#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u0k n ARG 3 N 0.00 0.00 -3.77 1.43 1.85 -1.26 -4.96 116.66 109.95 1u0k n ARG 3 Ca 0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 56.72 1u0k n ARG 3 Cb 0.00 0.00 -0.12 0.00 -1.05 0.00 0.00 32.46 31.29 1u0k n ARG 3 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1u0k s ARG 4 N 4.77 0.25 0.17 2.89 3.52 -1.26 -0.93 118.95 128.35 1u0k s ARG 4 Ca 0.00 0.39 -0.01 0.00 -0.13 0.00 0.00 55.73 55.98 1u0k s ARG 4 Cb 0.00 0.04 -0.04 0.00 -1.56 0.00 0.00 34.95 33.39 1u0k s ARG 4 CO 0.00 -0.08 0.11 1.52 -0.81 0.00 0.00 175.30 176.04 1u0k s TYR 5 N 0.52 1.01 0.01 5.12 -0.85 -0.64 -4.16 117.35 118.36 1u0k s TYR 5 Ca -0.03 -1.30 0.04 0.00 -0.52 0.00 0.00 57.07 55.26 1u0k s TYR 5 Cb -0.05 -0.51 -0.01 0.00 0.38 0.00 0.00 41.96 41.77 1u0k s TYR 5 CO -0.03 -0.60 -0.13 -1.58 -1.52 0.00 0.00 175.55 171.70 1u0k s TRP 6 N -4.11 1.12 -0.25 -3.49 0.52 0.14 -0.36 118.94 112.51 1u0k s TRP 6 Ca 0.32 -0.26 -0.11 0.00 0.02 0.00 0.00 56.10 56.07 1u0k s TRP 6 Cb 0.07 -0.70 -0.05 0.00 -1.15 0.00 0.00 33.47 31.64 1u0k s TRP 6 CO 0.08 -0.00 0.19 -1.14 0.02 0.00 0.00 176.95 176.10 1u0k s GLN 7 N -0.61 4.04 0.14 4.98 2.00 -0.47 -0.88 119.66 128.86 1u0k s GLN 7 Ca 0.03 -0.24 0.05 0.00 -2.00 0.00 0.00 55.36 53.20 1u0k s GLN 7 Cb -0.06 -3.58 -0.04 0.00 0.80 0.00 0.00 33.01 30.13 1u0k s GLN 7 CO 0.00 -0.03 -0.11 -0.51 -0.50 0.00 0.00 175.29 174.14 1u0k s LEU 8 N 1.33 2.51 -0.12 3.68 1.02 -0.30 -0.65 118.68 126.14 1u0k s LEU 8 Ca 0.08 -0.98 0.02 0.00 0.02 0.00 0.00 54.13 53.28 1u0k s LEU 8 Cb -0.14 -0.38 -0.01 0.00 0.02 0.00 0.00 46.19 45.68 1u0k s LEU 8 CO 0.07 -0.30 -0.18 -1.81 0.02 0.00 0.00 176.35 174.15 1u0k s ASP 9 N -3.04 3.55 -0.08 2.29 1.01 -0.11 -0.86 116.67 119.42 1u0k s ASP 9 Ca 0.15 -0.45 -0.02 0.00 0.71 0.00 0.00 52.55 52.94 1u0k s ASP 9 Cb 0.01 -1.51 -0.03 0.00 1.01 0.00 0.00 42.92 42.39 1u0k s ASP 9 CO 0.01 0.15 0.01 -0.69 0.21 0.00 0.00 175.17 174.86 1u0k s VAL 10 N 0.41 4.36 -0.98 -1.27 1.01 -0.23 -0.74 120.40 122.95 1u0k s VAL 10 Ca -0.14 -0.25 -0.04 0.00 0.00 0.00 0.00 61.98 61.56 1u0k s VAL 10 Cb -0.17 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.37 1u0k s VAL 10 CO 0.06 0.59 0.47 0.49 0.00 0.00 0.00 175.10 176.71 1u0k n PHE 11 N 2.08 -1.39 -4.11 5.22 0.99 0.13 -0.91 117.46 119.47 1u0k n PHE 11 Ca -0.18 0.40 -0.33 0.00 -0.00 0.00 0.00 57.45 57.34 1u0k n PHE 11 Cb 0.54 -3.34 -0.16 0.00 -1.00 0.00 0.00 39.48 35.51 1u0k n PHE 11 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1u0k s ALA 12 N -3.00 2.38 -0.35 4.37 0.00 -0.56 -2.19 121.76 122.41 1u0k s ALA 12 Ca 0.23 -1.32 0.27 0.00 0.00 0.00 0.00 51.96 51.14 1u0k s ALA 12 Cb -0.10 -1.26 0.77 0.00 0.00 0.00 0.00 23.12 22.53 1u0k s ALA 12 CO 0.29 -0.50 1.75 0.93 0.00 0.00 0.00 175.76 178.23 1u0k h GLU 13 N 7.91 0.00 -3.68 0.00 4.39 -1.87 -3.38 114.58 117.96 1u0k h GLU 13 Ca -0.41 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.21 1u0k h GLU 13 Cb 1.12 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.65 1u0k h GLU 13 CO 0.61 0.00 -0.21 -0.98 -1.16 0.00 0.00 179.01 177.27 1u0k s ARG 14 N -3.32 1.18 0.72 2.33 1.70 -1.26 -5.03 118.95 115.26 1u0k s ARG 14 Ca 0.06 -1.03 -0.16 0.00 -0.47 0.00 0.00 55.73 54.14 1u0k s ARG 14 Cb 0.08 0.42 0.03 0.00 -0.57 0.00 0.00 34.95 34.91 1u0k s ARG 14 CO 0.59 -0.45 1.24 -2.14 -1.08 0.00 0.00 175.30 173.47 1u0k s PRO 15 N -3.92 2.14 -0.83 3.89 0.02 -1.26 -3.55 135.00 131.49 1u0k s PRO 15 Ca 0.12 1.89 0.00 0.00 0.02 0.00 0.00 61.00 63.04 1u0k s PRO 15 Cb 0.02 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.72 1u0k s PRO 15 CO -0.03 -1.87 0.00 1.28 -0.33 0.00 0.00 177.00 176.05 1u0k n LEU 16 N -2.56 -0.80 0.00 -5.54 4.77 -1.26 -5.01 117.00 106.59 1u0k n LEU 16 Ca 0.14 0.15 -0.15 0.00 -0.03 0.00 0.00 56.01 56.12 1u0k n LEU 16 Cb 0.49 -1.45 -0.06 0.00 -2.33 0.00 0.00 43.42 40.08 1u0k n LEU 16 CO 0.47 -0.34 -0.08 1.07 -1.33 0.00 0.00 177.39 177.18 1u0k n THR 17 N -3.08 0.00 -4.48 -5.08 5.66 -1.23 -4.92 114.28 101.15 1u0k n THR 17 Ca -0.09 -1.86 0.00 0.00 -3.05 0.00 0.00 64.05 59.06 1u0k n THR 17 Cb 0.35 0.91 0.00 0.00 -1.55 0.00 0.00 70.33 70.04 1u0k n THR 17 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1u0k n GLY 18 N -0.46 -1.28 3.51 1.09 0.00 -1.22 -4.63 105.19 102.19 1u0k n GLY 18 Ca 0.05 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.45 1u0k n GLY 18 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1u0k s ASN 19 N -4.00 6.30 0.47 1.61 3.84 -0.09 -4.80 114.94 118.26 1u0k s ASN 19 Ca 0.00 -0.41 -0.24 0.00 0.21 0.00 0.00 52.86 52.42 1u0k s ASN 19 Cb 0.00 -2.30 -0.07 0.00 -0.55 0.00 0.00 41.25 38.33 1u0k s ASN 19 CO 0.00 -0.74 1.28 -0.83 -2.79 0.00 0.00 177.10 174.02 1u0k s GLY 20 N 1.96 2.87 -0.16 1.21 0.00 -1.26 -1.07 107.32 110.87 1u0k s GLY 20 Ca 0.20 1.18 -0.10 0.00 0.00 0.00 0.00 44.72 46.00 1u0k s GLY 20 CO 0.18 1.71 0.39 -2.27 0.00 0.00 0.00 173.10 173.11 1u0k s LEU 21 N -2.96 0.14 -0.16 0.66 2.96 -0.04 -4.38 118.68 114.90 1u0k s LEU 21 Ca 0.64 0.83 -0.10 0.00 -0.22 0.00 0.00 54.13 55.28 1u0k s LEU 21 Cb -0.36 1.31 -0.05 0.00 0.50 0.00 0.00 46.19 47.59 1u0k s LEU 21 CO 0.44 -0.17 0.18 0.00 -1.32 0.00 0.00 176.35 175.48 1u0k s ALA 22 N 0.98 3.72 -0.16 5.97 0.00 -1.25 -1.15 121.76 129.86 1u0k s ALA 22 Ca -0.06 -0.61 0.01 0.00 0.00 0.00 0.00 51.96 51.30 1u0k s ALA 22 Cb -0.07 -2.17 0.02 0.00 0.00 0.00 0.00 23.12 20.90 1u0k s ALA 22 CO -0.08 0.27 -0.18 0.08 0.00 0.00 0.00 175.76 175.85 1u0k s VAL 23 N -0.02 1.86 -0.41 0.00 1.01 -0.06 -1.52 120.40 121.26 1u0k s VAL 23 Ca 0.12 -0.82 -0.17 0.00 0.00 0.00 0.00 61.98 61.11 1u0k s VAL 23 Cb -0.12 -1.69 0.02 0.00 0.00 0.00 0.00 36.38 34.58 1u0k s VAL 23 CO 0.01 0.51 0.44 -0.36 0.00 0.00 0.00 175.10 175.70 1u0k s PHE 24 N 1.27 3.17 -0.23 5.22 0.40 -0.17 -0.69 117.98 126.96 1u0k s PHE 24 Ca 0.03 -0.27 0.26 0.00 -0.60 0.00 0.00 56.93 56.35 1u0k s PHE 24 Cb -0.13 -2.89 0.70 0.00 0.51 0.00 0.00 43.02 41.20 1u0k s PHE 24 CO -0.10 -0.66 1.74 0.38 0.70 0.00 0.00 175.22 177.28 1u0k h ASP 25 N 8.68 0.00 -2.32 1.36 2.03 -1.86 -0.70 116.42 123.62 1u0k h ASP 25 Ca -0.27 0.00 -0.46 0.00 -0.73 0.00 0.00 57.03 55.57 1u0k h ASP 25 Cb 1.12 0.00 -0.35 0.00 -0.83 0.00 0.00 39.33 39.26 1u0k h ASP 25 CO 0.79 0.02 -0.75 -0.62 -1.03 0.00 0.00 179.24 177.64 1u0k s ASP 26 N -6.04 2.20 -0.26 4.15 -1.08 -1.25 -4.56 116.67 109.83 1u0k s ASP 26 Ca 0.05 -1.66 0.08 0.00 -0.52 0.00 0.00 52.55 50.50 1u0k s ASP 26 Cb 0.07 0.08 0.62 0.00 -1.46 0.00 0.00 42.92 42.22 1u0k s ASP 26 CO 0.63 -0.32 1.59 0.00 0.52 0.00 0.00 175.17 177.59 1u0k n ALA 27 N 4.43 4.14 0.11 3.66 0.00 0.44 -4.63 120.51 128.68 1u0k n ALA 27 Ca 0.08 -1.84 0.18 0.00 0.00 0.00 0.00 53.44 51.85 1u0k n ALA 27 Cb 0.42 -1.20 0.74 0.00 0.00 0.00 0.00 19.45 19.40 1u0k n ALA 27 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1u0k h SER 28 N 2.31 0.00 -0.31 0.00 0.02 -1.95 -1.59 113.55 112.03 1u0k h SER 28 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1u0k h SER 28 Cb 2.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.54 1u0k h SER 28 CO 0.58 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.27 1u0k n ALA 29 N -2.49 2.51 -2.72 3.77 0.00 -1.26 -4.95 120.51 115.37 1u0k n ALA 29 Ca 0.05 -1.62 -0.37 0.00 0.00 0.00 0.00 53.44 51.51 1u0k n ALA 29 Cb 0.44 -0.55 -0.11 0.00 0.00 0.00 0.00 19.45 19.24 1u0k n ALA 29 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1u0k s LEU 30 N -1.74 3.93 0.87 0.00 1.43 -0.60 -5.10 118.68 117.48 1u0k s LEU 30 Ca 0.31 0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 53.30 1u0k s LEU 30 Cb 0.21 -2.06 0.11 0.00 0.03 0.00 0.00 46.19 44.48 1u0k s LEU 30 CO 0.13 0.02 1.11 1.51 0.23 0.00 0.00 176.35 179.35 1u0k s ASP 31 N 1.33 3.83 0.26 2.29 1.47 -1.26 -4.92 116.67 119.66 1u0k s ASP 31 Ca 0.07 1.17 -0.04 0.00 1.18 0.00 0.00 52.55 54.93 1u0k s ASP 31 Cb -0.15 -1.83 0.34 0.00 -0.34 0.00 0.00 42.92 40.94 1u0k s ASP 31 CO 0.06 -2.37 1.90 0.44 0.68 0.00 0.00 175.17 175.88 1u0k h ASP 32 N -1.37 1.10 -0.68 2.11 5.19 -1.98 -2.09 116.42 118.69 1u0k h ASP 32 Ca -0.49 -0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 55.88 1u0k h ASP 32 Cb 1.30 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 40.53 1u0k h ASP 32 CO 0.60 0.74 0.34 0.00 -3.12 0.00 0.00 179.24 177.81 1u0k h ALA 33 N 1.42 1.29 0.00 3.45 0.00 -2.05 -0.97 119.26 122.39 1u0k h ALA 33 Ca 0.40 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1u0k h ALA 33 Cb 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1u0k h ALA 33 CO -0.13 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.68 1u0k n ALA 34 N -2.44 2.02 0.00 0.00 0.00 -0.79 -0.87 120.51 118.44 1u0k n ALA 34 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1u0k n ALA 34 Cb 0.13 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1u0k n ALA 34 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1u0k n GLN 36 N 0.75 0.00 -0.16 0.00 -0.06 -0.37 -1.16 117.38 116.37 1u0k n GLN 36 Ca 0.00 0.00 -0.10 0.00 -2.00 0.00 0.00 57.00 54.90 1u0k n GLN 36 Cb 0.26 0.00 -0.00 0.00 -4.06 0.00 0.00 30.24 26.44 1u0k n GLN 36 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1u0k h ALA 37 N 0.00 0.64 -0.28 1.69 0.00 -1.25 -1.67 119.26 118.38 1u0k h ALA 37 Ca 0.00 -0.31 -0.13 0.00 0.00 0.00 0.00 54.91 54.47 1u0k h ALA 37 Cb 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1u0k h ALA 37 CO 0.00 0.49 -0.36 -1.49 0.00 0.00 0.00 179.25 177.88 1u0k h TRP 38 N 0.71 0.74 -0.53 0.00 4.06 -1.40 -0.99 115.95 118.53 1u0k h TRP 38 Ca 0.13 -0.20 0.05 0.00 2.06 0.00 0.00 58.89 60.92 1u0k h TRP 38 Cb 0.59 -0.16 -0.05 