#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xkd s PRO 7 N 0.00 4.05 0.07 -1.46 0.04 -1.26 -4.96 135.00 131.49 1xkd s PRO 7 Ca 0.00 1.83 -0.31 0.00 0.04 0.00 0.00 61.00 62.56 1xkd s PRO 7 Cb 0.00 -2.67 -0.06 0.00 0.04 0.00 0.00 34.50 31.81 1xkd s PRO 7 CO 0.00 -0.32 1.24 -2.14 0.04 0.00 0.00 177.00 175.82 1xkd s PRO 8 N -2.31 4.41 0.02 0.56 0.02 -1.26 -4.95 135.00 131.49 1xkd s PRO 8 Ca 0.57 1.83 0.21 0.00 0.02 0.00 0.00 61.00 63.63 1xkd s PRO 8 Cb -0.30 -3.32 -0.21 0.00 0.02 0.00 0.00 34.50 30.68 1xkd s PRO 8 CO 0.38 -0.29 0.62 0.00 -0.33 0.00 0.00 177.00 177.38 1xkd s THR 10 N -3.25 0.42 0.53 0.00 -4.23 -1.26 -4.69 115.64 103.16 1xkd s THR 10 Ca -0.06 -1.97 0.23 0.00 -1.18 0.00 0.00 61.69 58.71 1xkd s THR 10 Cb 0.11 -2.30 0.36 0.00 1.34 0.00 0.00 72.50 72.01 1xkd s THR 10 CO 0.85 -0.27 2.04 0.74 -0.54 0.00 0.00 174.62 177.44 1xkd h THR 11 N 2.63 0.77 -0.51 3.99 2.02 -1.92 -2.43 112.91 117.46 1xkd h THR 11 Ca -0.37 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.73 1xkd h THR 11 Cb 1.22 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 1xkd h THR 11 CO 0.60 0.00 -0.02 -0.33 0.37 0.00 0.00 175.52 176.14 1xkd h GLU 12 N 0.00 0.88 -5.17 6.66 3.07 -2.02 -3.32 114.58 114.67 1xkd h GLU 12 Ca 0.18 -0.26 -0.65 0.00 -0.50 0.00 0.00 59.36 58.13 1xkd h GLU 12 Cb 0.73 -0.09 -0.06 0.00 -0.84 0.00 0.00 28.75 28.49 1xkd h GLU 12 CO -0.00 0.89 2.37 0.39 -1.40 0.00 0.00 179.01 181.25 1xkd n GLU 13 N -4.19 2.81 -3.78 2.33 1.02 -0.92 -4.90 120.64 113.01 1xkd n GLU 13 Ca 0.03 -2.90 -0.36 0.00 -0.02 0.00 0.00 57.16 53.91 1xkd n GLU 13 Cb 0.33 -3.42 -0.10 0.00 -0.02 0.00 0.00 31.44 28.22 1xkd n GLU 13 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1xkd s LEU 14 N 4.16 3.91 -0.35 -4.62 2.96 -1.25 -4.75 118.68 118.74 1xkd s LEU 14 Ca 0.54 0.05 -0.04 0.00 -0.22 0.00 0.00 54.13 54.45 1xkd s LEU 14 Cb 0.07 -2.03 0.19 0.00 0.50 0.00 0.00 46.19 44.91 1xkd s LEU 14 CO 0.04 0.08 0.91 -0.44 -1.32 0.00 0.00 176.35 175.62 1xkd s SER 15 N 0.96 -0.72 0.50 3.68 0.01 -1.26 -5.12 113.70 111.74 1xkd s SER 15 Ca 0.06 -0.32 -0.23 0.00 1.31 0.00 0.00 55.95 56.78 1xkd s SER 15 Cb -0.13 0.98 -0.07 0.00 0.21 0.00 0.00 66.02 67.00 1xkd s SER 15 CO 0.03 -0.09 1.22 -0.81 0.41 0.00 0.00 173.24 174.00 1xkd n PRO 16 N 4.06 1.58 -0.83 12.44 -0.04 -1.26 -4.90 135.00 146.06 1xkd n PRO 16 Ca 0.07 0.58 -0.34 0.00 -0.04 0.00 0.00 63.50 63.77 1xkd n PRO 16 Cb 0.61 -2.38 0.11 0.00 -0.04 0.00 0.00 33.50 31.80 1xkd n PRO 16 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1xkd n PRO 17 N -0.53 -0.40 0.12 0.54 -0.02 -1.26 -4.90 135.00 128.54 1xkd n PRO 17 Ca 0.10 -0.09 -0.08 0.00 -2.02 0.00 0.00 63.50 61.41 1xkd n PRO 17 Cb 0.43 -1.62 -0.04 0.00 -0.02 0.00 0.00 33.50 32.24 1xkd n PRO 17 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1xkd h PRO 18 N -1.49 -0.42 -2.23 0.52 0.11 -1.98 -3.32 132.00 123.19 1xkd h PRO 18 Ca -0.45 0.03 -0.80 0.00 0.11 0.00 0.00 66.00 64.89 1xkd h PRO 18 Cb 1.30 0.10 -0.26 0.00 0.11 0.00 0.00 31.00 32.24 1xkd h PRO 18 CO 0.32 -0.28 1.09 0.41 -0.21 0.00 0.00 178.00 179.33 1xkd n GLY 19 N -1.25 6.03 3.44 -0.55 0.00 -1.26 -4.92 105.19 106.67 1xkd n GLY 19 Ca -0.05 -2.55 -0.09 0.00 0.00 0.00 0.00 46.02 43.33 1xkd n GLY 19 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xkd s GLY 20 N -1.24 -0.46 0.57 -0.02 0.00 -1.25 -4.93 107.32 99.99 1xkd s GLY 20 Ca 0.41 1.91 -0.13 0.00 0.00 0.00 0.00 44.72 46.92 1xkd s GLY 20 CO -0.17 1.97 1.00 -0.56 0.00 0.00 0.00 173.10 175.34 1xkd s SER 21 N 1.44 6.37 0.15 1.64 0.01 -0.69 -4.81 113.70 117.81 1xkd s SER 21 Ca -0.09 1.44 -0.13 0.00 1.31 0.00 0.00 55.95 58.48 1xkd s SER 21 Cb -0.07 -2.47 -0.07 0.00 0.21 0.00 0.00 66.02 63.63 1xkd s SER 21 CO -0.15 -0.75 0.52 -0.76 0.41 0.00 0.00 173.24 172.52 1xkd s LEU 22 N -4.75 4.31 0.43 2.44 1.43 -1.26 -1.95 118.68 119.33 1xkd s LEU 22 Ca 0.56 1.00 -0.26 0.00 -1.03 0.00 0.00 54.13 54.40 1xkd s LEU 22 Cb -0.11 -3.31 -0.08 0.00 0.03 0.00 0.00 46.19 42.72 1xkd s LEU 22 CO 0.45 0.08 1.37 -0.69 0.23 0.00 0.00 176.35 177.80 1xkd s VAL 23 N -1.53 2.31 0.19 -1.59 1.01 -1.26 -4.85 120.40 114.68 1xkd s VAL 23 Ca 0.39 0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.72 1xkd s VAL 23 Cb -0.14 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 1xkd s VAL 23 CO 0.19 0.04 -0.16 -1.61 0.00 0.00 0.00 175.10 173.56 1xkd s GLU 24 N -2.36 1.29 -0.09 2.72 2.02 -1.08 -4.70 118.70 116.50 1xkd s GLU 24 Ca 0.59 -1.50 -0.03 0.00 0.02 0.00 0.00 54.97 54.05 1xkd s GLU 24 Cb -0.41 -1.19 0.05 0.00 0.10 0.00 0.00 34.13 32.67 1xkd s GLU 24 CO 0.53 0.22 0.14 -0.47 0.02 0.00 0.00 175.26 175.70 1xkd s TYR 25 N -2.57 -0.12 -0.15 1.61 5.04 -1.26 -1.75 117.35 118.15 1xkd s TYR 25 Ca 0.19 0.46 -0.28 0.00 -2.44 0.00 0.00 57.07 55.00 1xkd s TYR 25 Cb -0.03 -0.34 0.07 0.00 0.35 0.00 0.00 41.96 42.02 1xkd s TYR 25 CO 0.07 -0.29 0.71 -1.54 -1.34 0.00 0.00 175.55 173.16 1xkd s SER 26 N 2.26 -0.69 -0.40 4.32 1.04 -0.86 -4.95 113.70 114.43 1xkd s SER 26 Ca 0.04 1.03 0.00 0.00 0.48 0.00 0.00 55.95 57.50 1xkd s SER 26 Cb -0.12 0.94 0.00 0.00 0.10 0.00 0.00 66.02 66.94 1xkd s SER 26 CO -0.06 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.33 1xkd n GLY 27 N 1.70 0.40 0.00 7.32 0.00 -1.26 -1.90 105.19 111.45 1xkd n GLY 27 Ca -0.17 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1xkd n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xkd n GLY 28 N 0.40 3.10 3.83 -0.02 0.00 -1.26 -5.08 105.19 106.17 1xkd n GLY 28 Ca -0.04 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.76 1xkd n GLY 28 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xkd s SER 29 N 0.00 5.42 -0.02 1.61 1.04 -0.80 -4.98 113.70 115.98 1xkd s SER 29 Ca 0.00 1.49 0.08 0.00 0.48 0.00 0.00 55.95 57.99 1xkd s SER 29 Cb 0.00 -2.37 -0.02 0.00 0.10 0.00 0.00 66.02 63.73 1xkd s SER 29 CO 0.00 -1.40 -0.24 -0.22 0.98 0.00 0.00 173.24 172.35 1xkd s LEU 30 N -5.49 2.05 -0.24 2.42 2.96 -1.26 -2.02 118.68 117.10 1xkd s LEU 30 Ca 0.58 -0.45 -0.00 0.00 -0.22 0.00 0.00 54.13 54.04 1xkd s LEU 30 Cb -0.13 -1.25 0.03 0.00 0.50 0.00 0.00 46.19 45.34 1xkd s LEU 30 CO 0.54 0.30 -0.09 -0.60 -1.32 0.00 0.00 176.35 175.18 1xkd s ARG 31 N -0.60 2.72 -0.35 1.98 6.06 -0.72 -5.02 118.95 123.03 1xkd s ARG 31 Ca 0.09 -1.04 -0.08 0.00 -2.50 0.00 0.00 55.73 52.20 1xkd s ARG 31 Cb -0.09 -2.91 0.03 0.00 0.06 0.00 0.00 34.95 32.04 1xkd s ARG 31 CO -0.01 -0.41 0.14 0.08 -2.50 0.00 0.00 175.30 172.59 1xkd s VAL 32 N 1.27 4.05 -2.00 7.11 1.01 -1.26 -2.64 120.40 127.94 1xkd s VAL 32 Ca -0.01 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 60.98 1xkd s VAL 32 Cb -0.17 -3.27 0.12 0.00 0.00 0.00 0.00 36.38 33.06 1xkd s VAL 32 CO -0.06 -0.19 1.16 -2.65 0.00 0.00 0.00 175.10 173.37 1xkd n PRO 33 N 4.87 1.00 -0.46 2.72 -0.02 -1.26 -4.79 135.00 137.07 1xkd n PRO 33 Ca -0.12 -0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 1xkd n PRO 33 Cb 0.45 -1.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.87 1xkd n PRO 33 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1xkd n ASP 34 N -0.56 0.00 -2.53 2.55 9.92 -1.26 -4.74 116.55 119.92 1xkd n ASP 34 Ca 0.03 0.00 -0.18 0.00 -0.53 0.00 0.00 54.79 54.11 1xkd n ASP 34 Cb 0.02 -2.29 0.02 0.00 -0.64 0.00 0.00 41.12 38.22 1xkd n ASP 34 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1xkd n ASN 35 N 0.00 3.26 -4.81 -2.24 4.05 -1.26 -2.64 115.26 111.63 1xkd n ASN 35 Ca 0.00 -3.21 -0.37 0.00 0.45 0.00 0.00 54.58 51.45 1xkd n ASN 35 Cb 0.00 -0.48 -0.06 0.00 1.23 0.00 0.00 39.78 40.47 1xkd n ASN 35 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1xkd s PRO 36 N -3.41 4.33 -0.16 1.20 0.05 -1.26 -1.70 135.00 134.05 1xkd s PRO 36 Ca 0.39 0.95 -0.22 0.00 0.05 0.00 0.00 61.00 62.17 1xkd s PRO 36 Cb 0.42 -2.95 -0.03 0.00 0.05 0.00 0.00 34.50 31.99 1xkd s PRO 36 CO -0.07 0.42 0.66 0.08 0.05 0.00 0.00 177.00 178.14 1xkd s VAL 37 N -1.46 5.03 -0.12 -0.36 1.01 -0.82 -2.73 120.40 120.95 1xkd s VAL 37 Ca 0.42 1.28 0.02 0.00 0.00 0.00 0.00 61.98 63.69 1xkd s VAL 37 Cb -0.18 -3.98 0.01 0.00 0.00 0.00 0.00 36.38 32.24 1xkd s VAL 37 CO 0.22 0.15 -0.16 -0.69 0.00 0.00 0.00 175.10 174.62 1xkd s VAL 38 N 1.56 1.63 0.37 2.92 1.01 -1.18 -4.50 120.40 122.21 1xkd s VAL 38 Ca 0.32 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 61.34 1xkd s VAL 38 Cb -0.16 -1.48 -0.09 0.00 0.00 0.00 0.00 36.38 34.64 1xkd s VAL 38 CO 0.12 0.47 1.00 0.00 0.00 0.00 0.00 175.10 176.69 1xkd s ALA 39 N 1.02 3.14 -0.02 5.51 0.00 -0.58 -2.15 121.76 128.67 1xkd s ALA 39 Ca -0.05 0.62 0.01 0.00 0.00 0.00 0.00 51.96 52.54 1xkd s ALA 39 Cb -0.15 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.75 1xkd s ALA 39 CO -0.03 -0.04 -0.05 -0.59 0.00 0.00 0.00 175.76 175.05 1xkd s PHE 40 N -1.67 0.61 -0.20 0.00 -0.12 -0.37 -0.34 117.98 115.89 1xkd s PHE 40 Ca 0.55 -0.13 -0.01 0.00 -0.05 0.00 0.00 56.93 57.28 1xkd s PHE 40 Cb -0.20 -0.49 0.01 0.00 -0.63 0.00 0.00 43.02 41.71 1xkd s PHE 40 CO 0.25 -0.10 -0.12 0.42 -0.05 0.00 0.00 175.22 175.63 1xkd s ILE 41 N 0.42 2.72 0.29 -4.49 1.01 -0.63 -0.78 121.20 119.73 1xkd s ILE 41 Ca -0.05 -0.72 -0.01 0.00 0.00 0.00 0.00 60.65 59.87 1xkd s ILE 41 Cb -0.09 -2.20 0.18 0.00 0.01 0.00 0.00 42.46 40.36 1xkd s ILE 41 CO -0.00 0.48 1.86 0.03 0.00 0.00 0.00 174.94 177.31 1xkd h ARG 42 N 8.02 0.87 0.00 2.79 3.08 -1.88 -0.56 114.38 126.70 1xkd h ARG 42 Ca -0.44 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.47 1xkd h ARG 42 Cb 1.15 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1xkd h ARG 42 CO 0.62 0.73 0.00 0.41 -1.07 0.00 0.00 179.97 180.66 1xkd n GLY 43 N -0.99 -0.89 3.46 0.04 0.00 -1.26 -1.61 105.19 103.94 1xkd n GLY 43 Ca 0.05 -1.21 -0.28 0.00 0.00 0.00 0.00 46.02 44.58 1xkd n GLY 43 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xkd s ASP 44 N -4.00 3.66 1.73 1.61 -0.00 0.19 -4.45 116.67 115.40 1xkd s ASP 44 Ca 0.00 -0.72 0.00 0.00 -0.00 0.00 0.00 52.55 51.83 1xkd s ASP 44 Cb 0.00 -0.40 0.00 0.00 -0.00 0.00 0.00 42.92 42.52 1xkd s ASP 44 CO 0.00 0.14 0.00 0.61 -0.00 0.00 0.00 175.17 175.92 1xkd n GLY 45 N 0.48 2.86 0.10 0.21 0.00 -1.26 -1.18 105.19 106.40 1xkd n GLY 45 Ca -0.14 0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.07 1xkd n GLY 45 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1xkd n VAL 46 N 0.00 0.78 -0.14 1.61 0.24 -0.44 -4.21 118.33 116.16 1xkd n VAL 46 Ca 0.00 0.14 -0.10 0.00 -2.04 0.00 0.00 64.34 62.34 1xkd n VAL 46 Cb 0.00 -1.02 -0.07 0.00 -1.47 0.00 0.00 33.84 31.28 1xkd n VAL 46 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1xkd h GLY 47 N 2.77 -1.30 0.13 7.63 0.00 -1.35 -1.94 103.07 109.01 1xkd h GLY 47 Ca 0.00 0.79 0.14 0.00 0.00 0.00 0.00 47.33 48.25 1xkd h GLY 47 CO 0.00 -0.29 0.26 -2.55 0.00 0.00 0.00 176.54 173.97 1xkd h PRO 48 N -0.23 0.38 -0.25 4.80 0.11 -1.47 -0.22 132.00 135.13 1xkd h PRO 48 Ca 0.07 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 66.21 1xkd h PRO 48 Cb 0.40 -0.09 -0.06 0.00 0.11 0.00 0.00 31.00 31.36 1xkd h PRO 48 CO -0.48 0.25 -0.17 0.93 -0.21 0.00 0.00 178.00 178.32 1xkd h GLU 49 N 0.40 -0.16 0.02 1.05 5.08 -1.65 -1.43 114.58 117.89 1xkd h GLU 49 Ca 0.40 0.01 -0.21 0.00 -1.00 0.00 0.00 59.36 58.55 1xkd h GLU 49 Cb 0.61 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1xkd h GLU 49 CO -0.41 -0.10 -0.96 -0.39 -1.00 0.00 0.00 179.01 176.15 1xkd h VAL 50 N -0.16 1.50 -0.35 3.13 -1.51 -0.64 -3.00 116.25 115.22 1xkd h VAL 50 Ca 0.14 -2.73 -0.08 0.00 -1.23 0.00 0.00 66.70 62.80 1xkd h VAL 50 Cb 0.37 2.57 -0.02 0.00 -2.13 0.00 0.00 31.29 32.08 1xkd h VAL 50 CO -0.35 0.80 -0.11 0.58 -1.23 0.00 0.00 177.57 177.26 1xkd h VAL 51 N 0.11 1.24 0.00 7.19 2.07 -1.01 -1.94 116.25 123.91 1xkd h VAL 51 Ca -0.06 -1.07 -0.06 0.00 0.82 0.00 0.00 66.70 66.33 1xkd h VAL 51 Cb 1.61 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 1xkd h VAL 51 CO 0.15 0.36 -0.28 -0.08 0.02 0.00 0.00 177.57 177.74 1xkd h GLU 52 N 0.56 0.00 -0.02 1.57 4.22 -1.19 -2.73 114.58 116.98 1xkd h GLU 52 Ca 0.10 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.52 1xkd h GLU 52 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1xkd h GLU 52 CO 0.03 0.28 -0.06 0.77 -2.18 0.00 0.00 179.01 177.85 1xkd h SER 53 N 0.00 0.09 -0.49 1.04 0.02 -1.33 -3.32 113.55 109.55 1xkd h SER 53 Ca -0.00 -0.59 0.10 0.00 -0.84 0.00 0.00 61.79 60.46 1xkd h SER 53 Cb 0.54 -0.03 -0.10 0.00 0.14 0.00 0.00 62.40 62.96 1xkd h SER 53 CO 0.04 0.66 -0.16 0.00 -1.14 0.00 0.00 176.83 176.23 1xkd h ALA 54 N 0.43 0.25 0.17 3.77 0.00 -1.05 0.23 119.26 123.06 1xkd h ALA 54 Ca -0.00 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1xkd h ALA 54 Cb 0.65 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1xkd h ALA 54 CO 0.01 -0.49 -0.08 -0.07 0.00 0.00 0.00 179.25 178.63 1xkd h LEU 55 N -0.05 -0.19 -0.92 0.00 3.38 -1.70 0.66 115.31 116.49 1xkd h LEU 55 Ca 0.23 -0.33 0.14 0.00 0.09 0.00 0.00 57.88 58.01 1xkd h LEU 55 Cb 0.41 0.05 -0.15 0.00 0.09 0.00 0.00 40.66 41.06 1xkd h LEU 55 CO -0.53 0.28 -0.41 0.50 0.09 0.00 0.00 178.44 178.38 1xkd h LYS 56 N -0.73 -0.03 -0.10 1.13 3.64 -1.63 0.82 116.57 119.67 1xkd h LYS 56 Ca -0.02 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1xkd h LYS 56 Cb 0.51 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1xkd h LYS 56 CO 0.04 -0.02 0.02 0.28 -2.27 0.00 0.00 179.45 177.50 1xkd h VAL 57 N -0.03 1.20 0.00 2.00 2.07 -0.38 -2.51 116.25 118.60 1xkd h VAL 57 Ca 0.30 -0.63 -0.09 0.00 0.82 0.00 0.00 66.70 67.11 1xkd h VAL 57 Cb 0.57 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1xkd h VAL 57 CO -0.93 0.18 -0.42 1.62 0.02 0.00 0.00 177.57 178.04 1xkd h VAL 58 N -0.06 1.10 0.00 2.57 3.04 -0.63 -2.32 116.25 119.95 1xkd h VAL 58 Ca 0.03 -1.54 -0.05 0.00 -1.01 0.00 0.00 66.70 64.12 1xkd h VAL 58 Cb 0.27 1.88 -0.01 0.00 -2.01 0.00 0.00 31.29 31.42 1xkd h VAL 58 CO 0.00 0.41 -0.25 0.44 -1.01 0.00 0.00 177.57 177.16 1xkd h ASP 59 N 0.00 0.00 0.70 3.17 3.45 0.83 0.13 116.42 124.70 1xkd h ASP 59 Ca -0.00 0.00 -0.24 0.00 0.43 0.00 0.00 57.03 57.22 1xkd h ASP 59 Cb 0.85 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.61 1xkd h ASP 59 CO 0.05 0.25 -1.08 0.00 -1.57 0.00 0.00 179.24 176.90 1xkd h ALA 60 N 1.75 0.27 -0.04 3.45 0.00 -1.20 -3.26 119.26 120.22 1xkd h ALA 60 Ca -0.00 -0.84 -0.03 0.00 0.00 0.00 0.00 54.91 54.04 1xkd h ALA 60 Cb 0.51 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1xkd h ALA 60 CO 0.03 1.02 -0.07 0.00 0.00 0.00 0.00 179.25 180.23 1xkd h ALA 61 N 0.78 0.07 0.00 0.00 0.00 -0.70 -3.19 119.26 116.22 1xkd h ALA 61 Ca -0.08 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1xkd h ALA 61 Cb 1.79 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.57 1xkd h ALA 61 CO 0.17 -0.10 -0.10 -0.39 0.00 0.00 0.00 179.25 178.82 1xkd h VAL 62 N -0.38 0.69 0.00 0.00 -1.51 -0.96 -1.40 116.25 112.69 1xkd h VAL 62 Ca 0.00 -0.42 -0.03 0.00 -1.23 0.00 0.00 66.70 65.02 1xkd h VAL 62 Cb 0.63 1.26 -0.00 0.00 -2.13 0.00 0.00 31.29 31.04 1xkd h VAL 62 CO 0.02 0.10 -0.13 0.50 -1.23 0.00 0.00 177.57 176.83 1xkd h LYS 63 N 0.00 0.00 -5.23 5.19 3.64 -1.59 -3.31 116.57 115.28 1xkd h LYS 63 Ca -0.00 0.00 -0.62 0.00 -1.27 0.00 0.00 60.65 58.76 1xkd h LYS 63 Cb 0.25 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 31.90 1xkd h LYS 63 CO 0.01 0.13 -0.57 0.15 -2.27 0.00 0.00 179.45 176.90 1xkd s LYS 64 N -3.96 3.93 -1.30 1.90 1.02 -0.53 -3.61 119.74 117.19 1xkd s LYS 64 Ca -0.01 -0.36 -0.06 0.00 0.02 0.00 0.00 55.97 55.56 1xkd s LYS 64 Cb 0.12 -3.24 0.01 0.00 -0.52 0.00 0.00 37.83 34.19 1xkd s LYS 64 CO 0.58 0.20 1.12 0.28 -0.92 0.00 0.00 175.35 176.61 1xkd n VAL 65 N 3.75 -4.12 0.00 3.17 0.31 -1.26 -4.91 118.33 115.27 1xkd n VAL 65 Ca -0.16 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1xkd n VAL 65 Cb 0.52 -4.37 0.00 0.00 -0.91 0.00 0.00 33.84 29.09 1xkd n VAL 65 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xkd n GLY 68 N -1.68 1.32 0.23 2.92 0.00 -1.24 -4.88 105.19 101.86 1xkd n GLY 68 Ca -0.10 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 45.95 1xkd n GLY 68 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xkd h SER 69 N 0.00 0.00 -3.53 1.61 4.64 -1.95 -3.42 113.55 110.90 1xkd h SER 69 Ca 0.00 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.88 1xkd h SER 69 Cb 0.00 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 61.95 1xkd h SER 69 CO 0.00 0.00 -0.62 0.00 -0.87 0.00 0.00 176.83 175.34 1xkd s ARG 70 N -3.50 1.58 -0.30 4.77 1.70 -1.26 -4.76 118.95 117.18 1xkd s ARG 70 Ca -0.01 -1.86 -0.18 0.00 -0.47 0.00 0.00 55.73 53.21 1xkd s ARG 70 Cb 0.03 -0.74 0.20 0.00 -0.57 0.00 0.00 34.95 33.87 1xkd s ARG 70 CO 0.09 -0.19 1.29 0.50 -1.08 0.00 0.00 175.30 175.90 1xkd s ARG 71 N -3.91 0.06 -0.05 3.89 3.52 -1.08 -4.79 118.95 116.59 1xkd s ARG 71 Ca 0.36 0.10 -0.25 0.00 -0.13 0.00 0.00 55.73 55.80 1xkd s ARG 71 Cb 0.08 0.02 -0.03 0.00 -1.56 0.00 0.00 34.95 33.45 1xkd s ARG 71 CO 0.15 -0.01 0.78 0.42 -0.81 0.00 0.00 175.30 175.83 1xkd s ILE 72 N 0.83 4.99 -0.50 4.11 1.01 -1.26 -4.08 121.20 126.30 1xkd s ILE 72 Ca -0.05 1.63 -0.15 0.00 0.00 0.00 0.00 60.65 62.07 1xkd s ILE 72 Cb -0.03 -4.12 0.10 0.00 0.01 0.00 0.00 42.46 38.42 1xkd s ILE 72 CO -0.11 0.22 0.44 0.68 0.00 0.00 0.00 174.94 176.17 1xkd s VAL 73 N 0.91 5.18 0.21 2.92 -7.23 -1.11 -5.04 120.40 116.25 1xkd s VAL 73 Ca 0.42 -1.29 -0.30 0.00 -1.81 0.00 0.00 61.98 58.99 1xkd s VAL 73 Cb -0.19 -4.21 -0.08 0.00 0.56 0.00 0.00 36.38 32.46 1xkd s VAL 73 CO 0.21 -0.72 1.18 0.26 -0.31 0.00 0.00 175.10 175.71 1xkd s TRP 74 N 1.61 3.45 -0.27 2.82 0.52 -1.26 -3.08 118.94 122.73 1xkd s TRP 74 Ca 0.04 1.49 0.01 0.00 0.02 0.00 0.00 56.10 57.65 1xkd s TRP 74 Cb -0.27 -3.40 0.08 0.00 -1.15 0.00 0.00 33.47 28.72 1xkd s TRP 74 CO 0.05 -1.07 0.01 -0.46 0.02 0.00 0.00 176.95 175.50 1xkd s TRP 75 N -0.34 2.31 -0.13 -1.98 -0.00 -0.91 -4.93 118.94 112.96 1xkd s TRP 75 Ca 0.51 -1.87 -0.29 0.00 -0.00 0.00 0.00 56.10 54.44 1xkd s TRP 75 Cb -0.33 -1.78 -0.02 0.00 -0.00 0.00 0.00 33.47 31.34 1xkd s TRP 75 CO 0.38 -0.81 1.18 -2.00 -0.00 0.00 0.00 176.95 175.70 1xkd s GLU 76 N 1.42 4.30 0.17 5.86 2.12 -1.26 -1.23 118.70 130.07 1xkd s GLU 76 Ca 0.01 1.59 0.09 0.00 0.36 0.00 0.00 54.97 57.03 1xkd s GLU 76 Cb -0.18 -3.65 -0.04 0.00 0.26 0.00 0.00 34.13 30.52 1xkd s GLU 76 CO -0.11 -0.56 -0.11 -0.51 -0.54 0.00 0.00 175.26 173.43 1xkd s LEU 77 N 2.83 2.94 -0.20 2.70 1.43 0.04 -4.27 118.68 124.15 1xkd s LEU 77 Ca 0.53 -0.58 -0.07 0.00 -1.03 0.00 0.00 54.13 52.98 1xkd s LEU 77 Cb -0.21 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1xkd s LEU 77 CO 0.16 0.11 0.05 -0.76 0.23 0.00 0.00 176.35 176.15 1xkd s LEU 78 N -2.75 3.59 -0.03 1.79 1.43 -1.26 -4.20 118.68 117.24 1xkd s LEU 78 Ca 0.24 -0.06 -0.12 0.00 -1.03 0.00 0.00 54.13 53.16 1xkd s LEU 78 Cb -0.09 -1.92 0.02 0.00 0.03 0.00 0.00 46.19 44.23 1xkd s LEU 78 CO 0.15 0.09 0.27 0.00 0.23 0.00 0.00 176.35 177.09 1xkd s ALA 79 N 0.85 -0.67 0.00 4.21 0.00 -1.26 -4.39 121.76 120.50 1xkd s ALA 79 Ca 0.03 0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.32 1xkd s ALA 79 Cb -0.14 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.95 1xkd s ALA 79 CO 0.02 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.97 1xkd n GLY 80 N 1.67 0.02 0.36 0.00 0.00 -0.60 -4.30 105.19 102.33 1xkd n GLY 80 Ca -0.20 -1.28 0.09 0.00 0.00 0.00 0.00 46.02 44.63 1xkd n GLY 80 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1xkd h HIS 81 N 0.00 0.69 -0.10 1.61 -0.00 -1.90 -1.54 115.15 113.92 1xkd h HIS 81 Ca 0.00 0.02 -0.18 0.00 -0.00 0.00 0.00 60.37 60.21 1xkd h HIS 81 Cb 0.00 -0.23 -0.00 0.00 -0.00 0.00 0.00 27.41 27.18 1xkd h HIS 81 CO 0.00 0.34 -0.70 -0.07 -0.00 0.00 0.00 177.93 177.50 1xkd h LEU 82 N 0.66 0.52 -0.91 6.12 3.38 -1.86 0.16 115.31 123.37 1xkd h LEU 82 Ca 0.33 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1xkd h LEU 82 Cb 0.42 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1xkd h LEU 82 CO -0.12 1.06 -0.06 0.00 0.09 0.00 0.00 178.44 179.42 1xkd h ALA 83 N 0.93 1.09 -0.06 1.53 0.00 -1.66 -2.43 119.26 118.66 1xkd h ALA 83 Ca -0.03 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.44 1xkd h ALA 83 Cb 1.27 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1xkd h ALA 83 CO 0.12 0.57 -0.67 -0.09 0.00 0.00 0.00 179.25 179.18 1xkd h ARG 84 N 0.68 0.26 0.00 0.00 2.43 -0.87 0.40 114.38 117.28 1xkd h ARG 84 Ca 0.13 -0.20 -0.12 0.00 -0.81 0.00 0.00 59.98 58.97 1xkd h ARG 84 Cb 0.50 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 1xkd h ARG 84 CO 0.03 0.83 -0.59 0.93 -1.51 0.00 0.00 179.97 179.66 1xkd h GLU 85 N 0.18 0.00 0.00 0.20 5.08 -0.66 -3.19 114.58 116.19 1xkd h GLU 85 Ca -0.02 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.04 1xkd h GLU 85 Cb 1.20 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.40 1xkd h GLU 85 CO 0.10 0.59 -2.11 1.63 -1.00 0.00 0.00 179.01 178.22 1xkd n LYS 86 N -3.41 0.46 -0.00 2.33 5.02 -0.92 -4.77 118.16 116.87 1xkd n LYS 86 Ca 0.01 0.14 0.08 0.00 -2.02 0.00 0.00 58.31 56.51 1xkd n LYS 86 Cb 0.70 -1.33 -0.12 0.00 -0.02 0.00 0.00 35.03 34.26 1xkd n LYS 86 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xkd n GLY 88 N 1.50 0.41 3.54 0.00 0.00 -0.97 -5.00 105.19 104.67 1xkd n GLY 88 Ca -0.01 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 1xkd n GLY 88 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1xkd s GLU 89 N -3.14 1.40 -0.04 1.61 -1.05 -1.24 -4.98 118.70 111.27 1xkd s GLU 89 Ca 0.00 -0.75 -0.06 0.00 -0.15 0.00 0.00 54.97 54.01 1xkd s GLU 89 Cb 0.00 0.56 -0.28 0.00 -0.44 0.00 0.00 34.13 33.96 1xkd s GLU 89 CO 0.00 -0.61 0.67 -0.07 0.95 0.00 0.00 175.26 176.20 1xkd h LEU 90 N 2.11 0.46 -6.58 1.83 3.38 -1.86 -2.85 115.31 111.80 1xkd h LEU 90 Ca -0.29 -0.73 -0.59 0.00 0.09 0.00 0.00 57.88 56.36 1xkd h LEU 90 Cb 1.28 -0.15 -0.39 0.00 0.09 0.00 0.00 40.66 41.49 1xkd h LEU 90 CO 0.35 1.63 -0.87 -0.22 0.09 0.00 0.00 178.44 179.43 1xkd s LEU 91 N -7.05 1.50 0.38 1.67 2.96 -1.26 -1.56 118.68 115.31 1xkd s LEU 91 Ca -0.14 -2.60 -0.26 0.00 -0.22 0.00 0.00 54.13 50.91 1xkd s LEU 91 Cb 0.06 -0.54 -0.11 0.00 0.50 0.00 0.00 46.19 46.10 1xkd s LEU 91 CO 0.84 -0.25 1.13 -2.65 -1.32 0.00 0.00 176.35 174.09 1xkd n PRO 92 N 3.49 1.65 -0.33 0.98 -0.02 -1.26 -4.88 135.00 134.63 1xkd n PRO 92 Ca 0.18 0.58 0.14 0.00 -2.02 0.00 0.00 63.50 62.38 1xkd n PRO 92 Cb 0.40 -2.14 0.32 0.00 -0.02 0.00 0.00 33.50 32.07 1xkd n PRO 92 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1xkd h LYS 93 N 1.97 0.56 -0.63 -0.52 1.63 -1.98 -2.42 116.57 115.17 1xkd h LYS 93 Ca -0.45 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.31 1xkd h LYS 93 Cb 1.32 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 32.79 1xkd h LYS 93 CO 0.59 0.37 0.36 0.00 -3.45 0.00 0.00 179.45 177.32 1xkd h ALA 94 N 1.68 0.81 -0.51 5.00 0.00 -1.84 0.76 119.26 125.16 1xkd h ALA 94 Ca 0.58 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.44 1xkd h ALA 94 Cb 1.02 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1xkd h ALA 94 CO -0.45 0.31 0.23 1.15 0.00 0.00 0.00 179.25 180.49 1xkd h THR 95 N 0.86 0.91 -0.67 0.00 2.02 -1.72 1.00 112.91 115.31 1xkd h THR 95 Ca 0.22 -0.16 -0.07 0.00 0.77 0.00 0.00 66.41 67.18 1xkd h THR 95 Cb 0.02 0.42 -0.03 0.00 -1.74 0.00 0.00 68.15 66.82 1xkd h THR 95 CO -0.04 0.08 0.15 -0.07 0.37 0.00 0.00 175.52 176.02 1xkd h LEU 96 N 0.46 1.02 -0.17 2.58 3.38 -1.42 -2.41 115.31 118.74 1xkd h LEU 96 Ca 0.23 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1xkd h LEU 96 Cb 0.18 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1xkd h LEU 96 CO -0.19 0.99 0.05 -0.33 0.09 0.00 0.00 178.44 179.06 1xkd h GLU 97 N 1.00 0.27 -0.51 1.13 4.39 0.23 -2.63 114.58 118.45 1xkd h GLU 97 Ca 0.21 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.86 1xkd h GLU 97 Cb 0.38 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 1xkd h GLU 97 CO 0.00 0.38 0.34 0.78 -1.16 0.00 0.00 179.01 179.36 1xkd h GLY 98 N 0.10 0.71 1.39 -3.84 0.00 0.11 0.04 103.07 101.59 1xkd h GLY 98 Ca 0.05 -0.26 -0.16 0.00 0.00 0.00 0.00 47.33 46.96 1xkd h GLY 98 CO -0.00 0.25 -0.51 -2.22 0.00 0.00 0.00 176.54 174.07 1xkd h ILE 99 N 0.68 1.30 0.00 2.60 2.04 -1.45 -1.44 117.51 121.24 1xkd h ILE 99 Ca 0.19 -1.72 0.00 0.00 1.00 0.00 0.00 64.86 64.33 1xkd h ILE 99 Cb -0.05 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1xkd h ILE 99 CO -0.04 0.54 0.00 -0.09 0.00 0.00 0.00 178.15 178.56 1xkd h ARG 100 N 0.51 0.00 0.02 2.37 2.43 -0.68 0.80 114.38 119.83 1xkd h ARG 100 Ca 0.02 0.00 -0.39 0.00 -0.81 0.00 0.00 59.98 58.80 1xkd h ARG 100 Cb 1.06 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.55 1xkd h ARG 100 CO 0.10 0.00 -2.35 1.28 -1.51 0.00 0.00 179.97 177.49 1xkd n LEU 101 N -2.46 2.67 0.22 3.80 7.99 -0.19 -4.27 117.00 124.76 1xkd n LEU 101 Ca 0.02 0.04 0.10 0.00 -0.01 0.00 0.00 56.01 56.16 1xkd n LEU 101 Cb 0.24 -0.93 0.38 0.00 -0.11 0.00 0.00 43.42 43.00 1xkd n LEU 101 CO 0.21 0.82 0.78 0.00 -1.51 0.00 0.00 177.39 177.70 1xkd h ALA 102 N -0.20 0.96 0.00 -1.18 0.00 -1.19 -3.44 119.26 114.21 1xkd h ALA 102 Ca -0.57 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1xkd h ALA 102 Cb 1.84 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1xkd h ALA 102 CO -0.13 0.25 0.00 0.54 0.00 0.00 0.00 179.25 179.91 1xkd n ARG 103 N -3.27 0.00 -3.93 0.00 5.12 0.27 -4.05 116.66 110.80 1xkd n ARG 103 Ca 0.01 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.80 1xkd n ARG 103 Cb 0.47 -2.11 -0.14 0.00 -1.16 0.00 0.00 32.46 29.52 1xkd n ARG 103 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1xkd s VAL 104 N -0.51 0.09 0.08 1.55 -7.23 -1.26 -2.32 120.40 110.80 1xkd s VAL 104 Ca 0.00 -0.04 -0.12 0.00 -1.81 0.00 0.00 61.98 60.01 1xkd s VAL 104 Cb 0.00 -0.09 0.01 0.00 0.56 0.00 0.00 36.38 36.86 1xkd s VAL 104 CO 0.00 0.03 0.27 0.00 -0.31 0.00 0.00 175.10 175.09 1xkd s ALA 105 N 0.01 -0.52 -0.10 1.32 0.00 -1.05 -1.53 121.76 119.89 1xkd s ALA 105 Ca 0.00 -0.30 0.02 0.00 0.00 0.00 0.00 51.96 51.69 1xkd s ALA 105 Cb -0.01 0.47 0.01 0.00 0.00 0.00 0.00 23.12 23.59 1xkd s ALA 105 CO -0.00 -0.50 -0.16 -1.17 0.00 0.00 0.00 175.76 173.93 1xkd s LEU 106 N -2.57 1.78 0.07 0.00 2.96 0.54 -0.57 118.68 120.90 1xkd s LEU 106 Ca 0.01 -0.43 0.07 0.00 -0.22 0.00 0.00 54.13 53.56 1xkd s LEU 106 Cb 0.02 -1.10 -0.03 0.00 0.50 0.00 0.00 46.19 45.58 1xkd s LEU 106 CO -0.09 0.05 -0.20 -1.59 -1.32 0.00 0.00 176.35 173.20 1xkd s LYS 107 N 0.80 1.24 0.80 1.98 -2.85 0.78 -1.61 119.74 120.88 1xkd s LYS 107 Ca -0.10 -1.02 -0.07 0.00 -1.00 0.00 0.00 55.97 53.78 1xkd s LYS 107 Cb -0.16 -1.41 0.14 0.00 -2.06 0.00 0.00 37.83 34.34 1xkd s LYS 107 CO 0.01 0.35 1.10 0.20 0.10 0.00 0.00 175.35 177.11 1xkd s GLY 108 N -1.48 1.76 0.43 0.59 0.00 -0.22 -4.27 107.32 104.14 1xkd s GLY 108 Ca 0.07 -1.42 -0.25 0.00 0.00 0.00 0.00 44.72 43.11 1xkd s GLY 108 CO 0.03 -0.81 1.36 2.56 0.00 0.00 0.00 173.10 176.23 1xkd s PRO 109 N -5.40 3.80 -0.07 2.90 0.04 -1.26 -4.65 135.00 130.35 1xkd s PRO 109 Ca 0.68 2.27 0.02 0.00 0.04 0.00 0.00 61.00 64.01 1xkd s PRO 109 Cb -0.06 -2.68 -0.02 0.00 0.04 0.00 0.00 34.50 31.78 1xkd s PRO 109 CO 0.47 -0.67 -0.12 -0.51 0.04 0.00 0.00 177.00 176.20 1xkd s LEU 110 N -2.63 2.83 0.20 -3.56 1.43 -1.26 0.53 118.68 116.22 1xkd s LEU 110 Ca 0.60 -0.18 -0.31 0.00 -1.03 0.00 0.00 54.13 53.21 1xkd s LEU 110 Cb -0.40 -1.60 -0.09 0.00 0.03 0.00 0.00 46.19 44.12 1xkd s LEU 110 CO 0.52 0.31 1.44 -0.70 0.23 0.00 0.00 176.35 178.14 1xkd s GLU 111 N -0.51 4.29 -0.13 1.70 2.12 -1.26 -4.79 118.70 120.12 1xkd s GLU 111 Ca 0.07 2.24 0.01 0.00 0.36 0.00 0.00 54.97 57.64 1xkd s GLU 111 Cb -0.12 -3.15 0.02 0.00 0.26 0.00 0.00 34.13 31.14 1xkd s GLU 111 CO 0.02 -0.43 -0.14 0.99 -0.54 0.00 0.00 175.26 175.15 1xkd s THR 112 N 0.42 1.52 0.59 -1.70 2.01 -1.26 -4.70 115.64 112.52 1xkd s THR 112 Ca 0.62 -0.61 -0.17 0.00 0.31 0.00 0.00 61.69 61.84 1xkd s THR 112 Cb -0.41 -1.42 -0.03 0.00 0.01 0.00 0.00 72.50 70.65 1xkd s THR 112 CO 0.38 0.45 1.09 -2.16 -0.69 0.00 0.00 174.62 173.69 1xkd s PRO 113 N 1.35 3.20 -0.17 4.92 0.04 -1.26 -5.03 135.00 138.04 1xkd s PRO 113 Ca 0.01 1.37 -0.06 0.00 0.04 0.00 0.00 61.00 62.36 1xkd s PRO 113 Cb -0.13 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 1xkd s PRO 113 CO -0.08 -0.93 0.04 0.08 0.04 0.00 0.00 177.00 176.15 1xkd s VAL 114 N -2.22 4.58 0.00 -0.36 1.01 -1.26 -4.54 120.40 117.60 1xkd s VAL 114 Ca 0.67 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.54 1xkd s VAL 114 Cb -0.19 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.14 1xkd s VAL 114 CO 0.34 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.53 1xkd n GLY 115 N 3.51 1.39 3.30 4.51 0.00 -1.26 -4.86 105.19 111.78 1xkd n GLY 115 Ca -0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 1xkd n GLY 115 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xkd n THR 116 N 0.00 0.00 -4.40 2.61 -2.24 -1.26 -5.11 114.28 103.88 1xkd n THR 116 Ca 0.00 -2.17 0.00 0.00 -2.27 0.00 0.00 64.05 59.61 1xkd n THR 