#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4t s ALA 2 N 0.00 3.58 -0.59 3.04 0.00 -1.26 -4.99 121.76 121.55 2k4t s ALA 2 Ca 0.00 -3.53 0.05 0.00 0.00 0.00 0.00 51.96 48.48 2k4t s ALA 2 Cb 0.00 -2.24 0.19 0.00 0.00 0.00 0.00 23.12 21.07 2k4t s ALA 2 CO 0.00 -2.06 0.49 1.55 0.00 0.00 0.00 175.76 175.73 2k4t n VAL 3 N 2.66 0.73 -1.18 0.00 3.14 -1.26 -5.11 118.33 117.30 2k4t n VAL 3 Ca 0.12 -4.43 -0.29 0.00 -2.96 0.00 0.00 64.34 56.77 2k4t n VAL 3 Cb 0.34 -2.00 0.16 0.00 -1.06 0.00 0.00 33.84 31.28 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 -1.15 0.75 -1.04 1.45 0.04 -1.26 -4.89 135.00 128.90 2k4t s PRO 4 Ca 0.30 0.63 -0.24 0.00 0.04 0.00 0.00 61.00 61.74 2k4t s PRO 4 Cb 0.03 -1.76 -0.07 0.00 0.04 0.00 0.00 34.50 32.73 2k4t s PRO 4 CO -0.15 -2.54 1.94 -1.25 0.04 0.00 0.00 177.00 175.04 2k4t s PRO 5 N -4.95 2.52 -0.00 0.56 0.04 -1.26 -4.69 135.00 127.22 2k4t s PRO 5 Ca 0.65 -0.71 0.13 0.00 0.04 0.00 0.00 61.00 61.11 2k4t s PRO 5 Cb -0.18 -5.15 -0.20 0.00 0.04 0.00 0.00 34.50 29.01 2k4t s PRO 5 CO 0.57 -3.68 0.76 1.79 0.04 0.00 0.00 177.00 176.49 2k4t h THR 6 N 6.74 0.84 0.00 1.26 1.35 -1.98 -2.89 112.91 118.23 2k4t h THR 6 Ca 0.15 -2.60 -0.15 0.00 -0.55 0.00 0.00 66.41 63.26 2k4t h THR 6 Cb 0.97 2.37 -0.02 0.00 -1.73 0.00 0.00 68.15 69.74 2k4t h THR 6 CO 1.22 0.48 -0.72 0.10 -0.25 0.00 0.00 175.52 176.35 2k4t h TYR 7 N 0.00 0.00 0.00 4.73 -0.00 -1.92 -2.92 116.97 116.86 2k4t h TYR 7 Ca -0.23 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.36 2k4t h TYR 7 Cb 1.89 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 38.60 2k4t h TYR 7 CO 0.00 0.72 -1.25 0.00 -0.00 0.00 0.00 178.16 177.63 2k4t h ALA 8 N 1.28 0.64 0.00 0.10 0.00 -1.95 -3.33 119.26 116.00 2k4t h ALA 8 Ca -0.01 -0.69 -0.11 0.00 0.00 0.00 0.00 54.91 54.10 2k4t h ALA 8 Cb 1.46 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.44 2k4t h ALA 8 CO 0.09 0.77 -0.52 -0.44 0.00 0.00 0.00 179.25 179.15 2k4t h ASP 9 N 0.00 0.00 1.02 0.00 5.19 -1.54 -3.15 116.42 117.95 2k4t h ASP 9 Ca -0.12 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.18 2k4t h ASP 9 Cb 1.49 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.98 2k4t h ASP 9 CO 0.04 0.52 -0.50 -0.07 -3.12 0.00 0.00 179.24 176.10 2k4t h LEU 10 N 0.00 0.00 0.00 1.55 3.38 -1.63 -3.48 115.31 115.14 2k4t h LEU 10 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2k4t h LEU 10 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2k4t h LEU 10 CO 0.07 0.50 0.00 0.61 0.09 0.00 0.00 178.44 179.71 2k4t n GLY 11 N 0.64 1.17 0.00 0.83 0.00 -1.19 -4.67 105.19 101.96 2k4t n GLY 11 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 0.72 1.56 -1.57 1.61 4.81 -1.26 -5.02 118.16 119.03 2k4t n LYS 12 Ca 0.00 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.06 2k4t n LYS 12 Cb 0.00 -0.94 0.04 0.00 0.02 0.00 0.00 35.03 34.15 2k4t n LYS 12 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2k4t n SER 13 N -2.14 0.27 -4.68 3.14 2.88 -1.26 -4.95 113.62 106.88 2k4t n SER 13 Ca 0.00 0.82 -0.30 0.00 -1.33 0.00 0.00 58.87 58.07 2k4t n SER 13 Cb 0.44 -1.31 0.16 0.00 -0.75 0.00 0.00 64.21 62.75 2k4t n SER 13 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k4t s ALA 14 N -1.54 1.22 -0.48 -1.46 0.00 -1.26 -5.02 121.76 113.23 2k4t s ALA 14 Ca 0.71 -0.05 0.04 0.00 0.00 0.00 0.00 51.96 52.66 2k4t s ALA 14 Cb -0.45 -3.21 0.12 0.00 0.00 0.00 0.00 23.12 19.58 2k4t s ALA 14 CO 0.51 -2.63 0.22 -0.98 0.00 0.00 0.00 175.76 172.88 2k4t s ARG 15 N -4.85 1.80 -0.29 0.00 3.03 -1.26 -5.04 118.95 112.33 2k4t s ARG 15 Ca 0.64 -2.40 -0.18 0.00 2.03 0.00 0.00 55.73 55.83 2k4t s ARG 15 Cb -0.19 -3.19 0.17 0.00 -1.03 0.00 0.00 34.95 30.71 2k4t s ARG 15 CO 0.58 -1.08 1.13 0.16 -1.13 0.00 0.00 175.30 174.96 2k4t s ASP 16 N 0.02 -0.29 -0.06 -2.89 1.47 -1.26 -5.05 116.67 108.61 2k4t s ASP 16 Ca 0.16 0.48 0.07 0.00 1.18 0.00 0.00 52.55 54.44 2k4t s ASP 16 Cb -0.24 1.01 -0.10 0.00 -0.34 0.00 0.00 42.92 43.25 2k4t s ASP 16 CO -0.02 -0.08 0.07 0.52 0.68 0.00 0.00 175.17 176.34 2k4t n VAL 17 N 3.16 0.37 -3.27 2.11 0.31 -1.26 -5.04 118.33 114.72 2k4t n VAL 17 Ca -0.17 -0.29 -0.16 0.00 -0.01 0.00 0.00 64.34 63.72 2k4t n VAL 17 Cb 0.57 -0.48 0.07 0.00 -0.91 0.00 0.00 33.84 33.09 2k4t n VAL 17 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2k4t n PHE 18 N -2.14 -2.00 -3.55 3.52 3.72 -1.26 -4.99 117.46 110.77 2k4t n PHE 18 Ca -0.09 0.82 -0.38 0.00 -0.05 0.00 0.00 57.45 57.74 2k4t n PHE 18 Cb 0.60 -4.60 -0.10 0.00 -0.94 0.00 0.00 39.48 34.44 2k4t n PHE 18 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2k4t s THR 19 N -3.30 5.28 0.07 4.37 2.01 -1.26 -4.92 115.64 117.90 2k4t s THR 19 Ca 0.11 0.32 0.00 0.00 0.31 0.00 0.00 61.69 62.42 2k4t s THR 19 Cb -0.05 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 68.88 2k4t s THR 19 CO 0.62 0.26 0.00 0.29 -0.69 0.00 0.00 174.62 175.10 2k4t n LYS 20 N 4.84 0.00 -3.65 4.92 4.76 -1.26 -5.13 118.16 122.65 2k4t n LYS 20 Ca -0.12 0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.30 2k4t n LYS 20 Cb 0.52 -0.40 -0.07 0.00 -1.84 0.00 0.00 35.03 33.24 2k4t n LYS 20 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2k4t s GLY 21 N -4.59 0.41 0.33 0.72 0.00 -1.26 -5.10 107.32 97.83 2k4t s GLY 21 Ca 0.00 3.57 -0.18 0.00 0.00 0.00 0.00 44.72 48.11 2k4t s GLY 21 CO 0.00 2.22 0.76 -0.47 0.00 0.00 0.00 173.10 175.61 2k4t s TYR 22 N 0.40 -0.04 0.00 1.90 5.04 -1.26 -5.16 117.35 118.24 2k4t s TYR 22 Ca 0.02 -0.53 0.00 0.00 -2.44 0.00 0.00 57.07 54.12 2k4t s TYR 22 Cb -0.04 0.77 0.00 0.00 0.35 0.00 0.00 41.96 43.04 2k4t s TYR 22 CO -0.13 -1.40 0.00 0.41 -1.34 0.00 0.00 175.55 173.09 2k4t n GLY 23 N -0.50 -2.33 3.13 8.97 0.00 -1.26 -4.59 105.19 108.61 2k4t n GLY 23 Ca -0.06 -1.19 -0.13 0.00 0.00 0.00 0.00 46.02 44.64 2k4t n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2k4t s PHE 24 N 0.00 0.85 -0.05 1.61 -0.12 -1.26 -4.89 117.98 114.12 2k4t s PHE 24 Ca 0.00 -0.66 -0.02 0.00 -0.05 0.00 0.00 56.93 56.20 2k4t s PHE 24 Cb 0.00 -0.49 0.01 0.00 -0.63 0.00 0.00 43.02 41.91 2k4t s PHE 24 CO 0.00 -0.08 0.04 0.41 -0.05 0.00 0.00 175.22 175.55 2k4t n GLY 25 N 0.79 -3.42 3.50 1.99 0.00 -1.02 -4.67 105.19 102.36 2k4t n GLY 25 Ca -0.18 0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 2k4t n GLY 25 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k4t s LEU 26 N -0.22 2.76 -0.21 0.99 1.02 -0.17 -3.38 118.68 119.47 2k4t s LEU 26 Ca -0.05 -0.48 0.01 0.00 0.02 0.00 0.00 54.13 53.63 2k4t s LEU 26 Cb 0.00 -1.60 0.05 0.00 0.02 0.00 0.00 46.19 44.66 2k4t s LEU 26 CO 0.19 0.20 -0.09 -0.63 0.02 0.00 0.00 176.35 176.04 2k4t s ILE 27 N -1.10 1.66 0.11 -0.59 -1.09 -0.34 -0.72 121.20 119.14 2k4t s ILE 27 Ca 0.18 -1.09 0.03 0.00 -2.23 0.00 0.00 60.65 57.53 2k4t s ILE 27 Cb -0.11 -1.77 -0.04 0.00 -1.58 0.00 0.00 42.46 38.96 2k4t s ILE 27 CO 0.09 0.11 0.15 -0.54 -1.23 0.00 0.00 174.94 173.52 2k4t s LYS 28 N 1.37 3.08 -0.10 2.79 3.01 -0.03 -0.56 119.74 129.31 2k4t s LYS 28 Ca -0.03 -0.69 -0.05 0.00 -1.01 0.00 0.00 55.97 54.20 2k4t s LYS 28 Cb -0.17 -2.80 0.04 0.00 -1.01 0.00 0.00 37.83 33.90 2k4t s LYS 28 CO -0.08 0.54 0.22 -1.17 0.51 0.00 0.00 175.35 175.38 2k4t s LEU 29 N -2.78 0.49 -0.13 3.17 2.96 0.78 -0.51 118.68 122.67 2k4t s LEU 29 Ca 0.32 0.47 -0.00 0.00 -0.22 0.00 0.00 54.13 54.69 2k4t s LEU 29 Cb -0.11 0.64 0.03 0.00 0.50 0.00 0.00 46.19 47.25 2k4t s LEU 29 CO 0.25 -0.16 -0.08 -0.62 -1.32 0.00 0.00 176.35 174.42 2k4t s ASP 30 N 1.24 2.39 -0.20 3.68 2.15 0.06 -0.54 116.67 125.44 2k4t s ASP 30 Ca -0.09 -0.40 -0.10 0.00 0.43 0.00 0.00 52.55 52.38 2k4t s ASP 30 Cb -0.11 -0.90 -0.05 0.00 -0.30 0.00 0.00 42.92 41.56 2k4t s ASP 30 CO -0.08 -0.13 0.13 -0.22 -0.17 0.00 0.00 175.17 174.71 2k4t s LEU 31 N 1.66 4.18 -0.16 -1.34 2.96 0.43 -2.88 118.68 123.53 2k4t s LEU 31 Ca 0.04 0.21 0.00 0.00 -0.22 0.00 0.00 54.13 54.16 2k4t s LEU 31 Cb -0.13 -2.09 0.03 0.00 0.50 0.00 0.00 46.19 44.51 2k4t s LEU 31 CO -0.08 0.17 -0.10 -0.75 -1.32 0.00 0.00 176.35 174.27 2k4t s LYS 32 N 0.44 1.88 -0.08 1.98 2.20 -1.20 -0.40 119.74 124.56 2k4t s LYS 32 Ca 0.08 -0.59 0.01 0.00 -0.36 0.00 0.00 55.97 55.10 2k4t s LYS 32 Cb -0.11 -2.10 0.02 0.00 -1.51 0.00 0.00 37.83 34.12 2k4t s LYS 32 CO -0.01 -0.35 -0.08 0.99 -0.36 0.00 0.00 175.35 175.54 2k4t s THR 33 N 1.53 0.91 -0.00 3.43 2.01 0.78 -3.47 115.64 120.82 2k4t s THR 33 Ca 0.02 -0.29 0.08 0.00 0.31 0.00 0.00 61.69 61.81 2k4t s THR 33 Cb -0.14 -0.89 -0.02 0.00 0.01 0.00 0.00 72.50 71.45 2k4t s THR 33 CO -0.09 0.32 -0.25 -0.54 -0.69 0.00 0.00 174.62 173.37 2k4t s LYS 34 N 1.13 2.05 0.49 4.92 1.02 -1.26 -0.33 119.74 127.77 2k4t s LYS 34 Ca -0.06 -0.96 -0.00 0.00 0.02 0.00 0.00 55.97 54.96 2k4t s LYS 34 Cb -0.14 -2.06 0.01 0.00 -0.52 0.00 0.00 37.83 35.12 2k4t s LYS 34 CO -0.01 0.55 0.73 0.45 -0.92 0.00 0.00 175.35 176.14 2k4t s SER 35 N -0.82 5.65 0.21 2.83 0.15 -0.95 -4.93 113.70 115.84 2k4t s SER 35 Ca 0.11 0.25 0.04 0.00 0.70 0.00 0.00 55.95 57.05 2k4t s SER 35 Cb -0.10 -1.37 0.17 0.00 -1.71 0.00 0.00 66.02 63.01 2k4t s SER 35 CO 0.00 -0.87 1.50 -0.33 1.20 0.00 0.00 173.24 174.75 2k4t h GLU 36 N 0.24 0.23 -0.38 5.44 4.39 -2.01 -3.13 114.58 119.36 2k4t h GLU 36 Ca -0.45 -0.18 -0.08 0.00 0.34 0.00 0.00 59.36 58.99 2k4t h GLU 36 Cb 1.27 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.93 2k4t h GLU 36 CO 0.56 0.83 -0.08 -0.91 -1.16 0.00 0.00 179.01 178.25 2k4t h ASN 37 N 0.16 0.62 0.00 1.42 2.35 -1.98 -3.46 115.58 114.69 2k4t h ASN 37 Ca -0.02 -0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 