0.00 -1.00 0.00 0.00 29.16 28.54 1u0k h TRP 38 CO 0.04 0.90 0.27 1.15 -3.56 0.00 0.00 178.44 177.24 1u0k h THR 39 N 0.53 0.94 -0.16 1.49 2.02 -1.75 -1.21 112.91 114.77 1u0k h THR 39 Ca 0.05 -0.18 -0.12 0.00 0.77 0.00 0.00 66.41 66.93 1u0k h THR 39 Cb 0.87 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1u0k h THR 39 CO 0.07 0.09 -0.44 0.03 0.37 0.00 0.00 175.52 175.65 1u0k h ARG 40 N 0.51 0.39 -0.14 6.66 3.08 -0.99 -2.05 114.38 121.84 1u0k h ARG 40 Ca 0.24 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1u0k h ARG 40 Cb 0.16 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1u0k h ARG 40 CO -0.17 0.75 0.03 1.49 -1.07 0.00 0.00 179.97 181.01 1u0k h GLU 41 N 0.32 0.22 0.00 0.04 4.57 -0.75 -3.22 114.58 115.76 1u0k h GLU 41 Ca 0.02 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.12 1u0k h GLU 41 Cb 0.90 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.45 1u0k h GLU 41 CO 0.08 0.38 -0.15 -0.07 -1.18 0.00 0.00 179.01 178.07 1u0k h LEU 42 N 0.03 0.00 0.19 1.64 3.38 -1.14 -3.47 115.31 115.94 1u0k h LEU 42 Ca 0.04 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1u0k h LEU 42 Cb 0.26 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1u0k h LEU 42 CO 0.00 0.15 -0.07 0.54 0.09 0.00 0.00 178.44 179.14 1u0k n ARG 43 N -3.15 -1.51 -2.14 1.13 1.74 -0.78 -4.98 116.66 106.98 1u0k n ARG 43 Ca 0.03 0.57 -0.38 0.00 -0.77 0.00 0.00 57.85 57.30 1u0k n ARG 43 Cb 0.55 -4.78 0.00 0.00 -1.02 0.00 0.00 32.46 27.22 1u0k n ARG 43 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1u0k s GLN 44 N -2.04 3.66 0.26 5.56 -1.52 -1.26 -4.90 119.66 119.41 1u0k s GLN 44 Ca 0.00 1.91 -0.03 0.00 -1.95 0.00 0.00 55.36 55.30 1u0k s GLN 44 Cb 0.00 -2.42 0.41 0.00 -0.22 0.00 0.00 33.01 30.78 1u0k s GLN 44 CO 0.00 -0.68 1.85 0.35 -0.25 0.00 0.00 175.29 176.57 1u0k h PHE 45 N 2.01 1.07 -3.99 0.91 3.57 -1.94 -3.40 116.94 115.17 1u0k h PHE 45 Ca -0.50 0.03 -0.41 0.00 3.53 0.00 0.00 57.97 60.62 1u0k h PHE 45 Cb 1.26 -0.34 -0.23 0.00 2.79 0.00 0.00 35.95 39.42 1u0k h PHE 45 CO 0.52 0.51 -0.78 -1.21 -2.23 0.00 0.00 178.31 175.11 1u0k s GLU 46 N -6.03 0.84 0.16 1.11 2.02 -1.26 -3.88 118.70 111.66 1u0k s GLU 46 Ca -0.12 -0.83 0.11 0.00 0.02 0.00 0.00 54.97 54.15 1u0k s GLU 46 Cb 0.20 -0.83 -0.04 0.00 0.10 0.00 0.00 34.13 33.56 1u0k s GLU 46 CO 0.80 0.19 -0.25 -1.12 0.02 0.00 0.00 175.26 174.90 1u0k s SER 47 N -1.41 3.36 -0.00 -0.19 0.01 -0.56 -3.89 113.70 111.02 1u0k s SER 47 Ca -0.01 -0.81 0.05 0.00 1.31 0.00 0.00 55.95 56.50 1u0k s SER 47 Cb -0.09 -0.23 -0.01 0.00 0.21 0.00 0.00 66.02 65.89 1u0k s SER 47 CO 0.02 0.15 -0.17 -0.51 0.41 0.00 0.00 173.24 173.14 1u0k s ILE 48 N -1.36 1.31 -0.13 1.44 2.07 -0.58 -1.36 121.20 122.59 1u0k s ILE 48 Ca 0.17 -0.78 0.02 0.00 -1.41 0.00 0.00 60.65 58.65 1u0k s ILE 48 Cb -0.09 -1.10 0.01 0.00 0.13 0.00 0.00 42.46 41.41 1u0k s ILE 48 CO 0.08 0.31 -0.18 -0.36 -1.91 0.00 0.00 174.94 172.87 1u0k s PHE 49 N -0.48 2.31 -0.01 3.50 0.40 -0.08 -0.99 117.98 122.62 1u0k s PHE 49 Ca 0.06 -1.14 0.01 0.00 -0.60 0.00 0.00 56.93 55.25 1u0k s PHE 49 Cb -0.07 -1.62 -0.04 0.00 0.51 0.00 0.00 43.02 41.81 1u0k s PHE 49 CO -0.00 -0.55 0.02 -0.51 0.70 0.00 0.00 175.22 174.87 1u0k s LEU 50 N 0.94 3.61 -0.03 -0.37 1.43 -0.27 -1.35 118.68 122.65 1u0k s LEU 50 Ca -0.06 0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.10 1u0k s LEU 50 Cb -0.15 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.04 1u0k s LEU 50 CO -0.02 0.29 -0.06 -0.76 0.23 0.00 0.00 176.35 176.03 1u0k s LEU 51 N -1.51 1.57 0.34 1.79 1.02 0.12 -0.42 118.68 121.60 1u0k s LEU 51 Ca 0.19 -0.13 -0.28 0.00 0.02 0.00 0.00 54.13 53.94 1u0k s LEU 51 Cb -0.12 -0.43 -0.12 0.00 0.02 0.00 0.00 46.19 45.54 1u0k s LEU 51 CO 0.10 -0.00 1.25 -0.81 0.02 0.00 0.00 176.35 176.91 1u0k n PRO 52 N 3.64 2.02 0.00 1.29 -0.04 -1.26 -0.81 135.00 139.84 1u0k n PRO 52 Ca -0.21 0.71 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 1u0k n PRO 52 Cb 0.53 -2.28 0.00 0.00 -0.04 0.00 0.00 33.50 31.71 1u0k n PRO 52 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1u0k n GLY 53 N 0.82 1.31 1.99 0.55 0.00 0.43 -4.58 105.19 105.70 1u0k n GLY 53 Ca 0.05 -1.79 -0.11 0.00 0.00 0.00 0.00 46.02 44.17 1u0k n GLY 53 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1u0k n ASP 54 N 0.00 4.30 -3.65 1.61 8.00 -1.26 -4.87 116.55 120.68 1u0k n ASP 54 Ca 0.00 -3.23 -0.00 0.00 0.71 0.00 0.00 54.79 52.27 1u0k n ASP 54 Cb 0.00 -0.76 -0.06 0.00 -0.02 0.00 0.00 41.12 40.28 1u0k n ASP 54 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1u0k s ASP 55 N -0.94 -0.17 0.06 -2.24 -1.08 -1.26 -5.05 116.67 105.99 1u0k s ASP 55 Ca 0.51 0.28 0.14 0.00 -0.52 0.00 0.00 52.55 52.97 1u0k s ASP 55 Cb 0.41 0.89 0.62 0.00 -1.46 0.00 0.00 42.92 43.38 1u0k s ASP 55 CO 0.12 -0.05 1.45 -0.81 0.52 0.00 0.00 175.17 176.40 1u0k n PRO 56 N 2.90 0.04 -0.06 4.34 -0.04 -1.26 -2.12 135.00 138.81 1u0k n PRO 56 Ca -0.16 0.34 0.07 0.00 -0.04 0.00 0.00 63.50 63.70 1u0k n PRO 56 Cb 0.57 -1.59 0.09 0.00 -0.04 0.00 0.00 33.50 32.53 1u0k n PRO 56 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1u0k n ARG 57 N -1.67 1.40 -4.82 0.54 1.74 -1.26 -4.97 116.66 107.62 1u0k n ARG 57 Ca 0.03 -1.54 -0.33 0.00 -0.77 0.00 0.00 57.85 55.24 1u0k n ARG 57 Cb 0.15 -1.28 -0.15 0.00 -1.02 0.00 0.00 32.46 30.16 1u0k n ARG 57 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1u0k s ALA 58 N -1.11 2.53 0.05 7.54 0.00 -0.90 -1.30 121.76 128.57 1u0k s ALA 58 Ca 0.19 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 51.26 1u0k s ALA 58 Cb 0.12 -1.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.07 1u0k s ALA 58 CO 0.18 0.22 -0.10 -0.06 0.00 0.00 0.00 175.76 176.01 1u0k s PHE 59 N 0.40 0.82 0.06 0.00 0.40 -0.54 -0.43 117.98 118.69 1u0k s PHE 59 Ca -0.12 -0.47 -0.17 0.00 -0.60 0.00 0.00 56.93 55.58 1u0k s PHE 59 Cb -0.16 -0.48 -0.06 0.00 0.51 0.00 0.00 43.02 42.82 1u0k s PHE 59 CO 0.06 -0.04 0.50 1.03 0.70 0.00 0.00 175.22 177.47 1u0k s ARG 60 N -1.54 4.05 0.06 0.44 0.52 0.01 -0.54 118.95 121.95 1u0k s ARG 60 Ca -0.07 0.56 0.07 0.00 -0.52 0.00 0.00 55.73 55.77 1u0k s ARG 60 Cb -0.10 -3.17 -0.03 0.00 0.52 0.00 0.00 34.95 32.18 1u0k s ARG 60 CO 0.01 0.63 -0.18 0.00 0.02 0.00 0.00 175.30 175.78 1u0k s ALA 61 N -1.17 1.52 -0.09 2.13 0.00 -0.28 -0.70 121.76 123.16 1u0k s ALA 61 Ca 0.29 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 51.22 1u0k s ALA 61 Cb -0.18 -0.24 0.02 0.00 0.00 0.00 0.00 23.12 22.73 1u0k s ALA 61 CO 0.17 0.30 -0.10 1.03 0.00 0.00 0.00 175.76 177.17 1u0k s ARG 62 N -1.43 1.63 -0.14 0.00 1.81 -0.46 -4.60 118.95 115.76 1u0k s ARG 62 Ca 0.04 -0.33 -0.00 0.00 -1.72 0.00 0.00 55.73 53.72 1u0k s ARG 62 Cb -0.09 -1.53 -0.01 0.00 -0.45 0.00 0.00 34.95 32.87 1u0k s ARG 62 CO 0.02 -0.14 -0.14 0.42 -0.68 0.00 0.00 175.30 174.79 1u0k s ILE 63 N 1.25 2.95 -0.02 1.52 1.01 -1.26 -0.91 121.20 125.75 1u0k s ILE 63 Ca -0.03 -0.69 0.06 0.00 0.00 0.00 0.00 60.65 59.99 1u0k s ILE 63 Cb -0.14 -2.24 -0.02 0.00 0.01 0.00 0.00 42.46 40.07 1u0k s ILE 63 CO -0.03 0.52 -0.21 -0.36 0.00 0.00 0.00 174.94 174.86 1u0k s PHE 64 N 0.47 1.91 0.74 3.97 0.40 -0.47 -0.79 117.98 124.21 1u0k s PHE 64 Ca -0.10 -0.38 -0.00 0.00 -0.60 0.00 0.00 56.93 55.85 1u0k s PHE 64 Cb -0.16 -1.23 0.14 0.00 0.51 0.00 0.00 43.02 42.28 1u0k s PHE 64 CO 0.05 -0.04 1.01 0.95 0.70 0.00 0.00 175.22 177.89 1u0k s THR 65 N -0.46 2.04 0.00 0.64 -4.23 -0.27 -1.49 115.64 111.87 1u0k s THR 65 Ca 0.07 -0.62 0.32 0.00 -1.18 0.00 0.00 61.69 60.28 1u0k s THR 65 Cb -0.08 -2.42 0.35 0.00 1.34 0.00 0.00 72.50 71.69 1u0k s THR 65 CO -0.01 0.00 1.95 -0.07 -0.54 0.00 0.00 174.62 175.95 1u0k h LEU 66 N -0.57 0.00 0.08 4.79 4.07 -1.85 -3.24 115.31 118.59 1u0k h LEU 66 Ca -0.35 0.00 -0.34 0.00 0.08 0.00 0.00 57.88 57.27 1u0k h LEU 66 Cb 1.26 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.97 1u0k h LEU 66 CO 0.38 0.00 -1.92 -0.62 -1.08 0.00 0.00 178.44 175.20 1u0k n GLU 67 N -2.82 0.70 -3.62 1.13 4.71 -1.26 -4.91 120.64 114.57 1u0k n GLU 67 Ca 0.00 0.32 -0.07 0.00 -0.01 0.00 0.00 57.16 57.40 1u0k n GLU 67 Cb 0.24 -1.69 -0.02 0.00 -1.01 0.00 0.00 31.44 28.97 1u0k n GLU 67 CO 0.00 0.00 0.00 -1.83 0.09 0.00 0.00 177.13 175.39 1u0k s GLU 68 N -2.51 1.11 0.30 3.49 -1.05 -1.23 -5.15 118.70 113.67 1u0k s GLU 68 Ca -0.26 -0.52 -0.29 0.00 -0.15 0.00 0.00 54.97 53.75 1u0k s GLU 68 Cb 0.07 0.44 -0.10 0.00 -0.44 0.00 0.00 34.13 34.10 1u0k s GLU 68 CO 0.70 -0.50 1.26 -2.00 0.95 0.00 0.00 175.26 175.67 1u0k s GLU 69 N -3.34 4.43 -0.53 -4.83 2.12 -1.26 -1.11 118.70 114.17 1u0k s GLU 69 Ca 0.08 2.10 0.04 0.00 0.36 0.00 0.00 54.97 57.55 1u0k s GLU 69 Cb -0.02 -3.11 0.16 0.00 0.26 0.00 0.00 34.13 31.42 1u0k s GLU 69 CO -0.04 -0.10 0.37 -0.51 -0.54 0.00 0.00 175.26 174.45 1u0k s LEU 70 N -1.52 3.07 -1.59 2.70 1.43 0.03 -4.90 118.68 117.90 1u0k s LEU 70 Ca 0.49 -3.26 -0.10 0.00 -1.03 0.00 0.00 54.13 50.23 1u0k s LEU 70 Cb -0.38 -1.06 -0.08 0.00 0.03 0.00 0.00 46.19 44.71 1u0k s LEU 70 CO 0.48 -0.16 2.89 -0.81 0.23 0.00 0.00 176.35 178.98 1u0k n PRO 71 N 2.69 3.59 -4.07 1.29 -0.04 -1.26 -4.58 135.00 132.62 1u0k n PRO 71 Ca 0.20 -2.20 -0.13 0.00 -0.04 0.00 0.00 63.50 61.33 1u0k n PRO 71 Cb 0.39 -2.82 -0.12 0.00 -0.04 0.00 0.00 33.50 30.91 1u0k n PRO 71 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1u0k s PHE 72 N 2.29 0.56 0.12 0.54 0.40 -1.26 -4.79 117.98 115.83 1u0k s PHE 72 Ca 0.67 -0.39 -0.31 0.00 -0.60 0.00 0.00 56.93 56.30 1u0k s PHE 72 Cb 0.17 -0.34 -0.10 0.00 0.51 0.00 0.00 43.02 43.26 1u0k s PHE 72 CO -0.06 -0.08 1.86 0.00 0.70 0.00 0.00 175.22 177.65 1u0k s ALA 73 N -1.06 3.75 0.00 5.36 0.00 -1.26 -4.91 121.76 123.63 1u0k s ALA 73 Ca -0.08 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1u0k s ALA 73 Cb -0.08 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.26 1u0k s ALA 73 CO 0.00 -1.28 0.00 0.41 0.00 0.00 0.00 175.76 174.89 1u0k n GLY 74 N 4.30 1.71 0.38 0.00 0.00 -1.26 -3.79 105.19 106.52 1u0k n GLY 74 Ca 0.18 -0.95 0.18 0.00 0.00 0.00 0.00 46.02 45.42 1u0k n GLY 74 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1u0k h HIS 75 N 0.95 0.81 -0.06 1.61 2.07 -1.87 -1.72 115.15 116.94 1u0k h HIS 75 Ca 0.00 0.03 0.02 0.00 -2.85 0.00 0.00 60.37 57.56 1u0k h HIS 75 Cb 0.00 -0.24 -0.00 0.00 2.57 0.00 0.00 27.41 29.73 1u0k h HIS 75 CO 0.00 0.15 0.05 -1.35 -3.07 0.00 0.00 177.93 173.71 1u0k h PRO 76 N 0.56 0.00 -0.41 5.12 0.11 -1.96 -1.85 132.00 133.56 1u0k h PRO 76 Ca 0.56 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.58 1u0k h PRO 76 Cb 1.16 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1u0k h PRO 76 CO -0.31 0.00 -0.11 -0.07 -0.21 0.00 0.00 178.00 177.30 1u0k h LEU 77 N 0.00 0.72 -0.55 2.35 3.38 -1.69 -0.64 115.31 118.88 1u0k h LEU 77 Ca 0.03 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 1u0k h LEU 77 Cb 0.12 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1u0k h LEU 77 CO -0.00 0.86 0.19 -0.07 0.09 0.00 0.00 178.44 179.51 1u0k h LEU 78 N 0.66 0.78 -0.62 1.67 3.38 -1.46 -1.07 115.31 118.65 1u0k h LEU 78 Ca 0.11 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 1u0k h LEU 78 Cb 0.58 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1u0k h LEU 78 CO 0.04 0.76 0.18 1.23 0.09 0.00 0.00 178.44 180.74 1u0k h GLY 79 N 0.75 1.05 0.99 0.83 0.00 -1.31 -2.06 103.07 103.32 1u0k h GLY 79 Ca 0.18 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 1u0k h GLY 79 CO -0.01 0.59 0.32 0.00 0.00 0.00 0.00 176.54 177.44 1u0k h ALA 80 N 1.06 0.77 -0.48 3.60 0.00 -0.89 -1.17 119.26 122.15 1u0k h ALA 80 Ca 0.20 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1u0k h ALA 80 Cb 0.31 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1u0k h ALA 80 CO -0.00 0.31 0.24 0.00 0.00 0.00 0.00 179.25 179.79 1u0k h ALA 81 N 1.14 0.62 -0.57 0.00 0.00 -1.04 0.81 119.26 120.22 1u0k h ALA 81 Ca 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1u0k h ALA 81 Cb 0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1u0k h ALA 81 CO -0.03 0.17 0.36 0.00 0.00 0.00 0.00 179.25 179.75 1u0k h ALA 82 N 1.08 0.73 -0.61 0.00 0.00 -1.17 -1.38 119.26 117.90 1u0k h ALA 82 Ca 0.17 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1u0k h ALA 82 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1u0k h ALA 82 CO -0.02 0.19 0.05 1.25 0.00 0.00 0.00 179.25 180.71 1u0k h LEU 83 N 0.77 1.02 -1.14 0.00 5.85 -0.80 -0.88 115.31 120.14 1u0k h LEU 83 Ca 0.21 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 1u0k h LEU 83 Cb -0.05 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.67 1u0k h LEU 83 CO -0.04 1.05 0.47 -0.07 -0.34 0.00 0.00 178.44 179.51 1u0k h LEU 84 N 0.95 0.94 -0.32 2.25 3.38 -0.56 -0.68 115.31 121.27 1u0k h LEU 84 Ca 0.18 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1u0k h LEU 84 Cb 0.50 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1u0k h LEU 84 CO 0.02 0.72 0.07 -0.74 0.09 0.00 0.00 178.44 178.61 1u0k h HIS 85 N 1.08 0.53 -0.57 1.13 2.76 -0.93 -0.40 115.15 118.75 1u0k h HIS 85 Ca 0.28 -0.06 0.10 0.00 -2.20 0.00 0.00 60.37 58.49 1u0k h HIS 85 Cb -0.05 -0.15 -0.08 0.00 1.55 0.00 0.00 27.41 28.69 1u0k h HIS 85 CO 0.00 0.56 0.14 1.25 -1.30 0.00 0.00 177.93 178.59 1u0k h HIS 86 N 0.35 0.23 0.03 5.26 -0.00 -0.65 -1.30 115.15 119.07 1u0k h HIS 86 Ca 0.10 0.03 -0.25 0.00 -0.00 0.00 0.00 60.37 60.25 1u0k h HIS 86 Cb 0.30 -0.01 0.01 0.00 -0.00 0.00 0.00 27.41 27.71 1u0k h HIS 86 CO 0.02 -0.00 -1.03 -0.07 -0.00 0.00 0.00 177.93 176.84 1u0k h LEU 87 N 0.28 0.64 0.11 0.26 3.38 -0.84 -3.33 115.31 115.81 1u0k h LEU 87 Ca 0.30 -0.54 -0.28 0.00 0.09 0.00 0.00 57.88 57.45 1u0k h LEU 87 Cb 0.42 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1u0k h LEU 87 CO -0.36 1.35 -1.34 -0.09 0.09 0.00 0.00 178.44 178.08 1u0k h ARG 88 N 0.25 0.23 0.00 1.13 2.43 -0.98 -3.51 114.38 113.93 1u0k h ARG 88 Ca -0.11 -0.39 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1u0k h ARG 88 Cb 1.69 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 31.38 1u0k h ARG 88 CO 0.19 1.14 0.00 0.41 -1.51 0.00 0.00 179.97 180.19 1u0k n GLY 89 N 1.56 -2.51 0.00 2.80 0.00 -0.50 -5.09 105.19 101.45 1u0k n GLY 89 Ca -0.11 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1u0k n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u0k n GLY 90 N -0.84 3.91 0.13 -0.02 0.00 -1.26 -4.91 105.19 102.20 1u0k n GLY 90 Ca 0.00 -1.53 -0.25 0.00 0.00 0.00 0.00 46.02 44.24 1u0k n GLY 90 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1u0k n ASP 91 N 0.00 1.94 -2.61 1.61 8.00 -1.26 -4.92 116.55 119.32 1u0k n ASP 91 Ca 0.00 0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.84 1u0k n ASP 91 Cb 0.00 -0.80 0.00 0.00 -0.02 0.00 0.00 41.12 40.30 1u0k n ASP 91 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1u0k n ASN 92 N -4.29 0.00 -4.73 -2.24 4.05 -1.26 -4.70 115.26 102.09 1u0k n ASN 92 Ca -0.45 0.00 -0.42 0.00 0.45 0.00 0.00 54.58 54.17 1u0k n ASN 92 Cb 0.80 0.00 -0.03 0.00 1.23 0.00 0.00 39.78 41.78 1u0k n ASN 92 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 177.26 173.51 1u0k s GLU 93 N 0.47 4.34 -0.05 1.20 2.12 -1.26 -4.61 118.70 120.91 1u0k s GLU 93 Ca 0.00 2.09 -0.02 0.00 0.36 0.00 0.00 54.97 57.40 1u0k s GLU 93 Cb 0.00 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 31.14 1u0k s GLU 93 CO 0.00 -0.38 0.07 -0.65 -0.54 0.00 0.00 175.26 173.77 1u0k s GLN 94 N 0.55 3.13 -0.02 4.30 -1.52 -0.05 -4.95 119.66 121.11 1u0k s GLN 94 Ca 0.61 -0.39 0.03 0.00 -1.95 0.00 0.00 55.36 53.67 1u0k s GLN 94 Cb -0.37 -2.91 -0.03 0.00 -0.22 0.00 0.00 33.01 29.47 1u0k s GLN 94 CO 0.34 0.69 -0.09 -1.01 -0.25 0.00 0.00 175.29 174.97 1u0k s HIS 95 N -1.08 2.84 0.03 0.91 3.76 -1.26 -1.16 115.29 119.32 1u0k s HIS 95 Ca 0.19 -0.07 0.01 0.00 -0.15 0.00 0.00 55.06 55.04 1u0k s HIS 95 Cb -0.12 -1.62 -0.02 0.00 1.11 0.00 0.00 32.58 31.93 1u0k s HIS 95 CO 0.09 0.32 -0.04 -1.58 -0.85 0.00 0.00 174.74 172.68 1u0k s TRP 96 N -0.91 0.43 -0.19 1.40 0.52 -0.31 -4.88 118.94 115.01 1u0k s TRP 96 Ca 0.15 -0.61 0.01 0.00 0.02 0.00 0.00 56.10 55.67 1u0k s TRP 96 Cb -0.11 -0.28 0.02 0.00 -1.15 0.00 0.00 33.47 31.95 1u0k s TRP 96 CO 0.05 -0.19 -0.19 0.99 0.02 0.00 0.00 176.95 177.63 1u0k s THR 97 N -1.86 2.09 -0.20 2.01 2.01 -0.42 -0.96 115.64 118.31 1u0k s THR 97 Ca -0.10 -0.98 -0.03 0.00 0.31 0.00 0.00 61.69 60.89 1u0k s THR 97 Cb -0.07 -1.90 -0.01 0.00 0.01 0.00 0.00 72.50 70.53 1u0k s THR 97 CO -0.02 0.50 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.59 1u0k s LEU 98 N 1.28 2.84 -0.23 4.42 1.43 -0.32 -1.47 118.68 126.64 1u0k s LEU 98 Ca 0.04 -0.38 -0.14 0.00 -1.03 0.00 0.00 54.13 52.62 1u0k s LEU 98 Cb -0.13 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 1u0k s LEU 98 CO -0.12 0.02 0.34 -1.00 0.23 0.00 0.00 176.35 175.82 1u0k s HIS 99 N 1.22 3.33 -0.40 0.29 3.76 0.30 -1.05 115.29 122.74 1u0k s HIS 99 Ca 0.02 0.48 0.02 0.00 -0.15 0.00 0.00 55.06 55.43 1u0k s HIS 99 Cb -0.14 -2.48 0.11 0.00 1.11 0.00 0.00 32.58 31.18 1u0k s HIS 99 CO -0.02 -0.05 0.14 -0.51 -0.85 0.00 0.00 174.74 173.45 1u0k s LEU 100 N 1.44 4.85 0.00 0.89 1.43 -0.25 -1.13 118.68 125.91 1u0k s LEU 100 Ca 0.16 -2.29 0.00 0.00 -1.03 0.00 0.00 54.13 50.97 1u0k s LEU 100 Cb -0.15 -1.69 0.00 0.00 0.03 0.00 0.00 46.19 44.38 1u0k s LEU 100 CO 0.08 -0.40 0.00 0.00 0.23 0.00 0.00 176.35 176.26 1u0k n ALA 101 N 4.13 0.00 1.04 4.21 0.00 -1.26 -1.47 120.51 127.17 1u0k n ALA 101 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.59 1u0k n ALA 101 Cb 0.40 0.00 0.58 0.00 0.00 0.00 0.00 19.45 20.43 1u0k n ALA 101 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1u0k n SER 102 N 4.54 0.00 -4.73 0.00 3.41 -1.26 -4.79 113.62 110.79 1u0k n SER 102 Ca 0.00 0.15 -0.38 0.00 -0.26 0.00 0.00 58.87 58.38 1u0k n SER 102 Cb 0.00 -0.37 -0.06 0.00 -0.26 0.00 0.00 64.21 63.52 1u0k n SER 102 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1u0k s LYS 103 N -2.74 4.32 -0.42 4.33 1.02 -0.54 -5.04 119.74 120.67 1u0k s LYS 103 Ca 0.19 0.53 -0.08 0.00 0.02 0.00 0.00 55.97 56.62 1u0k s LYS 103 Cb 0.16 -3.41 0.09 0.00 -0.52 0.00 0.00 37.83 34.15 1u0k s LYS 103 CO 0.40 0.20 0.26 0.45 -0.92 0.00 0.00 175.35 175.74 1u0k s SER 104 N 0.45 5.58 -0.23 2.83 0.15 -1.26 -1.09 113.70 120.13 1u0k s SER 104 Ca 0.28 -1.61 -0.14 0.00 0.70 0.00 0.00 55.95 55.17 1u0k s SER 104 Cb -0.16 -1.96 -0.04 0.00 -1.71 0.00 0.00 66.02 62.15 1u0k s SER 104 CO 0.12 -0.55 0.34 -0.69 1.20 0.00 0.00 173.24 173.66 1u0k s VAL 105 N 1.38 5.23 -0.17 4.45 1.01 -0.22 -4.91 120.40 127.17 1u0k s VAL 105 Ca 0.04 0.55 -0.25 0.00 0.00 0.00 0.00 61.98 62.31 1u0k s VAL 105 Cb -0.23 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1u0k s VAL 105 CO 0.01 0.25 0.83 0.00 0.00 0.00 0.00 175.10 176.18 1u0k s ALA 106 N 1.44 3.52 0.10 5.51 0.00 -1.26 -1.17 121.76 129.90 1u0k s ALA 106 Ca 0.15 0.03 0.10 0.00 0.00 0.00 0.00 51.96 52.24 1u0k s ALA 106 Cb -0.15 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1u0k s ALA 106 CO 0.08 -0.65 -0.25 -0.51 0.00 0.00 0.00 175.76 174.42 1u0k s LEU 107 N 2.15 2.26 -0.00 0.00 1.02 -0.14 -1.81 118.68 122.16 1u0k s LEU 107 Ca 0.38 -0.68 0.05 0.00 0.02 0.00 0.00 54.13 53.90 1u0k s LEU 107 Cb -0.17 -1.17 -0.01 0.00 0.02 0.00 0.00 46.19 44.86 1u0k s