116 Cb 0.00 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.65 1xkd n THR 116 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xkd n GLY 117 N -0.51 -0.87 3.82 3.38 0.00 -1.26 -4.62 105.19 105.14 1xkd n GLY 117 Ca -0.19 -1.16 -0.33 0.00 0.00 0.00 0.00 46.02 44.35 1xkd n GLY 117 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xkd s TYR 118 N 0.00 3.27 0.61 1.61 -0.85 -1.26 -5.00 117.35 115.72 1xkd s TYR 118 Ca 0.00 1.52 -0.17 0.00 -0.52 0.00 0.00 57.07 57.90 1xkd s TYR 118 Cb 0.00 -2.88 -0.03 0.00 0.38 0.00 0.00 41.96 39.43 1xkd s TYR 118 CO 0.00 -0.52 1.15 1.03 -1.52 0.00 0.00 175.55 175.69 1xkd s ARG 119 N -3.75 2.99 -0.14 -3.49 0.52 -1.26 -4.42 118.95 109.39 1xkd s ARG 119 Ca 0.62 1.59 -0.36 0.00 -0.52 0.00 0.00 55.73 57.06 1xkd s ARG 119 Cb -0.12 -1.96 -0.13 0.00 0.52 0.00 0.00 34.95 33.27 1xkd s ARG 119 CO 0.27 -1.14 1.84 0.45 0.02 0.00 0.00 175.30 176.73 1xkd n SER 120 N -1.85 3.12 0.20 0.23 2.88 -1.26 -4.87 113.62 112.06 1xkd n SER 120 Ca 0.12 1.01 0.04 0.00 -1.33 0.00 0.00 58.87 58.71 1xkd n SER 120 Cb 0.51 -1.30 0.40 0.00 -0.75 0.00 0.00 64.21 63.07 1xkd n SER 120 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1xkd h LEU 121 N 8.55 0.00 -0.52 2.46 3.38 -1.90 -0.12 115.31 127.15 1xkd h LEU 121 Ca -0.48 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.44 1xkd h LEU 121 Cb 1.29 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1xkd h LEU 121 CO 0.95 0.35 0.13 0.78 0.09 0.00 0.00 178.44 180.74 1xkd h ASN 122 N 0.00 0.79 -0.38 -0.43 2.35 -1.89 -1.67 115.58 114.36 1xkd h ASN 122 Ca -0.00 -0.23 -0.13 0.00 -0.55 0.00 0.00 56.30 55.39 1xkd h ASN 122 Cb 0.67 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1xkd h ASN 122 CO 0.04 0.82 -0.24 0.58 -1.65 0.00 0.00 177.43 176.98 1xkd h VAL 123 N 0.73 1.27 -0.80 2.81 2.07 -1.86 -2.35 116.25 118.13 1xkd h VAL 123 Ca 0.17 -1.39 -0.04 0.00 0.82 0.00 0.00 66.70 66.26 1xkd h VAL 123 Cb 0.33 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 1xkd h VAL 123 CO 0.00 0.47 0.36 0.00 0.02 0.00 0.00 177.57 178.42 1xkd h ALA 124 N 0.96 1.13 0.08 1.67 0.00 -0.88 0.13 119.26 122.35 1xkd h ALA 124 Ca 0.10 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xkd h ALA 124 Cb 0.79 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1xkd h ALA 124 CO 0.07 0.64 -0.04 0.82 0.00 0.00 0.00 179.25 180.74 1xkd h ILE 125 N 1.14 1.04 -0.99 0.00 2.04 -1.23 0.33 117.51 119.84 1xkd h ILE 125 Ca 0.27 -0.44 0.07 0.00 1.00 0.00 0.00 64.86 65.77 1xkd h ILE 125 Cb 0.15 1.33 -0.07 0.00 -0.74 0.00 0.00 36.82 37.49 1xkd h ILE 125 CO -0.03 0.11 0.64 0.03 0.00 0.00 0.00 178.15 178.90 1xkd h ARG 126 N -0.31 1.10 0.17 2.37 3.08 -1.20 -0.42 114.38 119.18 1xkd h ARG 126 Ca -0.01 -0.07 -0.24 0.00 0.07 0.00 0.00 59.98 59.74 1xkd h ARG 126 Cb 0.26 -0.25 0.02 0.00 0.08 0.00 0.00 29.97 30.09 1xkd h ARG 126 CO 0.02 0.73 -1.06 1.96 -1.07 0.00 0.00 179.97 180.55 1xkd h GLN 127 N 1.14 0.36 -0.61 0.04 4.20 -0.62 -1.21 115.11 118.40 1xkd h GLN 127 Ca 0.44 -0.62 -0.08 0.00 0.06 0.00 0.00 58.65 58.45 1xkd h GLN 127 Cb 0.22 0.23 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 1xkd h GLN 127 CO -0.18 1.29 0.07 0.00 -0.67 0.00 0.00 178.83 179.34 1xkd h ALA 128 N 0.09 0.96 -0.16 3.87 0.00 -0.29 -2.99 119.26 120.75 1xkd h ALA 128 Ca -0.19 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1xkd h ALA 128 Cb 1.80 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1xkd h ALA 128 CO 0.18 0.64 0.00 1.28 0.00 0.00 0.00 179.25 181.35 1xkd n LEU 129 N -4.21 2.11 -2.88 0.00 4.77 -0.17 -4.95 117.00 111.68 1xkd n LEU 129 Ca 0.04 -0.83 -0.22 0.00 -0.03 0.00 0.00 56.01 54.97 1xkd n LEU 129 Cb 0.30 -0.10 0.02 0.00 -2.33 0.00 0.00 43.42 41.31 1xkd n LEU 129 CO 0.43 0.42 -0.08 -0.67 -1.33 0.00 0.00 177.39 176.16 1xkd n ASP 130 N 0.62 -5.74 -4.58 -1.43 2.03 -0.96 -4.90 116.55 101.60 1xkd n ASP 130 Ca 0.17 -0.21 -0.41 0.00 0.52 0.00 0.00 54.79 54.87 1xkd n ASP 130 Cb 0.42 -4.68 -0.01 0.00 -0.72 0.00 0.00 41.12 36.12 1xkd n ASP 130 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1xkd n LEU 131 N -3.70 4.64 0.08 -2.67 4.77 -0.50 -4.40 117.00 115.22 1xkd n LEU 131 Ca -0.14 -3.80 0.13 0.00 -0.03 0.00 0.00 56.01 52.17 1xkd n LEU 131 Cb 0.63 -1.75 0.47 0.00 -2.33 0.00 0.00 43.42 40.44 1xkd n LEU 131 CO 0.42 -0.17 0.90 0.00 -1.33 0.00 0.00 177.39 177.20 1xkd n TYR 132 N 9.38 0.63 -4.17 -1.77 0.18 -0.95 -4.41 117.16 116.04 1xkd n TYR 132 Ca 0.48 0.19 -0.33 0.00 1.88 0.00 0.00 57.90 60.13 1xkd n TYR 132 Cb 0.46 -0.81 -0.16 0.00 -0.38 0.00 0.00 39.34 38.45 1xkd n TYR 132 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1xkd s ALA 133 N -3.09 2.35 -0.43 -3.48 0.00 -0.48 -1.39 121.76 115.24 1xkd s ALA 133 Ca 0.11 -1.20 -0.13 0.00 0.00 0.00 0.00 51.96 50.74 1xkd s ALA 133 Cb 0.14 -1.19 0.06 0.00 0.00 0.00 0.00 23.12 22.12 1xkd s ALA 133 CO 0.54 -0.32 0.31 1.21 0.00 0.00 0.00 175.76 177.51 1xkd s ASN 134 N 1.24 5.91 -0.33 0.00 3.04 -0.49 0.83 114.94 125.13 1xkd s ASN 134 Ca 0.04 -1.29 -0.11 0.00 0.04 0.00 0.00 52.86 51.54 1xkd s ASN 134 Cb -0.13 -2.09 -0.01 0.00 -1.54 0.00 0.00 41.25 37.48 1xkd s ASN 134 CO -0.11 -0.55 0.20 -0.63 -3.04 0.00 0.00 177.10 172.97 1xkd s ILE 135 N 1.56 4.91 -0.38 -5.21 -1.09 0.88 -2.08 121.20 119.80 1xkd s ILE 135 Ca 0.03 -0.39 0.02 0.00 -2.23 0.00 0.00 60.65 58.08 1xkd s ILE 135 Cb -0.22 -3.55 0.11 0.00 -1.58 0.00 0.00 42.46 37.22 1xkd s ILE 135 CO 0.05 -0.01 0.14 -0.13 -1.23 0.00 0.00 174.94 173.76 1xkd s ARG 136 N 1.66 1.23 0.30 2.79 0.52 -0.80 -1.01 118.95 123.64 1xkd s ARG 136 Ca 0.05 -1.73 -0.29 0.00 -0.52 0.00 0.00 55.73 53.24 1xkd s ARG 136 Cb -0.17 -2.58 -0.10 0.00 0.52 0.00 0.00 34.95 32.61 1xkd s ARG 136 CO 0.08 -1.03 1.23 -2.14 0.02 0.00 0.00 175.30 173.46 1xkd s PRO 137 N 0.86 4.47 -0.26 3.54 0.02 -1.26 -1.73 135.00 140.64 1xkd s PRO 137 Ca 0.13 2.05 0.03 0.00 0.02 0.00 0.00 61.00 63.23 1xkd s PRO 137 Cb -0.21 -3.12 0.06 0.00 0.02 0.00 0.00 34.50 31.25 1xkd s PRO 137 CO -0.11 -0.04 -0.11 0.08 -0.33 0.00 0.00 177.00 176.50 1xkd s VAL 138 N -1.08 2.22 0.05 3.83 1.01 0.94 -4.41 120.40 122.95 1xkd s VAL 138 Ca 0.48 -1.58 0.04 0.00 0.00 0.00 0.00 61.98 60.92 1xkd s VAL 138 Cb -0.37 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.71 1xkd s VAL 138 CO 0.48 0.00 -0.12 -0.13 0.00 0.00 0.00 175.10 175.33 1xkd s ARG 139 N 1.12 0.76 -0.19 2.72 1.81 -1.26 -1.59 118.95 122.32 1xkd s ARG 139 Ca -0.08 -0.78 -0.10 0.00 -1.72 0.00 0.00 55.73 53.05 1xkd s ARG 139 Cb -0.20 -0.71 -0.05 0.00 -0.45 0.00 0.00 34.95 33.55 1xkd s ARG 139 CO -0.05 0.16 0.14 -0.47 -0.68 0.00 0.00 175.30 174.40 1xkd s TYR 140 N -1.07 3.43 -0.03 -0.53 5.04 -1.25 -4.96 117.35 117.99 1xkd s TYR 140 Ca -0.02 0.36 0.04 0.00 -2.44 0.00 0.00 57.07 55.01 1xkd s TYR 140 Cb -0.09 -2.14 0.06 0.00 0.35 0.00 0.00 41.96 40.14 1xkd s TYR 140 CO 0.01 0.34 0.99 0.66 -1.34 0.00 0.00 175.55 176.22 1xkd n TYR 141 N 3.34 0.00 0.00 4.97 4.02 -1.26 -4.98 117.16 123.24 1xkd n TYR 141 Ca -0.16 -0.55 0.00 0.00 -0.01 0.00 0.00 57.90 57.17 1xkd n TYR 141 Cb 0.52 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.78 1xkd n TYR 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1xkd n GLY 142 N -0.64 0.35 3.67 2.72 0.00 -1.26 -4.53 105.19 105.49 1xkd n GLY 142 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1xkd n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xkd n GLN 143 N -1.90 0.88 -1.67 1.61 0.00 -1.26 -4.76 117.38 110.28 1xkd n GLN 143 Ca 0.00 0.35 -0.45 0.00 0.00 0.00 0.00 57.00 56.90 1xkd n GLN 143 Cb 0.00 -2.35 -0.03 0.00 0.00 0.00 0.00 30.24 27.86 1xkd n GLN 143 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 1xkd n PRO 144 N -1.67 2.08 -3.87 2.61 -0.02 -1.26 -4.94 135.00 127.94 1xkd n PRO 144 Ca 0.15 0.74 -0.11 0.00 -2.02 0.00 0.00 63.50 62.26 1xkd n PRO 144 Cb 0.48 -2.45 -0.10 0.00 -0.02 0.00 0.00 33.50 31.42 1xkd n PRO 144 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xkd s ALA 145 N 0.29 -0.33 -0.22 3.55 0.00 -1.26 -4.46 121.76 119.33 1xkd s ALA 145 Ca 0.72 -0.07 0.25 0.00 0.00 0.00 0.00 51.96 52.86 1xkd s ALA 145 Cb -0.66 0.07 0.61 0.00 0.00 0.00 0.00 23.12 23.14 1xkd s ALA 145 CO 0.45 -0.19 1.70 -1.00 0.00 0.00 0.00 175.76 176.72 1xkd h PRO 146 N 4.47 0.00 -5.79 0.00 0.14 -1.79 -3.44 132.00 125.59 1xkd h PRO 146 Ca -0.30 0.00 -0.58 0.00 0.14 0.00 0.00 66.00 65.26 1xkd h PRO 146 Cb 1.19 0.00 -0.08 0.00 0.14 0.00 0.00 31.00 32.26 1xkd h PRO 146 CO 0.41 0.09 0.02 -1.58 0.14 0.00 0.00 178.00 177.07 1xkd s HIS 147 N -3.33 3.48 0.57 1.56 2.46 -1.17 -4.96 115.29 113.91 1xkd s HIS 147 Ca 0.05 1.00 0.27 0.00 0.47 0.00 0.00 55.06 56.84 1xkd s HIS 147 Cb 0.07 -2.71 1.58 0.00 -0.13 0.00 0.00 32.58 31.38 1xkd s HIS 147 CO 0.65 0.02 2.10 0.87 -2.47 0.00 0.00 174.74 175.90 1xkd h LYS 148 N 7.02 0.00 -0.53 2.88 1.57 -1.91 -2.35 116.57 123.25 1xkd h LYS 148 Ca -0.37 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.02 1xkd h LYS 148 Cb 1.17 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 33.14 1xkd h LYS 148 CO 0.76 0.00 -0.79 0.66 -0.57 0.00 0.00 179.45 179.51 1xkd n TYR 149 N -3.99 1.92 -0.23 -1.35 4.02 -1.26 -4.78 117.16 111.50 1xkd n TYR 149 Ca 0.02 -2.00 0.14 0.00 -0.01 0.00 0.00 57.90 56.05 1xkd n TYR 149 Cb 0.32 -0.30 0.44 0.00 -0.02 0.00 0.00 39.34 39.78 1xkd n TYR 149 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xkd h ALA 150 N 1.94 1.99 0.00 -0.72 0.00 -1.70 0.80 119.26 121.56 1xkd h ALA 150 Ca 0.22 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1xkd h ALA 150 Cb 1.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1xkd h ALA 150 CO 0.52 -0.22 0.00 -0.40 0.00 0.00 0.00 179.25 179.14 1xkd n ASP 151 N -4.53 0.00 -0.52 0.00 5.75 -1.26 -1.53 116.55 114.46 1xkd n ASP 151 Ca 0.17 -0.05 0.11 0.00 -0.01 0.00 0.00 54.79 55.01 1xkd n ASP 151 Cb 0.53 -0.21 0.07 0.00 -1.03 0.00 0.00 41.12 40.47 1xkd n ASP 151 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1xkd n ARG 152 N -1.21 1.31 -2.99 0.11 3.00 0.27 -4.86 116.66 112.28 1xkd n ARG 152 Ca 0.08 -1.05 -0.41 0.00 -0.01 0.00 0.00 57.85 56.46 1xkd n ARG 152 Cb 0.10 -1.48 -0.05 0.00 0.00 0.00 0.00 32.46 31.03 1xkd n ARG 152 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1xkd s VAL 153 N -2.42 4.87 -0.33 1.55 1.01 -0.58 -3.71 120.40 120.78 1xkd s VAL 153 Ca 0.21 1.21 0.02 0.00 0.00 0.00 0.00 61.98 63.42 1xkd s VAL 153 Cb 0.19 -4.07 0.15 0.00 0.00 0.00 0.00 36.38 32.65 1xkd s VAL 153 CO 0.53 -0.13 0.38 -0.62 0.00 0.00 0.00 175.10 175.26 1xkd s ASP 154 N 1.52 0.95 0.12 3.32 3.68 -1.25 -3.89 116.67 121.13 1xkd s ASP 154 Ca 0.30 -1.05 0.01 0.00 2.13 0.00 0.00 52.55 53.95 1xkd s ASP 154 Cb -0.15 0.76 -0.04 0.00 -1.45 0.00 0.00 42.92 42.04 1xkd s ASP 154 CO 0.10 -0.31 -0.03 -0.04 0.13 0.00 0.00 175.17 175.02 1xkd s MET 155 N 1.95 0.92 -0.05 4.34 -1.94 -0.62 -4.52 119.30 119.38 1xkd s MET 155 Ca 0.13 -1.40 -0.00 0.00 -1.71 0.00 0.00 55.69 52.71 1xkd s MET 155 Cb -0.14 -0.17 0.03 0.00 2.01 0.00 0.00 34.83 36.56 1xkd s MET 155 CO -0.17 -0.08 -0.01 0.08 -0.01 0.00 0.00 175.02 174.83 1xkd s VAL 156 N -3.69 0.34 -0.24 -6.03 1.01 0.11 -0.04 120.40 111.85 1xkd s VAL 156 Ca 0.17 0.06 -0.13 0.00 0.00 0.00 0.00 61.98 62.08 1xkd s VAL 156 Cb 0.06 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 1xkd s VAL 156 CO -0.02 0.21 0.26 -0.63 0.00 0.00 0.00 175.10 174.93 1xkd s ILE 157 N 1.40 5.28 -0.48 2.22 1.01 -0.70 -1.01 121.20 128.91 1xkd s ILE 157 Ca -0.04 0.38 -0.13 0.00 0.00 0.00 0.00 60.65 60.86 1xkd s ILE 157 Cb -0.13 -3.60 0.10 0.00 0.01 0.00 0.00 42.46 38.85 1xkd s ILE 157 CO -0.03 0.27 0.39 -0.36 0.00 0.00 0.00 174.94 175.21 1xkd s PHE 158 N 1.45 3.32 -0.23 3.97 0.08 0.89 -1.90 117.98 125.55 1xkd s PHE 158 Ca 0.12 -1.42 -0.07 0.00 0.12 0.00 0.00 56.93 55.67 1xkd s PHE 158 Cb -0.15 -3.41 -0.03 0.00 -0.57 0.00 0.00 43.02 38.86 1xkd s PHE 158 CO 0.08 -0.93 0.06 0.50 -0.10 0.00 0.00 175.22 174.82 1xkd s ARG 159 N 1.51 3.69 0.21 0.44 3.52 -0.88 -1.15 118.95 126.28 1xkd s ARG 159 Ca 0.04 -0.47 -0.32 0.00 -0.13 0.00 0.00 55.73 54.86 1xkd s ARG 159 Cb -0.26 -3.27 -0.12 0.00 -1.56 0.00 0.00 34.95 29.73 1xkd s ARG 159 CO 0.03 -0.10 1.73 -2.00 -0.81 0.00 0.00 175.30 174.15 1xkd s GLU 160 N 1.35 4.12 -0.04 5.12 -6.30 0.16 -1.40 118.70 121.72 1xkd s GLU 160 Ca 0.05 2.61 0.11 0.00 -2.50 0.00 0.00 54.97 55.25 1xkd s GLU 160 Cb -0.15 -3.09 0.33 0.00 0.00 0.00 0.00 34.13 31.22 1xkd s GLU 160 CO 0.03 -0.76 1.27 -1.71 0.02 0.00 0.00 175.26 174.11 1xkd n ASN 161 N 4.05 3.04 0.00 -1.70 5.15 -0.48 -2.89 115.26 122.44 1xkd n ASN 161 Ca 0.16 -2.24 0.00 0.00 -0.60 0.00 0.00 54.58 51.90 1xkd n ASN 161 Cb 0.35 -0.28 0.00 0.00 -0.53 0.00 0.00 39.78 39.32 1xkd n ASN 161 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1xkd n THR 162 N 0.17 0.00 -0.93 -0.44 -2.24 -1.26 -4.67 114.28 104.91 1xkd n THR 162 Ca 0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 1xkd n THR 162 Cb 0.52 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.39 1xkd n THR 162 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1xkd n GLU 163 N -1.14 2.74 0.00 -0.78 0.28 -1.26 -4.42 120.64 116.06 1xkd n GLU 163 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1xkd n GLU 163 Cb 0.20 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.07 1xkd n GLU 163 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1xkd n ASP 164 N 0.00 -3.56 0.30 -1.84 -0.08 -0.13 -3.21 116.55 108.03 1xkd n ASP 164 Ca 0.00 0.00 0.17 0.00 -1.51 0.00 0.00 54.79 53.45 1xkd n ASP 164 Cb 0.00 0.00 0.85 0.00 2.34 0.00 0.00 41.12 44.31 1xkd n ASP 164 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 1xkd h VAL 165 N 0.00 0.08 0.00 5.18 -1.51 -1.84 -0.46 116.25 117.70 1xkd h VAL 165 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1xkd h VAL 165 Cb 0.00 0.71 0.00 0.00 -2.13 0.00 0.00 31.29 29.87 1xkd h VAL 165 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.12 1xkd n TYR 166 N -3.07 0.45 0.28 5.19 4.02 -1.20 -2.55 117.16 120.28 1xkd n TYR 166 Ca -0.01 0.23 0.18 0.00 -0.01 0.00 0.00 57.90 58.30 1xkd n TYR 166 Cb 0.38 -0.88 0.96 0.00 -0.02 0.00 0.00 39.34 39.78 1xkd n TYR 166 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1xkd h ALA 167 N 2.01 1.00 -2.25 -0.72 0.00 -1.19 -3.46 119.26 114.65 1xkd h ALA 167 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1xkd h ALA 167 Cb 0.01 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.83 1xkd h ALA 167 CO 0.00 0.00 -0.25 0.41 0.00 0.00 0.00 179.25 179.41 1xkd n GLY 168 N -1.07 0.24 3.33 0.00 0.00 -1.06 -5.01 105.19 