#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d6k n ALA 9 N 0.00 1.92 0.09 0.00 0.00 -1.26 -2.87 120.51 118.40 3d6k n ALA 9 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 53.44 53.46 3d6k n ALA 9 Cb 0.00 -1.41 -0.04 0.00 0.00 0.00 0.00 19.45 18.00 3d6k n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d6k h ARG 10 N 0.00 0.00 -0.24 0.00 3.08 -2.05 -3.17 114.38 112.00 3d6k h ARG 10 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 3d6k h ARG 10 Cb 0.50 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 3d6k h ARG 10 CO 0.00 0.55 -0.00 1.25 -1.07 0.00 0.00 179.97 180.70 3d6k h LEU 11 N 0.00 0.42 -2.05 3.04 5.85 -1.96 0.25 115.31 120.86 3d6k h LEU 11 Ca -0.06 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.34 3d6k h LEU 11 Cb 1.54 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.45 3d6k h LEU 11 CO 0.07 0.63 -0.06 0.00 -0.34 0.00 0.00 178.44 178.75 3d6k h ALA 12 N 0.80 1.12 0.08 1.25 0.00 -1.66 -1.41 119.26 119.45 3d6k h ALA 12 Ca 0.07 -0.05 -0.25 0.00 0.00 0.00 0.00 54.91 54.68 3d6k h ALA 12 Cb 0.42 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3d6k h ALA 12 CO 0.01 0.07 -1.30 0.37 0.00 0.00 0.00 179.25 178.41 3d6k h GLN 13 N 0.00 0.17 -0.69 0.00 4.15 -1.45 -3.23 115.11 114.05 3d6k h GLN 13 Ca -0.00 -0.29 -0.07 0.00 0.77 0.00 0.00 58.65 59.06 3d6k h GLN 13 Cb 0.31 0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.08 3d6k h GLN 13 CO 0.01 1.14 0.16 -0.24 -1.93 0.00 0.00 178.83 177.97 3d6k h VAL 14 N -0.49 1.26 0.00 2.39 3.04 -0.38 -1.14 116.25 120.93 3d6k h VAL 14 Ca -0.30 -0.97 -0.06 0.00 -1.01 0.00 0.00 66.70 64.36 3d6k h VAL 14 Cb 1.61 0.57 -0.01 0.00 -2.01 0.00 0.00 31.29 31.45 3d6k h VAL 14 CO -0.00 0.37 -0.28 0.08 -1.01 0.00 0.00 177.57 176.73 3d6k h ARG 15 N 1.04 0.00 -0.16 4.17 0.11 -1.44 0.14 114.38 118.23 3d6k h ARG 15 Ca 0.22 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 60.17 3d6k h ARG 15 Cb 0.38 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.46 3d6k h ARG 15 CO 0.00 0.28 -0.39 1.49 0.10 0.00 0.00 179.97 181.45 3d6k h GLU 16 N 0.00 0.55 0.00 0.08 4.81 -1.49 -0.71 114.58 117.82 3d6k h GLU 16 Ca -0.00 -0.38 -0.12 0.00 -0.13 0.00 0.00 59.36 58.73 3d6k h GLU 16 Cb 0.76 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.18 3d6k h GLU 16 CO 0.04 0.99 -0.59 1.05 -0.73 0.00 0.00 179.01 179.77 3d6k h GLU 17 N 0.19 0.00 -0.07 1.92 4.11 -0.95 -1.47 114.58 118.31 3d6k h GLU 17 Ca -0.00 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.23 3d6k h GLU 17 Cb 1.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.26 3d6k h GLU 17 CO 0.09 0.59 -0.74 0.28 0.07 0.00 0.00 179.01 179.30 3d6k h VAL 18 N 0.00 1.33 -0.97 -1.06 2.07 -0.80 -2.18 116.25 114.65 3d6k h VAL 18 Ca -0.01 -2.02 0.00 0.00 0.82 0.00 0.00 66.70 65.50 3d6k h VAL 18 Cb 1.25 2.26 -0.05 0.00 -1.52 0.00 0.00 31.29 33.24 3d6k h VAL 18 CO 0.08 0.62 0.61 0.74 0.02 0.00 0.00 177.57 179.64 3d6k h THR 19 N 0.26 1.26 -0.76 2.57 2.02 -1.05 0.34 112.91 117.54 3d6k h THR 19 Ca -0.07 -0.51 -0.05 0.00 0.77 0.00 0.00 66.41 66.55 3d6k h THR 19 Cb 1.39 -0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 3d6k h THR 19 CO 0.15 0.26 0.30 0.00 0.37 0.00 0.00 175.52 176.60 3d6k h ALA 20 N 1.34 0.99 -0.33 6.16 0.00 -1.29 -0.03 119.26 126.10 3d6k h ALA 20 Ca 0.35 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 3d6k h ALA 20 Cb -0.11 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 3d6k h ALA 20 CO -0.07 0.62 -0.24 0.87 0.00 0.00 0.00 179.25 180.43 3d6k h LYS 21 N 1.11 0.65 -0.41 0.00 1.79 -0.86 0.32 116.57 119.16 3d6k h LYS 21 Ca 0.25 -0.26 -0.11 0.00 -2.18 0.00 0.00 60.65 58.35 3d6k h LYS 21 Cb 0.22 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 3d6k h LYS 21 CO -0.02 0.83 -0.20 -0.92 -1.08 0.00 0.00 179.45 178.06 3d6k h TYR 22 N 0.57 0.91 -0.39 -1.35 3.20 -0.68 0.03 116.97 119.25 3d6k h TYR 22 Ca 0.08 -0.20 -0.11 0.00 3.14 0.00 0.00 58.73 61.64 3d6k h TYR 22 Cb 0.71 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 3d6k h TYR 22 CO 0.03 0.94 -0.18 0.00 -1.64 0.00 0.00 178.16 177.31 3d6k h ALA 23 N 1.06 0.54 -0.42 1.82 0.00 -0.82 -0.20 119.26 121.25 3d6k h ALA 23 Ca 0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3d6k h ALA 23 Cb 0.72 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3d6k h ALA 23 CO 0.06 0.48 0.23 0.93 0.00 0.00 0.00 179.25 180.95 3d6k h GLU 24 N 0.61 0.57 -0.22 0.00 5.08 -0.89 -1.20 114.58 118.52 3d6k h GLU 24 Ca 0.09 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 3d6k h GLU 24 Cb 0.73 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 3d6k h GLU 24 CO 0.06 0.42 -0.35 1.25 -1.00 0.00 0.00 179.01 179.39 3d6k h LEU 25 N 0.58 0.69 -0.86 1.33 5.85 -0.72 -2.95 115.31 119.23 3d6k h LEU 25 Ca 0.15 -0.52 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 3d6k h LEU 25 Cb 0.02 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.81 3d6k h LEU 25 CO -0.03 1.08 0.53 0.11 -0.34 0.00 0.00 178.44 179.79 3d6k h LYS 26 N 0.33 1.16 0.00 1.25 1.57 -0.76 -2.92 116.57 117.20 3d6k h LYS 26 Ca 0.02 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 3d6k h LYS 26 Cb 0.94 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 3d6k h LYS 26 CO 0.08 0.81 -0.10 0.00 -0.57 0.00 0.00 179.45 179.67 3d6k h ALA 27 N 1.29 1.42 0.00 3.86 0.00 -1.16 -1.33 119.26 123.33 3d6k h ALA 27 Ca 0.31 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3d6k h ALA 27 Cb -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3d6k h ALA 27 CO -0.06 0.13 0.00 1.63 0.00 0.00 0.00 179.25 180.95 3d6k n LYS 28 N -3.82 0.17 -3.56 0.00 5.02 -1.10 -4.92 118.16 109.95 3d6k n LYS 28 Ca -0.02 0.52 -0.25 0.00 -2.02 0.00 0.00 58.31 56.53 3d6k n LYS 28 Cb 0.20 -1.92 0.04 0.00 -0.02 0.00 0.00 35.03 33.33 3d6k n LYS 28 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3d6k n ASN 29 N -2.26 -5.76 -4.87 4.39 5.15 -0.50 -4.93 115.26 106.47 3d6k n ASN 29 Ca 0.01 -0.87 -0.30 0.00 -0.60 0.00 0.00 54.58 52.81 3d6k n ASN 29 Cb 0.15 -3.70 -0.00 0.00 -0.53 0.00 0.00 39.78 35.69 3d6k n ASN 29 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3d6k s LEU 30 N -5.93 3.42 -0.36 1.20 2.01 -1.26 -5.06 118.68 112.70 3d6k s LEU 30 Ca 0.39 1.32 0.01 0.00 0.01 0.00 0.00 54.13 55.85 3d6k s LEU 30 Cb -0.12 -4.32 0.14 0.00 0.01 0.00 0.00 46.19 41.90 3d6k s LEU 30 CO 0.84 -0.73 0.26 -0.55 1.01 0.00 0.00 176.35 177.17 3d6k s SER 31 N -3.93 2.42 0.09 2.29 0.15 -1.21 -4.43 113.70 109.08 3d6k s SER 31 Ca 0.54 -2.03 0.04 0.00 0.70 0.00 0.00 55.95 55.20 3d6k s SER 31 Cb -0.11 -0.12 -0.03 0.00 -1.71 0.00 0.00 66.02 64.05 3d6k s SER 31 CO 0.47 -0.29 -0.10 -0.76 1.20 0.00 0.00 173.24 173.75 3d6k s LEU 32 N 1.16 2.37 -0.05 3.45 1.43 -0.33 -5.03 118.68 121.68 3d6k s LEU 32 Ca 0.18 -0.75 -0.03 0.00 -1.03 0.00 0.00 54.13 52.50 3d6k s LEU 32 Cb -0.21 -0.32 0.03 0.00 0.03 0.00 0.00 46.19 45.72 3d6k s LEU 32 CO -0.00 -0.23 0.11 1.51 0.23 0.00 0.00 176.35 177.98 3d6k s ASP 33 N -2.23 -0.09 -0.72 2.29 3.84 -1.26 0.47 116.67 118.96 3d6k s ASP 33 Ca 0.02 0.23 -0.01 0.00 -0.00 0.00 0.00 52.55 52.80 3d6k s ASP 33 Cb -0.05 0.17 0.39 0.00 -1.38 0.00 0.00 42.92 42.05 3d6k s ASP 33 CO 0.00 -0.10 1.87 0.18 -0.00 0.00 0.00 175.17 177.12 3d6k n LEU 34 N 3.69 7.08 -0.01 2.11 4.77 0.12 -4.63 117.00 130.12 3d6k n LEU 34 Ca -0.20 -4.75 -0.01 0.00 -0.03 0.00 0.00 56.01 51.01 3d6k n LEU 34 Cb 0.55 -0.93 -0.02 0.00 -2.33 0.00 0.00 43.42 40.68 3d6k n LEU 34 CO 0.20 1.77 -0.60 0.41 -1.33 0.00 0.00 177.39 177.85 3d6k n THR 35 N -0.63 0.20 -3.09 -5.08 -1.04 -1.26 -2.13 114.28 101.26 3d6k n THR 35 Ca 0.54 -0.13 -0.45 0.00 -2.04 0.00 0.00 64.05 61.97 3d6k n THR 35 Cb 0.43 -0.89 -0.04 0.00 -1.82 0.00 0.00 70.33 68.01 3d6k n THR 35 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3d6k s ARG 36 N -2.08 3.17 0.00 -2.82 0.52 -1.26 -4.85 118.95 111.62 3d6k s ARG 36 Ca -0.01 -1.43 -0.04 0.00 -0.52 0.00 0.00 55.73 53.72 3d6k s ARG 36 Cb 0.01 -4.36 -0.19 0.00 0.52 0.00 0.00 34.95 30.94 3d6k s ARG 36 CO 0.12 -1.57 2.81 0.41 0.02 0.00 0.00 175.30 177.09 3d6k n GLY 37 N 5.20 2.53 3.34 -3.53 0.00 -1.26 -4.36 105.19 107.11 3d6k n GLY 37 Ca -0.03 -0.83 -0.18 0.00 0.00 0.00 0.00 46.02 44.98 3d6k n GLY 37 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d6k s LYS 38 N 1.25 1.32 0.46 1.61 -2.85 -1.26 -5.07 119.74 115.21 3d6k s LYS 38 Ca 0.46 -1.62 -0.25 0.00 -1.00 0.00 0.00 55.97 53.56 3d6k s LYS 38 Cb 0.22 -0.92 -0.08 0.00 -2.06 0.00 0.00 37.83 34.99 3d6k s LYS 38 CO 0.00 0.07 1.44 -2.14 0.10 0.00 0.00 175.35 174.82 3d6k s PRO 39 N -3.73 3.63 0.90 1.78 0.02 -1.26 -3.77 135.00 132.57 3d6k s PRO 39 Ca 0.24 2.44 -0.11 0.00 0.02 0.00 0.00 61.00 63.59 3d6k s PRO 39 Cb 0.02 -2.63 0.13 0.00 0.02 0.00 0.00 34.50 32.04 3d6k s PRO 39 CO 0.07 -0.87 1.09 -1.54 -0.33 0.00 0.00 177.00 175.42 3d6k s SER 40 N -0.50 3.42 0.53 2.53 1.04 -1.25 -4.82 113.70 114.65 3d6k s SER 40 Ca 0.62 1.59 0.21 0.00 0.48 0.00 0.00 55.95 58.85 3d6k s SER 40 Cb -0.44 -2.26 1.34 0.00 0.10 0.00 0.00 66.02 64.76 3d6k s SER 40 CO 0.57 -2.69 2.06 0.00 0.98 0.00 0.00 173.24 174.16 3d6k h ALA 41 N -1.58 2.28 -0.02 5.32 0.00 -1.93 -1.09 119.26 122.24 3d6k h ALA 41 Ca -0.49 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 3d6k h ALA 41 Cb 1.28 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 3d6k h ALA 41 CO 0.53 -0.37 0.01 1.49 0.00 0.00 0.00 179.25 180.91 3d6k h GLU 42 N 0.00 0.02 -0.48 0.00 4.81 -1.95 -0.79 114.58 116.19 3d6k h GLU 42 Ca 0.14 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 3d6k h GLU 42 Cb 0.57 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 3d6k h GLU 42 CO -0.00 0.19 0.32 1.96 -0.73 0.00 0.00 179.01 180.75 3d6k h GLN 43 N -0.15 0.64 -0.76 1.92 4.20 -1.81 -2.96 115.11 116.20 3d6k h GLN 43 Ca 0.01 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.69 3d6k h GLN 43 Cb 0.18 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.77 3d6k h GLN 43 CO -0.00 0.43 0.49 -0.07 -0.67 0.00 0.00 178.83 179.01 3d6k h LEU 44 N 0.66 0.83 -2.13 1.46 3.38 -1.08 -2.11 115.31 116.32 3d6k h LEU 44 Ca 0.18 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.19 3d6k h LEU 44 Cb -0.07 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3d6k h LEU 44 CO -0.04 0.59 0.31 0.44 0.09 0.00 0.00 178.44 179.83 3d6k h ASP 45 N 0.99 0.00 0.52 -0.43 3.32 -0.97 -1.33 116.42 118.53 3d6k h ASP 45 Ca 0.29 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.32 3d6k h ASP 45 Cb -0.05 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.49 3d6k h ASP 45 CO -0.09 0.00 -0.10 -0.07 -1.72 0.00 0.00 179.24 177.27 3d6k h LEU 46 N 0.00 0.00 -3.53 1.55 3.38 -1.38 -2.67 115.31 112.66 3d6k h LEU 46 Ca 0.09 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 3d6k h LEU 46 Cb 0.71 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.42 3d6k h LEU 46 CO -0.00 0.10 0.06 -1.20 0.09 0.00 0.00 178.44 177.48 3d6k n SER 47 N -3.42 5.03 0.25 -0.43 7.64 -0.50 -4.68 113.62 117.51 3d6k n SER 47 Ca -0.01 -3.05 0.09 0.00 1.01 0.00 0.00 58.87 56.90 3d6k n SER 47 Cb 0.26 -0.67 0.65 0.00 -1.01 0.00 0.00 64.21 63.44 3d6k n SER 47 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 3d6k h ASN 48 N 3.10 0.00 -0.09 6.43 2.35 -1.60 -1.73 115.58 124.04 3d6k h ASN 48 Ca 0.07 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 3d6k h ASN 48 Cb 1.94 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 40.29 3d6k h ASN 48 CO 0.49 0.00 -0.16 0.44 -1.65 0.00 0.00 177.43 176.55 3d6k h ASP 49 N 0.00 0.44 -0.05 5.81 3.32 -1.86 -2.43 116.42 121.66 3d6k h ASP 49 Ca 0.01 -0.12 0.01 0.00 0.02 0.00 0.00 57.03 56.95 3d6k h ASP 49 Cb 0.04 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 3d6k h ASP 49 CO -0.00 0.63 0.05 0.25 -1.72 0.00 0.00 179.24 178.44 3d6k h LEU 50 N 0.42 0.00 -1.83 1.55 5.85 -1.68 -2.72 115.31 116.91 3d6k h LEU 50 Ca 0.08 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.80 3d6k h LEU 50 Cb 0.52 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.55 3d6k h LEU 50 CO 0.03 0.00 0.00 -0.07 -0.34 0.00 0.00 178.44 178.06 3d6k h LEU 51 N 0.00 0.00 -1.76 2.25 4.07 -1.53 -2.53 115.31 115.82 3d6k h LEU 51 Ca 0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.98 3d6k h LEU 51 Cb 0.11 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.85 3d6k h LEU 51 CO -0.00 0.00 0.00 -1.20 -1.08 0.00 0.00 178.44 176.16 3d6k n SER 52 N -2.82 2.63 -4.94 -0.43 7.64 -1.02 -5.00 113.62 109.67 3d6k n SER 52 Ca -0.01 -1.81 -0.26 0.00 1.01 0.00 0.00 58.87 57.81 3d6k n SER 52 Cb 0.18 -0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.34 3d6k n SER 52 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3d6k s LEU 53 N -1.61 4.30 0.00 -3.43 1.02 -0.95 -3.41 118.68 114.60 3d6k s LEU 53 Ca 0.23 0.14 0.29 0.00 0.02 0.00 0.00 54.13 54.81 3d6k s LEU 53 Cb 0.16 -2.87 1.23 0.00 0.02 0.00 0.00 46.19 44.73 3d6k s LEU 53 CO 0.24 0.04 1.86 -0.81 0.02 0.00 0.00 176.35 177.70 3d6k n PRO 54 N -0.63 0.86 0.00 1.29 -0.04 -1.26 -4.83 135.00 130.39 3d6k n PRO 54 Ca -0.07 -0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.06 3d6k n PRO 54 Cb 0.54 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 3d6k n PRO 54 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3d6k n GLY 55 N 1.24 2.04 0.00 0.55 0.00 -1.22 -2.28 105.19 105.52 3d6k n GLY 55 Ca 0.16 -0.53 0.06 0.00 0.00 0.00 0.00 46.02 45.71 3d6k n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d6k n GLY 56 N 0.00 -0.80 2.73 -0.02 0.00 -1.26 -3.77 105.19 102.07 3d6k n GLY 56 Ca 0.00 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 3d6k n GLY 56 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3d6k n ASP 57 N -0.75 7.43 -0.60 1.61 4.64 -0.97 -4.75 116.55 123.17 3d6k n ASP 57 Ca 0.10 -3.71 0.07 0.00 -1.38 0.00 0.00 54.79 49.87 3d6k n ASP 57 Cb 0.04 -1.14 0.23 0.00 -1.04 0.00 0.00 41.12 39.21 3d6k n ASP 57 CO 0.00 0.00 0.00 2.22 -0.82 0.00 0.00 177.20 178.60 3d6k n PHE 58 N -0.14 0.37 -4.03 -0.67 -1.74 -1.25 -4.80 117.46 105.20 3d6k n PHE 58 Ca 0.50 -0.19 -0.34 0.00 -0.56 0.00 0.00 57.45 56.87 3d6k n PHE 58 Cb 0.26 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.19 3d6k n PHE 58 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 3d6k s ARG 59 N -1.63 3.22 1.00 3.97 0.52 -1.26 -1.92 118.95 122.85 3d6k s ARG 59 Ca 0.26 -0.38 -0.12 0.00 -0.52 0.00 0.00 55.73 54.97 3d6k s ARG 59 Cb 0.14 -2.97 0.19 0.00 0.52 0.00 0.00 34.95 32.83 3d6k s ARG 59 CO 0.19 0.68 1.08 0.95 0.02 0.00 0.00 175.30 178.22 3d6k s THR 60 N -1.19 2.29 0.24 0.02 -4.23 -0.75 -4.88 115.64 107.15 3d6k s THR 60 Ca 0.22 0.09 -0.08 0.00 -1.18 0.00 0.00 61.69 60.75 3d6k s THR 60 Cb -0.12 -2.38 0.28 0.00 1.34 0.00 0.00 72.50 71.61 3d6k s THR 60 CO 0.13 -0.12 1.63 0.07 -0.54 0.00 0.00 174.62 175.79 3d6k h LYS 61 N -1.98 0.09 0.00 3.99 2.10 -2.00 -0.63 116.57 118.14 3d6k h LYS 61 Ca -0.53 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.11 3d6k h LYS 61 Cb 1.30 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 3d6k h LYS 61 CO 0.52 0.06 0.00 -0.40 -2.00 0.00 0.00 179.45 177.62 3d6k n ASP 62 N -5.36 0.09 0.00 7.07 5.75 -1.26 -4.87 116.55 117.97 3d6k n ASP 62 Ca 0.13 0.53 0.00 0.00 -0.01 0.00 0.00 54.79 55.44 3d6k n ASP 62 Cb 0.46 -0.54 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 3d6k n ASP 62 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d6k n GLY 63 N -0.46 0.54 3.67 6.12 0.00 -0.24 -5.08 105.19 109.74 3d6k n GLY 63 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 3d6k n GLY 63 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d6k s VAL 64 N -2.00 4.44 -0.48 1.61 0.11 -1.26 -4.73 120.40 118.09 3d6k s VAL 64 Ca 0.00 1.74 -0.31 0.00 -2.93 0.00 0.00 61.98 60.48 3d6k s VAL 64 Cb 0.00 -4.12 -0.11 0.00 -1.53 0.00 0.00 36.38 30.62 3d6k s VAL 64 CO 0.00 -0.08 2.34 -0.67 -3.33 0.00 0.00 175.10 173.37 3d6k n ASP 65 N 5.83 2.02 -0.01 3.54 -0.08 -1.26 -1.81 116.55 124.77 3d6k n ASP 65 Ca 0.12 0.08 0.15 0.00 -1.51 0.00 0.00 54.79 53.63 3d6k n ASP 65 Cb 0.46 -1.34 0.86 0.00 2.34 0.00 0.00 41.12 43.44 3d6k n ASP 65 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3d6k n ARG 67 N -1.08 0.23 -4.56 0.00 1.74 -1.26 -4.13 116.66 107.59 3d6k n ARG 67 Ca 0.20 0.02 -0.27 0.00 -0.77 0.00 0.00 57.85 57.03 3d6k n ARG 67 Cb 0.17 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.01 3d6k n ARG 67 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3d6k s ASN 68 N -2.77 3.80 0.88 0.55 3.84 -1.22 -5.11 114.94 114.92 3d6k s ASN 68 Ca 0.21 -1.25 -0.11 0.00 0.21 0.00 0.00 52.86 51.92 3d6k s ASN 68 Cb 0.19 -0.37 0.13 0.00 -0.55 0.00 0.00 41.25 40.64 3d6k s ASN 68 CO 0.47 -0.29 1.16 -1.22 -2.79 0.00 0.00 177.10 174.43 3d6k n TYR 69 N -0.86 0.96 0.00 0.43 4.01 -1.26 -4.99 117.16 115.46 3d6k n TYR 69 Ca -0.05 0.40 0.00 0.00 -0.16 0.00 0.00 57.90 58.09 3d6k n TYR 69 Cb 0.65 -2.03 0.00 0.00 -0.31 0.00 0.00 39.34 37.64 3d6k n TYR 69 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3d6k n GLY 70 N 0.39 3.22 0.40 2.72 0.00 -1.26 -5.10 105.19 105.55 3d6k n GLY 70 Ca 0.12 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.46 3d6k n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d6k n GLY 71 N -0.25 -0.63 0.08 -0.02 0.00 -1.26 -4.94 105.19 98.16 3d6k n GLY 71 Ca 0.00 -0.84 -0.05 0.00 0.00 0.00 0.00 46.02 45.14 