#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4t n ALA 2 N 0.00 3.93 -2.67 3.04 0.00 -1.26 -4.85 120.51 118.70 2k4t n ALA 2 Ca 0.00 -3.37 -0.03 0.00 0.00 0.00 0.00 53.44 50.04 2k4t n ALA 2 Cb 0.00 -0.38 0.04 0.00 0.00 0.00 0.00 19.45 19.11 2k4t n ALA 2 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2k4t n VAL 3 N -0.90 0.00 -1.18 0.00 3.14 -1.26 -5.17 118.33 112.96 2k4t n VAL 3 Ca 0.25 -0.29 -0.29 0.00 -2.96 0.00 0.00 64.34 61.05 2k4t n VAL 3 Cb 0.80 0.68 0.16 0.00 -1.06 0.00 0.00 33.84 34.42 2k4t n VAL 3 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2k4t s PRO 4 N 0.84 0.75 -1.14 1.45 0.04 -1.26 -4.88 135.00 130.80 2k4t s PRO 4 Ca 0.24 0.64 -0.23 0.00 0.04 0.00 0.00 61.00 61.70 2k4t s PRO 4 Cb 0.14 -1.76 -0.10 0.00 0.04 0.00 0.00 34.50 32.82 2k4t s PRO 4 CO -0.10 -2.54 1.93 -0.35 0.04 0.00 0.00 177.00 175.98 2k4t n PRO 5 N -4.06 1.59 -0.04 0.56 -0.04 -1.26 -4.51 135.00 127.24 2k4t n PRO 5 Ca 0.06 -2.40 -0.00 0.00 -0.04 0.00 0.00 63.50 61.11 2k4t n PRO 5 Cb 0.56 -3.65 -0.12 0.00 -0.04 0.00 0.00 33.50 30.26 2k4t n PRO 5 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2k4t n THR 6 N 7.62 0.55 0.11 0.52 -1.04 -1.26 -4.40 114.28 116.39 2k4t n THR 6 Ca 0.45 -0.51 -0.20 0.00 -2.04 0.00 0.00 64.05 61.76 2k4t n THR 6 Cb 0.46 -0.27 -0.13 0.00 -1.82 0.00 0.00 70.33 68.56 2k4t n THR 6 CO 0.00 0.00 0.00 0.10 -0.64 0.00 0.00 175.07 174.53 2k4t h TYR 7 N 0.00 0.75 0.00 -1.42 -0.00 -1.99 -3.21 116.97 111.10 2k4t h TYR 7 Ca -0.22 -0.52 -0.00 0.00 -0.00 0.00 0.00 58.73 57.99 2k4t h TYR 7 Cb 1.37 -0.04 -0.00 0.00 -0.00 0.00 0.00 36.73 38.06 2k4t h TYR 7 CO 0.00 1.39 -0.01 0.00 -0.00 0.00 0.00 178.16 179.54 2k4t h ALA 8 N 0.41 1.04 0.00 0.10 0.00 -1.88 -1.40 119.26 117.52 2k4t h ALA 8 Ca -0.18 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 2k4t h ALA 8 Cb 1.99 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.76 2k4t h ALA 8 CO 0.23 0.01 -0.55 0.22 0.00 0.00 0.00 179.25 179.16 2k4t h ASP 9 N 0.00 0.00 0.94 0.00 1.82 -1.76 -3.26 116.42 114.15 2k4t h ASP 9 Ca -0.00 0.00 -0.16 0.00 -0.39 0.00 0.00 57.03 56.48 2k4t h ASP 9 Cb 0.22 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.21 2k4t h ASP 9 CO 0.00 0.39 -0.78 -0.07 -1.61 0.00 0.00 179.24 177.17 2k4t h LEU 10 N 0.00 0.00 0.00 2.28 4.07 -1.31 -3.45 115.31 116.90 2k4t h LEU 10 Ca -0.02 0.00 -0.66 0.00 0.08 0.00 0.00 57.88 57.27 2k4t h LEU 10 Cb 1.32 0.00 -0.13 0.00 1.08 0.00 0.00 40.66 42.93 2k4t h LEU 10 CO 0.05 0.78 -0.49 0.61 -1.08 0.00 0.00 178.44 178.30 2k4t n GLY 11 N 0.92 3.47 3.06 0.83 0.00 -1.15 -4.76 105.19 107.56 2k4t n GLY 11 Ca -0.00 -2.32 -0.21 0.00 0.00 0.00 0.00 46.02 43.48 2k4t n GLY 11 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2k4t n LYS 12 N -1.24 -3.78 -1.98 1.61 4.81 -1.26 -4.84 118.16 111.48 2k4t n LYS 12 Ca -0.18 0.69 -0.42 0.00 -0.87 0.00 0.00 58.31 57.53 2k4t n LYS 12 Cb 0.66 -5.45 -0.03 0.00 0.02 0.00 0.00 35.03 30.23 2k4t n LYS 12 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 2k4t s SER 13 N -2.59 6.64 0.10 3.14 1.04 -1.26 -5.00 113.70 115.77 2k4t s SER 13 Ca 0.29 2.53 -0.10 0.00 0.48 0.00 0.00 55.95 59.15 2k4t s SER 13 Cb -0.14 -2.59 0.01 0.00 0.10 0.00 0.00 66.02 63.39 2k4t s SER 13 CO 0.36 -0.80 0.24 0.00 0.98 0.00 0.00 173.24 174.03 2k4t s ALA 14 N 1.34 -0.35 0.43 5.32 0.00 -1.26 -5.12 121.76 122.12 2k4t s ALA 14 Ca 0.69 -0.52 -0.26 0.00 0.00 0.00 0.00 51.96 51.87 2k4t s ALA 14 Cb -0.42 0.56 -0.09 0.00 0.00 0.00 0.00 23.12 23.18 2k4t s ALA 14 CO 0.31 -0.55 1.37 0.50 0.00 0.00 0.00 175.76 177.39 2k4t s ARG 15 N -3.86 3.84 0.55 0.00 6.06 -1.26 -4.89 118.95 119.39 2k4t s ARG 15 Ca 0.06 2.30 0.25 0.00 -2.50 0.00 0.00 55.73 55.84 2k4t s ARG 15 Cb 0.04 -2.72 1.56 0.00 0.06 0.00 0.00 34.95 33.89 2k4t s ARG 15 CO -0.10 -0.65 2.18 0.38 -2.50 0.00 0.00 175.30 174.60 2k4t h ASP 16 N 2.53 0.00 -4.92 -2.12 2.03 -2.03 -3.43 116.42 108.48 2k4t h ASP 16 Ca -0.50 0.00 -0.15 0.00 -0.73 0.00 0.00 57.03 55.65 2k4t h ASP 16 Cb 1.26 0.00 -0.21 0.00 -0.83 0.00 0.00 39.33 39.55 2k4t h ASP 16 CO 0.62 0.04 -0.49 0.68 -1.03 0.00 0.00 179.24 179.06 2k4t s VAL 17 N -4.65 0.08 0.00 4.15 -7.23 -1.26 -5.05 120.40 106.43 2k4t s VAL 17 Ca -0.05 -0.66 0.00 0.00 -1.81 0.00 0.00 61.98 59.47 2k4t s VAL 17 Cb 0.15 -0.42 0.00 0.00 0.56 0.00 0.00 36.38 36.67 2k4t s VAL 17 CO 0.60 -0.36 0.00 2.22 -0.31 0.00 0.00 175.10 177.24 2k4t n PHE 18 N 1.53 0.00 -4.30 2.82 -1.74 -1.26 -5.10 117.46 109.40 2k4t n PHE 18 Ca -0.22 0.00 -0.25 0.00 -0.56 0.00 0.00 57.45 56.41 2k4t n PHE 18 Cb 0.56 0.08 -0.09 0.00 1.52 0.00 0.00 39.48 41.56 2k4t n PHE 18 CO 0.00 0.00 0.00 -0.08 -0.56 0.00 0.00 176.76 176.12 2k4t s THR 19 N -1.47 3.27 0.65 1.97 -1.32 -1.26 -5.14 115.64 112.34 2k4t s THR 19 Ca 0.00 -1.77 -0.04 0.00 -1.21 0.00 0.00 61.69 58.68 2k4t s THR 19 Cb 0.00 -2.67 0.05 0.00 -1.51 0.00 0.00 72.50 68.37 2k4t s THR 19 CO 0.00 -0.21 0.93 -0.75 -2.21 0.00 0.00 174.62 172.38 2k4t s LYS 20 N -3.15 2.29 0.28 7.08 2.20 -1.26 -5.11 119.74 122.07 2k4t s LYS 20 Ca 0.27 -0.48 -0.19 0.00 -0.36 0.00 0.00 55.97 55.22 2k4t s LYS 20 Cb -0.08 -2.29 0.02 0.00 -1.51 0.00 0.00 37.83 33.97 2k4t s LYS 20 CO 0.17 -1.07 0.67 0.20 -0.36 0.00 0.00 175.35 174.96 2k4t s GLY 21 N -4.49 0.08 0.21 5.54 0.00 -1.26 -5.19 107.32 102.21 2k4t s GLY 21 Ca 0.59 -0.47 -0.04 0.00 0.00 0.00 0.00 44.72 44.80 2k4t s GLY 21 CO 0.42 -0.22 0.36 1.58 0.00 0.00 0.00 173.10 175.24 2k4t n TYR 22 N -0.45 -1.37 0.00 1.90 4.11 -1.26 -5.00 117.16 115.10 2k4t n TYR 22 Ca -0.04 -1.21 0.00 0.00 -0.00 0.00 0.00 57.90 56.66 2k4t n TYR 22 Cb 0.60 0.41 0.00 0.00 -0.00 0.00 0.00 39.34 40.35 2k4t n TYR 22 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2k4t n GLY 23 N -0.32 2.81 2.73 -7.48 0.00 -1.26 -4.84 105.19 96.83 2k4t n GLY 23 Ca -0.02 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.04 2k4t n GLY 23 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2k4t n PHE 24 N 0.73 3.55 0.00 1.61 -1.74 -1.26 -3.90 117.46 116.44 2k4t n PHE 24 Ca 0.00 -3.31 0.00 0.00 -0.56 0.00 0.00 57.45 53.58 2k4t n PHE 24 Cb 0.00 -0.50 0.00 0.00 1.52 0.00 0.00 39.48 40.50 2k4t n PHE 24 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2k4t n GLY 25 N -0.35 1.25 3.73 4.97 0.00 -1.26 -4.85 105.19 108.68 2k4t n GLY 25 Ca 0.38 -0.43 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 2k4t n GLY 25 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k4t s LEU 26 N 0.00 3.67 -0.27 0.99 2.96 -0.16 -1.03 118.68 124.84 2k4t s LEU 26 Ca 0.00 0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.96 2k4t s LEU 26 Cb 0.00 -2.15 0.05 0.00 0.50 0.00 0.00 46.19 44.59 2k4t s LEU 26 CO 0.00 0.27 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.60 2k4t s ILE 27 N -1.15 2.60 -0.17 6.68 -1.09 0.66 -0.11 121.20 128.61 2k4t s ILE 27 Ca 0.22 -1.42 -0.06 0.00 -2.23 0.00 0.00 60.65 57.15 2k4t s ILE 27 Cb -0.12 -2.47 -0.04 0.00 -1.58 0.00 0.00 42.46 38.26 2k4t s ILE 27 CO 0.13 -0.01 0.02 -0.54 -1.23 0.00 0.00 174.94 173.31 2k4t s LYS 28 N 1.20 3.86 -0.17 2.79 3.01 0.91 -0.74 119.74 130.60 2k4t s LYS 28 Ca -0.06 -0.41 0.01 0.00 -1.01 0.00 0.00 55.97 54.51 2k4t s LYS 28 Cb -0.19 -3.10 0.02 0.00 -1.01 0.00 0.00 37.83 33.54 2k4t s LYS 28 CO -0.04 0.26 -0.20 -1.17 0.51 0.00 0.00 175.35 174.71 2k4t s LEU 29 N 0.38 2.10 -0.30 3.17 2.96 0.91 -0.70 118.68 127.20 2k4t s LEU 29 Ca 0.00 -0.63 -0.12 0.00 -0.22 0.00 0.00 54.13 53.16 2k4t s LEU 29 Cb -0.13 -1.45 -0.04 0.00 0.50 0.00 0.00 46.19 45.07 2k4t s LEU 29 CO 0.01 0.02 0.23 -0.62 -1.32 0.00 0.00 176.35 174.66 2k4t s ASP 30 N 1.19 6.06 -0.18 3.68 2.15 -0.26 -1.17 116.67 128.14 2k4t s ASP 30 Ca 0.02 -0.11 0.00 0.00 0.43 0.00 0.00 52.55 52.89 2k4t s ASP 30 Cb -0.14 -2.14 0.01 0.00 -0.30 0.00 0.00 42.92 40.36 2k4t s ASP 30 CO -0.10 -0.12 -0.17 -0.76 -0.17 0.00 0.00 175.17 173.85 2k4t s LEU 31 N 1.79 2.32 -0.11 -1.34 1.43 -0.43 -3.14 118.68 119.20 2k4t s LEU 31 Ca 0.08 -0.57 0.03 0.00 -1.03 0.00 0.00 54.13 52.63 2k4t s LEU 31 Cb -0.16 -1.54 -0.00 0.00 0.03 0.00 0.00 46.19 44.52 2k4t s LEU 31 CO 0.11 0.02 -0.20 -1.59 0.23 0.00 0.00 176.35 174.91 2k4t s LYS 32 N 1.19 3.16 -0.08 1.70 -2.85 -1.21 -0.95 119.74 120.71 2k4t s LYS 32 Ca 0.02 -0.81 0.01 0.00 -1.00 0.00 0.00 55.97 54.18 2k4t s LYS 32 Cb -0.14 -2.42 0.02 0.00 -2.06 0.00 0.00 37.83 33.24 2k4t s LYS 32 CO -0.08 0.18 -0.08 0.99 0.10 0.00 0.00 175.35 176.46 2k4t s THR 33 N 0.36 0.91 0.10 3.79 2.01 0.66 -2.86 115.64 120.61 2k4t s THR 33 Ca -0.16 -0.29 0.10 0.00 0.31 0.00 0.00 61.69 61.65 2k4t s THR 33 Cb -0.17 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.40 2k4t s THR 33 CO 0.08 0.32 -0.24 -0.54 -0.69 0.00 0.00 174.62 173.55 2k4t s LYS 34 N 1.16 1.61 0.38 4.92 1.02 -1.26 -1.05 119.74 126.52 2k4t s LYS 34 Ca -0.06 -1.24 0.08 0.00 0.02 0.00 0.00 55.97 54.78 2k4t s LYS 34 Cb -0.14 -1.98 -0.06 0.00 -0.52 0.00 0.00 37.83 35.12 2k4t s LYS 34 CO -0.02 0.48 0.02 0.45 -0.92 0.00 0.00 175.35 175.36 2k4t s SER 35 N -1.86 4.05 0.52 2.83 0.15 -1.24 -5.02 113.70 113.13 2k4t s SER 35 Ca 0.14 -1.16 0.20 0.00 0.70 0.00 0.00 55.95 55.83 2k4t s SER 35 Cb -0.10 -0.45 1.34 0.00 -1.71 0.00 0.00 66.02 65.10 2k4t s SER 35 CO 0.06 -0.36 2.13 1.05 1.20 0.00 0.00 173.24 177.32 2k4t h GLU 36 N 1.76 0.00 0.23 5.44 4.11 -2.01 -2.88 114.58 121.24 2k4t h GLU 36 Ca -0.43 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.01 2k4t h GLU 36 Cb 1.25 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 2k4t h GLU 36 CO 0.72 0.06 -0.33 -0.91 0.07 0.00 0.00 179.01 178.62 2k4t h ASN 37 N 0.00 -0.91 0.00 3.06 4.21 -2.05 -3.47 115.58 116.42 2k4t h ASN 37 Ca -0.00 