101.62 1xkd n GLY 168 Ca -0.02 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 1xkd n GLY 168 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xkd s ILE 169 N -2.85 4.47 -0.06 -0.61 1.01 -1.26 -5.02 121.20 116.87 1xkd s ILE 169 Ca 0.14 -1.11 -0.30 0.00 0.00 0.00 0.00 60.65 59.38 1xkd s ILE 169 Cb -0.06 -3.61 0.11 0.00 0.01 0.00 0.00 42.46 38.91 1xkd s ILE 169 CO 0.18 -0.37 0.97 -1.83 0.00 0.00 0.00 174.94 173.88 1xkd s GLU 170 N 1.50 0.69 0.00 2.79 -1.05 -1.26 -0.85 118.70 120.53 1xkd s GLU 170 Ca 0.02 -0.22 0.02 0.00 -0.15 0.00 0.00 54.97 54.64 1xkd s GLU 170 Cb -0.21 0.32 -0.01 0.00 -0.44 0.00 0.00 34.13 33.79 1xkd s GLU 170 CO 0.05 -0.29 -0.06 -1.58 0.95 0.00 0.00 175.26 174.33 1xkd s TRP 171 N -2.76 0.50 0.70 4.83 0.51 0.22 -4.98 118.94 117.95 1xkd s TRP 171 Ca 0.05 -0.16 -0.17 0.00 -2.12 0.00 0.00 56.10 53.71 1xkd s TRP 171 Cb -0.01 -0.32 0.02 0.00 -0.81 0.00 0.00 33.47 32.35 1xkd s TRP 171 CO -0.07 -0.02 1.25 -0.35 -0.51 0.00 0.00 176.95 177.25 1xkd n PRO 172 N 2.69 0.83 0.23 4.98 -0.04 -1.26 -2.42 135.00 140.01 1xkd n PRO 172 Ca -0.15 0.34 0.09 0.00 -0.04 0.00 0.00 63.50 63.75 1xkd n PRO 172 Cb 0.58 -2.49 0.64 0.00 -0.04 0.00 0.00 33.50 32.19 1xkd n PRO 172 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1xkd h HIS 173 N 0.10 0.02 -0.28 0.54 2.07 -1.92 -2.63 115.15 113.05 1xkd h HIS 173 Ca -0.49 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.03 1xkd h HIS 173 Cb 1.33 -0.01 0.00 0.00 2.57 0.00 0.00 27.41 31.30 1xkd h HIS 173 CO 0.42 0.01 0.00 -0.40 -3.07 0.00 0.00 177.93 174.89 1xkd n ASP 174 N -4.52 2.99 -4.78 3.10 3.85 -1.26 -4.65 116.55 111.28 1xkd n ASP 174 Ca -0.02 -1.87 -0.36 0.00 -0.71 0.00 0.00 54.79 51.83 1xkd n ASP 174 Cb 0.14 -0.18 -0.02 0.00 -1.35 0.00 0.00 41.12 39.71 1xkd n ASP 174 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 1xkd s SER 175 N -1.27 6.23 0.46 -1.12 1.04 -0.99 -4.94 113.70 113.11 1xkd s SER 175 Ca 0.29 2.19 0.14 0.00 0.48 0.00 0.00 55.95 59.06 1xkd s SER 175 Cb 0.17 -2.59 1.09 0.00 0.10 0.00 0.00 66.02 64.79 1xkd s SER 175 CO 0.24 -0.87 2.05 1.55 0.98 0.00 0.00 173.24 177.19 1xkd h PRO 176 N 1.95 0.28 -0.58 4.02 0.13 -1.93 -2.71 132.00 133.16 1xkd h PRO 176 Ca -0.49 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 1xkd h PRO 176 Cb 1.24 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1xkd h PRO 176 CO 0.60 0.19 0.25 0.93 -0.23 0.00 0.00 178.00 179.73 1xkd h GLU 177 N 0.29 0.86 -0.74 0.86 3.07 -1.92 0.50 114.58 117.51 1xkd h GLU 177 Ca 0.17 -0.15 -0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1xkd h GLU 177 Cb 0.31 -0.14 -0.04 0.00 -0.84 0.00 0.00 28.75 28.04 1xkd h GLU 177 CO -0.04 0.73 0.41 0.00 -1.40 0.00 0.00 179.01 178.71 1xkd h ALA 178 N 1.09 0.95 -0.58 3.43 0.00 -1.71 -1.93 119.26 120.51 1xkd h ALA 178 Ca 0.20 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1xkd h ALA 178 Cb 0.18 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1xkd h ALA 178 CO -0.02 0.46 0.03 0.00 0.00 0.00 0.00 179.25 179.73 1xkd h ALA 179 N 1.21 0.97 -0.86 0.00 0.00 -1.15 0.44 119.26 119.87 1xkd h ALA 179 Ca 0.26 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1xkd h ALA 179 Cb 0.03 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1xkd h ALA 179 CO -0.04 0.63 0.42 -0.09 0.00 0.00 0.00 179.25 180.17 1xkd h ARG 180 N 0.91 1.24 -0.33 0.00 2.43 -0.67 -1.42 114.38 116.53 1xkd h ARG 180 Ca 0.17 -0.18 -0.12 0.00 -0.81 0.00 0.00 59.98 59.05 1xkd h ARG 180 Cb 0.48 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1xkd h ARG 180 CO 0.02 0.94 -0.25 0.82 -1.51 0.00 0.00 179.97 180.00 1xkd h ILE 181 N 1.23 1.29 -0.68 1.20 2.04 -0.88 0.26 117.51 121.96 1xkd h ILE 181 Ca 0.30 -1.40 0.12 0.00 1.00 0.00 0.00 64.86 64.87 1xkd h ILE 181 Cb 0.11 1.46 -0.08 0.00 -0.74 0.00 0.00 36.82 37.57 1xkd h ILE 181 CO -0.04 0.46 0.26 0.03 0.00 0.00 0.00 178.15 178.85 1xkd h ARG 182 N 0.53 0.41 -0.19 2.37 3.08 -0.88 0.54 114.38 120.24 1xkd h ARG 182 Ca 0.06 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 1xkd h ARG 182 Cb 0.81 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.77 1xkd h ARG 182 CO 0.07 0.27 -0.19 0.00 -1.07 0.00 0.00 179.97 179.04 1xkd h ARG 183 N 0.42 0.46 -0.46 0.04 3.08 -0.96 -1.79 114.38 115.19 1xkd h ARG 183 Ca 0.36 -0.25 0.01 0.00 0.07 0.00 0.00 59.98 60.17 1xkd h ARG 183 Cb 0.49 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.52 1xkd h ARG 183 CO -0.36 0.82 0.28 0.35 -1.07 0.00 0.00 179.97 180.00 1xkd h PHE 184 N 0.12 0.54 -0.08 3.04 3.57 -0.73 -0.73 116.94 122.66 1xkd h PHE 184 Ca 0.03 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.41 1xkd h PHE 184 Cb 0.74 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.29 1xkd h PHE 184 CO 0.08 0.32 -0.54 -0.07 -2.23 0.00 0.00 178.31 175.88 1xkd h LEU 185 N 0.57 0.25 -0.19 0.59 3.38 -0.85 -1.36 115.31 117.70 1xkd h LEU 185 Ca 0.18 -0.13 -0.15 0.00 0.09 0.00 0.00 57.88 57.87 1xkd h LEU 185 Cb -0.02 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1xkd h LEU 185 CO -0.06 0.74 -0.46 0.00 0.09 0.00 0.00 178.44 178.74 1xkd h ALA 186 N 1.27 0.31 0.03 1.53 0.00 -1.03 -0.32 119.26 121.06 1xkd h ALA 186 Ca 0.00 -0.48 -0.24 0.00 0.00 0.00 0.00 54.91 54.20 1xkd h ALA 186 Cb 1.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1xkd h ALA 186 CO 0.08 0.46 -1.01 0.93 0.00 0.00 0.00 179.25 179.71 1xkd h GLU 187 N 0.33 0.39 0.03 0.00 5.08 -1.04 -2.05 114.58 117.33 1xkd h GLU 187 Ca -0.00 -0.46 -0.34 0.00 -1.00 0.00 0.00 59.36 57.56 1xkd h GLU 187 Cb 1.07 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 30.41 1xkd h GLU 187 CO 0.10 1.13 -2.00 0.39 -1.00 0.00 0.00 179.01 177.63 1xkd n GLU 188 N -3.71 0.68 0.00 2.33 -0.58 -0.52 -4.45 120.64 114.39 1xkd n GLU 188 Ca -0.07 0.21 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 1xkd n GLU 188 Cb 0.88 -1.69 0.00 0.00 -0.57 0.00 0.00 31.44 30.06 1xkd n GLU 188 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1xkd n PHE 189 N -3.13 0.00 -2.17 -0.32 0.99 -1.02 -5.01 117.46 106.80 1xkd n PHE 189 Ca -0.27 -0.16 -0.21 0.00 -0.00 0.00 0.00 57.45 56.81 1xkd n PHE 189 Cb 1.06 -0.02 -0.03 0.00 -1.00 0.00 0.00 39.48 39.49 1xkd n PHE 189 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1xkd n GLY 190 N -0.16 0.23 3.74 1.37 0.00 -0.77 -4.96 105.19 104.64 1xkd n GLY 190 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1xkd n GLY 190 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xkd s ILE 191 N -2.96 4.94 -0.17 -0.61 -1.09 -0.18 -4.90 121.20 116.23 1xkd s ILE 191 Ca 0.00 1.37 -0.03 0.00 -2.23 0.00 0.00 60.65 59.75 1xkd s ILE 191 Cb 0.00 -3.99 -0.02 0.00 -1.58 0.00 0.00 42.46 36.86 1xkd s ILE 191 CO 0.00 0.35 -0.05 -0.55 -1.23 0.00 0.00 174.94 173.46 1xkd s SER 192 N 0.21 4.57 -0.03 3.58 0.15 -1.26 -2.53 113.70 118.38 1xkd s SER 192 Ca 0.34 -0.23 0.05 0.00 0.70 0.00 0.00 55.95 56.82 1xkd s SER 192 Cb -0.18 -1.75 -0.01 0.00 -1.71 0.00 0.00 66.02 62.37 1xkd s SER 192 CO 0.18 0.11 -0.19 -0.63 1.20 0.00 0.00 173.24 173.92 1xkd s ILE 193 N 0.69 1.54 0.51 6.45 1.01 -1.26 -5.10 121.20 125.03 1xkd s ILE 193 Ca -0.03 -0.80 -0.23 0.00 0.00 0.00 0.00 60.65 59.59 1xkd s ILE 193 Cb -0.15 -1.30 -0.06 0.00 0.01 0.00 0.00 42.46 40.96 1xkd s ILE 193 CO 0.02 0.44 1.41 -0.13 0.00 0.00 0.00 174.94 176.67 1xkd s ARG 194 N -0.19 3.37 0.59 2.79 0.52 -1.26 -4.89 118.95 119.87 1xkd s ARG 194 Ca 0.01 2.36 0.29 0.00 -0.52 0.00 0.00 55.73 57.86 1xkd s ARG 194 Cb -0.10 -2.44 1.79 0.00 0.52 0.00 0.00 34.95 34.72 1xkd s ARG 194 CO 0.01 -1.05 2.25 0.93 0.02 0.00 0.00 175.30 177.45 1xkd h GLU 195 N 1.84 0.00 -0.73 3.54 4.39 -2.00 -2.28 114.58 119.34 1xkd h GLU 195 Ca -0.51 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 58.84 1xkd h GLU 195 Cb 1.29 0.00 -0.21 0.00 -0.10 0.00 0.00 28.75 29.73 1xkd h GLU 195 CO 0.59 0.00 0.35 -0.40 -1.16 0.00 0.00 179.01 178.39 1xkd n ASP 196 N -3.89 3.49 -4.72 1.42 5.75 -1.26 -4.78 116.55 112.57 1xkd n ASP 196 Ca -0.03 -3.59 -0.35 0.00 -0.01 0.00 0.00 54.79 50.81 1xkd n ASP 196 Cb 0.09 -0.75 -0.08 0.00 -1.03 0.00 0.00 41.12 39.35 1xkd n ASP 196 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xkd s ALA 197 N -3.23 3.60 0.61 2.12 0.00 -0.86 -4.92 121.76 119.08 1xkd s ALA 197 Ca 0.52 -0.71 -0.17 0.00 0.00 0.00 0.00 51.96 51.61 1xkd s ALA 197 Cb 0.45 -2.02 -0.03 0.00 0.00 0.00 0.00 23.12 21.52 1xkd s ALA 197 CO 0.08 0.25 1.12 0.20 0.00 0.00 0.00 175.76 177.40 1xkd s GLY 198 N 0.12 2.37 -0.08 0.00 0.00 -1.26 -4.16 107.32 104.31 1xkd s GLY 198 Ca 0.07 0.67 -0.00 0.00 0.00 0.00 0.00 44.72 45.46 1xkd s GLY 198 CO -0.00 1.03 -0.04 -0.42 0.00 0.00 0.00 173.10 173.66 1xkd s ILE 199 N -2.08 0.70 0.21 0.90 1.01 -1.01 -4.93 121.20 115.99 1xkd s ILE 199 Ca 0.70 -0.11 0.10 0.00 0.00 0.00 0.00 60.65 61.33 1xkd s ILE 199 Cb -0.22 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 1xkd s ILE 199 CO 0.35 0.30 -0.10 -0.83 0.00 0.00 0.00 174.94 174.66 1xkd s GLY 200 N 1.61 1.73 -0.06 6.18 0.00 -1.26 -0.61 107.32 114.90 1xkd s GLY 200 Ca 0.01 -1.56 0.05 0.00 0.00 0.00 0.00 44.72 43.22 1xkd s GLY 200 CO -0.05 -1.60 -0.23 0.14 0.00 0.00 0.00 173.10 171.36 1xkd s VAL 201 N -1.91 1.90 -0.39 1.40 1.01 -0.03 -4.96 120.40 117.42 1xkd s VAL 201 Ca 0.26 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1xkd s VAL 201 Cb -0.08 -1.62 0.10 0.00 0.00 0.00 0.00 36.38 34.78 1xkd s VAL 201 CO 0.16 0.53 0.18 -0.75 0.00 0.00 0.00 175.10 175.22 1xkd s LYS 202 N -0.01 2.14 -0.13 2.72 2.20 -1.26 -4.58 119.74 120.83 1xkd s LYS 202 Ca -0.07 -1.69 -0.12 0.00 -0.36 0.00 0.00 55.97 53.73 1xkd s LYS 202 Cb -0.14 -3.54 -0.05 0.00 -1.51 0.00 0.00 37.83 32.59 1xkd s LYS 202 CO 0.04 -0.98 0.27 -1.25 -0.36 0.00 0.00 175.35 173.07 1xkd s PRO 203 N 1.19 4.04 -0.08 4.03 0.04 -1.26 -4.97 135.00 137.99 1xkd s PRO 203 Ca 0.05 0.09 -0.00 0.00 0.04 0.00 0.00 61.00 61.18 1xkd s PRO 203 Cb -0.22 -3.35 0.02 0.00 0.04 0.00 0.00 34.50 30.99 1xkd s PRO 203 CO -0.03 0.42 -0.06 0.42 0.04 0.00 0.00 177.00 177.80 1xkd s ILE 204 N -0.09 0.78 0.17 0.56 -1.09 -1.26 -0.95 121.20 119.33 1xkd s ILE 204 Ca 0.17 -0.17 0.07 0.00 -2.23 0.00 0.00 60.65 58.48 1xkd s ILE 204 Cb -0.13 -0.83 -0.04 0.00 -1.58 0.00 0.00 42.46 39.88 1xkd s ILE 204 CO 0.05 0.31 0.04 -0.94 -1.23 0.00 0.00 174.94 173.17 1xkd s SER 205 N 1.53 4.99 0.16 3.58 1.04 -1.26 -4.90 113.70 118.83 1xkd s SER 205 Ca -0.00 -0.32 -0.15 0.00 0.48 0.00 0.00 55.95 55.96 1xkd s SER 205 Cb -0.13 -1.14 0.07 0.00 0.10 0.00 0.00 66.02 64.92 1xkd s SER 205 CO -0.05 0.08 1.79 -0.09 0.98 0.00 0.00 173.24 175.95 1xkd h ARG 206 N 2.61 0.44 -0.12 4.02 2.43 -1.99 -2.75 114.38 119.02 1xkd h ARG 206 Ca -0.47 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.67 1xkd h ARG 206 Cb 1.20 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.65 1xkd h ARG 206 CO 0.60 0.29 0.06 0.35 -1.51 0.00 0.00 179.97 179.75 1xkd h PHE 207 N 0.45 0.18 -0.59 2.20 3.04 -1.99 -1.70 116.94 118.53 1xkd h PHE 207 Ca 0.18 -0.01 -0.09 0.00 3.98 0.00 0.00 57.97 62.03 1xkd h PHE 207 Cb 0.06 -0.06 -0.02 0.00 2.56 0.00 0.00 35.95 38.49 1xkd h PHE 207 CO -0.09 0.24 0.03 0.00 -2.02 0.00 0.00 178.31 176.47 1xkd h ALA 208 N 0.92 0.94 -0.05 2.41 0.00 -1.99 -2.45 119.26 119.04 1xkd h ALA 208 Ca 0.04 -0.29 -0.23 0.00 0.00 0.00 0.00 54.91 54.44 1xkd h ALA 208 Cb 0.13 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.70 1xkd h ALA 208 CO -0.00 0.64 -0.89 1.79 0.00 0.00 0.00 179.25 180.79 1xkd h THR 209 N 0.92 1.34 0.41 0.00 1.35 -1.41 -2.97 112.91 112.56 1xkd h THR 209 Ca 0.17 -2.23 -0.02 0.00 -0.55 0.00 0.00 66.41 63.78 1xkd h THR 209 Cb 0.50 2.25 0.00 0.00 -1.73 0.00 0.00 68.15 69.17 1xkd h THR 209 CO 0.02 0.68 -0.20 0.03 -0.25 0.00 0.00 175.52 175.81 1xkd h ARG 210 N 0.35 -0.54 -0.86 4.72 3.08 -1.27 -0.50 114.38 119.37 1xkd h ARG 210 Ca -0.08 0.04 0.12 0.00 0.07 0.00 0.00 59.98 60.13 1xkd h ARG 210 Cb 1.52 0.12 -0.13 0.00 0.08 0.00 0.00 29.97 31.56 1xkd h ARG 210 CO 0.17 -0.30 -0.37 -2.13 -1.07 0.00 0.00 179.97 176.26 1xkd n ARG 211 N -5.29 -0.23 0.04 0.04 0.63 -0.93 -0.71 116.66 110.21 1xkd n ARG 211 Ca -0.11 1.32 -0.13 0.00 -0.92 0.00 0.00 57.85 58.02 1xkd n ARG 211 Cb 0.26 -1.96 -0.09 0.00 0.45 0.00 0.00 32.46 31.13 1xkd n ARG 211 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 1xkd h LEU 212 N 0.00 -0.07 -1.24 6.15 5.85 -1.34 -2.67 115.31 121.99 1xkd h LEU 212 Ca 0.27 -0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.76 1xkd h LEU 212 Cb 0.49 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1xkd h LEU 212 CO -0.85 0.21 0.52 -0.03 -0.34 0.00 0.00 178.44 177.96 1xkd h MET 213 N -0.35 1.00 -0.15 1.25 4.05 -0.62 -0.56 114.93 119.54 1xkd h MET 213 Ca -0.01 -0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.35 1xkd h MET 213 Cb 0.31 -0.23 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 1xkd h MET 213 CO 0.01 0.66 0.09 0.93 0.23 0.00 0.00 176.91 178.83 1xkd h GLU 214 N 1.03 0.21 -0.82 0.39 5.08 -0.86 0.20 114.58 119.81 1xkd h GLU 214 Ca 0.30 -0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.69 1xkd h GLU 214 Cb -0.06 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.10 1xkd h GLU 214 CO -0.07 0.19 0.51 0.00 -1.00 0.00 0.00 179.01 178.63 1xkd h ARG 215 N 0.17 0.93 0.02 2.33 2.47 -1.01 -1.67 114.38 117.62 1xkd h ARG 215 Ca 0.05 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1xkd h ARG 215 Cb 0.04 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.14 1xkd h ARG 215 CO -0.01 0.61 -0.04 0.00 0.56 0.00 0.00 179.97 181.09 1xkd h ALA 216 N 1.37 -0.06 -0.55 0.04 0.00 -0.68 -0.65 119.26 118.74 1xkd h ALA 216 Ca 0.35 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.36 1xkd h ALA 216 Cb 0.11 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 17.87 1xkd h ALA 216 CO -0.15 -0.54 -0.00 -0.07 0.00 0.00 0.00 179.25 178.48 1xkd h LEU 217 N -0.08 -0.25 -0.22 0.00 -0.00 -0.25 -0.34 115.31 114.17 1xkd h LEU 217 Ca 0.01 0.14 -0.22 0.00 -0.00 0.00 0.00 57.88 57.81 1xkd h LEU 217 Cb 0.09 0.24 0.00 0.00 -0.00 0.00 0.00 40.66 40.99 1xkd h LEU 217 CO -0.03 -0.09 -0.90 -0.33 -0.00 0.00 0.00 178.44 177.09 1xkd h GLU 218 N 0.11 0.40 -0.41 1.13 5.08 -1.24 -2.01 114.58 117.64 1xkd h GLU 218 Ca 0.28 -0.41 0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1xkd h GLU 218 Cb 0.44 0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.75 1xkd h GLU 218 CO -0.47 1.07 0.13 2.35 -1.00 0.00 0.00 179.01 181.09 1xkd h TRP 219 N 0.23 0.23 -0.64 4.33 2.91 -0.81 -0.52 115.95 121.69 1xkd h TRP 219 Ca -0.07 0.02 -0.03 0.00 1.13 0.00 0.00 58.89 