#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i7t s ASP 10 N 0.00 4.43 -0.20 4.04 1.01 0.31 -4.89 116.67 121.38 2i7t s ASP 10 Ca 0.00 -0.17 -0.10 0.00 0.71 0.00 0.00 52.55 52.99 2i7t s ASP 10 Cb 0.00 -0.99 -0.05 0.00 1.01 0.00 0.00 42.92 42.89 2i7t s ASP 10 CO 0.00 0.30 0.12 -1.58 0.21 0.00 0.00 175.17 174.22 2i7t s GLN 11 N -1.23 4.16 -0.15 8.23 0.74 -1.26 -0.26 119.66 129.88 2i7t s GLN 11 Ca 0.15 -0.24 -0.04 0.00 0.05 0.00 0.00 55.36 55.29 2i7t s GLN 11 Cb -0.11 -3.39 -0.03 0.00 1.10 0.00 0.00 33.01 30.58 2i7t s GLN 11 CO 0.05 0.29 -0.03 -1.17 -0.55 0.00 0.00 175.29 173.89 2i7t s LEU 12 N 0.38 3.32 -0.09 3.68 0.20 0.25 -4.45 118.68 121.97 2i7t s LEU 12 Ca 0.07 -0.09 0.04 0.00 0.69 0.00 0.00 54.13 54.84 2i7t s LEU 12 Cb -0.11 -1.80 -0.00 0.00 -0.43 0.00 0.00 46.19 43.85 2i7t s LEU 12 CO -0.02 0.19 -0.24 -0.22 -0.29 0.00 0.00 176.35 175.77 2i7t s LEU 13 N 0.27 2.09 -0.09 -0.68 0.20 -0.21 -0.95 118.68 119.30 2i7t s LEU 13 Ca -0.02 -0.55 0.03 0.00 0.69 0.00 0.00 54.13 54.28 2i7t s LEU 13 Cb -0.14 -1.40 0.00 0.00 -0.43 0.00 0.00 46.19 44.22 2i7t s LEU 13 CO 0.03 0.18 -0.20 -0.63 -0.29 0.00 0.00 176.35 175.43 2i7t s ILE 14 N 0.23 1.79 -0.16 6.68 1.01 -0.71 -0.29 121.20 129.76 2i7t s ILE 14 Ca -0.16 -0.86 -0.04 0.00 0.00 0.00 0.00 60.65 59.60 2i7t s ILE 14 Cb -0.17 -1.57 0.08 0.00 0.01 0.00 0.00 42.46 40.80 2i7t s ILE 14 CO 0.08 0.50 0.22 -0.60 0.00 0.00 0.00 174.94 175.14 2i7t s ARG 15 N 0.50 0.15 0.37 2.79 3.52 0.39 -0.23 118.95 126.44 2i7t s ARG 15 Ca -0.16 0.45 -0.26 0.00 -0.13 0.00 0.00 55.73 55.62 2i7t s ARG 15 Cb -0.17 -0.65 -0.09 0.00 -1.56 0.00 0.00 34.95 32.48 2i7t s ARG 15 CO 0.06 -0.47 1.17 -2.14 -0.81 0.00 0.00 175.30 173.11 2i7t s PRO 16 N 2.35 4.20 -0.00 5.12 0.02 -1.25 -0.84 135.00 144.61 2i7t s PRO 16 Ca 0.05 1.87 0.02 0.00 0.02 0.00 0.00 61.00 62.95 2i7t s PRO 16 Cb -0.14 -2.81 -0.02 0.00 0.02 0.00 0.00 34.50 31.55 2i7t s PRO 16 CO -0.10 -0.20 0.07 1.28 -0.33 0.00 0.00 177.00 177.72 2i7t n LEU 17 N 0.36 0.08 -3.56 -5.54 4.32 0.12 -0.23 117.00 112.54 2i7t n LEU 17 Ca 0.03 -0.49 -0.15 0.00 -0.02 0.00 0.00 56.01 55.38 2i7t n LEU 17 Cb 0.46 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.20 2i7t n LEU 17 CO 0.52 0.02 0.55 -0.83 -1.22 0.00 0.00 177.39 176.43 2i7t s GLY 18 N -1.18 -0.45 -0.07 -0.72 0.00 -0.96 -0.70 107.32 103.24 2i7t s GLY 18 Ca 0.01 1.75 0.00 0.00 0.00 0.00 0.00 44.72 46.48 2i7t s GLY 18 CO 0.07 1.19 0.00 0.00 0.00 0.00 0.00 173.10 174.36 2i7t n ALA 19 N 1.28 -0.01 -2.61 3.20 0.00 -0.97 -2.69 120.51 118.72 2i7t n ALA 19 Ca -0.15 0.01 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 2i7t n ALA 19 Cb 0.57 -0.31 -0.04 0.00 0.00 0.00 0.00 19.45 19.67 2i7t n ALA 19 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2i7t s GLY 20 N -2.25 1.62 -1.32 0.00 0.00 -1.26 -0.71 107.32 103.41 2i7t s GLY 20 Ca 0.00 -0.44 -0.01 0.00 0.00 0.00 0.00 44.72 44.28 2i7t s GLY 20 CO 0.00 1.92 0.06 -1.06 0.00 0.00 0.00 173.10 174.02 2i7t n GLN 21 N 6.56 -2.25 -3.76 2.90 6.02 -1.23 -3.71 117.38 121.92 2i7t n GLN 21 Ca 0.06 0.73 -0.09 0.00 -0.01 0.00 0.00 57.00 57.70 2i7t n GLN 21 Cb 0.48 -5.37 -0.02 0.00 1.02 0.00 0.00 30.24 26.34 2i7t n GLN 21 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 2i7t s GLU 22 N -5.12 1.61 -0.12 -1.09 -1.05 -0.03 -2.22 118.70 110.67 2i7t s GLU 22 Ca 0.04 -0.88 -0.01 0.00 -0.15 0.00 0.00 54.97 53.97 2i7t s GLU 22 Cb -0.02 0.58 -0.02 0.00 -0.44 0.00 0.00 34.13 34.23 2i7t s GLU 22 CO 0.04 -0.72 -0.09 0.08 0.95 0.00 0.00 175.26 175.52 2i7t s VAL 23 N -3.88 3.42 0.00 1.83 1.01 -1.26 -1.66 120.40 119.85 2i7t s VAL 23 Ca 0.09 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.53 2i7t s VAL 23 Cb -0.04 -2.44 0.00 0.00 0.00 0.00 0.00 36.38 33.90 2i7t s VAL 23 CO 0.01 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.26 2i7t n GLY 24 N 3.23 3.64 4.21 4.51 0.00 -1.26 -4.85 105.19 114.67 2i7t n GLY 24 Ca -0.18 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 43.81 2i7t n GLY 24 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2i7t n ARG 25 N -1.21 -0.89 -1.69 1.61 1.85 -0.89 -2.28 116.66 113.15 2i7t n ARG 25 Ca 0.00 0.11 -0.42 0.00 -1.00 0.00 0.00 57.85 56.54 2i7t n ARG 25 Cb 0.00 -3.32 -0.03 0.00 -1.05 0.00 0.00 32.46 28.05 2i7t n ARG 25 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2i7t n SER 26 N -2.66 4.04 -3.15 2.89 7.64 0.65 -3.34 113.62 119.68 2i7t n SER 26 Ca -0.26 0.99 0.05 0.00 1.01 0.00 0.00 58.87 60.66 2i7t n SER 26 Cb 0.65 -1.55 -0.00 0.00 -1.01 0.00 0.00 64.21 62.31 2i7t n SER 26 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2i7t s ILE 28 N 2.89 2.38 -0.00 0.00 1.09 -0.30 0.15 121.20 127.42 2i7t s ILE 28 Ca 0.17 -0.90 -0.15 0.00 -1.10 0.00 0.00 60.65 58.66 2i7t s ILE 28 Cb -0.07 -1.94 -0.06 0.00 -1.06 0.00 0.00 42.46 39.33 2i7t s ILE 28 CO -0.23 0.55 0.41 -0.63 -0.10 0.00 0.00 174.94 174.94 2i7t s ILE 29 N 0.33 5.03 -0.05 2.92 -1.09 -0.02 -0.29 121.20 128.03 2i7t s ILE 29 Ca -0.16 0.85 0.03 0.00 -2.23 0.00 0.00 60.65 59.14 2i7t s ILE 29 Cb -0.17 -3.72 0.01 0.00 -1.58 0.00 0.00 42.46 37.00 2i7t s ILE 29 CO 0.08 0.57 -0.13 -0.22 -1.23 0.00 0.00 174.94 174.01 2i7t s LEU 30 N -1.03 1.74 -0.07 2.97 2.96 0.03 -0.46 118.68 124.81 2i7t s LEU 30 Ca 0.24 -0.29 -0.00 0.00 -0.22 0.00 0.00 54.13 53.85 2i7t s LEU 30 Cb -0.17 -0.82 0.02 0.00 0.50 0.00 0.00 46.19 45.73 2i7t s LEU 30 CO 0.13 0.07 -0.04 -1.61 -1.32 0.00 0.00 176.35 173.58 2i7t s GLU 31 N 0.42 1.00 -0.21 1.98 2.02 0.61 -0.46 118.70 124.06 2i7t s GLU 31 Ca -0.10 -0.09 -0.16 0.00 0.02 0.00 0.00 54.97 54.64 2i7t s GLU 31 Cb -0.13 -1.12 0.06 0.00 0.10 0.00 0.00 34.13 33.04 2i7t s GLU 31 CO 0.03 -0.19 0.54 0.12 0.02 0.00 0.00 175.26 175.78 2i7t s PHE 32 N 1.46 -0.71 -1.39 1.61 5.36 -0.32 -1.05 117.98 122.94 2i7t s PHE 32 Ca -0.02 1.58 -0.00 0.00 -0.96 0.00 0.00 56.93 57.53 2i7t s PHE 32 Cb -0.13 0.33 0.00 0.00 -0.34 0.00 0.00 43.02 42.87 2i7t s PHE 32 CO -0.03 -0.36 0.00 1.63 -1.46 0.00 0.00 175.22 175.00 2i7t n LYS 33 N 3.57 -0.94 0.00 10.12 5.02 -1.26 -0.15 118.16 134.51 2i7t n LYS 33 Ca -0.18 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 2i7t n LYS 33 Cb 0.57 -3.20 0.00 0.00 -0.02 0.00 0.00 35.03 32.37 2i7t n LYS 33 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2i7t n GLY 34 N -2.42 1.96 3.93 0.72 0.00 -1.26 -5.04 105.19 103.07 2i7t n GLY 34 Ca -0.29 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 2i7t n GLY 34 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i7t s ARG 35 N -0.51 3.44 -0.05 1.61 3.00 0.79 -5.07 118.95 122.17 2i7t s ARG 35 Ca 0.00 -0.48 0.02 0.00 0.00 0.00 0.00 55.73 55.26 2i7t s ARG 35 Cb 0.00 -3.02 0.01 0.00 0.00 0.00 0.00 34.95 31.95 2i7t s ARG 35 CO 0.00 0.59 -0.08 0.15 0.00 0.00 0.00 175.30 175.95 2i7t s LYS 36 N -2.71 1.14 0.01 3.54 1.02 -1.26 -1.18 119.74 120.30 2i7t s LYS 36 Ca 0.35 -0.25 0.03 0.00 0.02 0.00 0.00 55.97 56.12 2i7t s LYS 36 Cb -0.12 -1.03 -0.01 0.00 -0.52 0.00 0.00 37.83 36.14 2i7t s LYS 36 CO 0.28 0.00 -0.10 0.42 -0.92 0.00 0.00 175.35 175.03 2i7t s ILE 37 N 0.65 0.81 -0.13 2.17 1.01 0.40 -0.98 121.20 125.13 2i7t s ILE 37 Ca -0.11 -0.58 -0.01 0.00 0.00 0.00 0.00 60.65 59.96 2i7t s ILE 37 Cb -0.13 -0.71 -0.02 0.00 0.01 0.00 0.00 42.46 41.61 2i7t s ILE 37 CO 0.01 0.13 -0.11 -0.32 0.00 0.00 0.00 174.94 174.66 2i7t s MET 38 N -0.50 3.40 -0.34 2.79 -2.45 0.42 -0.79 119.30 121.82 2i7t s MET 38 Ca 0.02 -0.64 -0.08 0.00 -1.25 0.00 0.00 55.69 53.74 2i7t s MET 38 Cb -0.05 -2.69 0.03 0.00 1.25 0.00 0.00 34.83 33.37 2i7t s MET 38 CO -0.00 0.25 0.14 -0.51 1.05 0.00 0.00 175.02 175.95 2i7t s LEU 39 N 0.27 4.39 0.38 4.11 1.43 0.61 -1.11 118.68 128.76 2i7t s LEU 39 Ca -0.08 -1.02 0.00 0.00 -1.03 0.00 0.00 54.13 52.00 2i7t s LEU 39 Cb -0.15 -1.93 0.00 0.00 0.03 0.00 0.00 46.19 44.14 2i7t s LEU 39 CO 0.05 -0.33 0.00 0.47 0.23 0.00 0.00 176.35 176.77 2i7t n ASP 40 N 4.88 -5.08 -2.74 2.29 10.43 0.19 -1.15 116.55 125.37 2i7t n ASP 40 Ca -0.13 0.88 -0.05 0.00 2.57 0.00 0.00 54.79 58.07 2i7t n ASP 40 Cb 0.46 -3.13 0.03 0.00 1.84 0.00 0.00 41.12 40.31 2i7t n ASP 40 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2i7t n GLY 42 N 2.37 3.03 3.54 0.00 0.00 -0.87 -1.97 105.19 111.29 2i7t n GLY 42 Ca 0.13 -2.25 -0.24 0.00 0.00 0.00 0.00 46.02 43.67 2i7t n GLY 42 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2i7t s ILE 43 N -1.50 2.78 -0.42 -0.61 -5.25 -0.77 -4.23 121.20 111.20 2i7t s ILE 43 Ca 0.14 -2.21 -0.23 0.00 -0.99 0.00 0.00 60.65 57.36 2i7t s ILE 43 Cb -0.01 -2.53 0.02 0.00 2.95 0.00 0.00 42.46 42.89 2i7t s ILE 43 CO 0.09 -0.36 0.80 -2.28 -1.79 0.00 0.00 174.94 171.40 2i7t s HIS 44 N -2.46 3.03 0.66 1.37 5.65 0.14 -2.09 115.29 121.59 2i7t s HIS 44 Ca 0.31 0.33 0.33 0.00 0.25 0.00 0.00 55.06 56.28 2i7t s HIS 44 Cb -0.05 -3.60 1.82 0.00 -1.18 0.00 0.00 32.58 29.57 2i7t s HIS 44 CO 0.17 -0.91 2.04 -1.35 -0.65 0.00 0.00 174.74 174.04 2i7t h PRO 45 N 8.81 0.00 -0.69 2.88 0.11 -1.91 -1.27 132.00 139.93 2i7t h PRO 45 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2i7t h PRO 45 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2i7t h PRO 45 CO 0.95 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.15 2i7t n GLY 46 N -1.22 2.65 3.34 -0.55 0.00 -1.26 -4.81 105.19 103.35 2i7t n GLY 46 Ca -0.01 -0.84 -0.18 0.00 0.00 0.00 0.00 46.02 44.98 2i7t n GLY 46 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i7t s LEU 47 N -1.60 2.38 -0.03 0.99 1.43 -0.48 -4.63 118.68 116.73 2i7t s LEU 47 Ca 0.51 -1.14 0.00 0.00 -1.03 0.00 0.00 54.13 52.47 2i7t s LEU 47 Cb 0.31 -0.43 -0.03 0.00 0.03 0.00 0.00 46.19 46.07 2i7t s LEU 47 CO 0.28 -0.39 0.01 -0.70 0.23 0.00 0.00 176.35 175.78 2i7t s GLU 48 N -3.78 2.89 2.31 1.70 2.12 -1.26 -4.64 118.70 118.04 2i7t s GLU 48 Ca 0.25 -0.52 0.00 0.00 0.36 0.00 0.00 54.97 55.07 2i7t s GLU 48 Cb 0.04 -2.74 0.00 0.00 0.26 0.00 0.00 34.13 31.69 2i7t s GLU 48 CO 0.08 0.66 0.00 0.41 -0.54 0.00 0.00 175.26 175.86 2i7t n GLY 49 N 1.66 2.64 0.30 -1.50 0.00 -1.26 -1.96 105.19 105.06 2i7t n GLY 49 Ca -0.16 -0.08 0.17 0.00 0.00 0.00 0.00 46.02 45.95 2i7t n GLY 49 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2i7t h MET 50 N 0.00 0.00 0.00 1.61 2.86 -1.99 -2.20 114.93 115.21 2i7t h MET 50 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2i7t h MET 50 Cb 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 2i7t h MET 50 CO 0.00 0.04 -0.03 -0.44 1.06 0.00 0.00 176.91 177.54 2i7t h ASP 51 N 0.00 0.00 -0.28 1.22 3.32 -1.78 -2.82 116.42 116.07 2i7t h ASP 51 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2i7t h ASP 51 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2i7t h ASP 51 CO 0.01 0.03 0.00 0.00 -1.72 0.00 0.00 179.24 177.56 2i7t n ALA 52 N -2.11 2.65 -2.84 3.45 0.00 -0.83 -4.84 120.51 115.99 2i7t n ALA 52 Ca 0.01 -0.60 -0.27 0.00 0.00 0.00 0.00 53.44 52.58 2i7t n ALA 52 Cb 0.37 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.77 2i7t n ALA 52 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2i7t s LEU 53 N -1.04 3.98 1.11 0.00 1.43 -1.07 -0.68 118.68 122.41 2i7t s LEU 53 Ca 0.21 0.00 -0.13 0.00 -1.03 0.00 0.00 54.13 53.18 2i7t s LEU 53 Cb 0.12 -2.60 0.25 0.00 0.03 0.00 0.00 46.19 44.00 2i7t s LEU 53 CO 0.11 0.09 1.05 -2.84 0.23 0.00 0.00 176.35 175.00 2i7t s PRO 54 N -2.94 -0.44 -1.31 1.29 0.02 -1.26 -4.84 135.00 125.51 2i7t s PRO 54 Ca 0.32 0.64 -0.07 0.00 0.02 0.00 0.00 61.00 61.90 2i7t s PRO 54 Cb -0.11 -1.62 0.00 0.00 0.02 0.00 0.00 34.50 32.79 2i7t s PRO 54 CO 0.25 -3.35 2.74 0.66 -0.33 0.00 0.00 177.00 176.96 2i7t n TYR 55 N -4.63 2.29 0.40 6.54 4.02 0.12 -4.64 117.16 121.27 2i7t n TYR 55 Ca 0.04 -2.80 0.04 0.00 -0.01 0.00 0.00 57.90 55.16 2i7t n TYR 55 Cb 0.56 -2.07 0.20 0.00 -0.02 0.00 0.00 39.34 38.01 2i7t n TYR 55 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 2i7t n ILE 56 N 2.50 0.39 0.02 -0.72 5.41 -1.26 -1.98 119.36 123.72 2i7t n ILE 56 Ca 0.67 0.10 -0.09 0.00 1.00 0.00 0.00 62.75 64.43 2i7t n ILE 56 Cb 0.30 -0.98 0.07 0.00 -0.71 0.00 0.00 39.64 38.32 2i7t n ILE 56 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 2i7t h ASP 57 N 0.00 0.55 0.16 4.38 5.19 -2.00 -2.89 116.42 121.81 2i7t h ASP 57 Ca 0.00 -0.30 0.00 0.00 -0.62 0.00 0.00 57.03 56.11 2i7t h ASP 57 Cb 0.03 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 39.38 2i7t h ASP 57 CO 0.00 1.00 0.00 0.18 -3.12 0.00 0.00 179.24 177.30 2i7t n LEU 58 N -3.94 0.00 -4.37 1.55 4.77 -0.84 -4.72 117.00 109.45 2i7t n LEU 58 Ca -0.03 0.35 -0.19 0.00 -0.03 0.00 0.00 56.01 56.12 2i7t n LEU 58 Cb 0.61 -0.35 -0.10 0.00 -2.33 0.00 0.00 43.42 41.24 2i7t n LEU 58 CO 0.47 -0.27 -0.30 0.27 -1.33 0.00 0.00 177.39 176.22 2i7t s ILE 59 N -2.71 1.03 -0.40 -0.08 -4.36 -1.09 -5.12 121.20 108.47 2i7t s ILE 59 Ca 0.05 -2.02 -0.07 0.00 -0.26 0.00 0.00 60.65 58.35 2i7t s ILE 59 Cb 0.05 -2.54 0.08 0.00 1.25 0.00 0.00 42.46 41.29 2i7t s ILE 59 CO 0.11 -0.17 0.22 -0.62 0.24 0.00 0.00 174.94 174.73 2i7t s ASP 60 N -3.37 5.50 0.39 4.36 2.15 -1.26 -4.97 116.67 119.47 2i7t s ASP 60 Ca 0.33 -1.55 0.23 0.00 0.43 0.00 0.00 52.55 51.98 2i7t s ASP 60 Cb 0.07 -1.93 1.30 0.00 -0.30 0.00 0.00 42.92 42.05 2i7t s ASP 60 CO 0.12 -0.51 1.63 -0.65 -0.17 0.00 0.00 175.17 175.59 2i7t h PRO 61 N 8.31 0.14 0.00 4.34 0.11 -1.89 0.44 132.00 143.44 2i7t h PRO 61 Ca -0.21 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.89 2i7t h PRO 61 Cb 1.08 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 2i7t h PRO 61 CO 0.72 0.09 -0.00 0.00 -0.21 0.00 0.00 178.00 178.60 2i7t h ALA 62 N 1.78 1.19 -0.02 -0.75 0.00 -1.92 -1.92 119.26 117.63 2i7t h ALA 62 Ca 0.80 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.70 2i7t h ALA 62 Cb 2.