2k4t h ASN 37 Cb 1.23 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.44 2k4t h ASN 37 CO 0.11 0.75 0.00 0.61 -1.65 0.00 0.00 177.43 177.24 2k4t n GLY 38 N -0.61 0.41 3.90 2.83 0.00 -1.18 -4.92 105.19 105.62 2k4t n GLY 38 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2k4t n GLY 38 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k4t s LEU 39 N 0.00 4.35 -0.25 0.99 0.20 -1.25 -1.70 118.68 121.02 2k4t s LEU 39 Ca 0.00 0.42 0.02 0.00 0.69 0.00 0.00 54.13 55.25 2k4t s LEU 39 Cb 0.00 -2.83 0.06 0.00 -0.43 0.00 0.00 46.19 42.99 2k4t s LEU 39 CO 0.00 0.20 -0.07 -0.70 -0.29 0.00 0.00 176.35 175.49 2k4t s GLU 40 N -2.17 1.85 -0.24 1.98 2.12 0.89 -2.24 118.70 120.90 2k4t s GLU 40 Ca 0.32 -1.19 -0.03 0.00 0.36 0.00 0.00 54.97 54.42 2k4t s GLU 40 Cb -0.13 -2.74 0.01 0.00 0.26 0.00 0.00 34.13 31.54 2k4t s GLU 40 CO 0.22 -0.62 -0.04 0.12 -0.54 0.00 0.00 175.26 174.40 2k4t s PHE 41 N 1.25 3.02 -0.25 5.30 5.36 0.55 -0.91 117.98 132.30 2k4t s PHE 41 Ca -0.06 -1.26 -0.02 0.00 -0.96 0.00 0.00 56.93 54.63 2k4t s PHE 41 Cb -0.19 -2.09 0.08 0.00 -0.34 0.00 0.00 43.02 40.47 2k4t s PHE 41 CO -0.06 -0.65 0.06 0.99 -1.46 0.00 0.00 175.22 174.09 2k4t s THR 42 N 1.40 0.76 -0.28 0.12 2.01 0.76 -0.16 115.64 120.26 2k4t s THR 42 Ca 0.03 -0.99 -0.07 0.00 0.31 0.00 0.00 61.69 60.96 2k4t s THR 42 Cb -0.16 -1.38 -0.01 0.00 0.01 0.00 0.00 72.50 70.97 2k4t s THR 42 CO -0.04 -0.42 0.08 -0.55 -0.69 0.00 0.00 174.62 173.00 2k4t s SER 43 N 1.71 5.12 -0.13 3.53 0.15 0.46 -0.39 113.70 124.16 2k4t s SER 43 Ca 0.03 -0.51 -0.07 0.00 0.70 0.00 0.00 55.95 56.11 2k4t s SER 43 Cb -0.17 -1.90 -0.04 0.00 -1.71 0.00 0.00 66.02 62.20 2k4t s SER 43 CO -0.16 -0.13 0.12 -0.44 1.20 0.00 0.00 173.24 173.83 2k4t s SER 44 N 1.55 6.22 -0.14 5.45 0.01 -0.10 -0.43 113.70 126.26 2k4t s SER 44 Ca 0.04 0.40 -0.13 0.00 1.31 0.00 0.00 55.95 57.57 2k4t s SER 44 Cb -0.16 -2.00 0.04 0.00 0.21 0.00 0.00 66.02 64.10 2k4t s SER 44 CO 0.03 0.38 0.37 -0.83 0.41 0.00 0.00 173.24 173.59 2k4t s GLY 45 N -0.83 -0.27 -0.03 3.44 0.00 0.30 -0.39 107.32 109.54 2k4t s GLY 45 Ca 0.14 1.03 0.04 0.00 0.00 0.00 0.00 44.72 45.92 2k4t s GLY 45 CO 0.03 0.89 -0.14 -0.56 0.00 0.00 0.00 173.10 173.32 2k4t s SER 46 N 0.19 1.70 0.09 1.64 0.01 0.88 -0.15 113.70 118.06 2k4t s SER 46 Ca -0.00 -0.27 0.06 0.00 1.31 0.00 0.00 55.95 57.05 2k4t s SER 46 Cb -0.03 -0.38 -0.03 0.00 0.21 0.00 0.00 66.02 65.79 2k4t s SER 46 CO 0.01 0.13 -0.15 0.00 0.41 0.00 0.00 173.24 173.64 2k4t s ALA 47 N -0.03 1.35 0.18 1.44 0.00 0.28 -1.27 121.76 123.71 2k4t s ALA 47 Ca -0.01 -1.12 0.11 0.00 0.00 0.00 0.00 51.96 50.94 2k4t s ALA 47 Cb -0.09 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.88 2k4t s ALA 47 CO 0.01 0.17 -0.20 -0.80 0.00 0.00 0.00 175.76 174.93 2k4t s ASN 48 N -1.99 3.65 0.14 0.00 0.01 -1.01 -1.20 114.94 114.54 2k4t s ASN 48 Ca 0.02 -0.77 0.17 0.00 -0.71 0.00 0.00 52.86 51.58 2k4t s ASN 48 Cb -0.08 -0.38 0.76 0.00 0.41 0.00 0.00 41.25 41.95 2k4t s ASN 48 CO 0.03 0.12 1.54 0.41 -1.51 0.00 0.00 177.10 177.69 2k4t n THR 49 N 0.29 1.03 -0.13 1.60 -1.04 -1.22 -4.66 114.28 110.15 2k4t n THR 49 Ca -0.13 0.31 -0.14 0.00 -2.04 0.00 0.00 64.05 62.06 2k4t n THR 49 Cb 0.55 -1.18 0.13 0.00 -1.82 0.00 0.00 70.33 68.01 2k4t n THR 49 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2k4t n GLU 50 N -1.87 -3.02 0.00 -2.82 1.02 -1.26 -4.93 120.64 107.76 2k4t n GLU 50 Ca 0.02 -0.66 0.00 0.00 -0.02 0.00 0.00 57.16 56.50 2k4t n GLU 50 Cb 0.16 -0.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.68 2k4t n GLU 50 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2k4t n THR 51 N -4.26 0.00 -3.43 2.62 -2.24 -1.26 -4.70 114.28 101.01 2k4t n THR 51 Ca 0.06 1.29 -0.16 0.00 -2.27 0.00 0.00 64.05 62.97 2k4t n THR 51 Cb 0.27 -2.08 -0.11 0.00 -2.10 0.00 0.00 70.33 66.32 2k4t n THR 51 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2k4t s THR 52 N -2.16 -0.41 -0.29 4.28 2.01 -1.26 -5.08 115.64 112.73 2k4t s THR 52 Ca 0.00 -0.25 0.02 0.00 0.31 0.00 0.00 61.69 61.77 2k4t s THR 52 Cb 0.00 -0.82 0.16 0.00 0.01 0.00 0.00 72.50 71.85 2k4t s THR 52 CO 0.00 -0.29 0.41 -0.54 -0.69 0.00 0.00 174.62 173.51 2k4t s LYS 53 N 2.38 0.41 -0.08 4.92 -0.14 -1.26 -5.08 119.74 120.89 2k4t s LYS 53 Ca 0.09 0.14 0.01 0.00 -1.36 0.00 0.00 55.97 54.84 2k4t s LYS 53 Cb -0.15 -0.31 0.02 0.00 -1.68 0.00 0.00 37.83 35.71 2k4t s LYS 53 CO -0.20 -1.03 -0.08 0.08 -0.76 0.00 0.00 175.35 173.36 2k4t s VAL 54 N 2.54 0.90 -0.02 3.17 1.01 -1.26 -2.40 120.40 124.34 2k4t s VAL 54 Ca 0.10 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2k4t s VAL 54 Cb -0.12 -0.90 0.01 0.00 0.00 0.00 0.00 36.38 35.37 2k4t s VAL 54 CO -0.30 0.32 -0.03 -0.89 0.00 0.00 0.00 175.10 174.20 2k4t s THR 55 N 1.22 0.35 0.34 3.92 2.01 -0.39 -4.97 115.64 118.11 2k4t s THR 55 Ca -0.05 -0.10 -0.18 0.00 0.31 0.00 0.00 61.69 61.68 2k4t s THR 55 Cb -0.14 -0.36 0.04 0.00 0.01 0.00 0.00 72.50 72.06 2k4t s THR 55 CO -0.02 0.14 0.77 -0.83 -0.69 0.00 0.00 174.62 173.99 2k4t s GLY 56 N 0.47 0.17 0.16 4.40 0.00 -1.26 -0.08 107.32 111.17 2k4t s GLY 56 Ca -0.05 -0.56 0.00 0.00 0.00 0.00 0.00 44.72 44.12 2k4t s GLY 56 CO -0.01 -0.16 0.03 -1.35 0.00 0.00 0.00 173.10 171.62 2k4t s SER 57 N -3.02 0.75 -0.08 1.64 1.04 0.48 -4.41 113.70 110.11 2k4t s SER 57 Ca 0.14 -1.20 0.05 0.00 0.48 0.00 0.00 55.95 55.41 2k4t s SER 57 Cb -0.05 0.21 -0.01 0.00 0.10 0.00 0.00 66.02 66.27 2k4t s SER 57 CO 0.09 -0.66 -0.23 -0.22 0.98 0.00 0.00 173.24 173.21 2k4t s LEU 58 N -3.12 2.18 -0.19 2.42 1.98 -0.52 -0.93 118.68 120.51 2k4t s LEU 58 Ca 0.25 -0.49 -0.00 0.00 -2.89 0.00 0.00 54.13 51.00 2k4t s LEU 58 Cb 0.07 -1.42 0.05 0.00 0.66 0.00 0.00 46.19 45.55 2k4t s LEU 58 CO 0.03 0.22 -0.06 -0.70 -1.89 0.00 0.00 176.35 173.95 2k4t s GLU 59 N 0.01 1.59 -0.14 1.98 2.12 0.47 -0.37 118.70 124.36 2k4t s GLU 59 Ca -0.08 -0.68 0.00 0.00 0.36 0.00 0.00 54.97 54.57 2k4t s GLU 59 Cb -0.15 -2.22 0.02 0.00 0.26 0.00 0.00 34.13 32.04 2k4t s GLU 59 CO 0.05 -0.47 -0.12 0.99 -0.54 0.00 0.00 175.26 175.17 2k4t s THR 60 N 1.54 1.43 -0.04 -1.70 2.01 0.64 -0.17 115.64 119.35 2k4t s THR 60 Ca -0.01 -0.57 0.04 0.00 0.31 0.00 0.00 61.69 61.46 2k4t s THR 60 Cb -0.16 -1.38 -0.00 0.00 0.01 0.00 0.00 72.50 70.97 2k4t s THR 60 CO -0.08 0.42 -0.15 -0.75 -0.69 0.00 0.00 174.62 173.37 2k4t s LYS 61 N 1.54 1.66 -0.36 4.92 2.20 -0.09 0.03 119.74 129.64 2k4t s LYS 61 Ca 0.05 -0.54 -0.06 0.00 -0.36 0.00 0.00 55.97 55.06 2k4t s LYS 61 Cb -0.13 -1.44 0.06 0.00 -1.51 0.00 0.00 37.83 34.81 2k4t s LYS 61 CO -0.10 0.19 0.13 -0.47 -0.36 0.00 0.00 175.35 174.74 2k4t s TYR 62 N 0.15 3.31 -0.54 4.03 6.14 -0.37 -0.08 117.35 129.98 2k4t s TYR 62 Ca -0.05 -1.62 -0.16 0.00 0.64 0.00 0.00 57.07 55.88 2k4t s TYR 62 Cb -0.12 -2.49 0.12 0.00 0.42 0.00 0.00 41.96 39.90 2k4t s TYR 62 CO 0.02 -0.79 0.51 0.50 0.64 0.00 0.00 175.55 176.43 2k4t s ARG 63 N 1.36 2.99 0.43 4.97 6.06 -0.69 -1.14 118.95 132.93 2k4t s ARG 63 Ca -0.00 -1.65 0.23 0.00 -2.50 0.00 0.00 55.73 51.81 2k4t s ARG 63 Cb -0.21 -4.29 0.54 0.00 0.06 0.00 0.00 34.95 31.06 2k4t s ARG 63 CO 0.01 -1.33 1.67 2.35 -2.50 0.00 0.00 175.30 175.50 2k4t h TRP 64 N 8.91 0.00 -1.01 5.12 7.01 -1.82 -3.42 115.95 130.73 2k4t h TRP 64 Ca -0.30 0.00 0.25 0.00 2.11 0.00 0.00 58.89 60.95 2k4t h TRP 64 Cb 1.10 0.00 -0.29 0.00 -2.10 0.00 0.00 29.16 27.87 2k4t h TRP 64 CO 0.73 0.13 0.98 -0.08 -2.79 0.00 0.00 178.44 177.42 2k4t s THR 65 N -3.30 0.00 0.42 2.65 -1.32 -1.26 -5.01 115.64 107.82 2k4t s THR 65 Ca 0.05 0.00 0.18 0.00 -1.21 0.00 0.00 61.69 60.70 2k4t s THR 65 Cb 0.07 -1.00 0.38 0.00 -1.51 0.00 0.00 72.50 70.44 2k4t s THR 65 CO 0.66 0.00 1.86 -0.33 -2.21 0.00 0.00 174.62 174.60 2k4t h GLU 66 N 2.17 0.38 -4.35 7.08 5.08 -1.97 -3.39 114.58 119.59 2k4t h GLU 66 Ca -0.10 -0.02 -0.51 0.00 -1.00 0.00 0.00 59.36 57.72 2k4t h GLU 66 Cb 1.19 -0.09 -0.35 0.00 0.50 0.00 0.00 28.75 30.00 2k4t h GLU 66 CO 0.21 0.25 -0.81 1.52 -1.00 0.00 0.00 179.01 179.19 2k4t s TYR 67 N -5.41 1.41 0.00 4.33 1.13 -1.26 -4.88 117.35 112.66 2k4t s TYR 67 Ca -0.08 -0.60 0.00 0.00 -1.41 0.00 0.00 57.07 54.98 2k4t s TYR 67 Cb 0.23 -1.11 0.00 0.00 -1.10 0.00 0.00 41.96 39.98 2k4t s TYR 67 CO 0.78 -0.38 0.00 0.41 -2.51 0.00 0.00 175.55 173.85 2k4t n GLY 68 N 4.36 0.51 3.32 5.49 0.00 0.42 -4.99 105.19 114.29 2k4t n GLY 68 Ca -0.18 -0.65 -0.33 0.00 0.00 0.00 0.00 46.02 44.86 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 2.49 0.04 0.99 2.01 -1.26 -1.00 118.68 121.95 2k4t s LEU 69 Ca 0.00 -0.40 0.05 0.00 0.01 0.00 0.00 54.13 53.79 2k4t s LEU 69 Cb 0.00 -1.53 -0.02 0.00 0.01 0.00 0.00 46.19 44.65 2k4t s LEU 69 CO 0.00 0.17 -0.15 0.42 1.01 0.00 0.00 176.35 177.81 2k4t s THR 70 N 0.28 1.16 -0.01 5.49 -4.23 -0.34 -4.17 115.64 113.83 2k4t s THR 70 Ca -0.12 -1.01 -0.09 0.00 -1.18 0.00 0.00 61.69 59.28 2k4t s THR 70 Cb -0.16 -1.05 -0.05 0.00 1.34 0.00 0.00 72.50 72.58 2k4t s THR 70 CO 0.07 0.03 0.30 -0.36 -0.54 0.00 0.00 174.62 174.11 2k4t s PHE 71 N -0.84 3.62 -0.10 3.99 0.40 -0.29 -0.22 117.98 124.53 2k4t s PHE 71 Ca 0.02 0.70 0.00 0.00 -0.60 0.00 0.00 56.93 57.05 2k4t s PHE 71 Cb -0.08 -2.08 0.02 0.00 0.51 0.00 0.00 43.02 41.40 2k4t s PHE 71 CO 0.01 0.63 -0.10 0.99 0.70 0.00 0.00 175.22 177.45 2k4t s THR 72 N -1.22 1.13 -0.04 0.64 2.01 -0.62 -1.24 115.64 116.31 2k4t s THR 72 Ca 0.25 -0.39 0.01 0.00 0.31 0.00 0.00 61.69 61.88 2k4t s THR 72 Cb -0.14 -1.10 0.02 0.00 0.01 0.00 0.00 72.50 71.29 2k4t s THR 72 CO 0.14 0.38 -0.06 -0.70 -0.69 0.00 0.00 174.62 173.69 2k4t s GLU 73 N 