LEU 107 CO 0.12 0.18 -0.15 -0.13 0.02 0.00 0.00 176.35 176.39 1u0k s ARG 108 N -1.75 1.19 0.04 1.70 0.52 -0.52 -1.16 118.95 118.98 1u0k s ARG 108 Ca 0.12 -0.60 0.03 0.00 -0.52 0.00 0.00 55.73 54.76 1u0k s ARG 108 Cb -0.10 -1.17 -0.02 0.00 0.52 0.00 0.00 34.95 34.18 1u0k s ARG 108 CO 0.04 0.32 -0.09 -1.54 0.02 0.00 0.00 175.30 174.05 1u0k s SER 109 N -0.52 1.00 0.02 0.23 1.04 -0.31 -1.19 113.70 113.97 1u0k s SER 109 Ca 0.05 -0.54 0.01 0.00 0.48 0.00 0.00 55.95 55.96 1u0k s SER 109 Cb -0.06 0.01 -0.02 0.00 0.10 0.00 0.00 66.02 66.05 1u0k s SER 109 CO -0.00 -0.17 -0.05 0.68 0.98 0.00 0.00 173.24 174.68 1u0k s VAL 110 N -1.29 0.32 0.42 5.02 -7.23 0.05 -0.87 120.40 116.82 1u0k s VAL 110 Ca -0.08 -0.82 -0.26 0.00 -1.81 0.00 0.00 61.98 59.02 1u0k s VAL 110 Cb -0.10 -0.40 -0.08 0.00 0.56 0.00 0.00 36.38 36.36 1u0k s VAL 110 CO 0.01 -0.33 1.35 -0.13 -0.31 0.00 0.00 175.10 175.69 1u0k s ARG 111 N -1.22 3.85 0.40 4.82 0.52 -1.26 -0.71 118.95 125.35 1u0k s ARG 111 Ca -0.10 2.26 0.06 0.00 -0.52 0.00 0.00 55.73 57.43 1u0k s ARG 111 Cb -0.08 -2.71 -0.07 0.00 0.52 0.00 0.00 34.95 32.61 1u0k s ARG 111 CO -0.00 -0.63 0.02 0.00 0.02 0.00 0.00 175.30 174.71 1u0k s ALA 112 N -1.24 3.08 0.25 2.13 0.00 -0.24 -4.70 121.76 121.04 1u0k s ALA 112 Ca 0.59 -2.08 -0.04 0.00 0.00 0.00 0.00 51.96 50.43 1u0k s ALA 112 Cb -0.40 0.27 0.37 0.00 0.00 0.00 0.00 23.12 23.36 1u0k s ALA 112 CO 0.52 -0.15 1.87 0.78 0.00 0.00 0.00 175.76 178.77 1u0k h GLY 113 N 1.80 1.42 -7.13 0.00 0.00 -1.97 -3.35 103.07 93.84 1u0k h GLY 113 Ca -0.43 -0.43 -0.67 0.00 0.00 0.00 0.00 47.33 45.80 1u0k h GLY 113 CO 0.78 0.30 -0.81 -0.45 0.00 0.00 0.00 176.54 176.35 1u0k s SER 114 N -5.83 3.98 1.05 0.19 0.15 -1.26 -5.05 113.70 106.92 1u0k s SER 114 Ca -0.13 -1.07 0.00 0.00 0.70 0.00 0.00 55.95 55.46 1u0k s SER 114 Cb 0.19 -1.54 0.00 0.00 -1.71 0.00 0.00 66.02 62.96 1u0k s SER 114 CO 0.80 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.74 1u0k n GLY 115 N 4.53 1.85 3.17 9.45 0.00 -1.26 -4.83 105.19 118.11 1u0k n GLY 115 Ca -0.17 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.24 1u0k n GLY 115 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1u0k s PHE 116 N 0.00 0.92 -0.07 1.61 0.40 -0.36 -1.08 117.98 119.39 1u0k s PHE 116 Ca 0.00 -1.13 0.03 0.00 -0.60 0.00 0.00 56.93 55.23 1u0k s PHE 116 Cb 0.00 -0.53 -0.02 0.00 0.51 0.00 0.00 43.02 42.98 1u0k s PHE 116 CO 0.00 -0.39 -0.15 -0.47 0.70 0.00 0.00 175.22 174.92 1u0k s TYR 117 N -3.89 2.71 0.03 0.36 5.04 0.11 -0.68 117.35 121.02 1u0k s TYR 117 Ca 0.21 -0.35 0.01 0.00 -2.44 0.00 0.00 57.07 54.50 1u0k s TYR 117 Cb 0.07 -1.69 -0.02 0.00 0.35 0.00 0.00 41.96 40.67 1u0k s TYR 117 CO 0.00 0.03 -0.05 0.00 -1.34 0.00 0.00 175.55 174.19 1u0k s ALA 118 N -0.36 0.35 0.00 3.97 0.00 -0.58 -0.77 121.76 124.38 1u0k s ALA 118 Ca 0.03 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.41 1u0k s ALA 118 Cb -0.12 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.06 1u0k s ALA 118 CO 0.02 -0.05 0.00 -0.85 0.00 0.00 0.00 175.76 174.88 1u0k n GLU 119 N 1.80 0.00 -3.65 0.00 0.28 -0.33 -1.14 120.64 117.59 1u0k n GLU 119 Ca -0.21 0.00 -0.27 0.00 -0.16 0.00 0.00 57.16 56.52 1u0k n GLU 119 Cb 0.56 0.00 -0.17 0.00 1.43 0.00 0.00 31.44 33.26 1u0k n GLU 119 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1u0k s ASP 121 N -0.57 2.70 0.00 -1.84 -1.08 -0.75 -1.44 116.67 113.69 1u0k s ASP 121 Ca 0.00 -0.78 0.27 0.00 -0.52 0.00 0.00 52.55 51.52 1u0k s ASP 121 Cb 0.00 -0.39 1.21 0.00 -1.46 0.00 0.00 42.92 42.28 1u0k s ASP 121 CO 0.00 -0.35 1.83 0.00 0.52 0.00 0.00 175.17 177.17 1u0k n GLN 122 N 5.18 1.44 0.00 4.34 6.02 0.06 -4.40 117.38 130.04 1u0k n GLN 122 Ca -0.07 -0.65 0.00 0.00 -0.01 0.00 0.00 57.00 56.26 1u0k n GLN 122 Cb 0.48 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.29 1u0k n GLN 122 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1u0k n GLY 123 N 1.08 -1.46 3.74 1.08 0.00 -1.25 -4.83 105.19 103.55 1u0k n GLY 123 Ca 0.19 -1.29 -0.40 0.00 0.00 0.00 0.00 46.02 44.51 1u0k n GLY 123 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u0k s ARG 124 N 0.00 4.57 0.43 1.61 0.52 -1.26 -0.72 118.95 124.09 1u0k s ARG 124 Ca 0.00 1.21 -0.24 0.00 -0.52 0.00 0.00 55.73 56.18 1u0k s ARG 124 Cb 0.00 -3.38 -0.08 0.00 0.52 0.00 0.00 34.95 32.01 1u0k s ARG 124 CO 0.00 0.22 1.16 0.00 0.02 0.00 0.00 175.30 176.70 1u0k s ALA 125 N 0.08 3.05 -0.18 2.13 0.00 -1.26 -4.80 121.76 120.78 1u0k s ALA 125 Ca 0.42 0.93 -0.02 0.00 0.00 0.00 0.00 51.96 53.29 1u0k s ALA 125 Cb -0.21 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 1u0k s ALA 125 CO 0.25 -0.57 -0.08 -1.21 0.00 0.00 0.00 175.76 174.15 1u0k s GLU 126 N -2.53 3.37 0.04 0.00 2.02 0.29 -4.97 118.70 116.93 1u0k s GLU 126 Ca 0.61 -0.65 -0.08 0.00 0.02 0.00 0.00 54.97 54.86 1u0k s GLU 126 Cb -0.29 -2.84 -0.05 0.00 0.10 0.00 0.00 34.13 31.05 1u0k s GLU 126 CO 0.36 -0.03 0.33 -0.06 0.02 0.00 0.00 175.26 175.88 1u0k s PHE 127 N 1.01 3.59 0.00 1.61 0.40 -1.26 -1.15 117.98 122.17 1u0k s PHE 127 Ca -0.01 0.68 0.00 0.00 -0.60 0.00 0.00 56.93 57.00 1u0k s PHE 127 Cb -0.15 -2.07 0.00 0.00 0.51 0.00 0.00 43.02 41.31 1u0k s PHE 127 CO -0.01 0.57 0.00 0.41 0.70 0.00 0.00 175.22 176.90 1u0k n GLY 128 N 1.05 4.85 3.65 4.36 0.00 0.28 -5.00 105.19 114.39 1u0k n GLY 128 Ca -0.10 -0.82 -0.36 0.00 0.00 0.00 0.00 46.02 44.74 1u0k n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u0k n ALA 129 N -3.00 0.07 -3.79 4.61 0.00 -1.26 -4.54 120.51 112.60 1u0k n ALA 129 Ca 0.00 -0.17 -0.29 0.00 0.00 0.00 0.00 53.44 52.98 1u0k n ALA 129 Cb 0.00 -2.18 -0.13 0.00 0.00 0.00 0.00 19.45 17.15 1u0k n ALA 129 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1u0k s THR 130 N -1.78 2.01 0.57 0.00 2.01 -1.26 -1.78 115.64 115.41 1u0k s THR 130 Ca 0.75 -3.28 -0.20 0.00 0.31 0.00 0.00 61.69 59.27 1u0k s THR 130 Cb -0.34 -2.37 -0.05 0.00 0.01 0.00 0.00 72.50 69.75 1u0k s THR 130 CO 0.48 -0.95 1.19 -0.81 -0.69 0.00 0.00 174.62 173.85 1u0k n PRO 131 N 2.88 1.31 -1.64 4.92 -0.04 -1.26 -4.99 135.00 136.18 1u0k n PRO 131 Ca 0.14 0.49 -0.29 0.00 -0.04 0.00 0.00 63.50 63.80 1u0k n PRO 131 Cb 0.36 -2.39 0.16 0.00 -0.04 0.00 0.00 33.50 31.59 1u0k n PRO 131 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1u0k s ASP 132 N -1.07 3.09 0.23 3.54 1.47 -1.26 -4.73 116.67 117.93 1u0k s ASP 132 Ca 0.74 0.66 -0.08 0.00 1.18 0.00 0.00 52.55 55.05 1u0k s ASP 132 Cb -0.43 -1.00 0.20 0.00 -0.34 0.00 0.00 42.92 41.35 1u0k s ASP 132 CO 0.48 -2.78 1.87 0.00 0.68 0.00 0.00 175.17 175.42 1u0k h ALA 133 N -1.66 1.11 -0.65 2.11 0.00 -1.99 -0.66 119.26 117.53 1u0k h ALA 133 Ca -0.47 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 1u0k h ALA 133 Cb 1.29 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1u0k h ALA 133 CO 0.50 0.58 0.37 0.78 0.00 0.00 0.00 179.25 181.48 1u0k h GLY 134 N 1.20 0.96 1.04 0.00 0.00 -1.99 -1.47 103.07 102.81 1u0k h GLY 134 Ca 0.31 -0.42 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 1u0k h GLY 134 CO -0.06 0.41 -0.21 -0.84 0.00 0.00 0.00 176.54 175.84 1u0k h THR 135 N 0.88 1.28 -0.66 4.70 2.02 -1.74 -1.76 112.91 117.63 1u0k h THR 135 Ca 0.23 -1.36 0.00 0.00 0.77 0.00 0.00 66.41 66.05 1u0k h THR 135 Cb 0.02 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 1u0k h THR 135 CO -0.04 0.46 0.42 0.00 0.37 0.00 0.00 175.52 176.73 1u0k h ARG 137 N 0.89 1.02 -0.80 0.00 3.08 -1.18 -1.47 114.38 115.93 1u0k h ARG 137 Ca 0.24 -0.13 0.01 0.00 0.07 0.00 0.00 59.98 60.17 1u0k h ARG 137 Cb -0.08 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 29.74 1u0k h ARG 137 CO -0.05 0.78 0.52 2.35 -1.07 0.00 0.00 179.97 182.50 1u0k h TRP 138 N 0.99 0.99 -0.40 3.04 7.01 -0.86 -0.84 115.95 125.88 1u0k h TRP 138 Ca 0.25 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.19 1u0k h TRP 138 Cb 0.07 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 26.79 1u0k h TRP 138 CO 0.00 0.61 -0.09 0.74 -2.79 0.00 0.00 178.44 176.91 1u0k h PHE 139 N 1.06 0.85 -0.40 2.65 -1.00 -0.95 -0.24 116.94 118.91 1u0k h PHE 139 Ca 0.30 -0.18 0.06 0.00 2.81 0.00 0.00 57.97 60.96 1u0k h PHE 139 Cb -0.09 -0.21 -0.05 0.00 3.61 0.00 0.00 35.95 39.21 1u0k h PHE 139 CO -0.02 0.89 0.09 0.00 -1.61 0.00 0.00 178.31 177.65 1u0k h ALA 140 N 0.84 0.44 -0.05 2.45 0.00 -1.04 -2.30 119.26 119.59 1u0k h ALA 140 Ca 0.10 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1u0k h ALA 140 Cb 0.61 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1u0k h ALA 140 CO 0.04 -0.31 -0.22 0.93 0.00 0.00 0.00 179.25 179.68 1u0k h GLU 141 N 0.22 0.09 0.00 0.00 5.08 -0.93 -0.57 114.58 118.47 1u0k h GLU 141 Ca 0.19 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1u0k h GLU 141 Cb 0.22 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1u0k h GLU 141 CO -0.24 0.31 0.00 0.00 -1.00 0.00 0.00 179.01 178.08 1u0k h ALA 142 N 1.69 1.00 -0.37 3.43 0.00 -0.47 -1.61 119.26 122.94 1u0k h ALA 142 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1u0k h ALA 142 Cb 0.44 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1u0k h ALA 142 CO 0.03 0.00 0.03 1.19 0.00 0.00 0.00 179.25 180.50 1u0k n PHE 143 N -2.50 1.24 -1.71 0.00 3.01 -0.40 -0.84 117.46 116.26 1u0k n PHE 143 Ca 0.00 -1.19 -0.14 0.00 1.01 0.00 0.00 57.45 57.13 1u0k n PHE 143 Cb 0.19 -0.44 -0.04 0.00 -0.01 0.00 0.00 39.48 39.17 1u0k n PHE 143 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1u0k n SER 144 N -0.70 -4.61 -4.73 4.37 7.64 -0.60 -1.19 113.62 113.79 1u0k n SER 144 Ca 0.29 0.23 -0.22 0.00 1.01 0.00 0.00 58.87 60.17 1u0k n SER 144 Cb 1.03 -3.50 -0.06 0.00 -1.01 0.00 0.00 64.21 60.67 