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.98 2i7t h ALA 62 CO -0.57 0.01 -0.06 0.39 0.00 0.00 0.00 179.25 179.02 2i7t n GLU 63 N -3.37 1.60 -2.84 0.00 1.02 0.15 -4.72 120.64 112.48 2i7t n GLU 63 Ca -0.03 -1.02 -0.42 0.00 -0.02 0.00 0.00 57.16 55.67 2i7t n GLU 63 Cb 0.09 -1.48 -0.04 0.00 -0.02 0.00 0.00 31.44 29.99 2i7t n GLU 63 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2i7t s ILE 64 N -2.10 4.65 -0.06 -3.67 -1.09 -0.72 -4.47 121.20 113.73 2i7t s ILE 64 Ca 0.34 1.20 -0.25 0.00 -2.23 0.00 0.00 60.65 59.70 2i7t s ILE 64 Cb 0.20 -4.28 -0.23 0.00 -1.58 0.00 0.00 42.46 36.57 2i7t s ILE 64 CO 0.37 -0.45 1.03 0.44 -1.23 0.00 0.00 174.94 175.10 2i7t h ASP 65 N 8.35 0.15 -4.22 3.58 3.32 -1.38 -3.32 116.42 122.90 2i7t h ASP 65 Ca -0.23 -0.76 -0.47 0.00 0.02 0.00 0.00 57.03 55.58 2i7t h ASP 65 Cb 1.08 -0.05 -0.28 0.00 0.22 0.00 0.00 39.33 40.30 2i7t h ASP 65 CO 0.95 0.90 -0.81 -0.22 -1.72 0.00 0.00 179.24 178.34 2i7t s LEU 66 N -8.59 2.06 -0.17 1.55 0.20 -1.12 -2.15 118.68 110.46 2i7t s LEU 66 Ca -0.16 -0.29 -0.00 0.00 0.69 0.00 0.00 54.13 54.36 2i7t s LEU 66 Cb 0.00 -0.69 0.04 0.00 -0.43 0.00 0.00 46.19 45.11 2i7t s LEU 66 CO 0.72 0.14 -0.07 -0.22 -0.29 0.00 0.00 176.35 176.63 2i7t s LEU 67 N -0.49 1.81 -0.14 -0.68 2.96 0.40 -0.44 118.68 122.10 2i7t s LEU 67 Ca 0.05 -0.71 -0.02 0.00 -0.22 0.00 0.00 54.13 53.23 2i7t s LEU 67 Cb -0.06 -1.03 -0.02 0.00 0.50 0.00 0.00 46.19 45.58 2i7t s LEU 67 CO -0.00 -0.16 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.03 2i7t s LEU 68 N 1.55 3.04 -0.22 -0.68 1.43 -0.26 -1.03 118.68 122.52 2i7t s LEU 68 Ca 0.01 -0.20 -0.04 0.00 -1.03 0.00 0.00 54.13 52.87 2i7t s LEU 68 Cb -0.15 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 2i7t s LEU 68 CO -0.08 0.18 -0.04 -0.63 0.23 0.00 0.00 176.35 176.01 2i7t s ILE 69 N 0.27 3.41 0.00 -0.59 -1.09 -0.78 0.58 121.20 123.00 2i7t s ILE 69 Ca -0.06 -0.48 -0.25 0.00 -2.23 0.00 0.00 60.65 57.63 2i7t s ILE 69 Cb -0.15 -2.55 -0.19 0.00 -1.58 0.00 0.00 42.46 37.99 2i7t s ILE 69 CO 0.04 0.42 1.33 0.77 -1.23 0.00 0.00 174.94 176.27 2i7t h SER 70 N 8.11 -0.06 -5.23 3.58 4.64 -1.88 -3.43 113.55 119.28 2i7t h SER 70 Ca -0.41 -0.36 -0.12 0.00 -0.47 0.00 0.00 61.79 60.43 2i7t h SER 70 Cb 1.16 0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 63.22 2i7t h SER 70 CO 0.60 0.33 0.05 -1.38 -0.87 0.00 0.00 176.83 175.57 2i7t s HIS 71 N -4.61 0.50 -1.27 4.77 -3.43 -1.26 -1.29 115.29 108.69 2i7t s HIS 71 Ca -0.15 -0.96 0.24 0.00 -0.80 0.00 0.00 55.06 53.39 2i7t s HIS 71 Cb 0.02 0.41 1.15 0.00 -1.43 0.00 0.00 32.58 32.73 2i7t s HIS 71 CO 0.65 -1.33 1.79 1.97 -2.00 0.00 0.00 174.74 175.82 2i7t n PHE 72 N -0.53 0.00 -1.78 0.38 1.16 -1.26 -4.43 117.46 111.00 2i7t n PHE 72 Ca -0.04 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.17 2i7t n PHE 72 Cb 0.61 -0.37 0.06 0.00 -1.61 0.00 0.00 39.48 38.17 2i7t n PHE 72 CO 0.00 0.00 0.00 -1.01 -1.87 0.00 0.00 176.76 173.88 2i7t s HIS 73 N -2.73 2.16 0.43 2.97 3.76 -1.26 -4.78 115.29 115.84 2i7t s HIS 73 Ca 0.19 1.45 0.10 0.00 -0.15 0.00 0.00 55.06 56.65 2i7t s HIS 73 Cb 0.16 -3.71 0.93 0.00 1.11 0.00 0.00 32.58 31.07 2i7t s HIS 73 CO 0.39 -2.87 2.03 -0.07 -0.85 0.00 0.00 174.74 173.38 2i7t h LEU 74 N 0.84 0.28 0.00 0.89 3.38 -1.93 -2.09 115.31 116.68 2i7t h LEU 74 Ca -0.51 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2i7t h LEU 74 Cb 1.32 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2i7t h LEU 74 CO 0.54 0.27 0.00 -0.90 0.09 0.00 0.00 178.44 178.45 2i7t n ASP 75 N -4.43 0.00 0.00 -0.43 3.85 -1.25 -0.01 116.55 114.29 2i7t n ASP 75 Ca 0.00 -1.32 0.00 0.00 -0.71 0.00 0.00 54.79 52.76 2i7t n ASP 75 Cb 0.13 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.90 2i7t n ASP 75 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.20 177.60 2i7t n HIS 76 N -0.68 0.00 -1.29 2.11 8.25 -0.83 -0.26 115.22 122.53 2i7t n HIS 76 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 2i7t n HIS 76 Cb 0.03 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.14 2i7t n HIS 76 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2i7t h GLY 78 N 0.00 0.00 -2.39 0.00 0.00 -0.40 -2.69 103.07 97.60 2i7t h GLY 78 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2i7t h GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 2i7t n ALA 79 N -2.48 2.41 0.12 3.60 0.00 -0.83 -4.61 120.51 118.72 2i7t n ALA 79 Ca -0.03 -1.07 -0.14 0.00 0.00 0.00 0.00 53.44 52.20 2i7t n ALA 79 Cb 0.19 -0.91 -0.08 0.00 0.00 0.00 0.00 19.45 18.66 2i7t n ALA 79 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2i7t h LEU 80 N 4.31 -0.20 -0.80 0.00 5.85 -1.30 -1.59 115.31 121.59 2i7t h LEU 80 Ca 0.00 -0.00 0.16 0.00 0.84 0.00 0.00 57.88 58.88 2i7t h LEU 80 Cb 0.96 0.05 -0.11 0.00 0.37 0.00 0.00 40.66 41.94 2i7t h LEU 80 CO 0.00 -0.13 0.31 -0.65 -0.34 0.00 0.00 178.44 177.63 2i7t h PRO 81 N -0.25 0.41 -0.02 5.25 0.11 -1.81 0.25 132.00 135.94 2i7t h PRO 81 Ca -0.02 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.06 2i7t h PRO 81 Cb 0.19 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.21 2i7t h PRO 81 CO 0.04 0.27 0.01 2.35 -0.21 0.00 0.00 178.00 180.46 2i7t h TRP 82 N 0.42 0.03 -0.82 0.65 7.01 -1.80 -0.07 115.95 121.37 2i7t h TRP 82 Ca 0.46 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.44 2i7t h TRP 82 Cb 0.75 -0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 27.76 2i7t h TRP 82 CO -0.17 0.05 0.46 0.35 -2.79 0.00 0.00 178.44 176.34 2i7t h PHE 83 N -0.01 1.11 0.01 2.65 3.57 -0.08 -0.46 116.94 123.74 2i7t h PHE 83 Ca 0.01 -0.02 -0.20 0.00 3.53 0.00 0.00 57.97 61.29 2i7t h PHE 83 Cb 0.03 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.40 2i7t h PHE 83 CO -0.07 0.76 -0.90 -0.07 -2.23 0.00 0.00 178.31 175.80 2i7t h LEU 84 N 1.13 0.14 -2.74 0.59 3.38 -0.43 -3.29 115.31 114.08 2i7t h LEU 84 Ca 0.29 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2i7t h LEU 84 Cb 0.01 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2i7t h LEU 84 CO -0.05 0.97 0.00 0.00 0.09 0.00 0.00 178.44 179.45 2i7t n GLN 85 N -3.57 2.63 -0.23 1.13 1.13 -0.05 -4.68 117.38 113.74 2i7t n GLN 85 Ca -0.02 -1.89 0.00 0.00 -1.94 0.00 0.00 57.00 53.15 2i7t n GLN 85 Cb 0.83 -1.23 0.00 0.00 0.11 0.00 0.00 30.24 29.95 2i7t n GLN 85 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2i7t n LYS 86 N 0.41 0.00 -4.37 -1.09 5.02 -0.19 -5.02 118.16 112.92 2i7t n LYS 86 Ca 0.10 -0.65 -0.19 0.00 -2.02 0.00 0.00 58.31 55.54 2i7t n LYS 86 Cb 0.39 -0.45 -0.09 0.00 -0.02 0.00 0.00 35.03 34.86 2i7t n LYS 86 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2i7t s THR 87 N 0.00 0.52 -1.85 -0.18 -4.23 -1.24 -4.98 115.64 103.68 2i7t s THR 87 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2i7t s THR 87 Cb 0.00 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.29 2i7t s THR 87 CO 0.00 0.00 0.86 -1.54 -0.54 0.00 0.00 174.62 173.40 2i7t n SER 88 N -0.84 0.14 -4.68 3.99 3.41 -1.26 -4.87 113.62 109.51 2i7t n SER 88 Ca -0.01 -1.87 -0.42 0.00 -0.26 0.00 0.00 58.87 56.31 2i7t n SER 88 Cb 0.65 -0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 2i7t n SER 88 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2i7t s PHE 89 N -1.85 2.22 -0.08 7.33 5.36 -1.26 -3.32 117.98 126.39 2i7t s PHE 89 Ca 0.00 0.18 0.16 0.00 -0.96 0.00 0.00 56.93 56.31 2i7t s PHE 89 Cb 0.00 -4.02 0.33 0.00 -0.34 0.00 0.00 43.02 38.99 2i7t s PHE 89 CO 0.00 -4.19 1.15 0.36 -1.46 0.00 0.00 175.22 171.08 2i7t n LYS 90 N 5.95 0.63 -1.51 10.12 2.85 -1.26 -4.94 118.16 130.00 2i7t n LYS 90 Ca 0.17 -2.27 -0.10 0.00 -1.05 0.00 0.00 58.31 55.06 2i7t n LYS 90 Cb 0.40 -0.77 0.05 0.00 -0.65 0.00 0.00 35.03 34.07 2i7t n LYS 90 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2i7t n GLY 91 N -0.33 0.77 3.87 2.58 0.00 -1.25 -5.07 105.19 105.77 2i7t n GLY 91 Ca 0.10 -2.00 -0.36 0.00 0.00 0.00 0.00 46.02 43.76 2i7t n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i7t s ARG 92 N -3.58 3.41 -0.04 1.61 0.52 -0.91 -4.97 118.95 114.98 2i7t s ARG 92 Ca 0.30 -0.19 0.06 0.00 -0.52 0.00 0.00 55.73 55.38 2i7t s ARG 92 Cb -0.02 -3.15 -0.02 0.00 0.52 0.00 0.00 34.95 32.29 2i7t s ARG 92 CO 0.20 0.75 -0.21 0.99 0.02 0.00 0.00 175.30 177.05 2i7t s THR 93 N -1.08 2.47 0.01 0.02 2.01 -1.26 -0.46 115.64 117.35 2i7t s THR 93 Ca 0.17 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.26 2i7t s THR 93 Cb -0.12 -1.91 -0.01 0.00 0.01 0.00 0.00 72.50 70.47 2i7t s THR 93 CO 0.07 0.58 -0.10 -0.36 -0.69 0.00 0.00 174.62 174.12 2i7t s PHE 94 N -0.60 0.85 0.17 4.92 0.40 -0.20 -0.64 117.98 122.89 2i7t s PHE 94 Ca 0.09 -0.23 -0.06 0.00 -0.60 0.00 0.00 56.93 56.13 2i7t s PHE 94 Cb -0.11 -0.53 -0.02 0.00 0.51 0.00 0.00 43.02 42.87 2i7t s PHE 94 CO 0.00 -0.01 0.21 -1.64 0.70 0.00 0.00 175.22 174.48 2i7t s MET 95 N -0.56 1.15 0.59 0.44 -1.94 -0.55 -1.87 119.30 116.56 2i7t s MET 95 Ca 0.01 -1.35 -0.10 0.00 -1.71 0.00 0.00 55.69 52.54 2i7t s MET 95 Cb -0.05 0.33 -0.04 0.00 2.01 0.00 0.00 34.83 37.08 2i7t s MET 95 CO 0.00 -0.40 0.98 0.95 -0.01 0.00 0.00 175.02 176.54 2i7t s THR 96 N -4.04 4.74 0.12 2.05 -4.23 -1.26 -0.13 115.64 112.89 2i7t s THR 96 Ca 0.24 0.76 -0.32 0.00 -1.18 0.00 0.00 61.69 61.18 2i7t s THR 96 Cb 0.05 -3.86 -0.11 0.00 1.34 0.00 0.00 72.50 69.91 2i7t s THR 96 CO 0.04 -1.07 1.57 0.45 -0.54 0.00 0.00 174.62 175.07 2i7t h HIS 97 N -0.15 -1.41 -0.83 3.99 3.86 -1.93 -1.71 115.15 116.97 2i7t h HIS 97 Ca -0.45 0.04 0.12 0.00 -1.16 0.00 0.00 60.37 58.92 2i7t h HIS 97 Cb 1.19 0.61 -0.08 0.00 1.06 0.00 0.00 27.41 30.19 2i7t h HIS 97 CO 0.64 -0.55 0.45 0.00 0.86 0.00 0.00 177.93 179.34 2i7t h ALA 98 N -0.26 1.20 -0.33 2.45 0.00 -1.93 -1.30 119.26 119.10 2i7t h ALA 98 Ca 0.03 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2i7t h ALA 98 Cb 0.70 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 2i7t h ALA 98 CO -0.34 0.01 0.11 1.15 0.00 0.00 0.00 179.25 180.19 2i7t h THR 99 N 0.71 0.91 -0.58 0.00 2.02 -1.64 -1.72 112.91 112.60 2i7t h THR 99 Ca 0.42 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.50 2i7t h THR 99 Cb 0.48 0.63 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 2i7t h THR 99 CO -0.30 0.05 0.31 0.50 0.37 0.00 0.00 175.52 176.45 2i7t h LYS 100 N 0.25 0.81 0.29 6.66 3.64 -0.46 -0.35 116.57 127.42 2i7t h LYS 100 Ca 0.15 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 2i7t h LYS 100 Cb 0.12 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 2i7t h LYS 100 CO -0.15 0.63 -0.33 0.00 -2.27 0.00 0.00 179.45 177.33 2i7t h ALA 101 N 1.14 -0.99 -0.00 5.00 0.00 -0.78 -1.89 119.26 121.73 2i7t h ALA 101 Ca 0.20 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2i7t h ALA 101 Cb 0.06 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2i7t h ALA 101 CO -0.03 -1.02 0.00 0.82 0.00 0.00 0.00 179.25 179.02 2i7t h ILE 102 N -0.63 0.25 0.57 0.00 2.04 -1.30 -2.95 117.51 115.48 2i7t h ILE 102 Ca -0.04 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 2i7t h ILE 102 Cb 0.56 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 2i7t h ILE 102 CO -0.06 0.00 -0.42 0.22 0.00 0.00 0.00 178.15 177.88 2i7t h TYR 103 N 0.00 -1.14 -0.36 1.37 3.20 -0.21 0.25 116.97 120.07 2i7t h TYR 103 Ca 0.00 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.89 2i7t h TYR 103 Cb 0.00 0.42 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 2i7t h TYR 103 CO 0.00 -0.61 0.20 0.07 -1.64 0.00 0.00 178.16 176.18 2i7t h ARG 104 N -0.96 0.40 0.28 1.82 0.11 -1.37 0.13 114.38 114.78 2i7t h ARG 104 Ca -0.07 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 59.98 2i7t h ARG 104 Cb 0.81 -0.09 0.00 0.00 1.11 0.00 0.00 29.97 31.80 2i7t h ARG 104 CO 0.02 0.26 -0.13 -1.49 0.10 0.00 0.00 179.97 178.73 2i7t h TRP 105 N 0.41 -0.35 0.04 4.08 4.06 -1.57 -1.74 115.95 120.89 2i7t h TRP 105 Ca 0.14 -0.01 -0.00 0.00 2.06 0.00 0.00 58.89 61.08 2i7t h TRP 105 Cb 0.02 0.11 0.00 0.00 -1.00 0.00 0.00 29.16 28.30 2i7t h TRP 105 CO -0.08 -0.16 -0.02 1.25 -3.56 0.00 0.00 178.44 175.87 2i7t h LEU 106 N -0.45 -0.04 -1.61 -4.49 7.12 -0.40 -2.48 115.31 112.95 2i7t h LEU 106 Ca -0.04 -0.17 -0.04 0.00 0.13 0.00 0.00 57.88 57.76 2i7t h LEU 106 Cb 0.34 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.48 2i7t h LEU 106 CO 0.06 0.15 -0.15 -0.07 -0.13 0.00 0.00 178.44 178.30 2i7t h LEU 107 N -0.23 0.05 0.45 2.25 -0.00 -0.80 -1.80 115.31 115.23 2i7t h LEU 107 Ca -0.01 -0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.84 2i7t h LEU 107 Cb 0.21 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 40.86 2i7t h LEU 107 CO 0.01 0.21 -0.22 -1.28 -0.00 0.00 0.00 178.44 177.16 2i7t h SER 108 N 0.05 -0.51 -0.42 -0.43 0.87 -1.17 -2.50 113.55 109.44 2i7t h SER 108 Ca 0.01 -0.08 0.12 0.00 -1.23 0.00 0.00 61.79 60.61 2i7t h SER 108 Cb 0.30 0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 2i7t h SER 108 CO 0.02 -0.20 0.31 -0.78 -0.53 0.00 0.00 176.83 175.65 2i7t h ASP 109 N -0.84 0.00 0.29 6.23 1.82 -1.23 0.67 116.42 123.36 2i7t h ASP 109 Ca -0.06 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.55 2i7t h ASP 109 Cb 0.56 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.57 2i7t h ASP 109 CO 0.10 0.00 -0.16 0.22 -1.61 0.00 0.00 179.24 177.79 2i7t h TYR 110 N 0.00 0.00 0.00 0.28 3.20 -0.90 -3.32 116.97 116.23 2i7t h TYR 110 Ca 0.20 0.00 -0.66 0.00 3.14 0.00 0.00 58.73 61.41 2i7t h TYR 110 Cb 0.82 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.10 2i7t h TYR 110 CO 0.00 0.16 2.81 0.28 -1.64 0.00 0.00 178.16 179.77 2i7t n VAL 111 N -3.92 2.78 0.43 1.81 0.31 0.23 -5.10 118.33 114.89 2i7t n VAL 111 Ca -0.02 -2.30 0.07 0.00 -0.01 0.00 0.00 64.34 62.08 2i7t n VAL 111 Cb 0.25 -2.46 0.09 0.00 -0.91 0.00 0.00 33.84 30.81 2i7t n VAL 111 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2i7t n LYS 112 N 6.17 1.40 0.00 5.55 5.02 -1.25 -5.02 118.16 130.03 2i7t n LYS 112 Ca 0.52 -1.54 0.00 0.00 -2.02 0.00 0.00 58.31 55.27 2i7t n LYS 112 Cb 0.37 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 2i7t n LYS 112 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2i7t n LEU 122 N 0.82 0.00 -3.82 -0.35 4.77 -1.26 -5.18 117.00 111.98 2i7t n LEU 122 Ca 0.10 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 56.00 2i7t n LEU 122 Cb 0.39 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.49 2i7t n LEU 122 CO 0.09 0.00 0.56 -0.72 -1.33 0.00 0.00 177.39 175.99 2i7t s TYR 123 N 0.00 0.03 0.32 -1.77 -0.85 -1.26 -4.73 117.35 109.09 2i7t s TYR 123 Ca 0.00 -0.62 0.03 0.00 -0.52 0.00 0.00 57.07 55.97 2i7t s TYR 123 Cb 0.00 0.79 -0.06 0.00 0.38 0.00 0.00 41.96 43.07 2i7t s TYR 123 CO 0.00 -1.39 0.07 0.95 -1.52 0.00 0.00 175.55 173.66 2i7t s THR 124 N -2.69 1.04 0.38 -3.49 -4.23 -1.26 -5.01 115.64 100.39 2i7t s THR 124 Ca 0.15 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.83 2i7t s THR 124 Cb -0.05 -2.75 0.37 0.00 1.34 0.00 0.00 72.50 71.42 2i7t s THR 124 CO 0.09 0.00 1.75 -0.08 -0.54 0.00 0.00 174.62 175.84 2i7t h GLU 125 N 2.15 0.41 -0.06 3.99 4.57 -1.95 0.33 114.58 124.02 2i7t h GLU 125 Ca -0.40 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 57.75 2i7t h GLU 125 Cb 1.25 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.74 2i7t h GLU 125 CO 0.67 0.27 0.03 1.15 -1.18 0.00 0.00 179.01 179.96 2i7t h THR 126 N 0.42 1.10 -0.79 0.32 2.02 -2.00 -2.66 112.91 111.32 2i7t h THR 126 Ca 0.63 -0.28 0.04 0.00 0.77 0.00 0.00 66.41 67.56 2i7t h THR 126 Cb 1.50 1.18 -0.05 0.00 -1.74 0.00 0.00 68.15 69.04 2i7t h THR 126 CO -0.36 0.08 0.50 0.44 0.37 0.00 0.00 175.52 176.55 2i7t h ASP 127 N -0.02 0.82 0.08 4.18 3.32 -1.34 -1.77 116.42 121.69 2i7t h ASP 127 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2i7t h ASP 127 Cb 0.11 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2i7t h ASP 127 CO -0.00 0.55 -0.09 0.25 -1.72 0.00 0.00 179.24 178.24 2i7t h LEU 128 N 0.96 -0.23 -2.00 1.55 5.85 -1.30 -1.49 115.31 118.66 2i7t h LEU 128 Ca 0.32 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 59.05 2i7t h LEU 128 Cb 0.04 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 2i7t h LEU 128 CO -0.12 -0.13 -0.09 -0.33 -0.34 0.00 0.00 178.44 177.42 2i7t h GLU 129 N -0.19 0.00 0.00 1.25 5.08 -1.25 -1.70 114.58 117.77 2i7t h GLU 129 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2i7t h GLU 129 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2i7t h GLU 129 CO -0.03 0.09 -0.19 -1.91 -1.00 0.00 0.00 179.01 175.97 2i7t n GLU 130 N -3.96 0.28 0.02 2.33 4.07 -0.69 -3.66 120.64 119.03 2i7t n GLU 130 Ca -0.02 0.18 -0.01 0.00 -0.06 0.00 0.00 57.16 57.25 2i7t n GLU 130 Cb 0.18 -1.78 -0.10 0.00 -0.06 0.00 0.00 31.44 29.69 2i7t n GLU 130 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2i7t n SER 131 N -2.24 0.74 -0.33 4.31 7.64 -0.62 -4.20 113.62 118.91 2i7t n SER 131 Ca 0.05 0.33 0.15 0.00 1.01 0.00 0.00 58.87 60.41 2i7t n SER 131 Cb 0.44 0.33 0.35 0.00 -1.01 0.00 0.00 64.21 64.31 2i7t n SER 131 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2i7t h MET 132 N 0.00 0.50 0.00 1.43 2.86 -1.58 0.37 114.93 118.52 2i7t h MET 132 Ca -0.19 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.36 2i7t h MET 132 Cb 1.62 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 33.16 2i7t h MET 132 CO 0.04 0.33 -0.27 -0.44 1.06 0.00 0.00 176.91 177.63 2i7t h ASP 133 N 0.52 0.00 -0.01 1.22 5.19 -1.78 -2.47 116.42 119.09 2i7t h ASP 133 Ca 0.60 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 57.01 2i7t h ASP 133 Cb 1.13 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.64 2i7t h ASP 133 CO -0.49 0.27 0.00 0.29 -3.12 0.00 0.00 179.24 176.20 2i7t n LYS 134 N -4.00 1.31 -3.82 3.56 4.76 0.13 -4.77 118.16 115.33 2i7t n LYS 134 Ca -0.02 -0.45 -0.36 0.00 -2.87 0.00 0.00 58.31 54.61 2i7t n LYS 134 Cb 0.34 -1.48 -0.13 0.00 -1.84 0.00 0.00 35.03 31.91 2i7t n LYS 134 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2i7t s ILE 135 N -2.00 3.68 0.36 -0.18 1.01 -0.93 -4.12 121.20 119.03 2i7t s ILE 135 Ca 0.43 -0.68 -0.08 0.00 0.00 0.00 0.00 60.65 60.31 2i7t s ILE 135 Cb 0.21 -2.85 -0.06 0.00 0.01 0.00 0.00 42.46 39.78 2i7t s ILE 135 CO 0.35 0.18 0.68 -1.61 0.00 0.00 0.00 174.94 174.54 2i7t s GLU 136 N 1.47 3.72 0.38 2.79 2.02 0.19 -4.96 118.70 124.31 2i7t s GLU 136 Ca 0.03 0.29 0.08 0.00 0.02 0.00 0.00 54.97 55.38 2i7t s GLU 136 Cb -0.16 -2.49 -0.02 0.00 0.10 0.00 0.00 34.13 31.55 2i7t s GLU 136 CO 0.00 0.07 0.35 0.95 0.02 0.00 0.00 175.26 176.65 2i7t s THR 137 N -2.25 3.11 -0.17 3.63 -4.23 -1.26 -1.48 115.64 112.99 2i7t s THR 137 Ca 0.48 -1.33 -0.14 0.00 -1.18 0.00 0.00 61.69 59.52 2i7t s THR 137 Cb -0.10 -3.09 0.05 0.00 1.34 0.00 0.00 72.50 70.69 2i7t s THR 137 CO 0.30 -0.08 0.44 -0.51 -0.54 0.00 0.00 174.62 174.23 2i7t s ILE 138 N -2.38 -0.00 0.56 2.99 2.07 0.81 -4.78 121.20 120.47 2i7t s ILE 138 Ca 0.45 0.02 -0.08 0.00 -1.41 0.00 0.00 60.65 59.63 2i7t s ILE 138 Cb -0.05 -0.62 -0.03 0.00 0.13 0.00 0.00 42.46 41.90 2i7t s ILE 138 CO 0.28 0.01 0.91 0.20 -1.91 0.00 0.00 174.94 174.43 2i7t s ASN 139 N 0.48 6.08 0.43 4.50 0.01 -1.26 -3.94 114.94 121.23 2i7t s ASN 139 Ca -0.02 1.08 -0.24 0.00 -0.71 0.00 0.00 52.86 52.97 2i7t s ASN 139 Cb -0.04 -2.21 -0.08 0.00 0.41 0.00 0.00 41.25 39.33 2i7t s ASN 139 CO -0.02 -0.82 1.11 -0.36 -1.51 0.00 0.00 177.10 175.50 2i7t s PHE 140 N -2.98 3.07 -1.63 2.20 0.08 -1.26 -3.56 117.98 113.90 2i7t s PHE 140 Ca 0.52 1.59 -0.03 0.00 0.12 0.00 0.00 56.93 59.12 2i7t s PHE 140 Cb -0.11 -3.26 0.00 0.00 -0.57 0.00 0.00 43.02 39.09 2i7t s PHE 140 CO 0.49 -1.08 0.46 0.72 -0.10 0.00 0.00 175.22 175.70 2i7t n HIS 141 N -0.26 -1.73 -3.93 0.36 8.25 -0.56 -4.97 115.22 112.37 2i7t n HIS 141 Ca 0.06 0.39 -0.28 0.00 -0.26 0.00 0.00 57.72 57.63 2i7t n HIS 141 Cb 0.49 -4.39 -0.17 0.00 1.12 0.00 0.00 29.99 27.04 2i7t n HIS 141 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2i7t s GLU 142 N -5.54 1.70 0.05 -0.41 2.12 -1.23 -5.02 118.70 110.36 2i7t s GLU 142 Ca 0.23 -0.45 -0.30 0.00 0.36 0.00 0.00 54.97 54.81 2i7t s GLU 142 Cb -0.10 -1.89 -0.05 0.00 0.26 0.00 0.00 34.13 32.35 2i7t s GLU 142 CO 0.28 -0.32 1.13 0.08 -0.54 0.00 0.00 175.26 175.89 2i7t s VAL 143 N 1.61 4.28 0.11 3.70 1.01 -1.26 -4.50 120.40 125.35 2i7t s VAL 143 Ca 0.03 1.64 0.10 0.00 0.00 0.00 0.00 61.98 63.75 2i7t s VAL 143 Cb -0.14 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 2i7t s VAL 143 CO -0.09 0.13 -0.24 -0.75 0.00 0.00 0.00 175.10 174.15 2i7t s LYS 144 N 1.01 1.29 -0.05 2.72 2.47 0.13 -4.97 119.74 122.34 2i7t s LYS 144 Ca 0.56 -1.25 0.02 0.00 -1.56 0.00 0.00 55.97 53.74 2i7t s LYS 144 Cb -0.27 -1.68 0.01 0.00 -1.46 0.00 0.00 37.83 34.44 2i7t s LYS 144 CO 0.29 0.40 -0.10 -2.00 0.16 0.00 0.00 175.35 174.09 2i7t s GLU 145 N -1.95 1.35 -0.05 4.03 2.12 -1.26 -1.00 118.70 121.94 2i7t s GLU 145 Ca 0.11 -0.35 -0.02 0.00 0.36 0.00 0.00 54.97 55.07 2i7t s GLU 145 Cb -0.10 -1.18 0.04 0.00 0.26 0.00 0.00 34.13 33.15 2i7t s GLU 145 CO 0.05 0.06 0.09 0.08 -0.54 0.00 0.00 175.26 174.99 2i7t s VAL 146 N 0.51 -0.10 -1.24 3.70 1.01 -0.16 -4.89 120.40 119.24 2i7t s VAL 146 Ca -0.10 0.27 -0.08 0.00 0.00 0.00 0.00 61.98 62.08 2i7t s VAL 146 Cb -0.13 -0.17 0.06 0.00 0.00 0.00 0.00 36.38 36.13 2i7t s VAL 146 CO 0.02 0.11 0.42 0.00 0.00 0.00 0.00 175.10 175.65 2i7t n ALA 147 N 4.61 -1.02 -0.83 5.51 0.00 -1.26 0.56 120.51 128.07 2i7t n ALA 147 Ca -0.19 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2i7t n ALA 147 Cb 0.50 -2.60 0.00 0.00 0.00 0.00 0.00 19.45 17.35 2i7t n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i7t n GLY 148 N -1.12 0.58 3.38 0.00 0.00 -1.26 -4.96 105.19 101.80 2i7t n GLY 148 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 2i7t n GLY 148 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2i7t s ILE 149 N -2.01 3.93 -0.16 -0.61 1.01 0.19 -4.68 121.20 118.87 2i7t s ILE 149 Ca 0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 60.65 60.16 2i7t s ILE 149 Cb 0.00 -2.87 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 2i7t s ILE 149 CO 0.00 0.30 0.15 -0.54 0.00 0.00 0.00 174.94 174.85 2i7t s LYS 150 N 1.54 3.89 0.06 2.79 1.02 -0.60 -0.98 119.74 127.45 2i7t s LYS 150 Ca 0.05 -0.16 -0.07 0.00 0.02 0.00 0.00 55.97 55.82 2i7t s LYS 150 Cb -0.15 -3.32 -0.01 0.00 -0.52 0.00 0.00 37.83 33.82 2i7t s LYS 150 CO 0.01 0.50 0.13 -0.59 -0.92 0.00 0.00 175.35 174.48 2i7t s PHE 151 N -0.22 0.20 0.16 3.18 -0.71 -0.17 0.06 117.98 120.48 2i7t s PHE 151 Ca 0.11 -0.55 -0.21 0.00 -1.04 0.00 0.00 56.93 55.24 2i7t s PHE 151 Cb -0.12 -0.12 0.06 0.00 -1.21 0.00 0.00 43.02 41.63 2i7t s PHE 151 CO 0.01 -0.44 0.57 1.67 -1.34 0.00 0.00 175.22 175.69 2i7t s TRP 152 N -3.18 -0.44 0.16 3.49 -2.14 -0.71 -0.69 118.94 115.42 2i7t s TRP 152 Ca -0.00 0.19 0.07 0.00 2.66 0.00 0.00 56.10 59.02 2i7t s TRP 152 Cb 0.02 0.52 -0.04 0.00 -3.10 0.00 0.00 33.47 30.86 2i7t s TRP 152 CO -0.07 -0.86 -0.16 0.00 -2.66 0.00 0.00 176.95 173.20 2i7t s TYR 154 N -2.30 2.59 0.20 0.00 1.51 0.08 -1.50 117.35 117.93 2i7t s TYR 154 Ca 0.15 -0.35 -0.30 0.00 -1.01 0.00 0.00 57.07 55.55 2i7t s TYR 154 Cb -0.04 -1.37 -0.09 0.00 -0.11 0.00 0.00 41.96 40.35 2i7t s TYR 154 CO 0.05 0.53 1.26 -1.01 -1.11 0.00 0.00 175.55 175.27 2i7t s HIS 155 N -2.45 3.32 -1.45 2.71 3.76 -1.26 -1.34 115.29 118.58 2i7t s HIS 155 Ca 0.34 1.32 0.21 0.00 -0.15 0.00 0.00 55.06 56.78 2i7t s HIS 155 Cb -0.03 -3.53 -0.12 0.00 1.11 0.00 0.00 32.58 30.02 2i7t s HIS 155 CO 0.19 -1.57 0.95 0.00 -0.85 0.00 0.00 174.74 173.47 2i7t n ALA 156 N 2.47 4.08 -0.54 -1.40 0.00 -0.63 -1.84 120.51 122.65 2i7t n ALA 156 Ca 0.05 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.89 2i7t n ALA 156 Cb 0.44 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.14 2i7t n ALA 156 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i7t n GLY 157 N 1.43 1.85 5.06 0.00 0.00 -1.26 -1.65 105.19 110.62 2i7t n GLY 157 Ca 0.06 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2i7t n GLY 157 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2i7t n HIS 158 N 13.08 0.00 -4.12 1.61 -0.00 -1.26 -4.43 115.22 120.09 2i7t n HIS 158 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.61 2i7t n HIS 158 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 29.99 29.91 2i7t n HIS 158 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 2i7t s VAL 159 N 0.00 0.01 0.18 3.57 -7.23 -1.26 -4.90 120.40 110.77 2i7t s VAL 159 Ca 0.00 -1.79 -0.32 0.00 -1.81 0.00 0.00 61.98 58.06 2i7t s VAL 159 Cb 0.00 -2.34 -0.12 0.00 0.56 0.00 0.00 36.38 34.49 2i7t s VAL 159 CO 0.00 -0.06 1.76 -0.11 -0.31 0.00 0.00 175.10 176.39 2i7t n LEU 160 N -0.28 4.03 0.00 1.32 -0.00 -1.26 -1.93 117.00 118.88 2i7t n LEU 160 Ca -0.00 1.04 0.00 0.00 -0.00 0.00 0.00 56.01 57.04 2i7t n LEU 160 Cb 0.64 -1.57 0.00 0.00 -0.00 0.00 0.00 43.42 42.50 2i7t n LEU 160 CO 0.29 0.19 0.00 0.61 -0.00 0.00 0.00 177.39 178.48 2i7t n GLY 161 N 4.07 1.26 3.74 -3.96 0.00 -1.26 -4.62 105.19 104.42 2i7t n GLY 161 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2i7t n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i7t s ALA 162 N -3.71 3.69 0.11 4.61 0.00 -0.81 -4.58 121.76 121.06 2i7t s ALA 162 Ca 0.00 1.39 0.06 0.00 0.00 0.00 0.00 51.96 53.41 2i7t s ALA 162 Cb 0.00 -3.59 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 2i7t s ALA 162 CO 0.00 -0.80 -0.16 0.00 0.00 0.00 0.00 175.76 174.80 2i7t s ALA 163 N 0.25 1.52 -0.26 0.00 0.00 -0.41 -1.60 121.76 121.25 2i7t s ALA 163 Ca 0.63 -1.21 -0.02 0.00 0.00 0.00 0.00 51.96 51.36 2i7t s ALA 163 Cb -0.44 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.58 2i7t s ALA 163 CO 0.41 0.20 -0.04 -1.64 0.00 0.00 0.00 175.76 174.69 2i7t s MET 164 N -2.21 2.78 -0.11 0.00 -1.94 -0.45 -4.53 119.30 112.84 2i7t s MET 164 Ca 0.06 -1.02 -0.22 0.00 -1.71 0.00 0.00 55.69 52.79 2i7t s MET 164 Cb -0.08 -3.05 -0.03 0.00 2.01 0.00 0.00 34.83 33.68 2i7t s MET 164 CO 0.03 -0.44 0.66 -0.06 -0.01 0.00 0.00 175.02 175.20 2i7t s PHE 165 N 1.33 3.51 -0.17 -0.03 0.40 -0.79 -0.74 117.98 121.50 2i7t s PHE 165 Ca -0.01 1.13 -0.08 0.00 -0.60 0.00 0.00 56.93 57.37 2i7t s PHE 165 Cb -0.17 -2.78 -0.04 0.00 0.51 0.00 0.00 43.02 40.53 2i7t s PHE 165 CO -0.03 0.02 0.12 1.41 0.70 0.00 0.00 175.22 177.44 2i7t s MET 166 N 1.11 3.87 -0.03 0.44 -2.45 0.11 -1.04 119.30 121.31 2i7t s MET 166 Ca 0.34 -0.21 0.07 0.00 -1.25 0.00 0.00 55.69 54.64 2i7t s MET 166 Cb -0.17 -3.30 -0.02 0.00 1.25 0.00 0.00 34.83 32.60 2i7t s MET 166 CO 0.15 0.48 -0.23 0.42 1.05 0.00 0.00 175.02 176.88 2i7t s ILE 167 N -0.16 1.83 -0.06 10.11 1.01 0.13 -1.74 121.20 132.32 2i7t s ILE 167 Ca 0.10 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.78 2i7t s ILE 167 Cb -0.11 -1.53 0.02 0.00 0.01 0.00 0.00 42.46 40.85 2i7t s ILE 167 CO 0.00 0.52 -0.06 -0.70 0.00 0.00 0.00 174.94 174.70 2i7t s GLU 168 N -0.44 1.11 -0.07 2.79 2.12 0.11 -0.80 118.70 123.52 2i7t s GLU 168 Ca 0.06 -0.18 -0.03 0.00 0.36 0.00 0.00 54.97 55.18 2i7t s GLU 168 Cb -0.10 -1.07 0.04 0.00 0.26 0.00 0.00 34.13 33.26 2i7t s GLU 168 CO 0.00 -0.09 0.11 0.42 -0.54 0.00 0.00 175.26 175.17 2i7t s ILE 169 N 1.01 -0.19 -1.48 -3.70 1.01 -0.48 -1.56 121.20 115.81 2i7t s ILE 169 Ca -0.09 0.36 -0.11 0.00 0.00 0.00 0.00 60.65 60.81 2i7t s ILE 169 Cb -0.14 -0.25 0.07 0.00 0.01 0.00 0.00 42.46 42.14 2i7t s ILE 169 CO -0.00 0.14 0.92 0.00 0.00 0.00 0.00 174.94 176.00 2i7t n ALA 170 N 5.31 -1.44 -0.09 9.38 0.00 -1.26 -1.09 120.51 131.32 2i7t n ALA 170 Ca -0.04 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2i7t n ALA 170 Cb 0.50 -3.96 0.00 0.00 0.00 0.00 0.00 19.45 15.99 2i7t n ALA 170 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i7t n GLY 171 N -1.68 2.68 3.75 0.00 0.00 -1.26 -5.00 105.19 103.67 2i7t n GLY 171 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 2i7t n GLY 171 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i7t s VAL 172 N -2.99 5.01 -0.04 1.61 1.01 -0.25 -5.04 120.40 119.71 2i7t s VAL 172 Ca 0.00 1.18 0.07 0.00 0.00 0.00 0.00 61.98 63.23 2i7t s VAL 172 Cb 0.00 -3.91 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 