3d6k n GLY 71 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3d6k n LEU 72 N 0.00 0.54 -0.72 0.99 7.94 -1.26 -4.11 117.00 120.38 3d6k n LEU 72 Ca 0.00 0.25 0.06 0.00 -1.11 0.00 0.00 56.01 55.21 3d6k n LEU 72 Cb 0.00 0.22 0.17 0.00 0.53 0.00 0.00 43.42 44.34 3d6k n LEU 72 CO 0.00 0.31 0.64 0.18 -1.11 0.00 0.00 177.39 177.41 3d6k n LEU 73 N -2.84 3.03 0.00 -1.96 4.77 -1.26 -4.39 117.00 114.35 3d6k n LEU 73 Ca -0.18 -1.97 0.00 0.00 -0.03 0.00 0.00 56.01 53.83 3d6k n LEU 73 Cb 0.97 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.81 3d6k n LEU 73 CO 0.44 0.75 0.00 0.61 -1.33 0.00 0.00 177.39 177.86 3d6k n GLY 74 N 0.66 1.61 3.79 -0.72 0.00 -1.12 -0.48 105.19 108.92 3d6k n GLY 74 Ca 0.13 -1.86 -0.37 0.00 0.00 0.00 0.00 46.02 43.92 3d6k n GLY 74 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3d6k s ILE 75 N -2.89 4.28 0.33 -0.61 -4.36 -1.26 -4.83 121.20 111.86 3d6k s ILE 75 Ca 0.00 1.72 0.06 0.00 -0.26 0.00 0.00 60.65 62.17 3d6k s ILE 75 Cb 0.00 -4.00 0.30 0.00 1.25 0.00 0.00 42.46 40.02 3d6k s ILE 75 CO 0.00 0.18 1.87 0.00 0.24 0.00 0.00 174.94 177.24 3d6k h ALA 76 N 3.30 1.70 -0.19 2.27 0.00 -1.98 -2.10 119.26 122.27 3d6k h ALA 76 Ca -0.47 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.50 3d6k h ALA 76 Cb 1.19 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 3d6k h ALA 76 CO 0.65 0.08 -0.18 -0.44 0.00 0.00 0.00 179.25 179.36 3d6k h ASP 77 N 0.82 -0.58 0.24 0.00 5.19 -1.97 0.20 116.42 120.32 3d6k h ASP 77 Ca 0.44 0.11 -0.26 0.00 -0.62 0.00 0.00 57.03 56.70 3d6k h ASP 77 Cb 0.55 0.28 0.01 0.00 0.18 0.00 0.00 39.33 40.35 3d6k h ASP 77 CO -0.20 -0.23 -1.09 -0.29 -3.12 0.00 0.00 179.24 174.31 3d6k h ILE 78 N -0.20 1.35 -0.73 0.35 6.09 -1.79 -2.90 117.51 119.67 3d6k h ILE 78 Ca 0.12 -2.49 -0.06 0.00 -1.37 0.00 0.00 64.86 61.06 3d6k h ILE 78 Cb 0.38 2.56 -0.03 0.00 0.47 0.00 0.00 36.82 40.19 3d6k h ILE 78 CO -0.31 0.75 0.23 0.03 -3.07 0.00 0.00 178.15 175.78 3d6k h ARG 79 N 0.26 1.14 -0.11 2.19 3.08 -1.17 -0.95 114.38 118.82 3d6k h ARG 79 Ca -0.13 -0.24 -0.06 0.00 0.07 0.00 0.00 59.98 59.62 3d6k h ARG 79 Cb 1.75 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 31.64 3d6k h ARG 79 CO 0.20 0.97 -0.15 0.93 -1.07 0.00 0.00 179.97 180.85 3d6k h GLU 80 N 1.09 0.30 0.10 0.04 5.08 -0.68 -1.04 114.58 119.47 3d6k h GLU 80 Ca 0.24 -0.17 0.02 0.00 -1.00 0.00 0.00 59.36 58.45 3d6k h GLU 80 Cb 0.30 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.52 3d6k h GLU 80 CO -0.01 0.74 -0.39 1.25 -1.00 0.00 0.00 179.01 179.60 3d6k h LEU 81 N -0.12 -1.15 -0.34 1.33 6.46 -1.45 -1.95 115.31 118.10 3d6k h LEU 81 Ca 0.01 0.13 -0.02 0.00 -0.12 0.00 0.00 57.88 57.89 3d6k h LEU 81 Cb 0.70 0.44 -0.02 0.00 -0.73 0.00 0.00 40.66 41.06 3d6k h LEU 81 CO 0.04 -0.46 0.15 -0.25 -0.62 0.00 0.00 178.44 177.29 3d6k h TRP 82 N -0.61 0.50 -0.98 1.25 2.91 -1.19 -2.21 115.95 115.60 3d6k h TRP 82 Ca 0.03 -0.03 0.09 0.00 1.13 0.00 0.00 58.89 60.11 3d6k h TRP 82 Cb 0.65 -0.15 -0.07 0.00 -0.51 0.00 0.00 29.16 29.07 3d6k h TRP 82 CO -0.35 0.45 0.63 0.00 -1.03 0.00 0.00 178.44 178.14 3d6k h ALA 83 N 1.00 1.49 -0.35 2.65 0.00 -1.13 -1.53 119.26 121.39 3d6k h ALA 83 Ca 0.11 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3d6k h ALA 83 Cb 0.15 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3d6k h ALA 83 CO -0.01 0.32 0.06 1.49 0.00 0.00 0.00 179.25 181.10 3d6k h GLU 84 N 1.06 0.58 -0.79 0.00 4.81 -1.03 0.42 114.58 119.62 3d6k h GLU 84 Ca 0.45 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 3d6k h GLU 84 Cb 0.33 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 3d6k h GLU 84 CO -0.21 0.66 0.51 0.00 -0.73 0.00 0.00 179.01 179.23 3d6k h ALA 85 N 0.90 1.40 -0.00 2.92 0.00 -0.99 -1.47 119.26 122.02 3d6k h ALA 85 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3d6k h ALA 85 Cb 0.36 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3d6k h ALA 85 CO 0.01 0.54 -0.27 1.28 0.00 0.00 0.00 179.25 180.81 3d6k n LEU 86 N -4.40 0.31 -0.27 0.00 4.77 -0.61 -4.97 117.00 111.83 3d6k n LEU 86 Ca 0.09 0.20 -0.03 0.00 -0.03 0.00 0.00 56.01 56.24 3d6k n LEU 86 Cb 0.04 -0.34 -0.01 0.00 -2.33 0.00 0.00 43.42 40.78 3d6k n LEU 86 CO 0.37 0.07 -0.03 0.61 -1.33 0.00 0.00 177.39 177.08 3d6k n GLY 87 N 1.48 0.39 3.72 -0.72 0.00 -0.00 -4.75 105.19 105.30 3d6k n GLY 87 Ca 0.07 -0.85 -0.25 0.00 0.00 0.00 0.00 46.02 45.00 3d6k n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d6k s LEU 88 N -0.71 3.47 0.38 0.99 1.43 0.13 -4.95 118.68 119.42 3d6k s LEU 88 Ca 0.00 -0.39 -0.25 0.00 -1.03 0.00 0.00 54.13 52.47 3d6k s LEU 88 Cb 0.00 -2.06 -0.09 0.00 0.03 0.00 0.00 46.19 44.07 3d6k s LEU 88 CO 0.00 0.03 1.07 -2.84 0.23 0.00 0.00 176.35 174.84 3d6k s PRO 89 N -3.36 4.21 0.25 1.29 0.02 -1.26 -4.15 135.00 132.01 3d6k s PRO 89 Ca 0.30 1.58 -0.05 0.00 0.02 0.00 0.00 61.00 62.85 3d6k s PRO 89 Cb -0.08 -2.64 0.27 0.00 0.02 0.00 0.00 34.50 32.07 3d6k s PRO 89 CO 0.21 -0.11 1.86 0.00 -0.33 0.00 0.00 177.00 178.63 3d6k h ALA 90 N 2.69 1.20 0.00 -1.55 0.00 -1.91 -2.13 119.26 117.56 3d6k h ALA 90 Ca -0.48 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.29 3d6k h ALA 90 Cb 1.22 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3d6k h ALA 90 CO 0.63 0.63 0.00 -0.40 0.00 0.00 0.00 179.25 180.11 3d6k n ASP 91 N -4.33 0.00 -0.79 0.00 3.85 -1.26 -1.69 116.55 112.33 3d6k n ASP 91 Ca 0.08 0.36 0.12 0.00 -0.71 0.00 0.00 54.79 54.64 3d6k n ASP 91 Cb 0.12 -0.42 0.14 0.00 -1.35 0.00 0.00 41.12 39.61 3d6k n ASP 91 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 3d6k n LEU 92 N -1.42 2.57 -4.27 -2.12 4.77 -0.80 -4.91 117.00 110.83 3d6k n LEU 92 Ca 0.04 -0.87 -0.33 0.00 -0.03 0.00 0.00 56.01 54.82 3d6k n LEU 92 Cb 0.12 -0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.05 3d6k n LEU 92 CO 0.10 0.44 -0.49 -0.69 -1.33 0.00 0.00 177.39 175.41 3d6k s VAL 93 N -2.10 2.57 -0.10 4.08 1.01 -0.68 -1.88 120.40 123.30 3d6k s VAL 93 Ca 0.27 -0.82 -0.00 0.00 0.00 0.00 0.00 61.98 61.44 3d6k s VAL 93 Cb 0.20 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 3d6k s VAL 93 CO 0.36 0.53 -0.08 -0.69 0.00 0.00 0.00 175.10 175.22 3d6k s VAL 94 N 0.65 3.59 -0.14 2.92 1.01 0.14 -4.95 120.40 123.61 3d6k s VAL 94 Ca -0.09 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 3d6k s VAL 94 Cb -0.16 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 3d6k s VAL 94 CO 0.02 0.56 -0.12 0.00 0.00 0.00 0.00 175.10 175.56 3d6k s ALA 95 N -0.32 2.65 0.00 5.51 0.00 0.36 -1.19 121.76 128.78 3d6k s ALA 95 Ca 0.04 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.09 3d6k s ALA 95 Cb -0.13 -1.28 0.00 0.00 0.00 0.00 0.00 23.12 21.72 3d6k s ALA 95 CO 0.02 0.18 0.00 1.04 0.00 0.00 0.00 175.76 177.00 3d6k n GLN 96 N 3.66 2.93 0.00 0.00 1.13 0.17 -2.79 117.38 122.47 3d6k n GLN 96 Ca -0.18 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.88 3d6k n GLN 96 Cb 0.52 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.87 3d6k n GLN 96 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 3d6k n ASP 97 N 0.00 0.00 -0.68 1.08 10.43 -1.26 -4.06 116.55 122.06 3d6k n ASP 97 Ca 0.00 0.00 0.07 0.00 2.57 0.00 0.00 54.79 57.43 3d6k n ASP 97 Cb 0.00 0.00 0.21 0.00 1.84 0.00 0.00 41.12 43.17 3d6k n ASP 97 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3d6k n GLY 98 N 5.00 0.70 2.75 0.44 0.00 -1.23 0.75 105.19 113.61 3d6k n GLY 98 Ca 0.00 -0.42 -0.19 0.00 0.00 0.00 0.00 46.02 45.41 3d6k n GLY 98 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3d6k s SER 99 N -1.13 1.05 0.39 1.61 0.15 -1.26 -4.33 113.70 110.18 3d6k s SER 99 Ca 0.27 0.14 0.21 0.00 0.70 0.00 0.00 55.95 57.27 3d6k s SER 99 Cb 0.14 0.07 0.65 0.00 -1.71 0.00 0.00 66.02 65.18 3d6k s SER 99 CO 0.20 -0.26 1.71 0.77 1.20 0.00 0.00 173.24 176.86 3d6k h SER 100 N 8.40 0.00 -0.82 5.45 4.64 -1.87 -2.90 113.55 126.45 3d6k h SER 100 Ca -0.13 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.23 3d6k h SER 100 Cb 1.12 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.16 3d6k h SER 100 CO 0.16 0.31 0.52 0.25 -0.87 0.00 0.00 176.83 177.20 3d6k h LEU 101 N 0.00 0.86 -0.59 5.97 5.85 -1.96 -1.94 115.31 123.49 3d6k h LEU 101 Ca -0.00 -0.00 0.10 0.00 0.84 0.00 0.00 57.88 58.81 3d6k h LEU 101 Cb 0.94 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.71 3d6k h LEU 101 CO 0.04 0.58 0.19 0.78 -0.34 0.00 0.00 178.44 179.70 3d6k h ASN 102 N 1.01 0.16 0.00 1.25 -0.26 -1.93 -1.40 115.58 114.40 3d6k h ASN 102 Ca 0.33 0.09 0.00 0.00 -0.56 0.00 0.00 56.30 56.16 3d6k h ASN 102 Cb 0.03 0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.38 3d6k h ASN 102 CO -0.12 0.10 0.00 -0.38 -1.06 0.00 0.00 177.43 175.96 3d6k n ILE 103 N -5.03 0.11 0.00 2.81 5.41 -0.73 -1.74 119.36 120.19 3d6k n ILE 103 Ca 0.08 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.83 3d6k n ILE 103 Cb 0.28 -0.34 0.00 0.00 -0.71 0.00 0.00 39.64 38.87 3d6k n ILE 103 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 3d6k n PHE 105 N 0.54 0.00 -0.14 1.39 7.35 -0.53 -0.60 117.46 125.46 3d6k n PHE 105 Ca 0.00 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.68 3d6k n PHE 105 Cb 0.10 0.00 0.22 0.00 0.35 0.00 0.00 39.48 40.16 3d6k n PHE 105 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 3d6k h ASP 106 N 0.00 0.77 -0.42 -2.13 3.32 -1.60 0.53 116.42 116.90 3d6k h ASP 106 Ca 0.00 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 3d6k h ASP 106 Cb 0.00 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 3d6k h ASP 106 CO 0.00 0.69 0.18 -0.07 -1.72 0.00 0.00 179.24 178.32 3d6k h LEU 107 N 0.84 0.57 -0.09 1.55 3.38 -1.13 0.13 115.31 120.56 3d6k h LEU 107 Ca 0.20 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 3d6k h LEU 107 Cb 0.15 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3d6k h LEU 107 CO -0.02 0.56 -0.27 0.40 0.09 0.00 0.00 178.44 179.20 3d6k h ILE 108 N 0.54 1.41 -0.71 1.22 2.04 -1.72 -2.16 117.51 118.13 3d6k h ILE 108 Ca 0.14 -1.62 0.14 0.00 1.00 0.00 0.00 64.86 64.52 3d6k h ILE 108 Cb 0.16 2.21 -0.10 0.00 -0.74 0.00 0.00 36.82 38.36 3d6k h ILE 108 CO -0.01 0.47 0.22 -1.28 0.00 0.00 0.00 178.15 177.54 3d6k h SER 109 N -0.12 0.13 0.39 1.72 0.87 0.21 0.09 113.55 116.85 3d6k h SER 109 Ca -0.01 0.12 -0.19 0.00 -1.23 0.00 0.00 61.79 60.48 3d6k h SER 109 Cb 0.89 0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 3d6k h SER 109 CO 0.06 0.04 -0.78 -0.50 -0.53 0.00 0.00 176.83 175.12 3d6k h TRP 110 N 0.35 0.43 -0.82 2.24 6.55 -0.75 -0.80 115.95 123.15 3d6k h TRP 110 Ca 0.39 -0.21 -0.00 0.00 0.95 0.00 0.00 58.89 60.02 3d6k h TRP 110 Cb 0.60 -0.06 -0.04 0.00 -0.86 0.00 0.00 29.16 28.80 3d6k h TRP 110 CO -0.21 0.97 0.50 0.77 -1.05 0.00 0.00 178.44 179.42 3d6k h SER 111 N 0.20 0.98 -0.34 -3.49 0.02 -0.87 -1.09 113.55 108.95 3d6k h SER 111 Ca -0.04 -0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 60.82 3d6k h SER 111 Cb 1.37 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 3d6k h SER 111 CO 0.13 0.75 0.09 0.22 -1.14 0.00 0.00 176.83 176.88 3d6k h TYR 112 N 1.12 0.57 0.13 3.45 3.20 -0.75 0.30 116.97 124.99 3d6k h TYR 112 Ca 0.29 -0.07 -0.25 0.00 3.14 0.00 0.00 58.73 61.85 3d6k h TYR 112 Cb -0.05 -0.16 0.03 0.00 1.54 0.00 0.00 36.73 38.08 3d6k h TYR 112 CO -0.01 0.58 -1.05 1.15 -1.64 0.00 0.00 178.16 177.19 3d6k h THR 113 N 0.40 1.37 0.00 1.81 2.02 -1.05 -1.10 112.91 116.37 3d6k h THR 113 Ca 0.11 -2.45 0.00 0.00 0.77 0.00 0.00 66.41 64.83 3d6k h THR 113 Cb 0.29 2.88 0.00 0.00 -1.74 0.00 0.00 68.15 69.58 3d6k h THR 113 CO 0.00 0.72 -0.41 0.79 0.37 0.00 0.00 175.52 176.99 3d6k n TRP 114 N -3.95 0.00 0.00 3.16 8.01 -0.43 -4.79 117.44 119.44 3d6k n TRP 114 Ca -0.14 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.05 3d6k n TRP 114 Cb 0.91 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.21 3d6k n TRP 114 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3d6k n GLY 115 N 1.47 -0.73 3.97 6.99 0.00 0.97 -4.30 105.19 113.57 3d6k n GLY 115 Ca 0.00 -1.52 -0.27 0.00 0.00 0.00 0.00 46.02 44.24 3d6k n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d6k s ASN 116 N -1.91 3.53 0.26 1.61 2.20 -1.26 -4.41 114.94 114.96 3d6k s ASN 116 Ca 0.00 -0.19 0.21 0.00 -0.94 0.00 0.00 52.86 51.94 3d6k s ASN 116 Cb 0.00 0.07 0.99 0.00 -2.00 0.00 0.00 41.25 40.31 3d6k s ASN 116 CO 0.00 -2.43 1.65 -0.46 -2.94 0.00 0.00 177.10 172.92 3d6k n ASN 117 N -3.36 0.57 -0.63 3.54 6.94 -1.26 -0.74 115.26 120.32 3d6k n ASN 117 Ca 0.17 0.69 0.11 0.00 -0.02 0.00 0.00 54.58 55.52 3d6k n ASN 117 Cb 0.60 -0.79 0.03 0.00 -2.36 0.00 0.00 39.78 37.26 3d6k n ASN 117 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 3d6k n ASP 118 N -2.18 2.28 -4.76 0.53 8.00 -1.26 -5.01 116.55 114.15 3d6k n ASP 118 Ca 0.01 -1.64 -0.39 0.00 0.71 0.00 0.00 54.79 53.47 3d6k n ASP 118 Cb 0.15 0.30 -0.04 0.00 -0.02 0.00 0.00 41.12 41.50 3d6k n ASP 118 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3d6k s SER 119 N -2.16 7.14 0.39 -2.24 0.01 0.08 -4.30 113.70 112.62 3d6k s SER 119 Ca 0.20 2.20 0.23 0.00 1.31 0.00 0.00 55.95 59.89 3d6k s SER 119 Cb 0.17 -2.62 0.28 0.00 0.21 0.00 0.00 66.02 64.07 3d6k s SER 119 CO 0.44 -0.23 1.51 0.28 0.41 0.00 0.00 173.24 175.65 3d6k h SER 120 N 3.47 0.00 -5.00 2.44 0.02 -1.95 -3.46 113.55 109.07 3d6k h SER 120 Ca -0.47 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.42 3d6k h SER 120 Cb 1.21 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 63.57 3d6k h SER 120 CO 0.66 0.00 0.18 0.00 -1.14 0.00 0.00 176.83 176.52 3d6k s ARG 121 N -3.24 1.08 0.57 3.45 1.70 -1.26 -5.14 118.95 116.11 3d6k s ARG 121 Ca 0.06 0.13 -0.21 0.00 -0.47 0.00 0.00 55.73 55.23 3d6k s ARG 121 Cb 0.06 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 34.91 3d6k s ARG 121 CO 0.69 -0.36 1.36 -2.14 -1.08 0.00 0.00 175.30 173.77 3d6k s PRO 122 N -1.60 3.00 0.58 3.89 0.02 -1.26 -4.60 135.00 135.03 3d6k s PRO 122 Ca -0.09 2.23 0.27 0.00 0.02 0.00 0.00 61.00 63.43 3d6k s PRO 122 Cb -0.00 -2.17 1.67 0.00 0.02 0.00 0.00 34.50 34.01 3d6k s PRO 122 CO 0.06 -1.29 2.17 -1.49 -0.33 0.00 0.00 177.00 176.12 3d6k h TRP 123 N 1.26 0.00 0.00 6.54 6.55 -1.25 -0.32 115.95 128.73 3d6k h TRP 123 Ca -0.51 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.32 3d6k h TRP 123 Cb 1.31 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 29.61 3d6k h TRP 123 CO 0.45 0.00 -0.03 0.66 -1.05 0.00 0.00 178.44 178.47 3d6k h SER 124 N 0.00 0.00 0.85 -3.49 4.64 -1.44 -2.42 113.55 111.68 3d6k h SER 124 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3d6k h SER 124 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 3d6k h SER 124 CO -0.00 0.03 -0.09 0.00 -0.87 0.00 0.00 176.83 175.90 3d6k n ALA 125 N -2.24 2.57 -1.80 5.18 0.00 -0.13 -4.87 120.51 119.23 3d6k n ALA 125 Ca -0.03 -0.15 -0.34 0.00 0.00 0.00 0.00 53.44 52.92 3d6k n ALA 125 Cb 0.12 -1.41 -0.04 0.00 0.00 0.00 0.00 19.45 18.13 3d6k n ALA 125 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3d6k s GLU 126 N -2.94 3.89 0.12 0.00 0.41 -0.91 -4.97 118.70 114.30 3d6k s GLU 126 Ca 0.15 1.38 -0.21 0.00 -0.41 0.00 0.00 54.97 55.88 3d6k s GLU 126 Cb 0.19 -2.18 -0.04 0.00 -1.78 0.00 0.00 34.13 30.31 3d6k s GLU 126 CO 0.55 -0.35 1.70 0.93 -0.49 0.00 0.00 175.26 177.60 3d6k h GLU 127 N 1.76 -0.05 -3.32 1.61 5.08 -1.89 -3.45 114.58 114.32 3d6k h GLU 127 Ca -0.49 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 57.72 3d6k h GLU 127 Cb 1.22 0.01 -0.23 0.00 0.50 0.00 0.00 28.75 30.25 3d6k h GLU 127 CO 0.60 -0.04 -0.46 0.21 -1.00 0.00 0.00 179.01 178.32 3d6k s LYS 128 N -6.19 0.39 -0.15 2.33 2.20 -1.26 -5.16 119.74 111.91 3d6k s LYS 128 Ca -0.14 -0.05 0.01 0.00 -0.36 0.00 0.00 55.97 55.44 3d6k s LYS 128 Cb 0.10 0.17 0.00 0.00 -1.51 0.00 0.00 37.83 36.59 3d6k s LYS 128 CO 0.68 -0.08 -0.18 0.08 -0.36 0.00 0.00 175.35 175.48 3d6k s VAL 129 N -0.66 2.39 0.19 4.02 1.01 -1.26 -4.80 120.40 121.29 3d6k s VAL 129 Ca -0.08 -0.87 0.06 0.00 0.00 0.00 0.00 61.98 61.10 3d6k s VAL 129 Cb -0.04 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 3d6k s VAL 129 CO 0.01 0.53 0.12 -0.54 0.00 0.00 0.00 175.10 175.23 3d6k s LYS 130 N 0.81 2.80 -0.13 2.72 1.02 0.53 -0.11 119.74 127.38 3d6k s LYS 130 Ca -0.06 -0.98 -0.06 0.00 0.02 0.00 0.00 55.97 54.88 3d6k s LYS 130 Cb -0.15 -2.56 0.05 0.00 -0.52 0.00 0.00 37.83 34.65 3d6k s LYS 130 CO -0.01 0.45 0.30 -0.46 -0.92 0.00 0.00 175.35 174.71 3d6k s TRP 131 N -1.87 -0.42 0.14 3.18 -0.11 -0.54 -1.47 118.94 117.85 3d6k s TRP 131 Ca 0.31 0.94 -0.27 0.00 1.22 0.00 0.00 56.10 58.30 3d6k s TRP 131 Cb -0.09 0.11 -0.07 0.00 -1.50 0.00 0.00 33.47 31.92 3d6k s TRP 131 CO 0.23 -0.27 0.85 -0.51 -4.62 0.00 0.00 176.95 172.63 3d6k s LEU 132 N 1.35 4.54 -0.48 5.86 1.43 -0.38 -0.83 118.68 130.17 3d6k s LEU 132 Ca -0.09 1.69 0.03 0.00 -1.03 0.00 0.00 54.13 54.73 3d6k s LEU 132 Cb -0.10 -3.41 0.16 0.00 0.03 0.00 0.00 46.19 42.87 3d6k s LEU 132 CO -0.10 0.08 0.33 0.00 0.23 0.00 0.00 176.35 176.90 3d6k n PRO 134 N 2.96 1.88 -4.32 0.00 -0.02 -1.25 -1.09 135.00 133.16 3d6k n PRO 134 Ca 0.20 0.68 -0.22 0.00 -2.02 0.00 0.00 63.50 62.15 3d6k n PRO 134 Cb 0.40 -2.44 -0.13 0.00 -0.02 0.00 0.00 33.50 31.32 3d6k n PRO 134 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3d6k s VAL 135 N 1.91 1.45 0.40 -1.45 -7.23 0.21 -3.75 120.40 