1u0k n SER 144 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1u0k s LEU 145 N -3.55 3.43 0.39 -3.43 1.43 -0.36 -4.88 118.68 111.72 1u0k s LEU 145 Ca 0.00 -0.53 0.08 0.00 -1.03 0.00 0.00 54.13 52.64 1u0k s LEU 145 Cb 0.00 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.25 1u0k s LEU 145 CO 0.00 -0.10 0.45 -0.94 0.23 0.00 0.00 176.35 176.00 1u0k s SER 146 N -3.79 5.48 0.39 2.29 1.04 -1.26 -2.82 113.70 115.03 1u0k s SER 146 Ca 0.34 -0.49 0.09 0.00 0.48 0.00 0.00 55.95 56.37 1u0k s SER 146 Cb -0.06 -0.78 0.86 0.00 0.10 0.00 0.00 66.02 66.14 1u0k s SER 146 CO 0.23 -0.61 1.98 0.00 0.98 0.00 0.00 173.24 175.81 1u0k h ALA 147 N 0.89 1.82 0.00 5.32 0.00 -1.96 -1.26 119.26 124.08 1u0k h ALA 147 Ca -0.42 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1u0k h ALA 147 Cb 1.27 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1u0k h ALA 147 CO 0.52 0.07 -0.04 -0.97 0.00 0.00 0.00 179.25 178.83 1u0k h ASN 148 N 0.60 0.00 1.59 0.00 -0.73 -2.00 -2.51 115.58 112.53 1u0k h ASN 148 Ca 0.28 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.45 1u0k h ASN 148 Cb 0.33 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.92 1u0k h ASN 148 CO -0.09 0.04 0.00 0.44 -0.37 0.00 0.00 177.43 177.45 1u0k h ASP 149 N 0.00 0.00 -3.46 1.15 3.32 -1.61 -3.44 116.42 112.38 1u0k h ASP 149 Ca -0.00 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.52 1u0k h ASP 149 Cb 0.36 0.00 0.06 0.00 0.22 0.00 0.00 39.33 39.97 1u0k h ASP 149 CO 0.01 0.00 0.74 -0.76 -1.72 0.00 0.00 179.24 177.50 1u0k s LEU 150 N -5.40 4.39 0.00 1.55 1.43 -0.95 -1.73 118.68 117.98 1u0k s LEU 150 Ca 0.08 2.66 0.28 0.00 -1.03 0.00 0.00 54.13 56.12 1u0k s LEU 150 Cb 0.09 -3.63 1.16 0.00 0.03 0.00 0.00 46.19 43.84 1u0k s LEU 150 CO 0.61 -0.67 1.85 -1.54 0.23 0.00 0.00 176.35 176.83 1u0k n SER 151 N 2.11 0.16 0.00 2.29 3.41 -0.71 -4.79 113.62 116.10 1u0k n SER 151 Ca 0.06 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1u0k n SER 151 Cb 0.41 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 1u0k n SER 151 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u0k n GLY 152 N 1.43 2.59 3.71 5.00 0.00 -1.26 -5.02 105.19 111.64 1u0k n GLY 152 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1u0k n GLY 152 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1u0k s HIS 153 N -2.68 3.50 0.11 1.61 3.76 -1.26 -4.95 115.29 115.38 1u0k s HIS 153 Ca 0.00 1.42 -0.31 0.00 -0.15 0.00 0.00 55.06 56.02 1u0k s HIS 153 Cb 0.00 -3.34 -0.09 0.00 1.11 0.00 0.00 32.58 30.26 1u0k s HIS 153 CO 0.00 -0.94 1.61 -1.25 -0.85 0.00 0.00 174.74 173.31 1u0k s PRO 154 N 0.91 4.21 0.41 8.40 0.04 -1.26 -4.48 135.00 143.23 1u0k s PRO 154 Ca 0.56 2.33 -0.27 0.00 0.04 0.00 0.00 61.00 63.67 1u0k s PRO 154 Cb -0.28 -3.42 -0.10 0.00 0.04 0.00 0.00 34.50 30.74 1u0k s PRO 154 CO 0.29 -0.67 1.44 -2.30 0.04 0.00 0.00 177.00 175.80 1u0k n PRO 155 N 4.93 2.44 -3.88 0.56 -0.02 -1.26 -4.86 135.00 132.91 1u0k n PRO 155 Ca 0.15 0.86 -0.11 0.00 -2.02 0.00 0.00 63.50 62.38 1u0k n PRO 155 Cb 0.40 -2.62 -0.10 0.00 -0.02 0.00 0.00 33.50 31.16 1u0k n PRO 155 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1u0k s ARG 156 N -2.23 0.43 -0.10 -0.52 1.81 -1.06 -4.20 118.95 113.08 1u0k s ARG 156 Ca 0.57 -0.36 -0.25 0.00 -1.72 0.00 0.00 55.73 53.97 1u0k s ARG 156 Cb -0.47 0.18 -0.03 0.00 -0.45 0.00 0.00 34.95 34.18 1u0k s ARG 156 CO 0.61 -0.10 0.79 0.08 -0.68 0.00 0.00 175.30 176.00 1u0k s VAL 157 N -1.24 4.96 0.01 3.52 1.01 -0.73 -0.76 120.40 127.17 1u0k s VAL 157 Ca -0.13 1.60 0.00 0.00 0.00 0.00 0.00 61.98 63.45 1u0k s VAL 157 Cb -0.07 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.18 1u0k s VAL 157 CO 0.01 0.15 -0.02 -0.69 0.00 0.00 0.00 175.10 174.55 1u0k s VAL 158 N 1.34 0.14 -0.12 2.92 1.01 -0.31 -0.55 120.40 124.83 1u0k s VAL 158 Ca 0.40 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.79 1u0k s VAL 158 Cb -0.18 -0.20 0.03 0.00 0.00 0.00 0.00 36.38 36.04 1u0k s VAL 158 CO 0.17 -0.22 0.32 -0.55 0.00 0.00 0.00 175.10 174.83 1u0k s SER 159 N -0.73 -0.33 -0.20 3.32 0.15 -0.30 -1.47 113.70 114.15 1u0k s SER 159 Ca -0.07 0.62 0.15 0.00 0.70 0.00 0.00 55.95 57.35 1u0k s SER 159 Cb -0.05 0.64 0.45 0.00 -1.71 0.00 0.00 66.02 65.35 1u0k s SER 159 CO -0.00 -0.13 1.34 0.35 1.20 0.00 0.00 173.24 176.00 1u0k n THR 160 N 2.81 2.24 0.00 6.45 -2.24 -1.26 -0.55 114.28 121.74 1u0k n THR 160 Ca -0.13 -2.34 0.00 0.00 -2.27 0.00 0.00 64.05 59.31 1u0k n THR 160 Cb 0.58 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.54 1u0k n THR 160 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u0k n GLY 161 N -0.98 3.40 3.22 3.38 0.00 -1.26 -4.78 105.19 108.16 1u0k n GLY 161 Ca 0.23 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 1u0k n GLY 161 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1u0k s LEU 162 N 0.00 4.49 0.05 0.99 2.96 -1.26 -5.02 118.68 120.89 1u0k s LEU 162 Ca 0.00 -1.39 -0.31 0.00 -0.22 0.00 0.00 54.13 52.21 1u0k s LEU 162 Cb 0.00 -1.83 -0.06 0.00 0.50 0.00 0.00 46.19 44.80 1u0k s LEU 162 CO 0.00 -0.38 1.29 -2.16 -1.32 0.00 0.00 176.35 173.78 1u0k s PRO 163 N 1.32 4.37 -0.07 0.98 0.04 -1.26 -4.63 135.00 135.74 1u0k s PRO 163 Ca -0.00 1.88 0.02 0.00 0.04 0.00 0.00 61.00 62.94 1u0k s PRO 163 Cb -0.21 -3.38 -0.02 0.00 0.04 0.00 0.00 34.50 30.93 1u0k s PRO 163 CO 0.00 -0.38 -0.13 0.71 0.04 0.00 0.00 177.00 177.24 1u0k s TYR 164 N 1.41 2.75 -0.42 0.56 1.51 -0.54 -0.94 117.35 121.68 1u0k s TYR 164 Ca 0.61 -0.25 -0.29 0.00 -1.01 0.00 0.00 57.07 56.13 1u0k s TYR 164 Cb -0.31 -1.69 0.02 0.00 -0.11 0.00 0.00 41.96 39.87 1u0k s TYR 164 CO 0.28 0.11 1.31 -1.17 -1.11 0.00 0.00 175.55 174.97 1u0k s LEU 165 N -0.49 3.64 -0.22 -1.29 2.96 -0.16 -1.16 118.68 121.96 1u0k s LEU 165 Ca 0.07 0.76 -0.25 0.00 -0.22 0.00 0.00 54.13 54.49 1u0k s LEU 165 Cb -0.12 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.02 1u0k s LEU 165 CO 0.02 -1.33 0.82 -0.76 -1.32 0.00 0.00 176.35 173.78 1u0k s LEU 166 N 4.97 4.11 -0.44 -0.68 1.43 0.06 -0.98 118.68 127.15 1u0k s LEU 166 Ca 0.56 1.06 0.00 0.00 -1.03 0.00 0.00 54.13 54.73 1u0k s LEU 166 Cb -0.12 -3.18 0.12 0.00 0.03 0.00 0.00 46.19 43.04 1u0k s LEU 166 CO 0.31 -0.47 0.20 -0.22 0.23 0.00 0.00 176.35 176.40 1u0k s LEU 167 N 2.58 4.95 -0.08 1.79 2.96 -0.56 -2.56 118.68 127.76 1u0k s LEU 167 Ca 0.35 -2.35 -0.30 0.00 -0.22 0.00 0.00 54.13 51.61 1u0k s LEU 167 Cb -0.16 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 1u0k s LEU 167 CO 0.09 -0.41 1.52 -2.84 -1.32 0.00 0.00 176.35 173.39 1u0k s PRO 168 N 0.65 4.20 0.21 0.98 0.02 -1.26 -1.66 135.00 138.15 1u0k s PRO 168 Ca 0.12 2.03 0.05 0.00 0.02 0.00 0.00 61.00 63.22 1u0k s PRO 168 Cb -0.22 -3.88 -0.05 0.00 0.02 0.00 0.00 34.50 30.37 1u0k s PRO 168 CO -0.05 -0.78 -0.07 0.14 -0.33 0.00 0.00 177.00 175.91 1u0k s VAL 169 N 3.73 1.32 0.83 3.83 -7.23 -0.15 -1.74 120.40 121.00 1u0k s VAL 169 Ca 0.67 -2.09 -0.11 0.00 -1.81 0.00 0.00 61.98 58.64 1u0k s VAL 169 Cb -0.30 -2.16 0.09 0.00 0.56 0.00 0.00 36.38 34.57 1u0k s VAL 169 CO 0.25 -0.50 1.09 0.42 -0.31 0.00 0.00 175.10 176.05 1u0k s THR 170 N -3.23 2.96 0.24 5.32 -4.23 -0.70 -3.90 115.64 112.09 1u0k s THR 170 Ca 0.24 0.31 -0.06 0.00 -1.18 0.00 0.00 61.69 61.00 1u0k s THR 170 Cb 0.03 -2.93 0.24 0.00 1.34 0.00 0.00 72.50 71.18 1u0k s THR 170 CO 0.06 -0.41 1.91 0.00 -0.54 0.00 0.00 174.62 175.65 1u0k h ALA 171 N -1.26 1.24 -0.36 3.99 0.00 -1.95 0.04 119.26 120.97 1u0k h ALA 171 Ca -0.48 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.36 1u0k h ALA 171 Cb 1.27 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1u0k h ALA 171 CO 0.57 0.66 0.21 0.93 0.00 0.00 0.00 179.25 181.63 1u0k h GLU 172 N 1.33 0.43 -0.47 0.00 3.07 -1.97 -2.49 114.58 114.48 1u0k h GLU 172 Ca 0.35 -0.03 -0.07 0.00 -0.50 0.00 0.00 59.36 59.11 1u0k h GLU 172 Cb -0.11 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 27.69 1u0k h GLU 172 CO -0.07 0.28 0.00 0.00 -1.40 0.00 0.00 179.01 177.82 1u0k h ALA 173 N 1.15 0.63 -0.85 3.43 0.00 -1.78 -2.94 119.26 118.89 1u0k h ALA 173 Ca 0.14 -0.27 0.10 0.00 0.00 0.00 0.00 54.91 54.87 1u0k h ALA 173 Cb -0.01 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.54 1u0k h ALA 173 CO -0.06 0.43 0.55 1.25 0.00 0.00 0.00 179.25 181.43 1u0k h LEU 174 N 0.68 0.74 0.00 0.00 5.85 -0.63 -1.33 115.31 120.63 1u0k h LEU 174 Ca 0.13 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1u0k h LEU 174 Cb 0.50 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.40 1u0k h LEU 174 CO 0.02 0.44 0.00 0.61 -0.34 0.00 0.00 178.44 179.17 1u0k n GLY 175 N -1.42 -1.21 0.14 3.75 0.00 -0.97 -3.05 105.19 102.42 1u0k n GLY 175 Ca 0.15 -0.15 0.06 0.00 0.00 0.00 0.00 46.02 46.07 1u0k n GLY 175 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1u0k n ARG 176 N -1.24 1.23 -2.08 1.61 1.85 -0.55 -5.07 116.66 112.41 1u0k n ARG 176 Ca 0.15 -1.94 -0.41 0.00 -1.00 0.00 0.00 57.85 54.66 1u0k n ARG 176 Cb 0.21 -1.15 -0.02 0.00 -1.05 0.00 0.00 32.46 30.46 1u0k n ARG 176 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1u0k s ALA 177 N -1.79 3.51 -0.28 2.89 0.00 -0.90 -4.90 121.76 120.30 1u0k s ALA 177 Ca 0.18 1.30 -0.09 0.00 0.00 0.00 0.00 51.96 53.35 1u0k s ALA 177 Cb 0.16 -3.50 0.12 0.00 0.00 0.00 0.00 23.12 19.90 1u0k s ALA 177 CO 0.02 -0.69 0.59 0.50 0.00 0.00 0.00 175.76 176.18 1u0k s ARG 178 N -1.77 0.52 0.09 0.00 3.52 -0.34 -5.02 118.95 115.96 1u0k s ARG 178 Ca 0.50 1.34 -0.31 0.00 -0.13 0.00 0.00 55.73 57.12 1u0k s ARG 178 Cb -0.41 0.73 -0.08 0.00 -1.56 0.00 0.00 34.95 33.64 1u0k s ARG 178 CO 0.54 -0.23 1.42 -1.14 -0.81 0.00 0.00 175.30 175.07 1u0k s GLN 179 N 