 0.04 -1.26 -4.79 135.00 130.18 3m4p s PRO 415 Ca 0.07 2.19 -0.17 0.00 0.04 0.00 0.00 61.00 63.13 3m4p s PRO 415 Cb -0.01 -3.17 0.04 0.00 0.04 0.00 0.00 34.50 31.40 3m4p s PRO 415 CO -0.01 -0.41 0.40 -3.38 0.04 0.00 0.00 177.00 173.64 3m4p s HIS 416 N 0.46 -0.34 0.17 0.56 -3.43 -1.26 -0.27 115.29 111.19 3m4p s HIS 416 Ca 0.62 0.67 0.03 0.00 -0.80 0.00 0.00 55.06 55.57 3m4p s HIS 416 Cb -0.40 0.16 -0.05 0.00 -1.43 0.00 0.00 32.58 30.87 3m4p s HIS 416 CO 0.37 -0.37 -0.03 0.20 -2.00 0.00 0.00 174.74 172.91 3m4p s GLY 417 N -0.82 1.20 0.20 -1.38 0.00 -1.01 -1.37 107.32 104.14 3m4p s GLY 417 Ca -0.09 -1.58 -0.09 0.00 0.00 0.00 0.00 44.72 42.97 3m4p s GLY 417 CO 0.04 -1.56 0.45 0.61 0.00 0.00 0.00 173.10 172.63 3m4p n GLY 418 N -0.24 1.37 3.53 0.20 0.00 -0.80 -0.56 105.19 108.68 3m4p n GLY 418 Ca -0.08 -1.13 -0.10 0.00 0.00 0.00 0.00 46.02 44.72 3m4p n GLY 418 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3m4p s TYR 419 N -5.11 -0.24 0.02 1.61 -0.85 -0.65 -1.82 117.35 110.31 3m4p s TYR 419 Ca 0.09 -0.08 0.06 0.00 -0.52 0.00 0.00 57.07 56.62 3m4p s TYR 419 Cb -0.02 0.47 -0.02 0.00 0.38 0.00 0.00 41.96 42.77 3m4p s TYR 419 CO 0.06 -0.93 -0.18 0.20 -1.52 0.00 0.00 175.55 173.17 3m4p s GLY 420 N -2.84 0.97 -0.05 5.49 0.00 0.92 -1.88 107.32 109.93 3m4p s GLY 420 Ca 0.07 -0.91 0.02 0.00 0.00 0.00 0.00 44.72 43.90 3m4p s GLY 420 CO -0.05 -0.83 -0.11 -2.27 0.00 0.00 0.00 173.10 169.84 3m4p s LEU 421 N -0.92 1.68 -0.60 0.66 0.20 0.11 -1.50 118.68 118.30 3m4p s LEU 421 Ca 0.06 -0.25 -0.24 0.00 0.69 0.00 0.00 54.13 54.40 3m4p s LEU 421 Cb -0.08 -0.71 0.05 0.00 -0.43 0.00 0.00 46.19 45.02 3m4p s LEU 421 CO 0.01 0.05 0.97 -0.83 -0.29 0.00 0.00 176.35 176.25 3m4p s GLY 422 N 0.47 1.37 0.12 7.98 0.00 -0.73 -1.68 107.32 114.85 3m4p s GLY 422 Ca -0.09 -1.45 -0.20 0.00 0.00 0.00 0.00 44.72 42.97 3m4p s GLY 422 CO 0.02 2.09 1.72 -2.08 0.00 0.00 0.00 173.10 174.84 3m4p h VAL 423 N 6.00 0.85 0.00 1.40 2.07 -1.86 -1.19 116.25 123.54 3m4p h VAL 423 Ca -0.27 -0.01 -0.08 0.00 0.82 0.00 0.00 66.70 67.16 3m4p h VAL 423 Cb 1.07 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 3m4p h VAL 423 CO 1.13 0.00 -0.38 1.05 0.02 0.00 0.00 177.57 179.39 3m4p h GLU 424 N 0.02 0.00 -0.49 1.57 9.09 -1.92 0.93 114.58 123.78 3m4p h GLU 424 Ca 0.08 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.40 3m4p h GLU 424 Cb 0.11 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.20 3m4p h GLU 424 CO -0.16 0.38 -0.05 0.00 0.05 0.00 0.00 179.01 179.24 3m4p h ARG 425 N 0.00 0.90 -0.34 1.06 3.08 -1.85 0.89 114.38 118.13 3m4p h ARG 425 Ca -0.00 -0.31 -0.02 0.00 0.07 0.00 0.00 59.98 59.72 3m4p h ARG 425 Cb 0.70 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.67 3m4p h ARG 425 CO 0.05 0.96 0.14 1.25 -1.07 0.00 0.00 179.97 181.30 3m4p h LEU 426 N 0.76 0.46 -0.05 3.04 6.46 -0.60 -1.07 115.31 124.30 3m4p h LEU 426 Ca 0.13 -0.16 -0.00 0.00 -0.12 0.00 0.00 57.88 57.74 3m4p h LEU 426 Cb 0.58 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.39 3m4p h LEU 426 CO 0.03 0.49 0.03 0.58 -0.62 0.00 0.00 178.44 178.95 