59.94 1xkd h TRP 219 Cb 1.52 -0.04 -0.03 0.00 -0.51 0.00 0.00 29.16 30.10 1xkd h TRP 219 CO 0.05 0.08 0.26 0.00 -1.03 0.00 0.00 178.44 177.81 1xkd h ALA 220 N 1.28 1.26 -0.02 2.65 0.00 -0.85 -2.27 119.26 121.31 1xkd h ALA 220 Ca 0.19 -0.16 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 1xkd h ALA 220 Cb 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1xkd h ALA 220 CO -0.21 0.55 -0.81 -0.07 0.00 0.00 0.00 179.25 178.71 1xkd h LEU 221 N 0.92 0.30 -0.45 0.00 3.38 -1.04 0.17 115.31 118.58 1xkd h LEU 221 Ca 0.22 -0.22 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 1xkd h LEU 221 Cb 0.16 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1xkd h LEU 221 CO -0.02 0.98 -0.72 0.03 0.09 0.00 0.00 178.44 178.80 1xkd h ARG 222 N 0.15 0.31 0.00 1.13 3.08 -0.96 -3.30 114.38 114.78 1xkd h ARG 222 Ca -0.04 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1xkd h ARG 222 Cb 1.40 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.51 1xkd h ARG 222 CO 0.13 0.90 -1.06 0.09 -1.07 0.00 0.00 179.97 178.96 1xkd n ASN 223 N -3.81 0.61 0.00 7.04 3.02 -0.87 -4.99 115.26 116.26 1xkd n ASN 223 Ca -0.04 -0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 1xkd n ASN 223 Cb 0.70 0.76 0.00 0.00 -0.61 0.00 0.00 39.78 40.63 1xkd n ASN 223 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xkd n GLY 224 N 1.32 0.43 3.77 7.41 0.00 -0.61 -5.08 105.19 112.43 1xkd n GLY 224 Ca 0.01 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.70 1xkd n GLY 224 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xkd s ASN 225 N -2.96 6.64 0.00 1.61 0.02 0.50 -4.96 114.94 115.80 1xkd s ASN 225 Ca 0.00 2.56 0.09 0.00 -1.02 0.00 0.00 52.86 54.48 1xkd s ASN 225 Cb 0.00 -2.64 -0.01 0.00 0.02 0.00 0.00 41.25 38.62 1xkd s ASN 225 CO 0.00 -0.61 0.56 0.35 0.02 0.00 0.00 177.10 177.42 1xkd n THR 226 N 0.50 0.00 -4.03 1.60 -2.24 -1.26 -4.67 114.28 104.17 1xkd n THR 226 Ca 0.02 -0.40 -0.18 0.00 -2.27 0.00 0.00 64.05 61.22 1xkd n THR 226 Cb 0.44 1.09 -0.16 0.00 -2.10 0.00 0.00 70.33 69.60 1xkd n THR 226 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1xkd s VAL 227 N -1.28 0.33 -0.14 2.28 1.01 -1.26 -0.16 120.40 121.18 1xkd s VAL 227 Ca 0.07 -0.01 -0.00 0.00 0.00 0.00 0.00 61.98 62.04 1xkd s VAL 227 Cb 0.07 -0.39 0.03 0.00 0.00 0.00 0.00 36.38 36.09 1xkd s VAL 227 CO 0.23 0.17 -0.10 -0.69 0.00 0.00 0.00 175.10 174.71 1xkd s VAL 228 N 0.93 1.28 -0.17 2.92 1.01 0.83 -2.22 120.40 125.00 1xkd s VAL 228 Ca -0.11 -0.53 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 1xkd s VAL 228 Cb -0.14 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1xkd s VAL 228 CO -0.01 0.34 -0.10 -0.89 0.00 0.00 0.00 175.10 174.44 1xkd s THR 229 N 1.59 3.16 -0.26 3.92 2.01 0.52 -1.03 115.64 125.55 1xkd s THR 229 Ca 0.04 -0.60 -0.19 0.00 0.31 0.00 0.00 61.69 61.25 1xkd s THR 229 Cb -0.13 -2.37 -0.02 0.00 0.01 0.00 0.00 72.50 69.98 1xkd s THR 229 CO -0.09 0.49 0.55 -0.63 -0.69 0.00 0.00 174.62 174.24 1xkd s ILE 230 N 0.78 5.04 -0.26 1.82 1.01 0.48 0.07 121.20 130.15 1xkd s ILE 230 Ca -0.04 0.92 -0.10 0.00 0.00 0.00 0.00 60.65 61.43 1xkd s ILE 230 Cb -0.15 -3.86 -0.05 0.00 0.01 0.00 0.00 42.46 38.41 1xkd s ILE 230 CO 0.01 0.05 0.16 -0.32 0.00 0.00 0.00 174.94 174.85 1xkd s MET 231 N 2.37 3.95 0.06 2.79 1.75 -0.14 -0.86 119.30 129.22 1xkd s MET 231 Ca 0.22 -0.32 -0.20 0.00 -1.25 0.00 0.00 55.69 54.14 1xkd s MET 231 Cb -0.16 -3.56 0.04 0.00 2.84 0.00 0.00 34.83 33.99 1xkd s MET 231 CO 0.09 -0.09 0.46 -3.38 -0.65 0.00 0.00 175.02 171.46 1xkd s HIS 232 N 1.46 -0.33 -0.55 4.11 -0.00 -1.00 -4.37 115.29 114.61 1xkd s HIS 232 Ca 0.07 0.29 0.03 0.00 -0.00 0.00 0.00 55.06 55.45 1xkd s HIS 232 Cb -0.15 0.29 0.41 0.00 -0.00 0.00 0.00 32.58 33.12 1xkd s HIS 232 CO 0.08 -0.63 1.39 1.17 -0.00 0.00 0.00 174.74 176.75 1xkd n LYS 233 N 0.33 3.24 0.05 -0.38 3.00 -1.26 -0.02 118.16 123.12 1xkd n LYS 233 Ca -0.18 -4.18 0.09 0.00 -0.00 0.00 0.00 58.31 54.04 1xkd n LYS 233 Cb 0.61 -2.26 0.39 0.00 0.00 0.00 0.00 35.03 33.76 1xkd n LYS 233 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1xkd n GLY 234 N -0.53 -1.12 0.17 3.14 0.00 -1.26 -1.51 105.19 104.08 1xkd n GLY 234 Ca 0.44 0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.51 1xkd n GLY 234 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1xkd h ASN 235 N 0.00 0.00 0.00 1.61 -1.07 -1.95 -3.23 115.58 110.94 1xkd h ASN 235 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 56.30 56.07 1xkd h ASN 235 Cb 0.30 0.00 -0.05 0.00 -2.07 0.00 0.00 38.32 36.50 1xkd h ASN 235 CO 0.00 0.42 -2.11 -0.38 0.07 0.00 0.00 177.43 175.43 1xkd n ILE 236 N -3.44 1.11 -3.46 6.14 2.08 -1.03 -4.71 119.36 116.05 1xkd n ILE 236 Ca 0.00 -0.40 -0.41 0.00 0.56 0.00 0.00 62.75 62.51 1xkd n ILE 236 Cb 0.58 -1.30 -0.03 0.00 -0.75 0.00 0.00 39.64 38.14 1xkd n ILE 236 CO 0.00 0.00 0.00 0.23 0.56 0.00 0.00 176.55 177.34 1xkd n MET 237 N -3.23 3.17 0.16 0.38 2.81 -0.57 -4.92 117.12 114.93 1xkd n MET 237 Ca -0.35 -4.47 0.03 0.00 -1.81 0.00 0.00 57.70 51.09 1xkd n MET 237 Cb 0.85 -2.49 0.42 0.00 -0.71 0.00 0.00 33.22 31.29 1xkd n MET 237 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1xkd h LYS 238 N 6.30 0.12 -0.03 0.03 1.79 -1.83 -0.73 116.57 122.24 1xkd h LYS 238 Ca 0.17 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 1xkd h LYS 238 Cb 0.83 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 1xkd h LYS 238 CO 0.96 0.32 0.00 0.66 -1.08 0.00 0.00 179.45 180.31 1xkd n TYR 239 N -4.25 0.00 0.00 -1.35 0.53 -1.26 -2.13 117.16 108.70 1xkd n TYR 239 Ca -0.01 -0.00 -0.00 0.00 -1.02 0.00 0.00 57.90 56.86 1xkd n TYR 239 Cb 0.29 -0.00 -0.00 0.00 -1.03 0.00 0.00 39.34 38.60 1xkd n TYR 239 CO 0.00 0.00 0.00 0.25 -1.02 0.00 0.00 176.86 176.09 1xkd n THR 240 N 1.07 0.12 -0.18 -0.72 -2.24 -1.23 -4.51 114.28 106.60 1xkd n THR 240 Ca 0.11 0.06 -0.09 0.00 -2.27 0.00 0.00 64.05 61.86 1xkd n THR 240 Cb 0.48 -1.09 0.01 0.00 -2.10 0.00 0.00 70.33 67.63 1xkd n THR 240 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1xkd h GLU 241 N -0.01 0.85 -0.57 -0.78 4.39 -1.78 -0.33 114.58 116.36 1xkd h GLU 241 Ca 0.00 -0.23 -0.09 0.00 0.34 0.00 0.00 59.36 59.39 1xkd h GLU 241 Cb 0.01 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.53 1xkd h GLU 241 CO 0.00 0.84 0.01 0.78 -1.16 0.00 0.00 179.01 179.48 1xkd h GLY 242 N 0.74 1.08 1.01 -3.84 0.00 -1.05 -1.92 103.07 99.09 1xkd h GLY 242 Ca 0.16 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.69 1xkd h GLY 242 CO 0.01 0.72 0.43 0.00 0.00 0.00 0.00 176.54 177.71 1xkd h ALA 243 N 0.97 0.99 -0.42 3.60 0.00 -1.38 -0.95 119.26 122.08 1xkd h ALA 243 Ca 0.16 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1xkd h ALA 243 Cb 0.53 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1xkd h ALA 243 CO 0.03 0.49 0.19 0.35 0.00 0.00 0.00 179.25 180.31 1xkd h PHE 244 N 1.07 0.34 -0.51 0.00 3.04 -0.73 0.97 116.94 121.12 1xkd h PHE 244 Ca 0.27 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.24 1xkd h PHE 244 Cb 0.02 -0.09 -0.02 0.00 2.56 0.00 0.00 35.95 38.41 1xkd h PHE 244 CO -0.00 0.16 0.32 1.98 -2.02 0.00 0.00 178.31 178.76 1xkd h MET 245 N 0.38 0.68 -0.42 1.11 4.05 -1.02 -1.64 114.93 118.08 1xkd h MET 245 Ca 0.19 -0.05 -0.10 0.00 -0.28 0.00 0.00 59.70 59.45 1xkd h MET 245 Cb 0.12 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.76 1xkd h MET 245 CO -0.15 0.47 -0.15 0.00 0.23 0.00 0.00 176.91 177.32 1xkd h ARG 246 N 0.69 0.83 -0.20 0.39 3.08 -0.34 -2.08 114.38 116.75 1xkd h ARG 246 Ca 0.18 -0.34 -0.08 0.00 0.07 0.00 0.00 59.98 59.82 1xkd h ARG 246 Cb -0.05 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 1xkd h ARG 246 CO -0.04 0.97 -0.21 -1.49 -1.07 0.00 0.00 179.97 178.13 1xkd h TRP 247 N 0.65 0.38 -0.21 3.04 6.55 -0.83 -1.22 115.95 124.33 1xkd h TRP 247 Ca 0.10 -0.07 -0.14 0.00 0.95 0.00 0.00 58.89 59.74 1xkd h TRP 247 Cb 0.69 -0.10 0.00 0.00 -0.86 0.00 0.00 29.16 28.89 1xkd h TRP 247 CO 0.05 0.55 -0.41 0.00 -1.05 0.00 0.00 178.44 177.59 1xkd h ALA 248 N 1.46 0.33 -0.94 1.49 0.00 -1.09 -2.41 119.26 118.10 1xkd h ALA 248 Ca 0.05 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.52 1xkd h ALA 248 Cb 0.56 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 1xkd h ALA 248 CO 0.04 0.43 0.62 1.88 0.00 0.00 0.00 179.25 182.23 1xkd h TYR 249 N 0.33 1.18 0.07 0.00 0.05 -1.23 -2.55 116.97 114.83 1xkd h TYR 249 Ca 0.01 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 1xkd h TYR 249 Cb 1.01 -0.40 0.00 0.00 1.01 0.00 0.00 36.73 38.35 1xkd h TYR 249 CO 0.09 0.74 -0.03 1.49 -1.05 0.00 0.00 178.16 179.39 1xkd h GLU 250 N 1.27 -0.09 -0.46 4.88 4.81 -1.09 -1.81 114.58 122.09 1xkd h GLU 250 Ca 0.35 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.54 1xkd h GLU 250 Cb -0.14 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 1xkd h GLU 250 CO -0.08 0.02 0.08 0.28 -0.73 0.00 0.00 179.01 178.59 1xkd h VAL 251 N -0.19 1.21 -0.68 0.32 2.07 -1.37 0.21 116.25 117.83 1xkd h VAL 251 Ca -0.01 -0.79 0.04 0.00 0.82 0.00 0.00 66.70 66.76 1xkd h VAL 251 Cb 0.16 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 1xkd h VAL 251 CO 0.02 0.28 0.41 0.00 0.02 0.00 0.00 177.57 178.30 1xkd h ALA 252 N 1.42 0.90 0.00 1.67 0.00 -1.14 -0.86 119.26 121.25 1xkd h ALA 252 Ca 0.15 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 1xkd h ALA 252 Cb 0.30 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1xkd h ALA 252 CO 0.00 0.14 -0.82 -0.07 0.00 0.00 0.00 179.25 178.50 1xkd h LEU 253 N 0.78 0.00 0.06 0.00 3.38 -0.90 -2.78 115.31 115.86 1xkd h LEU 253 Ca 0.29 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 1xkd h LEU 253 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1xkd h LEU 253 CO -0.14 0.82 -0.03 -0.08 0.09 0.00 0.00 178.44 179.10 1xkd h GLU 254 N 0.00 -0.08 -0.00 1.13 4.81 -0.67 -3.30 114.58 116.48 1xkd h GLU 254 Ca -0.01 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1xkd h GLU 254 Cb 1.63 0.02 0.00 0.00 0.63 0.00 0.00 28.75 31.03 1xkd h GLU 254 CO 0.11 0.51 -0.84 1.63 -0.73 0.00 0.00 179.01 179.69 1xkd n LYS 255 N -4.81 1.08 -1.35 1.92 5.02 -0.35 -4.55 118.16 115.12 1xkd n LYS 255 Ca -0.08 -0.02 0.03 0.00 -2.02 0.00 0.00 58.31 56.22 1xkd n LYS 255 Cb 0.31 -1.35 0.02 0.00 -0.02 0.00 0.00 35.03 33.99 1xkd n LYS 255 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1xkd n PHE 256 N -1.39 0.00 -0.25 2.13 3.72 -1.05 -4.95 117.46 115.67 1xkd n PHE 256 Ca 0.04 -0.43 0.05 0.00 -0.05 0.00 0.00 57.45 57.06 1xkd n PHE 256 Cb 0.28 -0.12 0.17 0.00 -0.94 0.00 0.00 39.48 38.87 1xkd n PHE 256 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1xkd h ARG 257 N 0.84 0.16 -0.12 -1.08 1.12 -1.62 0.90 114.38 114.58 1xkd h ARG 257 Ca -0.20 -0.01 -0.09 0.00 -1.11 0.00 0.00 59.98 58.57 1xkd h ARG 257 Cb 1.82 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 31.73 1xkd h ARG 257 CO 0.08 0.11 -0.31 0.93 -3.11 0.00 0.00 179.97 177.66 1xkd h GLU 258 N 0.17 0.23 0.00 0.20 4.39 -1.90 -2.95 114.58 114.71 1xkd h GLU 258 Ca 0.41 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 60.02 1xkd h GLU 258 Cb 0.71 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.35 1xkd h GLU 258 CO -0.59 0.53 -0.55 0.72 -1.16 0.00 0.00 179.01 177.95 1xkd n HIS 259 N -4.11 0.19 -5.01 4.33 8.25 0.09 -4.88 115.22 114.08 1xkd n HIS 259 Ca -0.01 0.06 -0.32 0.00 -0.26 0.00 0.00 57.72 57.18 1xkd n HIS 259 Cb 0.40 -0.40 -0.14 0.00 1.12 0.00 0.00 29.99 30.97 1xkd n HIS 259 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1xkd s VAL 260 N -3.07 2.77 0.08 1.59 1.01 0.03 0.01 120.40 122.82 1xkd s VAL 260 Ca 0.09 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.29 1xkd s VAL 260 Cb 0.16 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1xkd s VAL 260 CO 0.71 0.59 -0.16 0.54 0.00 0.00 0.00 175.10 176.78 1xkd s VAL 261 N -0.68 1.24 0.18 2.92 0.11 0.67 -4.85 120.40 119.99 1xkd s VAL 261 Ca 0.11 -1.36 -0.09 0.00 -2.93 0.00 0.00 61.98 57.70 1xkd s VAL 261 Cb -0.11 -1.18 -0.07 0.00 -1.53 0.00 0.00 36.38 33.50 1xkd s VAL 261 CO 0.00 -0.20 0.49 -0.89 -3.33 0.00 0.00 175.10 171.17 1xkd s THR 262 N -1.27 5.00 0.25 5.04 2.01 -1.26 0.86 115.64 126.27 1xkd s THR 262 Ca -0.00 0.42 -0.06 0.00 0.31 0.00 0.00 61.69 62.37 1xkd s THR 262 Cb -0.10 -3.64 0.25 0.00 0.01 0.00 0.00 72.50 69.02 1xkd s THR 262 CO 0.03 0.05 1.91 -0.08 -0.69 0.00 0.00 174.62 175.84 1xkd h GLU 263 N 2.93 1.23 -1.27 4.92 4.81 -1.98 -1.29 114.58 123.93 1xkd h GLU 263 Ca -0.47 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1xkd h GLU 263 Cb 1.18 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 30.28 1xkd h GLU 263 CO 0.69 0.81 0.00 0.94 -0.73 0.00 0.00 179.01 180.72 1xkd n GLN 264 N -4.44 0.95 0.01 1.92 7.27 -1.26 -2.39 117.38 119.44 1xkd n GLN 264 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.19 1xkd n GLN 264 Cb 0.06 -1.02 0.00 0.00 2.41 0.00 0.00 30.24 31.69 1xkd n GLN 264 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1xkd n GLU 265 N 0.76 0.00 -0.33 3.69 2.13 -1.17 -4.81 120.64 120.91 1xkd n GLU 265 Ca 0.00 0.00 0.19 0.00 0.66 0.00 0.00 57.16 58.01 1xkd n GLU 265 Cb 0.48 0.00 0.40 0.00 0.27 0.00 0.00 31.44 32.59 1xkd n GLU 265 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1xkd h VAL 266 N 0.00 0.37 -0.80 6.31 2.07 -1.01 0.29 116.25 123.49 1xkd h VAL 266 Ca 0.00 -0.13 -0.60 0.00 0.82 0.00 0.00 66.70 66.80 1xkd h VAL 266 Cb 0.00 -0.03 -0.11 0.00 -1.52 0.00 0.00 31.29 29.64 1xkd h VAL 266 CO 0.00 0.07 1.75 1.67 0.02 0.00 0.00 177.57 181.08 1xkd n GLN 267 N -5.05 3.53 0.00 1.57 -0.06 -1.00 -1.00 117.38 115.37 1xkd n GLN 267 Ca 0.28 -2.64 0.00 0.00 -2.00 0.00 0.00 57.00 52.63 1xkd n GLN 267 Cb 0.84 -2.45 0.00 0.00 -4.06 0.00 0.00 30.24 24.58 1xkd n GLN 267 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 1xkd n GLU 268 N 1.89 0.00 -0.00 3.69 2.13 -0.42 -4.96 120.64 122.96 1xkd n GLU 268 Ca 0.59 0.00 0.05 0.00 0.66 0.00 0.00 57.16 58.46 1xkd n GLU 268 Cb 0.41 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.06 1xkd n GLU 268 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1xkd n LYS 269 N 0.00 2.24 -0.51 5.31 5.02 0.90 -4.70 118.16 126.42 1xkd n LYS 269 Ca 0.00 -0.04 0.05 0.00 -2.02 0.00 0.00 58.31 56.30 1xkd n LYS 269 Cb 0.00 -1.08 0.08 0.00 -0.02 0.00 0.00 35.03 34.01 1xkd n LYS 269 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1xkd n TYR 270 N -1.50 0.00 -2.33 2.13 4.02 -1.05 -5.01 117.16 113.42 1xkd n TYR 270 Ca 0.00 -0.65 -0.15 0.00 -0.01 0.00 0.00 57.90 57.09 1xkd n TYR 270 Cb 0.20 -0.13 -0.01 0.00 -0.02 0.00 0.00 39.34 39.38 1xkd n TYR 270 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1xkd n GLY 271 N -0.60 -0.30 1.25 2.72 0.00 -0.93 -1.02 105.19 106.30 1xkd n GLY 271 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1xkd n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xkd n GLY 272 N -0.82 0.75 3.01 -0.02 0.00 -0.17 -5.01 105.19 102.93 1xkd n GLY 272 Ca -0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 1xkd n GLY 272 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xkd s VAL 273 N -2.62 1.03 -0.16 1.61 1.01 -0.19 -4.91 120.40 116.17 1xkd s VAL 273 Ca 0.00 -0.43 -0.29 0.00 0.00 0.00 0.00 61.98 61.26 1xkd s VAL 273 Cb 0.00 -0.94 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 1xkd s VAL 273 CO 0.00 0.33 1.89 -0.60 0.00 0.00 0.00 175.10 176.72 1xkd s ARG 274 N 0.63 3.66 0.27 2.72 3.52 -1.26 -4.80 118.95 123.69 1xkd s ARG 274 Ca -0.13 2.00 -0.30 0.00 -0.13 0.00 0.00 55.73 57.18 1xkd s ARG 274 Cb -0.15 -4.18 -0.11 0.00 -1.56 0.00 0.00 34.95 28.96 1xkd s ARG 274 CO 0.03 -1.48 1.51 -1.25 -0.81 0.00 0.00 175.30 173.31 1xkd s PRO 275 N 5.17 4.20 0.28 5.12 0.04 -1.26 -4.93 135.00 143.61 1xkd s PRO 275 Ca 0.85 2.43 -0.30 0.00 0.04 0.00 0.00 61.00 64.02 1xkd s PRO 275 Cb -0.32 -3.07 -0.11 0.00 0.04 0.00 0.00 34.50 31.05 1xkd s PRO 275 CO 0.34 -0.52 1.51 -1.21 0.04 0.00 0.00 177.00 177.16 1xkd s GLU 276 N -0.42 4.19 0.00 4.56 2.02 -1.26 -1.72 118.70 126.08 1xkd s GLU 276 Ca 0.61 2.44 0.00 0.00 0.02 0.00 0.00 54.97 58.05 1xkd s GLU 276 Cb -0.45 -3.06 0.00 0.00 0.10 0.00 0.00 34.13 30.73 1xkd s GLU 276 CO 0.45 -0.52 0.00 0.41 0.02 0.00 0.00 175.26 175.63 1xkd n GLY 277 N 1.99 0.57 3.14 -1.39 0.00 -1.26 -5.05 105.19 103.19 1xkd n GLY 277 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1xkd n GLY 277 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xkd s LYS 278 N -0.81 2.82 -0.05 1.61 1.02 -0.70 -4.87 119.74 118.76 1xkd s LYS 278 Ca 0.00 -0.78 -0.30 0.00 0.02 0.00 0.00 55.97 54.91 1xkd s LYS 278 Cb 0.00 -2.30 -0.03 0.00 -0.52 0.00 0.00 37.83 34.98 1xkd s LYS 278 CO 0.00 -0.03 1.22 0.42 -0.92 0.00 0.00 175.35 176.04 1xkd s ILE 279 N 0.86 4.20 -0.06 2.17 1.01 0.10 -4.68 121.20 124.81 1xkd s ILE 279 Ca -0.07 1.53 -0.30 0.00 0.00 0.00 0.00 60.65 61.82 1xkd s ILE 279 Cb -0.15 -3.99 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 1xkd s ILE 279 CO -0.02 -0.00 1.41 -0.22 0.00 0.00 0.00 174.94 176.10 1xkd s LEU 280 N 2.26 4.28 -0.32 2.97 2.96 0.78 -0.24 118.68 131.37 1xkd s LEU 280 Ca 0.57 2.01 -0.08 0.00 -0.22 0.00 0.00 54.13 56.41 1xkd s LEU 280 Cb -0.25 -3.55 0.02 0.00 0.50 0.00 0.00 46.19 42.91 1xkd s LEU 280 CO 0.22 -0.76 0.11 -0.69 -1.32 0.00 0.00 176.35 173.91 1xkd s VAL 281 N 3.01 4.08 0.30 1.68 1.01 0.25 -0.12 120.40 130.61 1xkd s VAL 281 Ca 0.63 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.86 1xkd s VAL 281 Cb -0.29 -3.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 1xkd s VAL 281 CO 0.24 -0.02 0.12 -0.46 0.00 0.00 0.00 175.10 174.97 1xkd n ASN 282 N 4.89 0.98 -3.81 3.32 2.04 -0.19 -3.92 115.26 118.57 1xkd n ASN 282 Ca -0.14 -2.62 -0.12 0.00 -0.44 0.00 0.00 54.58 51.27 1xkd n ASN 282 Cb 0.47 0.82 -0.09 0.00 -2.53 0.00 0.00 39.78 38.45 1xkd n ASN 282 CO 0.00 0.00 0.00 1.51 -0.44 0.00 0.00 177.26 178.33 1xkd s ASP 283 N -2.85 -0.07 -0.01 0.53 -4.77 -1.26 -0.38 116.67 107.86 1xkd s ASP 283 Ca 0.17 -0.13 0.00 0.00 -3.30 0.00 0.00 52.55 49.29 1xkd s ASP 283 Cb 0.01 0.28 0.01 0.00 -1.09 0.00 0.00 42.92 42.12 1xkd s ASP 283 CO 0.12 -0.46 -0.01 -0.13 0.70 0.00 0.00 175.17 175.39 1xkd s ARG 284 N -1.74 0.11 0.27 2.11 1.81 -0.04 -4.88 118.95 116.60 1xkd s ARG 284 Ca -0.11 0.00 -0.31 0.00 -1.72 0.00 0.00 55.73 53.59 1xkd s ARG 284 Cb -0.05 -0.18 -0.12 0.00 -0.45 0.00 0.00 34.95 34.16 1xkd s ARG 284 CO 0.01 -0.02 1.62 -0.89 -0.68 0.00 0.00 175.30 175.34 1xkd n ILE 285 N 3.36 0.75 -0.23 1.52 2.08 -1.25 -2.39 119.36 123.20 1xkd n ILE 285 Ca -0.17 -0.19 0.03 0.00 0.56 0.00 0.00 62.75 62.99 1xkd n ILE 285 Cb 0.57 -1.94 0.14 0.00 -0.75 0.00 0.00 39.64 37.66 1xkd n ILE 285 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1xkd h ALA 286 N 5.28 0.78 -0.40 -1.39 0.00 -0.78 0.42 119.26 123.16 1xkd h ALA 286 Ca -0.46 0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 1xkd h ALA 286 Cb 1.22 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 1xkd h ALA 286 CO 0.83 -0.37 -0.03 0.38 0.00 0.00 0.00 179.25 180.07 1xkd h ASP 287 N 0.19 0.72 -0.72 0.00 2.03 -1.90 -2.18 116.42 114.57 1xkd h ASP 287 Ca 0.37 -0.32 0.07 0.00 -0.73 0.00 0.00 57.03 56.42 1xkd h ASP 287 Cb 0.62 -0.20 -0.06 0.00 -0.83 0.00 0.00 39.33 38.86 1xkd h ASP 287 CO -0.52 0.87 0.40 -1.13 -1.03 0.00 0.00 179.24 177.83 1xkd h ASN 288 N 0.56 0.58 -0.72 4.15 -0.00 -1.43 -2.34 115.58 116.37 1xkd h ASN 288 Ca 0.11 0.04 0.09 0.00 -0.00 0.00 0.00 56.30 56.54 1xkd h ASN 288 Cb 0.52 -0.07 -0.07 0.00 -0.00 0.00 0.00 38.32 38.70 1xkd h ASN 288 CO 0.03 0.36 0.37 -0.03 -0.00 0.00 0.00 177.43 178.15 1xkd h MET 289 N 0.71 0.61 -0.39 6.67 4.05 0.09 0.24 114.93 126.92 1xkd h MET 289 Ca 0.33 -0.04 0.02 0.00 -0.28 0.00 0.00 59.70 59.73 1xkd h MET 289 Cb 0.25 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 30.88 1xkd h MET 289 CO -0.21 0.41 0.23 -0.07 0.23 0.00 0.00 176.91 177.50 1xkd h LEU 290 N 0.63 0.37 -0.62 3.39 4.07 -1.04 -1.14 115.31 120.97 1xkd h LEU 290 Ca 0.35 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.30 1xkd h LEU 290 Cb 0.35 -0.08 -0.03 0.00 1.08 0.00 0.00 40.66 41.98 1xkd h LEU 290 CO -0.26 0.27 0.35 1.56 -1.08 0.00 0.00 178.44 179.28 1xkd h GLN 291 N 0.47 0.86 -0.58 1.13 4.20 -0.83 -3.17 115.11 117.19 1xkd h GLN 291 Ca 0.15 -0.10 -0.09 0.00 0.06 0.00 0.00 58.65 58.67 1xkd h GLN 291 Cb 0.00 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 1xkd h GLN 291 CO -0.07 0.65 -0.01 1.96 -0.67 0.00 0.00 178.83 180.69 1xkd h GLN 292 N 0.85 1.01 0.00 1.46 1.08 -0.18 0.15 115.11 119.48 1xkd h GLN 292 Ca 0.22 -0.31 -0.04 0.00 -1.45 0.00 0.00 58.65 57.07 1xkd h GLN 292 Cb 0.03 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 1xkd h GLN 292 CO -0.04 1.00 -0.17 -0.84 -0.95 0.00 0.00 178.83 177.83 1xkd h ILE 293 N 0.93 0.92 0.17 2.54 3.07 -1.25 0.41 117.51 124.29 1xkd h ILE 293 Ca 0.17 -0.62 -0.23 0.00 1.55 0.00 0.00 64.86 65.73 1xkd h ILE 293 Cb 0.55 1.36 0.03 0.00 -0.27 0.00 0.00 36.82 38.48 1xkd h ILE 293 CO 0.03 0.17 -0.99 0.40 -1.05 0.00 0.00 178.15 176.71 1xkd h ILE 294 N 0.00 1.45 0.03 0.16 2.04 -1.36 -3.28 117.51 116.56 1xkd h ILE 294 Ca -0.00 -2.57 -0.28 0.00 1.00 0.00 0.00 64.86 63.01 1xkd h ILE 294 Cb 0.34 3.16 -0.03 0.00 -0.74 0.00 0.00 36.82 39.54 1xkd h ILE 294 CO 0.02 0.74 -1.51 0.74 0.00 0.00 0.00 178.15 178.14 1xkd h THR 295 N -0.23 1.11 -0.90 -0.27 2.02 -0.60 -3.42 112.91 110.63 1xkd h THR 295 Ca -0.17 -2.88 -0.34 0.00 0.77 0.00 0.00 66.41 63.78 1xkd h THR 295 Cb 1.78 2.60 -0.33 0.00 -1.74 0.00 0.00 68.15 70.46 1xkd h THR 295 CO 0.19 0.70 -0.98 -1.14 0.37 0.00 0.00 175.52 174.66 1xkd n ARG 296 N -3.23 1.12 0.23 6.66 0.63 0.14 -4.97 116.66 117.23 1xkd n ARG 296 Ca -0.13 -2.90 0.07 0.00 -0.92 0.00 0.00 57.85 53.96 1xkd n ARG 296 Cb 1.02 -1.06 0.53 0.00 0.45 0.00 0.00 32.46 33.40 1xkd n ARG 296 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1xkd h PRO 297 N 2.80 0.00 0.00 -0.14 0.13 -1.60 -1.99 132.00 131.20 1xkd h PRO 297 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1xkd h PRO 297 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1xkd h PRO 297 CO 0.36 0.20 0.00 0.11 -0.23 0.00 0.00 178.00 178.44 1xkd h TRP 298 N 0.00 0.00 -0.09 1.56 5.08 -1.90 -2.68 115.95 117.92 1xkd h TRP 298 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1xkd h TRP 298 Cb 0.38 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.54 1xkd h TRP 298 CO 0.00 0.00 0.00 -3.47 -1.28 0.00 0.00 178.44 173.69 1xkd n ASP 299 N -2.61 1.27 -4.20 0.11 4.64 -0.75 -4.89 116.55 110.11 1xkd n ASP 299 Ca 0.01 -1.56 -0.21 0.00 -1.38 0.00 0.00 54.79 51.65 1xkd n ASP 299 Cb 0.23 -0.05 -0.12 0.00 -1.04 0.00 0.00 41.12 40.13 1xkd n ASP 299 CO 0.00 0.00 0.00 -0.31 -0.82 0.00 0.00 177.20 176.07 1xkd s TYR 300 N -1.89 1.41 0.00 -0.67 2.02 -1.01 -5.01 117.35 112.20 1xkd s TYR 300 Ca 0.34 -0.43 0.00 0.00 -0.37 0.00 0.00 57.07 56.62 1xkd s TYR 300 Cb 0.18 -0.80 0.00 0.00 -0.40 0.00 0.00 41.96 40.94 1xkd s TYR 300 CO 0.28 0.10 0.00 1.04 -1.57 0.00 0.00 175.55 175.40 1xkd n GLN 301 N 1.35 0.00 -3.27 -0.62 6.02 -1.26 -4.70 117.38 114.90 1xkd n GLN 301 Ca -0.20 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.40 1xkd n GLN 301 Cb 0.54 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.74 1xkd n GLN 301 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1xkd s VAL 302 N 0.00 5.14 -0.16 5.09 1.01 -0.94 -0.71 120.40 129.83 1xkd s VAL 302 Ca 0.00 0.97 0.01 0.00 0.00 0.00 0.00 61.98 62.96 1xkd s VAL 302 Cb 0.00 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1xkd s VAL 302 CO 0.00 0.24 -0.17 -0.63 0.00 0.00 0.00 175.10 174.54 1xkd s ILE 303 N 1.19 2.45 -0.17 2.22 1.01 -0.18 -0.36 121.20 127.36 1xkd s ILE 303 Ca 0.25 -0.84 -0.03 0.00 0.00 0.00 0.00 60.65 60.03 1xkd s ILE 303 Cb -0.15 -2.02 -0.02 0.00 0.01 0.00 0.00 42.46 40.27 1xkd s ILE 303 CO 0.10 0.52 -0.05 -0.69 0.00 0.00 0.00 174.94 174.83 1xkd s VAL 304 N 0.89 3.64 -0.00 2.92 1.01 0.11 -0.08 120.40 128.89 1xkd s VAL 304 Ca -0.04 -0.43 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 1xkd s VAL 304 Cb -0.15 -2.61 -0.00 0.00 0.00 0.00 0.00 36.38 33.62 1xkd s VAL 304 CO -0.02 0.47 0.10 0.00 0.00 0.00 0.00 175.10 175.65 1xkd s ALA 305 N 0.72 -0.23 1.11 5.51 0.00 -0.30 -0.97 121.76 127.60 1xkd s ALA 305 Ca -0.02 -0.17 -0.13 0.00 0.00 0.00 0.00 51.96 51.64 1xkd s ALA 305 Cb -0.15 0.08 0.25 0.00 0.00 0.00 0.00 23.12 23.30 1xkd s ALA 305 CO 0.02 -0.18 1.06 -1.25 0.00 0.00 0.00 175.76 175.41 1xkd s PRO 306 N -1.20 -0.46 0.15 0.00 0.04 -1.26 -0.67 135.00 131.60 1xkd s PRO 306 Ca -0.13 0.61 -0.22 0.00 0.04 0.00 0.00 61.00 61.30 1xkd s PRO 306 Cb -0.07 -1.63 0.04 0.00 0.04 0.00 0.00 34.50 32.88 1xkd s PRO 306 CO 0.01 -3.36 1.63 -0.97 0.04 0.00 0.00 177.00 174.35 1xkd h ASN 307 N -2.35 -0.74 0.11 6.66 -0.73 -1.80 -0.96 115.58 115.78 1xkd h ASN 307 Ca -0.58 0.14 -0.01 0.00 1.87 0.00 0.00 56.30 57.72 1xkd h ASN 307 Cb 1.34 0.36 0.00 0.00 0.27 0.00 0.00 38.32 40.28 1xkd h ASN 307 CO 0.53 -0.26 -0.05 0.25 -0.37 0.00 0.00 177.43 177.53 1xkd h LEU 308 N -0.22 -0.13 -0.88 0.34 5.85 -1.89 -1.27 115.31 117.11 1xkd h LEU 308 Ca 0.14 -0.34 0.16 0.00 0.84 0.00 0.00 57.88 58.69 1xkd h LEU 308 Cb 0.45 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 41.41 1xkd h LEU 308 CO -0.39 0.29 0.47 0.78 -0.34 0.00 0.00 178.44 179.24 1xkd h ASN 309 N -0.57 0.56 -0.67 1.25 2.35 -1.93 -0.66 115.58 115.91 1xkd h ASN 309 Ca -0.02 0.10 -0.08 0.00 -0.55 0.00 0.00 56.30 55.75 1xkd h ASN 309 Cb 0.46 0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.81 1xkd h ASN 309 CO 0.03 0.21 0.09 1.23 -1.65 0.00 0.00 177.43 177.34 1xkd h GLY 310 N 0.63 1.20 0.96 2.83 0.00 -1.08 0.16 103.07 107.77 1xkd h GLY 310 Ca 0.49 -0.82 0.01 0.00 0.00 0.00 0.00 47.33 47.02 1xkd h GLY 310 CO -0.38 0.76 0.27 -1.80 0.00 0.00 0.00 176.54 175.38 1xkd h ASP 311 N 1.04 0.45 -0.14 0.19 -0.00 -0.29 -2.49 116.42 115.17 1xkd h ASP 311 Ca 0.20 -0.01 -0.09 0.00 -0.00 0.00 0.00 57.03 57.13 1xkd h ASP 311 Cb 0.47 -0.10 0.00 0.00 -0.00 0.00 0.00 39.33 39.69 1xkd h ASP 311 CO 0.02 0.32 -0.27 1.88 -0.00 0.00 0.00 179.24 181.19 1xkd h TYR 312 N 0.54 0.53 -0.59 0.28 -1.99 -0.65 -3.15 116.97 111.96 1xkd h TYR 312 Ca 0.16 -0.19 -0.06 0.00 2.00 0.00 0.00 58.73 60.64 1xkd h TYR 312 Cb -0.03 -0.10 -0.03 0.00 2.00 0.00 0.00 36.73 38.57 1xkd h TYR 312 CO -0.06 0.89 0.12 0.97 -0.00 0.00 0.00 178.16 180.08 1xkd h ILE 313 N 0.03 1.24 -0.34 -2.88 6.09 -0.70 -1.90 117.51 119.06 1xkd h ILE 313 Ca 0.01 -0.91 -0.12 0.00 -1.37 0.00 0.00 64.86 62.47 1xkd h ILE 313 Cb 0.86 0.67 -0.01 0.00 0.47 0.00 0.00 36.82 38.81 1xkd h ILE 313 CO 0.06 0.34 -0.24 0.77 -3.07 0.00 0.00 178.15 176.00 1xkd h SER 314 N 0.88 0.80 -0.51 2.19 4.64 -1.53 0.14 113.55 120.17 1xkd h SER 314 Ca 0.19 -0.44 -0.03 0.00 -0.47 0.00 0.00 61.79 61.04 1xkd h SER 314 Cb 0.35 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 1xkd h SER 314 CO 0.00 1.07 0.20 0.44 -0.87 0.00 0.00 176.83 177.67 1xkd h ASP 315 N 0.54 0.71 -0.30 4.97 3.45 -1.49 -1.88 116.42 122.42 1xkd h ASP 315 Ca 0.07 -0.17 -0.01 0.00 0.43 0.00 0.00 57.03 57.34 1xkd h ASP 315 Cb 0.81 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 39.38 1xkd h ASP 315 CO 0.07 0.69 0.14 0.00 -1.57 0.00 0.00 179.24 178.57 1xkd h ALA 316 N 1.05 0.39 -0.52 3.45 0.00 -1.07 -2.47 119.26 120.08 1xkd h ALA 316 Ca 0.17 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1xkd h ALA 316 Cb 0.20 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1xkd h ALA 316 CO -0.01 -0.05 0.03 0.00 0.00 0.00 0.00 179.25 179.21 1xkd h ALA 317 N 1.00 1.07 -0.13 0.00 0.00 -0.66 -2.75 119.26 117.80 1xkd h ALA 317 Ca 0.10 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 1xkd h ALA 317 Cb 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1xkd h ALA 317 CO -0.01 0.59 -0.36 0.77 0.00 0.00 0.00 179.25 180.23 1xkd h SER 318 N 0.80 0.28 -0.79 0.00 0.02 -1.28 -2.77 113.55 109.80 1xkd h SER 318 Ca 0.16 -0.11 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1xkd h SER 318 Cb 0.44 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.87 1xkd h SER 318 CO 0.02 0.63 0.32 0.00 -1.14 0.00 0.00 176.83 176.65 1xkd h ALA 319 N 1.39 1.06 -0.96 3.77 0.00 -1.16 0.18 119.26 123.54 1xkd h ALA 319 Ca 0.03 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 54.83 1xkd h ALA 319 Cb 0.75 -0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 1xkd h ALA 319 CO 0.06 0.67 0.60 -0.07 0.00 0.00 0.00 179.25 180.50 1xkd h LEU 320 N 1.16 0.92 -2.30 0.00 3.38 -1.24 -2.20 115.31 115.03 1xkd h LEU 320 Ca 0.27 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1xkd h LEU 320 Cb 0.22 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1xkd h LEU 320 CO -0.02 0.54 0.00 1.33 0.09 0.00 0.00 178.44 180.38 1xkd n VAL 321 N -4.60 1.25 0.00 1.22 0.24 -0.93 -3.02 118.33 112.50 1xkd n VAL 321 Ca 0.16 -0.82 0.00 0.00 -2.04 0.00 0.00 64.34 61.64 1xkd n VAL 321 Cb 0.25 0.03 0.00 0.00 -1.47 0.00 0.00 33.84 32.66 1xkd n VAL 321 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xkd n GLY 322 N 0.92 0.95 0.00 7.63 0.00 -0.83 -4.78 105.19 109.08 1xkd n GLY 