111.95 3d6k s VAL 135 Ca 0.85 -1.34 -0.27 0.00 -1.81 0.00 0.00 61.98 59.41 3d6k s VAL 135 Cb -0.77 -1.33 -0.10 0.00 0.56 0.00 0.00 36.38 34.75 3d6k s VAL 135 CO 0.46 -0.05 1.41 -2.84 -0.31 0.00 0.00 175.10 173.77 3d6k s PRO 136 N -1.63 3.97 0.00 4.82 0.02 -1.26 -4.68 135.00 136.24 3d6k s PRO 136 Ca 0.04 2.41 0.00 0.00 0.02 0.00 0.00 61.00 63.46 3d6k s PRO 136 Cb -0.09 -2.83 0.00 0.00 0.02 0.00 0.00 34.50 31.59 3d6k s PRO 136 CO 0.03 -0.59 0.00 0.41 -0.33 0.00 0.00 177.00 176.52 3d6k n GLY 137 N 0.58 5.48 3.56 0.52 0.00 0.14 -4.33 105.19 111.14 3d6k n GLY 137 Ca 0.03 -1.42 -0.40 0.00 0.00 0.00 0.00 46.02 44.23 3d6k n GLY 137 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3d6k s TYR 138 N -0.25 3.22 0.36 1.61 6.04 -1.24 -4.42 117.35 122.67 3d6k s TYR 138 Ca 0.00 0.01 0.12 0.00 0.04 0.00 0.00 57.07 57.24 3d6k s TYR 138 Cb 0.00 -2.50 0.91 0.00 -1.04 0.00 0.00 41.96 39.32 3d6k s TYR 138 CO 0.00 -0.30 1.80 0.38 -1.54 0.00 0.00 175.55 175.90 3d6k h ASP 139 N 8.41 0.61 0.42 4.32 -0.00 -1.87 -2.13 116.42 126.18 3d6k h ASP 139 Ca -0.32 0.07 -0.07 0.00 -0.00 0.00 0.00 57.03 56.72 3d6k h ASP 139 Cb 1.16 -0.03 -0.01 0.00 -0.00 0.00 0.00 39.33 40.45 3d6k h ASP 139 CO 0.62 0.22 -0.32 0.03 -0.00 0.00 0.00 179.24 179.78 3d6k h ARG 140 N 0.59 0.00 0.91 4.15 3.08 -1.92 -0.49 114.38 120.70 3d6k h ARG 140 Ca 0.54 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.55 3d6k h ARG 140 Cb 1.07 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.13 3d6k h ARG 140 CO -0.29 0.32 -0.44 0.45 -1.07 0.00 0.00 179.97 178.94 3d6k h HIS 141 N 0.00 -1.14 -0.62 3.04 3.86 -1.81 -3.16 115.15 115.33 3d6k h HIS 141 Ca -0.00 -0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.20 3d6k h HIS 141 Cb 0.62 0.38 -0.03 0.00 1.06 0.00 0.00 27.41 29.43 3d6k h HIS 141 CO 0.00 -0.70 0.41 0.74 0.86 0.00 0.00 177.93 179.24 3d6k h PHE 142 N -1.24 0.73 -0.58 2.45 0.04 -1.31 -1.21 116.94 115.82 3d6k h PHE 142 Ca -0.13 0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.69 3d6k h PHE 142 Cb 0.94 -0.25 -0.03 0.00 2.20 0.00 0.00 35.95 38.81 3d6k h PHE 142 CO -0.01 0.44 0.38 1.15 -0.60 0.00 0.00 178.31 179.68 3d6k h THR 143 N 0.77 1.08 0.10 -1.55 2.02 -1.11 0.80 112.91 115.02 3d6k h THR 143 Ca 0.24 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3d6k h THR 143 Cb 0.02 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 66.76 3d6k h THR 143 CO -0.06 0.13 -0.05 0.40 0.37 0.00 0.00 175.52 176.31 3d6k h ILE 144 N 0.69 1.11 -0.44 3.11 2.04 -1.18 -0.60 117.51 122.23 3d6k h ILE 144 Ca 0.23 -0.82 -0.14 0.00 1.00 0.00 0.00 64.86 65.14 3d6k h ILE 144 Cb 0.07 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 3d6k h ILE 144 CO -0.06 0.20 -0.27 0.71 0.00 0.00 0.00 178.15 178.73 3d6k h THR 145 N -0.51 1.27 -0.63 -0.27 1.35 -1.38 -0.77 112.91 111.98 3d6k h THR 145 Ca -0.01 -1.43 0.12 0.00 -0.55 0.00 0.00 66.41 64.53 3d6k h THR 145 Cb 0.42 1.21 -0.09 0.00 -1.73 0.00 0.00 68.15 67.96 3d6k h THR 145 CO 0.02 0.49 0.16 -0.08 -0.25 0.00 0.00 175.52 175.86 3d6k h GLU 146 N 0.81 0.29 -0.45 4.72 4.81 -0.88 -1.04 114.58 122.85 3d6k h GLU 146 Ca 0.09 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.26 3d6k h GLU 146 Cb 0.84 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 3d6k h GLU 146 CO 0.07 0.19 0.08 1.25 -0.73 0.00 0.00 179.01 179.88 3d6k h HIS 147 N 0.30 0.70 0.00 0.92 2.76 -0.49 -0.95 115.15 118.38 3d6k h HIS 147 Ca 0.33 -0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.44 3d6k h HIS 147 Cb 0.49 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.24 3d6k h HIS 147 CO -0.23 0.61 0.00 1.19 -1.30 0.00 0.00 177.93 178.21 3d6k n PHE 148 N -4.29 0.00 -2.01 5.26 3.01 -0.35 -4.90 117.46 114.17 3d6k n PHE 148 Ca 0.03 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.41 3d6k n PHE 148 Cb 0.22 -0.38 -0.01 0.00 -0.01 0.00 0.00 39.48 39.31 3d6k n PHE 148 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3d6k n GLY 149 N 0.84 0.18 3.76 1.37 0.00 -0.36 -5.02 105.19 105.96 3d6k n GLY 149 Ca 0.09 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 45.13 3d6k n GLY 149 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d6k s PHE 150 N -2.36 3.90 0.40 1.61 0.08 -0.46 -4.75 117.98 116.41 3d6k s PHE 150 Ca 0.00 1.86 -0.07 0.00 0.12 0.00 0.00 56.93 58.84 3d6k s PHE 150 Cb 0.00 -2.95 0.09 0.00 -0.57 0.00 0.00 43.02 39.60 3d6k s PHE 150 CO 0.00 0.40 0.55 -1.91 -0.10 0.00 0.00 175.22 174.15 3d6k n GLU 151 N 1.24 -0.52 -3.29 0.44 2.13 0.84 -4.55 120.64 116.94 3d6k n GLU 151 Ca -0.01 -0.85 0.03 0.00 0.66 0.00 0.00 57.16 56.98 3d6k n GLU 151 Cb 0.48 -0.56 -0.04 0.00 0.27 0.00 0.00 31.44 31.59 3d6k n GLU 151 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3d6k s ILE 153 N -2.18 -0.29 0.31 6.31 -1.09 -0.01 -1.47 121.20 122.77 3d6k s ILE 153 Ca 0.31 0.00 -0.29 0.00 -2.23 0.00 0.00 60.65 58.44 3d6k s ILE 153 Cb -0.01 -1.00 -0.10 0.00 -1.58 0.00 0.00 42.46 39.78 3d6k s ILE 153 CO 0.22 0.00 1.17 0.20 -1.23 0.00 0.00 174.94 175.29 3d6k s ASN 154 N 2.31 7.04 -0.08 3.58 -0.87 -1.26 -0.39 114.94 125.27 3d6k s ASN 154 Ca -0.01 2.40 0.02 0.00 -1.57 0.00 0.00 52.86 53.70 3d6k s ASN 154 Cb -0.04 -2.63 0.01 0.00 -0.02 0.00 0.00 41.25 38.57 3d6k s ASN 154 CO -0.16 -0.32 -0.13 -0.69 -2.57 0.00 0.00 177.10 173.23 3d6k s VAL 155 N -1.19 1.26 0.00 1.60 1.01 -0.25 -4.83 120.40 118.00 3d6k s VAL 155 Ca 0.47 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.92 3d6k s VAL 155 Cb -0.34 -1.16 0.00 0.00 0.00 0.00 0.00 36.38 34.88 3d6k s VAL 155 CO 0.44 0.39 0.00 -2.65 0.00 0.00 0.00 175.10 173.28 3d6k n PRO 156 N 3.97 2.29 -3.81 2.72 -0.02 -1.26 -0.62 135.00 138.27 3d6k n PRO 156 Ca -0.21 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.17 3d6k n PRO 156 Cb 0.52 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 34.01 3d6k n PRO 156 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3d6k n THR 158 N 0.00 0.00 0.43 3.45 -2.24 0.32 -0.59 114.28 115.65 3d6k n THR 158 Ca 0.00 -1.17 0.12 0.00 -2.27 0.00 0.00 64.05 60.72 3d6k n THR 158 Cb 0.00 1.01 0.47 0.00 -2.10 0.00 0.00 70.33 69.71 3d6k n THR 158 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3d6k n ASP 159 N -1.55 0.61 -0.02 3.42 3.85 -1.26 -2.86 116.55 118.74 3d6k n ASP 159 Ca -0.07 0.64 0.03 0.00 -0.71 0.00 0.00 54.79 54.68 3d6k n ASP 159 Cb 0.59 -0.77 0.04 0.00 -1.35 0.00 0.00 41.12 39.63 3d6k n ASP 159 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 3d6k n GLU 160 N -2.16 2.54 0.00 0.11 0.28 -1.26 -4.71 120.64 115.44 3d6k n GLU 160 Ca 0.03 -1.76 0.00 0.00 -0.16 0.00 0.00 57.16 55.26 3d6k n GLU 160 Cb 0.24 -1.12 0.00 0.00 1.43 0.00 0.00 31.44 31.99 3d6k n GLU 160 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3d6k n GLY 161 N -0.73 0.79 3.78 -1.84 0.00 -1.14 -1.23 105.19 104.82 3d6k n GLY 161 Ca 0.04 -2.03 -0.34 0.00 0.00 0.00 0.00 46.02 43.69 3d6k n GLY 161 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3d6k s PRO 162 N -1.31 3.18 1.21 1.61 0.02 -1.26 0.12 135.00 138.56 3d6k s PRO 162 Ca 0.00 1.44 -0.16 0.00 0.02 0.00 0.00 61.00 62.30 3d6k s PRO 162 Cb 0.00 -2.00 0.25 0.00 0.02 0.00 0.00 34.50 32.78 3d6k s PRO 162 CO 0.00 -0.96 0.64 -3.47 -0.33 0.00 0.00 177.00 172.89 3d6k n ASP 163 N -1.81 -2.47 0.00 2.53 -0.08 0.24 -4.68 116.55 110.29 3d6k n ASP 163 Ca 0.10 -0.31 0.00 0.00 -1.51 0.00 0.00 54.79 53.08 3d6k n ASP 163 Cb 0.52 -1.09 0.00 0.00 2.34 0.00 0.00 41.12 42.89 3d6k n ASP 163 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3d6k n GLY 165 N 1.58 0.00 0.14 0.27 0.00 -1.26 -1.48 105.19 104.44 3d6k n GLY 165 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 3d6k n GLY 165 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3d6k h VAL 166 N 0.00 0.87 -0.58 1.61 2.07 -1.98 -3.02 116.25 115.22 3d6k h VAL 166 Ca 0.00 -0.98 0.12 0.00 0.82 0.00 0.00 66.70 66.66 3d6k h VAL 166 Cb 0.00 1.39 -0.10 0.00 -1.52 0.00 0.00 31.29 31.06 3d6k h VAL 166 CO 0.00 0.20 -0.04 0.58 0.02 0.00 0.00 177.57 178.33 3d6k h VAL 167 N -0.79 0.50 -0.57 2.57 2.07 -1.64 -0.84 116.25 117.55 3d6k h VAL 167 Ca -0.03 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.48 3d6k h VAL 167 Cb 0.52 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 3d6k h VAL 167 CO 0.04 0.02 0.36 0.03 0.02 0.00 0.00 177.57 178.04 3d6k h ARG 168 N 0.08 0.70 -0.35 1.57 3.08 -1.84 -1.39 114.38 116.24 3d6k h ARG 168 Ca 0.29 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 60.19 3d6k h ARG 168 Cb 0.46 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 3d6k h ARG 168 CO -0.52 0.47 -0.22 1.49 -1.07 0.00 0.00 179.97 180.11 3d6k h GLU 169 N 0.73 0.77 -0.11 0.04 4.57 -1.28 -3.25 