3m4p h VAL 427 N 0.40 1.08 -0.87 1.05 2.07 -0.74 -0.25 116.25 118.99 3m4p h VAL 427 Ca 0.11 -0.23 0.21 0.00 0.82 0.00 0.00 66.70 67.62 3m4p h VAL 427 Cb 0.17 1.14 -0.13 0.00 -1.52 0.00 0.00 31.29 30.96 3m4p h VAL 427 CO -0.01 0.07 0.33 -0.03 0.02 0.00 0.00 177.57 177.95 3m4p h MET 428 N -0.01 0.33 0.20 1.57 1.85 -0.77 -0.46 114.93 117.65 3m4p h MET 428 Ca 0.02 -0.02 -0.01 0.00 -0.61 0.00 0.00 59.70 59.08 3m4p h MET 428 Cb 0.08 -0.08 0.00 0.00 0.43 0.00 0.00 31.60 32.04 3m4p h MET 428 CO -0.00 0.22 -0.09 2.35 -0.40 0.00 0.00 176.91 178.98 3m4p h TRP 429 N 0.34 -0.25 -0.53 1.39 7.01 -0.40 -2.05 115.95 121.47 3m4p h TRP 429 Ca 0.54 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.52 3m4p h TRP 429 Cb 1.02 0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 28.14 3m4p h TRP 429 CO -0.18 0.04 0.29 1.25 -2.79 0.00 0.00 178.44 177.05 3m4p h LEU 430 N -0.53 0.66 -0.61 0.65 5.85 -0.22 -2.97 115.31 118.14 3m4p h LEU 430 Ca -0.03 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.60 3m4p h LEU 430 Cb 0.40 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.26 3m4p h LEU 430 CO 0.04 0.57 -0.14 0.18 -0.34 0.00 0.00 178.44 178.75 3m4p n LEU 431 N -4.63 1.09 -2.03 2.25 4.77 -0.26 -4.84 117.00 113.36 3m4p n LEU 431 Ca 0.03 -0.31 -0.09 0.00 -0.03 0.00 0.00 56.01 55.61 3m4p n LEU 431 Cb 0.09 -0.08 0.04 0.00 -2.33 0.00 0.00 43.42 41.13 3m4p n LEU 431 CO 0.37 0.19 0.08 0.61 -1.33 0.00 0.00 177.39 177.31 3m4p n GLY 432 N 1.26 0.16 3.80 -0.72 0.00 -1.03 -4.27 105.19 104.40 3m4p n GLY 432 Ca 0.15 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 3m4p n GLY 432 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3m4p s GLU 433 N -5.10 3.57 0.00 1.61 2.56 -0.80 -4.93 118.70 115.61 3m4p s GLU 433 Ca 0.13 -0.20 0.28 0.00 0.00 0.00 0.00 54.97 55.17 3m4p s GLU 433 Cb -0.06 -3.18 1.00 0.00 2.00 0.00 0.00 34.13 33.89 3m4p s GLU 433 CO 0.34 0.63 1.72 -0.40 -0.56 0.00 0.00 175.26 176.99 3m4p n ASP 434 N 2.43 0.81 -3.79 -1.70 5.75 -1.26 -4.76 116.55 114.03 3m4p n ASP 434 Ca -0.19 -0.80 -0.13 0.00 -0.01 0.00 0.00 54.79 53.66 3m4p n ASP 434 Cb 0.54 0.03 -0.14 0.00 -1.03 0.00 0.00 41.12 40.52 3m4p n ASP 434 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 3m4p s HIS 435 N -2.44 -0.10 0.47 2.11 3.76 -1.26 -4.97 115.29 112.85 3m4p s HIS 435 Ca 0.28 0.32 0.20 0.00 -0.15 0.00 0.00 55.06 55.71 3m4p s HIS 435 Cb 0.20 -0.06 1.28 0.00 1.11 0.00 0.00 32.58 35.11 3m4p s HIS 435 CO 0.48 -0.10 2.08 0.97 -0.85 0.00 0.00 174.74 177.32 3m4p h ILE 436 N 5.64 0.89 -0.32 0.60 2.10 -1.21 -2.29 117.51 122.92 3m4p h ILE 436 Ca -0.36 -0.41 -0.04 0.00 1.08 0.00 0.00 64.86 65.13 3m4p h ILE 436 Cb 1.16 1.24 -0.02 0.00 -1.09 0.00 0.00 36.82 38.11 3m4p h ILE 436 CO 0.45 0.11 0.03 0.08 -1.08 0.00 0.00 178.15 177.74 3m4p h ARG 437 N 0.00 0.48 0.00 2.19 0.11 -1.92 -2.72 114.38 112.52 3m4p h ARG 437 Ca -0.00 -0.09 0.00 0.00 0.10 0.00 0.00 59.98 59.99 3m4p h ARG 437 Cb 0.23 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 31.23 3m4p h ARG 437 CO 0.01 0.48 0.00 0.87 0.10 0.00 0.00 179.97 181.44 3m4p h LYS 438 N 