1.37 0.82 -0.04 4.92 2.12 0.10 -0.57 118.70 127.42 2k4t s GLU 73 Ca -0.01 -0.16 -0.05 0.00 0.36 0.00 0.00 54.97 55.11 2k4t s GLU 73 Cb -0.14 -0.80 0.01 0.00 0.26 0.00 0.00 34.13 33.46 2k4t s GLU 73 CO -0.05 -0.02 0.13 0.15 -0.54 0.00 0.00 175.26 174.94 2k4t s LYS 74 N 0.64 0.23 -0.13 4.30 -0.14 0.11 -0.26 119.74 124.48 2k4t s LYS 74 Ca -0.09 0.06 0.01 0.00 -1.36 0.00 0.00 55.97 54.59 2k4t s LYS 74 Cb -0.12 0.10 0.02 0.00 -1.68 0.00 0.00 37.83 36.15 2k4t s LYS 74 CO 0.00 -0.04 -0.13 -0.46 -0.76 0.00 0.00 175.35 173.97 2k4t s TRP 75 N -0.24 1.96 -0.02 3.18 -0.11 0.50 -0.05 118.94 124.15 2k4t s TRP 75 Ca -0.03 -1.02 0.07 0.00 1.22 0.00 0.00 56.10 56.33 2k4t s TRP 75 Cb -0.02 -1.46 -0.02 0.00 -1.50 0.00 0.00 33.47 30.46 2k4t s TRP 75 CO 0.00 -0.57 -0.23 -0.80 -4.62 0.00 0.00 176.95 170.73 2k4t s ASN 76 N 1.37 3.29 -1.15 5.86 0.01 -0.62 -1.44 114.94 122.26 2k4t s ASN 76 Ca 0.01 -0.41 0.00 0.00 -0.71 0.00 0.00 52.86 51.75 2k4t s ASN 76 Cb -0.13 -0.46 0.00 0.00 0.41 0.00 0.00 41.25 41.07 2k4t s ASN 76 CO -0.07 0.32 0.00 0.41 -1.51 0.00 0.00 177.10 176.25 2k4t n THR 77 N 2.38 -0.25 -2.38 1.60 -1.04 -1.26 -0.98 114.28 112.35 2k4t n THR 77 Ca -0.16 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.76 2k4t n THR 77 Cb 0.51 -1.38 -0.01 0.00 -1.82 0.00 0.00 70.33 67.64 2k4t n THR 77 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2k4t n ASP 78 N -0.99 -2.89 0.00 8.00 -0.08 -1.26 -4.58 116.55 114.74 2k4t n ASP 78 Ca -0.13 0.29 0.00 0.00 -1.51 0.00 0.00 54.79 53.44 2k4t n ASP 78 Cb 0.49 -2.53 0.00 0.00 2.34 0.00 0.00 41.12 41.42 2k4t n ASP 78 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2k4t n ASN 79 N -1.58 0.01 -4.58 1.67 5.03 -0.19 -5.03 115.26 110.59 2k4t n ASN 79 Ca -0.10 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 54.94 2k4t n ASN 79 Cb 0.55 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.29 2k4t n ASN 79 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2k4t s THR 80 N -1.94 3.83 -0.46 3.41 -4.23 -0.15 -4.20 115.64 111.90 2k4t s THR 80 Ca 0.00 0.73 -0.19 0.00 -1.18 0.00 0.00 61.69 61.05 2k4t s THR 80 Cb 0.00 -4.46 0.03 0.00 1.34 0.00 0.00 72.50 69.41 2k4t s THR 80 CO 0.00 -1.16 0.60 -0.76 -0.54 0.00 0.00 174.62 172.76 2k4t s LEU 81 N 5.83 4.73 -0.65 4.79 2.01 -0.25 -1.59 118.68 133.55 2k4t s LEU 81 Ca 0.52 -0.61 -0.07 0.00 0.01 0.00 0.00 54.13 53.98 2k4t s LEU 81 Cb -0.10 -2.56 0.17 0.00 0.01 0.00 0.00 46.19 43.71 2k4t s LEU 81 CO 0.26 -0.78 0.51 -0.83 1.01 0.00 0.00 176.35 176.52 2k4t s GLY 82 N 2.20 2.45 0.24 -3.19 0.00 0.93 -1.22 107.32 108.72 2k4t s GLY 82 Ca 0.18 -3.12 0.11 0.00 0.00 0.00 0.00 44.72 41.89 2k4t s GLY 82 CO 0.15 1.15 -0.20 -1.08 0.00 0.00 0.00 173.10 173.12 2k4t s THR 83 N 0.31 2.28 -2.12 0.90 -1.32 0.66 0.03 115.64 116.39 2k4t s THR 83 Ca 0.15 -2.24 0.00 0.00 -1.21 0.00 0.00 61.69 58.39 2k4t s THR 83 Cb -0.19 -2.17 0.00 0.00 -1.51 0.00 0.00 72.50 68.63 2k4t s THR 83 CO -0.04 -0.34 0.00 1.21 -2.21 0.00 0.00 174.62 173.23 2k4t n GLU 84 N -0.27 0.00 -3.88 7.08 0.00 0.26 -1.91 120.64 121.93 2k4t n GLU 84 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 57.16 56.97 2k4t n GLU 84 Cb 0.59 0.00 -0.09 0.00 0.00 0.00 0.00 31.44 31.93 2k4t n GLU 84 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.13 178.09 2k4t s ILE 85 N -3.39 0.10 -0.05 6.31 -5.25 -0.99 -1.59 121.20 116.35 2k4t s ILE 85 Ca 0.00 -0.86 0.00 0.00 -0.99 0.00 0.00 60.65 58.81 2k4t s ILE 85 Cb 0.00 -0.71 0.03 0.00 2.95 0.00 0.00 42.46 44.73 2k4t s ILE 85 CO 0.00 -0.47 -0.01 0.28 -1.79 0.00 0.00 174.94 172.94 2k4t s THR 86 N -2.07 0.35 -0.23 8.37 -1.32 0.69 -1.57 115.64 119.86 2k4t s THR 86 Ca -0.09 0.03 -0.10 0.00 -1.21 0.00 0.00 61.69 60.31 2k4t s THR 86 Cb -0.04 -0.44 -0.05 0.00 -1.51 0.00 0.00 72.50 70.46 2k4t s THR 86 CO -0.02 0.21 0.16 0.54 -2.21 0.00 0.00 174.62 173.30 2k4t s VAL 87 N 1.26 5.37 0.02 5.08 0.11 0.10 -1.20 120.40 131.14 2k4t s VAL 87 Ca -0.06 0.19 0.08 0.00 -2.93 0.00 0.00 61.98 59.27 2k4t s VAL 87 Cb -0.13 -3.50 -0.02 0.00 -1.53 0.00 0.00 36.38 31.19 2k4t s VAL 87 CO -0.02 0.36 -0.25 -1.83 -3.33 0.00 0.00 175.10 170.03 2k4t s GLU 88 N 0.93 1.83 -0.77 1.54 -1.05 -0.17 -1.13 118.70 119.88 2k4t s GLU 88 Ca 0.08 -1.01 -0.03 0.00 -0.15 0.00 0.00 54.97 53.85 2k4t s GLU 88 Cb -0.13 -1.91 -0.04 0.00 -0.44 0.00 0.00 34.13 31.61 2k4t s GLU 88 CO 0.03 0.51 0.69 -0.25 0.95 0.00 0.00 175.26 177.19 2k4t n ASP 89 N 2.03 -6.12 -4.41 0.83 9.92 -1.25 -0.44 116.55 117.11 2k4t n ASP 89 Ca -0.17 -0.41 -0.32 0.00 -0.53 0.00 0.00 54.79 53.37 2k4t n ASP 89 Cb 0.52 -4.42 0.17 0.00 -0.64 0.00 0.00 41.12 36.75 2k4t n ASP 89 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 2k4t n GLN 90 N -2.49 -1.16 0.18 -1.24 -0.06 0.60 -4.50 117.38 108.71 2k4t n GLN 90 Ca -0.04 -0.30 0.17 0.00 -2.00 0.00 0.00 57.00 54.82 2k4t n GLN 90 Cb 0.57 -1.93 0.79 0.00 -4.06 0.00 0.00 30.24 25.60 2k4t n GLN 90 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 2k4t h LEU 91 N -1.99 0.00 -0.34 1.69 3.38 -1.93 0.25 115.31 116.37 2k4t h LEU 91 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2k4t h LEU 91 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2k4t h LEU 91 CO 0.39 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.92 2k4t n ALA 92 N -2.40 1.58 -3.01 1.53 0.00 -1.26 -4.92 120.51 112.03 2k4t n ALA 92 Ca 0.02 0.02 -0.02 0.00 0.00 0.00 0.00 53.44 53.46 2k4t n ALA 92 Cb 0.34 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2k4t n ALA 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k4t n ARG 93 N -1.82 -1.59 0.00 0.00 3.00 0.89 -4.74 116.66 112.40 2k4t n ARG 93 Ca 0.02 1.66 0.00 0.00 -0.01 0.00 0.00 57.85 59.52 2k4t n ARG 93 Cb 0.17 -5.75 0.00 0.00 0.00 0.00 0.00 32.46 26.89 2k4t n ARG 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k4t n GLY 94 N -1.40 0.37 3.73 -0.13 0.00 -1.26 -5.02 105.19 101.47 2k4t n GLY 94 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 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 3.81 -0.01 0.99 1.43 -1.26 -2.09 118.68 121.54 2k4t s LEU 95 Ca 0.00 0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.33 2k4t s LEU 95 Cb 0.00 -1.89 0.00 0.00 0.03 0.00 0.00 46.19 44.33 2k4t s LEU 95 CO 0.00 0.37 -0.04 -0.75 0.23 0.00 0.00 176.35 176.16 2k4t s LYS 96 N -0.80 0.42 0.04 1.70 2.36 -0.40 -0.29 119.74 122.77 2k4t s LYS 96 Ca 0.13 -0.13 0.05 0.00 -2.55 0.00 0.00 55.97 53.47 2k4t s LYS 96 Cb -0.12 -0.44 -0.02 0.00 -1.05 0.00 0.00 37.83 36.20 2k4t s LYS 96 CO 0.03 0.05 -0.14 -1.17 1.55 0.00 0.00 175.35 175.66 2k4t s LEU 97 N 0.17 2.18 -0.04 5.43 0.20 -0.28 -0.09 118.68 126.24 2k4t s LEU 97 Ca -0.01 -0.47 -0.02 0.00 0.69 0.00 0.00 54.13 54.31 2k4t s LEU 97 Cb -0.05 -0.61 0.03 0.00 -0.43 0.00 0.00 46.19 45.13 2k4t s LEU 97 CO -0.00 0.03 0.07 -0.89 -0.29 0.00 0.00 176.35 175.27 2k4t s THR 98 N -0.88 -0.12 -0.15 3.68 2.01 0.16 0.00 115.64 120.34 2k4t s THR 98 Ca 0.01 0.41 -0.01 0.00 0.31 0.00 0.00 61.69 62.42 2k4t s THR 98 Cb -0.08 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.26 2k4t s THR 98 CO 0.01 0.17 -0.12 0.12 -0.69 0.00 0.00 174.62 174.11 2k4t s PHE 99 N 2.14 2.83 0.03 4.92 2.19 -0.61 -0.11 117.98 129.38 2k4t s PHE 99 Ca 0.04 -0.77 0.08 0.00 0.33 0.00 0.00 56.93 56.61 2k4t s PHE 99 Cb -0.12 -1.89 -0.02 0.00 -1.31 0.00 0.00 43.02 39.67 2k4t s PHE 99 CO -0.03 -0.32 -0.23 0.34 1.83 0.00 0.00 175.22 176.81 2k4t s ASP 100 N 0.62 2.76 -0.06 6.13 -1.08 0.31 -2.33 116.67 123.01 2k4t s ASP 100 Ca -0.07 -0.52 -0.01 0.00 -0.52 0.00 0.00 52.55 51.43 2k4t s ASP 100 Cb -0.15 -0.26 0.03 0.00 -1.46 0.00 0.00 42.92 41.08 2k4t s ASP 100 CO 0.03 0.22 -0.00 -0.55 0.52 0.00 0.00 175.17 175.39 2k4t s SER 101 N -1.04 1.35 -0.05 -0.34 0.15 -0.80 -1.38 113.70 111.59 2k4t s SER 101 Ca 0.09 -0.08 0.05 0.00 0.70 0.00 0.00 55.95 56.71 2k4t s SER 101 Cb -0.09 -0.41 -0.01 0.00 -1.71 0.00 0.00 66.02 63.80 2k4t s SER 101 CO 0.01 -0.17 -0.20 -0.55 1.20 0.00 0.00 173.24 173.54 2k4t s SER 102 N 1.72 2.43 -0.06 5.45 0.15 -0.33 -0.24 113.70 122.81 2k4t s SER 102 Ca 0.01 -0.40 -0.10 0.00 0.70 0.00 0.00 55.95 56.16 2k4t s SER 102 Cb -0.13 -0.64 0.02 0.00 -1.71 0.00 0.00 66.02 63.56 2k4t s SER 102 CO -0.04 0.19 0.26 0.12 1.20 0.00 0.00 173.24 174.96 2k4t s PHE 103 N -0.05 -0.21 -0.44 3.44 5.36 -0.35 -0.29 117.98 125.43 2k4t s PHE 103 Ca -0.03 0.47 -0.00 0.00 -0.96 0.00 0.00 56.93 56.41 2k4t s PHE 103 Cb -0.12 0.07 0.12 0.00 -0.34 0.00 0.00 43.02 42.75 2k4t s PHE 103 CO 0.02 -0.22 0.21 -1.12 -1.46 0.00 0.00 175.22 172.65 2k4t s SER 104 N -0.45 5.01 0.22 6.13 0.01 0.24 -1.09 113.70 123.78 2k4t s SER 104 Ca -0.06 -2.34 -0.01 0.00 1.31 0.00 0.00 55.95 54.86 2k4t s SER 104 Cb -0.04 -1.76 0.22 0.00 0.21 0.00 0.00 66.02 64.65 2k4t s SER 104 CO 0.01 -0.43 1.58 1.55 0.41 0.00 0.00 173.24 176.37 2k4t h PRO 105 N 7.56 0.53 0.07 12.44 0.13 -1.88 -3.32 132.00 147.53 2k4t h PRO 105 Ca -0.08 -0.28 -0.00 0.00 -0.87 0.00 0.00 66.00 64.77 2k4t h PRO 105 Cb 1.