114.58 116.04 3d6k h GLU 169 Ca 0.22 -0.36 -0.11 0.00 -1.18 0.00 0.00 59.36 57.93 3d6k h GLU 169 Cb -0.02 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 3d6k h GLU 169 CO -0.08 0.98 -0.42 -0.07 -1.18 0.00 0.00 179.01 178.25 3d6k h LEU 170 N 0.56 0.27 -0.06 1.64 3.38 -0.96 -2.94 115.31 117.20 3d6k h LEU 170 Ca 0.07 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3d6k h LEU 170 Cb 0.78 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3d6k h LEU 170 CO 0.06 0.66 0.00 0.55 0.09 0.00 0.00 178.44 179.81 3d6k n VAL 171 N -4.02 0.44 0.23 1.22 3.14 -0.54 -2.03 118.33 116.77 3d6k n VAL 171 Ca -0.02 -0.13 0.11 0.00 -2.96 0.00 0.00 64.34 61.34 3d6k n VAL 171 Cb 0.49 -0.62 0.52 0.00 -1.06 0.00 0.00 33.84 33.17 3d6k n VAL 171 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 3d6k n LYS 172 N -1.99 0.15 -3.00 1.45 5.02 -1.11 -1.46 118.16 117.22 3d6k n LYS 172 Ca 0.06 0.56 -0.41 0.00 -2.02 0.00 0.00 58.31 56.49 3d6k n LYS 172 Cb 0.37 -1.90 -0.05 0.00 -0.02 0.00 0.00 35.03 33.43 3d6k n LYS 172 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3d6k s ASP 173 N -4.02 6.65 0.31 4.39 -1.08 -0.86 -4.63 116.67 117.42 3d6k s ASP 173 Ca -0.00 0.70 0.25 0.00 -0.52 0.00 0.00 52.55 52.98 3d6k s ASP 173 Cb 0.07 -2.38 1.04 0.00 -1.46 0.00 0.00 42.92 40.18 3d6k s ASP 173 CO 0.24 -0.52 1.76 1.55 0.52 0.00 0.00 175.17 178.73 3d6k h PRO 174 N 8.00 0.00 0.00 4.34 0.13 -1.88 -1.29 132.00 141.29 3d6k h PRO 174 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3d6k h PRO 174 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3d6k h PRO 174 CO 0.84 0.00 0.00 1.96 -0.23 0.00 0.00 178.00 180.57 3d6k h GLN 175 N 0.00 0.00 -6.60 0.86 4.20 -1.92 -3.40 115.11 108.25 3d6k h GLN 175 Ca 0.00 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.15 3d6k h GLN 175 Cb 0.41 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.12 3d6k h GLN 175 CO 0.00 0.00 0.99 0.08 -0.67 0.00 0.00 178.83 179.23 3d6k s VAL 176 N -3.38 4.04 -0.42 -0.54 1.01 -0.49 -0.35 120.40 120.28 3d6k s VAL 176 Ca 0.04 0.99 0.23 0.00 0.00 0.00 0.00 61.98 63.24 3d6k s VAL 176 Cb 0.09 -4.58 -0.14 0.00 0.00 0.00 0.00 36.38 31.76 3d6k s VAL 176 CO 0.45 -1.12 0.92 0.29 0.00 0.00 0.00 175.10 175.64 3d6k n LYS 177 N 8.21 0.43 0.00 2.72 4.76 -0.54 -4.50 118.16 129.23 3d6k n LYS 177 Ca 0.11 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 3d6k n LYS 177 Cb 0.49 -1.63 0.00 0.00 -1.84 0.00 0.00 35.03 32.05 3d6k n LYS 177 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3d6k n GLY 178 N 1.31 1.12 3.16 0.72 0.00 -1.26 -1.51 105.19 108.72 3d6k n GLY 178 Ca 0.00 -0.25 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 3d6k n GLY 178 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3d6k s TRP 180 N -0.93 1.91 0.03 1.61 0.52 -0.98 -1.25 118.94 119.85 3d6k s TRP 180 Ca 0.00 -0.60 0.02 0.00 0.02 0.00 0.00 56.10 55.53 3d6k s TRP 180 Cb 0.00 -1.29 -0.02 0.00 -1.15 0.00 0.00 33.47 31.01 3d6k s TRP 180 CO 0.00 -0.22 -0.07 0.95 0.02 0.00 0.00 176.95 177.63 3d6k s THR 181 N 0.11 0.46 -0.46 2.01 -4.23 -0.50 -4.32 115.64 108.71 3d6k s THR 181 Ca -0.07 -0.90 0.04 0.00 -1.18 0.00 0.00 61.69 59.57 3d6k s THR 181 Cb -0.13 -0.51 0.12 0.00 1.34 0.00 0.00 72.50 73.32 3d6k s THR 181 CO 0.03 -0.31 0.19 -0.69 -0.54 0.00 0.00 174.62 173.30 3d6k s VAL 182 N -1.16 2.53 -0.84 2.29 1.01 -1.26 -1.71 120.40 121.26 3d6k s VAL 182 Ca -0.09 -2.93 0.26 0.00 0.00 0.00 0.00 61.98 59.22 3d6k s VAL 182 Cb -0.09 -2.79 0.16 0.00 0.00 0.00 0.00 36.38 33.66 3d6k s VAL 182 CO 0.00 -0.73 1.64 -0.81 0.00 0.00 0.00 175.10 175.21 3d6k n PRO 183 N 3.56 0.14 -4.44 2.72 -0.04 -1.26 -3.99 135.00 131.70 3d6k n PRO 183 Ca 0.05 0.08 -0.24 0.00 -0.04 0.00 0.00 63.50 63.35 3d6k n PRO 183 Cb 0.36 -1.63 -0.17 0.00 -0.04 0.00 0.00 33.50 32.03 3d6k n PRO 183 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3d6k s VAL 184 N -3.07 0.99 -1.36 0.52 1.01 -1.26 -0.39 120.40 116.84 3d6k s VAL 184 Ca 0.11 -0.38 -0.08 0.00 0.00 0.00 0.00 61.98 61.63 3d6k s VAL 184 Cb 0.15 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.61 3d6k s VAL 184 CO 0.63 0.33 0.44 0.49 0.00 0.00 0.00 175.10 176.99 3d6k n PHE 185 N 3.95 -1.60 -1.76 5.22 3.72 -1.14 -4.24 117.46 121.61 3d6k n PHE 185 Ca -0.23 0.60 -0.42 0.00 -0.05 0.00 0.00 57.45 57.36 3d6k n PHE 185 Cb 0.51 -3.43 -0.02 0.00 -0.94 0.00 0.00 39.48 35.61 3d6k n PHE 185 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3d6k s GLY 186 N -4.12 2.04 -0.20 1.37 0.00 -0.34 -4.46 107.32 101.60 3d6k s GLY 186 Ca 0.14 1.59 -0.29 0.00 0.00 0.00 0.00 44.72 46.16 3d6k s GLY 186 CO 0.91 2.59 1.27 0.21 0.00 0.00 0.00 173.10 178.08 3d6k s ASN 187 N 0.55 6.88 0.00 1.64 2.47 -1.26 0.14 114.94 125.35 3d6k s ASN 187 Ca 0.64 1.55 0.16 0.00 0.42 0.00 0.00 52.86 55.63 3d6k s ASN 187 Cb -0.48 -2.54 0.28 0.00 -1.45 0.00 0.00 41.25 37.06 3d6k s ASN 187 CO 0.47 -0.85 1.19 -0.81 -3.72 0.00 0.00 177.10 173.38 3d6k n PRO 188 N 6.79 1.98 0.21 0.43 -0.04 -1.26 -3.67 135.00 139.44 3d6k n PRO 188 Ca 0.14 -1.86 0.10 0.00 -0.04 0.00 0.00 63.50 61.83 3d6k n PRO 188 Cb 0.45 -1.36 0.24 0.00 -0.04 0.00 0.00 33.50 32.80 3d6k n PRO 188 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3d6k h THR 189 N 3.15 0.32 0.00 0.52 1.35 -0.90 -3.25 112.91 114.09 3d6k h THR 189 Ca 0.00 -1.28 0.00 0.00 -0.55 0.00 0.00 66.41 64.58 3d6k h THR 189 Cb 0.76 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 69.19 3d6k h THR 189 CO 0.00 0.17 0.00 0.61 -0.25 0.00 0.00 175.52 176.05 3d6k n GLY 190 N 0.85 2.61 3.79 5.82 0.00 0.37 -4.75 105.19 113.87 3d6k n GLY 190 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 3d6k n GLY 190 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d6k s VAL 191 N -2.45 3.46 -0.15 1.61 -7.23 -1.26 -3.72 120.40 110.67 3d6k s VAL 191 Ca 0.00 0.90 0.01 0.00 -1.81 0.00 0.00 61.98 61.08 3d6k s VAL 191 Cb 0.00 -3.36 -0.00 0.00 0.56 0.00 0.00 36.38 33.58 3d6k s VAL 191 CO 0.00 -0.21 -0.16 -0.89 -0.31 0.00 0.00 175.10 173.53 3d6k s THR 192 N -1.89 2.61 0.32 5.32 2.01 -1.26 -1.20 115.64 121.54 3d6k s THR 192 Ca 0.70 -0.79 -0.29 0.00 0.31 0.00 0.00 61.69 61.61 3d6k s THR 192 Cb -0.20 -2.09 -0.11 0.00 0.01 0.00 0.00 72.50 70.11 3d6k s THR 192 CO 0.24 0.52 1.47 -0.36 -0.69 0.00 0.00 174.62 175.80 3d6k s PHE 193 N 0.75 2.82 0.80 4.92 2.99 0.47 -4.61 117.98 126.11 3d6k s PHE 193 Ca -0.07 1.08 -0.11 0.00 0.00 0.00 0.00 56.93 57.84 3d6k s PHE 193 Cb -0.16 -3.92 0.07 0.00 0.00 0.00 0.00 43.02 39.02 3d6k s PHE 193 CO 0.01 -2.85 1.11 -1.54 -0.00 0.00 0.00 175.22 171.96 3d6k s SER 194 N 0.08 4.12 0.27 1.36 1.04 -0.36 -4.79 113.70 115.42 3d6k s SER 194 Ca 0.56 1.97 0.00 0.00 0.48 0.00 0.00 55.95 58.96 3d6k s SER 194 Cb -0.44 -2.54 0.53 0.00 0.10 0.00 0.00 66.02 63.67 3d6k s SER 194 CO 0.52 -2.30 1.81 -0.08 0.98 0.00 0.00 173.24 174.18 3d6k h GLU 195 N -1.16 0.83 -0.24 4.02 4.81 -1.93 0.27 114.58 121.17 3d6k h GLU 195 Ca -0.44 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 58.78 3d6k h GLU 195 Cb 1.25 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 30.40 3d6k h GLU 195 CO 0.49 0.55 -0.01 0.37 -0.73 0.00 0.00 179.01 179.67 3d6k h GLN 196 N 0.85 0.06 -0.23 1.92 4.15 -1.95 0.87 115.11 120.78 3d6k h GLN 196 Ca 0.48 -0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.86 3d6k h GLN 196 Cb 0.54 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.21 3d6k h GLN 196 CO -0.29 0.04 0.01 1.15 -1.93 0.00 0.00 178.83 177.80 3d6k h THR 197 N 0.06 1.25 -0.70 2.39 2.02 -1.65 -0.75 112.91 115.53 3d6k h THR 197 Ca 0.12 -0.87 0.13 0.00 0.77 0.00 0.00 66.41 66.56 3d6k h THR 197 Cb 0.16 1.37 -0.09 0.00 -1.74 0.00 0.00 68.15 67.85 3d6k h THR 197 CO -0.21 0.27 0.23 0.00 0.37 0.00 0.00 175.52 176.18 3d6k h ARG 199 N 0.36 0.55 -0.43 0.00 3.08 -0.39 -2.75 114.38 114.80 3d6k h ARG 199 Ca 0.38 -0.26 0.05 0.00 0.07 0.00 0.00 59.98 60.22 3d6k h ARG 199 Cb 0.58 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.58 3d6k h ARG 199 CO -0.42 0.83 0.17 0.93 -1.07 0.00 0.00 179.97 180.41 3d6k h GLU 200 N 0.27 0.34 -0.03 0.04 5.08 -0.92 -0.15 114.58 119.21 3d6k h GLU 200 Ca 0.05 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 3d6k h GLU 200 Cb 0.68 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 3d6k h GLU 200 CO 0.04 0.22 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.11 3d6k h LEU 201 N 0.35 0.04 0.01 1.33 3.38 -1.19 -1.99 115.31 117.23 3d6k h LEU 201 Ca 0.20 -0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.92 3d6k h LEU 201 Cb 0.17 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3d6k h LEU 201 CO -0.19 0.15 -1.09 0.00 0.09 0.00 0.00 178.44 177.40 