0.46 0.00 -0.07 0.08 1.57 -1.83 -2.44 116.57 114.35 3m4p h LYS 438 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3m4p h LYS 438 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3m4p h LYS 438 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 179.45 179.16 3m4p n VAL 439 N -3.03 0.07 -4.26 0.50 0.31 -1.03 -4.93 118.33 105.97 3m4p n VAL 439 Ca -0.01 -0.34 -0.27 0.00 -0.01 0.00 0.00 64.34 63.71 3m4p n VAL 439 Cb 0.16 0.66 -0.09 0.00 -0.91 0.00 0.00 33.84 33.67 3m4p n VAL 439 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3m4p n LEU 441 N 0.05 0.18 -3.67 0.00 7.94 -1.26 -4.63 117.00 115.61 3m4p n LEU 441 Ca -0.11 0.75 -0.29 0.00 -1.11 0.00 0.00 56.01 55.26 3m4p n LEU 441 Cb 0.55 -0.41 -0.12 0.00 0.53 0.00 0.00 43.42 43.97 3m4p n LEU 441 CO 0.36 -0.41 -0.22 -0.31 -1.11 0.00 0.00 177.39 175.70 3m4p s TYR 442 N -2.05 2.05 0.66 1.96 2.02 -1.26 -4.91 117.35 115.83 3m4p s TYR 442 Ca 0.00 -2.56 -0.17 0.00 -0.37 0.00 0.00 57.07 53.97 3m4p s TYR 442 Cb 0.00 -1.79 0.00 0.00 -0.40 0.00 0.00 41.96 39.77 3m4p s TYR 442 CO 0.00 -0.74 1.21 -1.25 -1.57 0.00 0.00 175.55 173.19 3m4p s PRO 443 N -0.07 2.55 -0.14 -1.71 0.04 -1.26 -4.92 135.00 129.49 3m4p s PRO 443 Ca 0.23 1.78 -0.03 0.00 0.04 0.00 0.00 61.00 63.02 3m4p s PRO 443 Cb -0.13 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 3m4p s PRO 443 CO -0.08 -1.52 -0.05 1.03 0.04 0.00 0.00 177.00 176.42 3m4p s ARG 444 N -3.66 3.53 0.27 4.56 1.81 -1.26 -4.72 118.95 119.47 3m4p s ARG 444 Ca 0.76 -0.53 -0.17 0.00 -1.72 0.00 0.00 55.73 54.07 3m4p s ARG 444 Cb -0.30 -2.85 0.06 0.00 -0.45 0.00 0.00 34.95 31.41 3m4p s ARG 444 CO 0.40 0.31 0.86 2.48 -0.68 0.00 0.00 175.30 178.66 3m4p n TYR 445 N 3.33 -1.77 -1.68 -0.53 0.18 -1.12 -0.41 117.16 115.15 3m4p n TYR 445 Ca -0.18 -1.45 -0.59 0.00 1.88 0.00 0.00 57.90 57.57 3m4p n TYR 445 Cb 0.53 0.72 -0.08 0.00 -0.38 0.00 0.00 39.34 40.13 3m4p n TYR 445 CO 0.00 0.00 0.00 -0.11 -2.08 0.00 0.00 176.86 174.67 3m4p n LEU 446 N 0.00 1.87 0.00 -3.48 7.94 -1.26 -0.49 117.00 121.58 3m4p n LEU 446 Ca -0.05 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 55.96 3m4p n LEU 446 Cb 0.55 -1.08 0.00 0.00 0.53 0.00 0.00 43.42 43.42 3m4p n LEU 446 CO 0.23 -0.72 0.00 -0.62 -1.11 0.00 0.00 177.39 175.17 3m4p n GLU 447 N 4.35 -0.50 -3.91 1.96 1.02 -1.26 -4.96 120.64 117.34 3m4p n GLU 447 Ca 0.25 0.12 -0.30 0.00 -0.02 0.00 0.00 57.16 57.22 3m4p n GLU 447 Cb 0.10 -3.67 -0.15 0.00 -0.02 0.00 0.00 31.44 27.71 3m4p n GLU 447 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3m4p s ARG 448 N -0.69 1.38 -0.03 3.49 6.06 0.36 -4.88 118.95 124.62 3m4p s ARG 448 Ca 0.00 -1.86 0.05 0.00 -2.50 0.00 0.00 55.73 51.42 3m4p s ARG 448 Cb 0.00 -2.85 0.08 0.00 0.06 0.00 0.00 34.95 32.23 3m4p s ARG 448 CO 0.00 -1.01 0.92 0.00 -2.50 0.00 0.00 175.30 172.71 3m4p s GLU 450 N -1.05 0.74 0.00 0.00 2.02 -1.26 -5.12 118.70 114.03 3m4p s GLU 450 Ca 0.08 -0.95 0.01 0.00 0.02 0.00 0.00 54.97 54.13 3m4p s GLU 450 Cb 0.07 -0.57 0.06 0.00 0.10 0.00 0.00 34.13 33.79 3m4p s GLU 450 CO 0.01 0.11 0.55 -2.30 0.02 0.00 0.00 175.26 173.65