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2k4t h PRO 105 CO 0.65 0.86 -0.03 -0.91 -0.23 0.00 0.00 178.00 178.34 2k4t h ASN 106 N 0.43 -0.08 -1.75 1.44 4.21 -1.93 -3.46 115.58 114.45 2k4t h ASN 106 Ca 0.03 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.42 2k4t h ASN 106 Cb 0.93 0.02 -0.28 0.00 -1.12 0.00 0.00 38.32 37.87 2k4t h ASN 106 CO 0.08 -0.01 -0.46 0.42 -1.29 0.00 0.00 177.43 176.17 2k4t s THR 107 N -2.06 -0.66 0.00 2.81 -4.23 -1.26 -5.09 115.64 105.15 2k4t s THR 107 Ca -0.01 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.40 2k4t s THR 107 Cb 0.00 -0.87 0.00 0.00 1.34 0.00 0.00 72.50 72.97 2k4t s THR 107 CO 0.04 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 2k4t n GLY 108 N 5.37 -0.65 2.13 3.99 0.00 -1.25 -4.90 105.19 109.88 2k4t n GLY 108 Ca -0.02 0.39 0.02 0.00 0.00 0.00 0.00 46.02 46.41 2k4t n GLY 108 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2k4t n LYS 109 N 0.00 0.06 -4.31 1.61 2.85 -1.25 -4.93 118.16 112.19 2k4t n LYS 109 Ca 0.00 -0.36 -0.31 0.00 -1.05 0.00 0.00 58.31 56.59 2k4t n LYS 109 Cb 0.00 0.63 -0.10 0.00 -0.65 0.00 0.00 35.03 34.91 2k4t n LYS 109 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 2k4t s LYS 110 N -2.00 2.43 -0.22 -1.58 2.20 -1.26 -0.59 119.74 118.72 2k4t s LYS 110 Ca 0.17 -0.84 -0.19 0.00 -0.36 0.00 0.00 55.97 54.75 2k4t s LYS 110 Cb -0.00 -2.46 0.06 0.00 -1.51 0.00 0.00 37.83 33.92 2k4t s LYS 110 CO -0.01 0.56 0.57 -0.80 -0.36 0.00 0.00 175.35 175.31 2k4t s ASN 111 N -1.87 -0.61 -0.02 1.43 0.01 0.61 -4.95 114.94 109.53 2k4t s ASN 111 Ca 0.21 1.16 0.07 0.00 -0.71 0.00 0.00 52.86 53.58 2k4t s ASN 111 Cb -0.11 1.16 -0.02 0.00 0.41 0.00 0.00 41.25 42.69 2k4t s ASN 111 CO 0.12 -0.20 -0.22 0.00 -1.51 0.00 0.00 177.10 175.29 2k4t s ALA 112 N 0.44 1.83 0.03 0.60 0.00 -1.25 -1.19 121.76 122.22 2k4t s ALA 112 Ca -0.01 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.03 2k4t s ALA 112 Cb -0.04 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.58 2k4t s ALA 112 CO -0.01 0.44 -0.07 0.15 0.00 0.00 0.00 175.76 176.27 2k4t s LYS 113 N -0.47 0.47 -0.00 0.00 1.02 -0.48 -1.35 119.74 118.93 2k4t s LYS 113 Ca 0.07 -0.59 -0.01 0.00 0.02 0.00 0.00 55.97 55.46 2k4t s LYS 113 Cb -0.09 -0.27 -0.00 0.00 -0.52 0.00 0.00 37.83 36.94 2k4t s LYS 113 CO -0.00 0.05 0.02 -1.50 -0.92 0.00 0.00 175.35 173.00 2k4t s ILE 114 N -1.06 0.04 -0.02 2.17 -1.16 -0.20 -0.53 121.20 120.45 2k4t s ILE 114 Ca -0.08 -0.37 0.03 0.00 -0.51 0.00 0.00 60.65 59.73 2k4t s ILE 114 Cb -0.08 -0.16 -0.00 0.00 0.61 0.00 0.00 42.46 42.83 2k4t s ILE 114 CO 0.00 -0.20 -0.11 -0.54 -2.81 0.00 0.00 174.94 171.28 2k4t s LYS 115 N -0.61 1.07 -0.23 3.50 3.01 0.85 -0.10 119.74 127.23 2k4t s LYS 115 Ca -0.07 -0.39 0.01 0.00 -1.01 0.00 0.00 55.97 54.51 2k4t s LYS 115 Cb -0.04 -1.00 0.06 0.00 -1.01 0.00 0.00 37.83 35.84 2k4t s LYS 115 CO -0.00 0.18 -0.07 0.99 0.51 0.00 0.00 175.35 176.96 2k4t s THR 116 N 0.00 1.60 -0.14 2.17 2.01 0.79 -0.66 115.64 121.41 2k4t s THR 116 Ca -0.00 -1.19 -0.07 0.00 0.31 0.00 0.00 61.69 60.74 2k4t s THR 116 Cb -0.07 -1.81 -0.04 0.00 0.01 0.00 0.00 72.50 70.59 2k4t s THR 116 CO 0.00 -0.03 0.10 -0.83 -0.69 0.00 0.00 174.62 173.18 2k4t s GLY 117 N 1.38 2.03 -0.04 4.40 0.00 0.87 -0.26 107.32 115.70 2k4t s GLY 117 Ca -0.05 -0.70 0.05 0.00 0.00 0.00 0.00 44.72 44.02 2k4t s GLY 117 CO -0.07 -0.22 -0.17 -0.47 0.00 0.00 0.00 173.10 172.17 2k4t s TYR 118 N -0.45 1.69 -0.20 1.90 5.04 0.09 -1.28 117.35 124.15 2k4t s TYR 118 Ca 0.11 -0.45 -0.09 0.00 -2.44 0.00 0.00 57.07 54.20 2k4t s TYR 118 Cb -0.12 -1.13 -0.05 0.00 0.35 0.00 0.00 41.96 41.02 2k4t s TYR 118 CO 0.02 -0.13 0.10 0.21 -1.34 0.00 0.00 175.55 174.41 2k4t s LYS 119 N -0.07 4.09 0.12 4.97 2.20 -0.89 -1.44 119.74 128.72 2k4t s LYS 119 Ca -0.01 -0.27 0.00 0.00 -0.36 0.00 0.00 55.97 55.32 2k4t s LYS 119 Cb -0.10 -3.35 -0.00 0.00 -1.51 0.00 0.00 37.83 32.87 2k4t s LYS 119 CO 0.01 0.27 0.00 -2.13 -0.36 0.00 0.00 175.35 173.15 2k4t n ARG 120 N 3.59 1.63 0.03 4.03 0.63 -0.82 -4.95 116.66 120.79 2k4t n ARG 120 Ca -0.16 -0.86 -0.07 0.00 -0.92 0.00 0.00 57.85 55.84 2k4t n ARG 120 Cb 0.52 0.25 -0.04 0.00 0.45 0.00 0.00 32.46 33.64 2k4t n ARG 120 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2k4t h GLU 121 N 0.00 -0.28 -0.01 -0.14 5.08 -2.04 -3.36 114.58 113.82 2k4t h GLU 121 Ca -0.10 0.02 -0.16 0.00 -1.00 0.00 0.00 59.36 58.12 2k4t h GLU 121 Cb 0.30 0.06 -0.35 0.00 0.50 0.00 0.00 28.75 29.26 2k4t h GLU 121 CO 0.16 -0.19 -0.98 0.72 -1.00 0.00 0.00 179.01 177.72 2k4t n HIS 122 N -3.74 0.03 -3.77 4.33 8.25 -1.26 -5.06 115.22 114.00 2k4t n HIS 122 Ca -0.03 -0.65 -0.13 0.00 -0.26 0.00 0.00 57.72 56.65 2k4t n HIS 122 Cb 0.17 -0.16 -0.13 0.00 1.12 0.00 0.00 29.99 30.98 2k4t n HIS 122 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 2k4t s ILE 123 N -0.46 -0.03 -0.16 1.59 2.07 -1.26 -3.84 121.20 119.12 2k4t s ILE 123 Ca 0.34 0.10 -0.05 0.00 -1.41 0.00 0.00 60.65 59.63 2k4t s ILE 123 Cb 0.39 -0.27 -0.03 0.00 0.13 0.00 0.00 42.46 42.67 2k4t s ILE 123 CO -0.16 0.04 0.01 0.20 -1.91 0.00 0.00 174.94 173.13 2k4t s ASN 124 N 0.76 5.21 0.01 4.50 0.01 -0.40 -1.95 114.94 123.08 2k4t s ASN 124 Ca -0.06 -0.02 0.03 0.00 -0.71 0.00 0.00 52.86 52.11 2k4t s ASN 124 Cb -0.07 -1.85 -0.04 0.00 0.41 0.00 0.00 41.25 39.70 2k4t s ASN 124 CO -0.04 0.18 -0.04 -0.22 -1.51 0.00 0.00 177.10 175.47 2k4t s LEU 125 N 0.29 3.30 -0.37 0.60 2.96 -0.52 -0.97 118.68 123.98 2k4t s LEU 125 Ca -0.00 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 2k4t s LEU 125 Cb -0.13 -1.91 0.15 0.00 0.50 0.00 0.00 46.19 44.80 2k4t s LEU 125 CO 0.02 0.27 0.25 -0.83 -1.32 0.00 0.00 176.35 174.73 2k4t s GLY 126 N -1.56 0.88 -0.45 7.98 0.00 0.86 -0.73 107.32 114.31 2k4t s GLY 126 Ca 0.19 -1.95 -0.19 0.00 0.00 0.00 0.00 44.72 42.77 2k4t s GLY 126 CO 0.09 2.14 0.53 0.00 0.00 0.00 0.00 173.10 175.86 2k4t s ASP 128 N 2.09 3.52 0.08 0.00 -4.77 -0.22 -0.15 116.67 117.22 2k4t s ASP 128 Ca 0.15 -0.51 0.10 0.00 -3.30 0.00 0.00 52.55 48.99 2k4t s ASP 128 Cb -0.17 -0.46 -0.03 0.00 -1.09 0.00 0.00 42.92 41.16 2k4t s ASP 128 CO 0.14 0.25 -0.26 -0.32 0.70 0.00 0.00 175.17 175.69 2k4t s MET 129 N -1.38 1.55 -0.04 2.11 1.75 0.86 -0.09 119.30 124.07 2k4t s MET 129 Ca 0.13 -1.19 0.06 0.00 -1.25 0.00 0.00 55.69 53.44 2k4t s MET 129 Cb -0.10 -1.86 -0.01 0.00 2.84 0.00 0.00 34.83 35.70 2k4t s MET 129 CO 0.04 0.46 -0.21 -0.51 -0.65 0.00 0.00 175.02 174.15 2k4t s ASP 130 N -1.60 2.56 -0.28 1.11 1.01 0.14 -1.03 116.67 118.58 2k4t s ASP 130 Ca 0.12 -0.41 -0.10 0.00 0.71 0.00 0.00 52.55 52.87 2k4t s ASP 130 Cb -0.10 -0.53 -0.03 0.00 1.01 0.00 0.00 42.92 43.26 2k4t s ASP 130 CO 0.04 0.22 0.15 0.12 0.21 0.00 0.00 175.17 175.91 2k4t s PHE 131 N -0.24 3.17 0.20 4.23 5.36 -0.46 -1.37 117.98 128.87 2k4t s PHE 131 Ca 0.01 -0.19 0.08 0.00 -0.96 0.00 0.00 56.93 55.87 2k4t s PHE 131 Cb -0.11 -2.33 -0.05 0.00 -0.34 0.00 0.00 43.02 40.19 2k4t s PHE 131 CO 0.01 -0.28 -0.14 -0.51 -1.46 0.00 0.00 175.22 172.84 2k4t s ASP 132 N 1.69 2.52 0.34 6.13 1.01 -1.23 -3.91 116.67 123.21 2k4t s ASP 132 Ca 0.06 -1.01 0.03 0.00 0.71 0.00 0.00 52.55 52.35 2k4t s ASP 132 Cb -0.16 -0.13 0.65 0.00 1.01 0.00 0.00 42.92 44.29 2k4t s ASP 132 CO 0.08 -0.17 1.97 0.16 0.21 0.00 0.00 175.17 177.41 2k4t h ILE 133 N 2.62 1.09 0.34 0.77 3.07 -1.98 -2.89 117.51 120.53 2k4t h ILE 133 Ca -0.38 -0.30 -0.02 0.00 1.55 0.00 0.00 64.86 65.72 2k4t h ILE 133 Cb 1.22 0.15 0.00 0.00 -0.27 0.00 0.00 36.82 37.92 2k4t h ILE 133 CO 0.61 0.16 -0.17 0.00 -1.05 0.00 0.00 178.15 177.71 2k4t h ALA 134 N 1.58 -0.46 -1.04 0.16 0.00 -2.02 -3.49 119.26 113.99 2k4t h ALA 134 Ca 0.30 -0.19 0.37 0.00 0.00 0.00 0.00 54.91 55.39 2k4t h ALA 134 Cb 0.11 0.18 -0.17 0.00 0.00 0.00 0.00 17.79 17.90 2k4t h ALA 134 CO -0.09 -0.58 0.98 0.20 0.00 0.00 0.00 179.25 179.76 2k4t s GLY 135 N -2.72 -0.36 0.25 0.00 0.00 -1.09 -5.08 107.32 98.31 2k4t s GLY 135 Ca -0.14 1.39 -0.30 0.00 0.00 0.00 0.00 44.72 45.68 2k4t s GLY 135 CO 0.52 0.39 1.27 2.56 0.00 0.00 0.00 173.10 177.83 2k4t s PRO 136 N -2.04 4.43 -0.03 2.90 0.04 -1.26 -3.56 135.00 135.48 2k4t s PRO 136 Ca 0.13 2.05 0.06 0.00 0.04 0.00 0.00 61.00 63.29 2k4t s PRO 136 Cb 0.04 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.41 2k4t s PRO 136 CO -0.05 -0.15 -0.22 -1.12 0.04 0.00 0.00 177.00 175.50 2k4t s SER 137 N -0.13 2.68 -0.32 6.66 0.01 -0.47 -3.93 113.70 118.20 2k4t s SER 137 Ca 0.52 -0.42 -0.03 0.00 1.31 0.00 0.00 55.95 57.32 2k4t s SER 137 Cb -0.37 -0.47 0.05 0.00 0.21 0.00 0.00 66.02 65.45 2k4t s SER 137 CO 0.43 0.25 0.05 -0.63 0.41 0.00 0.00 173.24 173.75 2k4t s ILE 138 N -0.36 3.26 -0.31 1.44 1.09 -0.07 -0.68 121.20 125.57 2k4t s ILE 138 Ca 0.04 -1.36 -0.11 0.00 -1.10 0.00 0.00 60.65 58.12 2k4t s ILE 138 Cb -0.10 -2.90 -0.02 0.00 -1.06 0.00 0.00 42.46 38.38 2k4t s ILE 138 CO 0.01 -0.18 0.18 -0.13 -0.10 0.00 0.00 174.94 174.72 2k4t s ARG 139 N 1.29 3.52 -0.15 2.79 0.52 0.87 -0.13 118.95 127.66 2k4t s ARG 139 Ca -0.03 -0.61 -0.06 0.00 -0.52 0.00 0.00 55.73 54.51 2k4t s ARG 139 Cb -0.20 -3.65 -0.04 0.00 0.52 0.00 0.00 34.95 31.58 2k4t s ARG 139 CO -0.00 -0.37 0.06 0.20 0.02 0.00 0.00 175.30 175.21 2k4t s GLY 140 N 1.68 1.93 -0.07 -3.53 0.00 0.77 -1.06 107.32 107.03 2k4t s GLY 140 Ca 0.06 -0.74 0.02 0.00 0.00 0.00 0.00 44.72 44.05 2k4t s GLY 140 CO 0.08 -0.14 -0.11 0.00 0.00 0.00 0.00 173.10 172.94 2k4t s ALA 141 N -0.09 1.21 -0.07 3.20 0.00 0.00 -1.30 121.76 124.71 2k4t s ALA 141 Ca 0.07 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 51.65 2k4t s ALA 141 Cb -0.12 -0.62 -0.02 0.00 0.00 0.00 0.00 23.12 22.36 2k4t s ALA 141 CO 0.01 -0.00 -0.14 -1.17 0.00 0.00 0.00 175.76 174.46 2k4t s LEU 142 N 0.89 2.73 -0.13 0.00 2.96 0.39 -0.10 118.68 125.43 2k4t s LEU 142 Ca -0.10 -0.24 0.00 0.00 -0.22 0.00 0.00 54.13 53.57 2k4t s LEU 142 Cb -0.15 -1.57 0.02 0.00 0.50 0.00 0.00 46.19 44.99 2k4t s LEU 142 CO 0.01 0.29 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.52 2k4t s VAL 143 N -0.40 1.37 -0.23 1.68 1.01 -0.14 -0.22 120.40 123.47 2k4t s VAL 143 Ca 0.05 -0.52 -0.12 0.00 0.00 0.00 0.00 61.98 61.39 2k4t s VAL 143 Cb -0.12 -1.30 -0.05 0.00 0.00 0.00 0.00 36.38 34.91 2k4t s VAL 143 CO 0.02 0.42 0.21 -0.76 0.00 0.00 0.00 175.10 175.00 2k4t s LEU 144 N 1.44 4.13 -0.32 3.92 2.01 0.81 -1.27 118.68 129.39 2k4t s LEU 144 Ca 0.02 0.20 -0.01 0.00 0.01 0.00 0.00 54.13 54.36 2k4t s LEU 144 Cb -0.13 -2.20 0.07 0.00 0.01 0.00 0.00 46.19 43.93 2k4t s LEU 144 CO -0.08 0.03 0.03 -0.83 1.01 0.00 0.00 176.35 176.52 2k4t s GLY 145 N 1.05 1.80 0.18 -3.19 0.00 -1.25 -1.53 107.32 104.38 2k4t s GLY 145 Ca 0.10 -1.96 0.10 0.00 0.00 0.00 0.00 44.72 42.96 2k4t s GLY 145 CO 0.05 0.76 -0.20 -0.19 0.00 0.00 0.00 173.10 173.52 2k4t s TYR 146 N 1.19 1.99 -0.60 1.90 2.02 0.10 -4.83 117.35 119.12 2k4t s TYR 146 Ca -0.02 -0.43 -0.26 0.00 -0.37 0.00 0.00 57.07 55.99 2k4t s TYR 146 Cb -0.20 -0.99 -0.09 0.00 -0.40 0.00 0.00 41.96 40.28 2k4t s TYR 146 CO -0.03 0.40 2.40 -1.21 -1.57 0.00 0.00 175.55 175.54 2k4t s GLU 147 N -2.78 1.93 0.00 -0.62 2.02 -1.26 -1.36 118.70 116.64 2k4t s GLU 147 Ca 0.18 1.07 0.00 0.00 0.02 0.00 0.00 54.97 56.24 2k4t s GLU 147 Cb -0.06 -4.65 0.00 0.00 0.10 0.00 0.00 34.13 29.51 2k4t s GLU 147 CO 0.08 -3.68 0.00 0.41 0.02 0.00 0.00 175.26 172.09 2k4t n GLY 148 N 6.28 2.96 3.41 -1.39 0.00 -1.26 -5.02 105.19 110.16 2k4t n GLY 148 Ca 0.40 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.11 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 -2.32 2.47 -0.07 1.61 0.52 -0.46 -1.33 118.94 119.36 2k4t s TRP 149 Ca 0.00 -0.31 -0.05 0.00 0.02 0.00 0.00 56.10 55.75 2k4t s TRP 149 Cb 0.00 -1.46 0.03 0.00 -1.15 0.00 0.00 33.47 30.89 2k4t s TRP 149 CO 0.00 0.18 0.17 -0.48 0.02 0.00 0.00 176.95 176.84 2k4t s LEU 150 N -1.24 1.08 0.20 2.99 2.34 -0.25 0.01 118.68 123.81 2k4t s LEU 150 Ca 0.13 0.36 0.03 0.00 0.06 0.00 0.00 54.13 54.70 2k4t s LEU 150 Cb -0.10 0.55 -0.05 0.00 -0.56 0.00 0.00 46.19 46.03 2k4t s LEU 150 CO 0.03 -0.09 -0.01 0.00 -1.06 0.00 0.00 176.35 175.22 2k4t s ALA 151 N 0.50 1.55 -0.25 1.48 0.00 -0.58 -1.16 121.76 123.30 2k4t s ALA 151 Ca -0.03 -1.66 -0.23 0.00 0.00 0.00 0.00 51.96 50.04 2k4t s ALA 151 Cb -0.05 0.49 0.06 0.00 0.00 0.00 0.00 23.12 23.62 2k4t s ALA 151 CO -0.02 -0.27 0.66 0.20 0.00 0.00 0.00 175.76 176.32 2k4t s GLY 152 N -3.23 -0.49 -0.08 0.00 0.00 0.93 -0.14 107.32 104.30 2k4t s GLY 152 Ca 0.25 1.86 0.01 0.00 0.00 0.00 0.00 44.72 46.85 2k4t s GLY 152 CO 0.06 1.61 -0.10 -0.19 0.00 0.00 0.00 173.10 174.48 2k4t s TYR 153 N 0.38 1.43 -0.19 1.90 2.02 0.70 -0.03 117.35 123.56 2k4t s TYR 153 Ca -0.00 -0.60 -0.00 0.00 -0.37 0.00 0.00 57.07 56.09 2k4t s TYR 153 Cb -0.05 -1.11 0.01 0.00 -0.40 0.00 0.00 41.96 40.41 2k4t s TYR 153 CO 0.00 -0.36 -0.15 -0.65 -1.57 0.00 0.00 175.55 172.82 2k4t s GLN 154 N 1.07 3.14 0.01 -0.62 -0.21 -0.08 -0.46 119.66 122.51 2k4t s GLN 154 Ca -0.07 -0.76 -0.01 0.00 0.02 0.00 0.00 55.36 54.54 2k4t s GLN 154 Cb -0.14 -2.70 -0.01 0.00 1.00 0.00 0.00 33.01 31.16 2k4t s GLN 154 CO -0.01 -0.16 0.01 0.00 -2.12 0.00 0.00 175.29 173.00 2k4t s MET 155 N 1.25 0.30 -0.12 2.91 0.23 -0.42 -0.61 119.30 122.84 2k4t s MET 155 Ca 0.03 -0.47 -0.00 0.00 -1.03 0.00 0.00 55.69 54.22 2k4t s MET 155 Cb -0.14 0.11 0.02 0.00 -1.53 0.00 0.00 34.83 33.30 2k4t s MET 155 CO -0.08 -0.05 -0.09 -0.80 -2.03 0.00 0.00 175.02 171.97 2k4t s ASN 156 N -1.21 2.28 -0.08 -1.18 0.01 -1.25 -0.17 114.94 113.35 2k4t s ASN 156 Ca -0.13 -0.34 0.04 0.00 -0.71 0.00 0.00 52.86 51.71 2k4t s ASN 156 Cb -0.08 -0.92 -0.01 0.00 0.41 0.00 0.00 41.25 40.65 2k4t s ASN 156 CO -0.00 -0.10 -0.20 0.12 -1.51 0.00 0.00 177.10 175.40 2k4t s PHE 157 N 1.63 2.59 -0.19 2.20 2.19 0.82 -3.15 117.98 124.07 2k4t s PHE 157 Ca 0.04 -0.68 -0.07 0.00 0.33 0.00 0.00 56.93 56.55 2k4t s PHE 157 Cb -0.13 -1.68 -0.04 0.00 -1.31 0.00 0.00 43.02 39.86 2k4t s PHE 157 CO -0.08 -0.19 0.06 -1.21 1.83 0.00 0.00 175.22 175.62 2k4t s GLU 158 N -0.03 3.91 0.04 10.12 8.01 -1.26 -0.89 118.70 138.60 2k4t s GLU 158 Ca -0.06 -0.38 0.07 0.00 0.01 0.00 0.00 54.97 54.61 2k4t s GLU 158 Cb -0.15 -3.21 -0.23 0.00 -4.31 0.00 0.00 34.13 26.23 2k4t s GLU 158 CO 0.05 0.21 0.99 1.15 0.01 0.00 0.00 175.26 177.67 2k4t h THR 159 N 4.99 1.32 0.01 3.63 2.02 -1.96 0.24 112.91 123.16 2k4t h THR 159 Ca -0.36 -3.06 -0.24 0.00 0.77 0.00 0.00 66.41 63.52 2k4t h THR 159 Cb 1.17 2.69 -0.03 0.00 -1.74 0.00 0.00 68.15 70.24 2k4t h THR 159 CO 0.68 0.79 -1.22 0.00 0.37 0.00 0.00 175.52 176.13 2k4t h ALA 160 N 0.89 0.45 0.00 6.16 0.00 -1.95 -3.34 119.26 121.48 2k4t h ALA 160 Ca -0.15 -1.07 -0.21 0.00 0.00 0.00 0.00 54.91 53.49 2k4t h ALA 160 Cb 1.90 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.69 2k4t h ALA 160 CO 0.12 1.33 -2.06 1.63 0.00 0.00 0.00 179.25 180.27 2k4t n LYS 161 N -3.28 0.67 -3.51 0.00 4.01 -1.25 -5.02 118.16 109.77 2k4t n LYS 161 Ca -0.05 -0.02 -0.21 0.00 -0.51 0.00 0.00 58.31 57.51 2k4t n LYS 161 Cb 0.98 -1.58 0.05 0.00 -0.51 0.00 0.00 35.03 33.97 2k4t n LYS 161 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2k4t n SER 162 N -2.62 -4.11 -3.34 4.39 2.88 0.85 -5.00 113.62 106.67 2k4t n SER 162 Ca -0.19 -0.81 0.02 0.00 -1.33 0.00 0.00 58.87 56.57 2k4t n SER 162 Cb 0.90 -4.41 -0.03 0.00 -0.75 0.00 0.00 64.21 59.92 2k4t n SER 162 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2k4t s ARG 163 N -5.38 0.34 -0.09 -1.46 0.52 -1.22 -4.99 118.95 106.66 2k4t s ARG 163 Ca 0.27 0.76 -0.30 0.00 -0.52 0.00 0.00 55.73 55.95 2k4t s ARG 163 Cb -0.06 0.45 -0.04 0.00 0.52 0.00 0.00 34.95 35.82 2k4t s ARG 163 CO 0.79 -0.20 1.50 0.08 0.02 0.00 0.00 175.30 177.49 2k4t s VAL 164 N 2.66 3.85 0.00 3.52 1.01 -1.26 -4.10 120.40 126.07 2k4t s VAL 164 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.02 2k4t s VAL 164 Cb -0.09 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.63 2k4t s VAL 164 CO -0.17 -0.09 0.97 0.41 0.00 0.00 0.00 175.10 176.23 2k4t n THR 165 N 5.41 0.00 -3.77 3.92 -1.04 -1.19 -4.92 114.28 112.70 2k4t n THR 165 Ca 0.16 1.47 -0.10 0.00 -2.04 0.00 0.00 64.05 63.55 2k4t n THR 165 Cb 0.44 -2.37 -0.06 0.00 -1.82 0.00 0.00 70.33 66.51 2k4t n THR 165 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2k4t s GLN 166 N -2.90 0.91 -0.09 -2.82 1.11 -1.26 -5.10 119.66 109.52 2k4t s GLN 166 Ca 0.00 -0.80 0.02 0.00 0.01 0.00 0.00 55.36 54.59 2k4t s GLN 166 Cb 0.00 0.39 0.01 0.00 -1.01 0.00 0.00 33.01 32.40 2k4t s GLN 166 CO 0.00 -0.32 -0.13 -1.54 0.01 0.00 0.00 175.29 173.31 2k4t s SER 167 N -2.71 2.15 0.11 5.90 1.04 -1.26 -3.76 113.70 115.16 2k4t s SER 167 Ca 0.03 -0.36 0.09 0.00 0.48 0.00 0.00 55.95 56.18 2k4t s SER 167 Cb 0.03 -0.96 -0.04 0.00 0.10 0.00 0.00 66.02 65.15 2k4t s SER 167 CO -0.10 0.01 -0.20 0.20 0.98 0.00 0.00 173.24 174.13 2k4t s ASN 168 N 0.91 3.74 0.17 7.02 0.01 0.22 -2.27 114.94 124.75 2k4t s ASN 168 Ca -0.09 -0.58 0.07 0.00 -0.71 0.00 0.00 52.86 51.55 2k4t s ASN 168 Cb -0.15 -0.48 -0.04 0.00 0.41 0.00 0.00 41.25 40.98 2k4t s ASN 168 CO 0.00 0.19 -0.14 -0.36 -1.51 0.00 0.00 177.10 175.28 2k4t s PHE 169 N -1.08 1.58 -0.15 2.20 0.40 -0.32 -0.90 117.98 119.72 2k4t s PHE 169 Ca 0.16 -0.58 -0.11 0.00 -0.60 0.00 0.00 56.93 55.80 2k4t s PHE 169 Cb -0.10 -0.77 0.04 0.00 0.51 0.00 0.00 43.02 42.70 2k4t s PHE 169 CO 0.08 0.26 0.37 0.00 0.70 0.00 0.00 175.22 176.64 2k4t s ALA 170 N -2.69 -0.93 -0.18 5.36 0.00 0.95 -0.11 121.76 124.16 2k4t s ALA 170 Ca 0.17 1.19 -0.13 0.00 0.00 0.00 0.00 51.96 53.19 2k4t s ALA 170 Cb -0.02 -0.71 0.05 0.00 0.00 0.00 0.00 23.12 22.45 2k4t s ALA 170 CO 0.05 -0.20 0.45 0.54 0.00 0.00 0.00 175.76 176.59 2k4t s VAL 171 N 0.63 -0.01 0.07 0.00 0.11 -0.37 -0.05 120.40 120.78 2k4t s VAL 171 Ca -0.04 0.03 -0.26 0.00 -2.93 0.00 0.00 61.98 58.79 2k4t s VAL 171 Cb -0.05 -0.64 0.08 0.00 -1.53 0.00 0.00 36.38 34.24 2k4t s VAL 171 CO -0.04 0.01 0.73 -0.83 -3.33 0.00 0.00 175.10 171.65 2k4t s GLY 172 N 0.74 -0.54 0.00 6.54 0.00 -0.31 -0.03 107.32 113.72 2k4t s GLY 172 Ca -0.04 0.81 -0.05 0.00 0.00 0.00 0.00 44.72 45.44 2k4t s GLY 172 CO -0.05 0.32 0.08 -2.52 0.00 0.00 0.00 173.10 170.93 2k4t s TYR 173 N -3.23 0.08 -0.26 1.90 -0.85 0.54 -1.09 117.35 114.45 2k4t s TYR 173 Ca 0.02 -0.18 -0.07 0.00 -0.52 0.00 0.00 57.07 56.32 2k4t s TYR 173 Cb -0.01 -0.07 -0.01 0.00 0.38 0.00 0.00 41.96 42.24 2k4t s TYR 173 CO -0.09 -0.22 0.06 -1.59 -1.52 0.00 0.00 175.55 172.18 2k4t s LYS 174 N -1.16 3.43 -0.05 -3.49 -2.85 -0.45 -1.31 119.74 113.85 2k4t s LYS 174 Ca -0.13 -0.62 -0.01 0.00 -1.00 0.00 0.00 55.97 54.21 2k4t s LYS 174 Cb -0.07 -3.29 0.03 0.00 -2.06 0.00 0.00 37.83 32.44 2k4t s LYS 174 CO 0.01 -0.27 0.02 0.99 0.10 0.00 0.00 175.35 176.19 2k4t s THR 175 N 1.56 0.20 0.00 3.79 2.01 -1.16 -4.86 115.64 117.18 2k4t s THR 175 Ca 0.05 0.19 0.00 0.00 0.31 0.00 0.00 61.69 62.25 2k4t s THR 175 Cb -0.16 -0.37 0.00 0.00 0.01 0.00 0.00 72.50 71.99 2k4t s THR 175 CO 0.02 0.21 0.00 0.47 -0.69 0.00 0.00 174.62 174.63 2k4t n ASP 176 N 4.94 -2.54 0.32 3.53 8.00 -1.26 -3.55 116.55 125.99 2k4t n ASP 176 Ca -0.11 0.00 0.20 0.00 0.71 0.00 0.00 54.79 55.59 2k4t n ASP 176 Cb 0.50 0.00 1.08 0.00 -0.02 0.00 0.00 41.12 42.68 2k4t n ASP 176 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2k4t h GLU 177 N 0.00 0.00 -6.35 -1.24 5.08 -1.96 -3.42 114.58 106.69 2k4t h GLU 177 Ca 0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.91 2k4t h GLU 177 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 2k4t h GLU 177 CO 0.00 0.01 -0.32 -0.59 -1.00 0.00 0.00 179.01 177.10 2k4t s PHE 178 N -4.29 3.22 0.03 4.33 -0.12 -1.23 -3.38 117.98 116.54 2k4t s PHE 178 Ca -0.05 -0.09 0.02 0.00 -0.05 0.00 0.00 56.93 56.76 2k4t s PHE 178 Cb 0.14 -1.94 -0.02 0.00 -0.63 0.00 0.00 43.02 40.57 2k4t s PHE 178 CO 0.47 0.05 -0.06 1.14 -0.05 0.00 0.00 175.22 176.77 2k4t s GLN 179 N -4.19 0.44 -0.22 1.99 -2.07 0.39 -3.01 119.66 112.99 2k4t s GLN 179 Ca 0.43 -0.59 0.02 0.00 -1.82 0.00 0.00 55.36 53.40 2k4t s GLN 179 Cb -0.09 -0.21 0.04 0.00 -1.09 0.00 0.00 33.01 31.65 2k4t s GLN 179 CO 0.32 0.04 -0.15 -1.17 -1.32 0.00 0.00 175.29 173.00 2k4t s LEU 180 N -1.22 2.84 -0.15 2.60 1.98 -0.43 -0.99 118.68 123.31 2k4t s LEU 180 Ca -0.09 -1.05 0.02 0.00 -2.89 0.00 0.00 54.13 50.12 2k4t s LEU 180 Cb -0.08 -1.52 0.01 0.00 0.66 0.00 0.00 46.19 45.26 2k4t s LEU 180 CO -0.00 -0.10 -0.21 -1.38 -1.89 0.00 0.00 176.35 172.77 2k4t s HIS 181 N 1.19 2.69 0.09 5.38 -3.43 -0.52 -0.34 115.29 120.35 2k4t s HIS 181 Ca -0.02 -1.33 0.09 0.00 -0.80 0.00 0.00 55.06 53.00 2k4t s HIS 181 Cb -0.17 -1.83 -0.04 0.00 -1.43 0.00 0.00 32.58 29.11 2k4t s HIS 181 CO -0.09 -0.61 -0.23 0.99 -2.00 0.00 0.00 174.74 172.80 2k4t s THR 182 N 0.85 2.47 -0.04 -5.38 2.01 0.96 -1.45 115.64 115.05 2k4t s THR 182 Ca -0.06 -1.49 -0.02 0.00 0.31 0.00 0.00 61.69 60.43 2k4t s THR 182 Cb -0.15 -2.06 0.03 0.00 0.01 0.00 0.00 72.50 70.32 2k4t s THR 182 CO -0.03 0.21 0.10 0.21 -0.69 0.00 0.00 174.62 174.43 2k4t s ASN 183 N -1.75 -0.07 -0.07 3.53 2.47 0.75 -1.23 114.94 118.58 2k4t s ASN 183 Ca 0.14 0.20 0.03 0.00 0.42 0.00 0.00 52.86 53.66 2k4t s ASN 183 Cb -0.10 0.13 -0.02 0.00 -1.45 0.00 0.00 41.25 39.81 2k4t s ASN 183 CO 0.06 -0.10 -0.16 -0.69 -3.72 0.00 0.00 177.10 172.49 2k4t s VAL 184 N 0.72 2.87 -0.13 -5.21 1.01 0.84 -0.58 120.40 119.93 2k4t s VAL 184 Ca -0.06 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2k4t s VAL 184 Cb -0.08 -2.13 0.00 0.00 0.00 0.00 0.00 36.38 34.18 2k4t s VAL 184 CO -0.03 0.57 -0.20 0.20 0.00 0.00 0.00 175.10 175.64 2k4t s ASN 185 N -0.41 3.36 -1.91 3.32 0.01 -0.28 -1.17 114.94 117.86 2k4t s ASN 185 Ca 0.04 -0.52 0.00 0.00 -0.71 0.00 0.00 52.86 51.67 2k4t s ASN 185 Cb -0.12 -1.49 0.00 0.00 0.41 0.00 0.00 41.25 40.05 2k4t s ASN 185 CO 0.02 0.12 0.00 0.47 -1.51 0.00 0.00 177.10 176.20 2k4t n ASP 186 N 3.83 -5.19 -2.22 -1.22 8.00 -0.96 -1.41 116.55 117.39 2k4t n ASP 186 Ca -0.19 0.34 -0.13 0.00 0.71 0.00 0.00 54.79 55.52 2k4t n ASP 186 Cb 0.52 -4.53 -0.02 0.00 -0.02 0.00 0.00 41.12 37.08 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 -0.14 0.13 0.44 0.00 -1.23 -4.67 105.19 99.17 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 -0.37 0.00 0.00 0.00 173.32 172.95 2k4t n THR 188 N -3.08 0.00 -3.09 2.61 5.66 -0.70 -5.03 114.28 110.64 2k4t n THR 188 Ca -0.15 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.43 2k4t n THR 188 Cb 0.57 -0.18 -0.07 0.00 -1.55 0.00 0.00 70.33 69.11 2k4t n THR 188 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2k4t s GLU 189 N -1.32 3.46 -0.21 1.09 2.02 -0.50 -3.10 118.70 120.14 2k4t s GLU 189 Ca 0.00 -0.16 -0.15 0.00 0.02 0.00 0.00 54.97 54.68 2k4t s GLU 189 Cb 0.00 -3.89 -0.04 0.00 0.10 0.00 0.00 34.13 30.30 2k4t s GLU 189 CO 0.00 -0.90 0.36 0.12 0.02 0.00 0.00 175.26 174.85 2k4t s PHE 190 N 2.82 3.36 -0.09 1.61 2.19 1.00 -1.13 117.98 127.75 2k4t s PHE 190 Ca 0.24 0.54 0.03 0.00 0.33 0.00 0.00 56.93 58.07 2k4t s PHE 190 Cb -0.14 -2.48 0.01 0.00 -1.31 0.00 0.00 43.02 39.10 2k4t s PHE 190 CO 0.18 0.00 -0.17 0.20 1.83 0.00 0.00 175.22 177.26 2k4t s GLY 191 N 1.05 1.03 -0.03 13.12 0.00 0.26 0.09 107.32 122.83 2k4t s GLY 191 Ca 0.17 -0.67 0.03 0.00 0.00 0.00 0.00 44.72 44.25 2k4t s GLY 191 CO 0.07 -0.00 -0.10 -0.32 0.00 0.00 0.00 173.10 172.75 2k4t s GLY 192 N 0.63 0.58 -0.03 0.20 0.00 -0.44 -0.18 107.32 108.08 2k4t s GLY 192 Ca -0.14 -0.35 -0.02 0.00 0.00 0.00 0.00 44.72 44.20 2k4t s GLY 192 CO 0.04 -0.07 0.08 -0.56 0.00 0.00 0.00 173.10 172.60 2k4t s SER 193 N 0.25 -0.07 -0.04 1.64 0.01 -0.53 -1.03 113.70 113.93 2k4t s SER 193 Ca -0.04 0.16 0.05 0.00 1.31 0.00 0.00 55.95 57.43 2k4t s SER 193 Cb -0.10 0.14 -0.02 0.00 0.21 0.00 0.00 66.02 66.25 2k4t s SER 193 CO 0.01 -0.05 -0.18 -0.63 0.41 0.00 0.00 173.24 172.80 2k4t s ILE 194 N 0.25 2.75 -0.17 1.44 1.09 0.85 -1.44 121.20 125.97 2k4t s ILE 194 Ca -0.02 -0.84 0.00 0.00 -1.10 0.00 0.00 60.65 58.70 2k4t s ILE 194 Cb -0.03 -2.05 0.00 0.00 -1.06 0.00 0.00 42.46 39.33 2k4t s ILE 194 CO -0.01 0.59 -0.16 -0.47 -0.10 0.00 0.00 174.94 174.79 2k4t s TYR 195 N -0.66 2.78 -0.38 3.97 5.04 -0.16 -0.48 117.35 127.46 2k4t s TYR 195 Ca 0.10 -1.21 -0.02 0.00 -2.44 0.00 0.00 57.07 53.50 2k4t s TYR 195 Cb -0.11 -1.91 0.10 0.00 0.35 0.00 0.00 41.96 40.39 2k4t s TYR 195 CO 0.00 -0.58 0.15 -0.65 -1.34 0.00 0.00 175.55 173.13 2k4t s GLN 196 N 1.00 2.03 -0.12 4.97 -0.21 0.94 -0.46 119.66 127.81 2k4t s GLN 196 Ca -0.02 -1.72 -0.05 0.00 0.02 0.00 0.00 55.36 53.60 2k4t s GLN 196 Cb -0.15 -3.47 -0.04 0.00 1.00 0.00 0.00 33.01 30.36 2k4t s GLN 196 CO -0.04 -0.97 0.06 -1.59 -2.12 0.00 0.00 175.29 170.63 2k4t s LYS 197 N 1.14 3.41 0.24 2.91 -2.85 -1.22 -1.04 119.74 122.33 2k4t s LYS 197 Ca 0.06 -0.31 0.07 0.00 -1.00 0.00 0.00 55.97 54.79 2k4t s LYS 197 Cb -0.22 -3.03 -0.04 0.00 -2.06 0.00 0.00 37.83 32.49 2k4t s LYS 197 CO -0.04 0.60 0.13 0.08 0.10 0.00 0.00 175.35 176.21 2k4t s VAL 198 N -0.55 4.16 0.00 1.79 1.01 -1.26 -4.71 120.40 120.84 2k4t s VAL 198 Ca 0.11 -1.49 0.00 0.00 0.00 0.00 0.00 61.98 60.59 2k4t s VAL 198 Cb -0.12 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.05 2k4t s VAL 198 CO 0.02 -0.31 0.77 0.59 0.00 0.00 0.00 175.10 176.18 2k4t n ASN 199 N -0.94 0.00 -0.03 3.32 3.02 -1.26 -4.54 115.26 114.84 2k4t n ASN 199 Ca -0.08 0.77 -0.04 0.00 -0.03 0.00 0.00 54.58 55.21 2k4t n ASN 199 Cb 0.58 -0.27 -0.03 0.00 -0.61 0.00 0.00 39.78 39.44 2k4t n ASN 199 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2k4t n LYS 200 N -1.76 0.81 -0.66 3.52 0.00 -1.26 -5.05 118.16 113.76 2k4t n LYS 200 Ca 0.00 0.03 -0.31 0.00 -0.00 0.00 0.00 58.31 58.03 2k4t n LYS 200 Cb 0.00 -1.12 0.17 0.00 -0.00 0.00 0.00 35.03 34.09 2k4t n LYS 200 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2k4t n LYS 201 N -2.57 -0.85 -0.81 -1.58 5.02 -1.26 -4.93 118.16 111.18 2k4t n LYS 201 Ca -0.10 -0.20 -0.33 0.00 -2.02 0.00 0.00 58.31 55.67 2k4t n LYS 201 Cb 0.62 -2.18 0.13 0.00 -0.02 0.00 0.00 35.03 33.57 2k4t n LYS 201 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2k4t n LEU 202 N -3.57 0.85 -4.41 -0.35 7.99 -1.26 -4.38 117.00 111.88 2k4t n LEU 202 Ca 0.09 0.38 -0.23 0.00 -0.01 0.00 0.00 56.01 56.24 2k4t n LEU 202 Cb 0.53 -1.28 -0.10 0.00 -0.11 0.00 0.00 43.42 42.46 2k4t n LEU 202 CO 0.51 -3.19 -0.48 -1.83 -1.51 0.00 0.00 177.39 170.90 2k4t s GLU 203 N -3.83 1.50 0.08 3.23 -1.05 -0.68 -4.40 118.70 113.56 2k4t s GLU 203 Ca 0.60 -1.63 0.01 0.00 -0.15 0.00 0.00 54.97 53.81 2k4t s GLU 203 Cb -0.23 -1.54 -0.04 0.00 -0.44 0.00 0.00 34.13 31.88 2k4t s GLU 203 CO 0.64 0.29 -0.06 0.95 0.95 0.00 0.00 175.26 178.03 2k4t s THR 204 N -2.43 0.60 0.06 1.83 -4.23 -0.21 -0.69 115.64 110.57 2k4t s THR 204 Ca 0.24 -1.78 -0.13 0.00 -1.18 0.00 0.00 61.69 58.84 2k4t s THR 204 Cb -0.04 -1.49 0.02 0.00 1.34 0.00 0.00 72.50 72.32 2k4t s THR 204 CO 0.11 -0.82 0.30 0.00 -0.54 0.00 0.00 174.62 173.67 2k4t s ALA 205 N -3.32 -0.63 0.01 3.99 0.00 0.85 -0.04 121.76 122.61 2k4t s ALA 205 Ca 0.08 -0.11 0.03 0.00 0.00 0.00 0.00 51.96 51.96 2k4t s ALA 205 Cb 0.03 0.40 -0.01 0.00 0.00 0.00 0.00 23.12 23.54 2k4t s ALA 205 CO -0.05 -0.46 -0.10 0.54 0.00 0.00 0.00 175.76 175.70 2k4t s VAL 206 N -2.94 0.76 -0.02 0.00 0.11 0.36 -0.99 120.40 117.69 2k4t s VAL 206 Ca -0.02 -0.59 0.01 0.00 -2.93 0.00 0.00 61.98 58.44 2k4t s VAL 206 Cb 0.00 -0.68 0.02 0.00 -1.53 0.00 0.00 36.38 34.19 2k4t s VAL 206 CO -0.06 0.09 -0.02 0.54 -3.33 0.00 0.00 175.10 172.32 2k4t s ASN 207 N -0.57 0.48 -0.01 3.54 4.22 -0.41 -0.11 114.94 122.08 2k4t s ASN 207 Ca 0.01 -0.05 0.00 0.00 -2.14 0.00 0.00 52.86 50.68 2k4t s ASN 207 Cb -0.05 -0.19 0.02 0.00 1.28 0.00 0.00 41.25 42.31 2k4t s ASN 207 CO 0.00 -0.04 0.00 -1.48 -2.04 0.00 0.00 177.10 173.54 2k4t s LEU 208 N 0.61 1.49 -0.24 3.54 0.05 -0.20 -1.05 118.68 122.89 2k4t s LEU 208 Ca -0.06 -0.00 -0.01 0.00 0.05 0.00 0.00 54.13 54.10 2k4t s LEU 208 Cb -0.10 -0.11 0.02 0.00 -2.05 0.00 0.00 46.19 43.96 2k4t s LEU 208 CO -0.01 -0.06 -0.08 0.00 -0.55 0.00 0.00 176.35 175.65 2k4t s ALA 209 N 0.59 2.66 -0.22 1.48 0.00 -0.00 -1.32 121.76 124.95 2k4t s ALA 209 Ca -0.05 -1.41 -0.06 0.00 0.00 0.00 0.00 51.96 50.44 2k4t s ALA 209 Cb -0.08 -1.62 -0.02 0.00 0.00 0.00 0.00 23.12 21.40 2k4t s ALA 209 CO -0.01 -0.72 0.02 -0.46 0.00 0.00 0.00 175.76 174.58 2k4t s TRP 210 N 1.33 3.05 -0.21 0.00 -0.11 0.11 -0.49 118.94 122.63 2k4t s TRP 210 Ca 0.01 -0.48 -0.05 0.00 1.22 0.00 0.00 56.10 56.81 2k4t s TRP 210 Cb -0.16 -2.13 -0.02 0.00 -1.50 0.00 0.00 33.47 29.66 2k4t s TRP 210 CO -0.05 -0.29 -0.02 -0.08 -4.62 0.00 0.00 176.95 171.89 2k4t s THR 211 N 1.20 3.73 0.62 5.86 -1.32 -1.26 -0.00 115.64 124.47 2k4t s THR 211 Ca 0.03 -0.38 0.31 0.00 -1.21 0.00 0.00 61.69 60.44 2k4t s THR 211 Cb -0.14 -2.69 0.36 0.00 -1.51 0.00 0.00 72.50 68.51 2k4t s THR 211 CO 0.02 0.43 2.04 0.00 -2.21 0.00 0.00 174.62 174.89 2k4t h ALA 212 N 7.70 1.69 -3.00 11.08 0.00 -1.93 -3.41 119.26 131.39 2k4t h ALA 212 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2k4t h ALA 212 Cb 1.17 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2k4t h ALA 212 CO 0.60 -0.37 0.00 0.41 0.00 0.00 0.00 179.25 179.89 2k4t n GLY 213 N -1.35 -0.68 0.00 0.00 0.00 -1.26 -5.08 105.19 96.82 2k4t n GLY 213 Ca 0.02 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.43 