0.09 0.00 0.00 1.21 0.00 0.00 56.30 57.60 2k4t h ASN 37 Cb 0.11 0.33 0.00 0.00 -1.12 0.00 0.00 38.32 37.64 2k4t h ASN 37 CO 0.01 -0.44 0.00 0.61 -1.29 0.00 0.00 177.43 176.32 2k4t n GLY 38 N -1.43 1.16 3.60 2.83 0.00 -1.09 -5.03 105.19 105.23 2k4t n GLY 38 Ca -0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 2k4t n GLY 38 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2k4t n LEU 39 N 0.00 1.78 -3.80 0.99 -0.00 -1.26 -4.61 117.00 110.10 2k4t n LEU 39 Ca 0.00 0.24 -0.27 0.00 -0.00 0.00 0.00 56.01 55.98 2k4t n LEU 39 Cb 0.00 -1.41 -0.17 0.00 -0.00 0.00 0.00 43.42 41.85 2k4t n LEU 39 CO 0.00 -2.54 -0.39 -0.70 -0.00 0.00 0.00 177.39 173.76 2k4t s GLU 40 N -4.54 0.93 -0.30 1.47 2.12 -0.28 -3.66 118.70 114.44 2k4t s GLU 40 Ca 0.67 -0.34 -0.05 0.00 0.36 0.00 0.00 54.97 55.61 2k4t s GLU 40 Cb -0.24 -1.82 0.02 0.00 0.26 0.00 0.00 34.13 32.35 2k4t s GLU 40 CO 0.60 -0.49 0.05 0.12 -0.54 0.00 0.00 175.26 175.00 2k4t s PHE 41 N 1.80 3.17 0.02 5.30 2.19 -0.21 -0.91 117.98 129.33 2k4t s PHE 41 Ca 0.01 -1.30 0.01 0.00 0.33 0.00 0.00 56.93 55.98 2k4t s PHE 41 Cb -0.15 -2.20 -0.01 0.00 -1.31 0.00 0.00 43.02 39.34 2k4t s PHE 41 CO -0.07 -0.67 -0.05 -0.08 1.83 0.00 0.00 175.22 176.18 2k4t s THR 42 N 1.41 0.34 0.02 0.12 -1.32 -0.58 -0.25 115.64 115.38 2k4t s THR 42 Ca 0.00 -0.64 -0.00 0.00 -1.21 0.00 0.00 61.69 59.84 2k4t s THR 42 Cb -0.18 -0.38 -0.02 0.00 -1.51 0.00 0.00 72.50 70.42 2k4t s THR 42 CO 0.01 -0.21 -0.02 -0.94 -2.21 0.00 0.00 174.62 171.25 2k4t s SER 43 N -0.91 0.21 -0.21 8.08 1.04 -0.12 -1.02 113.70 120.77 2k4t s SER 43 Ca -0.06 -0.44 0.01 0.00 0.48 0.00 0.00 55.95 55.93 2k4t s SER 43 Cb -0.06 0.10 0.03 0.00 0.10 0.00 0.00 66.02 66.18 2k4t s SER 43 CO -0.00 -0.28 -0.15 -0.55 0.98 0.00 0.00 173.24 173.24 2k4t s SER 44 N -1.33 3.64 -0.18 7.02 0.15 -0.10 -1.32 113.70 121.58 2k4t s SER 44 Ca -0.15 -0.81 -0.08 0.00 0.70 0.00 0.00 55.95 55.61 2k4t s SER 44 Cb -0.09 -1.54 -0.04 0.00 -1.71 0.00 0.00 66.02 62.64 2k4t s SER 44 CO -0.01 -0.06 0.07 -0.83 1.20 0.00 0.00 173.24 173.62 2k4t s GLY 45 N 1.27 1.93 -0.05 9.45 0.00 -0.31 -0.36 107.32 119.24 2k4t s GLY 45 Ca 0.02 -0.73 0.05 0.00 0.00 0.00 0.00 44.72 44.05 2k4t s GLY 45 CO -0.10 0.05 -0.20 -1.35 0.00 0.00 0.00 173.10 171.50 2k4t s SER 46 N 0.30 3.50 0.10 1.64 1.04 0.82 -0.06 113.70 121.04 2k4t s SER 46 Ca 0.04 -0.37 0.04 0.00 0.48 0.00 0.00 55.95 56.14 2k4t s SER 46 Cb -0.12 -0.80 -0.04 0.00 0.10 0.00 0.00 66.02 65.17 2k4t s SER 46 CO -0.00 0.29 -0.11 0.00 0.98 0.00 0.00 173.24 174.40 2k4t s ALA 47 N -0.42 1.19 -0.18 5.32 0.00 0.08 -0.53 121.76 127.21 2k4t s ALA 47 Ca 0.04 -1.18 -0.05 0.00 0.00 0.00 0.00 51.96 50.78 2k4t s ALA 47 Cb -0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 2k4t s ALA 47 CO 0.02 0.02 -0.01 1.21 0.00 0.00 0.00 175.76 176.99 2k4t s ASN 48 N -2.34 4.84 0.22 0.00 3.84 -0.04 -0.25 114.94 121.21 2k4t s ASN 48 Ca 0.05 -0.16 -0.30 0.00 0.21 0.00 0.00 52.86 52.66 2k4t s ASN 48 Cb -0.04 -1.81 -0.09 0.00 -0.55 0.00 0.00 41.25 38.76 2k4t s ASN 48 CO 0.01 0.11 1.08 0.42 -2.79 0.00 0.00 177.10 175.93 2k4t s THR 49 N 0.73 3.75 -1.61 -5.21 -4.23 -0.20 -3.13 115.64 105.74 2k4t s THR 49 Ca -0.01 1.63 0.00 0.00 -1.18 0.00 0.00 61.69 62.13 2k4t s THR 49 Cb -0.14 -4.04 0.00 0.00 1.34 0.00 0.00 72.50 69.66 2k4t s THR 49 CO 0.02 0.34 0.00 -0.62 -0.54 0.00 0.00 174.62 173.82 2k4t n GLU 50 N 1.81 -1.70 -3.66 3.99 4.71 -1.26 -4.85 120.64 119.68 2k4t n GLU 50 Ca 0.01 0.90 -0.12 0.00 -0.01 0.00 0.00 57.16 57.94 2k4t n GLU 50 Cb 0.46 -5.41 -0.06 0.00 -1.01 0.00 0.00 31.44 25.42 2k4t n GLU 50 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 2k4t s THR 51 N -2.69 0.06 -1.12 2.62 2.01 -1.18 -5.09 115.64 110.25 2k4t s THR 51 Ca 0.00 -0.53 -0.08 0.00 0.31 0.00 0.00 61.69 61.39 2k4t s THR 51 Cb 0.00 -1.06 0.28 0.00 0.01 0.00 0.00 72.50 71.73 2k4t s THR 51 CO 0.00 -0.29 1.31 0.41 -0.69 0.00 0.00 174.62 175.36 2k4t n THR 52 N 0.16 4.83 -3.37 -0.82 -1.04 -1.26 -4.52 114.28 108.26 2k4t n THR 52 Ca -0.17 -5.50 -0.14 0.00 -2.04 0.00 0.00 64.05 56.20 2k4t n THR 52 Cb 0.62 -2.38 -0.08 0.00 -1.82 0.00 0.00 70.33 66.66 2k4t n THR 52 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2k4t s LYS 53 N -1.57 0.35 -0.08 -2.82 -0.14 -1.26 -5.04 119.74 109.17 2k4t s LYS 53 Ca 0.32 0.05 0.00 0.00 -1.36 0.00 0.00 55.97 54.98 2k4t s LYS 53 Cb -0.03 -0.56 0.02 0.00 -1.68 0.00 0.00 37.83 35.59 2k4t s LYS 53 CO -0.00 -0.96 -0.06 0.08 -0.76 0.00 0.00 175.35 173.64 2k4t s VAL 54 N 2.44 0.83 -0.02 3.17 1.01 -1.26 -0.86 120.40 125.70 2k4t s VAL 54 Ca 0.10 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.87 2k4t s VAL 54 Cb -0.14 -0.85 0.01 0.00 0.00 0.00 0.00 36.38 35.40 2k4t s VAL 54 CO -0.29 0.32 -0.03 0.28 0.00 0.00 0.00 175.10 175.38 2k4t s THR 55 N 1.39 0.37 0.01 3.92 -1.32 0.31 -4.98 115.64 115.34 2k4t s THR 55 Ca -0.02 -0.10 0.06 0.00 -1.21 0.00 0.00 61.69 60.42 2k4t s THR 55 Cb -0.13 -0.38 -0.02 0.00 -1.51 0.00 0.00 72.50 70.45 2k4t s THR 55 CO -0.04 0.15 -0.19 -0.83 -2.21 0.00 0.00 174.62 171.51 2k4t s GLY 56 N 0.53 0.96 -0.09 6.08 0.00 -1.26 -0.12 107.32 113.42 2k4t s GLY 56 Ca -0.06 -0.88 -0.01 0.00 0.00 0.00 0.00 44.72 43.77 2k4t s GLY 56 CO -0.00 -0.78 -0.04 -1.35 0.00 0.00 0.00 173.10 170.93 2k4t s SER 57 N -0.74 4.87 -0.22 1.64 1.04 0.51 -2.20 113.70 118.59 2k4t s SER 57 Ca 0.07 0.02 -0.04 0.00 0.48 0.00 0.00 55.95 56.47 2k4t s SER 57 Cb -0.08 -1.35 -0.01 0.00 0.10 0.00 0.00 66.02 64.68 2k4t s SER 57 CO 0.00 0.34 -0.02 -0.22 0.98 0.00 0.00 173.24 174.32 2k4t s LEU 58 N -0.68 2.99 -0.16 2.42 1.98 -0.48 -0.92 118.68 123.83 2k4t s LEU 58 Ca 0.10 -0.35 -0.00 0.00 -2.89 0.00 0.00 54.13 50.99 2k4t s LEU 58 Cb -0.12 -1.77 0.04 0.00 0.66 0.00 0.00 46.19 45.01 2k4t s LEU 58 CO 0.02 -0.01 -0.06 -1.83 -1.89 0.00 0.00 176.35 172.58 2k4t s GLU 59 N 1.45 1.49 0.08 1.98 -1.05 -0.19 -0.55 118.70 121.91 2k4t s GLU 59 Ca 0.05 -0.50 0.08 0.00 -0.15 0.00 0.00 54.97 54.45 2k4t s GLU 59 Cb -0.14 -1.97 -0.03 0.00 -0.44 0.00 0.00 34.13 31.54 2k4t s GLU 59 CO -0.02 -0.41 -0.20 0.99 0.95 0.00 0.00 175.26 176.57 2k4t s THR 60 N 1.63 1.65 -0.03 1.83 2.01 -0.59 -1.52 115.64 120.62 2k4t s THR 60 Ca 0.01 -1.43 0.03 0.00 0.31 0.00 0.00 61.69 60.61 2k4t s THR 60 Cb -0.15 -1.49 0.00 0.00 0.01 0.00 0.00 72.50 70.88 2k4t s THR 60 CO -0.08 -0.00 -0.10 -1.59 -0.69 0.00 0.00 174.62 172.15 2k4t s LYS 61 N -1.70 1.12 0.10 4.92 -2.85 -0.09 -0.14 119.74 121.09 2k4t s LYS 61 Ca 0.06 -0.35 0.10 0.00 -1.00 0.00 0.00 55.97 54.77 2k4t s LYS 61 Cb -0.10 -1.02 -0.03 0.00 -2.06 0.00 0.00 37.83 34.62 2k4t s LYS 61 CO 0.03 0.13 -0.25 -0.47 0.10 0.00 0.00 175.35 174.89 2k4t s TYR 62 N 0.20 2.16 -0.52 1.78 5.04 -0.46 -1.13 117.35 124.42 2k4t s TYR 62 Ca -0.04 -0.39 -0.03 0.00 -2.44 0.00 0.00 57.07 54.16 2k4t s TYR 62 Cb -0.09 -1.21 0.00 0.00 0.35 0.00 0.00 41.96 41.01 2k4t s TYR 62 CO 0.01 0.24 0.53 0.54 -1.34 0.00 0.00 175.55 175.53 2k4t n ARG 63 N 1.23 -1.27 -4.17 4.97 1.74 -1.26 -1.15 116.66 116.76 2k4t n ARG 63 Ca -0.18 1.42 -0.34 0.00 -0.77 0.00 0.00 57.85 57.99 2k4t n ARG 63 Cb 0.53 -4.85 -0.15 0.00 -1.02 0.00 0.00 32.46 26.97 2k4t n ARG 63 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 2k4t s TRP 64 N -2.80 2.85 -0.05 -1.55 -0.00 -1.26 -2.75 118.94 113.38 2k4t s TRP 64 Ca 0.05 -1.18 -0.30 0.00 -0.00 0.00 0.00 56.10 54.67 2k4t s TRP 64 Cb -0.02 -1.98 0.10 0.00 -0.00 0.00 0.00 33.47 31.58 2k4t s TRP 64 CO 0.60 -0.60 1.33 0.95 -0.00 0.00 0.00 176.95 179.22 2k4t s THR 65 N 1.20 0.00 0.00 5.86 -4.23 -1.26 -4.92 115.64 112.29 2k4t s THR 65 Ca 0.02 -0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.42 2k4t s THR 65 Cb -0.14 -2.78 0.00 0.00 1.34 0.00 0.00 72.50 70.91 2k4t s THR 65 CO -0.05 0.00 0.72 -0.62 -0.54 0.00 0.00 174.62 174.12 2k4t n GLU 66 N -0.85 0.00 -3.22 3.99 4.71 -1.26 -4.52 120.64 119.49 2k4t n GLU 66 Ca 0.02 0.42 -0.39 0.00 -0.01 0.00 0.00 57.16 57.20 2k4t n GLU 66 Cb 0.59 -1.22 -0.06 0.00 -1.01 0.00 0.00 31.44 29.75 2k4t n GLU 66 CO 0.00 0.00 0.00 1.52 0.09 0.00 0.00 177.13 178.74 2k4t s TYR 67 N -1.86 3.47 -4.24 -0.32 1.13 -0.70 -2.97 117.35 111.87 2k4t s TYR 67 Ca 0.00 0.94 0.00 0.00 -1.41 0.00 0.00 57.07 56.60 2k4t s TYR 67 Cb 0.00 -2.67 0.00 0.00 -1.10 0.00 0.00 41.96 38.19 2k4t s TYR 67 CO 0.00 0.04 0.00 0.41 -2.51 0.00 0.00 175.55 173.49 2k4t n GLY 68 N 3.45 0.92 3.00 5.49 0.00 -0.06 -4.98 105.19 113.01 2k4t n GLY 68 Ca -0.04 -1.98 -0.25 0.00 0.00 0.00 0.00 46.02 43.74 2k4t n GLY 68 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k4t s LEU 69 N 0.00 1.54 -0.15 0.99 1.02 -1.26 -1.15 118.68 119.67 2k4t s LEU 69 Ca 0.00 -0.31 -0.08 0.00 0.02 0.00 0.00 54.13 53.76 2k4t s LEU 69 Cb 0.00 -0.85 -0.04 0.00 0.02 0.00 0.00 46.19 45.32 2k4t s LEU 69 CO 0.00 -0.01 0.15 0.28 0.02 0.00 0.00 176.35 176.79 2k4t s THR 70 N 0.95 5.46 -0.30 5.49 -1.32 0.20 -4.72 115.64 121.39 2k4t s THR 70 Ca -0.09 0.23 -0.09 0.00 -1.21 0.00 0.00 61.69 60.52 2k4t s THR 70 Cb -0.15 -3.44 -0.01 0.00 -1.51 0.00 0.00 72.50 67.39 2k4t s THR 70 CO 0.00 0.54 0.14 -0.36 -2.21 0.00 0.00 174.62 172.73 2k4t s PHE 71 N -0.46 3.16 -0.20 9.09 0.40 -0.30 -1.57 117.98 128.11 2k4t s PHE 71 Ca 0.13 -0.53 -0.07 0.00 -0.60 0.00 0.00 56.93 55.85 2k4t s PHE 71 Cb -0.12 -2.33 -0.04 0.00 0.51 0.00 0.00 43.02 41.05 2k4t s PHE 71 CO 0.02 -0.43 0.06 0.99 0.70 0.00 0.00 175.22 176.56 2k4t s THR 72 N 1.61 4.61 -0.21 0.64 2.01 0.94 -1.36 115.64 123.89 2k4t s THR 72 Ca 0.05 -0.09 -0.01 0.00 0.31 0.00 0.00 61.69 61.95 2k4t s THR 72 Cb -0.17 -3.09 0.01 0.00 0.01 0.00 0.00 72.50 69.26 2k4t s THR 72 CO 0.06 0.43 -0.12 -0.70 -0.69 0.00 