2i7t s VAL 172 CO 0.00 0.37 -0.25 -0.54 0.00 0.00 0.00 175.10 174.69 2i7t s LYS 173 N 0.14 2.29 -0.04 2.72 1.02 -1.26 -1.38 119.74 123.23 2i7t s LYS 173 Ca 0.30 -0.89 0.02 0.00 0.02 0.00 0.00 55.97 55.42 2i7t s LYS 173 Cb -0.17 -2.05 0.01 0.00 -0.52 0.00 0.00 37.83 35.09 2i7t s LYS 173 CO 0.15 0.45 -0.09 -1.17 -0.92 0.00 0.00 175.35 173.78 2i7t s LEU 174 N -0.35 1.65 -0.16 3.17 0.20 0.02 0.67 118.68 123.88 2i7t s LEU 174 Ca 0.03 -0.20 -0.03 0.00 0.69 0.00 0.00 54.13 54.62 2i7t s LEU 174 Cb -0.12 -0.58 -0.02 0.00 -0.43 0.00 0.00 46.19 45.04 2i7t s LEU 174 CO 0.01 0.03 -0.05 -0.22 -0.29 0.00 0.00 176.35 175.83 2i7t s LEU 175 N 0.46 3.10 -0.25 -0.68 2.96 0.34 0.19 118.68 124.82 2i7t s LEU 175 Ca -0.08 -0.20 -0.02 0.00 -0.22 0.00 0.00 54.13 53.62 2i7t s LEU 175 Cb -0.12 -1.74 0.03 0.00 0.50 0.00 0.00 46.19 44.85 2i7t s LEU 175 CO 0.01 0.14 -0.06 -0.47 -1.32 0.00 0.00 176.35 174.65 2i7t s TYR 176 N 0.51 3.06 0.02 5.38 5.04 -0.21 -0.43 117.35 130.72 2i7t s TYR 176 Ca -0.04 -1.55 0.28 0.00 -2.44 0.00 0.00 57.07 53.32 2i7t s TYR 176 Cb -0.15 -2.06 1.02 0.00 0.35 0.00 0.00 41.96 41.12 2i7t s TYR 176 CO 0.03 -0.73 1.86 1.79 -1.34 0.00 0.00 175.55 177.16 2i7t h THR 177 N 6.13 0.20 0.00 4.34 1.35 -1.53 -2.09 112.91 121.31 2i7t h THR 177 Ca -0.33 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 64.69 2i7t h THR 177 Cb 1.11 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 2i7t h THR 177 CO 0.57 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 176.54 2i7t n GLY 178 N 0.28 2.57 3.83 5.82 0.00 -1.26 -4.22 105.19 112.22 2i7t n GLY 178 Ca 0.01 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 2i7t n GLY 178 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2i7t s ASP 179 N -4.00 6.31 0.10 1.61 1.01 -1.26 -4.13 116.67 116.32 2i7t s ASP 179 Ca 0.00 0.39 -0.09 0.00 0.71 0.00 0.00 52.55 53.56 2i7t s ASP 179 Cb 0.00 -2.07 -0.00 0.00 1.01 0.00 0.00 42.92 41.86 2i7t s ASP 179 CO 0.00 0.33 0.21 0.72 0.21 0.00 0.00 175.17 176.64 2i7t s PHE 180 N -0.56 0.20 0.06 4.23 -0.00 -1.26 -4.74 117.98 115.91 2i7t s PHE 180 Ca 0.13 -0.61 0.01 0.00 -0.00 0.00 0.00 56.93 56.46 2i7t s PHE 180 Cb -0.12 -0.06 -0.03 0.00 -0.00 0.00 0.00 43.02 42.81 2i7t s PHE 180 CO 0.02 -0.58 -0.06 -1.54 -0.00 0.00 0.00 175.22 173.06 2i7t s SER 181 N -2.88 0.83 -0.10 1.98 1.04 -0.66 -2.04 113.70 111.87 2i7t s SER 181 Ca 0.07 -0.78 0.14 0.00 0.48 0.00 0.00 55.95 55.87 2i7t s SER 181 Cb 0.05 0.09 0.25 0.00 0.10 0.00 0.00 66.02 66.50 2i7t s SER 181 CO -0.09 -0.37 1.12 0.54 0.98 0.00 0.00 173.24 175.43 2i7t n ARG 182 N 0.73 0.95 -0.08 4.02 5.12 -1.26 -0.54 116.66 125.59 2i7t n ARG 182 Ca -0.18 -2.27 -0.10 0.00 -1.93 0.00 0.00 57.85 53.37 2i7t n ARG 182 Cb 0.58 -1.20 -0.15 0.00 -1.16 0.00 0.00 32.46 30.53 2i7t n ARG 182 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2i7t n GLN 183 N -0.95 0.68 0.00 5.56 10.64 -1.26 -4.82 117.38 127.22 2i7t n GLN 183 Ca 0.12 0.06 0.00 0.00 -1.83 0.00 0.00 57.00 55.35 2i7t n GLN 183 Cb 0.69 -1.58 0.00 0.00 -0.86 0.00 0.00 30.24 28.49 2i7t n GLN 183 CO 0.00 0.00 0.00 -0.12 -1.83 0.00 0.00 177.06 175.11 2i7t n MET 189 N -2.83 0.00 -4.05 2.61 0.00 -1.26 -4.94 117.12 106.65 2i7t n MET 189 Ca -0.30 0.00 -0.31 0.00 -0.00 0.00 0.00 57.70 57.09 2i7t n MET 189 Cb 1.13 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 34.29 2i7t n MET 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2i7t s ALA 190 N 0.00 3.60 0.37 -5.12 0.00 -1.26 -4.35 121.76 115.00 2i7t s ALA 190 Ca 0.00 -0.99 -0.28 0.00 0.00 0.00 0.00 51.96 50.70 2i7t s ALA 190 Cb 0.00 -1.47 -0.10 0.00 0.00 0.00 0.00 23.12 21.55 2i7t s ALA 190 CO 0.00 0.75 1.37 0.00 0.00 0.00 0.00 175.76 177.88 2i7t s ALA 191 N -1.38 3.45 0.41 0.00 0.00 0.29 -4.46 121.76 120.07 2i7t s ALA 191 Ca 0.29 1.37 -0.23 0.00 0.00 0.00 0.00 51.96 53.39 2i7t s ALA 191 Cb -0.12 -3.53 -0.10 0.00 0.00 0.00 0.00 23.12 19.37 2i7t s ALA 191 CO 0.22 -0.84 0.99 -1.21 0.00 0.00 0.00 175.76 174.91 2i7t s GLU 192 N -2.03 4.22 -0.39 0.00 2.02 -0.76 -4.92 118.70 116.85 2i7t s GLU 192 Ca 0.53 1.31 -0.10 0.00 0.02 0.00 0.00 54.97 56.72 2i7t s GLU 192 Cb -0.42 -2.40 0.05 0.00 0.10 0.00 0.00 34.13 31.46 2i7t s GLU 192 CO 0.55 -0.05 0.22 0.42 0.02 0.00 0.00 175.26 176.42 2i7t s ILE 193 N -1.88 4.36 0.29 -1.63 1.01 -1.26 -4.91 121.20 117.18 2i7t s ILE 193 Ca 0.59 -1.12 -0.30 0.00 0.00 0.00 0.00 60.65 59.82 2i7t s ILE 193 Cb -0.16 -3.54 -0.13 0.00 0.01 0.00 0.00 42.46 38.64 2i7t s ILE 193 CO 0.20 -0.35 1.37 -2.65 0.00 0.00 0.00 174.94 173.51 2i7t n PRO 194 N 4.95 2.15 0.15 2.79 -0.02 -1.26 -4.88 135.00 138.87 2i7t n PRO 194 Ca -0.11 0.76 0.05 0.00 -2.02 0.00 0.00 63.50 62.18 2i7t n PRO 194 Cb 0.44 -2.39 0.05 0.00 -0.02 0.00 0.00 33.50 31.58 2i7t n PRO 194 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2i7t h ASN 195 N 3.52 0.00 -3.03 2.55 2.35 -1.99 -3.43 115.58 115.55 2i7t h ASN 195 Ca -0.46 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 54.72 2i7t h ASN 195 Cb 1.27 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.60 2i7t h ASN 195 CO 0.70 0.34 0.81 -0.63 -1.65 0.00 0.00 177.43 177.01 2i7t s ILE 196 N -3.05 4.51 -0.17 2.81 1.01 -1.26 -4.99 121.20 120.05 2i7t s ILE 196 Ca 0.04 1.82 -0.25 0.00 0.00 0.00 0.00 60.65 62.25 2i7t s ILE 196 Cb 0.07 -4.17 -0.01 0.00 0.01 0.00 0.00 42.46 38.36 2i7t s ILE 196 CO 0.73 -0.14 0.83 -0.54 0.00 0.00 0.00 174.94 175.83 2i7t s LYS 197 N 3.15 4.29 0.41 2.79 -0.14 -1.26 -5.05 119.74 123.92 2i7t s LYS 197 Ca 0.49 1.02 -0.09 0.00 -1.36 0.00 0.00 55.97 56.03 2i7t s LYS 197 Cb -0.18 -3.58 -0.06 0.00 -1.68 0.00 0.00 37.83 32.33 2i7t s LYS 197 CO 0.11 -0.34 0.75 -1.25 -0.76 0.00 0.00 175.35 173.87 2i7t s PRO 198 N 2.19 3.74 0.12 -1.68 0.04 -1.26 -4.91 135.00 133.24 2i7t s PRO 198 Ca 0.38 0.40 0.07 0.00 0.04 0.00 0.00 61.00 61.89 2i7t s PRO 198 Cb -0.16 -2.41 -0.19 0.00 0.04 0.00 0.00 34.50 31.77 2i7t s PRO 198 CO 0.12 -0.04 1.29 -0.44 0.04 0.00 0.00 177.00 177.97 2i7t h ASP 199 N 1.16 0.00 -3.88 6.66 3.32 -0.15 -3.41 116.42 120.13 2i7t h ASP 199 Ca -0.47 -0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.20 2i7t h ASP 199 Cb 1.19 -0.00 -0.30 0.00 0.22 0.00 0.00 39.33 40.44 2i7t h ASP 199 CO 0.64 0.99 -0.77 -0.63 -1.72 0.00 0.00 179.24 177.75 2i7t s ILE 200 N -2.74 0.60 -0.13 0.35 1.01 -0.69 -3.12 121.20 116.48 2i7t s ILE 200 Ca 0.01 -0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.38 2i7t s ILE 200 Cb 0.10 -0.53 0.02 0.00 0.01 0.00 0.00 42.46 42.06 2i7t s ILE 200 CO 0.82 0.18 -0.17 -0.22 0.00 0.00 0.00 174.94 175.55 2i7t s LEU 201 N 0.05 1.85 -0.27 2.97 2.96 -0.22 -0.50 118.68 125.52 2i7t s LEU 201 Ca -0.00 -0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 53.33 2i7t s LEU 201 Cb -0.05 -1.24 -0.01 0.00 0.50 0.00 0.00 46.19 45.38 2i7t s LEU 201 CO -0.00 0.01 0.08 -0.63 -1.32 0.00 0.00 176.35 174.48 2i7t s ILE 202 N 1.11 4.16 0.04 6.68 1.01 0.43 0.21 121.20 134.84 2i7t s ILE 202 Ca -0.02 -0.40 0.04 0.00 0.00 0.00 0.00 60.65 60.26 2i7t s ILE 202 Cb -0.14 -3.03 -0.02 0.00 0.01 0.00 0.00 42.46 39.27 2i7t s ILE 202 CO -0.05 0.22 -0.11 -0.51 0.00 0.00 0.00 174.94 174.49 2i7t s ILE 203 N 1.57 0.86 0.64 2.92 2.07 -0.41 -1.38 121.20 127.46 2i7t s ILE 203 Ca 0.05 -0.96 -0.17 0.00 -1.41 0.00 0.00 60.65 58.16 2i7t s ILE 203 Cb -0.16 -0.82 -0.01 0.00 0.13 0.00 0.00 42.46 41.60 2i7t s ILE 203 CO 0.03 -0.11 1.16 -1.83 -1.91 0.00 0.00 174.94 172.27 2i7t s GLU 204 N -1.20 2.80 -0.07 3.50 -1.05 -1.26 -2.04 118.70 119.38 2i7t s GLU 204 Ca -0.02 1.62 0.11 0.00 -0.15 0.00 0.00 54.97 56.53 2i7t s GLU 204 Cb -0.08 -1.93 0.16 0.00 -0.44 0.00 0.00 34.13 31.84 2i7t s GLU 204 CO 0.01 -1.29 1.05 0.43 0.95 0.00 0.00 175.26 176.41 2i7t n SER 205 N -2.07 1.62 -0.38 0.83 7.64 0.21 -4.82 113.62 116.65 2i7t n SER 205 Ca 0.12 -2.55 -0.06 0.00 1.01 0.00 0.00 58.87 57.39 2i7t n SER 205 Cb 0.51 -0.29 -0.03 0.00 -1.01 0.00 0.00 64.21 63.39 2i7t n SER 205 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2i7t h THR 206 N 1.79 0.01 -0.20 0.44 2.02 -1.07 -1.49 112.91 114.41 2i7t h THR 206 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2i7t h THR 206 Cb 1.02 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2i7t h THR 206 CO 0.00 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.67 2i7t n TYR 207 N -5.37 0.25 0.00 3.16 4.01 -1.26 -4.69 117.16 113.27 2i7t n TYR 207 Ca 0.06 -0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 2i7t n TYR 207 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 2i7t n TYR 207 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2i7t n GLY 208 N 1.10 3.03 1.13 2.72 0.00 -0.56 -1.14 105.19 111.47 2i7t n GLY 208 Ca 0.15 0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.30 2i7t n GLY 208 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2i7t n THR 209 N 0.00 0.79 -1.43 2.61 -2.24 -1.26 -3.94 114.28 108.80 2i7t n THR 209 Ca 0.00 -0.81 -0.33 0.00 -2.27 0.00 0.00 64.05 60.64 2i7t n THR 209 Cb 0.00 0.46 0.09 0.00 -2.10 0.00 0.00 70.33 68.77 2i7t n THR 209 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2i7t s HIS 210 N -1.21 2.24 -0.11 4.78 4.02 -0.29 -4.66 115.29 120.07 2i7t s HIS 210 Ca 0.41 1.60 0.02 0.00 1.02 0.00 0.00 55.06 58.12 2i7t s HIS 210 Cb 0.22 -3.31 0.01 0.00 -1.02 0.00 0.00 32.58 28.48 2i7t s HIS 210 CO 0.29 -2.24 -0.18 0.42 1.02 0.00 0.00 174.74 174.05 2i7t s ILE 211 N -2.28 1.70 0.19 0.60 1.01 -1.26 -1.27 121.20 119.88 2i7t s ILE 211 Ca 0.69 -0.78 -0.30 0.00 0.00 0.00 0.00 60.65 60.27 2i7t s ILE 211 Cb -0.24 -1.52 -0.08 0.00 0.01 0.00 0.00 42.46 40.63 2i7t s ILE 211 CO 0.47 0.48 1.13 -1.00 0.00 0.00 0.00 174.94 176.02 2i7t s HIS 212 N 0.79 3.54 0.66 3.97 3.76 -1.26 -5.01 115.29 121.74 2i7t s HIS 212 Ca -0.10 1.56 -0.16 0.00 -0.15 0.00 0.00 55.06 56.21 2i7t s HIS 212 Cb -0.16 -3.33 0.00 0.00 1.11 0.00 0.00 32.58 30.21 2i7t s HIS 212 CO 0.01 -0.79 1.16 -1.83 -0.85 0.00 0.00 174.74 172.44 2i7t s GLU 213 N -0.46 2.66 0.22 1.40 -1.05 -1.26 -4.90 118.70 115.31 2i7t s GLU 213 Ca 0.50 1.62 -0.30 0.00 -0.15 0.00 0.00 54.97 56.64 2i7t s GLU 213 Cb -0.31 -1.91 -0.16 0.00 -0.44 0.00 0.00 34.13 31.32 2i7t s GLU 213 CO 0.36 -1.40 0.92 1.63 0.95 0.00 0.00 175.26 177.73 2i7t n LYS 214 N -2.24 0.88 -0.32 -4.83 4.76 -1.26 -4.74 118.16 110.40 2i7t n LYS 214 Ca 0.12 0.31 0.03 0.00 -2.87 0.00 0.00 58.31 55.90 2i7t n LYS 214 Cb 0.51 -1.62 0.18 0.00 -1.84 0.00 0.00 35.03 32.25 2i7t n LYS 214 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 2i7t h ARG 215 N 2.14 0.92 -0.53 1.97 2.43 -1.99 -0.28 114.38 119.04 2i7t h ARG 215 Ca -0.38 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 58.63 2i7t h ARG 215 Cb 1.37 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 2i7t h ARG 215 CO 0.62 0.61 -0.09 1.05 -1.51 0.00 0.00 179.97 180.65 2i7t h GLU 216 N 0.95 0.98 0.00 0.20 4.11 -1.99 -1.24 114.58 117.58 2i7t h GLU 216 Ca 0.42 -0.35 -0.10 0.00 0.07 0.00 0.00 59.36 59.40 2i7t h GLU 216 Cb 0.31 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2i7t h GLU 216 CO -0.22 1.02 -0.48 0.93 0.07 0.00 0.00 179.01 180.34 2i7t h GLU 217 N 0.88 0.00 -0.13 1.06 5.08 -1.73 -1.88 114.58 117.86 2i7t h GLU 217 Ca 0.14 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.41 2i7t h GLU 217 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2i7t h GLU 217 CO 0.04 0.48 -0.26 -0.09 -1.00 0.00 0.00 179.01 178.18 2i7t h ARG 218 N 0.00 0.40 0.00 2.33 2.43 -0.68 -1.71 114.38 117.16 2i7t h ARG 218 Ca -0.00 -0.26 -0.10 0.00 -0.81 0.00 0.00 59.98 58.80 2i7t h ARG 218 Cb 0.87 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 2i7t h ARG 218 CO 0.06 0.86 -0.48 0.93 -1.51 0.00 0.00 179.97 179.83 2i7t h GLU 219 N -0.01 0.00 -0.13 0.20 5.08 -1.17 -1.40 114.58 117.16 2i7t h GLU 219 Ca 0.00 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 2i7t h GLU 219 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 2i7t h GLU 219 CO 0.06 0.48 -0.32 0.00 -1.00 0.00 0.00 179.01 178.23 2i7t h ALA 220 N 1.52 0.21 -0.32 3.43 0.00 -1.32 -1.28 119.26 121.50 2i7t h ALA 220 Ca -0.00 -0.43 -0.08 0.00 0.00 0.00 0.00 54.91 54.40 2i7t h ALA 220 Cb 0.87 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2i7t h ALA 220 CO 0.06 0.26 -0.12 -0.09 0.00 0.00 0.00 179.25 179.36 2i7t h ARG 221 N 0.04 0.55 -0.10 0.00 2.43 -1.17 0.79 114.38 116.92 2i7t h ARG 221 Ca -0.00 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.00 2i7t h ARG 221 Cb 0.93 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.42 2i7t h ARG 221 CO 0.07 0.66 0.04 0.35 -1.51 0.00 0.00 179.97 179.59 2i7t h PHE 222 N 0.51 0.16 -0.63 2.20 3.04 -1.21 -0.84 116.94 120.18 2i7t h PHE 222 Ca 0.09 -0.01 -0.09 0.00 3.98 0.00 0.00 57.97 61.94 2i7t h PHE 222 Cb 0.51 -0.05 -0.02 0.00 2.56 0.00 0.00 35.95 38.95 2i7t h PHE 222 CO 0.02 0.26 0.02 0.00 -2.02 0.00 0.00 178.31 176.59 2i7t h ASN 224 N 1.00 0.00 -0.13 0.00 2.35 -0.77 -0.87 115.58 117.16 2i7t h ASN 224 Ca 0.18 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.79 2i7t h ASN 224 Cb 0.54 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.92 2i7t h ASN 224 CO 0.03 0.45 -0.48 0.74 -1.65 0.00 0.00 177.43 176.51 2i7t h THR 225 N 0.00 1.35 -0.66 2.81 2.02 -0.95 -1.30 112.91 116.18 2i7t h THR 225 Ca -0.00 -1.78 -0.04 0.00 0.77 0.00 0.00 66.41 65.35 2i7t h THR 225 Cb 0.82 2.11 -0.03 0.00 -1.74 0.00 0.00 68.15 69.31 2i7t h THR 225 CO 0.06 0.54 0.24 0.58 0.37 0.00 0.00 175.52 177.31 2i7t h VAL 226 N 0.17 1.25 -0.10 3.16 2.07 -1.28 -2.32 116.25 119.20 2i7t h VAL 226 Ca -0.02 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.70 2i7t h VAL 226 Cb 1.12 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 2i7t h VAL 226 CO 0.10 0.31 0.07 -0.74 0.02 0.00 0.00 177.57 177.33 2i7t h HIS 227 N 0.95 0.13 -0.76 1.57 6.17 -1.13 -2.37 115.15 119.70 2i7t h HIS 227 Ca 0.22 0.00 0.08 0.00 0.71 0.00 0.00 60.37 61.38 2i7t h HIS 227 Cb 0.25 -0.04 -0.07 0.00 