322 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1xkd n GLY 322 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xkd n GLY 323 N 0.00 2.24 0.00 -0.02 0.00 0.59 -4.74 105.19 103.26 1xkd n GLY 323 Ca 0.00 -1.99 0.10 0.00 0.00 0.00 0.00 46.02 44.13 1xkd n GLY 323 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1xkd n ILE 324 N 0.89 0.00 0.26 -0.61 -0.00 -1.26 -2.31 119.36 116.33 1xkd n ILE 324 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 62.75 62.90 1xkd n ILE 324 Cb 0.00 -0.44 0.78 0.00 -0.00 0.00 0.00 39.64 39.98 1xkd n ILE 324 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 1xkd h GLY 325 N 4.43 0.00 -0.82 3.28 0.00 -1.90 -2.19 103.07 105.88 1xkd h GLY 325 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xkd h GLY 325 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.54 176.41 1xkd n MET 326 N -2.59 0.72 -3.09 4.80 1.56 -0.98 -1.21 117.12 116.34 1xkd n MET 326 Ca -0.01 -1.21 -0.43 0.00 -0.27 0.00 0.00 57.70 55.78 1xkd n MET 326 Cb 0.10 -1.19 -0.06 0.00 2.15 0.00 0.00 33.22 34.21 1xkd n MET 326 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1xkd s ALA 327 N -0.83 3.33 0.45 -5.12 0.00 -0.82 -4.53 121.76 114.24 1xkd s ALA 327 Ca 0.13 -1.31 -0.06 0.00 0.00 0.00 0.00 51.96 50.71 1xkd s ALA 327 Cb 0.08 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1xkd s ALA 327 CO 0.12 -1.90 0.76 0.00 0.00 0.00 0.00 175.76 174.74 1xkd s ALA 328 N 2.91 3.41 0.12 0.00 0.00 -1.26 -1.36 121.76 125.58 1xkd s ALA 328 Ca 0.22 -0.45 -0.09 0.00 0.00 0.00 0.00 51.96 51.64 1xkd s ALA 328 Cb -0.15 -2.58 -0.00 0.00 0.00 0.00 0.00 23.12 20.39 1xkd s ALA 328 CO 0.18 -0.22 0.24 0.20 0.00 0.00 0.00 175.76 176.16 1xkd s GLY 329 N -3.81 0.20 -0.20 0.00 0.00 -0.86 -4.06 107.32 98.59 1xkd s GLY 329 Ca 0.48 -0.67 -0.04 0.00 0.00 0.00 0.00 44.72 44.49 1xkd s GLY 329 CO 0.40 -0.77 0.34 -0.29 0.00 0.00 0.00 173.10 172.78 1xkd s MET 330 N -3.90 0.28 -0.73 2.90 1.75 -0.18 -2.90 119.30 116.52 1xkd s MET 330 Ca 0.09 0.63 -0.26 0.00 -1.25 0.00 0.00 55.69 54.90 1xkd s MET 330 Cb 0.04 -0.34 0.04 0.00 2.84 0.00 0.00 34.83 37.41 1xkd s MET 330 CO -0.07 -0.49 1.22 -0.80 -0.65 0.00 0.00 175.02 174.23 1xkd s ASN 331 N 2.50 6.17 -0.21 1.11 0.01 -0.94 -0.08 114.94 123.50 1xkd s ASN 331 Ca 0.06 -0.58 -0.06 0.00 -0.71 0.00 0.00 52.86 51.58 1xkd s ASN 331 Cb -0.14 -2.53 -0.03 0.00 0.41 0.00 0.00 41.25 38.96 1xkd s ASN 331 CO -0.13 -1.76 0.02 -0.32 -1.51 0.00 0.00 177.10 173.41 1xkd s MET 332 N 5.40 3.68 0.52 -0.60 -2.45 0.24 -1.82 119.30 124.27 1xkd s MET 332 Ca 0.33 -0.49 0.01 0.00 -1.25 0.00 0.00 55.69 54.29 1xkd s MET 332 Cb -0.09 -3.15 -0.00 0.00 1.25 0.00 0.00 34.83 32.84 1xkd s MET 332 CO 0.13 0.01 0.05 0.20 1.05 0.00 0.00 175.02 176.47 1xkd s GLY 333 N 1.02 2.99 -0.77 2.11 0.00 0.47 -1.38 107.32 111.76 1xkd s GLY 333 Ca 0.03 -0.32 -0.25 0.00 0.00 0.00 0.00 44.72 44.17 1xkd s GLY 333 CO 0.02 -2.18 2.13 0.99 0.00 0.00 0.00 173.10 174.06 1xkd s ASP 334 N -3.94 4.70 0.00 1.64 -0.00 -1.26 -2.70 116.67 115.10 1xkd s ASP 334 Ca 0.07 -0.08 0.00 0.00 -0.00 0.00 0.00 52.55 52.54 1xkd s ASP 334 Cb 0.00 -2.54 0.00 0.00 -0.00 0.00 0.00 42.92 40.38 1xkd s ASP 334 CO 0.04 -3.04 0.00 0.61 -0.00 0.00 0.00 175.17 172.78 1xkd n GLY 335 N 6.55 0.59 3.24 0.21 0.00 -1.26 -5.03 105.19 109.48 1xkd n GLY 335 Ca 0.38 -0.53 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 1xkd n GLY 335 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1xkd s ILE 336 N -2.00 -0.03 0.01 -0.61 2.07 -1.10 -4.87 121.20 114.67 1xkd s ILE 336 Ca 0.00 0.09 -0.04 0.00 -1.41 0.00 0.00 60.65 59.29 1xkd s ILE 336 Cb 0.00 -0.57 -0.01 0.00 0.13 0.00 0.00 42.46 42.02 1xkd s ILE 336 CO 0.00 0.04 0.07 0.00 -1.91 0.00 0.00 174.94 173.14 1xkd s ALA 337 N 1.25 -0.15 -0.23 1.50 0.00 -0.98 -0.40 121.76 122.76 1xkd s ALA 337 Ca -0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 51.96 51.59 1xkd s ALA 337 Cb -0.08 0.11 0.06 0.00 0.00 0.00 0.00 23.12 23.21 1xkd s ALA 337 CO -0.11 -0.18 -0.00 0.08 0.00 0.00 0.00 175.76 175.55 1xkd s VAL 338 N -1.30 1.12 0.25 0.00 1.01 -0.76 -2.54 120.40 118.18 1xkd s VAL 338 Ca -0.14 -1.03 -0.30 0.00 0.00 0.00 0.00 61.98 60.52 1xkd s VAL 338 Cb -0.08 -1.53 -0.09 0.00 0.00 0.00 0.00 36.38 34.68 1xkd s VAL 338 CO 0.00 -0.21 1.11 0.00 0.00 0.00 0.00 175.10 176.01 1xkd s ALA 339 N 1.57 3.40 -0.29 5.51 0.00 0.27 -2.22 121.76 130.01 1xkd s ALA 339 Ca -0.02 0.89 -0.16 0.00 0.00 0.00 0.00 51.96 52.67 1xkd s ALA 339 Cb -0.18 -3.34 0.12 0.00 0.00 0.00 0.00 23.12 19.72 1xkd s ALA 339 CO -0.09 -0.20 0.87 -2.00 0.00 0.00 0.00 175.76 174.34 1xkd s GLU 340 N -1.10 0.50 0.94 0.00 2.12 -1.14 -0.15 118.70 119.85 1xkd s GLU 340 Ca 0.46 0.88 -0.11 0.00 0.36 0.00 0.00 54.97 56.57 1xkd s GLU 340 Cb -0.32 0.14 0.15 0.00 0.26 0.00 0.00 34.13 34.36 1xkd s GLU 340 CO 0.39 -0.11 1.10 -1.25 -0.54 0.00 0.00 175.26 174.85 1xkd s PRO 341 N 1.54 0.89 0.03 4.30 0.04 -1.26 -2.02 135.00 138.51 1xkd s PRO 341 Ca -0.09 1.13 -0.25 0.00 0.04 0.00 0.00 61.00 61.83 1xkd s PRO 341 Cb -0.04 -1.74 -0.18 0.00 0.04 0.00 0.00 34.50 32.57 1xkd s PRO 341 CO -0.17 -2.58 1.46 0.28 0.04 0.00 0.00 177.00 176.03 1xkd h VAL 342 N -1.81 1.17 -4.13 -0.36 2.07 -1.45 -3.44 116.25 108.30 1xkd h VAL 342 Ca -0.49 -0.63 -0.54 0.00 0.82 0.00 0.00 66.70 65.87 1xkd h VAL 342 Cb 1.28 1.59 0.14 0.00 -1.52 0.00 0.00 31.29 32.78 1xkd h VAL 342 CO 0.49 0.16 0.46 -1.38 0.02 0.00 0.00 177.57 177.31 1xkd s HIS 343 N -5.10 2.17 0.00 1.57 -3.43 -1.26 -5.05 115.29 104.19 1xkd s HIS 343 Ca -0.15 1.54 0.00 0.00 -0.80 0.00 0.00 55.06 55.65 1xkd s HIS 343 Cb 0.03 -3.54 0.00 0.00 -1.43 0.00 0.00 32.58 27.64 1xkd s HIS 343 CO 0.66 -2.58 0.00 0.41 -2.00 0.00 0.00 174.74 171.23 1xkd n GLY 344 N 0.58 1.81 0.23 -1.38 0.00 -1.26 -4.63 105.19 100.54 1xkd n GLY 344 Ca 0.14 -1.74 0.12 0.00 0.00 0.00 0.00 46.02 44.55 1xkd n GLY 344 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xkd h THR 345 N 0.00 0.22 -6.29 2.61 2.02 -1.86 -3.44 112.91 106.16 1xkd h THR 345 Ca 0.00 -1.04 -0.29 0.00 0.77 0.00 0.00 66.41 65.85 1xkd h THR 345 Cb 0.00 1.87 -0.00 0.00 -1.74 0.00 0.00 68.15 68.27 1xkd h THR 345 CO 0.00 0.11 -0.60 0.00 0.37 0.00 0.00 175.52 175.40 1xkd n ALA 346 N -2.14 -1.96 0.25 6.16 0.00 -1.26 -1.33 120.51 120.23 1xkd n ALA 346 Ca 0.02 -0.20 0.11 0.00 0.00 0.00 0.00 53.44 53.37 1xkd n ALA 346 Cb 0.47 -0.64 0.66 0.00 0.00 0.00 0.00 19.45 19.94 1xkd n ALA 346 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1xkd h PRO 347 N 0.20 0.00 0.00 0.00 0.13 -1.95 -1.07 132.00 129.31 1xkd h PRO 347 Ca -0.36 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.75 1xkd h PRO 347 Cb 0.77 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 1xkd h PRO 347 CO 0.22 0.15 -0.08 1.57 -0.23 0.00 0.00 178.00 179.63 1xkd h LYS 348 N 0.00 0.00 -0.03 0.86 2.10 -2.02 -2.68 116.57 114.80 1xkd h LYS 348 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xkd h LYS 348 Cb 0.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 1xkd h LYS 348 CO 0.02 0.08 -0.10 0.66 -2.00 0.00 0.00 179.45 178.11 1xkd n TYR 349 N -3.25 0.00 0.00 0.07 0.53 -0.42 -4.88 117.16 109.21 1xkd n TYR 349 Ca -0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 1xkd n TYR 349 Cb 0.32 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.63 1xkd n TYR 349 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1xkd n ALA 350 N 1.05 0.00 -2.57 -0.72 0.00 -1.01 -2.76 120.51 114.49 1xkd n ALA 350 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.21 1xkd n ALA 350 Cb 0.56 0.31 0.01 0.00 0.00 0.00 0.00 19.45 20.33 1xkd n ALA 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xkd n GLY 351 N -0.97 5.90 0.00 0.00 0.00 -1.26 -4.43 105.19 104.43 1xkd n GLY 351 Ca 0.00 -2.63 0.00 0.00 0.00 0.00 0.00 46.02 43.39 1xkd n GLY 351 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xkd n LYS 352 N -0.23 1.44 -2.95 1.61 5.02 -1.11 -5.02 118.16 116.92 1xkd n LYS 352 Ca 0.44 -0.24 -0.22 0.00 -2.02 0.00 0.00 58.31 56.26 1xkd n LYS 352 Cb 0.32 -0.70 0.03 0.00 -0.02 0.00 0.00 35.03 34.66 1xkd n LYS 352 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1xkd n ASP 353 N -0.28 -6.08 -0.05 4.39 2.03 -1.26 -4.88 116.55 110.42 1xkd n ASP 353 Ca 0.00 -0.26 -0.06 0.00 0.52 0.00 0.00 54.79 54.99 1xkd n ASP 353 Cb 0.04 -4.93 -0.05 0.00 -0.72 0.00 0.00 41.12 35.45 1xkd n ASP 353 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1xkd n LEU 354 N -3.91 2.07 -4.56 -2.67 4.77 -1.26 -1.22 117.00 110.22 1xkd n LEU 354 Ca -0.13 -0.04 -0.38 0.00 -0.03 0.00 0.00 56.01 55.43 1xkd n LEU 354 Cb 0.63 -0.19 0.05 0.00 -2.33 0.00 0.00 43.42 41.57 1xkd n LEU 354 CO 0.45 0.53 0.36 0.00 -1.33 0.00 0.00 177.39 177.40 1xkd n ILE 355 N -2.65 3.16 -3.02 -0.08 0.13 -1.26 -4.43 119.36 111.20 1xkd n ILE 355 Ca -0.17 -0.50 -0.42 0.00 -1.10 0.00 0.00 62.75 60.56 1xkd n ILE 355 Cb 0.72 -0.96 -0.06 0.00 -0.84 0.00 0.00 39.64 38.50 1xkd n ILE 355 CO 0.00 0.00 0.00 0.21 2.80 0.00 0.00 176.55 179.56 1xkd s ASN 356 N -1.22 6.53 0.00 9.51 3.84 -1.26 -4.36 114.94 127.98 1xkd s ASN 356 Ca 0.73 0.37 0.29 0.00 0.21 0.00 0.00 52.86 54.46 1xkd s ASN 356 Cb -0.43 -2.37 1.30 0.00 -0.55 0.00 0.00 41.25 39.20 1xkd s ASN 356 CO 0.50 -0.64 1.94 -0.81 -2.79 0.00 0.00 177.10 175.30 1xkd n PRO 357 N 6.20 0.27 -0.28 0.43 -0.04 -1.26 -4.31 135.00 136.01 1xkd n PRO 357 Ca 0.01 -0.03 0.05 0.00 -0.04 0.00 0.00 63.50 63.49 1xkd n PRO 357 Cb 0.48 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.63 1xkd n PRO 357 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1xkd h SER 358 N 0.08 0.50 -0.52 3.54 0.02 -1.93 -1.67 113.55 113.57 1xkd h SER 358 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1xkd h SER 358 Cb 0.39 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 1xkd h SER 358 CO 0.00 0.24 0.32 0.00 -1.14 0.00 0.00 176.83 176.25 1xkd h ALA 359 N 1.51 0.66 -0.41 3.77 0.00 -1.35 0.13 119.26 123.57 1xkd h ALA 359 Ca 0.42 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.15 1xkd h ALA 359 Cb 0.54 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1xkd h ALA 359 CO -0.33 0.13 -0.25 1.49 0.00 0.00 0.00 179.25 180.29 1xkd h GLU 360 N 0.70 0.85 -0.55 0.00 4.57 -1.73 -1.29 114.58 117.13 1xkd h GLU 360 Ca 0.19 -0.37 -0.08 0.00 -1.18 0.00 0.00 59.36 57.92 1xkd h GLU 360 Cb -0.04 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 1xkd h GLU 360 CO -0.04 1.00 0.02 0.82 -1.18 0.00 0.00 179.01 179.64 1xkd h ILE 361 N 0.73 1.26 0.00 2.32 2.04 -1.00 -1.47 117.51 121.39 1xkd h ILE 361 Ca 0.09 -1.08 -0.08 0.00 1.00 0.00 0.00 64.86 64.79 1xkd h ILE 361 Cb 0.79 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 1xkd h ILE 361 CO 0.07 0.39 -0.37 -0.07 0.00 0.00 0.00 178.15 178.16 1xkd h LEU 362 N 0.83 0.00 -0.20 1.44 3.38 -0.64 0.25 115.31 120.37 1xkd h LEU 362 Ca 0.16 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 1xkd h LEU 362 Cb 0.51 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 1xkd h LEU 362 CO 0.02 0.37 -0.27 0.28 0.09 0.00 0.00 178.44 178.94 1xkd h SER 363 N 0.00 0.59 -0.68 -0.43 0.02 -1.16 -0.48 113.55 111.41 1xkd h SER 363 Ca -0.00 -0.51 0.05 0.00 -0.84 0.00 0.00 61.79 60.49 1xkd h SER 363 Cb 1.08 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.41 1xkd h SER 363 CO 0.05 0.98 0.45 0.00 -1.14 0.00 0.00 176.83 177.17 1xkd h ALA 364 N 0.63 1.69 0.00 3.77 0.00 -0.76 -0.94 119.26 123.64 1xkd h ALA 364 Ca 0.02 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1xkd h ALA 364 Cb 0.84 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1xkd h ALA 364 CO 0.06 0.22 -0.66 1.03 0.00 0.00 0.00 179.25 179.90 1xkd h SER 365 N 0.75 0.00 0.04 0.00 0.87 -0.76 -2.54 113.55 111.90 1xkd h SER 365 Ca 0.29 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.64 1xkd h SER 365 Cb 0.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1xkd h SER 365 CO -0.09 0.66 -0.76 0.25 -0.53 0.00 0.00 176.83 176.36 1xkd h LEU 366 N 0.00 0.74 0.67 2.23 5.85 -0.03 0.12 115.31 124.89 1xkd h LEU 366 Ca -0.01 -0.49 -0.03 0.00 0.84 0.00 0.00 57.88 58.19 1xkd h LEU 366 Cb 1.33 -0.22 0.01 0.00 0.37 0.00 0.00 40.66 42.14 1xkd h LEU 366 CO 0.09 1.26 -0.32 0.25 -0.34 0.00 0.00 178.44 179.38 1xkd h LEU 367 N 0.42 -0.76 -0.73 2.25 5.85 -1.24 -2.61 115.31 118.49 1xkd h LEU 367 Ca -0.04 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.58 1xkd h LEU 367 Cb 1.37 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.58 1xkd h LEU 367 CO 0.15 -0.42 -0.01 0.40 -0.34 0.00 0.00 178.44 178.22 1xkd h ILE 368 N -1.12 1.26 0.00 4.05 1.08 -1.51 -0.52 117.51 120.75 1xkd h ILE 368 Ca -0.09 -1.12 0.00 0.00 -0.39 0.00 0.00 64.86 63.26 1xkd h ILE 368 Cb 0.72 0.84 0.00 0.00 -3.07 0.00 0.00 36.82 35.32 1xkd h ILE 368 CO 0.15 0.40 0.00 0.61 -0.69 0.00 0.00 178.15 178.62 1xkd n GLY 369 N -0.49 -0.63 0.20 5.37 0.00 0.42 -1.70 105.19 108.35 1xkd n GLY 369 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 1xkd n GLY 369 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1xkd h GLU 370 N 0.00 0.53 0.00 1.61 4.57 -1.60 -2.95 114.58 116.74 1xkd h GLU 370 Ca 0.00 -0.38 -0.27 0.00 -1.18 0.00 0.00 59.36 57.52 1xkd h GLU 370 Cb 0.00 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.61 1xkd h GLU 370 CO 0.00 1.00 -1.54 0.34 -1.18 0.00 0.00 179.01 177.64 1xkd n PHE 371 N -3.91 0.74 0.05 0.92 7.35 -1.09 -4.46 117.46 117.07 1xkd n PHE 371 Ca -0.04 0.32 -0.12 0.00 -0.76 0.00 0.00 57.45 56.85 1xkd n PHE 371 Cb 0.66 -1.04 -0.01 0.00 0.35 0.00 0.00 39.48 39.44 1xkd n PHE 371 CO 0.00 0.00 0.00 0.52 -0.76 0.00 0.00 176.76 176.52 1xkd h MET 372 N -1.00 0.43 0.00 -4.13 2.86 -1.20 -3.48 114.93 108.41 1xkd h MET 372 Ca -0.41 -0.39 0.00 0.00 -2.06 0.00 0.00 59.70 56.83 1xkd h MET 372 Cb 1.33 0.10 0.00 0.00 0.06 0.00 0.00 31.60 33.09 1xkd h MET 372 CO -0.25 1.04 0.00 0.41 1.06 0.00 0.00 176.91 179.17 1xkd n GLY 373 N 0.73 1.01 3.31 8.32 0.00 -1.10 -4.78 105.19 112.68 1xkd n GLY 373 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 1xkd n GLY 373 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1xkd n TRP 374 N -0.31 4.39 0.03 1.61 7.02 -0.69 -4.82 117.44 124.68 1xkd n TRP 374 Ca 0.00 -3.09 0.03 0.00 -1.02 0.00 0.00 57.50 53.42 1xkd n TRP 374 Cb 0.00 -2.28 0.40 0.00 -2.42 0.00 0.00 31.31 27.01 1xkd n TRP 374 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1xkd h ARG 375 N 6.87 0.46 -0.32 -0.99 3.08 -1.82 -2.66 114.38 119.00 1xkd h ARG 375 Ca 0.39 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.31 1xkd h ARG 375 Cb 0.80 