0.00 174.62 173.60 2k4t s GLU 73 N 0.70 3.10 -0.24 4.92 2.12 0.80 -0.69 118.70 129.43 2k4t s GLU 73 Ca 0.03 -0.78 -0.01 0.00 0.36 0.00 0.00 54.97 54.56 2k4t s GLU 73 Cb -0.13 -2.80 0.02 0.00 0.26 0.00 0.00 34.13 31.48 2k4t s GLU 73 CO 0.02 -0.24 -0.08 0.21 -0.54 0.00 0.00 175.26 174.63 2k4t s LYS 74 N 1.36 2.92 -0.19 4.30 2.20 0.10 -1.54 119.74 128.89 2k4t s LYS 74 Ca 0.04 -0.91 0.00 0.00 -0.36 0.00 0.00 55.97 54.74 2k4t s LYS 74 Cb -0.14 -2.93 0.04 0.00 -1.51 0.00 0.00 37.83 33.29 2k4t s LYS 74 CO -0.08 -0.35 -0.08 -0.46 -0.36 0.00 0.00 175.35 174.02 2k4t s TRP 75 N 1.34 2.21 0.02 4.03 -0.11 0.28 0.05 118.94 126.76 2k4t s TRP 75 Ca 0.01 -1.46 -0.17 0.00 1.22 0.00 0.00 56.10 55.71 2k4t s TRP 75 Cb -0.16 -1.54 -0.06 0.00 -1.50 0.00 0.00 33.47 30.21 2k4t s TRP 75 CO -0.05 -0.71 0.49 -0.80 -4.62 0.00 0.00 176.95 171.25 2k4t s ASN 76 N 1.47 6.92 0.65 5.86 0.01 0.47 -1.38 114.94 128.93 2k4t s ASN 76 Ca -0.01 1.09 0.33 0.00 -0.71 0.00 0.00 52.86 53.56 2k4t s ASN 76 Cb -0.16 -2.30 1.79 0.00 0.41 0.00 0.00 41.25 40.99 2k4t s ASN 76 CO -0.08 0.28 2.03 0.74 -1.51 0.00 0.00 177.10 178.56 2k4t h THR 77 N 3.71 0.07 -0.09 1.60 2.02 -1.74 -2.39 112.91 116.10 2k4t h THR 77 Ca -0.50 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 66.55 2k4t h THR 77 Cb 1.21 0.75 -0.05 0.00 -1.74 0.00 0.00 68.15 68.32 2k4t h THR 77 CO 0.63 0.00 -0.12 -0.67 0.37 0.00 0.00 175.52 175.74 2k4t n ASP 78 N -3.08 5.44 -4.32 4.18 2.03 -1.26 -4.72 116.55 114.83 2k4t n ASP 78 Ca -0.01 -2.53 -0.38 0.00 0.52 0.00 0.00 54.79 52.39 2k4t n ASP 78 Cb 0.33 -1.25 -0.04 0.00 -0.72 0.00 0.00 41.12 39.43 2k4t n ASP 78 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2k4t n ASN 79 N 1.81 -2.67 -4.42 1.67 3.02 -0.97 -4.75 115.26 108.95 2k4t n ASN 79 Ca 0.23 -1.09 -0.33 0.00 -0.03 0.00 0.00 54.58 53.36 2k4t n ASN 79 Cb 0.69 -2.39 -0.14 0.00 -0.61 0.00 0.00 39.78 37.33 2k4t n ASN 79 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2k4t s THR 80 N -3.33 2.93 0.12 3.41 2.01 -0.94 -3.93 115.64 115.92 2k4t s THR 80 Ca 0.73 -0.75 0.10 0.00 0.31 0.00 0.00 61.69 62.08 2k4t s THR 80 Cb -0.41 -2.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.90 2k4t s THR 80 CO 0.96 0.57 -0.25 -0.76 -0.69 0.00 0.00 174.62 174.45 2k4t s LEU 81 N -0.40 2.37 -0.30 4.42 2.01 -0.25 -0.40 118.68 126.14 2k4t s LEU 81 Ca 0.04 -0.70 -0.03 0.00 0.01 0.00 0.00 54.13 53.45 2k4t s LEU 81 Cb -0.12 -1.28 0.19 0.00 0.01 0.00 0.00 46.19 44.99 2k4t s LEU 81 CO 0.02 0.19 0.71 -0.83 1.01 0.00 0.00 176.35 177.45 2k4t s GLY 82 N -2.00 -0.92 -0.08 -3.19 0.00 0.11 0.02 107.32 101.26 2k4t s GLY 82 Ca 0.14 1.88 -0.04 0.00 0.00 0.00 0.00 44.72 46.71 2k4t s GLY 82 CO 0.06 3.57 0.08 -0.51 0.00 0.00 0.00 173.10 176.30 2k4t s THR 83 N 2.88 4.94 -0.04 0.90 -4.23 -0.75 0.00 115.64 119.34 2k4t s THR 83 Ca 0.15 -0.09 -0.02 0.00 -1.18 0.00 0.00 61.69 60.55 2k4t s THR 83 Cb -0.12 -3.16 0.03 0.00 1.34 0.00 0.00 72.50 70.59 2k4t s THR 83 CO -0.20 0.55 0.07 -0.70 -0.54 0.00 0.00 174.62 173.79 2k4t s GLU 84 N -1.17 -0.05 -0.07 3.99 2.56 0.14 -2.92 118.70 121.17 2k4t s GLU 84 Ca 0.17 0.35 0.02 0.00 0.00 0.00 0.00 54.97 55.51 2k4t s GLU 84 Cb -0.12 -0.40 -0.02 0.00 2.00 0.00 0.00 34.13 35.59 2k4t s GLU 84 CO 0.06 -0.28 -0.12 -1.50 -0.56 0.00 0.00 175.26 172.87 2k4t s ILE 85 N 1.86 3.27 0.05 -3.70 -1.16 -1.20 -0.04 121.20 120.28 2k4t s ILE 85 Ca 0.01 -0.63 0.06 0.00 -0.51 0.00 0.00 60.65 59.57 2k4t s ILE 85 Cb -0.12 -2.32 -0.03 0.00 0.61 0.00 0.00 42.46 40.60 2k4t s ILE 85 CO -0.03 0.58 -0.16 -0.89 -2.81 0.00 0.00 174.94 171.62 2k4t s THR 86 N -0.49 1.29 -0.12 4.00 2.01 -0.61 -1.09 115.64 120.63 2k4t s THR 86 Ca 0.07 -1.15 0.00 0.00 0.31 0.00 0.00 61.69 60.91 2k4t s THR 86 Cb -0.12 -1.17 0.02 0.00 0.01 0.00 0.00 72.50 71.25 2k4t s THR 86 CO 0.02 -0.00 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.15 2k4t s VAL 87 N -0.95 1.20 0.06 3.82 1.01 0.14 -0.63 120.40 125.05 2k4t s VAL 87 Ca 0.03 -0.41 0.09 0.00 0.00 0.00 0.00 61.98 61.68 2k4t s VAL 87 Cb -0.09 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 2k4t s VAL 87 CO 0.02 0.39 -0.25 -0.70 0.00 0.00 0.00 175.10 174.56 2k4t s GLU 88 N 1.51 1.67 -0.01 2.72 2.12 -0.30 -1.50 118.70 124.90 2k4t s GLU 88 Ca 0.02 -1.11 -0.01 0.00 0.36 0.00 0.00 54.97 54.24 2k4t s GLU 88 Cb -0.13 -1.87 -0.00 0.00 0.26 0.00 0.00 34.13 32.39 2k4t s GLU 88 CO -0.07 0.48 -0.01 -3.47 -0.54 0.00 0.00 175.26 171.64 2k4t n ASP 89 N 1.68 0.06 -3.22 -1.70 -0.08 -1.16 -0.88 116.55 111.25 2k4t n ASP 89 Ca -0.17 0.01 -0.05 0.00 -1.51 0.00 0.00 54.79 53.07 2k4t n ASP 89 Cb 0.52 -0.50 0.02 0.00 2.34 0.00 0.00 41.12 43.50 2k4t n ASP 89 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 2k4t s GLN 90 N -1.05 1.60 0.32 -0.67 -0.21 -1.26 -1.71 119.66 116.67 2k4t s GLN 90 Ca -0.01 -1.03 0.17 0.00 0.02 0.00 0.00 55.36 54.51 2k4t s GLN 90 Cb 0.00 0.45 0.32 0.00 1.00 0.00 0.00 33.01 34.77 2k4t s GLN 90 CO 0.01 -0.75 1.56 1.37 -2.12 0.00 0.00 175.29 175.36 2k4t h LEU 91 N 2.00 0.00 0.41 2.90 -0.00 -2.00 -3.12 115.31 115.50 2k4t h LEU 91 Ca -0.29 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.57 2k4t h LEU 91 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.89 2k4t h LEU 91 CO 0.38 0.44 -0.20 0.00 -0.00 0.00 0.00 178.44 179.06 2k4t h ALA 92 N 1.56 -0.68 -1.16 0.17 0.00 -2.03 -3.38 119.26 113.74 2k4t h ALA 92 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2k4t h ALA 92 Cb 1.19 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2k4t h ALA 92 CO 0.06 -0.64 0.00 0.54 0.00 0.00 0.00 179.25 179.21 2k4t n ARG 93 N -4.48 0.00 -0.02 0.00 5.12 -1.25 -4.94 116.66 111.09 2k4t n ARG 93 Ca -0.07 0.44 0.00 0.00 -1.93 0.00 0.00 57.85 56.29 2k4t n ARG 93 Cb 0.22 -1.31 0.00 0.00 -1.16 0.00 0.00 32.46 30.21 2k4t n ARG 93 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2k4t n GLY 94 N -0.86 0.99 3.64 -0.13 0.00 -1.18 -4.72 105.19 102.93 2k4t n GLY 94 Ca 0.00 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 2k4t n GLY 94 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k4t s LEU 95 N 0.00 4.09 -0.04 0.99 1.43 -1.26 -1.90 118.68 121.99 2k4t s LEU 95 Ca 0.00 0.14 0.04 0.00 -1.03 0.00 0.00 54.13 53.27 2k4t s LEU 95 Cb 0.00 -2.17 -0.00 0.00 0.03 0.00 0.00 46.19 44.04 2k4t s LEU 95 CO 0.00 0.01 -0.15 -0.75 0.23 0.00 0.00 176.35 175.69 2k4t s LYS 96 N 1.32 1.54 -0.13 1.70 2.20 -0.52 -3.75 119.74 122.11 2k4t s LYS 96 Ca 0.09 -0.53 -0.00 0.00 -0.36 0.00 0.00 55.97 55.17 2k4t s LYS 96 Cb -0.14 -1.37 0.03 0.00 -1.51 0.00 0.00 37.83 34.84 2k4t s LYS 96 CO 0.07 0.22 -0.07 -1.17 -0.36 0.00 0.00 175.35 174.03 2k4t s LEU 97 N 0.06 1.34 -0.17 5.43 0.20 -0.56 -0.62 118.68 124.35 2k4t s LEU 97 Ca -0.03 -0.41 0.01 0.00 0.69 0.00 0.00 54.13 54.38 2k4t s LEU 97 Cb -0.10 -0.89 0.02 0.00 -0.43 0.00 0.00 46.19 44.79 2k4t s LEU 97 CO 0.02 -0.13 -0.17 0.42 -0.29 0.00 0.00 176.35 176.19 2k4t s THR 98 N 1.67 1.84 -0.03 3.68 -4.23 -0.46 0.24 115.64 118.35 2k4t s THR 98 Ca 0.04 -0.81 0.01 0.00 -1.18 0.00 0.00 61.69 59.75 2k4t s THR 98 Cb -0.13 -1.69 0.02 0.00 1.34 0.00 0.00 72.50 72.03 2k4t s THR 98 CO -0.08 0.50 -0.04 0.72 -0.54 0.00 0.00 174.62 175.18 2k4t s PHE 99 N 1.38 0.64 0.08 3.99 -0.12 -0.25 0.01 117.98 123.71 2k4t s PHE 99 Ca 0.05 -0.15 -0.25 0.00 -0.05 0.00 0.00 56.93 56.53 2k4t s PHE 99 Cb -0.13 -0.55 0.09 0.00 -0.63 0.00 0.00 43.02 41.79 2k4t s PHE 99 CO -0.12 -0.14 1.16 0.34 -0.05 0.00 0.00 175.22 176.41 2k4t s ASP 100 N 0.68 -0.00 0.07 1.98 -1.08 -0.64 -3.27 116.67 114.41 2k4t s ASP 100 Ca -0.09 -0.43 -0.00 0.00 -0.52 0.00 0.00 52.55 51.52 2k4t s ASP 100 Cb -0.12 0.32 -0.04 0.00 -1.46 0.00 0.00 42.92 41.62 2k4t s ASP 100 CO -0.00 -0.64 -0.04 -0.44 0.52 0.00 0.00 175.17 174.57 2k4t s SER 101 N -3.55 0.70 0.13 -0.34 0.01 -1.15 -0.24 113.70 109.27 2k4t s SER 101 Ca 0.25 -0.99 0.09 0.00 1.31 0.00 0.00 55.95 56.60 2k4t s SER 101 Cb -0.01 0.16 -0.04 0.00 0.21 0.00 0.00 66.02 66.34 2k4t s SER 101 CO 0.02 -0.55 -0.20 -0.94 0.41 0.00 0.00 173.24 171.98 2k4t s SER 102 N -2.92 2.65 -0.09 2.44 1.04 -0.32 -1.82 113.70 114.69 2k4t s SER 102 Ca 0.08 -0.76 0.04 0.00 0.48 0.00 0.00 55.95 55.79 2k4t s SER 102 Cb 0.07 -0.15 -0.00 0.00 0.10 0.00 0.00 66.02 66.03 2k4t s SER 102 CO -0.08 0.03 -0.24 0.12 0.98 0.00 0.00 173.24 174.05 2k4t s PHE 103 N -1.50 2.50 -0.02 5.02 2.19 0.10 -1.21 117.98 125.06 2k4t s PHE 103 Ca 0.11 -0.98 0.04 0.00 0.33 0.00 0.00 56.93 56.42 2k4t s PHE 103 Cb -0.08 -1.67 -0.03 0.00 -1.31 0.00 0.00 43.02 39.93 2k4t s PHE 103 CO 0.05 -0.39 -0.13 -1.12 1.83 0.00 0.00 175.22 175.46 2k4t s SER 104 N 0.28 4.11 -1.02 6.13 0.01 -0.47 -1.09 113.70 121.65 2k4t s SER 104 Ca -0.17 -0.23 -0.24 0.00 1.31 0.00 0.00 55.95 56.62 2k4t s SER 104 Cb -0.17 -0.85 -0.06 0.00 0.21 0.00 0.00 66.02 65.15 2k4t s SER 104 CO 0.08 0.31 1.94 -2.16 0.41 0.00 0.00 173.24 173.83 2k4t s PRO 105 N -1.03 2.53 -0.39 12.44 0.04 -1.25 -3.86 135.00 143.48 2k4t s PRO 105 Ca 0.13 -0.64 0.11 0.00 0.04 0.00 0.00 61.00 60.64 2k4t s PRO 105 Cb -0.11 -5.14 0.39 0.00 0.04 0.00 0.00 34.50 29.69 2k4t s PRO 105 CO 0.03 -3.62 1.13 -1.71 0.04 0.00 0.00 177.00 172.86 2k4t n ASN 106 N 14.14 -0.77 -2.03 6.66 5.15 -1.26 -4.95 115.26 132.20 2k4t n ASN 106 Ca 0.42 -2.84 -0.19 0.00 -0.60 0.00 0.00 54.58 51.37 2k4t n ASN 106 Cb 0.47 0.58 -0.03 0.00 -0.53 0.00 0.00 39.78 40.27 2k4t n ASN 106 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2k4t n THR 107 N -0.16 -0.68 -0.03 -0.44 -1.04 -1.26 -4.52 114.28 106.14 2k4t n THR 107 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 2k4t n THR 107 Cb 0.79 -2.57 0.00 0.00 -1.82 0.00 0.00 70.33 66.73 