2k4t n GLY 213 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2k4t n ASN 214 N 0.00 -0.32 -1.02 1.61 2.85 -1.26 -4.96 115.26 112.16 2k4t n ASN 214 Ca 0.00 -0.36 0.00 0.00 -0.11 0.00 0.00 54.58 54.11 2k4t n ASN 214 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2k4t n ASN 214 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2k4t n SER 215 N -1.57 -5.69 -4.75 1.20 7.64 -1.26 -4.87 113.62 104.31 2k4t n SER 215 Ca 0.00 0.96 -0.30 0.00 1.01 0.00 0.00 58.87 60.54 2k4t n SER 215 Cb 0.00 -2.80 0.11 0.00 -1.01 0.00 0.00 64.21 60.51 2k4t n SER 215 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2k4t s ASN 216 N -3.58 4.04 0.47 6.43 3.84 -1.26 -4.87 114.94 120.02 2k4t s ASN 216 Ca 0.00 1.67 -0.22 0.00 0.21 0.00 0.00 52.86 54.52 2k4t s ASN 216 Cb 0.00 -2.36 -0.08 0.00 -0.55 0.00 0.00 41.25 38.27 2k4t s ASN 216 CO 0.00 -2.31 1.10 0.28 -2.79 0.00 0.00 177.10 173.38 2k4t s THR 217 N -2.92 3.45 -0.16 -5.21 -1.32 -1.26 -4.88 115.64 103.33 2k4t s THR 217 Ca 0.62 1.00 -0.27 0.00 -1.21 0.00 0.00 61.69 61.83 2k4t s THR 217 Cb -0.17 -3.46 -0.01 0.00 -1.51 0.00 0.00 72.50 67.34 2k4t s THR 217 CO 0.56 -0.10 0.89 -0.60 -2.21 0.00 0.00 174.62 173.17 2k4t s ARG 218 N -2.92 4.32 -0.22 7.08 3.52 0.36 -4.91 118.95 126.18 2k4t s ARG 218 Ca 0.65 1.14 -0.02 0.00 -0.13 0.00 0.00 55.73 57.37 2k4t s ARG 218 Cb -0.23 -3.57 0.01 0.00 -1.56 0.00 0.00 34.95 29.60 2k4t s ARG 218 CO 0.27 -0.35 -0.09 0.12 -0.81 0.00 0.00 175.30 174.44 2k4t s PHE 219 N 2.20 2.95 0.00 5.12 5.36 -1.26 -0.82 117.98 131.53 2k4t s PHE 219 Ca 0.41 -1.35 0.02 0.00 -0.96 0.00 0.00 56.93 55.06 2k4t s PHE 219 Cb -0.17 -2.04 -0.01 0.00 -0.34 0.00 0.00 43.02 40.46 2k4t s PHE 219 CO 0.13 -0.68 -0.07 0.20 -1.46 0.00 0.00 175.22 173.34 2k4t s GLY 220 N 1.37 0.35 0.09 13.12 0.00 -0.21 -0.35 107.32 121.69 2k4t s GLY 220 Ca 0.04 -0.37 0.09 0.00 0.00 0.00 0.00 44.72 44.48 2k4t s GLY 220 CO -0.06 -0.34 -0.24 -0.26 0.00 0.00 0.00 173.10 172.20 2k4t s ILE 221 N -0.36 1.99 0.03 0.90 -0.00 0.48 -1.28 121.20 122.95 2k4t s ILE 221 Ca 0.00 -1.50 0.01 0.00 -0.00 0.00 0.00 60.65 59.16 2k4t s ILE 221 Cb -0.04 -1.75 -0.02 0.00 -0.00 0.00 0.00 42.46 40.66 2k4t s ILE 221 CO -0.00 0.15 -0.05 0.00 -0.00 0.00 0.00 174.94 175.04 2k4t s ALA 222 N -0.97 0.34 -0.28 2.27 0.00 -0.16 -0.85 121.76 122.11 2k4t s ALA 222 Ca 0.10 -0.65 -0.12 0.00 0.00 0.00 0.00 51.96 51.29 2k4t s ALA 222 Cb -0.10 0.09 0.10 0.00 0.00 0.00 0.00 23.12 23.22 2k4t s ALA 222 CO 0.04 -0.08 0.64 0.00 0.00 0.00 0.00 175.76 176.35 2k4t s ALA 223 N -1.36 -1.88 -0.21 0.00 0.00 -0.10 -0.11 121.76 118.10 2k4t s ALA 223 Ca -0.12 2.29 -0.09 0.00 0.00 0.00 0.00 51.96 54.04 2k4t s ALA 223 Cb -0.10 -1.57 -0.05 0.00 0.00 0.00 0.00 23.12 21.41 2k4t s ALA 223 CO -0.00 -0.67 0.11 0.15 0.00 0.00 0.00 175.76 175.35 2k4t s LYS 224 N 2.31 4.05 0.01 0.00 1.02 0.13 0.28 119.74 127.54 2k4t s LYS 224 Ca -0.08 -0.29 0.01 0.00 0.02 0.00 0.00 55.97 55.64 2k4t s LYS 224 Cb -0.09 -3.39 -0.01 0.00 -0.52 0.00 0.00 37.83 33.82 2k4t s LYS 224 CO -0.19 0.18 -0.04 1.52 -0.92 0.00 0.00 175.35 175.90 2k4t s TYR 225 N 0.67 0.38 -0.26 3.18 -0.85 -0.64 -1.69 117.35 118.14 2k4t s TYR 225 Ca 0.06 -0.24 0.01 0.00 -0.52 0.00 0.00 57.07 56.38 2k4t s TYR 225 Cb -0.12 -0.24 0.05 0.00 0.38 0.00 0.00 41.96 42.02 2k4t s TYR 225 CO 0.01 -0.05 -0.09 1.14 -1.52 0.00 0.00 175.55 175.04 2k4t s GLN 226 N -0.67 2.46 0.36 -3.49 -2.07 -1.26 -1.00 119.66 113.99 2k4t s GLN 226 Ca -0.04 -1.21 0.19 0.00 -1.82 0.00 0.00 55.36 52.47 2k4t s GLN 226 Cb -0.05 -2.94 0.51 0.00 -1.09 0.00 0.00 33.01 29.45 2k4t s GLN 226 CO -0.00 -0.51 1.65 -0.84 -1.32 0.00 0.00 175.29 174.26 2k4t h ILE 227 N 6.51 0.79 -3.05 3.63 -0.00 -1.95 -3.46 117.51 119.98 2k4t h ILE 227 Ca -0.25 -1.68 -0.41 0.00 -0.00 0.00 0.00 64.86 62.53 2k4t h ILE 227 Cb 1.07 2.07 -0.14 0.00 -0.00 0.00 0.00 36.82 39.81 2k4t h ILE 227 CO 0.51 0.38 -0.70 -1.81 -0.00 0.00 0.00 178.15 176.53 2k4t s ASP 228 N -6.38 2.26 0.00 2.16 1.11 -1.24 -5.02 116.67 109.55 2k4t s ASP 228 Ca 0.02 -1.09 0.14 0.00 0.18 0.00 0.00 52.55 51.80 2k4t s ASP 228 Cb 0.09 -0.08 0.65 0.00 1.07 0.00 0.00 42.92 44.66 2k4t s ASP 228 CO 0.70 -0.31 1.44 -0.81 1.18 0.00 0.00 175.17 177.36 2k4t n PRO 229 N -0.38 0.07 -0.27 8.23 -0.04 -1.26 -2.44 135.00 138.93 2k4t n PRO 229 Ca -0.08 0.22 0.04 0.00 -0.04 0.00 0.00 63.50 63.64 2k4t n PRO 229 Cb 0.62 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.63 2k4t n PRO 229 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2k4t n ASP 230 N -1.42 1.02 -3.82 3.54 8.00 -1.26 -5.03 116.55 117.58 2k4t n ASP 230 Ca 0.05 -2.34 -0.17 0.00 0.71 0.00 0.00 54.79 53.04 2k4t n ASP 230 Cb 0.15 -0.26 -0.16 0.00 -0.02 0.00 0.00 41.12 40.83 2k4t n ASP 230 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k4t s ALA 231 N -1.16 0.32 -0.22 2.24 0.00 -1.02 -2.26 121.76 119.66 2k4t s ALA 231 Ca 0.12 0.16 -0.01 0.00 0.00 0.00 0.00 51.96 52.23 2k4t s ALA 231 Cb 0.11 -0.33 0.06 0.00 0.00 0.00 0.00 23.12 22.97 2k4t s ALA 231 CO 0.01 -0.08 0.02 0.00 0.00 0.00 0.00 175.76 175.71 2k4t s PHE 233 N 1.69 3.11 0.32 0.00 0.40 -0.17 -2.28 117.98 121.04 2k4t s PHE 233 Ca -0.01 -0.41 -0.08 0.00 -0.60 0.00 0.00 56.93 55.83 2k4t s PHE 233 Cb -0.18 -2.27 -0.06 0.00 0.51 0.00 0.00 43.02 41.02 2k4t s PHE 233 CO -0.09 -0.36 0.64 0.45 0.70 0.00 0.00 175.22 176.55 2k4t s SER 234 N 1.63 6.53 -0.06 1.36 0.15 -1.12 -1.62 113.70 120.56 2k4t s SER 234 Ca 0.06 0.93 0.05 0.00 0.70 0.00 0.00 55.95 57.69 2k4t s SER 234 Cb -0.16 -2.23 -0.01 0.00 -1.71 0.00 0.00 66.02 61.92 2k4t s SER 234 CO 0.05 -0.24 -0.22 0.00 1.20 0.00 0.00 173.24 174.03 2k4t s ALA 235 N -2.12 1.92 -0.04 5.45 0.00 0.14 -0.79 121.76 126.32 2k4t s ALA 235 Ca 0.48 -0.90 -0.03 0.00 0.00 0.00 0.00 51.96 51.51 2k4t s ALA 235 Cb -0.11 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.41 2k4t s ALA 235 CO 0.28 0.34 0.10 -1.59 0.00 0.00 0.00 175.76 174.89 2k4t s LYS 236 N -0.01 0.08 -0.11 0.00 -2.85 -0.30 -0.92 119.74 115.63 2k4t s LYS 236 Ca -0.06 0.22 -0.05 0.00 -1.00 0.00 0.00 55.97 55.08 2k4t s LYS 236 Cb -0.14 -0.07 0.05 0.00 -2.06 0.00 0.00 37.83 35.61 2k4t s LYS 236 CO 0.04 -0.09 0.25 0.08 0.10 0.00 0.00 175.35 175.73 2k4t s VAL 237 N 0.59 -0.18 -0.06 1.79 1.01 -0.03 0.31 120.40 123.84 2k4t s VAL 237 Ca -0.05 0.20 0.06 0.00 0.00 0.00 0.00 61.98 62.20 2k4t s VAL 237 Cb -0.06 -0.40 -0.01 0.00 0.00 0.00 0.00 36.38 35.91 2k4t s VAL 237 CO -0.02 0.08 -0.24 0.54 0.00 0.00 0.00 175.10 175.46 2k4t s ASN 238 N 1.71 3.17 -0.89 3.32 4.22 -0.61 -0.39 114.94 125.47 2k4t s ASN 238 Ca -0.05 -0.48 0.00 0.00 -2.14 0.00 0.00 52.86 50.19 2k4t s ASN 238 Cb -0.11 -0.84 0.00 0.00 1.28 0.00 0.00 41.25 41.58 2k4t s ASN 238 CO -0.08 0.25 0.00 -3.20 -2.04 0.00 0.00 177.10 172.03 2k4t n ASN 239 N 2.89 -3.72 -0.75 3.54 2.85 0.52 -1.18 115.26 119.41 2k4t n ASN 239 Ca -0.17 0.21 -0.08 0.00 -0.11 0.00 0.00 54.58 54.43 2k4t n ASN 239 Cb 0.52 -3.01 -0.03 0.00 1.24 0.00 0.00 39.78 38.50 2k4t n ASN 239 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 2k4t n SER 240 N -0.19 -4.23 -0.10 1.20 3.41 -1.26 -4.71 113.62 107.73 2k4t n SER 240 Ca -0.08 0.20 -0.14 0.00 -0.26 0.00 0.00 58.87 58.58 2k4t n SER 240 Cb 0.40 -3.23 -0.09 0.00 -0.26 0.00 0.00 64.21 61.03 2k4t n SER 240 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2k4t n SER 241 N -0.36 2.39 -4.50 4.04 2.88 -0.33 -4.93 113.62 112.82 2k4t n SER 241 Ca -0.08 -0.10 -0.32 0.00 -1.33 0.00 0.00 58.87 57.04 2k4t n SER 241 Cb 0.44 -0.33 -0.12 0.00 -0.75 0.00 0.00 64.21 63.45 2k4t n SER 241 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2k4t s LEU 242 N -6.22 2.82 0.05 2.46 1.98 -1.02 -0.99 118.68 117.77 2k4t s LEU 242 Ca -0.27 -0.22 0.04 0.00 -2.89 0.00 0.00 54.13 50.79 2k4t s LEU 242 Cb 0.07 -1.61 -0.03 0.00 0.66 0.00 0.00 46.19 45.29 2k4t s LEU 242 CO 0.46 0.32 -0.13 -0.63 -1.89 0.00 0.00 176.35 174.48 2k4t s ILE 243 N -0.83 1.00 0.16 6.68 1.09 0.14 -1.58 121.20 127.87 2k4t s ILE 243 Ca 0.13 -1.14 -0.06 0.00 -1.10 0.00 0.00 60.65 58.48 2k4t s ILE 243 Cb -0.11 -0.96 -0.02 0.00 -1.06 0.00 0.00 42.46 40.32 2k4t s ILE 243 CO 0.03 -0.17 0.22 -0.83 -0.10 0.00 0.00 174.94 174.09 2k4t s GLY 244 N -1.47 0.73 -0.07 6.18 0.00 0.15 -0.00 107.32 112.83 2k4t s GLY 244 Ca -0.02 -1.14 -0.00 0.00 0.00 0.00 0.00 44.72 43.56 2k4t s GLY 244 CO 0.02 -1.03 -0.04 -2.27 0.00 0.00 0.00 173.10 169.78 2k4t s LEU 245 N -3.01 1.03 0.40 0.66 2.96 0.25 -1.15 118.68 119.82 2k4t s LEU 245 Ca 0.22 -0.16 -0.26 0.00 -0.22 0.00 0.00 54.13 53.70 2k4t s LEU 245 Cb 0.05 -0.57 -0.09 0.00 0.50 0.00 0.00 46.19 46.08 2k4t s LEU 245 CO 0.02 -0.12 1.31 -0.83 -1.32 0.00 0.00 176.35 175.41 2k4t s GLY 246 N 1.49 2.93 -0.90 7.98 0.00 0.03 -2.90 107.32 115.95 2k4t s GLY 246 Ca -0.01 1.24 -0.14 0.00 0.00 0.00 0.00 44.72 45.80 2k4t s GLY 246 CO -0.04 1.83 0.92 -2.52 0.00 0.00 0.00 173.10 173.30 2k4t s TYR 247 N -1.25 3.67 -0.30 1.90 1.13 0.12 -2.79 117.35 119.83 2k4t s TYR 247 Ca 0.56 -1.95 0.00 0.00 -1.41 0.00 0.00 57.07 54.27 2k4t s TYR 247 Cb -0.38 -3.95 0.09 0.00 -1.10 0.00 0.00 41.96 36.62 2k4t s TYR 247 CO 0.49 -1.12 0.06 0.99 -2.51 0.00 0.00 175.55 173.47 2k4t s THR 248 N 0.62 1.21 -0.00 -3.49 2.01 -0.97 -3.95 115.64 111.06 2k4t s THR 248 Ca 0.24 -1.50 -0.09 0.00 0.31 0.00 0.00 61.69 60.65 2k4t s THR 248 Cb -0.08 -1.84 0.01 0.00 0.01 0.00 0.00 72.50 70.59 2k4t s THR 248 CO -0.09 -0.55 0.18 -1.58 -0.69 0.00 0.00 174.62 171.89 2k4t s GLN 249 N 1.46 0.52 -0.39 4.92 0.74 0.79 0.84 119.66 128.54 2k4t s GLN 249 Ca 0.07 -0.32 