3d6k h ALA 202 N 1.86 0.26 -0.23 1.53 0.00 -1.14 -3.49 119.26 118.04 3d6k h ALA 202 Ca 0.01 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.06 3d6k h ALA 202 Cb 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3d6k h ALA 202 CO 0.01 1.05 0.00 0.39 0.00 0.00 0.00 179.25 180.71 3d6k n GLU 203 N -3.50 1.73 -5.13 0.00 1.02 -0.11 -4.63 120.64 110.03 3d6k n GLU 203 Ca -0.05 -0.92 -0.32 0.00 -0.02 0.00 0.00 57.16 55.86 3d6k n GLU 203 Cb 0.96 -1.32 -0.15 0.00 -0.02 0.00 0.00 31.44 30.90 3d6k n GLU 203 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3d6k s SER 205 N -0.83 3.42 0.06 1.62 1.04 -1.26 -4.99 113.70 112.77 3d6k s SER 205 Ca 0.17 -0.39 0.08 0.00 0.48 0.00 0.00 55.95 56.29 3d6k s SER 205 Cb 0.10 -0.75 -0.03 0.00 0.10 0.00 0.00 66.02 65.43 3d6k s SER 205 CO 0.10 0.29 -0.19 0.42 0.98 0.00 0.00 173.24 174.84 3d6k s THR 206 N -0.43 2.71 0.14 2.02 -4.23 -1.26 -4.73 115.64 109.86 3d6k s THR 206 Ca 0.04 -1.32 -0.08 0.00 -1.18 0.00 0.00 61.69 59.16 3d6k s THR 206 Cb -0.12 -2.16 -0.11 0.00 1.34 0.00 0.00 72.50 71.45 3d6k s THR 206 CO 0.01 0.27 1.40 0.00 -0.54 0.00 0.00 174.62 175.76 3d6k h ALA 207 N 4.33 0.48 -2.50 3.99 0.00 -1.51 -3.42 119.26 120.63 3d6k h ALA 207 Ca -0.48 -0.57 -0.53 0.00 0.00 0.00 0.00 54.91 53.33 3d6k h ALA 207 Cb 1.16 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.91 3d6k h ALA 207 CO 0.46 0.70 0.74 0.00 0.00 0.00 0.00 179.25 181.15 3d6k s ALA 208 N -3.85 3.57 -0.43 0.00 0.00 -1.26 -4.83 121.76 114.95 3d6k s ALA 208 Ca -0.09 1.03 0.26 0.00 0.00 0.00 0.00 51.96 53.16 3d6k s ALA 208 Cb 0.10 -3.54 0.97 0.00 0.00 0.00 0.00 23.12 20.65 3d6k s ALA 208 CO 0.88 -0.67 1.77 -1.00 0.00 0.00 0.00 175.76 176.73 3d6k h PRO 209 N 7.08 0.00 0.00 0.00 0.13 -1.89 -3.22 132.00 134.11 3d6k h PRO 209 Ca -0.41 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.72 3d6k h PRO 209 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 3d6k h PRO 209 CO 0.87 0.00 -0.06 -0.40 -0.23 0.00 0.00 178.00 178.18 3d6k n ASP 210 N -2.45 2.21 -4.59 1.44 5.75 -1.26 -4.84 116.55 112.80 3d6k n ASP 210 Ca 0.03 -3.10 -0.53 0.00 -0.01 0.00 0.00 54.79 51.17 3d6k n ASP 210 Cb 0.31 -0.43 -0.06 0.00 -1.03 0.00 0.00 41.12 39.91 3d6k n ASP 210 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 3d6k n PHE 211 N -1.35 1.47 -5.07 2.11 7.35 -1.22 -4.91 117.46 115.84 3d6k n PHE 211 Ca 0.16 0.68 -0.29 0.00 -0.76 0.00 0.00 57.45 57.23 3d6k n PHE 211 Cb 0.65 -2.32 -0.16 0.00 0.35 0.00 0.00 39.48 38.00 3d6k n PHE 211 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 3d6k s ARG 212 N 0.69 2.14 -0.27 -4.13 1.81 -0.57 -4.62 118.95 114.00 3d6k s ARG 212 Ca 0.86 -0.77 -0.08 0.00 -1.72 0.00 0.00 55.73 54.02 3d6k s ARG 212 Cb -1.00 -1.86 -0.02 0.00 -0.45 0.00 0.00 34.95 31.62 3d6k s ARG 212 CO 0.50 0.34 0.09 0.42 -0.68 0.00 0.00 175.30 175.97 3d6k s ILE 213 N -0.13 4.40 -0.61 1.52 1.01 0.11 -4.12 121.20 123.40 3d6k s ILE 213 Ca -0.02 -0.24 -0.28 0.00 0.00 0.00 0.00 60.65 60.11 3d6k s ILE 213 Cb -0.12 -3.12 0.02 0.00 0.01 0.00 0.00 42.46 39.25 3d6k s ILE 213 CO 0.02 0.26 1.38 -0.69 0.00 0.00 0.00 174.94 175.91 3d6k s VAL 214 N 1.62 3.78 -1.27 2.92 1.01 -1.26 -1.68 120.40 125.52 3d6k s VAL 214 Ca 0.06 0.63 -0.12 0.00 0.00 0.00 0.00 61.98 62.54 3d6k s VAL 214 Cb -0.16 -4.56 0.15 0.00 0.00 0.00 0.00 36.38 31.82 3d6k s VAL 214 CO 0.05 -1.33 1.71 1.87 0.00 0.00 0.00 175.10 177.39 3d6k n TRP 215 N 9.54 3.97 -2.48 5.22 -0.00 0.62 -1.41 117.44 132.90 3d6k n TRP 215 Ca 0.10 -3.05 -0.39 0.00 -0.00 0.00 0.00 57.50 54.16 3d6k n TRP 215 Cb 0.49 -2.15 -0.03 0.00 -0.00 0.00 0.00 31.31 29.63 3d6k n TRP 215 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 3d6k s ASP 216 N 2.11 6.35 -1.19 5.87 -1.08 -0.69 -4.38 116.67 123.65 3d6k s ASP 216 Ca 0.43 -1.67 -0.07 0.00 -0.52 0.00 0.00 52.55 50.72 3d6k s ASP 216 Cb 0.04 -2.57 -0.01 0.00 -1.46 0.00 0.00 42.92 38.92 3d6k s ASP 216 CO 0.00 -1.65 2.79 -3.20 0.52 0.00 0.00 175.17 173.63 3d6k n ASN 217 N 9.68 7.85 0.28 -0.34 2.85 -1.26 -4.20 115.26 130.12 3d6k n ASN 217 Ca 0.39 -2.86 0.13 0.00 -0.11 0.00 0.00 54.58 52.14 3d6k n ASN 217 Cb 0.49 -1.43 0.81 0.00 1.24 0.00 0.00 39.78 40.89 3d6k n ASN 217 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3d6k h ALA 218 N 4.39 1.54 0.00 5.20 0.00 -1.88 -3.01 119.26 125.50 3d6k h ALA 218 Ca 0.68 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.52 3d6k h ALA 218 Cb 0.48 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 3d6k h ALA 218 CO 1.39 0.05 -0.60 0.66 0.00 0.00 0.00 179.25 180.75 3d6k n TYR 219 N -3.92 0.00 0.04 0.00 4.01 -1.26 -4.75 117.16 111.28 3d6k n TYR 219 Ca -0.03 -1.31 0.20 0.00 -0.16 0.00 0.00 57.90 56.60 3d6k n TYR 219 Cb 0.13 -0.23 0.71 0.00 -0.31 0.00 0.00 39.34 39.65 3d6k n TYR 219 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3d6k h ALA 220 N 1.00 2.36 -0.04 -0.72 0.00 -1.79 -1.75 119.26 118.31 3d6k h ALA 220 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3d6k h ALA 220 Cb 1.17 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3d6k h ALA 220 CO 0.02 -0.61 0.00 1.28 0.00 0.00 0.00 179.25 179.94 3d6k n LEU 221 N -4.22 1.69 -2.99 0.00 4.32 -1.26 -4.58 117.00 109.96 3d6k n LEU 221 Ca 0.08 -1.44 -0.34 0.00 -0.02 0.00 0.00 56.01 54.29 3d6k n LEU 221 Cb 0.57 -0.03 -0.02 0.00 -1.62 0.00 0.00 43.42 42.32 3d6k n LEU 221 CO 0.34 0.41 1.84 1.41 -1.22 0.00 0.00 177.39 180.17 3d6k n HIS 222 N -0.00 2.21 -1.61 -1.77 8.25 -0.66 -4.93 115.22 116.70 3d6k n HIS 222 Ca 0.02 -2.34 -0.33 0.00 -0.26 0.00 0.00 57.72 54.81 3d6k n HIS 222 Cb 0.17 -1.49 0.06 0.00 1.12 0.00 0.00 29.99 29.85 3d6k n HIS 222 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3d6k s THR 223 N -2.44 3.19 -0.26 1.59 -1.32 -1.26 -1.56 115.64 113.57 3d6k s THR 223 Ca 0.54 0.51 0.22 0.00 -1.21 0.00 0.00 61.69 61.76 3d6k s THR 223 Cb 0.30 -3.02 -0.25 0.00 -1.51 0.00 0.00 72.50 68.03 3d6k s THR 223 CO -0.19 -0.38 0.69 0.18 -2.21 0.00 0.00 174.62 172.70 3d6k n LEU 224 N -2.71 0.33 0.00 9.08 4.77 -0.58 -4.28 117.00 123.62 3d6k n LEU 224 Ca 0.10 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3d6k n LEU 224 Cb 0.52 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3d6k n LEU 224 CO 0.49 0.01 0.00 -1.54 -1.33 0.00 0.00 177.39 175.02 3d6k n SER 225 N -2.18 0.12 -0.03 -1.43 3.41 -1.26 -4.59 113.62 107.66 3d6k n SER 225 Ca -0.02 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.71 3d6k n SER 225 Cb 0.52 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.64 3d6k n SER 225 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3d6k n ASP 226 N 0.00 0.68 -4.42 4.04 8.00 -1.26 -4.93 116.55 118.65 3d6k n ASP 226 Ca 0.00 -0.49 -0.32 0.00 0.71 0.00 0.00 54.79 54.69 3d6k n ASP 226 Cb 0.00 0.42 -0.14 0.00 -0.02 0.00 0.00 41.12 41.38 3d6k n ASP 226 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3d6k s GLU 227 N -2.96 2.30 0.12 -1.24 -1.05 -1.26 -5.11 118.70 109.50 3d6k s GLU 227 Ca 0.11 -0.82 -0.10 0.00 -0.15 0.00 0.00 54.97 54.01 3d6k s GLU 227 Cb 0.17 -2.24 -0.06 0.00 -0.44 0.00 0.00 34.13 31.56 3d6k s GLU 227 CO 0.72 0.59 0.44 -0.06 0.95 0.00 0.00 175.26 177.90 3d6k s PHE 228 N -0.74 3.55 0.58 4.83 0.08 -1.26 -4.73 117.98 120.29 3d6k s PHE 228 Ca 0.12 0.80 -0.16 0.00 0.12 0.00 0.00 56.93 57.81 3d6k s PHE 228 Cb -0.10 -2.18 -0.04 0.00 -0.57 0.00 0.00 43.02 40.12 3d6k s PHE 228 CO 0.01 0.46 1.05 -1.25 -0.10 0.00 0.00 175.22 175.39 3d6k s PRO 229 N -2.16 3.41 0.13 0.24 0.04 -1.26 -5.00 135.00 130.40 3d6k s PRO 229 Ca 0.37 1.18 -0.31 0.00 0.04 0.00 0.00 61.00 62.28 3d6k s PRO 229 Cb -0.13 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.28 3d6k s PRO 229 CO 0.20 -0.73 1.35 -1.50 0.04 0.00 0.00 177.00 176.35 3d6k s ILE 230 N -2.45 3.38 -0.53 0.56 1.10 -1.26 -4.98 121.20 117.02 3d6k s ILE 230 Ca 0.63 1.01 -0.22 0.00 -0.51 0.00 0.00 60.65 61.57 3d6k s ILE 230 Cb -0.15 -3.65 0.05 0.00 0.15 0.00 0.00 42.46 38.86 3d6k s ILE 230 CO 0.36 0.09 0.78 -0.69 -2.11 0.00 0.00 174.94 173.37 3d6k s VAL 231 N 0.89 4.63 -0.04 4.00 1.01 -1.26 -5.03 120.40 124.61 3d6k s VAL 231 Ca 0.62 -0.