2k4t n THR 107 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2k4t n GLY 108 N -0.90 0.54 3.15 3.41 0.00 -1.26 -5.13 105.19 104.99 2k4t n GLY 108 Ca -0.22 -0.95 0.04 0.00 0.00 0.00 0.00 46.02 44.89 2k4t n GLY 108 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k4t s LYS 109 N -0.78 0.49 0.01 1.61 2.47 -1.25 -5.05 119.74 117.23 2k4t s LYS 109 Ca 0.00 0.59 0.06 0.00 -1.56 0.00 0.00 55.97 55.06 2k4t s LYS 109 Cb 0.00 0.29 -0.03 0.00 -1.46 0.00 0.00 37.83 36.63 2k4t s LYS 109 CO 0.00 -0.81 -0.18 -1.59 0.16 0.00 0.00 175.35 172.93 2k4t s LYS 110 N 2.86 2.19 -0.09 4.03 -2.85 -1.26 -1.37 119.74 123.25 2k4t s LYS 110 Ca 0.14 -0.90 0.00 0.00 -1.00 0.00 0.00 55.97 54.22 2k4t s LYS 110 Cb -0.10 -2.22 0.02 0.00 -2.06 0.00 0.00 37.83 33.47 2k4t s LYS 110 CO -0.24 0.57 -0.07 -0.80 0.10 0.00 0.00 175.35 174.91 2k4t s ASN 111 N -1.13 1.82 -0.26 0.03 -0.87 -0.35 -4.81 114.94 109.36 2k4t s ASN 111 Ca 0.13 -0.24 -0.14 0.00 -1.57 0.00 0.00 52.86 51.04 2k4t s ASN 111 Cb -0.10 -0.72 -0.04 0.00 -0.02 0.00 0.00 41.25 40.36 2k4t s ASN 111 CO 0.03 -0.09 0.33 0.00 -2.57 0.00 0.00 177.10 174.80 2k4t s ALA 112 N 1.41 3.56 0.00 0.60 0.00 -1.01 -1.17 121.76 125.15 2k4t s ALA 112 Ca -0.02 -0.84 0.07 0.00 0.00 0.00 0.00 51.96 51.17 2k4t s ALA 112 Cb -0.13 -2.63 -0.02 0.00 0.00 0.00 0.00 23.12 20.33 2k4t s ALA 112 CO -0.04 -0.57 -0.20 0.15 0.00 0.00 0.00 175.76 175.10 2k4t s LYS 113 N 1.86 1.55 0.00 0.00 1.02 0.67 -0.33 119.74 124.51 2k4t s LYS 113 Ca 0.13 -0.79 0.03 0.00 0.02 0.00 0.00 55.97 55.37 2k4t s LYS 113 Cb -0.16 -1.54 -0.01 0.00 -0.52 0.00 0.00 37.83 35.60 2k4t s LYS 113 CO 0.10 0.41 -0.09 -1.50 -0.92 0.00 0.00 175.35 173.35 2k4t s ILE 114 N -0.58 0.71 -0.01 2.17 -1.16 -0.42 -1.62 121.20 120.30 2k4t s ILE 114 Ca 0.08 -0.51 0.03 0.00 -0.51 0.00 0.00 60.65 59.74 2k4t s ILE 114 Cb -0.08 -0.62 -0.01 0.00 0.61 0.00 0.00 42.46 42.36 2k4t s ILE 114 CO 0.00 0.11 -0.11 -0.54 -2.81 0.00 0.00 174.94 171.59 2k4t s LYS 115 N -0.44 0.90 -0.26 3.50 1.02 0.10 -0.20 119.74 124.36 2k4t s LYS 115 Ca 0.02 -0.39 0.01 0.00 0.02 0.00 0.00 55.97 55.63 2k4t s LYS 115 Cb -0.04 -0.87 0.07 0.00 -0.52 0.00 0.00 37.83 36.46 2k4t s LYS 115 CO -0.00 0.23 -0.02 0.95 -0.92 0.00 0.00 175.35 175.59 2k4t s THR 116 N -0.24 1.59 -0.24 2.17 -4.23 0.90 -1.35 115.64 114.24 2k4t s THR 116 Ca 0.04 -1.42 -0.15 0.00 -1.18 0.00 0.00 61.69 58.99 2k4t s THR 116 Cb -0.04 -1.93 -0.04 0.00 1.34 0.00 0.00 72.50 71.83 2k4t s THR 116 CO -0.00 -0.23 0.35 -0.83 -0.54 0.00 0.00 174.62 173.36 2k4t s GLY 117 N 1.34 1.97 -0.20 3.99 0.00 0.21 -1.39 107.32 113.24 2k4t s GLY 117 Ca -0.02 -0.72 -0.02 0.00 0.00 0.00 0.00 44.72 43.95 2k4t s GLY 117 CO -0.08 0.83 -0.09 -0.47 0.00 0.00 0.00 173.10 173.29 2k4t s TYR 118 N 1.63 2.90 -0.19 1.90 6.14 -0.39 -1.43 117.35 127.91 2k4t s TYR 118 Ca 0.15 -1.07 -0.05 0.00 0.64 0.00 0.00 57.07 56.74 2k4t s TYR 118 Cb -0.15 -2.04 -0.02 0.00 0.42 0.00 0.00 41.96 40.17 2k4t s TYR 118 CO 0.08 -0.57 -0.01 0.21 0.64 0.00 0.00 175.55 175.90 2k4t s LYS 119 N 1.32 3.62 0.00 4.97 2.20 -0.80 -1.30 119.74 129.75 2k4t s LYS 119 Ca 0.04 -0.53 0.00 0.00 -0.36 0.00 0.00 55.97 55.12 2k4t s LYS 119 Cb -0.14 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.14 2k4t s LYS 119 CO -0.05 0.05 0.00 -2.13 -0.36 0.00 0.00 175.35 172.86 2k4t n ARG 120 N 4.13 1.86 -0.15 4.03 3.00 -1.20 -4.64 116.66 123.69 2k4t n ARG 120 Ca -0.17 0.00 -0.06 0.00 -0.00 0.00 0.00 57.85 57.62 2k4t n ARG 120 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 32.93 2k4t n ARG 120 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2k4t h GLU 121 N 0.00 -0.08 -1.34 -0.14 5.08 -1.99 -3.32 114.58 112.79 2k4t h GLU 121 Ca 0.00 0.01 -0.40 0.00 -1.00 0.00 0.00 59.36 57.97 2k4t h GLU 121 Cb 0.00 0.02 -0.38 0.00 0.50 0.00 0.00 28.75 28.89 2k4t h GLU 121 CO 0.00 -0.05 -1.14 0.72 -1.00 0.00 0.00 179.01 177.54 2k4t n HIS 122 N -4.06 0.48 -3.92 4.33 8.25 -1.26 -5.10 115.22 113.93 2k4t n HIS 122 Ca -0.00 -3.16 -0.09 0.00 -0.26 0.00 0.00 57.72 54.21 2k4t n HIS 122 Cb 0.14 -0.25 -0.07 0.00 1.12 0.00 0.00 29.99 30.92 2k4t n HIS 122 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2k4t s ILE 123 N -2.59 0.12 -0.17 1.59 -5.25 -1.25 -2.29 121.20 111.36 2k4t s ILE 123 Ca 0.32 -1.34 -0.02 0.00 -0.99 0.00 0.00 60.65 58.63 2k4t s ILE 123 Cb 0.41 -1.56 0.05 0.00 2.95 0.00 0.00 42.46 44.30 2k4t s ILE 123 CO -0.02 -0.54 -0.00 0.21 -1.79 0.00 0.00 174.94 172.80 2k4t s ASN 124 N -2.91 2.75 -0.09 4.36 2.47 -0.05 -3.26 114.94 118.22 2k4t s ASN 124 Ca 0.10 -0.69 -0.00 0.00 0.42 0.00 0.00 52.86 52.69 2k4t s ASN 124 Cb 0.05 -0.71 -0.03 0.00 -1.45 0.00 0.00 41.25 39.11 2k4t s ASN 124 CO -0.07 -0.25 -0.06 -0.22 -3.72 0.00 0.00 177.10 172.78 2k4t s LEU 125 N 1.78 3.19 -0.31 3.21 0.20 -0.42 -1.38 118.68 124.95 2k4t s LEU 125 Ca 0.00 -0.04 -0.02 0.00 0.69 0.00 0.00 54.13 54.76 2k4t s LEU 125 Cb -0.16 -1.71 0.12 0.00 -0.43 0.00 0.00 46.19 44.01 2k4t s LEU 125 CO -0.07 0.32 0.20 -0.83 -0.29 0.00 0.00 176.35 175.68 2k4t s GLY 126 N -0.57 0.36 -0.42 7.98 0.00 0.12 -1.26 107.32 113.55 2k4t s GLY 126 Ca 0.09 -1.03 -0.13 0.00 0.00 0.00 0.00 44.72 43.64 2k4t s GLY 126 CO 0.02 2.26 0.30 0.00 0.00 0.00 0.00 173.10 175.68 2k4t s ASP 128 N 1.94 4.43 -0.04 0.00 2.15 0.82 -0.07 116.67 125.91 2k4t s ASP 128 Ca 0.04 -0.10 -0.02 0.00 0.43 0.00 0.00 52.55 52.90 2k4t s ASP 128 Cb -0.21 -1.14 0.03 0.00 -0.30 0.00 0.00 42.92 41.30 2k4t s ASP 128 CO 0.07 0.33 0.06 -0.04 -0.17 0.00 0.00 175.17 175.43 2k4t s MET 129 N -0.63 -0.07 -0.38 4.34 -1.94 0.72 0.05 119.30 121.39 2k4t s MET 129 Ca 0.09 0.38 -0.14 0.00 -1.71 0.00 0.00 55.69 54.32 2k4t s MET 129 Cb -0.11 -0.49 0.01 0.00 2.01 0.00 0.00 34.83 36.24 2k4t s MET 129 CO 0.02 -0.32 0.26 -0.51 -0.01 0.00 0.00 175.02 174.45 2k4t s ASP 130 N 2.15 6.02 -0.05 3.03 1.01 0.88 -1.29 116.67 128.42 2k4t s ASP 130 Ca 0.05 -0.75 -0.01 0.00 0.71 0.00 0.00 52.55 52.54 2k4t s ASP 130 Cb -0.12 -2.13 -0.04 0.00 1.01 0.00 0.00 42.92 41.65 2k4t s ASP 130 CO -0.03 -0.37 0.05 0.12 0.21 0.00 0.00 175.17 175.15 2k4t s PHE 131 N 1.67 3.24 -0.02 4.23 5.36 0.55 -1.16 117.98 131.85 2k4t s PHE 131 Ca 0.05 0.22 -0.12 0.00 -0.96 0.00 0.00 56.93 56.12 2k4t s PHE 131 Cb -0.18 -1.77 0.04 0.00 -0.34 0.00 0.00 43.02 40.77 2k4t s PHE 131 CO 0.10 0.53 0.53 -3.47 -1.46 0.00 0.00 175.22 171.44 2k4t n ASP 132 N 1.65 -0.45 -0.46 6.13 2.03 -1.26 -2.40 116.55 121.78 2k4t n ASP 132 Ca -0.16 -1.06 0.06 0.00 0.52 0.00 0.00 54.79 54.15 2k4t n ASP 132 Cb 0.53 0.68 0.15 0.00 -0.72 0.00 0.00 41.12 41.77 2k4t n ASP 132 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2k4t n ILE 133 N -0.38 1.58 -0.02 5.18 -0.00 -1.26 -4.53 119.36 119.93 2k4t n ILE 133 Ca 0.02 -1.54 -0.03 0.00 -0.00 0.00 0.00 62.75 61.21 2k4t n ILE 133 Cb 0.23 0.11 -0.04 0.00 -0.00 0.00 0.00 39.64 39.95 2k4t n ILE 133 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2k4t n ALA 134 N -0.42 1.88 0.00 -1.28 0.00 -1.26 -5.03 120.51 114.40 2k4t n ALA 134 Ca 0.13 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2k4t n ALA 134 Cb 0.58 0.17 0.00 0.00 0.00 0.00 0.00 19.45 20.20 2k4t n ALA 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4t n GLY 135 N 2.76 -1.29 3.77 0.00 0.00 -1.26 -5.16 105.19 104.01 2k4t n GLY 135 Ca -0.08 0.77 -0.35 0.00 0.00 0.00 0.00 46.02 46.36 2k4t n GLY 135 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k4t s PRO 136 N 0.00 3.30 -0.02 1.61 0.04 -1.26 -4.89 135.00 133.78 2k4t s PRO 136 Ca 0.00 1.59 0.00 0.00 0.04 0.00 0.00 61.00 62.63 2k4t s PRO 136 Cb 0.00 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.56 2k4t s PRO 136 CO 0.00 -0.88 -0.00 -1.54 0.04 0.00 0.00 177.00 174.62 2k4t s SER 137 N -1.85 0.27 -0.45 6.66 1.04 -0.31 -4.26 113.70 114.79 2k4t s SER 137 Ca 0.72 -0.02 -0.15 0.00 0.48 0.00 0.00 55.95 56.99 2k4t s SER 137 Cb -0.23 -0.11 0.06 0.00 0.10 0.00 0.00 66.02 65.83 2k4t s SER 137 CO 0.28 -0.06 0.36 -0.63 0.98 0.00 0.00 173.24 174.18 2k4t s ILE 138 N 0.63 5.14 -0.33 -1.02 -1.09 -1.26 -0.08 121.20 123.19 2k4t s ILE 138 Ca -0.06 -1.01 -0.15 0.00 -2.23 0.00 0.00 60.65 57.20 2k4t s ILE 138 Cb -0.09 -4.03 -0.01 0.00 -1.58 0.00 0.00 42.46 36.75 2k4t s ILE 138 CO -0.01 -0.51 0.38 -0.60 -1.23 0.00 0.00 174.94 172.96 2k4t s ARG 139 N 1.63 3.62 -0.17 2.79 3.52 0.11 0.89 118.95 131.34 2k4t s ARG 139 Ca 0.04 -0.34 0.00 0.00 -0.13 0.00 0.00 55.73 55.31 2k4t s ARG 139 Cb -0.23 -3.79 0.00 0.00 -1.56 0.00 0.00 34.95 29.38 2k4t s ARG 139 CO 0.07 -0.51 -0.16 0.20 -0.81 0.00 0.00 175.30 174.09 2k4t s GLY 140 N 1.73 1.45 -0.14 8.12 0.00 -1.06 -0.12 107.32 117.30 2k4t s GLY 140 Ca 0.13 -1.11 -0.04 0.00 0.00 0.00 0.00 44.72 43.70 2k4t s GLY 140 CO 0.12 0.13 0.08 0.00 0.00 0.00 0.00 173.10 173.42 2k4t s ALA 141 N 1.01 0.42 -0.16 3.20 0.00 -0.51 -0.02 121.76 125.71 2k4t s ALA 141 Ca -0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 51.96 51.73 2k4t s ALA 141 Cb -0.15 -0.93 0.05 0.00 0.00 0.00 0.00 23.12 22.09 2k4t s ALA 141 CO -0.04 -0.97 -0.01 -1.17 0.00 0.00 0.00 175.76 173.57 2k4t s LEU 142 N 2.12 1.26 0.10 0.00 1.98 -0.00 0.16 118.68 124.30 2k4t s LEU 142 Ca 0.03 -0.62 0.08 0.00 -2.89 0.00 0.00 54.13 50.72 2k4t s LEU 142 Cb -0.15 -0.70 -0.03 0.00 0.66 0.00 0.00 46.19 45.97 2k4t s LEU 142 CO -0.07 -0.23 -0.19 0.68 -1.89 0.00 0.00 176.35 174.64 2k4t s VAL 143 N 1.78 1.59 0.21 1.68 -7.23 -0.48 -0.04 120.40 117.92 2k4t s VAL 143 Ca 0.01 -1.53 0.04 0.00 -1.81 0.00 0.00 61.98 58.68 2k4t s VAL 143 Cb -0.15 -1.48 -0.05 0.00 0.56 0.00 0.00 36.38 35.25 2k4t s VAL 143 CO -0.07 -0.13 -0.03 -0.76 -0.31 0.00 0.00 175.10 173.80 2k4t s LEU 144 N -1.96 