2.52 0.00 0.00 27.41 30.07 2i7t h HIS 227 CO 0.02 0.10 0.42 -0.44 0.71 0.00 0.00 177.93 178.74 2i7t h ASP 228 N 0.13 0.60 0.11 3.26 3.32 -0.97 -0.80 116.42 122.07 2i7t h ASP 228 Ca 0.04 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 2i7t h ASP 228 Cb 0.00 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.48 2i7t h ASP 228 CO -0.01 0.36 -0.05 0.40 -1.72 0.00 0.00 179.24 178.22 2i7t h ILE 229 N 0.73 0.94 0.00 0.35 2.04 -1.14 -2.77 117.51 117.66 2i7t h ILE 229 Ca 0.36 -0.18 -0.11 0.00 1.00 0.00 0.00 64.86 65.93 2i7t h ILE 229 Cb 0.30 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 2i7t h ILE 229 CO -0.23 0.04 -0.50 -0.37 0.00 0.00 0.00 178.15 177.09 2i7t h VAL 230 N -0.23 1.24 -0.29 1.67 -1.51 -1.21 0.18 116.25 116.10 2i7t h VAL 230 Ca -0.01 -1.80 -0.05 0.00 -1.23 0.00 0.00 66.70 63.60 2i7t h VAL 230 Cb 0.18 2.01 -0.02 0.00 -2.13 0.00 0.00 31.29 31.33 2i7t h VAL 230 CO 0.02 0.49 -0.05 -1.13 -1.23 0.00 0.00 177.57 175.68 2i7t h ASN 231 N 0.00 0.43 -0.29 4.19 -1.24 -1.04 -1.53 115.58 116.11 2i7t h ASN 231 Ca -0.01 -0.09 0.00 0.00 0.71 0.00 0.00 56.30 56.92 2i7t h ASN 231 Cb 0.96 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 39.90 2i7t h ASN 231 CO 0.07 0.54 0.00 -2.11 -1.29 0.00 0.00 177.43 174.63 2i7t n ARG 232 N -4.27 2.23 -0.84 6.67 1.85 -1.06 -4.85 116.66 116.40 2i7t n ARG 232 Ca 0.01 -1.27 0.00 0.00 -1.00 0.00 0.00 57.85 55.59 2i7t n ARG 232 Cb 0.26 -1.55 0.00 0.00 -1.05 0.00 0.00 32.46 30.12 2i7t n ARG 232 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2i7t n GLY 233 N 0.64 0.54 3.92 2.89 0.00 -0.58 -4.90 105.19 107.70 2i7t n GLY 233 Ca 0.11 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.50 2i7t n GLY 233 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i7t s GLY 234 N -2.34 1.60 -0.22 -0.02 0.00 0.63 -4.29 107.32 102.69 2i7t s GLY 234 Ca 0.00 -0.74 -0.08 0.00 0.00 0.00 0.00 44.72 43.90 2i7t s GLY 234 CO 0.00 -0.47 0.10 0.50 0.00 0.00 0.00 173.10 173.23 2i7t s ARG 235 N -4.94 3.94 -0.25 2.90 1.81 -1.26 -2.77 118.95 118.39 2i7t s ARG 235 Ca 0.53 -0.35 -0.05 0.00 -1.72 0.00 0.00 55.73 54.14 2i7t s ARG 235 Cb -0.10 -3.35 -0.01 0.00 -0.45 0.00 0.00 34.95 31.04 2i7t s ARG 235 CO 0.44 0.10 0.01 0.20 -0.68 0.00 0.00 175.30 175.37 2i7t s GLY 236 N 0.87 1.69 -0.19 -3.53 0.00 0.39 -1.43 107.32 105.12 2i7t s GLY 236 Ca 0.05 -1.24 -0.13 0.00 0.00 0.00 0.00 44.72 43.40 2i7t s GLY 236 CO 0.03 0.51 0.26 -2.27 0.00 0.00 0.00 173.10 171.63 2i7t s LEU 237 N 1.50 4.20 -0.46 0.66 2.96 0.69 -0.64 118.68 127.59 2i7t s LEU 237 Ca 0.05 0.40 0.03 0.00 -0.22 0.00 0.00 54.13 54.39 2i7t s LEU 237 Cb -0.15 -2.31 0.13 0.00 0.50 0.00 0.00 46.19 44.36 2i7t s LEU 237 CO -0.01 0.08 0.22 -0.63 -1.32 0.00 0.00 176.35 174.70 2i7t s ILE 238 N 0.68 1.91 0.25 6.68 1.01 0.12 -0.90 121.20 130.94 2i7t s ILE 238 Ca 0.14 -2.77 -0.30 0.00 0.00 0.00 0.00 60.65 57.72 2i7t s ILE 238 Cb -0.13 -2.34 -0.10 0.00 0.01 0.00 0.00 42.46 39.90 2i7t s ILE 238 CO 0.04 -0.82 1.35 -2.84 0.00 0.00 0.00 174.94 172.66 2i7t s PRO 239 N 0.22 4.34 0.00 2.79 0.02 -1.26 -2.31 135.00 138.81 2i7t s PRO 239 Ca 0.16 2.18 -0.17 0.00 0.02 0.00 0.00 61.00 63.19 2i7t s PRO 239 Cb -0.24 -3.13 0.03 0.00 0.02 0.00 0.00 34.50 31.17 2i7t s PRO 239 CO -0.02 -0.28 0.36 0.14 -0.33 0.00 0.00 177.00 176.87 2i7t s VAL 240 N -0.27 0.06 0.61 3.83 -7.23 0.08 -4.30 120.40 113.18 2i7t s VAL 240 Ca 0.55 -0.46 0.01 0.00 -1.81 0.00 0.00 61.98 60.27 2i7t s VAL 240 Cb -0.39 -0.77 0.12 0.00 0.56 0.00 0.00 36.38 35.90 2i7t s VAL 240 CO 0.44 -0.25 0.84 0.49 -0.31 0.00 0.00 175.10 176.31 2i7t n PHE 241 N 0.98 -2.92 0.00 2.82 3.72 -1.26 -2.65 117.46 118.14 2i7t n PHE 241 Ca -0.20 -1.56 0.00 0.00 -0.05 0.00 0.00 57.45 55.64 2i7t n PHE 241 Cb 0.57 -0.61 0.00 0.00 -0.94 0.00 0.00 39.48 38.50 2i7t n PHE 241 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2i7t n ALA 242 N -2.86 0.00 -2.80 4.37 0.00 -1.26 -4.14 120.51 113.83 2i7t n ALA 242 Ca -0.14 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.22 2i7t n ALA 242 Cb 0.51 0.01 0.03 0.00 0.00 0.00 0.00 19.45 20.00 2i7t n ALA 242 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2i7t n LEU 243 N -0.40 -2.83 -0.72 0.00 -0.00 -1.26 -4.78 117.00 107.01 2i7t n LEU 243 Ca 0.00 -3.30 0.09 0.00 -0.00 0.00 0.00 56.01 52.80 2i7t n LEU 243 Cb 0.00 0.80 0.07 0.00 -0.00 0.00 0.00 43.42 44.29 2i7t n LEU 243 CO 0.00 1.98 0.53 0.61 -0.00 0.00 0.00 177.39 180.51 2i7t n GLY 244 N 2.04 0.41 0.00 -3.96 0.00 -1.26 -4.74 105.19 97.68 2i7t n GLY 244 Ca 0.13 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2i7t n GLY 244 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2i7t n ARG 245 N 0.97 0.00 -0.19 1.61 3.00 -1.26 -4.68 116.66 116.10 2i7t n ARG 245 Ca 0.11 0.00 -0.12 0.00 -0.00 0.00 0.00 57.85 57.84 2i7t n ARG 245 Cb 0.46 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 32.83 2i7t n ARG 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2i7t h ALA 246 N 0.00 -0.68 -0.53 5.13 0.00 -1.85 -0.53 119.26 120.80 2i7t h ALA 246 Ca 0.00 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2i7t h ALA 246 Cb 0.00 1.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2i7t h ALA 246 CO 0.00 -0.96 0.35 -0.56 0.00 0.00 0.00 179.25 178.08 2i7t h GLN 247 N -0.27 0.68 -0.58 0.00 -0.00 -1.93 -2.21 115.11 110.80 2i7t h GLN 247 Ca 0.09 -0.04 -0.09 0.00 -0.00 0.00 0.00 58.65 58.60 2i7t h GLN 247 Cb 0.50 -0.15 -0.02 0.00 -0.00 0.00 0.00 27.48 27.80 2i7t h GLN 247 CO -0.62 0.45 0.00 1.49 -0.00 0.00 0.00 178.83 180.15 2i7t h GLU 248 N 0.70 1.00 -0.32 0.06 4.81 -1.62 -2.51 114.58 116.70 2i7t h GLU 248 Ca 0.20 -0.30 -0.13 0.00 -0.13 0.00 0.00 59.36 58.99 2i7t h GLU 248 Cb -0.06 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 2i7t h GLU 248 CO -0.04 0.98 -0.35 -0.07 -0.73 0.00 0.00 179.01 178.79 2i7t h LEU 249 N 0.91 0.75 -1.28 1.64 3.38 -0.65 -2.56 115.31 117.51 2i7t h LEU 249 Ca 0.17 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 2i7t h LEU 249 Cb 0.53 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2i7t h LEU 249 CO 0.03 1.03 0.28 -0.07 0.09 0.00 0.00 178.44 179.80 2i7t h LEU 250 N 0.60 0.70 -0.72 1.67 3.38 -1.23 -0.83 115.31 118.88 2i7t h LEU 250 Ca 0.06 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2i7t h LEU 250 Cb 0.88 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2i7t h LEU 250 CO 0.08 0.58 -0.09 -0.07 0.09 0.00 0.00 178.44 179.03 2i7t h LEU 251 N 0.78 0.88 -0.14 1.67 3.38 -1.19 -1.38 115.31 119.32 2i7t h LEU 251 Ca 0.20 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 2i7t h LEU 251 Cb 0.06 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2i7t h LEU 251 CO -0.03 0.99 -0.04 0.40 0.09 0.00 0.00 178.44 179.85 2i7t h ILE 252 N 0.81 1.30 -0.17 1.22 2.04 -0.93 -2.73 117.51 119.04 2i7t h ILE 252 Ca 0.14 -1.02 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 2i7t h ILE 252 Cb 0.60 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 2i7t h ILE 252 CO 0.04 0.30 0.04 -0.07 0.00 0.00 0.00 178.15 178.45 2i7t h LEU 253 N -0.05 0.26 -0.62 1.44 3.38 -1.12 -1.70 115.31 116.90 2i7t h LEU 253 Ca 0.03 -0.24 0.09 0.00 0.09 0.00 0.00 57.88 57.85 2i7t h LEU 253 Cb 0.48 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.09 2i7t h LEU 253 CO 0.02 0.44 0.26 -0.78 0.09 0.00 0.00 178.44 178.46 2i7t h ASP 254 N 0.08 0.30 -0.08 -0.43 3.58 -1.32 0.28 116.42 118.84 2i7t h ASP 254 Ca 0.05 0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 2i7t h ASP 254 Cb 0.28 0.03 -0.00 0.00 1.72 0.00 0.00 39.33 41.35 2i7t h ASP 254 CO 0.00 0.18 0.04 -0.08 -2.88 0.00 0.00 179.24 176.50 2i7t h GLU 255 N 0.46 0.10 -0.69 0.28 4.81 -1.39 -0.45 114.58 117.71 2i7t h GLU 255 Ca 0.30 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.55 2i7t h GLU 255 Cb 0.34 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.66 2i7t h GLU 255 CO -0.28 0.15 0.44 -0.92 -0.73 0.00 0.00 179.01 177.67 2i7t h TYR 256 N 0.04 0.83 -0.90 0.92 3.20 -0.51 -1.42 116.97 119.12 2i7t h TYR 256 Ca 0.03 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.90 2i7t h TYR 256 Cb 0.07 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.03 2i7t h TYR 256 CO -0.05 0.49 0.49 -1.49 -1.64 0.00 0.00 178.16 175.96 2i7t h TRP 257 N 0.87 1.23 -0.88 -3.82 6.55 -0.19 -2.05 115.95 117.66 2i7t h TRP 257 Ca 0.27 -0.03 0.01 0.00 0.95 0.00 0.00 58.89 60.09 2i7t h TRP 257 Cb -0.02 -0.39 -0.04 0.00 -0.86 0.00 0.00 29.16 27.84 2i7t h TRP 257 CO -0.04 0.85 0.58 1.96 -1.05 0.00 0.00 178.44 180.74 2i7t h GLN 258 N 1.26 1.15 0.00 0.49 4.20 -0.04 -1.87 115.11 120.29 2i7t h GLN 258 Ca 0.32 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.96 2i7t h GLN 258 Cb 0.02 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.54 2i7t h GLN 258 CO -0.05 0.76 0.00 0.09 -0.67 0.00 0.00 178.83 178.96 2i7t n ASN 259 N -4.48 0.00 -3.72 1.46 3.02 -0.80 -4.32 115.26 106.43 2i7t n ASN 259 Ca 0.10 -0.03 -0.28 0.00 -0.03 0.00 0.00 54.58 54.34 2i7t n ASN 259 Cb 0.02 -0.31 -0.12 0.00 -0.61 0.00 0.00 39.78 38.77 2i7t n ASN 259 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2i7t s HIS 260 N -2.62 2.50 0.57 3.10 3.76 -0.70 -4.96 115.29 116.94 2i7t s HIS 260 Ca 0.24 -2.85 0.30 0.00 -0.15 0.00 0.00 55.06 52.60 2i7t s HIS 260 Cb 0.18 -2.03 1.46 0.00 1.11 0.00 0.00 32.58 33.30 2i7t s HIS 260 CO 0.42 -0.69 1.87 -1.35 -0.85 0.00 0.00 174.74 174.15 2i7t h PRO 261 N 5.82 0.00 0.00 8.40 0.11 -1.75 0.01 132.00 144.59 2i7t h PRO 261 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2i7t h PRO 261 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2i7t h PRO 261 CO 0.57 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.51 2i7t n GLU 262 N -3.90 0.15 0.00 1.05 0.00 -1.26 -2.14 120.64 114.55 2i7t n GLU 262 Ca 0.12 0.18 0.05 0.00 0.00 0.00 0.00 57.16 57.52 2i7t n GLU 262 Cb 0.80 -1.50 0.03 0.00 0.00 0.00 0.00 31.44 30.77 2i7t n GLU 262 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2i7t n LEU 263 N -1.28 1.66 0.13 -1.84 4.77 -0.01 -4.69 117.00 115.75 2i7t n LEU 263 Ca 0.05 -0.93 0.18 0.00 -0.03 0.00 0.00 56.01 55.28 2i7t n LEU 263 Cb 0.08 0.00 0.77 0.00 -2.33 0.00 0.00 43.42 41.94 2i7t n LEU 263 CO 0.08 0.32 1.16 0.45 -1.33 0.00 0.00 177.39 178.08 2i7t h HIS 264 N 1.73 0.00 -0.01 -1.77 3.86 -1.55 0.30 115.15 117.72 2i7t h HIS 264 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2i7t h HIS 264 Cb 0.40 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.87 2i7t h HIS 264 CO 0.00 0.00 -0.11 -0.25 0.86 0.00 0.00 177.93 178.43 2i7t n ASP 265 N -3.90 0.95 -4.55 2.45 10.43 -1.26 -4.76 116.55 115.90 2i7t n ASP 265 Ca 0.05 -1.02 -0.41 0.00 2.57 0.00 0.00 54.79 55.98 2i7t n ASP 265 Cb 0.46 0.02 -0.09 0.00 1.84 0.00 0.00 41.12 43.35 2i7t n ASP 265 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2i7t s ILE 266 N -2.28 5.18 0.64 0.53 1.01 0.09 -5.06 121.20 121.31 2i7t s ILE 266 Ca 0.32 0.06 -0.15 0.00 0.00 0.00 0.00 60.65 60.88 2i7t s ILE 266 Cb 0.20 -3.81 -0.01 0.00 0.01 0.00 0.00 42.46 38.86 2i7t s ILE 266 CO 0.43 -0.07 1.09 -2.16 0.00 0.00 0.00 174.94 174.24 2i7t s PRO 267 N 2.00 2.94 -0.14 2.79 0.04 -1.26 -4.92 135.00 136.45 2i7t s PRO 267 Ca 0.12 1.33 -0.01 0.00 0.04 0.00 0.00 61.00 62.47 2i7t s PRO 267 Cb -0.17 -1.97 0.04 0.00 0.04 0.00 0.00 34.50 32.44 2i7t s PRO 267 CO 0.12 -1.13 -0.04 0.42 0.04 0.00 0.00 177.00 176.41 2i7t s ILE 268 N -2.39 0.88 0.05 0.56 1.01 -1.25 -1.75 121.20 118.30 2i7t s ILE 268 Ca 0.66 -0.39 0.03 0.00 0.00 0.00 0.00 60.65 60.95 2i7t s ILE 268 Cb -0.19 -1.05 -0.04 0.00 0.01 0.00 0.00 42.46 41.19 2i7t s ILE 268 CO 0.41 0.17 -0.01 -0.31 0.00 0.00 0.00 174.94 175.20 2i7t s TYR 269 N 1.74 3.00 -0.17 3.97 1.51 0.73 -1.25 117.35 126.89 2i7t s TYR 269 Ca 0.02 0.01 0.00 0.00 -1.01 0.00 0.00 57.07 56.09 2i7t s TYR 269 Cb -0.14 -1.59 0.03 0.00 -0.11 0.00 0.00 41.96 40.15 2i7t s TYR 269 CO -0.07 0.46 -0.11 -0.47 -1.11 0.00 0.00 175.55 174.24 2i7t s TYR 270 N -1.18 2.16 -0.42 2.71 5.04 -0.61 -0.66 117.35 124.38 2i7t s TYR 270 Ca 0.22 -1.31 0.06 0.00 -2.44 0.00 0.00 57.07 53.60 2i7t s TYR 270 Cb -0.12 -1.55 0.42 0.00 0.35 0.00 0.00 41.96 41.07 2i7t s TYR 270 CO 0.14 -0.68 1.11 0.00 -1.34 0.00 0.00 175.55 174.77 2i7t n ALA 271 N 4.76 4.97 0.00 3.97 0.00 0.57 -0.53 120.51 134.26 2i7t n ALA 271 Ca -0.15 -4.23 0.00 0.00 0.00 0.00 0.00 53.44 49.06 2i7t n ALA 271 Cb 0.48 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.39 2i7t n ALA 271 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2i7t n PHE 305 N -0.47 0.00 0.42 0.00 3.01 -1.26 -3.11 117.46 116.04 2i7t n PHE 305 Ca 0.38 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.93 2i7t n PHE 305 Cb 0.69 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 40.02 2i7t n PHE 305 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 2i7t n LYS 306 N 0.52 0.56 0.00 -1.08 0.00 -1.26 -4.55 118.16 112.34 2i7t n LYS 306 Ca 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 58.31 58.21 2i7t n LYS 306 Cb 0.00 -1.46 0.00 0.00 -0.00 0.00 0.00 35.03 33.57 2i7t n LYS 306 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 2i7t n HIS 307 N -1.87 0.00 -4.66 5.58 8.25 -1.26 -5.03 115.22 116.23 2i7t n HIS 307 Ca -0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.13 2i7t n HIS 307 Cb 0.43 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.39 2i7t n HIS 307 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2i7t s ILE 308 N -0.02 2.89 0.14 1.59 1.01 -1.26 -3.74 121.20 121.82 2i7t s ILE 308 Ca 0.00 -0.71 0.07 0.00 0.00 0.00 0.00 60.65 60.02 2i7t s ILE 308 Cb 0.00 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 2i7t s ILE 308 CO 0.00 0.52 -0.05 -0.94 0.00 0.00 0.00 174.94 174.47 2i7t s SER 309 N 0.58 4.60 0.09 3.58 1.04 -0.38 -4.69 113.70 118.51 2i7t s SER 309 Ca -0.08 -0.39 -0.23 0.00 0.48 0.00 0.00 55.95 55.73 2i7t s SER 309 Cb -0.16 -0.93 -0.07 0.00 0.10 0.00 0.00 66.02 64.96 2i7t s SER 309 CO 0.03 0.13 0.68 