0.09 0.00 0.05 0.00 0.00 55.36 55.25 2k4t s GLN 249 Cb -0.18 0.22 0.27 0.00 1.10 0.00 0.00 33.01 34.42 2k4t s GLN 249 CO -0.18 -0.13 0.59 -2.37 -0.55 0.00 0.00 175.29 172.65 2k4t n THR 250 N 1.48 -0.56 -1.63 -0.34 5.66 -0.96 -0.34 114.28 117.59 2k4t n THR 250 Ca -0.22 -3.95 -0.38 0.00 -3.05 0.00 0.00 64.05 56.45 2k4t n THR 250 Cb 0.56 -1.43 -0.03 0.00 -1.55 0.00 0.00 70.33 67.88 2k4t n THR 250 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2k4t s LEU 251 N -1.39 3.41 0.56 1.09 1.98 -1.23 -4.65 118.68 118.44 2k4t s LEU 251 Ca 0.36 1.20 0.00 0.00 -2.89 0.00 0.00 54.13 52.79 2k4t s LEU 251 Cb 0.21 -2.76 0.00 0.00 0.66 0.00 0.00 46.19 44.29 2k4t s LEU 251 CO -0.11 -2.60 0.00 0.29 -1.89 0.00 0.00 176.35 172.04 2k4t n LYS 252 N 8.95 -3.01 0.00 1.98 5.02 -1.26 -3.83 118.16 126.01 2k4t n LYS 252 Ca 0.33 2.46 0.07 0.00 -2.02 0.00 0.00 58.31 59.15 2k4t n LYS 252 Cb 0.52 -3.52 0.32 0.00 -0.02 0.00 0.00 35.03 32.33 2k4t n LYS 252 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2k4t n PRO 253 N -4.12 0.07 0.00 1.97 -0.04 -1.26 -3.80 135.00 127.82 2k4t n PRO 253 Ca -0.08 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.60 2k4t n PRO 253 Cb 0.62 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 2k4t n PRO 253 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k4t n GLY 254 N -0.03 -1.43 3.02 0.55 0.00 -1.26 -4.91 105.19 101.13 2k4t n GLY 254 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 2k4t n GLY 254 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k4t s ILE 255 N -1.87 0.74 0.92 -0.61 1.01 -1.25 -4.94 121.20 115.20 2k4t s ILE 255 Ca 0.00 -0.39 -0.14 0.00 0.00 0.00 0.00 60.65 60.13 2k4t s ILE 255 Cb 0.00 -0.63 0.18 0.00 0.01 0.00 0.00 42.46 42.02 2k4t s ILE 255 CO 0.00 0.22 1.27 -0.54 0.00 0.00 0.00 174.94 175.89 2k4t s LYS 256 N -0.11 0.85 0.01 2.79 3.01 -1.26 -3.54 119.74 121.49 2k4t s LYS 256 Ca 0.02 -0.46 -0.05 0.00 -1.01 0.00 0.00 55.97 54.47 2k4t s LYS 256 Cb -0.05 -1.91 -0.01 0.00 -1.01 0.00 0.00 37.83 34.85 2k4t s LYS 256 CO -0.00 -2.24 0.09 -0.51 0.51 0.00 0.00 175.35 173.19 2k4t s LEU 257 N -5.78 1.77 -0.13 3.17 1.43 0.54 -3.92 118.68 115.76 2k4t s LEU 257 Ca 0.72 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.52 2k4t s LEU 257 Cb -0.04 0.50 -0.01 0.00 0.03 0.00 0.00 46.19 46.66 2k4t s LEU 257 CO 0.52 -0.36 -0.15 0.42 0.23 0.00 0.00 176.35 177.01 2k4t s THR 258 N -1.48 2.86 -0.41 5.49 -4.23 -0.29 -0.15 115.64 117.44 2k4t s THR 258 Ca -0.15 -0.73 -0.08 0.00 -1.18 0.00 0.00 61.69 59.55 2k4t s THR 258 Cb -0.08 -2.18 0.08 0.00 1.34 0.00 0.00 72.50 71.65 2k4t s THR 258 CO 0.01 0.53 0.23 -0.76 -0.54 0.00 0.00 174.62 174.09 2k4t s LEU 259 N 0.36 5.05 -0.16 4.79 1.43 -1.25 -1.50 118.68 127.40 2k4t s LEU 259 Ca -0.12 -1.52 -0.03 0.00 -1.03 0.00 0.00 54.13 51.42 2k4t s LEU 259 Cb -0.16 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.09 2k4t s LEU 259 CO 0.06 -0.51 -0.06 -0.55 0.23 0.00 0.00 176.35 175.52 2k4t s SER 260 N 2.00 4.54 -0.05 2.29 0.15 -0.41 0.12 113.70 122.34 2k4t s SER 260 Ca 0.03 -0.22 -0.02 0.00 0.70 0.00 0.00 55.95 56.43 2k4t s SER 260 Cb -0.23 -1.74 0.04 0.00 -1.71 0.00 0.00 66.02 62.38 2k4t s SER 260 CO 0.01 0.13 0.10 0.00 1.20 0.00 0.00 173.24 174.68 2k4t s ALA 261 N 0.60 -0.00 -0.18 5.45 0.00 -1.14 0.33 121.76 126.81 2k4t s ALA 261 Ca -0.04 0.41 -0.01 0.00 0.00 0.00 0.00 51.96 52.32 2k4t s ALA 261 Cb -0.15 -0.59 -0.00 0.00 0.00 0.00 0.00 23.12 22.38 2k4t s ALA 261 CO 0.03 -0.39 -0.11 -1.17 0.00 0.00 0.00 175.76 174.12 2k4t s LEU 262 N 1.84 2.64 -0.43 0.00 1.98 0.12 0.88 118.68 125.71 2k4t s LEU 262 Ca -0.01 -0.43 0.02 0.00 -2.89 0.00 0.00 54.13 50.83 2k4t s LEU 262 Cb -0.12 -1.63 0.13 0.00 0.66 0.00 0.00 46.19 45.23 2k4t s LEU 262 CO -0.04 0.05 0.21 -0.76 -1.89 0.00 0.00 176.35 173.92 2k4t s LEU 263 N 1.02 3.18 -0.59 -0.68 2.01 1.00 -2.25 118.68 122.37 2k4t s LEU 263 Ca -0.01 -2.54 -0.20 0.00 0.01 0.00 0.00 54.13 51.39 2k4t s LEU 263 Cb -0.15 -1.20 0.08 0.00 0.01 0.00 0.00 46.19 44.93 2k4t s LEU 263 CO -0.02 -0.29 0.77 -0.62 1.01 0.00 0.00 176.35 177.20 2k4t s ASP 264 N 0.43 6.20 -0.35 2.29 -1.08 -1.26 0.24 116.67 123.15 2k4t s ASP 264 Ca 0.16 -1.14 0.00 0.00 -0.52 0.00 0.00 52.55 51.05 2k4t s ASP 264 Cb -0.23 -2.34 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 2k4t s ASP 264 CO -0.04 -1.16 0.00 0.61 0.52 0.00 0.00 175.17 175.10 2k4t n GLY 265 N 5.26 0.34 3.08 2.66 0.00 -0.16 -2.13 105.19 114.24 2k4t n GLY 265 Ca -0.07 -0.01 -0.17 0.00 0.00 0.00 0.00 46.02 45.77 2k4t n GLY 265 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2k4t n LYS 266 N 0.20 -5.97 -2.66 1.61 4.81 -1.26 -4.91 118.16 109.99 2k4t n LYS 266 Ca -0.03 0.66 -0.03 0.00 -0.87 0.00 0.00 58.31 58.03 2k4t n LYS 266 Cb 0.50 -5.17 0.04 0.00 0.02 0.00 0.00 35.03 30.42 2k4t n LYS 266 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2k4t n ASN 267 N -2.27 -1.19 0.07 3.14 2.85 -0.91 -4.96 115.26 112.00 2k4t n ASN 267 Ca -0.07 -1.76 -0.12 0.00 -0.11 0.00 0.00 54.58 52.52 2k4t n ASN 267 Cb 0.58 1.07 -0.08 0.00 1.24 0.00 0.00 39.78 42.58 2k4t n ASN 267 CO 0.00 0.00 0.00 -0.37 -2.11 0.00 0.00 177.26 174.78 2k4t h VAL 268 N 0.42 0.93 -0.01 3.44 -1.51 -1.74 -3.27 116.25 114.52 2k4t h VAL 268 Ca -0.47 -0.99 0.00 0.00 -1.23 0.00 0.00 66.70 64.02 2k4t h VAL 268 Cb 1.23 1.48 0.00 0.00 -2.13 0.00 0.00 31.29 31.87 2k4t h VAL 268 CO -0.12 0.21 -0.24 -0.46 -1.23 0.00 0.00 177.57 175.72 2k4t n ASN 269 N -4.97 1.31 -0.72 4.19 0.23 -1.26 -4.73 115.26 109.31 2k4t n ASN 269 Ca -0.08 -1.11 -0.07 0.00 -0.53 0.00 0.00 54.58 52.78 2k4t n ASN 269 Cb 0.26 0.16 -0.01 0.00 -2.08 0.00 0.00 39.78 38.12 2k4t n ASN 269 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2k4t n ALA 270 N -0.36 -0.18 0.00 -2.53 0.00 -1.23 -4.78 120.51 111.42 2k4t n ALA 270 Ca 0.13 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2k4t n ALA 270 Cb 0.38 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.78 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 -1.28 0.20 0.00 0.00 0.00 -1.26 -5.11 105.19 97.74 2k4t n GLY 271 Ca -0.08 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.54 4.43 3.60 -0.02 0.00 -1.26 -5.11 105.19 106.28 2k4t n GLY 272 Ca 0.00 -0.48 -0.25 0.00 0.00 0.00 0.00 46.02 45.29 2k4t n GLY 272 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2k4t s HIS 273 N 0.58 2.49 -0.21 1.61 0.09 -1.26 -4.24 115.29 114.36 2k4t s HIS 273 Ca 0.00 -0.47 -0.08 0.00 -0.00 0.00 0.00 55.06 54.50 2k4t s HIS 273 Cb 0.00 -1.47 -0.04 0.00 -0.00 0.00 0.00 32.58 31.07 2k4t s HIS 273 CO 0.00 0.51 0.09 0.21 -0.00 0.00 0.00 174.74 175.55 2k4t s LYS 274 N -3.68 3.95 0.10 1.40 2.47 -0.95 -4.78 119.74 118.25 2k4t s LYS 274 Ca 0.34 -0.34 0.02 0.00 -1.56 0.00 0.00 55.97 54.43 2k4t s LYS 274 Cb 0.01 -3.33 -0.04 0.00 -1.46 0.00 0.00 37.83 33.01 2k4t s LYS 274 CO 0.18 0.14 -0.07 -0.51 0.16 0.00 0.00 175.35 175.25 2k4t s LEU 275 N 0.77 2.51 -0.29 5.43 1.43 -1.26 0.14 118.68 127.42 2k4t s LEU 275 Ca 0.05 -1.01 -0.13 0.00 -1.03 0.00 0.00 54.13 52.02 2k4t s LEU 275 Cb -0.13 -0.10 0.11 0.00 0.03 0.00 0.00 46.19 46.10 2k4t s LEU 275 CO 0.02 -0.45 0.68 -0.83 0.23 0.00 0.00 176.35 176.00 2k4t s GLY 276 N -3.05 -0.67 -0.11 -3.19 0.00 0.15 -1.00 107.32 99.44 2k4t s GLY 276 Ca 0.12 2.41 -0.12 0.00 0.00 0.00 0.00 44.72 47.13 2k4t s GLY 276 CO -0.04 2.79 0.27 0.48 0.00 0.00 0.00 173.10 176.60 2k4t s LEU 277 N 2.34 4.34 -0.10 0.66 0.05 0.10 -1.28 118.68 124.78 2k4t s LEU 277 Ca -0.08 0.60 0.02 0.00 0.05 0.00 0.00 54.13 54.72 2k4t s LEU 277 Cb -0.09 -2.33 -0.01 0.00 -2.05 0.00 0.00 46.19 41.71 2k4t s LEU 277 CO -0.19 0.24 -0.16 -0.83 -0.55 0.00 0.00 176.35 174.86 2k4t s GLY 278 N -0.32 1.49 -0.06 -3.48 0.00 -0.56 -0.85 107.32 103.55 2k4t s GLY 278 Ca 0.17 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 43.97 2k4t s GLY 278 CO 0.06 -0.36 -0.04 1.08 0.00 0.00 0.00 173.10 173.84 2k4t s LEU 279 N 0.09 3.33 -0.60 0.66 1.43 0.34 -1.13 118.68 122.80 2k4t s LEU 279 Ca -0.07 0.01 0.05 0.00 -1.03 0.00 0.00 54.13 53.10 2k4t s LEU 279 Cb -0.15 -1.78 0.20 0.00 0.03 0.00 0.00 46.19 44.48 2k4t s LEU 279 CO 0.05 0.35 0.52 -1.84 0.23 0.00 0.00 176.35 175.66 2k4t n GLU 280 N 2.01 1.53 -2.86 1.70 0.00 -1.25 -0.76 120.64 121.02 2k4t n GLU 280 Ca -0.17 -4.13 -0.39 0.00 0.00 0.00 0.00 57.16 52.48 2k4t n GLU 280 Cb 0.53 -2.04 -0.06 0.00 0.00 0.00 0.00 31.44 29.87 2k4t n GLU 280 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 2k4t s PHE 281 N -1.35 3.85 0.02 -1.84 0.40 -1.14 -4.40 117.98 113.52 2k4t s PHE 281 Ca 0.31 1.75 0.07 0.00 -0.60 0.00 0.00 56.93 58.46 2k4t s PHE 281 Cb 0.04 -2.87 -0.02 0.00 0.51 0.00 0.00 43.02 40.68 2k4t s PHE 281 CO -0.14 0.39 -0.21 1.14 0.70 0.00 0.00 175.22 177.11 2k4t s GLN 282 N -1.51 1.50 -0.50 0.44 0.00 -1.26 -3.28 119.66 115.06 2k4t s GLN 282 Ca 0.42 -0.86 -0.25 0.00 -0.00 0.00 0.00 55.36 54.67 2k4t s GLN 282 Cb -0.22 -1.55 0.03 0.00 0.00 0.00 0.00 33.01 31.27 2k4t s GLN 282 CO 0.27 0.41 0.96 0.00 0.00 0.00 0.00 175.29 176.92 2k4t s ALA 283 N -0.68 3.19 -0.25 2.60 0.00 -1.23 -4.88 121.76 120.52 2k4t s ALA 283 Ca 0.08 -0.94 -0.17 0.00 0.00 0.00 0.00 51.96 50.93 2k4t s ALA 283 Cb -0.08 -3.71 -0.15 0.00 0.00 0.00 0.00 23.12 19.18 2k4t s ALA 283 CO 0.01 -2.22 -0.12 -0.11 0.00 0.00 0.00 175.76 173.32 2k4t n LEU 284 N 7.38 1.91 0.00 0.00 7.94 -1.26 -4.82 117.00 128.16 2k4t n LEU 284 Ca 0.05 0.38 0.11 0.00 -1.11 0.00 0.00 56.01 55.44 2k4t n LEU 284 Cb 0.48 -0.88 0.67 0.00 0.53 0.00 0.00 43.42 44.22 2k4t n LEU 284 CO 0.65 0.42 0.86 -0.62 -1.11 0.00 0.00 177.39 177.58