2.83 4.30 0.00 5.12 0.74 -1.26 -2.83 119.66 128.56 1u0k s GLN 179 Ca -0.04 2.09 0.00 0.00 0.05 0.00 0.00 55.36 57.46 1u0k s GLN 179 Cb -0.12 -3.33 0.00 0.00 1.10 0.00 0.00 33.01 30.66 1u0k s GLN 179 CO -0.18 -0.49 0.66 1.33 -0.55 0.00 0.00 175.29 176.07 1u0k n VAL 180 N 4.13 0.34 -3.93 1.34 0.24 -0.02 -4.97 118.33 115.47 1u0k n VAL 180 Ca 0.12 -0.35 -0.10 0.00 -2.04 0.00 0.00 64.34 61.98 1u0k n VAL 180 Cb 0.42 0.84 -0.10 0.00 -1.47 0.00 0.00 33.84 33.54 1u0k n VAL 180 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1u0k s ASN 181 N -0.34 0.17 0.11 -1.34 3.84 -1.22 -5.03 114.94 111.12 1u0k s ASN 181 Ca 0.00 -0.48 -0.30 0.00 0.21 0.00 0.00 52.86 52.29 1u0k s ASN 181 Cb 0.00 0.20 -0.06 0.00 -0.55 0.00 0.00 41.25 40.84 1u0k s ASN 181 CO 0.00 -0.46 1.05 -0.62 -2.79 0.00 0.00 177.10 174.28 1u0k s ASP 182 N -1.92 7.33 0.00 -4.21 2.15 -1.26 -4.96 116.67 113.80 1u0k s ASP 182 Ca -0.08 1.91 0.17 0.00 0.43 0.00 0.00 52.55 54.98 1u0k s ASP 182 Cb -0.03 -2.59 -0.18 0.00 -0.30 0.00 0.00 42.92 39.82 1u0k s ASP 182 CO -0.03 -0.21 0.73 0.18 -0.17 0.00 0.00 175.17 175.67 1u0k n LEU 183 N 2.97 0.84 -0.08 -1.34 4.77 -1.26 -4.76 117.00 118.15 1u0k n LEU 183 Ca 0.04 -0.51 -0.10 0.00 -0.03 0.00 0.00 56.01 55.41 1u0k n LEU 183 Cb 0.48 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1u0k n LEU 183 CO 0.53 0.21 0.92 -0.61 -1.33 0.00 0.00 177.39 177.10 1u0k h GLN 184 N 0.07 0.39 -0.47 3.23 5.75 -1.93 -0.58 115.11 121.57 1u0k h GLN 184 Ca 0.00 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1u0k h GLN 184 Cb 0.41 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 1u0k h GLN 184 CO 0.00 0.37 0.28 0.93 -2.65 0.00 0.00 178.83 177.75 1u0k h GLU 185 N 0.31 0.64 -0.36 1.69 5.08 -1.99 -0.29 114.58 119.65 1u0k h GLU 185 Ca 0.09 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.26 1u0k h GLU 185 Cb 0.10 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1u0k h GLU 185 CO -0.01 0.47 -0.31 0.00 -1.00 0.00 0.00 179.01 178.16 1u0k h ALA 186 N 1.13 0.79 -0.25 3.43 0.00 -1.82 -2.14 119.26 120.39 1u0k h ALA 186 Ca 0.17 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 1u0k h ALA 186 Cb 0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1u0k h ALA 186 CO -0.03 0.65 -0.39 -0.07 0.00 0.00 0.00 179.25 179.41 1u0k h LEU 187 N 0.66 0.79 -0.85 0.00 3.38 -0.93 -3.04 115.31 115.32 1u0k h LEU 187 Ca 0.07 -0.52 0.09 0.00 0.09 0.00 0.00 57.88 57.61 1u0k h LEU 187 Cb 0.84 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 41.29 1u0k h LEU 187 CO 0.07 1.15 0.50 0.44 0.09 0.00 0.00 178.44 180.70 1u0k h ASP 188 N 0.44 0.74 -0.01 -0.43 3.32 -0.94 -0.97 116.42 118.58 1u0k h ASP 188 Ca 0.02 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 1u0k h ASP 188 Cb 0.99 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.42 1u0k h ASP 188 CO 0.09 0.43 -0.04 0.11 -1.72 0.00 0.00 179.24 178.11 1u0k h LYS 189 N 0.86 0.14 -0.01 3.56 1.57 -1.28 -2.20 116.57 119.20 1u0k h LYS 189 Ca 0.40 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 1u0k h LYS 189 Cb 0.33 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1u0k h LYS 189 CO -0.23 0.20 -0.18 1.28 -0.57 0.00 0.00 179.45 179.95 1u0k n LEU 190 N -4.40 1.66 -1.19 2.94 4.77 -0.62 -4.96 117.00 115.20 1u0k n LEU 190 Ca -0.01 -0.54 -0.10 0.00 -0.03 0.00 0.00 56.01 55.33 1u0k n LEU 190 Cb 0.17 -0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1u0k n LEU 190 CO 0.36 0.29 -0.12 0.61 -1.33 0.00 0.00 177.39 177.20 1u0k n GLY 191 N 1.30 -0.04 3.54 -0.72 0.00 -0.50 -4.49 105.19 104.29 1u0k n GLY 191 Ca 0.14 -0.45 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 1u0k n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u0k s ALA 192 N -2.53 2.86 -0.14 4.61 0.00 -0.49 -4.79 121.76 121.28 1u0k s ALA 192 Ca 0.01 -1.18 0.01 0.00 0.00 0.00 0.00 51.96 50.80 1u0k s ALA 192 Cb -0.00 -0.89 -0.24 0.00 0.00 0.00 0.00 23.12 21.99 1u0k s ALA 192 CO 0.01 0.61 0.27 0.00 0.00 0.00 0.00 175.76 176.66 1u0k n ALA 193 N 1.13 1.17 -2.52 0.00 0.00 -0.11 -4.05 120.51 116.13 1u0k n ALA 193 Ca -0.15 -0.80 -0.09 0.00 0.00 0.00 0.00 53.44 52.41 1u0k n ALA 193 Cb 0.52 -0.55 -0.08 0.00 0.00 0.00 0.00 19.45 19.34 1u0k n ALA 193 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1u0k s PHE 194 N -2.55 0.20 -0.09 0.00 0.40 -1.22 -4.99 117.98 109.73 1u0k s PHE 194 Ca -0.20 -0.62 -0.12 0.00 -0.60 0.00 0.00 56.93 55.38 1u0k s PHE 194 Cb 0.07 -0.12 -0.05 0.00 0.51 0.00 0.00 43.02 43.44 1u0k s PHE 194 CO 0.75 -0.49 0.30 0.08 0.70 0.00 0.00 175.22 176.55 1u0k s VAL 195 N -3.65 5.26 -0.23 -0.44 1.01 -1.26 -0.99 120.40 120.10 1u0k s VAL 195 Ca 0.04 0.57 0.01 0.00 0.00 0.00 0.00 61.98 62.59 1u0k s VAL 195 Cb 0.04 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.86 1u0k s VAL 195 CO -0.10 0.51 -0.13 -0.47 0.00 0.00 0.00 175.10 174.91 1u0k s TYR 196 N -0.46 3.03 0.01 5.22 5.04 -0.16 -4.53 117.35 125.50 1u0k s TYR 196 Ca 0.19 -1.88 -0.30 0.00 -2.44 0.00 0.00 57.07 52.64 1u0k s TYR 196 Cb -0.14 -1.96 -0.03 0.00 0.35 0.00 0.00 41.96 40.18 1u0k s TYR 196 CO 0.07 -0.82 0.98 -0.51 -1.34 0.00 0.00 175.55 173.94 1u0k s LEU 197 N 1.23 4.38 -0.12 6.97 1.43 -0.24 -1.50 118.68 130.83 1u0k s LEU 197 Ca -0.01 1.67 -0.00 0.00 -1.03 0.00 0.00 54.13 54.75 1u0k s LEU 197 Cb -0.16 -3.57 0.03 0.00 0.03 0.00 0.00 46.19 42.51 1u0k s LEU 197 CO -0.08 -0.26 -0.07 -0.22 0.23 0.00 0.00 176.35 175.95 1u0k s LEU 198 N 0.97 1.20 -0.70 1.79 2.96 -0.66 -1.28 118.68 122.96 1u0k s LEU 198 Ca 0.52 -0.32 -0.21 0.00 -0.22 0.00 0.00 54.13 53.90 1u0k s LEU 198 Cb -0.21 -0.84 0.09 0.00 0.50 0.00 0.00 46.19 45.73 1u0k s LEU 198 CO 0.28 -0.12 0.93 -0.62 -1.32 0.00 0.00 176.35 175.50 1u0k s ASP 199 N 1.71 6.27 0.23 3.68 2.15 0.45 -0.97 116.67 130.18 1u0k s ASP 199 Ca 0.05 -1.33 -0.06 0.00 0.43 0.00 0.00 52.55 51.64 1u0k s ASP 199 Cb -0.13 -2.38 0.23 0.00 -0.30 0.00 0.00 42.92 40.34 1u0k s ASP 199 CO -0.08 -1.28 1.77 -0.37 -0.17 0.00 0.00 175.17 175.05 1u0k h VAL 200 N 5.92 1.25 -0.20 1.11 -1.51 -1.82 0.81 116.25 121.81 1u0k h VAL 200 Ca -0.20 -0.88 -0.19 0.00 -1.23 0.00 0.00 66.70 64.21 1u0k h VAL 200 Cb 1.07 0.50 0.00 0.00 -2.13 0.00 0.00 31.29 30.73 1u0k h VAL 200 CO 1.14 0.34 -0.64 0.44 -1.23 0.00 0.00 177.57 177.63 1u0k h ASP 201 N 1.02 0.82 0.82 4.19 3.32 -1.91 -2.97 116.42 121.71 1u0k h ASP 201 Ca 0.22 -0.48 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1u0k h ASP 201 Cb 0.30 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1u0k h ASP 201 CO -0.01 1.25 -0.16 0.61 -1.72 0.00 0.00 179.24 179.22 1u0k n GLY 202 N 0.46 -1.40 3.82 2.75 0.00 -1.18 -4.95 105.19 104.69 1u0k n GLY 202 Ca -0.05 -0.18 -0.25 0.00 0.00 0.00 0.00 46.02 45.54 1u0k n GLY 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u0k n ARG 203 N -1.48 -4.66 -4.21 1.61 1.74 0.24 -4.82 116.66 105.09 1u0k n ARG 203 Ca 0.07 0.56 -0.17 0.00 -0.77 0.00 0.00 57.85 57.54 1u0k n ARG 203 Cb 0.34 -5.11 -0.13 0.00 -1.02 0.00 0.00 32.46 26.53 1u0k n ARG 203 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1u0k s GLU 204 N -6.27 0.66 0.24 5.56 2.12 -0.99 -0.78 118.70 119.24 1u0k s GLU 204 Ca 0.18 -0.59 0.01 0.00 0.36 0.00 0.00 54.97 54.93 1u0k s GLU 204 Cb -0.09 -0.58 -0.04 0.00 0.26 0.00 0.00 34.13 33.68 1u0k s GLU 204 CO 0.84 0.14 0.16 0.20 -0.54 0.00 0.00 175.26 176.05 1u0k s GLY 205 N -0.99 1.70 -0.01 -1.50 0.00 -1.04 -0.41 107.32 105.07 1u0k s GLY 205 Ca -0.02 -1.79 -0.05 0.00 0.00 0.00 0.00 44.72 42.86 1u0k s GLY 205 CO 0.01 -1.45 0.11 0.50 0.00 0.00 0.00 173.10 172.26 1u0k s ARG 206 N -3.98 0.34 0.03 2.90 0.52 -0.41 -4.60 118.95 113.75 1u0k s ARG 206 Ca 0.39 -0.23 -0.24 0.00 -0.52 0.00 0.00 55.73 55.13 1u0k s ARG 206 Cb 0.06 0.14 0.06 0.00 0.52 0.00 0.00 34.95 35.73 1u0k s ARG 206 CO 0.16 -0.07 0.56 -0.08 0.02 0.00 0.00 175.30 175.88 1u0k s THR 207 N -0.88 0.02 0.31 0.02 -1.32 -1.26 -1.07 115.64 111.46 1u0k s THR 207 Ca -0.10 -0.17 0.03 0.00 -1.21 0.00 0.00 61.69 60.24 1u0k s THR 207 Cb -0.06 -0.97 -0.05 0.00 -1.51 0.00 0.00 72.50 69.91 1u0k s THR 207 CO 0.01 -0.09 0.09 0.26 -2.21 0.00 0.00 174.62 172.67 1u0k s TRP 208 N -2.25 1.75 1.19 9.09 0.51 -1.26 -1.20 118.94 126.77 1u0k s TRP 208 Ca -0.06 -1.13 -0.13 0.00 -2.12 0.00 0.00 56.10 52.66 1u0k s TRP 208 Cb -0.01 -1.09 0.29 0.00 -0.81 0.00 0.00 33.47 31.86 1u0k s TRP 208 CO 0.00 -0.21 0.96 -0.40 -0.51 0.00 0.00 176.95 176.79 1u0k n ASP 209 N -0.72 -1.87 0.28 2.95 5.68 -0.67 -4.85 116.55 117.35 1u0k n ASP 209 Ca -0.02 -0.19 0.17 0.00 -0.50 0.00 0.00 54.79 54.25 1u0k n ASP 209 Cb 0.66 -1.24 0.94 0.00 -1.14 0.00 0.00 41.12 40.35 1u0k n ASP 209 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1u0k h ASN 210 N -2.71 0.00 0.10 -1.12 -0.00 -1.94 -1.24 115.58 108.67 1u0k h ASN 210 Ca -0.62 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.68 1u0k h ASN 210 Cb 1.34 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.66 1u0k h ASN 210 CO 0.49 0.00 -0.29 0.18 -0.00 0.00 0.00 177.43 177.81 1u0k n LEU 211 N -3.66 1.56 -0.51 6.14 4.77 -1.26 -4.69 117.00 119.35 1u0k n LEU 211 Ca -0.02 -0.51 -0.07 0.00 -0.03 0.00 0.00 56.01 55.39 1u0k n LEU 211 Cb 0.16 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.17 1u0k n LEU 211 CO 0.25 0.28 -0.06 0.61 -1.33 0.00 0.00 177.39 177.15 1u0k n GLY 212 N 1.35 0.83 0.13 -0.72 0.00 -0.47 -4.94 105.19 101.36 1u0k n GLY 212 Ca 0.12 -0.75 -0.22 0.00 0.00 0.00 0.00 46.02 45.17 1u0k n GLY 212 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u0k n LEU 213 N -0.75 2.29 -4.34 0.99 4.77 -1.26 -4.70 117.00 114.00 1u0k n LEU 213 Ca -0.07 0.27 -0.33 0.00 -0.03 0.00 0.00 56.01 55.85 1u0k n LEU 213 Cb 0.24 -1.