0.20 0.98 0.00 0.00 173.24 175.26 2i7t s ASN 310 N -2.60 7.19 0.09 7.02 0.01 -1.26 -1.58 114.94 123.81 2i7t s ASN 310 Ca 0.25 1.41 0.06 0.00 -0.71 0.00 0.00 52.86 53.87 2i7t s ASN 310 Cb -0.10 -2.43 -0.04 0.00 0.41 0.00 0.00 41.25 39.09 2i7t s ASN 310 CO 0.16 0.18 -0.09 -0.22 -1.51 0.00 0.00 177.10 175.63 2i7t s LEU 311 N -0.80 3.09 -0.19 0.60 0.20 0.31 -4.84 118.68 117.06 2i7t s LEU 311 Ca 0.33 -0.33 -0.06 0.00 0.69 0.00 0.00 54.13 54.76 2i7t s LEU 311 Cb -0.21 -1.87 -0.09 0.00 -0.43 0.00 0.00 46.19 43.59 2i7t s LEU 311 CO 0.22 0.19 -0.22 0.29 -0.29 0.00 0.00 176.35 176.54 2i7t n LYS 312 N 0.82 0.42 -3.96 1.98 5.02 -1.26 -4.30 118.16 116.88 2i7t n LYS 312 Ca -0.13 0.15 -0.09 0.00 -2.02 0.00 0.00 58.31 56.22 2i7t n LYS 312 Cb 0.52 -1.24 -0.05 0.00 -0.02 0.00 0.00 35.03 34.24 2i7t n LYS 312 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2i7t s SER 313 N -6.39 -0.13 0.00 4.39 0.15 -1.26 -4.97 113.70 105.49 2i7t s SER 313 Ca -0.26 -0.85 0.19 0.00 0.70 0.00 0.00 55.95 55.74 2i7t s SER 313 Cb 0.09 0.61 1.04 0.00 -1.71 0.00 0.00 66.02 66.05 2i7t s SER 313 CO 0.36 -1.16 1.58 0.80 1.20 0.00 0.00 173.24 176.02 2i7t n MET 314 N -0.39 0.40 0.00 5.44 1.56 -1.26 -0.83 117.12 122.05 2i7t n MET 314 Ca -0.03 0.07 0.07 0.00 -0.27 0.00 0.00 57.70 57.54 2i7t n MET 314 Cb 0.61 -1.50 -0.01 0.00 2.15 0.00 0.00 33.22 34.47 2i7t n MET 314 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 2i7t n ASP 315 N -1.18 1.39 -0.62 6.12 -0.08 -1.26 -4.42 116.55 116.51 2i7t n ASP 315 Ca 0.11 -1.20 0.06 0.00 -1.51 0.00 0.00 54.79 52.26 2i7t n ASP 315 Cb 0.12 0.55 0.17 0.00 2.34 0.00 0.00 41.12 44.30 2i7t n ASP 315 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2i7t n HIS 316 N -0.32 0.55 -3.81 -0.67 8.25 -0.01 -4.99 115.22 114.21 2i7t n HIS 316 Ca 0.06 -0.67 -0.12 0.00 -0.26 0.00 0.00 57.72 56.72 2i7t n HIS 316 Cb 0.29 -0.14 -0.11 0.00 1.12 0.00 0.00 29.99 31.16 2i7t n HIS 316 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 2i7t s PHE 317 N -1.79 -0.14 -0.24 4.41 -0.71 -1.16 -4.69 117.98 113.66 2i7t s PHE 317 Ca 0.28 0.29 -0.20 0.00 -1.04 0.00 0.00 56.93 56.26 2i7t s PHE 317 Cb 0.20 0.04 -0.02 0.00 -1.21 0.00 0.00 43.02 42.03 2i7t s PHE 317 CO 0.11 -0.23 0.60 -0.51 -1.34 0.00 0.00 175.22 173.85 2i7t s ASP 318 N -0.67 6.58 -1.14 1.98 1.01 -1.26 -4.93 116.67 118.23 2i7t s ASP 318 Ca -0.08 0.70 -0.16 0.00 0.71 0.00 0.00 52.55 53.73 2i7t s ASP 318 Cb -0.04 -2.33 0.14 0.00 1.01 0.00 0.00 42.92 41.70 2i7t s ASP 318 CO 0.01 -0.32 1.40 -0.62 0.21 0.00 0.00 175.17 175.86 2i7t s ASP 319 N 1.40 6.90 0.43 0.27 2.15 -1.26 -4.97 116.67 121.58 2i7t s ASP 319 Ca 0.26 -2.59 0.07 0.00 0.43 0.00 0.00 52.55 50.72 2i7t s ASP 319 Cb -0.16 -2.44 -0.03 0.00 -0.30 0.00 0.00 42.92 40.00 2i7t s ASP 319 CO 0.09 -0.93 0.26 -0.63 -0.17 0.00 0.00 175.17 173.79 2i7t s ILE 320 N 2.43 2.33 0.00 4.11 -1.09 -1.26 -5.11 121.20 122.61 2i7t s ILE 320 Ca 0.42 -1.58 0.00 0.00 -2.23 0.00 0.00 60.65 57.27 2i7t s ILE 320 Cb -0.02 -2.90 0.00 0.00 -1.58 0.00 0.00 42.46 37.96 2i7t s ILE 320 CO -0.02 0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.30 2i7t n GLY 321 N -1.38 0.00 3.82 6.18 0.00 -1.26 -4.47 105.19 108.07 2i7t n GLY 321 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2i7t n GLY 321 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2i7t s PRO 322 N 0.00 3.65 0.03 1.61 0.02 -1.26 -4.64 135.00 134.42 2i7t s PRO 322 Ca 0.00 1.14 -0.29 0.00 0.02 0.00 0.00 61.00 61.88 2i7t s PRO 322 Cb 0.00 -2.08 0.10 0.00 0.02 0.00 0.00 34.50 32.54 2i7t s PRO 322 CO 0.00 -0.53 1.20 -1.54 -0.33 0.00 0.00 177.00 175.80 2i7t s SER 323 N -2.72 -0.08 -0.07 2.53 1.04 -1.11 -4.44 113.70 108.85 2i7t s SER 323 Ca 0.63 -0.23 0.03 0.00 0.48 0.00 0.00 55.95 56.85 2i7t s SER 323 Cb -0.14 0.26 0.01 0.00 0.10 0.00 0.00 66.02 66.25 2i7t s SER 323 CO 0.31 -0.48 -0.14 -0.69 0.98 0.00 0.00 173.24 173.22 2i7t s VAL 324 N -2.61 1.28 -0.11 5.02 1.01 -0.72 -0.47 120.40 123.81 2i7t s VAL 324 Ca 0.15 -0.57 -0.00 0.00 0.00 0.00 0.00 61.98 61.56 2i7t s VAL 324 Cb 0.03 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 35.28 2i7t s VAL 324 CO -0.02 0.39 -0.09 -0.69 0.00 0.00 0.00 175.10 174.69 2i7t s VAL 325 N 0.58 1.12 -0.31 2.92 1.01 0.19 -0.19 120.40 125.71 2i7t s VAL 325 Ca -0.15 -0.36 -0.10 0.00 0.00 0.00 0.00 61.98 61.38 2i7t s VAL 325 Cb -0.16 -1.11 -0.01 0.00 0.00 0.00 0.00 36.38 35.10 2i7t s VAL 325 CO 0.04 0.38 0.15 -0.32 0.00 0.00 0.00 175.10 175.35 2i7t s MET 326 N 1.56 3.38 0.07 2.72 1.75 0.17 -0.70 119.30 128.25 2i7t s MET 326 Ca 0.03 -0.69 -0.04 0.00 -1.25 0.00 0.00 55.69 53.74 2i7t s MET 326 Cb -0.13 -3.56 -0.03 0.00 2.84 0.00 0.00 34.83 33.96 2i7t s MET 326 CO -0.07 -0.39 0.05 0.00 -0.65 0.00 0.00 175.02 173.95 2i7t s ALA 327 N 1.62 0.30 0.37 4.11 0.00 -0.98 -0.31 121.76 126.87 2i7t s ALA 327 Ca 0.05 -1.04 0.08 0.00 0.00 0.00 0.00 51.96 51.04 2i7t s ALA 327 Cb -0.17 0.39 -0.03 0.00 0.00 0.00 0.00 23.12 23.32 2i7t s ALA 327 CO 0.06 -0.43 0.31 -1.54 0.00 0.00 0.00 175.76 174.16 2i7t s SER 328 N -2.91 5.13 0.63 0.00 1.04 -1.18 -0.75 113.70 115.66 2i7t s SER 328 Ca 0.08 -0.63 -0.15 0.00 0.48 0.00 0.00 55.95 55.73 2i7t s SER 328 Cb 0.07 -0.79 -0.02 0.00 0.10 0.00 0.00 66.02 65.38 2i7t s SER 328 CO -0.09 -0.46 1.09 -2.16 0.98 0.00 0.00 173.24 172.59 2i7t s PRO 329 N -4.03 3.02 0.37 4.02 0.04 -1.26 -2.20 135.00 134.96 2i7t s PRO 329 Ca 0.43 1.31 0.08 0.00 0.04 0.00 0.00 61.00 62.86 2i7t s PRO 329 Cb -0.04 -1.98 0.73 0.00 0.04 0.00 0.00 34.50 33.24 2i7t s PRO 329 CO 0.27 -1.07 1.90 0.78 0.04 0.00 0.00 177.00 178.92 2i7t h GLY 330 N 0.19 0.35 -1.57 0.56 0.00 -1.75 -2.77 103.07 98.08 2i7t h GLY 330 Ca -0.47 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.65 2i7t h GLY 330 CO 0.55 0.20 0.00 1.03 0.00 0.00 0.00 176.54 178.32 2i7t n MET 331 N -4.28 2.09 -3.15 4.80 2.81 -1.26 -4.49 117.12 113.64 2i7t n MET 331 Ca -0.00 -1.65 -0.23 0.00 -1.81 0.00 0.00 57.70 54.01 2i7t n MET 331 Cb 0.26 -1.42 0.02 0.00 -0.71 0.00 0.00 33.22 31.37 2i7t n MET 331 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 2i7t n MET 332 N 0.86 -4.25 0.02 0.03 0.00 -1.05 -2.49 117.12 110.24 2i7t n MET 332 Ca 0.17 0.73 -0.12 0.00 0.00 0.00 0.00 57.70 58.48 2i7t n MET 332 Cb 0.44 -5.52 0.00 0.00 0.00 0.00 0.00 33.22 28.14 2i7t n MET 332 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 175.97 177.93 2i7t h GLN 333 N -1.20 0.56 0.00 0.03 7.50 -1.93 -3.42 115.11 116.65 2i7t h GLN 333 Ca -0.48 -0.43 0.00 0.00 0.50 0.00 0.00 58.65 58.23 2i7t h GLN 333 Cb 1.33 0.08 0.00 0.00 0.05 0.00 0.00 27.48 28.94 2i7t h GLN 333 CO 0.55 1.06 0.00 -1.13 -1.50 0.00 0.00 178.83 177.81 2i7t n SER 334 N -3.89 0.00 -0.09 1.46 3.41 -1.26 -5.00 113.62 108.25 2i7t n SER 334 Ca -0.05 -0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 2i7t n SER 334 Cb 0.70 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 2i7t n SER 334 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2i7t n GLY 335 N 0.00 -0.63 0.23 5.00 0.00 -1.26 -3.53 105.19 105.00 2i7t n GLY 335 Ca 0.00 -1.12 -0.11 0.00 0.00 0.00 0.00 46.02 44.79 2i7t n GLY 335 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2i7t h LEU 336 N 0.00 0.76 -0.94 0.99 5.85 -1.97 -2.04 115.31 117.96 2i7t h LEU 336 Ca 0.00 -0.34 0.10 0.00 0.84 0.00 0.00 57.88 58.48 2i7t h LEU 336 Cb 0.00 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 40.75 2i7t h LEU 336 CO 0.00 0.91 0.58 0.77 -0.34 0.00 0.00 178.44 180.36 2i7t h SER 337 N 0.59 0.87 -0.08 1.25 4.64 -1.62 0.32 113.55 119.51 2i7t h SER 337 Ca 0.11 0.04 -0.21 0.00 -0.47 0.00 0.00 61.79 61.26 2i7t h SER 337 Cb 0.55 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2i7t h SER 337 CO 0.03 0.50 -0.72 -0.09 -0.87 0.00 0.00 176.83 175.68 2i7t h ARG 338 N 0.97 0.72 -0.34 4.77 9.65 -1.57 -1.65 114.38 126.92 2i7t h ARG 338 Ca 0.44 -0.55 -0.03 0.00 -1.10 0.00 0.00 59.98 58.75 2i7t h ARG 338 Cb 0.36 0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.03 2i7t h ARG 338 CO -0.23 1.17 0.11 0.93 2.80 0.00 0.00 179.97 184.75 2i7t h GLU 339 N 0.50 0.53 -0.25 0.20 5.08 -0.65 -0.83 114.58 119.16 2i7t h GLU 339 Ca -0.03 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 2i7t h GLU 339 Cb 1.33 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 2i7t h GLU 339 CO 0.14 0.55 0.14 -0.07 -1.00 0.00 0.00 179.01 178.77 2i7t h LEU 340 N 0.40 0.31 -0.60 1.33 3.38 -0.97 -1.20 115.31 117.96 2i7t h LEU 340 Ca 0.11 -0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.08 2i7t h LEU 340 Cb 0.24 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 40.84 2i7t h LEU 340 CO -0.00 0.31 0.23 0.15 0.09 0.00 0.00 178.44 179.22 2i7t h PHE 341 N 0.29 0.40 0.00 1.13 3.57 -1.13 0.81 116.94 122.02 2i7t h PHE 341 Ca 0.09 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 2i7t h PHE 341 Cb 0.07 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 2i7t h PHE 341 CO -0.03 0.11 -0.23 0.93 -2.23 0.00 0.00 178.31 176.86 2i7t h GLU 342 N 0.42 0.00 0.00 1.11 5.08 -0.71 0.88 114.58 121.36 2i7t h GLU 342 Ca 0.30 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.65 2i7t h GLU 342 Cb 0.36 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 2i7t h GLU 342 CO -0.29 0.23 -0.61 0.77 -1.00 0.00 0.00 179.01 178.10 2i7t h SER 343 N 0.00 0.00 0.00 1.42 0.02 0.07 -3.38 113.55 111.68 2i7t h SER 343 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2i7t h SER 343 Cb 0.48 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.02 2i7t h SER 343 CO 0.03 0.04 -0.73 0.79 -1.14 0.00 0.00 176.83 175.81 2i7t n TRP 344 N -2.87 0.00 0.31 3.45 8.01 0.13 -4.74 117.44 121.73 2i7t n TRP 344 Ca 0.01 0.00 0.17 0.00 -1.31 0.00 0.00 57.50 56.37 2i7t n TRP 344 Cb 0.56 -0.06 0.98 0.00 -2.01 0.00 0.00 31.31 30.78 2i7t n TRP 344 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2i7t n THR 346 N -3.61 0.00 -3.70 0.00 -2.24 -1.25 -0.07 114.28 103.41 2i7t n THR 346 Ca -0.03 -0.01 -0.37 0.00 -2.27 0.00 0.00 64.05 61.37 2i7t n THR 346 Cb 0.10 -0.23 -0.12 0.00 -2.10 0.00 0.00 70.33 67.97 2i7t n THR 346 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2i7t s ASP 347 N -2.90 5.38 0.43 3.42 -1.08 -1.07 -4.58 116.67 116.27 2i7t s ASP 347 Ca 0.16 -0.33 0.30 0.00 -0.52 0.00 0.00 52.55 52.16 2i7t s ASP 347 Cb 0.19 -1.97 1.56 0.00 -1.46 0.00 0.00 42.92 41.24 2i7t s ASP 347 CO 0.57 -0.10 1.90 0.07 0.52 0.00 0.00 175.17 178.13 2i7t h LYS 348 N 8.29 0.00 0.00 4.34 2.10 -1.86 -1.48 116.57 127.96 2i7t h LYS 348 Ca -0.35 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.19 2i7t h LYS 348 Cb 1.16 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.48 2i7t h LYS 348 CO 0.59 0.00 -0.49 0.00 -2.00 0.00 0.00 179.45 177.55 2i7t h ARG 349 N 0.00 0.00 -7.62 0.07 3.08 -1.90 -3.40 114.38 104.61 2i7t h ARG 349 Ca 0.00 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.59 2i7t h ARG 349 Cb 0.06 0.00 0.12 0.00 0.08 0.00 0.00 29.97 30.23 2i7t h ARG 349 CO 0.00 0.49 0.37 -0.80 -1.07 0.00 0.00 179.97 178.97 2i7t s ASN 350 N -6.63 3.85 -0.09 7.04 0.01 -0.56 -3.60 114.94 114.95 2i7t s ASN 350 Ca -0.01 0.72 -0.30 0.00 -0.71 0.00 0.00 52.86 52.57 2i7t s ASN 350 Cb 0.12 -1.14 0.11 0.00 0.41 0.00 0.00 41.25 40.74 2i7t s ASN 350 CO 0.72 -2.31 0.89 -0.83 -1.51 0.00 0.00 177.10 174.06 2i7t s GLY 351 N -4.47 -0.39 -0.00 0.66 0.00 -0.51 -2.12 107.32 100.48 2i7t s GLY 351 Ca 0.65 1.59 0.07 0.00 0.00 0.00 0.00 44.72 47.02 2i7t s GLY 351 CO 0.51 0.82 -0.21 0.54 0.00 0.00 0.00 173.10 174.76 2i7t s VAL 352 N -1.70 1.64 -0.28 1.40 0.11 -0.59 -0.23 120.40 120.76 2i7t s VAL 352 Ca -0.02 -0.96 0.03 0.00 -2.93 0.00 0.00 61.98 58.09 2i7t s VAL 352 Cb -0.01 -1.38 0.07 0.00 -1.53 0.00 0.00 36.38 33.54 2i7t s VAL 352 CO 0.00 0.40 -0.05 -0.63 -3.33 0.00 0.00 175.10 171.49 2i7t s ILE 353 N -0.56 1.98 -0.25 7.04 1.01 -0.08 -1.14 121.20 129.20 2i7t s ILE 353 Ca 0.08 -1.70 -0.29 0.00 0.00 0.00 0.00 60.65 58.74 2i7t s ILE 353 Cb -0.08 -2.23 0.01 0.00 0.01 0.00 0.00 42.46 40.16 2i7t s ILE 353 CO -0.00 -0.22 1.14 -0.63 0.00 0.00 0.00 174.94 175.23 2i7t s ILE 354 N 1.15 4.46 -1.22 2.92 -1.09 0.81 -4.07 121.20 124.16 2i7t s ILE 354 Ca -0.02 1.73 0.16 0.00 -2.23 0.00 0.00 60.65 60.29 2i7t s ILE 354 Cb -0.19 -4.24 0.49 0.00 -1.58 0.00 0.00 42.46 36.93 2i7t s ILE 354 CO -0.07 -0.29 1.41 0.00 -1.23 0.00 0.00 174.94 174.76 2i7t n ALA 355 N 6.72 2.44 -2.45 9.38 0.00 -1.26 -1.49 120.51 133.84 2i7t n ALA 355 Ca 0.13 -1.35 -0.12 0.00 0.00 0.00 0.00 53.44 52.09 2i7t n ALA 355 Cb 0.46 -0.69 -0.09 0.00 0.00 0.00 0.00 19.45 19.13 2i7t n ALA 355 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2i7t s GLY 356 N -1.06 1.33 0.21 0.00 0.00 -1.26 -1.70 107.32 104.83 2i7t s GLY 356 Ca 0.37 -1.55 -0.30 0.00 0.00 0.00 0.00 44.72 43.24 2i7t s GLY 356 CO 0.22 -1.22 1.27 -0.47 0.00 0.00 0.00 173.10 172.90 2i7t s TYR 357 N -4.01 3.29 -0.17 1.90 5.04 -1.26 -4.92 117.35 117.23 2i7t s TYR 357 Ca 0.35 1.31 0.01 0.00 -2.44 0.00 0.00 57.07 56.30 2i7t s TYR 357 Cb 0.05 -3.56 0.01 0.00 0.35 0.00 0.00 41.96 38.81 2i7t s TYR 357 CO 0.13 -1.66 -0.20 0.00 -1.34 0.00 0.00 175.55 172.48 2i7t s VAL 359 N 1.10 3.53 0.57 0.00 1.01 -1.26 -4.79 120.40 120.56 2i7t s VAL 359 Ca 0.00 0.95 -0.20 0.00 0.00 0.00 0.00 61.98 62.73 2i7t s VAL 359 Cb -0.14 -3.38 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 2i7t s VAL 359 CO -0.08 -0.21 1.12 -0.62 0.00 0.00 0.00 175.10 175.31 2i7t n GLU 360 N -1.13 1.21 -0.03 2.72 -0.58 -1.26 -2.82 120.64 118.74 2i7t n GLU 360 Ca 0.10 0.45 0.00 0.00 -0.42 0.00 0.00 57.16 57.30 2i7t n GLU 360 Cb 0.52 -2.