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.75 1xkd h ARG 375 CO 1.43 0.38 -0.12 0.93 -1.07 0.00 0.00 179.97 181.52 1xkd h GLU 376 N 0.46 0.55 -0.02 0.04 4.39 -1.92 -2.03 114.58 116.06 1xkd h GLU 376 Ca 0.12 -0.16 -0.05 0.00 0.34 0.00 0.00 59.36 59.60 1xkd h GLU 376 Cb 0.10 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1xkd h GLU 376 CO -0.01 0.66 -0.23 0.28 -1.16 0.00 0.00 179.01 178.55 1xkd h VAL 377 N 0.51 1.18 -0.33 3.13 2.07 -1.82 -2.23 116.25 118.76 1xkd h VAL 377 Ca 0.09 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 1xkd h VAL 377 Cb 0.51 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 1xkd h VAL 377 CO 0.03 0.24 0.18 0.50 0.02 0.00 0.00 177.57 178.54 1xkd h LYS 378 N 0.03 0.46 0.04 1.57 3.64 -1.39 -2.19 116.57 118.73 1xkd h LYS 378 Ca 0.00 -0.05 -0.23 0.00 -1.27 0.00 0.00 60.65 59.10 1xkd h LYS 378 Cb 0.43 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1xkd h LYS 378 CO 0.03 0.38 -1.03 0.66 -2.27 0.00 0.00 179.45 177.23 1xkd h SER 379 N 0.41 0.26 0.03 4.20 4.64 -1.29 0.22 113.55 122.01 1xkd h SER 379 Ca 0.12 -0.24 -0.16 0.00 -0.47 0.00 0.00 61.79 61.03 1xkd h SER 379 Cb 0.06 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 1xkd h SER 379 CO -0.02 1.13 -0.54 -0.29 -0.87 0.00 0.00 176.83 176.23 1xkd h ILE 380 N 0.07 1.32 -0.45 0.95 6.09 -1.51 0.84 117.51 124.82 1xkd h ILE 380 Ca -0.07 -1.79 0.05 0.00 -1.37 0.00 0.00 64.86 61.68 1xkd h ILE 380 Cb 1.72 1.77 -0.05 0.00 0.47 0.00 0.00 36.82 40.74 1xkd h ILE 380 CO 0.16 0.56 0.19 0.58 -3.07 0.00 0.00 178.15 176.56 1xkd h VAL 381 N 0.43 0.90 0.15 2.19 2.07 -1.12 -1.19 116.25 119.68 1xkd h VAL 381 Ca 0.01 -0.13 -0.29 0.00 0.82 0.00 0.00 66.70 67.11 1xkd h VAL 381 Cb 1.09 0.49 0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1xkd h VAL 381 CO 0.10 0.07 -1.28 -0.33 0.02 0.00 0.00 177.57 176.15 1xkd h GLU 382 N 0.38 0.38 -0.66 1.57 5.08 -0.42 -3.28 114.58 117.64 1xkd h GLU 382 Ca 0.20 -0.61 -0.06 0.00 -1.00 0.00 0.00 59.36 57.89 1xkd h GLU 382 Cb 0.16 0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1xkd h GLU 382 CO -0.18 1.28 0.17 -0.92 -1.00 0.00 0.00 179.01 178.36 1xkd h TYR 383 N 0.12 1.10 0.26 4.33 3.20 -0.69 -1.61 116.97 123.67 1xkd h TYR 383 Ca -0.16 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.57 1xkd h TYR 383 Cb 1.98 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.95 1xkd h TYR 383 CO 0.08 0.90 -0.12 0.00 -1.64 0.00 0.00 178.16 177.38 1xkd h ALA 384 N 1.07 -0.35 -0.39 1.82 0.00 -1.34 -0.74 119.26 119.34 1xkd h ALA 384 Ca 0.21 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 55.01 1xkd h ALA 384 Cb 0.35 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 1xkd h ALA 384 CO 0.00 -0.51 -0.04 0.82 0.00 0.00 0.00 179.25 179.52 1xkd h ILE 385 N -0.72 0.66 -0.69 0.00 2.04 -1.63 0.13 117.51 117.29 1xkd h ILE 385 Ca -0.04 -0.02 0.13 0.00 1.00 0.00 0.00 64.86 65.94 1xkd h ILE 385 Cb 0.49 0.60 -0.09 0.00 -0.74 0.00 0.00 36.82 37.07 1xkd h ILE 385 CO 0.06 0.01 0.21 0.03 0.00 0.00 0.00 178.15 178.46 1xkd h ARG 386 N 0.05 0.33 -0.08 2.37 3.08 -1.25 0.10 114.38 118.99 1xkd h ARG 386 Ca 0.19 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 1xkd h ARG 386 Cb 0.28 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 1xkd h ARG 386 CO -0.36 0.22 -0.10 0.87 -1.07 0.00 0.00 179.97 179.53 1xkd h LYS 387 N 0.34 0.21 -0.71 0.04 1.79 -0.23 0.13 116.57 118.14 1xkd h LYS 387 Ca 0.37 -0.12 0.04 0.00 -2.18 0.00 0.00 60.65 58.77 1xkd h LYS 387 Cb 0.57 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.19 1xkd h LYS 387 CO -0.42 0.67 0.47 0.00 -1.08 0.00 0.00 179.45 179.09 1xkd h ALA 388 N 0.54 1.62 0.23 3.86 0.00 -0.56 -3.10 119.26 121.84 1xkd h ALA 388 Ca 0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1xkd h ALA 388 Cb 0.64 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1xkd h ALA 388 CO 0.02 0.30 -0.11 0.28 0.00 0.00 0.00 179.25 179.74 1xkd h VAL 389 N 0.83 0.38 0.00 0.00 2.07 -0.66 -2.74 116.25 116.14 1xkd h VAL 389 Ca 0.29 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.88 1xkd h VAL 389 Cb 0.11 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1xkd h VAL 389 CO -0.09 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.61 1xkd n GLN 390 N -4.98 0.50 0.00 1.57 6.02 0.44 -1.63 117.38 119.30 1xkd n GLN 390 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.93 1xkd n GLN 390 Cb 0.21 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.22 1xkd n GLN 390 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1xkd n SER 391 N 0.46 0.15 -2.65 1.08 3.41 -1.18 -5.01 113.62 109.87 1xkd n SER 391 Ca 0.00 -1.03 -0.17 0.00 -0.26 0.00 0.00 58.87 57.41 1xkd n SER 391 Cb 0.18 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.18 1xkd n SER 391 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1xkd n LYS 392 N -0.02 -5.53 -3.82 4.33 5.02 -0.65 -4.99 118.16 112.51 1xkd n LYS 392 Ca 0.00 0.58 -0.32 0.00 -2.02 0.00 0.00 58.31 56.55 1xkd n LYS 392 Cb 0.29 -4.87 -0.11 0.00 -0.02 0.00 0.00 35.03 30.33 1xkd n LYS 392 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1xkd s LYS 393 N -5.90 2.49 0.04 1.97 1.02 -1.03 -4.75 119.74 113.58 1xkd s LYS 393 Ca 0.41 -2.90 -0.00 0.00 0.02 0.00 0.00 55.97 53.49 1xkd s LYS 393 Cb -0.18 -3.57 -0.03 0.00 -0.52 0.00 0.00 37.83 33.53 1xkd s LYS 393 CO 0.50 -1.20 -0.04 0.14 -0.92 0.00 0.00 175.35 173.84 1xkd s VAL 394 N -0.72 0.21 0.89 3.17 -7.23 -1.26 -4.56 120.40 110.90 1xkd s VAL 394 Ca 0.21 -1.32 -0.11 0.00 -1.81 0.00 0.00 61.98 58.95 1xkd s VAL 394 Cb -0.16 -0.84 0.13 0.00 0.56 0.00 0.00 36.38 36.07 1xkd s VAL 394 CO -0.07 -0.70 1.09 0.42 -0.31 0.00 0.00 175.10 175.53 1xkd s THR 395 N -2.51 2.69 0.52 5.32 -4.23 -1.25 -0.55 115.64 115.63 1xkd s THR 395 Ca -0.05 0.22 0.26 0.00 -1.18 0.00 0.00 61.69 60.94 1xkd s THR 395 Cb -0.02 -2.62 0.41 0.00 1.34 0.00 0.00 72.50 71.61 1xkd s THR 395 CO -0.05 -0.29 1.96 0.06 -0.54 0.00 0.00 174.62 175.76 1xkd h GLN 396 N -1.58 0.05 -0.50 3.99 -0.00 -1.78 -2.08 115.11 113.21 1xkd h GLN 396 Ca -0.48 -0.00 -0.07 0.00 -0.00 0.00 0.00 58.65 58.10 1xkd h GLN 396 Cb 1.27 -0.01 -0.02 0.00 -0.00 0.00 0.00 27.48 28.72 1xkd h GLN 396 CO 0.52 0.03 0.03 0.38 -0.00 0.00 0.00 178.83 179.79 1xkd h ASP 397 N 0.05 0.78 0.14 0.06 2.03 -1.91 -1.26 116.42 116.31 1xkd h ASP 397 Ca 0.31 -0.18 -0.31 0.00 -0.73 0.00 0.00 57.03 56.12 1xkd h ASP 397 Cb 1.16 -0.21 0.00 0.00 -0.83 0.00 0.00 39.33 39.46 1xkd h ASP 397 CO -0.02 0.83 -1.57 -0.07 -1.03 0.00 0.00 179.24 177.38 1xkd h LEU 398 N 0.77 0.47 -2.70 0.15 3.38 -1.73 -3.36 115.31 112.29 1xkd h LEU 398 Ca 0.15 -0.89 0.01 0.00 0.09 0.00 0.00 57.88 57.24 1xkd h LEU 398 Cb 0.42 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1xkd h LEU 398 CO 0.01 1.70 0.06 0.00 0.09 0.00 0.00 178.44 180.30 1xkd h ALA 399 N 0.01 1.22 -0.48 1.53 0.00 -1.30 -2.46 119.26 117.78 1xkd h ALA 399 Ca -0.33 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 1xkd h ALA 399 Cb 1.90 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 1xkd h ALA 399 CO 0.10 -0.07 0.09 0.00 0.00 0.00 0.00 179.25 179.37 1xkd h ARG 400 N 0.00 0.79 -1.04 0.00 3.08 -1.37 -3.26 114.38 112.58 1xkd h ARG 400 Ca 0.01 -0.21 -0.07 0.00 0.07 0.00 0.00 59.98 59.78 1xkd h ARG 400 Cb 0.13 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 1xkd h ARG 400 CO -0.00 0.79 0.09 0.72 -1.07 0.00 0.00 179.97 180.51 1xkd n HIS 401 N -4.44 0.43 -3.64 3.04 8.25 -0.93 -4.74 115.22 113.19 1xkd n HIS 401 Ca 0.01 -0.72 -0.09 0.00 -0.26 0.00 0.00 57.72 56.67 1xkd n HIS 401 Cb 0.25 -0.36 -0.07 0.00 1.12 0.00 0.00 29.99 30.92 1xkd n HIS 401 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 1xkd s MET 402 N -0.47 0.71 0.35 -0.41 -2.45 -1.23 -4.44 119.30 111.36 1xkd s MET 402 Ca 0.08 1.15 -0.28 0.00 -1.25 0.00 0.00 55.69 55.39 1xkd s MET 402 Cb 0.07 0.18 -0.10 0.00 1.25 0.00 0.00 34.83 36.23 1xkd s MET 402 CO 0.01 -0.14 1.28 -1.25 1.05 0.00 0.00 175.02 175.98 1xkd s PRO 403 N 1.37 4.26 0.00 4.11 0.04 -1.26 -3.81 135.00 139.71 1xkd s PRO 403 Ca -0.08 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.11 1xkd s PRO 403 Cb -0.05 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.51 1xkd s PRO 403 CO -0.15 -0.24 0.00 0.41 0.04 0.00 0.00 177.00 177.05 1xkd n GLY 404 N 0.78 2.55 3.58 0.56 0.00 -1.26 -4.98 105.19 106.42 1xkd n GLY 404 Ca 0.01 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 1xkd n GLY 404 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xkd s VAL 405 N -1.02 3.22 0.17 1.61 1.01 -1.25 -4.96 120.40 119.19 1xkd s VAL 405 Ca 0.00 0.20 -0.30 0.00 0.00 0.00 0.00 61.98 61.88 1xkd s VAL 405 Cb 0.00 -3.35 -0.08 0.00 0.00 0.00 0.00 36.38 32.94 1xkd s VAL 405 CO 0.00 -0.26 1.31 -1.58 0.00 0.00 0.00 175.10 174.56 1xkd s GLN 406 N 6.54 4.39 0.21 2.72 2.00 -1.26 -4.83 119.66 129.43 1xkd s GLN 406 Ca 0.88 2.03 -0.18 0.00 -2.00 0.00 0.00 55.36 56.09 1xkd s GLN 406 Cb -0.24 -3.22 -0.08 0.00 0.80 0.00 0.00 33.01 30.27 1xkd s GLN 406 CO 0.31 -0.27 0.69 -1.25 -0.50 0.00 0.00 175.29 174.26 1xkd s PRO 407 N 0.18 4.17 -0.04 1.67 0.04 -1.26 -4.57 135.00 135.19 1xkd s PRO 407 Ca 0.58 0.77 0.01 0.00 0.04 0.00 0.00 61.00 62.39 1xkd s PRO 407 Cb -0.36 -2.86 -0.03 0.00 0.04 0.00 0.00 34.50 31.29 1xkd s PRO 407 CO 0.36 0.39 -0.02 -0.51 0.04 0.00 0.00 177.00 177.26 1xkd s LEU 408 N -2.05 3.42 0.91 -3.56 1.43 0.29 -4.92 118.68 114.19 1xkd s LEU 408 Ca 0.43 0.01 -0.10 0.00 -1.03 0.00 0.00 54.13 53.44 1xkd s LEU 408 Cb -0.16 -1.87 0.14 0.00 0.03 0.00 0.00 46.19 44.33 1xkd s LEU 408 CO 0.20 0.32 1.12 -0.13 0.23 0.00 0.00 176.35 178.10 1xkd s ARG 409 N -1.20 1.08 0.13 1.70 0.52 -1.26 -3.90 118.95 116.02 1xkd s ARG 409 Ca 0.16 1.38 -0.22 0.00 -0.52 0.00 0.00 55.73 56.52 1xkd s ARG 409 Cb -0.11 -1.75 -0.01 0.00 0.52 0.00 0.00 34.95 33.60 1xkd s ARG 409 CO 0.06 -2.53 1.66 1.15 0.02 0.00 0.00 175.30 175.66 1xkd h THR 410 N -1.79 0.57 -0.73 0.02 2.02 -1.36 0.13 112.91 111.77 1xkd h THR 410 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1xkd h THR 410 Cb 1.27 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 68.21 1xkd h THR 410 CO 0.45 0.00 0.46 0.77 0.37 0.00 0.00 175.52 177.57 1xkd h SER 411 N -0.20 0.86 1.13 4.18 4.64 -1.92 -1.06 113.55 121.19 1xkd h SER 411 Ca 0.10 -0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.25 1xkd h SER 411 Cb 0.34 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 1xkd h SER 411 CO -0.26 0.65 -0.57 1.05 -0.87 0.00 0.00 176.83 176.83 1xkd h GLU 412 N 1.00 0.00 -0.51 4.77 4.11 -1.84 -1.28 114.58 120.83 1xkd h GLU 412 Ca 0.27 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.58 1xkd h GLU 412 Cb -0.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1xkd h GLU 412 CO -0.05 0.57 -0.15 -0.92 0.07 0.00 0.00 179.01 178.53 1xkd h TYR 413 N 0.00 1.11 -0.15 2.06 3.20 -0.55 -2.65 116.97 119.99 1xkd h TYR 413 Ca -0.01 -0.24 -0.15 0.00 3.14 0.00 0.00 58.73 61.47 1xkd h TYR 413 Cb 1.29 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 1xkd h TYR 413 CO 0.00 1.05 -0.55 0.00 -1.64 0.00 0.00 178.16 177.02 1xkd h THR 414 N 0.86 1.34 0.00 1.81 1.03 -0.95 -2.19 112.91 114.81 1xkd h THR 414 Ca 0.13 -1.82 0.00 0.00 -0.01 0.00 0.00 66.41 64.70 1xkd h THR 414 Cb 0.71 1.82 0.00 0.00 -1.07 0.00 0.00 68.15 69.62 1xkd h THR 414 CO 0.05 0.56 0.00 1.05 -0.01 0.00 0.00 175.52 177.17 1xkd h GLU 415 N 0.34 0.00 -0.00 0.00 4.11 -1.27 -1.77 114.58 115.99 1xkd h GLU 415 Ca 0.01 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.35 1xkd h GLU 415 Cb 1.07 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.33 1xkd h GLU 415 CO 0.10 0.00 -0.33 1.15 0.07 0.00 0.00 179.01 180.00 1xkd h THR 416 N 0.00 1.52 -0.24 -1.06 2.02 -1.17 -3.04 112.91 110.94 1xkd h THR 416 Ca 0.00 -1.97 0.03 0.00 0.77 0.00 0.00 66.41 65.24 1xkd h THR 416 Cb 0.58 2.72 -0.03 0.00 -1.74 0.00 0.00 68.15 69.68 1xkd h THR 416 CO 0.00 0.55 0.07 -0.07 0.37 0.00 0.00 175.52 176.43 1xkd h LEU 417 N -0.41 0.06 -0.36 2.58 3.38 -1.21 -1.79 115.31 117.56 1xkd h LEU 417 Ca -0.04 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1xkd h LEU 417 Cb 1.07 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.78 1xkd h LEU 417 CO 0.06 0.06 -0.07 0.40 0.09 0.00 0.00 178.44 178.99 1xkd h ILE 418 N 0.17 0.66 -0.37 1.22 1.08 -1.43 -0.90 117.51 117.94 1xkd h ILE 418 Ca 0.10 -0.01 -0.02 0.00 -0.39 0.00 0.00 64.86 64.55 1xkd h ILE 418 Cb 0.09 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 34.45 1xkd h ILE 418 CO -0.12 0.00 0.16 0.00 -0.69 0.00 0.00 178.15 177.50 1xkd h ALA 419 N 1.35 1.59 -0.15 1.87 0.00 -1.39 -1.60 119.26 120.94 1xkd h ALA 419 Ca 0.17 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1xkd h ALA 419 Cb 0.26 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1xkd h ALA 419 CO -0.35 0.33 -0.34 1.88 0.00 0.00 0.00 179.25 180.76 1xkd h TYR 420 N 0.52 0.35 0.15 0.00 0.99 -0.32 -2.63 116.97 116.02 1xkd h TYR 420 Ca 0.13 -0.08 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 1xkd h TYR 420 Cb 0.09 -0.08 0.00 0.00 1.00 0.00 0.00 36.73 37.74 1xkd h TYR 420 CO 0.00 0.62 -0.07 0.82 -0.00 0.00 0.00 178.16 179.53 1xkd h ILE 421 N 0.26 0.96 0.00 -2.88 2.04 -0.61 -3.31 117.51 113.96 1xkd h ILE 421 Ca 0.03 -1.06 -0.03 0.00 1.00 0.00 0.00 64.86 64.80 1xkd h ILE 421 Cb 0.74 1.55 -0.00 0.00 -0.74 0.00 0.00 36.82 38.36 1xkd h ILE 421 CO 0.06 0.23 -0.14 0.44 0.00 0.00 0.00 178.15 178.73 1xkd h ASP 422 N -0.76 0.00 -0.60 1.72 3.32 -1.35 -3.13 116.42 115.62 1xkd h ASP 422 Ca -0.02 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.68 1xkd h ASP 422 Cb 0.53 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 39.87 1xkd h ASP 422 CO 0.03 0.14 0.11 -0.62 -1.72 0.00 0.00 179.24 177.18 1xkd n GLU 423 N -3.61 2.18 -4.14 3.56 1.02 -0.99 -5.04 120.64 113.62 1xkd n GLU 423 Ca -0.02 -3.26 -0.36 0.00 -0.02 0.00 0.00 57.16 53.51 1xkd n GLU 423 Cb 0.27 -1.99 -0.08 0.00 -0.02 0.00 0.00 31.44 29.62 1xkd n GLU 423 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xkd s ALA 424 N -3.36 3.56 -0.56 0.62 0.00 -1.18 -4.99 121.76 115.84 1xkd s ALA 424 Ca 0.50 -0.75 -0.28 0.00 0.00 0.00 0.00 51.96 51.43 1xkd s ALA 424 Cb 0.44 -1.69 0.02 0.00 0.00 0.00 0.00 23.12 21.89 1xkd s ALA 424 CO 0.02 0.61 1.28 0.34 0.00 0.00 0.00 175.76 178.02 1xkd s ASP 425 N -1.05 6.34 0.00 0.00 -1.08 -1.26 -5.12 116.67 114.50 1xkd s ASP 425 Ca 0.15 0.24 0.29 0.00 -0.52 0.00 0.00 52.55 52.71 1xkd s ASP 425 Cb -0.12 -2.55 1.31 0.00 -1.46 0.00 0.00 42.92 40.10 1xkd s ASP 425 CO 0.04 -1.54 1.89 0.18 0.52 0.00 0.00 175.17 176.26