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.19 1u0k n LEU 213 CO 0.10 0.61 -0.44 -0.69 -1.33 0.00 0.00 177.39 175.64 1u0k s VAL 214 N -2.47 3.09 0.01 4.08 1.01 -1.26 -5.02 120.40 119.83 1u0k s VAL 214 Ca -0.29 -0.63 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 1u0k s VAL 214 Cb 0.08 -2.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.08 1u0k s VAL 214 CO 0.64 0.50 0.64 -0.70 0.00 0.00 0.00 175.10 176.18 1u0k s GLU 215 N 0.68 4.36 0.13 2.72 2.12 -1.26 -1.67 118.70 125.78 1u0k s GLU 215 Ca -0.06 0.82 -0.27 0.00 0.36 0.00 0.00 54.97 55.83 1u0k s GLU 215 Cb -0.15 -3.34 -0.07 0.00 0.26 0.00 0.00 34.13 30.83 1u0k s GLU 215 CO 0.02 0.36 0.83 0.34 -0.54 0.00 0.00 175.26 176.28 1u0k s ASP 216 N -0.22 7.40 0.04 -1.70 2.15 -0.34 -4.98 116.67 119.01 1u0k s ASP 216 Ca 0.33 1.67 -0.19 0.00 0.43 0.00 0.00 52.55 54.79 1u0k s ASP 216 Cb -0.19 -2.53 -0.17 0.00 -0.30 0.00 0.00 42.92 39.73 1u0k s ASP 216 CO 0.19 0.10 1.24 0.58 -0.17 0.00 0.00 175.17 177.11 1u0k h VAL 217 N 3.65 1.38 -1.34 1.11 2.07 -1.93 -3.42 116.25 117.78 1u0k h VAL 217 Ca -0.45 -1.71 0.05 0.00 0.82 0.00 0.00 66.70 65.41 1u0k h VAL 217 Cb 1.21 2.16 -0.22 0.00 -1.52 0.00 0.00 31.29 32.91 1u0k h VAL 217 CO 0.69 0.51 -0.27 0.00 0.02 0.00 0.00 177.57 178.51 1u0k s ALA 218 N -3.78 -2.04 -0.71 1.67 0.00 -1.26 -1.58 121.76 114.05 1u0k s ALA 218 Ca -0.13 1.81 -0.12 0.00 0.00 0.00 0.00 51.96 53.52 1u0k s ALA 218 Cb 0.05 -2.01 0.18 0.00 0.00 0.00 0.00 23.12 21.34 1u0k s ALA 218 CO 0.80 -1.23 0.62 0.99 0.00 0.00 0.00 175.76 176.95 1u0k s THR 219 N 2.82 5.09 0.42 0.00 2.01 -1.26 -4.81 115.64 119.90 1u0k s THR 219 Ca 0.14 -2.31 0.09 0.00 0.31 0.00 0.00 61.69 59.92 1u0k s THR 219 Cb -0.14 -4.20 0.28 0.00 0.01 0.00 0.00 72.50 68.45 1u0k s THR 219 CO -0.20 -0.95 2.04 1.23 -0.69 0.00 0.00 174.62 176.05 1u0k h GLY 220 N 7.92 0.58 2.00 4.40 0.00 -1.92 -1.29 103.07 114.76 1u0k h GLY 220 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1u0k h GLY 220 CO 0.81 0.18 0.00 1.48 0.00 0.00 0.00 176.54 179.01 1u0k h SER 221 N 0.51 0.00 0.63 0.19 4.64 -1.89 -2.86 113.55 114.77 1u0k h SER 221 Ca 0.19 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.39 1u0k h SER 221 Cb 0.11 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.18 1u0k h SER 221 CO -0.05 0.00 -1.46 0.00 -0.87 0.00 0.00 176.83 174.45 1u0k n ALA 222 N -2.03 2.18 -0.24 5.18 0.00 -0.70 -4.43 120.51 120.46 1u0k n ALA 222 Ca 0.02 -0.52 -0.05 0.00 0.00 0.00 0.00 53.44 52.89 1u0k n ALA 222 Cb 0.37 -0.91 0.10 0.00 0.00 0.00 0.00 19.45 19.01 1u0k n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u0k h ALA 223 N 1.62 1.08 0.31 0.00 0.00 -1.02 -0.31 119.26 120.94 1u0k h ALA 223 Ca -0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 1u0k h ALA 223 Cb 1.40 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1u0k h ALA 223 CO 0.03 0.63 -0.15 0.78 0.00 0.00 0.00 179.25 180.54 1u0k h GLY 224 N 1.10 -0.44 0.25 0.00 0.00 -1.78 -0.82 103.07 101.38 1u0k h GLY 224 Ca 0.23 0.16 0.14 0.00 0.00 0.00 0.00 47.33 47.86 1u0k h GLY 224 CO -0.01 -0.16 0.40 -2.55 0.00 0.00 0.00 176.54 174.22 1u0k h PRO 225 N -0.63 0.57 -0.41 4.80 0.11 -1.73 -0.78 132.00 133.93 1u0k h PRO 225 Ca -0.04 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 1u0k h PRO 225 Cb 0.45 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 1u0k h PRO 225 CO 0.07 0.38 0.15 0.28 -0.21 0.00 0.00 178.00 178.67 1u0k h VAL 226 N 0.59 1.20 -0.52 3.15 2.07 -0.89 -0.02 116.25 121.83 1u0k h VAL 226 Ca 0.44 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1u0k h VAL 226 Cb 0.60 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1u0k h VAL 226 CO -0.36 0.23 0.28 0.00 0.02 0.00 0.00 177.57 177.75 1u0k h ALA 227 N 1.00 0.66 -0.83 1.67 0.00 -0.72 -0.80 119.26 120.24 1u0k h ALA 227 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1u0k h ALA 227 Cb 0.21 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1u0k h ALA 227 CO -0.01 0.18 0.53 0.00 0.00 0.00 0.00 179.25 179.95 1u0k h ALA 228 N 1.12 1.05 -0.11 0.00 0.00 -0.92 -1.84 119.26 118.57 1u0k h ALA 228 Ca 0.18 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1u0k h ALA 228 Cb 0.05 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1u0k h ALA 228 CO -0.03 0.48 0.05 -0.92 0.00 0.00 0.00 179.25 178.84 1u0k h TYR 229 N 1.13 0.15 -0.92 0.00 3.20 -0.51 -0.13 116.97 119.89 1u0k h TYR 229 Ca 0.30 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.16 1u0k h TYR 229 Cb -0.10 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.08 1u0k h TYR 229 CO -0.01 0.20 0.54 -0.07 -1.64 0.00 0.00 178.16 177.18 1u0k h LEU 230 N 0.06 1.12 -0.41 2.82 3.38 -0.92 -1.62 115.31 119.74 1u0k h LEU 230 Ca 0.04 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 1u0k h LEU 230 Cb 0.10 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1u0k h LEU 230 CO -0.01 0.87 -0.13 0.58 0.09 0.00 0.00 178.44 179.84 1u0k h VAL 231 N 1.27 1.28 -0.89 1.22 2.07 -1.18 0.68 116.25 120.69 1u0k h VAL 231 Ca 0.33 -1.25 0.05 0.00 0.82 0.00 0.00 66.70 66.65 1u0k h VAL 231 Cb -0.03 1.23 -0.05 0.00 -1.52 0.00 0.00 31.29 30.91 1u0k h VAL 231 CO -0.06 0.42 0.58 -0.08 0.02 0.00 0.00 177.57 178.45 1u0k h GLU 232 N 0.63 1.05 -0.70 1.57 4.57 -0.42 -2.42 114.58 118.85 1u0k h GLU 232 Ca 0.10 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1u0k h GLU 232 Cb 0.67 -0.24 0.00 0.00 -0.16 0.00 0.00 28.75 29.03 1u0k h GLU 232 CO 0.05 0.69 0.00 0.66 -1.18 0.00 0.00 179.01 179.23 1u0k n TYR 233 N -4.46 1.25 -1.40 0.92 4.02 -0.66 -4.94 117.16 111.89 1u0k n TYR 233 Ca 0.12 -0.55 -0.07 0.00 -0.01 0.00 0.00 57.90 57.39 1u0k n TYR 233 Cb 0.14 -0.13 -0.03 0.00 -0.02 0.00 0.00 39.34 39.30 1u0k n TYR 233 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1u0k n GLY 234 N 1.39 0.77 0.05 2.72 0.00 -0.91 -4.91 105.19 104.30 1u0k n GLY 234 Ca 0.25 -0.69 0.11 0.00 0.00 0.00 0.00 46.02 45.69 1u0k n GLY 234 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u0k n LEU 235 N -0.87 0.62 -3.94 0.99 4.77 0.20 -4.91 117.00 113.85 1u0k n LEU 235 Ca -0.08 0.07 -0.08 0.00 -0.03 0.00 0.00 56.01 55.89 1u0k n LEU 235 Cb 0.30 -0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 1u0k n LEU 235 CO 0.11 -0.01 -0.17 0.00 -1.33 0.00 0.00 177.39 175.99 1u0k s ALA 236 N -3.24 0.05 -0.10 -1.18 0.00 -1.03 -4.94 121.76 111.33 1u0k s ALA 236 Ca 0.03 -0.85 -0.10 0.00 0.00 0.00 0.00 51.96 51.04 1u0k s ALA 236 Cb 0.13 0.48 -0.05 0.00 0.00 0.00 0.00 23.12 23.69 1u0k s ALA 236 CO 0.80 -0.48 0.24 0.00 0.00 0.00 0.00 175.76 176.31 1u0k s ALA 237 N -3.90 3.78 0.26 0.00 0.00 -1.26 -4.17 121.76 116.47 1u0k s ALA 237 Ca 0.07 -0.50 -0.30 0.00 0.00 0.00 0.00 51.96 51.23 1u0k s ALA 237 Cb 0.06 -2.16 -0.11 0.00 0.00 0.00 0.00 23.12 20.91 1u0k s ALA 237 CO -0.09 0.48 1.57 0.50 0.00 0.00 0.00 175.76 178.22 1u0k s ARG 238 N -0.74 4.16 0.00 0.00 3.52 -1.26 -2.63 118.95 122.00 1u0k s ARG 238 Ca 0.17 2.50 0.00 0.00 -0.13 0.00 0.00 55.73 58.27 1u0k s ARG 238 Cb -0.13 -3.06 0.00 0.00 -1.56 0.00 0.00 34.95 30.20 1u0k s ARG 238 CO 0.06 -0.60 0.00 0.41 -0.81 0.00 0.00 175.30 174.36 1u0k n GLY 239 N 2.54 3.20 3.65 8.12 0.00 0.12 -4.83 105.19 117.98 1u0k n GLY 239 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 1u0k n GLY 239 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u0k s GLU 240 N -0.48 4.15 0.49 1.61 0.41 -1.08 -4.86 118.70 118.93 1u0k s GLU 240 Ca 0.00 0.28 -0.24 0.00 -0.41 0.00 0.00 54.97 54.61 1u0k s GLU 240 Cb 0.00 -3.57 -0.07 0.00 -1.78 0.00 0.00 34.13 28.71 1u0k s GLU 240 CO 0.00 -0.15 1.35 -2.14 -0.49 0.00 0.00 175.26 173.84 1u0k s PRO 241 N 1.64 3.49 0.19 0.39 0.02 -1.26 -4.65 135.00 134.82 1u0k s PRO 241 Ca 0.21 2.23 -0.00 0.00 0.02 0.00 0.00 61.00 63.46 1u0k s PRO 241 Cb -0.15 -2.47 0.00 0.00 0.02 0.00 0.00 34.50 31.90 1u0k s PRO 241 CO 0.09 -0.91 0.24 1.97 -0.33 0.00 0.00 177.00 178.06 1u0k n PHE 242 N -0.55 -0.88 -4.73 6.54 1.16 0.18 -5.00 117.46 114.17 1u0k n PHE 242 Ca 0.07 -1.29 -0.25 0.00 -1.87 0.00 0.00 57.45 54.11 1u0k n PHE 242 Cb 0.44 0.27 -0.16 0.00 -1.61 0.00 0.00 39.48 38.42 1u0k n PHE 242 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1u0k s VAL 243 N -2.65 1.28 0.19 1.97 1.01 -1.26 -1.21 120.40 119.73 1u0k s VAL 243 Ca 0.16 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.57 1u0k s VAL 243 Cb -0.00 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1u0k s VAL 243 CO 0.12 0.37 0.10 -0.76 0.00 0.00 0.00 175.10 174.94 1u0k s LEU 244 N 0.09 3.64 -0.04 3.92 1.43 0.17 -4.92 118.68 122.97 1u0k s LEU 244 Ca -0.04 -0.25 0.06 0.00 -1.03 0.00 0.00 54.13 52.87 1u0k s LEU 244 Cb -0.11 -2.25 -0.01 0.00 0.03 0.00 0.00 46.19 43.86 1u0k s LEU 244 CO 0.02 0.05 -0.21 -1.00 0.23 0.00 0.00 176.35 175.44 1u0k s HIS 245 N -1.85 2.01 0.01 0.29 3.76 0.04 -1.20 115.29 118.35 1u0k s HIS 245 Ca 0.30 -0.53 -0.23 0.00 -0.15 0.00 0.00 55.06 54.46 1u0k s HIS 245 Cb -0.09 -1.32 0.05 0.00 1.11 0.00 0.00 32.58 32.33 1u0k s HIS 245 CO 0.22 -0.14 0.52 -1.14 -0.85 0.00 0.00 174.74 173.35 1u0k s GLN 246 N -0.19 0.97 0.00 1.40 0.74 -1.16 -2.48 119.66 118.94 1u0k s GLN 246 Ca -0.00 -0.10 0.00 0.00 0.05 0.00 0.00 55.36 55.31 1u0k s GLN 246 Cb -0.11 0.45 0.00 0.00 1.10 0.00 0.00 33.01 34.44 1u0k s GLN 246 CO 0.02 -0.33 0.00 0.41 -0.55 0.00 0.00 175.29 174.84 1u0k n GLY 247 N 0.70 0.81 0.35 2.59 0.00 -0.62 -0.64 105.19 108.38 1u0k n GLY 247 Ca -0.19 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.91 1u0k n GLY 247 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1u0k h ARG 248 N 2.23 0.66 0.00 1.61 2.43 -1.87 -1.10 114.38 118.34 1u0k h ARG 248 