2.30 -0.20 1.32 1.43 0.14 -0.87 118.68 120.84 2k4t s LEU 144 Ca 0.06 -1.16 -0.02 0.00 -1.03 0.00 0.00 54.13 51.97 2k4t s LEU 144 Cb -0.09 -0.31 0.06 0.00 0.03 0.00 0.00 46.19 45.87 2k4t s LEU 144 CO 0.04 -0.45 0.03 -0.83 0.23 0.00 0.00 176.35 175.37 2k4t s GLY 145 N -3.28 0.79 -0.07 -3.19 0.00 -0.97 -1.44 107.32 99.17 2k4t s GLY 145 Ca 0.25 -0.82 0.03 0.00 0.00 0.00 0.00 44.72 44.19 2k4t s GLY 145 CO 0.07 1.37 -0.18 -0.47 0.00 0.00 0.00 173.10 173.89 2k4t s TYR 146 N 1.79 1.90 -0.97 1.90 5.04 0.65 -4.72 117.35 122.94 2k4t s TYR 146 Ca -0.01 -0.69 -0.04 0.00 -2.44 0.00 0.00 57.07 53.89 2k4t s TYR 146 Cb -0.17 -1.31 0.03 0.00 0.35 0.00 0.00 41.96 40.85 2k4t s TYR 146 CO -0.08 -0.29 0.18 0.39 -1.34 0.00 0.00 175.55 174.40 2k4t n GLU 147 N 3.52 -2.73 0.00 4.97 4.71 -1.26 0.11 120.64 129.96 2k4t n GLU 147 Ca -0.20 0.45 0.00 0.00 -0.01 0.00 0.00 57.16 57.39 2k4t n GLU 147 Cb 0.52 -5.07 0.00 0.00 -1.01 0.00 0.00 31.44 25.89 2k4t n GLU 147 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2k4t n GLY 148 N -0.89 3.14 3.85 0.62 0.00 -1.26 -5.02 105.19 105.63 2k4t n GLY 148 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 2k4t n GLY 148 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2k4t s TRP 149 N -1.75 3.44 -0.13 1.61 0.52 0.30 -4.50 118.94 118.43 2k4t s TRP 149 Ca 0.00 1.40 0.00 0.00 0.02 0.00 0.00 56.10 57.53 2k4t s TRP 149 Cb 0.00 -2.80 -0.01 0.00 -1.15 0.00 0.00 33.47 29.51 2k4t s TRP 149 CO 0.00 -0.64 -0.14 -0.51 0.02 0.00 0.00 176.95 175.68 2k4t s LEU 150 N -4.65 2.68 -0.11 2.99 1.43 0.85 -0.26 118.68 121.62 2k4t s LEU 150 Ca 0.58 -0.34 -0.09 0.00 -1.03 0.00 0.00 54.13 53.25 2k4t s LEU 150 Cb -0.11 -1.60 0.03 0.00 0.03 0.00 0.00 46.19 44.54 2k4t s LEU 150 CO 0.42 0.17 0.28 0.00 0.23 0.00 0.00 176.35 177.45 2k4t s ALA 151 N 0.32 -0.68 0.00 4.21 0.00 -0.52 -0.94 121.76 124.16 2k4t s ALA 151 Ca -0.11 0.88 0.00 0.00 0.00 0.00 0.00 51.96 52.73 2k4t s ALA 151 Cb -0.16 -0.53 0.00 0.00 0.00 0.00 0.00 23.12 22.43 2k4t s ALA 151 CO 0.06 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.07 2k4t n GLY 152 N 3.32 -1.22 3.02 0.00 0.00 0.01 0.26 105.19 110.59 2k4t n GLY 152 Ca -0.16 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 44.96 2k4t n GLY 152 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2k4t s TYR 153 N -3.00 0.36 0.02 1.61 -0.85 0.94 -1.36 117.35 115.07 2k4t s TYR 153 Ca 0.00 -0.72 0.06 0.00 -0.52 0.00 0.00 57.07 55.89 2k4t s TYR 153 Cb 0.00 -0.26 -0.02 0.00 0.38 0.00 0.00 41.96 42.06 2k4t s TYR 153 CO 0.00 -0.26 -0.18 -0.65 -1.52 0.00 0.00 175.55 172.95 2k4t s GLN 154 N -2.33 1.29 0.26 -3.49 -0.21 0.84 -0.82 119.66 115.20 2k4t s GLN 154 Ca -0.08 -0.77 0.06 0.00 0.02 0.00 0.00 55.36 54.59 2k4t s GLN 154 Cb -0.04 -1.32 -0.03 0.00 1.00 0.00 0.00 33.01 32.63 2k4t s GLN 154 CO -0.04 0.35 0.34 -1.64 -2.12 0.00 0.00 175.29 172.17 2k4t s MET 155 N -0.85 3.24 0.22 2.91 -1.94 0.97 -0.80 119.30 123.06 2k4t s MET 155 Ca 0.06 -0.89 0.05 0.00 -1.71 0.00 0.00 55.69 53.20 2k4t s MET 155 Cb -0.08 -2.79 -0.03 0.00 2.01 0.00 0.00 34.83 33.95 2k4t s MET 155 CO 0.01 0.35 0.31 1.21 -0.01 0.00 0.00 175.02 176.88 2k4t s ASN 156 N -3.98 6.13 -0.92 3.03 3.84 -1.23 -2.57 114.94 119.24 2k4t s ASN 156 Ca 0.36 0.01 -0.16 0.00 0.21 0.00 0.00 52.86 53.28 2k4t s ASN 156 Cb -0.09 -1.76 0.18 0.00 -0.55 0.00 0.00 41.25 39.04 2k4t s ASN 156 CO 0.28 -0.04 1.00 0.72 -2.79 0.00 0.00 177.10 176.27 2k4t s PHE 157 N -1.96 3.51 0.13 0.43 -0.12 0.26 -4.44 117.98 115.77 2k4t s PHE 157 Ca 0.34 -1.80 -0.31 0.00 -0.05 0.00 0.00 56.93 55.11 2k4t s PHE 157 Cb -0.09 -4.06 -0.08 0.00 -0.63 0.00 0.00 43.02 38.16 2k4t s PHE 157 CO 0.28 -1.23 1.41 -2.00 -0.05 0.00 0.00 175.22 173.63 2k4t s GLU 158 N 1.24 4.31 0.30 1.99 -6.30 -1.26 -4.15 118.70 114.82 2k4t s GLU 158 Ca 0.27 2.11 0.05 0.00 -2.50 0.00 0.00 54.97 54.90 2k4t s GLU 158 Cb -0.07 -3.23 0.69 0.00 0.00 0.00 0.00 34.13 31.52 2k4t s GLU 158 CO -0.08 -0.45 1.80 1.79 0.02 0.00 0.00 175.26 178.34 2k4t h THR 159 N 4.19 0.79 0.00 -1.70 1.35 -1.91 0.42 112.91 116.05 2k4t h THR 159 Ca -0.42 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 2k4t h THR 159 Cb 1.21 -0.12 0.00 0.00 -1.73 0.00 0.00 68.15 67.51 2k4t h THR 159 CO 0.86 0.15 0.00 0.00 -0.25 0.00 0.00 175.52 176.29 2k4t h ALA 160 N 1.60 1.00 -5.19 6.62 0.00 -1.90 -3.39 119.26 118.01 2k4t h ALA 160 Ca 0.54 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 55.08 2k4t h ALA 160 Cb 0.76 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 2k4t h ALA 160 CO -0.33 0.00 -0.54 1.17 0.00 0.00 0.00 179.25 179.55 2k4t n LYS 161 N -2.84 -3.52 0.00 0.00 4.81 0.15 -4.76 118.16 111.99 2k4t n LYS 161 Ca -0.02 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 57.96 2k4t n LYS 161 Cb 0.07 -5.26 0.00 0.00 0.02 0.00 0.00 35.03 29.86 2k4t n LYS 161 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2k4t n SER 162 N -2.28 0.08 0.00 3.14 3.41 -1.26 -5.06 113.62 111.65 2k4t n SER 162 Ca -0.04 -0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 2k4t n SER 162 Cb 0.56 0.52 0.00 0.00 -0.26 0.00 0.00 64.21 65.03 2k4t n SER 162 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2k4t n ARG 163 N -0.53 0.00 -1.84 4.33 5.12 -1.26 -5.15 116.66 117.32 2k4t n ARG 163 Ca 0.00 0.00 -0.38 0.00 -1.93 0.00 0.00 57.85 55.54 2k4t n ARG 163 Cb 0.00 0.00 0.03 0.00 -1.16 0.00 0.00 32.46 31.33 2k4t n ARG 163 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2k4t s VAL 164 N -0.72 2.21 -0.12 1.55 1.01 -1.26 -4.55 120.40 118.52 2k4t s VAL 164 Ca 0.00 0.16 0.09 0.00 0.00 0.00 0.00 61.98 62.23 2k4t s VAL 164 Cb 0.00 -3.08 -0.23 0.00 0.00 0.00 0.00 36.38 33.07 2k4t s VAL 164 CO 0.00 -0.00 0.35 0.35 0.00 0.00 0.00 175.10 175.80 2k4t n THR 165 N -0.97 1.57 -4.01 3.92 -2.24 -1.26 -4.93 114.28 106.36 2k4t n THR 165 Ca 0.10 -0.76 -0.16 0.00 -2.27 0.00 0.00 64.05 60.96 2k4t n THR 165 Cb 0.45 -1.05 -0.15 0.00 -2.10 0.00 0.00 70.33 67.48 2k4t n THR 165 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2k4t s GLN 166 N -2.55 0.33 -0.19 -0.78 1.11 -1.26 -5.11 119.66 111.21 2k4t s GLN 166 Ca -0.13 -0.03 -0.12 0.00 0.01 0.00 0.00 55.36 55.09 2k4t s GLN 166 Cb 0.07 -0.41 -0.05 0.00 -1.01 0.00 0.00 33.01 31.61 2k4t s GLN 166 CO 0.79 -0.04 0.23 -1.12 0.01 0.00 0.00 175.29 175.17 2k4t s SER 167 N 0.51 6.31 0.08 5.90 0.01 -1.26 -3.53 113.70 121.72 2k4t s SER 167 Ca -0.05 0.36 0.04 0.00 1.31 0.00 0.00 55.95 57.60 2k4t s SER 167 Cb -0.08 -2.15 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 2k4t s SER 167 CO -0.01 0.10 0.04 0.20 0.41 0.00 0.00 173.24 173.98 2k4t s ASN 168 N 0.61 5.30 0.15 2.44 0.01 0.02 -3.77 114.94 119.71 2k4t s ASN 168 Ca 0.13 -0.08 0.10 0.00 -0.71 0.00 0.00 52.86 52.29 2k4t s ASN 168 Cb -0.13 -1.36 -0.04 0.00 0.41 0.00 0.00 41.25 40.13 2k4t s ASN 168 CO 0.03 0.18 -0.17 -0.36 -1.51 0.00 0.00 177.10 175.26 2k4t s PHE 169 N -1.34 2.50 -0.04 2.20 0.08 0.91 -0.11 117.98 122.18 2k4t s PHE 169 Ca 0.27 -0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.05 2k4t s PHE 169 Cb -0.12 -1.28 0.03 0.00 -0.57 0.00 0.00 43.02 41.08 2k4t s PHE 169 CO 0.20 0.45 -0.02 0.00 -0.10 0.00 0.00 175.22 175.75 2k4t s ALA 170 N -1.42 0.51 -0.17 5.36 0.00 -0.46 -0.37 121.76 125.21 2k4t s ALA 170 Ca 0.20 0.03 -0.15 0.00 0.00 0.00 0.00 51.96 52.04 2k4t s ALA 170 Cb -0.09 -0.44 0.05 0.00 0.00 0.00 0.00 23.12 22.64 2k4t s ALA 170 CO 0.11 -0.12 0.46 0.54 0.00 0.00 0.00 175.76 176.75 2k4t s VAL 171 N 1.16 -0.00 -0.01 0.00 0.11 -0.38 -0.81 120.40 120.47 2k4t s VAL 171 Ca -0.08 0.01 -0.28 0.00 -2.93 0.00 0.00 61.98 58.70 2k4t s VAL 171 Cb -0.14 -0.65 0.10 0.00 -1.53 0.00 0.00 36.38 34.17 2k4t s VAL 171 CO -0.02 0.00 0.84 -0.83 -3.33 0.00 0.00 175.10 171.77 2k4t s GLY 172 N 0.40 -0.47 -0.01 6.54 0.00 -0.11 -1.18 107.32 112.49 2k4t s GLY 172 Ca -0.01 1.15 0.01 0.00 0.00 0.00 0.00 44.72 45.87 2k4t s GLY 172 CO -0.01 0.51 -0.03 -2.52 0.00 0.00 0.00 173.10 171.04 2k4t s TYR 173 N -2.63 0.34 0.04 1.90 1.13 0.06 -0.10 117.35 118.09 2k4t s TYR 173 Ca 0.01 -0.06 0.02 0.00 -1.41 0.00 0.00 57.07 55.63 2k4t s TYR 173 Cb -0.01 -0.24 -0.04 0.00 -1.10 0.00 0.00 41.96 40.57 2k4t s TYR 173 CO -0.06 -0.02 0.04 -1.59 -2.51 0.00 0.00 175.55 171.42 2k4t s LYS 174 N 0.01 2.82 0.08 -3.49 -2.85 -1.26 -0.24 119.74 114.81 2k4t s LYS 174 Ca 0.00 -0.65 -0.00 0.00 -1.00 0.00 0.00 55.97 54.32 2k4t s LYS 174 Cb -0.03 -2.70 -0.04 0.00 -2.06 0.00 0.00 37.83 33.00 2k4t s LYS 174 CO -0.00 0.60 -0.03 0.99 0.10 0.00 0.00 175.35 177.01 2k4t s THR 175 N -1.24 0.33 0.51 3.79 2.01 -0.99 -4.93 115.64 115.12 2k4t s THR 175 Ca 0.24 -1.86 0.26 0.00 0.31 0.00 0.00 61.69 60.65 2k4t s THR 175 Cb -0.12 -1.64 0.43 0.00 0.01 0.00 0.00 72.50 71.18 2k4t s THR 175 CO 0.16 -0.89 1.93 -2.24 -0.69 0.00 0.00 174.62 172.89 2k4t h ASP 176 N 3.06 0.08 0.00 3.53 2.03 -2.02 -3.23 116.42 119.88 2k4t h ASP 176 Ca -0.35 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 55.96 2k4t h ASP 176 Cb 1.16 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.65 2k4t h ASP 176 CO 0.65 0.04 0.00 -0.62 -1.03 0.00 0.00 179.24 178.27 2k4t n GLU 177 N -4.36 0.00 -4.18 4.15 1.02 -1.26 -5.01 120.64 111.01 2k4t n GLU 177 Ca 0.15 0.17 -0.11 0.00 -0.02 0.00 0.00 57.16 57.35 2k4t n GLU 177 Cb 0.76 -0.59 -0.10 0.00 -0.02 0.00 0.00 31.44 31.49 2k4t n GLU 177 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 2k4t s PHE 178 N -0.53 0.94 0.04 -0.32 -0.71 -1.22 -4.13 117.98 112.05 2k4t s PHE 178 Ca 0.00 -0.99 0.07 0.00 -1.04 0.00 0.00 56.93 54.98 2k4t s PHE 178 Cb 0.00 -0.55 -0.03 0.00 -1.21 0.00 0.00 43.02 41.23 2k4t s PHE 178 CO 0.00 -0.22 -0.19 1.14 -1.34 0.00 0.00 175.22 174.62 2k4t s GLN 179 N -3.88 2.07 -0.14 1.99 -2.07 0.36 -2.34 119.66 115.65 2k4t s GLN 179 Ca 0.16 -0.98 -0.01 0.00 -1.82 0.00 0.00 55.36 52.71 2k4t s GLN 179 Cb 0.06 -2.18 -0.01 0.00 -1.09 0.00 0.00 33.01 29.78 2k4t s GLN 179 CO -0.02 0.54 -0.12 -1.17 -1.32 0.00 0.00 175.29 173.20 2k4t s LEU 180 N -1.39 2.76 -0.17 2.60 1.98 0.67 -1.44 118.68 123.69 2k4t s LEU 180 Ca 0.14 -0.33 0.00 0.00 -2.89 0.00 0.00 54.13 51.05 2k4t s LEU 180 Cb -0.10 -1.63 0.04 0.00 0.66 0.00 0.00 46.19 45.15 2k4t s LEU 180 CO 0.05 0.14 -0.09 -2.28 -1.89 0.00 0.00 176.35 172.28 2k4t s HIS 181 N 0.52 1.99 0.03 5.38 5.65 -0.48 -0.76 115.29 127.63 2k4t s HIS 181 Ca -0.08 -1.22 0.04 0.00 0.25 0.00 0.00 55.06 54.05 2k4t s HIS 181 Cb -0.15 -1.46 -0.02 0.00 -1.18 0.00 0.00 32.58 29.76 2k4t s HIS 181 CO 0.04 -0.65 -0.13 -0.08 -0.65 0.00 0.00 174.74 173.27 2k4t s THR 182 N 1.54 1.01 -0.02 0.89 -1.32 -0.32 -0.36 115.64 117.06 2k4t s THR 182 Ca 0.02 -0.92 -0.07 0.00 -1.21 0.00 0.00 61.69 59.51 2k4t s THR 182 Cb -0.15 -0.92 0.01 0.00 -1.51 0.00 0.00 72.50 69.93 2k4t s THR 182 CO -0.09 0.00 0.14 0.54 -2.21 0.00 0.00 174.62 173.01 2k4t s ASN 183 N -1.04 -0.03 -0.14 8.08 4.22 -0.31 -1.25 114.94 124.47 2k4t s ASN 183 Ca 0.01 -0.05 -0.02 0.00 -2.14 0.00 0.00 52.86 50.66 2k4t s ASN 183 Cb -0.07 0.24 -0.02 0.00 1.28 0.00 0.00 41.25 42.67 2k4t s ASN 183 CO 0.01 -0.27 -0.07 -0.69 -2.04 0.00 0.00 177.10 174.04 2k4t s VAL 184 N -0.94 3.61 -0.12 3.54 1.01 0.50 -1.27 120.40 126.73 2k4t s VAL 184 Ca -0.10 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.44 2k4t s VAL 184 Cb -0.06 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2k4t s VAL 184 CO 0.01 0.51 -0.21 0.21 0.00 0.00 0.00 175.10 175.63 2k4t s ASN 185 N 0.23 3.28 -1.88 3.32 3.84 0.32 -0.06 114.94 123.99 2k4t s ASN 185 Ca -0.05 -0.54 0.00 0.00 0.21 0.00 0.00 52.86 52.49 2k4t s ASN 185 Cb -0.14 -1.47 0.00 0.00 -0.55 0.00 0.00 41.25 39.09 2k4t s ASN 185 CO 0.04 0.12 0.00 0.47 -2.79 0.00 0.00 177.10 174.94 2k4t n ASP 186 N 3.78 -5.11 -2.03 -4.21 8.00 -1.25 -0.59 116.55 115.14 2k4t n ASP 186 Ca -0.19 0.33 -0.13 0.00 0.71 0.00 0.00 54.79 55.52 2k4t n ASP 186 Cb 0.52 -4.46 -0.02 0.00 -0.02 0.00 0.00 41.12 37.13 2k4t n ASP 186 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2k4t n GLY 187 N -0.54 0.15 0.50 0.44 0.00 -1.26 -4.61 105.19 99.87 2k4t n GLY 187 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2k4t n GLY 187 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2k4t n THR 188 N -2.82 0.00 -2.87 2.61 -2.24 -0.67 -5.04 114.28 103.25 2k4t n THR 188 Ca -0.14 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.21 2k4t n THR 188 Cb 0.54 -0.12 -0.04 0.00 -2.10 0.00 0.00 70.33 68.60 2k4t n THR 188 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2k4t s GLU 189 N -1.25 3.46 -0.23 -0.78 8.01 0.24 -3.31 118.70 124.84 2k4t s GLU 189 Ca 0.00 0.01 -0.11 0.00 0.01 0.00 0.00 54.97 54.88 2k4t s GLU 189 Cb 0.00 -3.95 -0.05 0.00 -4.31 0.00 0.00 34.13 25.82 2k4t s GLU 189 CO 0.00 -1.23 0.19 0.12 0.01 0.00 0.00 175.26 174.35 2k4t s PHE 190 N 3.64 3.34 -0.03 1.61 2.19 0.94 -0.52 117.98 129.15 2k4t s PHE 190 Ca 0.34 0.31 0.07 0.00 0.33 0.00 0.00 56.93 57.98 2k4t s PHE 190 Cb -0.11 -2.29 -0.02 0.00 -1.31 0.00 0.00 43.02 39.29 2k4t s PHE 190 CO 0.24 0.09 -0.24 0.20 1.83 0.00 0.00 175.22 177.35 2k4t s GLY 191 N 0.94 1.18 -0.01 13.12 0.00 -0.40 -0.05 107.32 122.10 2k4t s GLY 191 Ca 0.10 -1.02 -0.03 0.00 0.00 0.00 0.00 44.72 43.77 2k4t s GLY 191 CO 0.04 -0.80 0.06 -0.32 0.00 0.00 0.00 173.10 172.08 2k4t s GLY 192 N -0.47 0.03 -0.04 0.20 0.00 -0.44 -1.16 107.32 105.44 2k4t s GLY 192 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 44.72 44.72 2k4t s GLY 192 CO -0.00 -0.09 0.11 -0.56 0.00 0.00 0.00 173.10 172.56 2k4t s SER 193 N -0.53 -0.10 -0.17 1.64 0.01 0.52 -0.67 113.70 114.39 2k4t s SER 193 Ca -0.06 0.22 -0.02 0.00 1.31 0.00 0.00 55.95 57.40 2k4t s SER 193 Cb -0.04 0.19 -0.01 0.00 0.21 0.00 0.00 66.02 66.37 2k4t s SER 193 CO 0.00 -0.07 -0.09 -0.63 0.41 0.00 0.00 173.24 172.86 2k4t s ILE 194 N 0.36 3.21 -0.26 1.44 -1.09 0.89 -1.38 121.20 124.37 2k4t s ILE 194 Ca -0.03 -0.58 -0.01 0.00 -2.23 0.00 0.00 60.65 57.81 2k4t s ILE 194 Cb -0.04 -2.40 0.04 0.00 -1.58 0.00 0.00 42.46 38.48 2k4t s ILE 194 CO -0.01 0.49 -0.07 -0.31 -1.23 0.00 0.00 174.94 173.80 2k4t s TYR 195 N 0.81 3.12 -0.02 3.97 1.51 -0.52 -0.65 117.35 125.58 2k4t s TYR 195 Ca -0.03 -1.76 0.02 0.00 -1.01 0.00 0.00 57.07 54.29 2k4t s TYR 195 Cb -0.15 -2.04 0.00 0.00 -0.11 0.00 0.00 41.96 39.67 2k4t s TYR 195 CO 0.01 -0.78 -0.08 -1.14 -1.11 0.00 0.00 175.55 172.46 2k4t s GLN 196 N 1.27 0.75 -0.41 -0.62 0.74 -0.46 -0.48 119.66 120.44 2k4t s GLN 196 Ca -0.02 -0.26 -0.07 0.00 0.05 0.00 0.00 55.36 55.06 2k4t s GLN 196 Cb -0.18 -0.72 0.09 0.00 1.10 0.00 0.00 33.01 33.30 2k4t s GLN 196 CO -0.04 0.12 0.24 -1.59 -0.55 0.00 0.00 175.29 173.46 2k4t s LYS 197 N 0.08 2.42 0.54 1.67 -2.85 -1.26 -0.34 119.74 120.01 2k4t s LYS 197 Ca -0.01 -1.58 0.30 0.00 -1.00 0.00 0.00 55.97 53.69 2k4t s LYS 197 Cb -0.06 -3.70 1.47 0.00 -2.06 0.00 0.00 37.83 33.47 2k4t s LYS 197 CO -0.00 -0.99 1.91 0.28 0.10 0.00 0.00 175.35 176.65 2k4t h VAL 198 N 6.19 0.56 -1.01 1.79 2.07 -1.92 -3.46 116.25 120.48 2k4t h VAL 198 Ca -0.20 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2k4t h VAL 198 Cb 1.07 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2k4t h VAL 198 CO 0.74 0.00 0.00 -3.20 0.02 0.00 0.00 177.57 175.13 2k4t n ASN 199 N -4.23 0.00 -0.24 0.57 2.85 -1.16 -4.99 115.26 108.07 2k4t n ASN 199 Ca 0.16 -0.93 0.11 0.00 -0.11 0.00 0.00 54.58 53.80 2k4t n ASN 199 Cb 0.87 0.00 0.52 0.00 1.24 0.00 0.00 39.78 42.41 2k4t n ASN 199 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 2k4t n LYS 200 N 0.00 1.32 -0.05 1.20 2.85 -1.26 -3.42 118.16 118.80 2k4t n LYS 200 Ca 0.00 -0.48 -0.06 0.00 -1.05 0.00 0.00 58.31 56.72 2k4t n LYS 200 Cb 0.00 -1.36 -0.14 0.00 -0.65 0.00 0.00 35.03 32.88 2k4t n LYS 200 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2k4t n LYS 201 N -0.33 0.66 -3.73 -1.58 5.02 -1.23 -4.36 118.16 112.61 2k4t n LYS 201 Ca 0.16 0.10 -0.04 0.00 -2.02 0.00 0.00 58.31 56.51 2k4t n LYS 201 Cb 0.19 -1.64 -0.01 0.00 -0.02 0.00 0.00 35.03 33.54 2k4t n LYS 201 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2k4t s LEU 202 N -5.62 -0.19 -0.07 -0.35 0.05 -1.22 -1.36 118.68 109.92 2k4t s LEU 202 Ca -0.07 -0.37 -0.09 0.00 0.05 0.00 0.00 54.13 53.65 2k4t s LEU 202 Cb 0.08 2.15 0.02 0.00 -2.05 0.00 0.00 46.19 46.39 2k4t s LEU 202 CO 0.83 -0.88 0.23 -1.61 -0.55 0.00 0.00 176.35 174.37 2k4t s GLU 203 N -3.27 0.33 -0.02 1.48 2.02 0.88 -2.99 118.70 117.14 2k4t s GLU 203 Ca 0.12 0.18 0.01 0.00 0.02 0.00 0.00 54.97 55.30 2k4t s GLU 203 Cb -0.01 0.16 -0.03 0.00 0.10 0.00 0.00 34.13 34.34 2k4t s GLU 203 CO 0.01 -0.06 -0.02 0.99 0.02 0.00 0.00 175.26 176.21 2k4t s THR 204 N -0.20 4.05 -0.01 3.63 2.01 0.54 -1.48 115.64 124.18 2k4t s THR 204 Ca -0.03 -0.58 -0.00 0.00 0.31 0.00 0.00 61.69 61.38 2k4t s THR 204 Cb -0.03 -2.78 0.01 0.00 0.01 0.00 0.00 72.50 69.72 2k4t s THR 204 CO 0.01 0.42 0.03 0.00 -0.69 0.00 0.00 174.62 174.39 2k4t s ALA 205 N -1.03 -0.01 -0.03 7.40 0.00 0.73 -1.36 121.76 127.48 2k4t s ALA 205 Ca 0.18 0.17 0.06 0.00 0.00 0.00 0.00 51.96 52.37 2k4t s ALA 205 Cb -0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.86 2k4t s ALA 205 CO 0.08 -0.05 -0.21 0.54 0.00 0.00 0.00 175.76 176.12 2k4t s VAL 206 N 0.46 1.65 -0.02 0.00 0.11 0.17 -0.72 120.40 122.05 2k4t s VAL 206 Ca -0.04 -0.87 0.02 0.00 -2.93 0.00 0.00 61.98 58.16 2k4t s VAL 206 Cb -0.05 -1.38 0.00 0.00 -1.53 0.00 0.00 36.38 33.42 2k4t s VAL 206 CO -0.01 0.47 -0.08 0.54 -3.33 0.00 0.00 175.10 172.68 2k4t s ASN 207 N -0.33 1.07 -0.01 3.54 2.20 -0.46 -0.08 114.94 120.88 2k4t s ASN 207 Ca 0.04 -0.16 0.00 0.00 -0.94 0.00 0.00 52.86 51.80 2k4t s ASN 207 Cb -0.09 -0.27 0.01 0.00 -2.00 0.00 0.00 41.25 38.90 2k4t s ASN 207 CO 0.00 0.06 0.01 -1.48 -2.94 0.00 0.00 177.10 172.75 2k4t s LEU 208 N 0.16 1.56 -0.22 3.54 2.34 0.15 -0.10 118.68 126.11 2k4t s LEU 208 Ca -0.02 0.01 0.00 0.00 0.06 0.00 0.00 54.13 54.18 2k4t s LEU 208 Cb -0.07 -0.06 0.03 0.00 -0.56 0.00 0.00 46.19 45.52 2k4t s LEU 208 CO 0.00 -0.06 -0.13 0.00 -1.06 0.00 0.00 176.35 175.11 2k4t s ALA 209 N 0.51 2.53 -0.28 1.48 0.00 0.85 -1.33 121.76 125.53 2k4t s ALA 209 Ca -0.04 -1.39 -0.08 0.00 0.00 0.00 0.00 51.96 50.44 2k4t s ALA 209 Cb -0.06 -1.46 -0.02 0.00 0.00 0.00 0.00 23.12 21.57 2k4t s ALA 209 CO -0.01 -0.66 0.11 -0.46 0.00 0.00 0.00 175.76 174.74 2k4t s TRP 210 N 1.28 3.14 -0.28 0.00 -0.11 0.93 -1.31 118.94 122.59 2k4t s TRP 210 Ca 0.01 -0.48 -0.07 0.00 1.22 0.00 0.00 56.10 56.78 2k4t s TRP 210 Cb -0.16 -2.30 0.00 0.00 -1.50 0.00 0.00 33.47 29.52 2k4t s TRP 210 CO -0.08 -0.40 0.07 0.95 -4.62 0.00 0.00 176.95 172.88 2k4t s THR 211 N 1.62 3.99 0.54 5.86 -4.23 -1.26 -0.04 115.64 122.11 2k4t s THR 211 Ca 0.05 -0.60 0.21 0.00 -1.18 0.00 0.00 61.69 60.18 2k4t s THR 211 Cb -0.16 -3.02 0.32 0.00 1.34 0.00 0.00 72.50 70.98 2k4t s THR 211 CO 0.05 0.14 2.11 0.00 -0.54 0.00 0.00 174.62 176.38 2k4t h ALA 212 N 8.23 2.08 -3.00 3.99 0.00 -1.94 -3.31 119.26 125.31 2k4t h ALA 212 Ca -0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2k4t h ALA 212 Cb 1.