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.07 2i7t n GLU 360 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2i7t n GLY 361 N 1.08 1.30 3.96 0.62 0.00 -1.26 -4.15 105.19 106.73 2i7t n GLY 361 Ca 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 2i7t n GLY 361 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2i7t s THR 362 N -2.48 4.91 0.12 2.61 -4.23 -1.13 -4.78 115.64 110.66 2i7t s THR 362 Ca 0.00 -0.66 -0.15 0.00 -1.18 0.00 0.00 61.69 59.70 2i7t s THR 362 Cb 0.00 -3.77 -0.03 0.00 1.34 0.00 0.00 72.50 70.04 2i7t s THR 362 CO 0.00 -0.43 1.57 0.25 -0.54 0.00 0.00 174.62 175.47 2i7t h LEU 363 N 0.83 0.64 -0.84 4.79 7.12 -1.81 -2.19 115.31 123.85 2i7t h LEU 363 Ca -0.50 -0.29 0.06 0.00 0.13 0.00 0.00 57.88 57.29 2i7t h LEU 363 Cb 1.23 -0.17 -0.06 0.00 -0.53 0.00 0.00 40.66 41.13 2i7t h LEU 363 CO 0.60 0.77 0.51 0.00 -0.13 0.00 0.00 178.44 180.20 2i7t h ALA 364 N 0.89 1.15 -0.26 1.25 0.00 -1.77 0.15 119.26 120.67 2i7t h ALA 364 Ca 0.11 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2i7t h ALA 364 Cb 0.43 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2i7t h ALA 364 CO 0.02 0.24 0.01 -0.22 0.00 0.00 0.00 179.25 179.30 2i7t h LYS 365 N 0.93 0.46 -0.80 0.00 3.11 -1.79 -3.00 116.57 115.49 2i7t h LYS 365 Ca 0.37 -0.14 0.01 0.00 -2.81 0.00 0.00 60.65 58.08 2i7t h LYS 365 Cb 0.18 -0.04 -0.04 0.00 -1.00 0.00 0.00 32.23 31.33 2i7t h LYS 365 CO -0.18 0.62 0.53 1.25 -2.81 0.00 0.00 179.45 178.86 2i7t h HIS 366 N 0.25 1.00 -0.46 1.91 2.76 -0.75 -2.60 115.15 117.26 2i7t h HIS 366 Ca 0.08 0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.34 2i7t h HIS 366 Cb 0.41 -0.34 -0.03 0.00 1.55 0.00 0.00 27.41 29.00 2i7t h HIS 366 CO 0.03 0.63 0.31 0.82 -1.30 0.00 0.00 177.93 178.42 2i7t h ILE 367 N 1.08 0.94 0.00 6.26 1.08 -0.60 -0.92 117.51 125.35 2i7t h ILE 367 Ca 0.30 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 64.65 2i7t h ILE 367 Cb -0.11 0.58 0.00 0.00 -3.07 0.00 0.00 36.82 34.21 2i7t h ILE 367 CO -0.07 0.06 0.00 0.24 -0.69 0.00 0.00 178.15 177.69 2i7t h MET 368 N 0.33 0.00 0.00 2.37 2.86 -1.33 -1.68 114.93 117.48 2i7t h MET 368 Ca 0.20 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 2i7t h MET 368 Cb 0.38 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.04 2i7t h MET 368 CO -0.05 0.00 0.00 -1.13 1.06 0.00 0.00 176.91 176.79 2i7t n SER 369 N -2.85 0.00 -3.51 1.22 3.41 -0.35 -4.92 113.62 106.62 2i7t n SER 369 Ca 0.01 -1.06 -0.25 0.00 -0.26 0.00 0.00 58.87 57.31 2i7t n SER 369 Cb 0.27 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.27 2i7t n SER 369 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2i7t n GLU 370 N -0.95 -1.60 -2.04 4.33 1.02 -0.63 -4.97 120.64 115.80 2i7t n GLU 370 Ca 0.20 0.63 -0.33 0.00 -0.02 0.00 0.00 57.16 57.65 2i7t n GLU 370 Cb 0.09 -4.78 0.01 0.00 -0.02 0.00 0.00 31.44 26.75 2i7t n GLU 370 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2i7t s PRO 371 N -5.32 3.27 0.23 3.49 0.04 -1.26 -4.96 135.00 130.50 2i7t s PRO 371 Ca 0.46 1.26 -0.04 0.00 0.04 0.00 0.00 61.00 62.72 2i7t s PRO 371 Cb -0.12 -2.02 0.24 0.00 0.04 0.00 0.00 34.50 32.63 2i7t s PRO 371 CO 0.81 -0.85 1.70 1.49 0.04 0.00 0.00 177.00 180.19 2i7t h GLU 372 N 0.47 0.83 -4.44 4.56 4.57 -1.93 -3.41 114.58 115.24 2i7t h GLU 372 Ca -0.47 -0.26 -0.19 0.00 -1.18 0.00 0.00 59.36 57.26 2i7t h GLU 372 Cb 1.23 -0.08 -0.15 0.00 -0.16 0.00 0.00 28.75 29.59 2i7t h GLU 372 CO 0.57 0.88 -0.65 -1.21 -1.18 0.00 0.00 179.01 177.42 2i7t s GLU 373 N -4.87 0.91 0.31 1.92 2.02 -1.26 -1.52 118.70 116.21 2i7t s GLU 373 Ca -0.10 -1.42 0.06 0.00 0.02 0.00 0.00 54.97 53.53 2i7t s GLU 373 Cb 0.14 0.19 -0.06 0.00 0.10 0.00 0.00 34.13 34.50 2i7t s GLU 373 CO 0.83 -0.23 -0.02 0.96 0.02 0.00 0.00 175.26 176.82 2i7t s ILE 374 N -4.00 1.57 -0.32 -1.63 -5.25 0.74 -4.80 121.20 107.51 2i7t s ILE 374 Ca 0.22 -2.08 -0.09 0.00 -0.99 0.00 0.00 60.65 57.71 2i7t s ILE 374 Cb 0.07 -2.61 0.01 0.00 2.95 0.00 0.00 42.46 42.88 2i7t s ILE 374 CO 0.01 -0.18 0.14 -0.89 -1.79 0.00 0.00 174.94 172.23 2i7t s THR 375 N -3.05 4.39 0.55 8.37 2.01 -1.26 -2.18 115.64 124.48 2i7t s THR 375 Ca 0.32 -0.61 -0.20 0.00 0.31 0.00 0.00 61.69 61.51 2i7t s THR 375 Cb 0.06 -3.30 -0.05 0.00 0.01 0.00 0.00 72.50 69.22 2i7t s THR 375 CO 0.14 0.00 1.22 -0.89 -0.69 0.00 0.00 174.62 174.39 2i7t s THR 376 N 1.56 2.69 0.53 -0.82 2.01 0.10 -4.86 115.64 116.85 2i7t s THR 376 Ca 0.03 0.47 0.25 0.00 0.31 0.00 0.00 61.69 62.75 2i7t s THR 376 Cb -0.18 -3.21 0.40 0.00 0.01 0.00 0.00 72.50 69.52 2i7t s THR 376 CO 0.05 -0.06 1.99 0.24 -0.69 0.00 0.00 174.62 176.16 2i7t h MET 377 N 1.29 0.02 -0.00 4.92 2.86 -1.97 0.65 114.93 122.69 2i7t h MET 377 Ca -0.50 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.14 2i7t h MET 377 Cb 1.28 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.94 2i7t h MET 377 CO 0.57 0.01 -0.01 -1.13 1.06 0.00 0.00 176.91 177.41 2i7t n SER 378 N -4.38 0.45 0.00 1.22 3.41 -1.26 -4.89 113.62 108.17 2i7t n SER 378 Ca 0.10 -1.11 0.00 0.00 -0.26 0.00 0.00 58.87 57.60 2i7t n SER 378 Cb 0.60 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 2i7t n SER 378 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2i7t n GLY 379 N 1.07 0.64 3.78 5.00 0.00 0.23 -5.06 105.19 110.84 2i7t n GLY 379 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 2i7t n GLY 379 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2i7t s GLN 380 N -0.78 3.24 -0.23 1.61 0.74 -1.25 -4.66 119.66 118.33 2i7t s GLN 380 Ca 0.00 1.53 -0.09 0.00 0.05 0.00 0.00 55.36 56.85 2i7t s GLN 380 Cb 0.00 -2.00 -0.04 0.00 1.10 0.00 0.00 33.01 32.07 2i7t s GLN 380 CO 0.00 -0.92 0.12 0.15 -0.55 0.00 0.00 175.29 174.09 2i7t s LYS 381 N -3.51 3.93 -0.01 1.67 -0.14 -1.26 0.03 119.74 120.44 2i7t s LYS 381 Ca 0.71 -0.35 0.06 0.00 -1.36 0.00 0.00 55.97 55.03 2i7t s LYS 381 Cb -0.22 -3.43 -0.02 0.00 -1.68 0.00 0.00 37.83 32.48 2i7t s LYS 381 CO 0.30 0.01 -0.19 -0.51 -0.76 0.00 0.00 175.35 174.21 2i7t s LEU 382 N 1.14 2.05 0.29 3.17 1.43 -0.93 -4.97 118.68 120.86 2i7t s LEU 382 Ca 0.06 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.51 2i7t s LEU 382 Cb -0.14 -0.96 -0.09 0.00 0.03 0.00 0.00 46.19 45.03 2i7t s LEU 382 CO 0.04 0.22 1.06 -2.16 0.23 0.00 0.00 176.35 175.75 2i7t s PRO 383 N -0.52 4.61 -0.61 1.29 0.04 -1.26 -0.18 135.00 138.37 2i7t s PRO 383 Ca 0.07 1.71 -0.21 0.00 0.04 0.00 0.00 61.00 62.61 2i7t s PRO 383 Cb -0.07 -3.12 0.08 0.00 0.04 0.00 0.00 34.50 31.44 2i7t s PRO 383 CO -0.00 0.22 0.82 -1.17 0.04 0.00 0.00 177.00 176.90 2i7t s LEU 384 N -1.57 4.89 -0.05 -3.56 2.96 -0.57 -3.82 118.68 116.97 2i7t s LEU 384 Ca 0.46 -1.18 0.11 0.00 -0.22 0.00 0.00 54.13 53.29 2i7t s LEU 384 Cb -0.30 -2.38 -0.16 0.00 0.50 0.00 0.00 46.19 43.86 2i7t s LEU 384 CO 0.38 -1.25 0.17 0.29 -1.32 0.00 0.00 176.35 174.62 2i7t n LYS 385 N 6.95 1.04 -2.12 1.98 4.76 0.90 -4.89 118.16 126.78 2i7t n LYS 385 Ca -0.07 -0.07 -0.36 0.00 -2.87 0.00 0.00 58.31 54.95 2i7t n LYS 385 Cb 0.44 -1.27 0.02 0.00 -1.84 0.00 0.00 35.03 32.38 2i7t n LYS 385 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2i7t s MET 386 N -2.59 3.25 0.72 1.97 0.23 -0.64 -3.90 119.30 118.34 2i7t s MET 386 Ca -0.04 1.79 -0.12 0.00 -1.03 0.00 0.00 55.69 56.28 2i7t s MET 386 Cb 0.06 -2.07 0.03 0.00 -1.53 0.00 0.00 34.83 31.32 2i7t s MET 386 CO 0.45 -0.97 1.09 -1.54 -2.03 0.00 0.00 175.02 172.02 2i7t s SER 387 N -1.55 4.88 -0.08 -1.18 1.04 -0.90 -4.88 113.70 111.03 2i7t s SER 387 Ca 0.73 1.84 -0.01 0.00 0.48 0.00 0.00 55.95 58.99 2i7t s SER 387 Cb -0.29 -2.53 0.03 0.00 0.10 0.00 0.00 66.02 63.33 2i7t s SER 387 CO 0.33 -1.78 -0.03 -0.69 0.98 0.00 0.00 173.24 172.05 2i7t s VAL 388 N -2.75 0.56 0.09 5.02 1.01 -1.26 -1.54 120.40 121.54 2i7t s VAL 388 Ca 0.62 -0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.64 2i7t s VAL 388 Cb -0.17 -0.66 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2i7t s VAL 388 CO 0.51 0.28 -0.17 -1.81 0.00 0.00 0.00 175.10 173.91 2i7t s ASP 389 N 1.71 2.06 -0.14 3.32 1.11 -0.29 -5.00 116.67 119.44 2i7t s ASP 389 Ca 0.02 -0.68 0.00 0.00 0.18 0.00 0.00 52.55 52.07 2i7t s ASP 389 Cb -0.13 -0.09 0.03 0.00 1.07 0.00 0.00 42.92 43.80 2i7t s ASP 389 CO -0.05 -0.04 -0.11 -0.31 1.18 0.00 0.00 175.17 175.84 2i7t s TYR 390 N -1.39 1.95 -0.17 4.23 1.51 -1.26 -0.13 117.35 122.08 2i7t s TYR 390 Ca 0.03 -1.10 -0.03 0.00 -1.01 0.00 0.00 57.07 54.96 2i7t s TYR 390 Cb -0.09 -1.47 0.05 0.00 -0.11 0.00 0.00 41.96 40.35 2i7t s TYR 390 CO 0.03 -0.63 0.04 0.42 -1.11 0.00 0.00 175.55 174.31 2i7t s ILE 391 N 1.56 0.40 0.26 2.71 1.01 -0.56 -4.98 121.20 121.60 2i7t s ILE 391 Ca 0.04 -0.39 -0.30 0.00 0.00 0.00 0.00 60.65 60.00 2i7t s ILE 391 Cb -0.13 -0.88 -0.11 0.00 0.01 0.00 0.00 42.46 41.35 2i7t s ILE 391 CO -0.09 -0.15 1.55 -0.44 0.00 0.00 0.00 174.94 175.80 2i7t s SER 392 N 1.92 6.49 0.00 3.58 0.01 -1.26 -4.08 113.70 120.37 2i7t s SER 392 Ca 0.00 2.81 0.00 0.00 1.31 0.00 0.00 55.95 60.07 2i7t s SER 392 Cb -0.16 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.45 2i7t s SER 392 CO -0.08 -0.83 0.32 0.49 0.41 0.00 0.00 173.24 173.55 2i7t n PHE 393 N 2.57 0.00 0.36 2.43 3.72 -0.69 -4.96 117.46 120.89 2i7t n PHE 393 Ca 0.09 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.54 2i7t n PHE 393 Cb 0.38 0.13 0.22 0.00 -0.94 0.00 0.00 39.48 39.28 2i7t n PHE 393 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2i7t n SER 394 N 0.00 0.00 -2.88 4.37 3.41 -1.22 -4.69 113.62 112.61 2i7t n SER 394 Ca 0.00 0.50 -0.11 0.00 -0.26 0.00 0.00 58.87 59.00 2i7t n SER 394 Cb 0.52 -0.50 0.05 0.00 -0.26 0.00 0.00 64.21 64.02 2i7t n SER 394 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2i7t n ALA 395 N -1.50 -2.11 -2.34 7.33 0.00 -1.26 -4.93 120.51 115.70 2i7t n ALA 395 Ca 0.03 0.10 -0.18 0.00 0.00 0.00 0.00 53.44 53.39 2i7t n ALA 395 Cb 0.12 -4.33 -0.10 0.00 0.00 0.00 0.00 19.45 15.15 2i7t n ALA 395 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2i7t s HIS 396 N -3.27 1.64 0.48 0.00 3.76 -1.26 -4.29 115.29 112.34 2i7t s HIS 396 Ca 0.32 -0.66 -0.20 0.00 -0.15 0.00 0.00 55.06 54.37 2i7t s HIS 396 Cb -0.04 -0.82 -0.09 0.00 1.11 0.00 0.00 32.58 32.74 2i7t s HIS 396 CO 0.59 0.25 1.02 0.95 -0.85 0.00 0.00 174.74 176.70 2i7t s THR 397 N -3.09 3.95 0.25 1.30 -4.23 -0.87 -4.78 115.64 108.16 2i7t s THR 397 Ca 0.23 1.20 0.04 0.00 -1.18 0.00 0.00 61.69 61.97 2i7t s THR 397 Cb 0.01 -3.49 0.04 0.00 1.34 0.00 0.00 72.50 70.40 2i7t s THR 397 CO 0.06 -0.28 0.33 -0.90 -0.54 0.00 0.00 174.62 173.30 2i7t n ASP 398 N -0.94 0.94 -0.23 3.99 5.68 -1.26 -4.41 116.55 120.33 2i7t n ASP 398 Ca 0.09 -1.66 -0.04 0.00 -0.50 0.00 0.00 54.79 52.67 2i7t n ASP 398 Cb 0.53 -0.17 0.06 0.00 -1.14 0.00 0.00 41.12 40.40 2i7t n ASP 398 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 2i7t h TYR 399 N 0.07 0.76 -0.60 2.11 5.03 -1.31 -0.74 116.97 122.29 2i7t h TYR 399 Ca -0.12 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.21 2i7t h TYR 399 Cb 0.53 -0.25 -0.03 0.00 1.55 0.00 0.00 36.73 38.53 2i7t h TYR 399 CO 0.00 0.45 0.37 0.37 -1.32 0.00 0.00 178.16 178.02 2i7t h GLN 400 N 0.80 0.82 -0.41 1.82 -0.00 -1.93 0.13 115.11 116.35 2i7t h GLN 400 Ca 0.25 -0.07 -0.06 0.00 -0.00 0.00 0.00 58.65 58.77 2i7t h GLN 400 Cb -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 27.48 27.28 2i7t h GLN 400 CO -0.09 0.59 0.02 1.96 0.00 0.00 0.00 178.83 181.30 2i7t h GLN 401 N 0.82 0.71 -0.15 1.69 4.20 -1.86 -0.49 115.11 120.03 2i7t h GLN 401 Ca 0.22 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2i7t h GLN 401 Cb -0.02 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 2i7t h GLN 401 CO -0.04 0.79 0.05 1.15 -0.67 0.00 0.00 178.83 180.11 2i7t h THR 402 N 0.55 1.17 -0.53 -0.54 2.02 -0.92 -1.47 112.91 113.19 2i7t h THR 402 Ca 0.12 -0.53 0.07 0.00 0.77 0.00 0.00 66.41 66.84 2i7t h THR 402 Cb 0.46 1.26 -0.06 0.00 -1.74 0.00 0.00 68.15 68.06 2i7t h THR 402 CO 0.02 0.16 0.19 -1.28 0.37 0.00 0.00 175.52 174.98 2i7t h SER 403 N 0.06 0.19 -0.46 4.18 0.87 -0.66 -0.07 113.55 117.67 2i7t h SER 403 Ca 0.05 0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.58 2i7t h SER 403 Cb 0.21 0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.20 2i7t h SER 403 CO -0.00 0.13 -0.06 -0.08 -0.53 0.00 0.00 176.83 176.29 2i7t h GLU 404 N 0.37 0.91 0.08 2.24 4.81 -1.01 -0.21 114.58 121.76 2i7t h GLU 404 Ca 0.26 -0.29 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2i7t h GLU 404 Cb 0.28 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.58 2i7t h GLU 404 CO -0.26 0.94 -0.04 0.35 -0.73 0.00 0.00 179.01 179.27 2i7t h PHE 405 N 0.83 -0.09 -0.45 0.92 3.04 -0.57 -0.69 116.94 119.92 2i7t h PHE 405 Ca 0.14 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.05 2i7t h PHE 405 Cb 0.57 0.03 -0.02 0.00 2.56 0.00 0.00 35.95 39.09 2i7t h PHE 405 CO 0.03 0.05 0.11 0.82 -2.02 0.00 0.00 178.31 177.31 2i7t h ILE 406 N -0.22 1.20 -0.06 1.41 2.04 -0.93 -2.35 117.51 118.59 2i7t h ILE 406 Ca -0.01 -0.69 -0.11 0.00 1.00 0.00 0.00 64.86 65.05 2i7t h ILE 406 Cb 0.19 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 2i7t h ILE 406 CO 0.02 0.25 -0.46 -0.09 0.00 0.00 0.00 178.15 177.87 2i7t h ARG 407 N 0.65 0.15 -0.15 2.37 2.43 -0.73 0.48 114.38 119.57 2i7t h ARG 407 Ca 0.15 -0.08 -0.17 0.00 -0.81 0.00 0.00 59.98 59.07 2i7t h ARG 407 Cb 0.24 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2i7t h ARG 407 CO -0.00 0.59 -0.60 0.00 -1.51 0.00 0.00 179.97 178.44 2i7t h ALA 408 N 1.40 0.67 0.00 2.80 0.00 -0.62 -3.32 119.26 120.20 2i7t h ALA 408 Ca 0.01 -0.54 -0.26 0.00 0.00 0.00 0.00 54.91 54.12 2i7t h ALA 408 Cb 0.87 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 2i7t h ALA 408 CO 0.07 0.71 -1.86 1.28 0.00 0.00 0.00 179.25 179.44 2i7t n LEU 409 N -3.92 0.54 -4.03 0.00 4.77 -0.97 -5.02 117.00 108.36 2i7t n LEU 409 Ca -0.04 0.25 -0.42 0.00 -0.03 0.00 0.00 56.01 55.77 2i7t n LEU 409 Cb 0.63 0.24 0.01 0.00 -2.33 0.00 0.00 43.42 41.97 2i7t n LEU 409 CO 0.47 0.33 -0.19 0.29 -1.33 0.00 0.00 177.39 176.96 2i7t n LYS 410 N -2.85 -0.62 -2.40 3.23 5.02 0.17 -4.69 118.16 116.01 2i7t n LYS 410 Ca -0.19 0.15 -0.42 0.00 -2.02 0.00 0.00 58.31 55.83 2i7t n LYS 410 Cb 0.99 -3.00 -0.03 0.00 -0.02 0.00 0.00 35.03 32.98 2i7t