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1u0k h ARG 248 Cb 0.00 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 1u0k h ARG 248 CO 0.00 0.44 0.00 1.19 -1.51 0.00 0.00 179.97 180.09 1u0k n PHE 249 N -4.48 0.00 -0.53 2.20 3.01 -1.26 -1.50 117.46 114.90 1u0k n PHE 249 Ca 0.11 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.64 1u0k n PHE 249 Cb 0.27 -0.47 0.21 0.00 -0.01 0.00 0.00 39.48 39.48 1u0k n PHE 249 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1u0k n LEU 250 N -1.47 3.41 -2.77 4.37 4.77 -0.59 -4.96 117.00 119.76 1u0k n LEU 250 Ca 0.05 -2.44 -0.21 0.00 -0.03 0.00 0.00 56.01 53.39 1u0k n LEU 250 Cb 0.21 -0.38 0.01 0.00 -2.33 0.00 0.00 43.42 40.94 1u0k n LEU 250 CO 0.17 0.71 -0.12 -0.62 -1.33 0.00 0.00 177.39 176.21 1u0k n GLU 251 N 0.12 -3.30 -3.20 3.23 4.71 -0.56 -4.93 120.64 116.72 1u0k n GLU 251 Ca 0.16 0.85 -0.23 0.00 -0.01 0.00 0.00 57.16 57.94 1u0k n GLU 251 Cb 0.64 -5.60 -0.06 0.00 -1.01 0.00 0.00 31.44 25.42 1u0k n GLU 251 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1u0k n ARG 252 N -3.49 1.32 -1.73 3.49 1.74 -0.52 -4.95 116.66 112.51 1u0k n ARG 252 Ca -0.15 -3.65 -0.42 0.00 -0.77 0.00 0.00 57.85 52.86 1u0k n ARG 252 Cb 0.63 -1.63 -0.01 0.00 -1.02 0.00 0.00 32.46 30.43 1u0k n ARG 252 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1u0k n PRO 253 N 0.79 2.43 -4.37 5.56 -0.04 -1.24 -3.49 135.00 134.64 1u0k n PRO 253 Ca 0.25 0.86 -0.20 0.00 -0.04 0.00 0.00 63.50 64.36 1u0k n PRO 253 Cb 0.54 -2.55 -0.13 0.00 -0.04 0.00 0.00 33.50 31.32 1u0k n PRO 253 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1u0k s SER 254 N 0.08 1.68 -0.24 3.54 0.01 0.18 -3.44 113.70 115.52 1u0k s SER 254 Ca 0.60 -0.45 -0.02 0.00 1.31 0.00 0.00 55.95 57.38 1u0k s SER 254 Cb -0.54 -0.11 0.02 0.00 0.21 0.00 0.00 66.02 65.60 1u0k s SER 254 CO 0.56 0.04 -0.06 -0.60 0.41 0.00 0.00 173.24 173.60 1u0k s ARG 255 N -1.12 3.01 -0.32 12.44 3.52 -0.93 -2.98 118.95 132.57 1u0k s ARG 255 Ca 0.02 -0.86 -0.06 0.00 -0.13 0.00 0.00 55.73 54.70 1u0k s ARG 255 Cb -0.08 -2.98 0.03 0.00 -1.56 0.00 0.00 34.95 30.36 1u0k s ARG 255 CO 0.01 -0.33 0.08 -0.51 -0.81 0.00 0.00 175.30 173.74 1u0k s LEU 256 N 1.37 4.07 0.08 -0.88 1.02 -0.34 -4.66 118.68 119.35 1u0k s LEU 256 Ca 0.02 -1.01 -0.29 0.00 0.02 0.00 0.00 54.13 52.87 1u0k s LEU 256 Cb -0.16 -1.85 -0.05 0.00 0.02 0.00 0.00 46.19 44.15 1u0k s LEU 256 CO -0.04 -0.27 0.94 -1.81 0.02 0.00 0.00 176.35 175.19 1u0k s ASP 257 N 1.41 7.44 0.04 2.29 1.01 -0.22 -0.65 116.67 127.99 1u0k s ASP 257 Ca -0.01 1.73 0.02 0.00 0.71 0.00 0.00 52.55 55.00 1u0k s ASP 257 Cb -0.19 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 41.15 1u0k s ASP 257 CO 0.02 -0.09 -0.07 0.68 0.21 0.00 0.00 175.17 175.92 1u0k s VAL 258 N 0.18 0.47 -0.15 -1.27 -7.23 -0.35 -0.69 120.40 111.36 1u0k s VAL 258 Ca 0.47 -1.09 -0.07 0.00 -1.81 0.00 0.00 61.98 59.47 1u0k s VAL 258 Cb -0.23 -0.60 0.06 0.00 0.56 0.00 0.00 36.38 36.17 1u0k s VAL 258 CO 0.29 -0.43 0.35 -1.58 -0.31 0.00 0.00 175.10 173.41 1u0k s GLN 259 N -1.67 0.31 -0.58 4.82 0.74 -0.66 -0.65 119.66 121.96 1u0k s GLN 259 Ca -0.10 0.71 -0.18 0.00 0.05 0.00 0.00 55.36 55.83 1u0k s GLN 259 Cb -0.09 -0.04 0.11 0.00 1.10 0.00 0.00 33.01 34.08 1u0k s GLN 259 CO -0.00 -0.17 0.67 0.08 -0.55 0.00 0.00 175.29 175.32 1u0k s VAL 260 N 1.45 4.88 0.67 1.34 1.01 -1.26 -0.96 120.40 127.53 1u0k s VAL 260 Ca -0.09 -1.05 -0.16 0.00 0.00 0.00 0.00 61.98 60.69 1u0k s VAL 260 Cb -0.09 -4.46 0.01 0.00 0.00 0.00 0.00 36.38 31.83 1u0k s VAL 260 CO -0.11 -1.08 1.15 0.00 0.00 0.00 0.00 175.10 175.06 1u0k s ALA 261 N 2.53 2.37 0.28 5.51 0.00 -0.11 0.13 121.76 132.48 1u0k s ALA 261 Ca 0.10 0.72 0.33 0.00 0.00 0.00 0.00 51.96 53.11 1u0k s ALA 261 Cb -0.25 -3.38 1.52 0.00 0.00 0.00 0.00 23.12 21.01 1u0k s ALA 261 CO 0.06 -1.43 2.06 1.79 0.00 0.00 0.00 175.76 178.24 1u0k h THR 262 N 0.09 0.20 -0.16 0.00 1.35 -1.88 -1.01 112.91 111.50 1u0k h THR 262 Ca -0.48 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 64.87 1u0k h THR 262 Cb 1.27 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 69.10 1u0k h THR 262 CO 0.53 0.06 0.00 -0.90 -0.25 0.00 0.00 175.52 174.96 1u0k n ASP 263 N -3.25 0.96 0.00 5.36 5.75 -1.26 -4.93 116.55 119.17 1u0k n ASP 263 Ca -0.01 -1.86 0.00 0.00 -0.01 0.00 0.00 54.79 52.91 1u0k n ASP 263 Cb 0.26 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 1u0k n ASP 263 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1u0k n GLY 264 N 0.85 1.69 3.72 6.12 0.00 -0.38 -5.07 105.19 112.12 1u0k n GLY 264 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1u0k n GLY 264 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1u0k s SER 265 N -0.10 6.73 -0.26 1.61 0.15 -1.26 -4.26 113.70 116.30 1u0k s SER 265 Ca 0.00 2.49 -0.12 0.00 0.70 0.00 0.00 55.95 59.02 1u0k s SER 265 Cb 0.00 -2.60 -0.05 0.00 -1.71 0.00 0.00 66.02 61.66 1u0k s SER 265 CO 0.00 -0.70 0.22 -0.69 1.20 0.00 0.00 173.24 173.26 1u0k s VAL 266 N 0.82 5.30 -0.10 4.45 1.01 0.10 -0.93 120.40 131.05 1u0k s VAL 266 Ca 0.65 0.26 -0.03 0.00 0.00 0.00 0.00 61.98 62.85 1u0k s VAL 266 Cb -0.40 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.39 1u0k s VAL 266 CO 0.34 0.27 0.03 -0.13 0.00 0.00 0.00 175.10 175.61 1u0k s ARG 267 N 1.52 3.14 -0.04 2.72 0.52 -0.13 -0.76 118.95 125.92 1u0k s ARG 267 Ca 0.09 -0.35 0.01 0.00 -0.52 0.00 0.00 55.73 54.97 1u0k s ARG 267 Cb -0.15 -2.90 0.02 0.00 0.52 0.00 0.00 34.95 32.44 1u0k s ARG 267 CO 0.08 0.69 -0.06 0.08 0.02 0.00 0.00 175.30 176.11 1u0k s VAL 268 N -0.84 0.66 0.31 3.52 1.01 -1.26 -1.66 120.40 122.14 1u0k s VAL 268 Ca 0.13 -0.21 -0.10 0.00 0.00 0.00 0.00 61.98 61.80 1u0k s VAL 268 Cb -0.12 -0.65 0.01 0.00 0.00 0.00 0.00 36.38 35.63 1u0k s VAL 268 CO 0.03 0.25 0.53 -0.83 0.00 0.00 0.00 175.10 175.07 1u0k s GLY 269 N 0.77 0.84 0.00 4.51 0.00 0.14 -4.43 107.32 109.15 1u0k s GLY 269 Ca -0.11 -1.08 0.00 0.00 0.00 0.00 0.00 44.72 43.53 1u0k s GLY 269 CO 0.01 -0.70 0.00 0.61 0.00 0.00 0.00 173.10 173.02 1u0k n GLY 270 N -0.47 -0.32 3.78 0.20 0.00 -0.29 -1.05 105.19 107.03 1u0k n GLY 270 Ca -0.02 -1.00 -0.36 0.00 0.00 0.00 0.00 46.02 44.65 1u0k n GLY 270 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1u0k s HIS 271 N -2.00 3.12 -0.06 1.61 3.76 -1.26 -1.53 115.29 118.93 1u0k s HIS 271 Ca 0.00 1.61 0.02 0.00 -0.15 0.00 0.00 55.06 56.54 1u0k s HIS 271 Cb 0.00 -3.15 0.02 0.00 1.11 0.00 0.00 32.58 30.55 1u0k s HIS 271 CO 0.00 -0.83 -0.10 0.08 -0.85 0.00 0.00 174.74 173.03 1u0k s VAL 272 N -1.73 1.01 0.02 -0.90 1.01 0.14 -0.69 120.40 119.27 1u0k s VAL 272 Ca 0.61 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 62.21 1u0k s VAL 272 Cb -0.22 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1u0k s VAL 272 CO 0.27 0.33 0.05 -1.10 0.00 0.00 0.00 175.10 174.65 1u0k s GLN 273 N 0.79 2.92 -0.29 2.72 -1.52 0.09 -1.23 119.66 123.14 1u0k s GLN 273 Ca -0.13 -0.58 -0.05 0.00 -1.95 0.00 0.00 55.36 52.65 1u0k s GLN 273 Cb -0.15 -2.76 0.02 0.00 -0.22 0.00 0.00 33.01 29.90 1u0k s GLN 273 CO 0.02 0.62 0.04 -1.17 -0.25 0.00 0.00 175.29 174.55 1u0k s LEU 274 N -1.86 3.74 -0.20 2.90 2.96 -1.26 -0.94 118.68 124.03 1u0k s LEU 274 Ca 0.23 -0.87 0.06 0.00 -0.22 0.00 0.00 54.13 53.34 1u0k s LEU 274 Cb -0.12 -1.80 -0.16 0.00 0.50 0.00 0.00 46.19 44.60 1u0k s LEU 274 CO 0.15 -0.20 -0.11 0.18 -1.32 0.00 0.00 176.35 175.05 1u0k n LEU 275 N 4.78 2.02 -3.58 -0.68 4.32 0.17 -5.01 117.00 119.02 1u0k n LEU 275 Ca -0.15 -0.08 -0.17 0.00 -0.02 0.00 0.00 56.01 55.60 1u0k n LEU 275 Cb 0.47 -0.38 -0.07 0.00 -1.62 0.00 0.00 43.42 41.83 1u0k n LEU 275 CO 0.30 0.72 0.35 0.00 -1.22 0.00 0.00 177.39 177.53 1u0k s ALA 276 N -2.42 -1.55 -0.22 -1.18 0.00 -1.07 -4.97 121.76 110.33 1u0k s ALA 276 Ca -0.22 1.14 -0.04 0.00 0.00 0.00 0.00 51.96 52.84 1u0k s ALA 276 Cb 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.13 1u0k s ALA 276 CO 0.56 -0.34 -0.03 0.50 0.00 0.00 0.00 175.76 176.44 1u0k s ARG 277 N -1.13 3.38 -0.11 0.00 3.52 -1.26 -1.37 118.95 121.99 1u0k s ARG 277 Ca -0.11 -0.62 0.00 0.00 -0.13 0.00 0.00 55.73 54.87 1u0k s ARG 277 Cb -0.01 -3.04 -0.02 0.00 -1.56 0.00 0.00 34.95 30.32 1u0k s ARG 277 CO 0.08 -0.20 -0.11 0.00 -0.81 0.00 0.00 175.30 174.26 1u0k s ALA 278 N 1.49 2.74 -0.16 6.12 0.00 0.51 -5.01 121.76 127.45 1u0k s ALA 278 Ca 0.06 -0.90 -0.03 0.00 0.00 0.00 0.00 51.96 51.09 1u0k s ALA 278 Cb -0.14 -1.22 -0.02 0.00 0.00 0.00 0.00 23.12 21.74 1u0k s ALA 278 CO -0.03 0.35 -0.07 -1.21 0.00 0.00 0.00 175.76 174.81 1u0k s GLU 279 N -0.04 3.54 0.32 0.00 0.41 -1.26 -1.63 118.70 120.05 1u0k s GLU 279 Ca -0.02 -0.58 -0.28 0.00 -0.41 0.00 0.00 54.97 53.67 1u0k s GLU 279 Cb -0.14 -2.85 -0.10 0.00 -1.78 0.00 0.00 34.13 29.27 1u0k s GLU 279 CO 0.04 0.17 1.21 -0.51 -0.49 0.00 0.00 175.26 175.67 1u0k s LEU 280 N 0.52 4.44 0.00 1.80 1.43 -0.11 -4.94 118.68 121.82 1u0k s LEU 280 Ca -0.05 2.47 0.11 0.00 -1.03 0.00 0.00 54.13 55.64 1u0k s LEU 280 Cb -0.15 -3.70 0.25 0.00 0.03 0.00 0.00 46.19 42.62 1u0k s LEU 280 CO 0.03 -0.41 1.15 0.18 0.23 0.00 0.00 176.35 177.53 1u0k n LEU 281 N 0.82 2.68 -3.93 1.79 4.77 -1.26 -4.35 117.00 117.52 1u0k n LEU 281 Ca 0.00 -1.71 -0.10 0.00 -0.03 0.00 0.00 56.01 54.17 1u0k n LEU 281 Cb 0.44 -0.17 -0.10 0.00 -2.33 0.00 0.00 43.42 41.25 1u0k n LEU 281 CO 0.56 0.63 -0.25 0.28 -1.33 0.00 0.00 177.39 177.29 1u0k s THR 282 N -0.99 0.11 -1.62 -5.08 -1.32 -1.26 -4.99 115.64 100.50 1u0k s THR 282 Ca 0.21 -0.91 0.13 0.00 -1.21 0.00 0.00 61.69 59.91 1u0k s THR 282 Cb 0.12 -0.54 0.10 0.00 -1.51 0.00 0.00 72.50 70.67 1u0k s THR 282 CO 0.16 -0.50 0.91 -1.54 -2.21 0.00 0.00 174.62 171.44