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2k4t h ALA 212 CO 0.60 -0.21 0.00 0.41 0.00 0.00 0.00 179.25 180.05 2k4t n GLY 213 N -1.54 -1.87 3.00 0.00 0.00 -1.26 -4.86 105.19 98.66 2k4t n GLY 213 Ca 0.01 0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.92 2k4t n GLY 213 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k4t n ASN 214 N -0.14 1.15 -1.86 1.61 3.02 -1.25 -5.00 115.26 112.80 2k4t n ASN 214 Ca 0.00 -1.93 -0.11 0.00 -0.03 0.00 0.00 54.58 52.51 2k4t n ASN 214 Cb 0.00 -0.47 0.21 0.00 -0.61 0.00 0.00 39.78 38.91 2k4t n ASN 214 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2k4t n SER 215 N -2.85 4.02 -4.60 6.41 3.41 -1.26 -4.69 113.62 114.06 2k4t n SER 215 Ca 0.13 -3.11 -0.38 0.00 -0.26 0.00 0.00 58.87 55.25 2k4t n SER 215 Cb 0.46 -0.73 -0.11 0.00 -0.26 0.00 0.00 64.21 63.57 2k4t n SER 215 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2k4t s ASN 216 N -0.77 6.03 -0.06 4.04 0.01 -1.26 -5.08 114.94 117.85 2k4t s ASN 216 Ca 0.45 0.01 -0.02 0.00 -0.71 0.00 0.00 52.86 52.59 2k4t s ASN 216 Cb 0.37 -2.12 -0.04 0.00 0.41 0.00 0.00 41.25 39.88 2k4t s ASN 216 CO 0.10 -0.03 0.04 -0.89 -1.51 0.00 0.00 177.10 174.81 2k4t s THR 217 N 1.63 4.53 -0.67 1.60 2.01 -1.26 -4.30 115.64 119.18 2k4t s THR 217 Ca 0.07 -0.27 -0.09 0.00 0.31 0.00 0.00 61.69 61.71 2k4t s THR 217 Cb -0.16 -2.97 0.17 0.00 0.01 0.00 0.00 72.50 69.56 2k4t s THR 217 CO 0.10 0.52 0.55 -0.60 -0.69 0.00 0.00 174.62 174.50 2k4t s ARG 218 N -1.18 2.97 0.38 4.92 3.52 -0.42 -4.93 118.95 124.21 2k4t s ARG 218 Ca 0.16 -2.32 0.02 0.00 -0.13 0.00 0.00 55.73 53.46 2k4t s ARG 218 Cb -0.12 -4.07 -0.02 0.00 -1.56 0.00 0.00 34.95 29.19 2k4t s ARG 218 CO 0.06 -1.23 0.57 0.12 -0.81 0.00 0.00 175.30 174.01 2k4t s PHE 219 N 0.38 3.31 -0.10 5.12 5.36 -1.26 -0.10 117.98 130.69 2k4t s PHE 219 Ca 0.14 0.18 -0.30 0.00 -0.96 0.00 0.00 56.93 55.99 2k4t s PHE 219 Cb -0.18 -2.06 0.10 0.00 -0.34 0.00 0.00 43.02 40.54 2k4t s PHE 219 CO -0.05 -0.08 0.86 0.20 -1.46 0.00 0.00 175.22 174.69 2k4t s GLY 220 N -4.13 -0.41 -0.06 13.12 0.00 0.86 -0.08 107.32 116.62 2k4t s GLY 220 Ca 0.44 1.65 0.03 0.00 0.00 0.00 0.00 44.72 46.84 2k4t s GLY 220 CO 0.35 0.93 -0.13 -0.26 0.00 0.00 0.00 173.10 173.99 2k4t s ILE 221 N -1.36 1.18 -0.09 0.90 -5.25 0.89 -1.35 121.20 116.11 2k4t s ILE 221 Ca -0.05 -0.52 0.02 0.00 -0.99 0.00 0.00 60.65 59.12 2k4t s ILE 221 Cb -0.00 -1.06 0.01 0.00 2.95 0.00 0.00 42.46 44.35 2k4t s ILE 221 CO 0.03 0.36 -0.16 0.00 -1.79 0.00 0.00 174.94 173.39 2k4t s ALA 222 N 0.54 1.61 -0.11 2.27 0.00 0.10 -0.67 121.76 125.50 2k4t s ALA 222 Ca -0.13 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.19 2k4t s ALA 222 Cb -0.15 -0.72 0.02 0.00 0.00 0.00 0.00 23.12 22.27 2k4t s ALA 222 CO 0.03 0.08 -0.11 0.00 0.00 0.00 0.00 175.76 175.77 2k4t s ALA 223 N 0.72 1.43 -0.24 0.00 0.00 -0.28 -0.19 121.76 123.20 2k4t s ALA 223 Ca -0.12 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.27 2k4t s ALA 223 Cb -0.16 -0.83 0.05 0.00 0.00 0.00 0.00 23.12 22.17 2k4t s ALA 223 CO 0.03 -0.24 -0.13 0.21 0.00 0.00 0.00 175.76 175.64 2k4t s LYS 224 N 1.32 2.46 -0.49 0.00 2.20 -0.55 -0.77 119.74 123.92 2k4t s LYS 224 Ca -0.01 -1.20 -0.15 0.00 -0.36 0.00 0.00 55.97 54.25 2k4t s LYS 224 Cb -0.14 -2.82 0.09 0.00 -1.51 0.00 0.00 37.83 33.45 2k4t s LYS 224 CO -0.05 -0.47 0.42 0.71 -0.36 0.00 0.00 175.35 175.60 2k4t s TYR 225 N 1.16 3.26 -0.12 4.03 1.51 0.10 -0.09 117.35 127.21 2k4t s TYR 225 Ca -0.05 -1.12 0.00 0.00 -1.01 0.00 0.00 57.07 54.89 2k4t s TYR 225 Cb -0.18 -3.37 -0.02 0.00 -0.11 0.00 0.00 41.96 38.28 2k4t s TYR 225 CO -0.07 -0.88 -0.13 1.14 -1.11 0.00 0.00 175.55 174.51 2k4t s GLN 226 N 1.60 3.28 0.00 -0.62 -2.07 -0.46 -1.48 119.66 119.91 2k4t s GLN 226 Ca 0.04 -0.68 0.00 0.00 -1.82 0.00 0.00 55.36 52.90 2k4t s GLN 226 Cb -0.26 -2.61 0.00 0.00 -1.09 0.00 0.00 33.01 29.05 2k4t s GLN 226 CO 0.05 0.28 0.00 1.51 -1.32 0.00 0.00 175.29 175.81 2k4t n ILE 227 N 3.34 0.00 -3.69 3.63 3.06 -1.26 -3.53 119.36 120.91 2k4t n ILE 227 Ca -0.18 0.00 -0.11 0.00 -2.50 0.00 0.00 62.75 59.96 2k4t n ILE 227 Cb 0.53 -0.66 -0.06 0.00 0.54 0.00 0.00 39.64 39.99 2k4t n ILE 227 CO 0.00 0.00 0.00 1.51 -2.50 0.00 0.00 176.55 175.56 2k4t s ASP 228 N -4.23 -0.17 0.00 9.51 1.47 -1.22 -5.01 116.67 117.02 2k4t s ASP 228 Ca 0.00 -0.29 0.15 0.00 1.18 0.00 0.00 52.55 53.58 2k4t s ASP 228 Cb 0.00 0.43 0.68 0.00 -0.34 0.00 0.00 42.92 43.69 2k4t s ASP 228 CO 0.00 -0.76 1.43 -0.81 0.68 0.00 0.00 175.17 175.71 2k4t n PRO 229 N 0.05 0.11 -0.03 2.11 -0.04 -1.26 -2.47 135.00 133.47 2k4t n PRO 229 Ca -0.17 0.20 -0.12 0.00 -0.04 0.00 0.00 63.50 63.37 2k4t n PRO 229 Cb 0.62 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.44 2k4t n PRO 229 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2k4t n ASP 230 N -1.39 1.09 -3.65 3.54 2.03 -1.26 -4.87 116.55 112.04 2k4t n ASP 230 Ca 0.05 0.30 -0.20 0.00 0.52 0.00 0.00 54.79 55.47 2k4t n ASP 230 Cb 0.14 -0.13 -0.17 0.00 -0.72 0.00 0.00 41.12 40.24 2k4t n ASP 230 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k4t s ALA 231 N -2.57 0.12 0.03 -1.67 0.00 -1.03 -2.73 121.76 113.91 2k4t s ALA 231 Ca -0.10 0.23 0.04 0.00 0.00 0.00 0.00 51.96 52.13 2k4t s ALA 231 Cb 0.07 -0.76 -0.02 0.00 0.00 0.00 0.00 23.12 22.41 2k4t s ALA 231 CO 0.81 -0.63 -0.12 0.00 0.00 0.00 0.00 175.76 175.81 2k4t s PHE 233 N -0.86 0.61 -0.00 0.00 0.40 -0.55 -0.76 117.98 116.81 2k4t s PHE 233 Ca -0.01 -0.60 0.03 0.00 -0.60 0.00 0.00 56.93 55.76 2k4t s PHE 233 Cb -0.08 -0.87 -0.01 0.00 0.51 0.00 0.00 43.02 42.58 2k4t s PHE 233 CO 0.01 -0.57 -0.10 -1.54 0.70 0.00 0.00 175.22 173.72 2k4t s SER 234 N 2.00 1.19 -0.19 1.36 1.04 -0.09 0.03 113.70 119.05 2k4t s SER 234 Ca 0.01 -0.22 -0.16 0.00 0.48 0.00 0.00 55.95 56.05 2k4t s SER 234 Cb -0.17 -0.12 0.05 0.00 0.10 0.00 0.00 66.02 65.89 2k4t s SER 234 CO -0.09 0.10 0.49 0.00 0.98 0.00 0.00 173.24 174.72 2k4t s ALA 235 N -0.34 -1.22 0.00 5.32 0.00 0.05 -0.05 121.76 125.51 2k4t s ALA 235 Ca 0.03 1.43 0.01 0.00 0.00 0.00 0.00 51.96 53.43 2k4t s ALA 235 Cb -0.04 -0.84 -0.01 0.00 0.00 0.00 0.00 23.12 22.23 2k4t s ALA 235 CO -0.00 -0.24 -0.03 -1.59 0.00 0.00 0.00 175.76 173.90 2k4t s LYS 236 N 0.39 0.23 0.05 0.00 -2.85 0.51 -1.12 119.74 116.96 2k4t s LYS 236 Ca -0.01 -0.20 -0.04 0.00 -1.00 0.00 0.00 55.97 54.72 2k4t s LYS 236 Cb -0.04 -0.16 -0.02 0.00 -2.06 0.00 0.00 37.83 35.55 2k4t s LYS 236 CO -0.01 0.04 0.06 0.14 0.10 0.00 0.00 175.35 175.68 2k4t s VAL 237 N -0.31 0.17 0.12 1.79 -7.23 0.16 -0.13 120.40 114.97 2k4t s VAL 237 Ca -0.02 -1.37 -0.00 0.00 -1.81 0.00 0.00 61.98 58.78 2k4t s VAL 237 Cb -0.03 -1.19 0.03 0.00 0.56 0.00 0.00 36.38 35.75 2k4t s VAL 237 CO -0.00 -0.76 0.17 0.59 -0.31 0.00 0.00 175.10 174.79 2k4t n ASN 238 N 0.39 0.20 -3.58 4.85 3.02 0.96 -0.08 115.26 121.02 2k4t n ASN 238 Ca -0.17 -1.17 -0.41 0.00 -0.03 0.00 0.00 54.58 52.80 2k4t n ASN 238 Cb 0.60 -0.11 -0.05 0.00 -0.61 0.00 0.00 39.78 39.61 2k4t n ASN 238 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2k4t n ASN 239 N -3.00 2.76 -1.03 6.41 5.15 0.88 -4.03 115.26 122.39 2k4t n ASN 239 Ca 0.03 -2.64 -0.13 0.00 -0.60 0.00 0.00 54.58 51.23 2k4t n ASN 239 Cb 0.10 -1.12 -0.06 0.00 -0.53 0.00 0.00 39.78 38.17 2k4t n ASN 239 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2k4t n SER 240 N 7.13 -5.47 -0.11 1.20 7.64 -1.26 -4.81 113.62 117.93 2k4t n SER 240 Ca 0.49 0.33 -0.18 0.00 1.01 0.00 0.00 58.87 60.52 2k4t n SER 240 Cb 0.38 -4.15 -0.12 0.00 -1.01 0.00 0.00 64.21 59.30 2k4t n SER 240 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2k4t n SER 241 N -1.07 1.91 -3.82 6.43 7.64 -1.26 -4.90 113.62 118.55 2k4t n SER 241 Ca -0.13 -0.10 -0.11 0.00 1.01 0.00 0.00 58.87 59.54 2k4t n SER 241 Cb 0.58 -0.40 -0.08 0.00 -1.01 0.00 0.00 64.21 63.30 2k4t n SER 241 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2k4t s LEU 242 N -6.53 1.25 -0.04 -3.43 2.96 -1.26 -3.73 118.68 107.90 2k4t s LEU 242 Ca -0.33 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.33 2k4t s LEU 242 Cb 0.09 1.02 0.02 0.00 0.50 0.00 0.00 46.19 47.82 2k4t s LEU 242 CO 0.63 -0.53 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.44 2k4t s ILE 243 N -2.27 0.57 0.01 6.68 1.09 0.93 -0.03 121.20 128.19 2k4t s ILE 243 Ca -0.07 -0.17 0.01 0.00 -1.10 0.00 0.00 60.65 59.31 2k4t s ILE 243 Cb -0.02 -0.57 -0.01 0.00 -1.06 0.00 0.00 42.46 40.79 2k4t s ILE 243 CO -0.02 0.22 -0.04 -0.83 -0.10 0.00 0.00 174.94 174.17 2k4t s GLY 244 N 0.71 0.23 0.11 6.18 0.00 0.82 0.31 107.32 115.67 2k4t s GLY 244 Ca -0.10 -0.34 -0.06 0.00 0.00 0.00 0.00 44.72 44.22 2k4t s GLY 244 CO 0.00 -0.35 0.15 1.08 0.00 0.00 0.00 173.10 173.98 2k4t s LEU 245 N -0.64 1.57 -0.30 0.66 1.02 -0.24 -0.36 118.68 120.40 2k4t s LEU 245 Ca -0.04 -0.87 -0.17 0.00 0.02 0.00 0.00 54.13 53.07 2k4t s LEU 245 Cb -0.05 0.79 0.19 0.00 0.02 0.00 0.00 46.19 47.14 2k4t s LEU 245 CO -0.00 -0.75 1.17 -0.83 0.02 0.00 0.00 176.35 175.96 2k4t s GLY 246 N -2.93 0.34 0.02 -3.19 0.00 0.92 -1.21 107.32 101.28 2k4t s GLY 246 Ca 0.12 3.57 0.02 0.00 0.00 0.00 0.00 44.72 48.42 2k4t s GLY 246 CO -0.06 2.90 -0.06 -2.52 0.00 0.00 0.00 173.10 173.36 2k4t s TYR 247 N 1.45 0.49 -0.12 1.90 1.13 0.83 -0.91 117.35 122.12 2k4t s TYR 247 Ca -0.06 -0.32 -0.01 0.00 -1.41 0.00 0.00 57.07 55.27 2k4t s TYR 247 Cb -0.03 -0.31 -0.02 0.00 -1.10 0.00 0.00 41.96 40.50 2k4t s TYR 247 CO -0.13 -0.06 -0.08 0.95 -2.51 0.00 0.00 175.55 173.71 2k4t s THR 248 N -0.85 3.51 0.05 -3.49 -4.23 0.06 -0.09 115.64 110.60 2k4t s THR 248 Ca -0.06 -0.51 0.03 0.00 -1.18 0.00 0.00 61.69 59.97 2k4t s THR 248 Cb -0.06 -2.48 -0.02 0.00 1.34 0.00 0.00 72.50 71.27 2k4t s THR 248 CO -0.00 0.54 -0.09 -1.10 -0.54 0.00 0.00 174.62 173.42 2k4t s GLN 249 N -0.01 0.59 0.70 3.99 -0.21 0.86 -1.31 119.66 124.27 2k4t s GLN 249 Ca -0.01 -0.79 -0.05 0.00 0.02 0.00 0.00 55.36 54.52 2k4t s GLN 249 Cb -0.14 -0.41 0.08 0.00 1.00 0.00 0.00 33.01 33.54 2k4t s GLN 249 CO 0.03 0.08 1.00 -0.08 -2.12 0.00 0.00 175.29 174.20 2k4t s THR 250 N -1.34 2.30 -0.08 -0.19 -1.32 -1.10 -0.08 115.64 113.82 2k4t s THR 250 Ca -0.08 -0.37 -0.02 0.00 -1.21 0.00 0.00 61.69 60.01 2k4t s THR 250 Cb -0.10 -2.92 -0.04 0.00 -1.51 0.00 0.00 72.50 67.93 2k4t s THR 250 CO 0.01 0.00 -0.08 -0.11 -2.21 0.00 0.00 174.62 172.23 2k4t n LEU 251 N -2.88 1.87 0.00 9.08 7.94 -1.26 -4.81 117.00 126.94 2k4t n LEU 251 Ca 0.10 0.02 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 2k4t n LEU 251 Cb 0.60 -0.25 0.00 0.00 0.53 0.00 0.00 43.42 44.31 2k4t n LEU 251 CO 0.49 0.41 0.00 1.17 -1.11 0.00 0.00 177.39 178.35 2k4t n LYS 252 N -3.01 0.00 -0.09 1.96 4.81 -1.26 -5.16 118.16 115.41 2k4t n LYS 252 Ca -0.14 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.27 2k4t n LYS 252 Cb 0.63 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.70 2k4t n LYS 252 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2k4t n PRO 253 N 0.00 -1.22 -0.08 1.64 -0.04 -1.26 -4.95 135.00 129.10 2k4t n PRO 253 Ca 0.00 -0.16 -0.09 0.00 -0.04 0.00 0.00 63.50 63.21 2k4t n PRO 253 Cb 0.00 -0.15 -0.02 0.00 -0.04 0.00 0.00 33.50 33.30 2k4t n PRO 253 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2k4t h GLY 254 N -0.71 0.40 -1.30 0.55 0.00 -2.05 -3.44 103.07 96.52 2k4t h GLY 254 Ca -0.04 -0.14 -0.40 0.00 0.00 0.00 0.00 47.33 46.75 2k4t h GLY 254 CO 0.02 0.13 -0.73 0.29 0.00 0.00 0.00 176.54 176.26 2k4t n ILE 255 N -4.90 0.00 -3.99 2.60 -5.35 -1.26 -5.03 119.36 101.42 2k4t n ILE 255 Ca -0.02 -0.26 -0.09 0.00 -0.27 0.00 0.00 62.75 62.11 2k4t n ILE 255 Cb 0.03 -0.68 -0.06 0.00 -1.74 0.00 0.00 39.64 37.20 2k4t n ILE 255 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 2k4t s LYS 256 N -3.73 1.44 0.10 6.28 -2.85 -1.26 -4.44 119.74 115.28 2k4t s LYS 256 Ca 0.56 -1.25 0.09 0.00 -1.00 0.00 0.00 55.97 54.36 2k4t s LYS 256 Cb -0.13 0.44 -0.04 0.00 -2.06 0.00 0.00 37.83 36.05 2k4t s LYS 256 CO 0.60 -0.58 -0.19 -0.51 0.10 0.00 0.00 175.35 174.76 2k4t s LEU 257 N -3.01 2.61 -0.31 2.77 1.43 0.89 -4.27 118.68 118.78 2k4t s LEU 257 Ca 0.22 -0.55 0.02 0.00 -1.03 0.00 0.00 54.13 52.80 2k4t s LEU 257 Cb 0.01 -1.49 0.09 0.00 0.03 0.00 0.00 46.19 44.83 2k4t s LEU 257 CO 0.07 0.20 0.03 -0.89 0.23 0.00 0.00 176.35 175.99 2k4t s THR 258 N -1.06 1.88 0.05 5.49 2.01 -0.46 -0.10 115.64 123.44 2k4t s THR 258 Ca 0.16 -1.91 -0.19 0.00 0.31 0.00 0.00 61.69 60.06 2k4t s THR 258 Cb -0.10 -2.31 -0.06 0.00 0.01 0.00 0.00 72.50 70.04 2k4t s THR 258 CO 0.08 -0.47 0.55 -0.22 -0.69 0.00 0.00 174.62 173.87 2k4t s LEU 259 N 1.14 4.50 -0.00 4.42 0.20 0.87 0.02 118.68 129.84 2k4t s LEU 259 Ca 0.06 1.20 0.00 0.00 0.69 0.00 0.00 54.13 56.08 2k4t s LEU 259 Cb -0.19 -2.86 0.00 0.00 -0.43 0.00 0.00 46.19 42.71 2k4t s LEU 259 CO -0.11 0.25 0.00 -0.94 -0.29 0.00 0.00 176.35 175.26 2k4t s SER 260 N -0.92 0.01 0.00 3.68 1.04 -0.13 -0.12 113.70 117.26 2k4t s SER 260 Ca 0.29 0.00 0.02 0.00 0.48 0.00 0.00 55.95 56.74 2k4t s SER 260 Cb -0.19 -0.01 -0.01 0.00 0.10 0.00 0.00 66.02 65.92 2k4t s SER 260 CO 0.18 -0.01 -0.07 0.00 0.98 0.00 0.00 173.24 174.32 2k4t s ALA 261 N 0.07 0.56 -0.12 5.32 0.00 -0.35 -0.70 121.76 126.55 2k4t s ALA 261 Ca -0.01 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.65 2k4t s ALA 261 Cb -0.01 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.99 2k4t s ALA 261 CO -0.00 0.12 -0.23 -1.17 0.00 0.00 0.00 175.76 174.48 2k4t s LEU 262 N -0.30 2.10 -0.37 0.00 1.98 0.85 -1.08 118.68 121.86 2k4t s LEU 262 Ca 0.01 -0.59 0.03 0.00 -2.89 0.00 0.00 54.13 50.70 2k4t s LEU 262 Cb -0.03 -1.43 0.11 0.00 0.66 0.00 0.00 46.19 45.50 2k4t s LEU 262 CO -0.00 0.11 0.11 -0.76 -1.89 0.00 0.00 176.35 173.92 2k4t s LEU 263 N 0.63 4.17 -0.47 -0.68 2.01 0.15 -1.09 118.68 123.39 2k4t s LEU 263 Ca -0.12 -2.27 -0.24 0.00 0.01 0.00 0.00 54.13 51.52 2k4t s LEU 263 Cb -0.16 -1.48 0.03 0.00 0.01 0.00 0.00 46.19 44.59 2k4t s LEU 263 CO 0.02 -0.35 0.86 -1.81 1.01 0.00 0.00 176.35 176.08 2k4t s ASP 264 N 0.76 6.43 0.00 2.29 1.01 -1.26 -0.05 116.67 125.85 2k4t s ASP 264 Ca 0.12 -0.08 0.01 0.00 0.71 0.00 0.00 52.55 53.30 2k4t s ASP 264 Cb -0.20 -2.42 0.03 0.00 1.01 0.00 0.00 42.92 41.34 2k4t s ASP 264 CO -0.09 -1.02 1.00 0.61 0.21 0.00 0.00 175.17 175.88 2k4t n GLY 265 N 4.99 -0.50 0.31 0.21 0.00 -1.24 0.19 105.19 109.14 2k4t n GLY 265 Ca 0.03 -0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.19 2k4t n GLY 265 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k4t n LYS 266 N -1.48 1.27 0.14 1.61 5.02 -1.25 -4.00 118.16 119.46 2k4t n LYS 266 Ca 0.00 -0.62 0.00 0.00 -2.02 0.00 0.00 58.31 55.67 2k4t n LYS 266 Cb 0.01 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 2k4t n LYS 266 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2k4t n ASN 267 N -0.32 -0.92 -0.18 4.39 4.13 0.35 -4.87 115.26 117.83 2k4t n ASN 267 Ca 0.18 0.48 0.27 0.00 1.68 0.00 0.00 54.58 57.19 2k4t n ASN 267 Cb 0.30 1.03 0.69 0.00 -1.54 0.00 0.00 39.78 40.26 2k4t n ASN 267 CO 0.00 0.00 0.00 -0.37 0.28 0.00 0.00 177.26 177.17 2k4t h VAL 268 N 0.00 0.58 -1.19 2.41 -1.51 -0.43 0.57 116.25 116.68 2k4t h VAL 268 Ca 0.00 -0.02 0.34 0.00 -1.23 0.00 0.00 66.70 65.79 2k4t h VAL 268 Cb 0.00 0.50 -0.05 0.00 -2.13 0.00 0.00 31.29 29.61 2k4t h VAL 268 CO 0.00 0.01 0.84 -1.13 -1.23 0.00 0.00 177.57 176.07 2k4t h ASN 269 N 0.07 0.06 0.00 4.19 -0.73 -1.69 0.21 115.58 117.68 2k4t h ASN 269 Ca 0.43 0.01 -0.06 0.00 1.87 0.00 0.00 56.30 58.55 2k4t h ASN 269 Cb 1.59 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 40.18 2k4t h ASN 269 CO -0.04 0.01 -1.89 0.00 -0.37 0.00 0.00 177.43 175.14 2k4t n ALA 270 N -2.74 2.45 0.00 1.57 0.00 0.16 -5.06 120.51 116.90 2k4t n ALA 270 Ca 0.26 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2k4t n ALA 270 Cb 1.22 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 20.16 2k4t n ALA 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4t n GLY 271 N 1.58 3.41 0.00 0.00 0.00 0.74 -5.13 105.19 105.79 2k4t n GLY 271 Ca -0.08 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2k4t n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k4t n GLY 272 N 0.00 -0.39 3.83 -0.02 0.00 -1.26 -4.65 105.19 102.70 2k4t n GLY 272 Ca 0.00 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 2k4t n GLY 272 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k4t s HIS 273 N 0.00 3.21 -0.16 1.61 -3.43 -1.26 -4.21 115.29 111.04 2k4t s HIS 273 Ca 0.00 1.42 -0.02 0.00 -0.80 0.00 0.00 55.06 55.67 2k4t s HIS 273 Cb 0.00 -2.87 -0.01 0.00 -1.43 0.00 0.00 32.58 28.26 2k4t s HIS 273 CO 0.00 -1.03 -0.10 0.15 -2.00 0.00 0.00 174.74 171.77 2k4t s LYS 274 N -4.74 3.42 -0.03 -0.38 1.02 -0.25 -4.36 119.74 114.42 2k4t s LYS 274 Ca 0.59 -0.65 0.02 0.00 0.02 0.00 0.00 55.97 55.96 2k4t s LYS 274 Cb -0.14 -2.77 0.01 0.00 -0.52 0.00 0.00 37.83 34.41 2k4t s LYS 274 CO 0.48 0.11 -0.10 -0.51 -0.92 0.00 0.00 175.35 174.41 2k4t s LEU 275 N 0.65 1.74 -0.15 3.17 2.01 -1.25 -0.10 118.68 124.75 2k4t s LEU 275 Ca -0.05 -0.21 -0.08 0.00 0.01 0.00 0.00 54.13 53.80 2k4t s LEU 275 Cb -0.15 -0.60 0.05 0.00 0.01 0.00 0.00 46.19 45.50 2k4t s LEU 275 CO 0.02 0.06 0.35 -0.83 1.01 0.00 0.00 176.35 176.97 2k4t s GLY 276 N 0.30 -0.26 -0.06 -3.19 0.00 0.12 -0.99 107.32 103.23 2k4t s GLY 276 Ca -0.05 1.33 -0.03 0.00 0.00 0.00 0.00 44.72 45.97 2k4t s GLY 276 CO 0.01 1.49 0.08 1.08 0.00 0.00 0.00 173.10 175.76 2k4t s LEU 277 N 1.27 3.96 -0.23 0.66 1.02 0.84 -0.96 118.68 125.25 2k4t s LEU 277 Ca -0.09 0.25 -0.03 0.00 0.02 0.00 0.00 54.13 54.29 2k4t s LEU 277 Cb -0.09 -2.09 0.01 0.00 0.02 0.00 0.00 46.19 44.04 2k4t s LEU 277 CO -0.11 0.35 -0.07 -0.83 0.02 0.00 0.00 176.35 175.71 2k4t s GLY 278 N -1.27 1.59 -0.12 -3.19 0.00 0.10 -0.06 107.32 104.37 2k4t s GLY 278 Ca 0.18 -1.30 -0.03 0.00 0.00 0.00 0.00 44.72 43.57 2k4t s GLY 278 CO 0.08 0.45 -0.01 1.08 0.00 0.00 0.00 173.10 174.70 2k4t s LEU 279 N 1.40 3.45 0.09 0.66 2.01 0.13 -1.36 118.68 125.05 2k4t s LEU 279 Ca 0.04 0.02 0.04 0.00 0.01 0.00 0.00 54.13 54.23 2k4t s LEU 279 Cb -0.15 -1.81 -0.04 0.00 0.01 0.00 0.00 46.19 44.20 2k4t s LEU 279 CO -0.05 0.27 0.07 -1.61 1.01 0.00 0.00 176.35 176.04 2k4t s GLU 280 N -0.23 2.82 -0.29 1.70 2.02 -1.26 -1.10 118.70 122.34 2k4t s GLU 280 Ca 0.05 -0.73 -0.01 0.00 0.02 0.00 0.00 54.97 54.30 2k4t s GLU 280 Cb -0.13 -2.69 0.19 0.00 0.10 0.00 0.00 34.13 31.61 2k4t s GLU 280 CO 0.02 0.56 0.74 -0.06 0.02 0.00 0.00 175.26 176.54 2k4t s PHE 281 N -1.40 -1.38 -0.32 1.61 0.08 -1.19 -4.92 117.98 110.47 2k4t s PHE 281 Ca 0.29 0.93 -0.15 0.00 0.12 0.00 0.00 56.93 58.12 2k4t s PHE 281 Cb -0.12 0.28 -0.02 0.00 -0.57 0.00 0.00 43.02 42.59 2k4t s PHE 281 CO 0.21 -0.80 0.34 -1.14 -0.10 0.00 0.00 175.22 173.74 2k4t s GLN 282 N 2.88 3.69 -0.46 0.44 0.74 -1.26 -3.28 119.66 122.41 2k4t s GLN 282 Ca 0.15 -0.33 -0.28 0.00 0.05 0.00 0.00 55.36 54.95 2k4t s GLN 282 Cb -0.09 -3.76 -0.00 0.00 1.10 0.00 0.00 33.01 30.26 2k4t s GLN 282 CO -0.23 -0.44 1.62 0.00 -0.55 0.00 0.00 175.29 175.69 2k4t s ALA 283 N 1.98 2.77 -0.19 1.58 0.00 -1.14 -4.92 121.76 121.86 2k4t s ALA 283 Ca 0.12 -0.23 -0.31 0.00 0.00 0.00 0.00 51.96 51.54 2k4t s ALA 283 Cb -0.16 -4.07 0.14 0.00 0.00 0.00 0.00 23.12 19.03 2k4t s ALA 283 CO 0.11 -2.87 1.13 -1.17 0.00 0.00 0.00 175.76 172.96 2k4t s LEU 284 N 6.73 -0.23 0.00 0.00 2.96 -1.26 -4.71 118.68 122.17 2k4t s LEU 284 Ca 0.66 0.18 0.00 0.00 -0.22 0.00 0.00 54.13 54.75 2k4t s LEU 284 Cb -0.16 1.56 0.00 0.00 0.50 0.00 0.00 46.19 48.10 2k4t s LEU 284 CO 0.29 -0.26 0.00 1.21 -1.32 0.00 0.00 176.35 176.27