n LYS 410 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 2i7t s PRO 411 N -7.16 4.44 0.59 1.97 0.02 -1.26 -4.89 135.00 128.70 2i7t s PRO 411 Ca 0.42 1.81 0.28 0.00 0.02 0.00 0.00 61.00 63.53 2i7t s PRO 411 Cb -0.21 -3.32 1.68 0.00 0.02 0.00 0.00 34.50 32.66 2i7t s PRO 411 CO 0.95 -0.24 2.14 -1.35 -0.33 0.00 0.00 177.00 178.17 2i7t h PRO 412 N 6.53 0.00 -4.18 5.54 0.11 -1.78 -3.40 132.00 134.83 2i7t h PRO 412 Ca -0.42 0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.21 2i7t h PRO 412 Cb 1.21 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 31.97 2i7t h PRO 412 CO 0.80 0.00 -0.79 -1.01 -0.21 0.00 0.00 178.00 176.79 2i7t s HIS 413 N -4.65 1.15 -0.13 0.65 3.76 -1.18 -0.84 115.29 114.05 2i7t s HIS 413 Ca -0.05 -0.45 0.03 0.00 -0.15 0.00 0.00 55.06 54.44 2i7t s HIS 413 Cb 0.15 -0.97 0.01 0.00 1.11 0.00 0.00 32.58 32.88 2i7t s HIS 413 CO 0.55 -0.33 -0.22 0.08 -0.85 0.00 0.00 174.74 173.97 2i7t s VAL 414 N 1.25 2.07 -0.22 -0.90 1.01 -0.29 -1.05 120.40 122.26 2i7t s VAL 414 Ca -0.05 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 60.92 2i7t s VAL 414 Cb -0.14 -1.81 0.01 0.00 0.00 0.00 0.00 36.38 34.44 2i7t s VAL 414 CO -0.02 0.55 -0.09 -0.63 0.00 0.00 0.00 175.10 174.91 2i7t s ILE 415 N 0.68 2.89 0.04 2.22 1.09 0.13 -0.45 121.20 127.81 2i7t s ILE 415 Ca -0.10 -0.76 -0.21 0.00 -1.10 0.00 0.00 60.65 58.48 2i7t s ILE 415 Cb -0.16 -2.33 -0.06 0.00 -1.06 0.00 0.00 42.46 38.84 2i7t s ILE 415 CO 0.01 0.39 0.62 -0.76 -0.10 0.00 0.00 174.94 175.10 2i7t s LEU 416 N 1.39 4.47 0.29 2.97 1.43 0.29 -1.29 118.68 128.22 2i7t s LEU 416 Ca 0.04 1.27 -0.03 0.00 -1.03 0.00 0.00 54.13 54.38 2i7t s LEU 416 Cb -0.15 -2.98 -0.01 0.00 0.03 0.00 0.00 46.19 43.08 2i7t s LEU 416 CO -0.06 0.16 0.37 0.68 0.23 0.00 0.00 176.35 177.73 2i7t s VAL 417 N -0.58 0.00 -0.99 -1.59 -7.23 -0.87 -4.41 120.40 104.74 2i7t s VAL 417 Ca 0.31 -1.70 -0.11 0.00 -1.81 0.00 0.00 61.98 58.67 2i7t s VAL 417 Cb -0.19 -2.49 -0.02 0.00 0.56 0.00 0.00 36.38 34.24 2i7t s VAL 417 CO 0.19 0.00 0.77 1.57 -0.31 0.00 0.00 175.10 177.32 2i7t n HIS 418 N -0.46 -2.26 -3.60 2.82 -0.00 0.11 -0.62 115.22 111.22 2i7t n HIS 418 Ca 0.01 0.72 -0.12 0.00 -0.00 0.00 0.00 57.72 58.34 2i7t n HIS 418 Cb 0.63 -3.61 -0.06 0.00 -0.00 0.00 0.00 29.99 26.94 2i7t n HIS 418 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 2i7t s GLY 419 N -3.29 -0.30 0.47 1.57 0.00 -0.66 -0.56 107.32 104.55 2i7t s GLY 419 Ca 0.31 2.20 -0.24 0.00 0.00 0.00 0.00 44.72 46.98 2i7t s GLY 419 CO 0.82 1.46 1.38 1.18 0.00 0.00 0.00 173.10 177.94 2i7t n GLU 420 N 1.65 2.05 -0.37 2.90 1.02 -1.26 -0.85 120.64 125.78 2i7t n GLU 420 Ca -0.13 0.73 -0.07 0.00 -0.02 0.00 0.00 57.16 57.67 2i7t n GLU 420 Cb 0.56 -2.57 -0.04 0.00 -0.02 0.00 0.00 31.44 29.38 2i7t n GLU 420 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 2i7t h GLN 421 N 2.03 -0.04 -0.61 3.49 4.15 -1.82 0.22 115.11 122.53 2i7t h GLN 421 Ca -0.50 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 58.88 2i7t h GLN 421 Cb 1.28 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.96 2i7t h GLN 421 CO 0.60 -0.03 0.21 -0.97 -1.93 0.00 0.00 178.83 176.71 2i7t h ASN 422 N -0.04 0.88 -0.61 -0.69 -0.00 -1.89 -0.80 115.58 112.42 2i7t h ASN 422 Ca 0.23 -0.20 -0.01 0.00 -0.00 0.00 0.00 56.30 56.31 2i7t h ASN 422 Cb 0.50 -0.23 -0.03 0.00 -0.00 0.00 0.00 38.32 38.56 2i7t h ASN 422 CO -0.92 0.84 0.33 -0.33 -0.00 0.00 0.00 177.43 177.36 2i7t h GLU 423 N 0.87 0.86 -0.27 6.67 4.39 -1.56 -2.49 114.58 123.05 2i7t h GLU 423 Ca 0.20 -0.10 -0.08 0.00 0.34 0.00 0.00 59.36 59.72 2i7t h GLU 423 Cb 0.27 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2i7t h GLU 423 CO -0.01 0.66 -0.17 1.98 -1.16 0.00 0.00 179.01 180.31 2i7t h MET 424 N 0.84 0.48 -0.55 2.33 4.05 -0.31 -2.30 114.93 119.46 2i7t h MET 424 Ca 0.22 -0.15 -0.10 0.00 -0.28 0.00 0.00 59.70 59.39 2i7t h MET 424 Cb 0.05 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.79 2i7t h MET 424 CO -0.03 0.63 -0.03 0.00 0.23 0.00 0.00 176.91 177.71 2i7t h ALA 425 N 1.39 0.74 -0.44 0.39 0.00 -0.75 -0.95 119.26 119.65 2i7t h ALA 425 Ca 0.08 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 2i7t h ALA 425 Cb 0.55 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2i7t h ALA 425 CO 0.04 0.60 -0.18 0.00 0.00 0.00 0.00 179.25 179.71 2i7t h ARG 426 N 0.87 0.84 -0.04 0.00 3.08 -1.29 -1.52 114.38 116.33 2i7t h ARG 426 Ca 0.15 -0.32 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 2i7t h ARG 426 Cb 0.58 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.58 2i7t h ARG 426 CO 0.03 0.95 0.02 1.25 -1.07 0.00 0.00 179.97 181.16 2i7t h LEU 427 N 0.74 0.05 -0.05 3.04 5.85 -1.21 0.58 115.31 124.30 2i7t h LEU 427 Ca 0.11 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.81 2i7t h LEU 427 Cb 0.70 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.66 2i7t h LEU 427 CO 0.05 0.10 -0.27 0.50 -0.34 0.00 0.00 178.44 178.48 2i7t h LYS 428 N -0.00 -0.37 -0.61 1.25 3.64 -1.05 0.29 116.57 119.72 2i7t h LYS 428 Ca 0.01 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.46 2i7t h LYS 428 Cb 0.06 0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.91 2i7t h LYS 428 CO -0.00 -0.25 0.34 0.00 -2.27 0.00 0.00 179.45 177.27 2i7t h ALA 429 N 0.46 0.80 -0.49 5.00 0.00 -1.08 0.17 119.26 124.12 2i7t h ALA 429 Ca 0.08 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2i7t h ALA 429 Cb 0.49 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2i7t h ALA 429 CO -0.27 0.03 0.03 0.00 0.00 0.00 0.00 179.25 179.05 2i7t h ALA 430 N 1.30 1.14 -0.19 0.00 0.00 -0.51 0.11 119.26 121.12 2i7t h ALA 430 Ca 0.26 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2i7t h ALA 430 Cb 0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2i7t h ALA 430 CO -0.15 0.56 -0.32 -0.07 0.00 0.00 0.00 179.25 179.27 2i7t h LEU 431 N 0.75 0.61 -0.87 0.00 3.38 -0.25 -2.08 115.31 116.84 2i7t h LEU 431 Ca 0.15 -0.53 0.02 0.00 0.09 0.00 0.00 57.88 57.61 2i7t h LEU 431 Cb 0.41 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 2i7t h LEU 431 CO 0.01 1.02 0.57 0.40 0.09 0.00 0.00 178.44 180.53 2i7t h ILE 432 N 0.21 1.17 -0.95 1.22 2.04 -0.40 -1.77 117.51 119.03 2i7t h ILE 432 Ca 0.01 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.49 2i7t h ILE 432 Cb 0.90 -0.05 -0.05 0.00 -0.74 0.00 0.00 36.82 36.89 2i7t h ILE 432 CO 0.07 0.20 0.61 -0.09 0.00 0.00 0.00 178.15 178.95 2i7t h ARG 433 N 1.12 1.27 -0.32 2.37 2.43 -0.67 -0.31 114.38 120.27 2i7t h ARG 433 Ca 0.34 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2i7t h ARG 433 Cb -0.04 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 29.21 2i7t h ARG 433 CO -0.10 0.85 0.19 0.93 -1.51 0.00 0.00 179.97 180.33 2i7t h GLU 434 N 1.30 0.42 -0.03 0.20 5.08 -0.59 -3.02 114.58 117.94 2i7t h GLU 434 Ca 0.35 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2i7t h GLU 434 Cb -0.12 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.04 2i7t h GLU 434 CO -0.07 0.30 0.00 0.66 -1.00 0.00 0.00 179.01 178.90 2i7t n TYR 435 N -4.47 0.02 0.50 4.33 4.01 -1.11 -4.44 117.16 116.00 2i7t n TYR 435 Ca 0.02 -0.03 0.10 0.00 -0.16 0.00 0.00 57.90 57.83 2i7t n TYR 435 Cb 0.08 -0.00 0.41 0.00 -0.31 0.00 0.00 39.34 39.52 2i7t n TYR 435 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 2i7t n GLU 436 N 0.49 0.09 -0.08 -0.72 2.13 -0.14 -3.63 120.64 118.77 2i7t n GLU 436 Ca 0.05 0.30 -0.09 0.00 0.66 0.00 0.00 57.16 58.08 2i7t n GLU 436 Cb 0.23 -1.67 -0.04 0.00 0.27 0.00 0.00 31.44 30.24 2i7t n GLU 436 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2i7t n ASP 437 N -1.84 1.83 -4.72 4.31 -0.08 -1.26 -4.91 116.55 109.89 2i7t n ASP 437 Ca 0.03 0.57 -0.42 0.00 -1.51 0.00 0.00 54.79 53.46 2i7t n ASP 437 Cb 0.22 -0.88 -0.03 0.00 2.34 0.00 0.00 41.12 42.77 2i7t n ASP 437 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2i7t s ASN 438 N -6.02 7.27 0.00 1.67 2.20 -1.24 -4.94 114.94 113.88 2i7t s ASN 438 Ca -0.19 1.86 0.18 0.00 -0.94 0.00 0.00 52.86 53.77 2i7t s ASN 438 Cb 0.03 -2.58 0.51 0.00 -2.00 0.00 0.00 41.25 37.22 2i7t s ASN 438 CO 0.32 -0.31 1.41 0.47 -2.94 0.00 0.00 177.10 176.05 2i7t n ASP 439 N 3.57 2.48 -0.68 3.54 8.00 -1.26 -3.94 116.55 128.26 2i7t n ASP 439 Ca 0.06 -1.92 0.09 0.00 0.71 0.00 0.00 54.79 53.74 2i7t n ASP 439 Cb 0.48 -0.25 0.06 0.00 -0.02 0.00 0.00 41.12 41.39 2i7t n ASP 439 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2i7t n GLU 440 N 0.85 1.64 -3.70 -1.24 1.02 -1.26 -4.80 120.64 113.15 2i7t n GLU 440 Ca 0.17 -1.46 -0.29 0.00 -0.02 0.00 0.00 57.16 55.56 2i7t n GLU 440 Cb 0.42 -1.36 -0.16 0.00 -0.02 0.00 0.00 31.44 30.32 2i7t n GLU 440 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2i7t s VAL 441 N -1.73 0.56 -0.32 2.62 1.01 -1.25 -5.11 120.40 116.18 2i7t s VAL 441 Ca 0.21 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 61.14 2i7t s VAL 441 Cb 0.16 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.24 2i7t s VAL 441 CO 0.30 -0.49 0.21 -1.00 0.00 0.00 0.00 175.10 174.12 2i7t s HIS 442 N 1.80 3.21 -0.09 5.22 3.76 -1.26 -4.90 115.29 123.04 2i7t s HIS 442 Ca 0.05 -0.22 -0.00 0.00 -0.15 0.00 0.00 55.06 54.74 2i7t s HIS 442 Cb -0.17 -2.42 0.02 0.00 1.11 0.00 0.00 32.58 31.12 2i7t s HIS 442 CO -0.20 -0.34 -0.05 0.42 -0.85 0.00 0.00 174.74 173.73 2i7t s ILE 443 N 1.71 0.74 -0.19 0.60 1.01 -1.26 -4.47 121.20 119.32 2i7t s ILE 443 Ca 0.06 -0.13 -0.10 0.00 0.00 0.00 0.00 60.65 60.48 2i7t s ILE 443 Cb -0.17 -0.80 -0.05 0.00 0.01 0.00 0.00 42.46 41.45 2i7t s ILE 443 CO 0.10 0.31 0.13 -1.61 0.00 0.00 0.00 174.94 173.86 2i7t s GLU 444 N 1.63 4.13 -0.16 2.79 2.02 -0.02 -4.95 118.70 124.15 2i7t s GLU 444 Ca 0.02 -0.22 -0.04 0.00 0.02 0.00 0.00 54.97 54.74 2i7t s GLU 444 Cb -0.13 -3.39 -0.03 0.00 0.10 0.00 0.00 34.13 30.68 2i7t s GLU 444 CO -0.05 0.33 -0.02 0.08 0.02 0.00 0.00 175.26 175.61 2i7t s VAL 445 N 0.27 4.00 0.01 2.63 1.01 -1.26 -1.14 120.40 125.92 2i7t s VAL 445 Ca 0.08 -0.32 0.07 0.00 0.00 0.00 0.00 61.98 61.82 2i7t s VAL 445 Cb -0.11 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 2i7t s VAL 445 CO -0.02 0.48 -0.21 -1.00 0.00 0.00 0.00 175.10 174.35 2i7t s HIS 446 N 0.44 2.47 -0.48 5.22 0.09 0.41 -4.99 115.29 118.45 2i7t s HIS 446 Ca -0.03 -0.32 0.08 0.00 -0.00 0.00 0.00 55.06 54.79 2i7t s HIS 446 Cb -0.14 -1.49 0.28 0.00 -0.00 0.00 0.00 32.58 31.23 2i7t s HIS 446 CO 0.02 0.13 0.67 0.27 -0.00 0.00 0.00 174.74 175.83 2i7t n ASN 447 N 2.00 1.76 -4.77 1.40 2.04 -1.26 -0.55 115.26 115.89 2i7t n ASN 447 Ca -0.16 -3.07 -0.41 0.00 -0.44 0.00 0.00 54.58 50.50 2i7t n ASN 447 Cb 0.52 -0.64 -0.01 0.00 -2.53 0.00 0.00 39.78 37.12 2i7t n ASN 447 CO 0.00 0.00 0.00 -2.16 -0.44 0.00 0.00 177.26 174.66 2i7t s PRO 448 N -2.03 4.22 0.76 -0.53 0.04 -1.26 -4.80 135.00 131.40 2i7t s PRO 448 Ca 0.39 2.41 -0.11 0.00 0.04 0.00 0.00 61.00 63.73 2i7t s PRO 448 Cb 0.21 -3.03 0.05 0.00 0.04 0.00 0.00 34.50 31.78 2i7t s PRO 448 CO -0.08 -0.40 1.13 1.03 0.04 0.00 0.00 177.00 178.71 2i7t s ARG 449 N -1.60 2.30 0.35 4.56 0.52 -1.26 -3.47 118.95 120.34 2i7t s ARG 449 Ca 0.53 0.18 -0.28 0.00 -0.52 0.00 0.00 55.73 55.64 2i7t s ARG 449 Cb -0.44 -2.01 -0.12 0.00 0.52 0.00 0.00 34.95 32.91 2i7t s ARG 449 CO 0.55 -1.35 1.38 0.09 0.02 0.00 0.00 175.30 175.99 2i7t n ASN 450 N -3.15 3.19 0.00 0.23 3.02 -1.24 -1.48 115.26 115.82 2i7t n ASN 450 Ca 0.07 1.21 0.00 0.00 -0.03 0.00 0.00 54.58 55.84 2i7t n ASN 450 Cb 0.60 -1.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.23 2i7t n ASN 450 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2i7t n THR 451 N 0.48 0.00 -2.49 3.41 -1.04 0.68 -5.00 114.28 110.33 2i7t n THR 451 Ca 0.04 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.64 2i7t n THR 451 Cb 0.37 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.84 2i7t n THR 451 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2i7t s GLU 452 N -0.11 4.64 0.10 -2.82 2.12 -0.55 -4.89 118.70 117.19 2i7t s GLU 452 Ca 0.00 1.79 0.04 0.00 0.36 0.00 0.00 54.97 57.16 2i7t s GLU 452 Cb 0.00 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 31.14 2i7t s GLU 452 CO 0.00 0.20 0.05 0.00 -0.54 0.00 0.00 175.26 174.97 2i7t s ALA 453 N -1.01 3.45 -0.11 6.30 0.00 -1.26 -3.76 121.76 125.37 2i7t s ALA 453 Ca 0.45 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 51.33 2i7t s ALA 453 Cb -0.31 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.47 2i7t s ALA 453 CO 0.40 0.69 -0.12 0.08 0.00 0.00 0.00 175.76 176.82 2i7t s VAL 454 N -1.41 3.22 -0.11 0.00 1.01 0.68 -4.96 120.40 118.83 2i7t s VAL 454 Ca 0.28 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.67 2i7t s VAL 454 Cb -0.12 -2.33 -0.00 0.00 0.00 0.00 0.00 36.38 33.93 2i7t s VAL 454 CO 0.21 0.55 -0.21 -0.89 0.00 0.00 0.00 175.10 174.75 2i7t s THR 455 N -0.05 2.30 0.01 3.92 2.01 -1.26 -1.73 115.64 120.83 2i7t s THR 455 Ca -0.02 -0.93 0.04 0.00 0.31 0.00 0.00 61.69 61.09 2i7t s THR 455 Cb -0.14 -1.91 -0.01 0.00 0.01 0.00 0.00 72.50 70.45 2i7t s THR 455 CO 0.04 0.55 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.63 2i7t s LEU 456 N 0.42 2.07 -0.12 4.42 1.43 -0.13 -4.98 118.68 121.79 2i7t s LEU 456 Ca -0.15 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 52.65 2i7t s LEU 456 Cb -0.17 -0.61 -0.02 0.00 0.03 0.00 0.00 46.19 45.42 2i7t s LEU 456 CO 0.07 0.11 -0.10 0.20 0.23 0.00 0.00 176.35 176.85 2i7t s ASN 457 N -0.55 4.27 0.09 2.29 0.01 -1.26 0.87 114.94 120.66 2i7t s ASN 457 Ca 0.04 -0.23 0.10 0.00 -0.71 0.00 0.00 52.86 52.05 2i7t s ASN 457 Cb -0.06 -1.53 -0.03 0.00 0.41 0.00 0.00 41.25 40.04 2i7t s ASN 457 CO 0.00 0.21 -0.25 -0.36 -1.51 0.00 0.00 177.10 175.19 2i7t s PHE 458 N 0.12 2.13 0.00 2.20 0.40 0.64 -4.92 117.98 118.54 2i7t s PHE 458 Ca -0.05 -0.39 0.00 0.00 -0.60 0.00 0.00 56.93 55.89 2i7t s PHE 458 Cb -0.14 -1.19 0.00 0.00 0.51 0.00 0.00 43.02 42.19 2i7t s PHE 458 CO 0.04 0.23 0.00 0.54 0.70 0.00 0.00 175.22 176.73