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.21 3d6k s VAL 231 Cb -0.36 -4.41 -0.05 0.00 0.00 0.00 0.00 36.38 31.56 3d6k s VAL 231 CO 0.32 -0.95 1.50 -1.00 0.00 0.00 0.00 175.10 174.97 3d6k s HIS 232 N 3.29 2.48 -1.18 5.22 3.76 -1.26 -4.91 115.29 122.68 3d6k s HIS 232 Ca 0.23 0.56 -0.21 0.00 -0.15 0.00 0.00 55.06 55.49 3d6k s HIS 232 Cb -0.16 -3.76 -0.05 0.00 1.11 0.00 0.00 32.58 29.72 3d6k s HIS 232 CO 0.16 -3.01 1.89 -1.71 -0.85 0.00 0.00 174.74 171.23 3d6k n ASN 233 N 6.26 3.55 0.27 1.40 2.85 -1.26 -4.74 115.26 123.59 3d6k n ASN 233 Ca 0.15 -2.76 0.12 0.00 -0.11 0.00 0.00 54.58 51.97 3d6k n ASN 233 Cb 0.43 -1.66 0.76 0.00 1.24 0.00 0.00 39.78 40.54 3d6k n ASN 233 CO 0.00 0.00 0.00 -0.37 -2.11 0.00 0.00 177.26 174.78 3d6k h VAL 234 N 5.69 0.71 -0.51 3.44 -1.51 -1.94 -1.63 116.25 120.49 3d6k h VAL 234 Ca 0.32 -0.25 -0.03 0.00 -1.23 0.00 0.00 66.70 65.51 3d6k h VAL 234 Cb 0.87 1.15 -0.02 0.00 -2.13 0.00 0.00 31.29 31.16 3d6k h VAL 234 CO 1.41 0.06 0.22 0.40 -1.23 0.00 0.00 177.57 178.43 3d6k h ILE 235 N 0.00 1.21 0.00 7.19 2.04 -1.94 0.24 117.51 126.25 3d6k h ILE 235 Ca -0.00 -0.64 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 3d6k h ILE 235 Cb 0.15 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3d6k h ILE 235 CO 0.01 0.24 -0.45 1.05 0.00 0.00 0.00 178.15 179.00 3d6k h GLU 236 N 0.69 0.00 -0.42 2.37 -0.00 -1.82 -0.37 114.58 115.03 3d6k h GLU 236 Ca 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.51 3d6k h GLU 236 Cb 0.18 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 28.91 3d6k h GLU 236 CO -0.02 0.45 0.18 0.74 -0.00 0.00 0.00 179.01 180.37 3d6k h PHE 237 N 0.00 0.62 0.30 2.06 0.04 -0.85 -1.86 116.94 117.24 3d6k h PHE 237 Ca -0.00 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.73 3d6k h PHE 237 Cb 1.21 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 39.16 3d6k h PHE 237 CO 0.00 0.53 -0.30 0.00 -0.60 0.00 0.00 178.31 177.94 3d6k h ALA 238 N 1.03 -0.63 -0.44 2.45 0.00 -0.16 -1.60 119.26 119.92 3d6k h ALA 238 Ca 0.14 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.04 3d6k h ALA 238 Cb 0.16 0.43 -0.08 0.00 0.00 0.00 0.00 17.79 18.30 3d6k h ALA 238 CO -0.01 -0.89 -0.07 1.96 0.00 0.00 0.00 179.25 180.24 3d6k h GLN 239 N -0.63 0.04 0.00 0.00 4.20 -1.02 -0.26 115.11 117.44 3d6k h GLN 239 Ca -0.01 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 3d6k h GLN 239 Cb 0.58 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.35 3d6k h GLN 239 CO -0.06 0.02 0.00 0.00 -0.67 0.00 0.00 178.83 178.12 3d6k n ALA 240 N -2.70 1.59 0.79 3.87 0.00 -0.70 -2.43 120.51 120.93 3d6k n ALA 240 Ca 0.03 0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.59 3d6k n ALA 240 Cb 0.24 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 3d6k n ALA 240 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d6k n ALA 241 N -1.65 3.54 -0.28 0.00 0.00 -0.24 -4.97 120.51 116.92 3d6k n ALA 241 Ca 0.02 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.92 3d6k n ALA 241 Cb 0.18 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 19.01 3d6k n ALA 241 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d6k n GLY 242 N 1.27 0.81 2.74 0.00 0.00 -0.81 -4.93 105.19 104.27 3d6k n GLY 242 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 3d6k n GLY 242 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3d6k n ASN 243 N 0.00 3.79 0.25 1.61 3.02 -0.44 -4.95 115.26 118.54 3d6k n ASN 243 Ca 0.00 -3.54 0.11 0.00 -0.03 0.00 0.00 54.58 51.11 3d6k n ASN 243 Cb 0.00 -0.56 0.67 0.00 -0.61 0.00 0.00 39.78 39.29 3d6k n ASN 243 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3d6k h PRO 244 N 2.93 0.00 -0.45 3.52 0.13 -1.83 -2.49 132.00 133.82 3d6k h PRO 244 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3d6k h PRO 244 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 3d6k h PRO 244 CO 0.76 0.13 0.00 0.09 -0.23 0.00 0.00 178.00 178.75 3d6k n ASN 245 N -3.87 3.13 0.07 1.44 5.03 -1.26 -4.37 115.26 115.44 3d6k n ASN 245 Ca -0.02 -1.95 0.00 0.00 0.87 0.00 0.00 54.58 53.48 3d6k n ASN 245 Cb 0.23 -0.29 0.31 0.00 -1.02 0.00 0.00 39.78 39.01 3d6k n ASN 245 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.26 175.34 3d6k h ARG 246 N 3.80 0.34 -5.16 3.52 2.43 -1.70 -3.44 114.38 114.18 3d6k h ARG 246 Ca 0.00 -0.09 -0.64 0.00 -0.81 0.00 0.00 59.98 58.43 3d6k h ARG 246 Cb 0.85 -0.04 -0.23 0.00 -0.42 0.00 0.00 29.97 30.13 3d6k h ARG 246 CO 0.00 0.50 -0.67 -0.06 -1.51 0.00 0.00 179.97 178.23 3d6k s PHE 247 N -4.66 3.03 -0.46 2.20 0.08 -1.26 0.10 117.98 117.00 3d6k s PHE 247 Ca -0.06 -0.46 -0.20 0.00 0.12 0.00 0.00 56.93 56.34 3d6k s PHE 247 Cb 0.15 -2.05 0.03 0.00 -0.57 0.00 0.00 43.02 40.58 3d6k s PHE 247 CO 0.75 -0.21 0.60 -1.58 -0.10 0.00 0.00 175.22 174.68 3d6k s TRP 248 N 0.87 3.07 0.22 0.36 0.51 -0.68 -4.49 118.94 118.81 3d6k s TRP 248 Ca 0.00 -0.25 0.03 0.00 -2.12 0.00 0.00 56.10 53.77 3d6k s TRP 248 Cb -0.14 -3.32 -0.03 0.00 -0.81 0.00 0.00 33.47 29.16 3d6k s TRP 248 CO 0.02 -0.89 0.36 0.12 -0.51 0.00 0.00 176.95 176.05 3d6k s PHE 249 N 2.66 3.47 0.00 -1.98 5.99 0.06 -0.28 117.98 127.91 3d6k s PHE 249 Ca 0.19 0.10 0.00 0.00 0.00 0.00 0.00 56.93 57.22 3d6k s PHE 249 Cb -0.16 -1.67 0.00 0.00 0.00 0.00 0.00 43.02 41.19 3d6k s PHE 249 CO 0.16 0.42 0.00 -1.13 -0.00 0.00 0.00 175.22 174.67 3d6k n SER 251 N -1.09 0.00 -3.60 6.13 3.41 -0.78 -0.16 113.62 117.53 3d6k n SER 251 Ca -0.07 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.47 3d6k n SER 251 Cb 0.56 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.49 3d6k n SER 251 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3d6k s SER 252 N 0.00 -0.31 -0.07 4.04 1.04 -1.26 -0.12 113.70 117.01 3d6k s SER 252 Ca 0.00 -0.17 0.16 0.00 0.48 0.00 0.00 55.95 56.43 3d6k s SER 252 Cb 0.00 0.45 0.60 0.00 0.10 0.00 0.00 66.02 67.17 3d6k s SER 252 CO 0.00 -0.78 1.49 0.35 0.98 0.00 0.00 173.24 175.28 3d6k n THR 253 N -0.35 1.39 -0.29 2.02 -2.24 -0.27 -4.69 114.28 109.85 3d6k n THR 253 Ca -0.08 -0.96 0.09 0.00 -2.27 0.00 0.00 64.05 60.83 3d6k n THR 253 Cb 0.62 0.14 0.24 0.00 -2.10 0.00 0.00 70.33 69.23 3d6k n THR 253 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3d6k h SER 254 N 3.52 0.41 -0.49 3.42 0.02 -1.84 0.26 113.55 118.85 3d6k h SER 254 Ca 0.00 0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 3d6k h SER 254 Cb 1.17 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 3d6k h SER 254 CO 0.16 0.13 0.02 0.29 -1.14 0.00 0.00 176.83 176.28 3d6k n LYS 255 N -4.95 4.18 -0.05 3.45 5.02 -1.26 -0.53 118.16 124.02 3d6k n LYS 255 Ca 0.18 -3.07 -0.09 0.00 -2.02 0.00 0.00 58.31 53.31 3d6k n LYS 255 Cb 0.50 -2.13 -0.04 0.00 -0.02 0.00 0.00 35.03 33.33 3d6k n LYS 255 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3d6k n ILE 256 N 0.19 0.57 0.00 -0.18 5.41 0.60 -5.00 119.36 120.95 3d6k n ILE 256 Ca 0.27 -0.19 0.00 0.00 1.00 0.00 0.00 62.75 63.83 3d6k n ILE 256 Cb 1.12 -1.18 0.00 0.00 -0.71 0.00 0.00 39.64 38.87 3d6k n ILE 256 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3d6k n THR 257 N -3.07 0.00 -3.84 1.39 -2.24 0.54 -4.88 114.28 102.17 3d6k n THR 257 Ca -0.19 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.23 3d6k n THR 257 Cb 0.67 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.77 3d6k n THR 257 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3d6k s HIS 258 N 1.45 3.20 -0.28 4.78 3.76 -1.26 -4.77 115.29 122.16 3d6k s HIS 258 Ca 0.00 -1.50 -0.28 0.00 -0.15 0.00 0.00 55.06 53.13 3d6k s HIS 258 Cb 0.00 -2.17 -0.05 0.00 1.11 0.00 0.00 32.58 31.46 3d6k s HIS 258 CO 0.00 -0.72 2.27 0.00 -0.85 0.00 0.00 174.74 175.43 3d6k s ALA 259 N 1.36 2.46 0.00 -1.40 0.00 0.31 -1.28 121.76 123.21 3d6k s ALA 259 Ca -0.02 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.54 3d6k s ALA 259 Cb -0.19 -4.14 0.00 0.00 0.00 0.00 0.00 23.12 18.79 3d6k s ALA 259 CO 0.00 -3.20 0.00 0.41 0.00 0.00 0.00 175.76 172.97 3d6k n GLY 260 N 5.83 1.68 1.17 0.00 0.00 -1.26 -4.91 105.19 107.69 3d6k n GLY 260 Ca 0.31 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.35 3d6k n GLY 260 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d6k n SER 261 N 0.00 1.83 -0.74 1.61 7.64 -0.40 -4.72 113.62 118.83 3d6k n SER 261 Ca 0.00 -3.19 0.00 0.00 1.01 0.00 0.00 58.87 56.69 3d6k n SER 261 Cb 0.00 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.76 3d6k n SER 261 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d6k n GLY 262 N -0.54 1.27 3.25 0.23 0.00 -1.08 -4.76 105.19 103.57 3d6k n GLY 262 Ca 0.17 -1.93 -0.32 0.00 0.00 0.00 0.00 46.02 43.94 3d6k n GLY 262 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d6k s VAL 263 N 1.55 2.12 0.01 1.61 1.01 -1.26 -3.47 120.40 121.97 3d6k s VAL 263 Ca 0.00 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 60.94 3d6k s VAL 263 Cb 0.00 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 3d6k s VAL 263 CO 0.00 0.56 0.18 -0.94 0.00 0.00 0.00 175.10 174.90 3d6k s SER 264 N 0.09 6.27 -0.05 3.32 1.04 0.23 -1.11 113.70 123.50 3d6k s SER 264 Ca -0.11 0.30 0.04 0.00 0.48 0.00 0.00 55.95 56.66 3d6k s SER 264 Cb -0.16 -1.94 -0.00 0.00 0.10 0.00 0.00 66.02 64.02 3d6k s SER 264 CO 0.06 0.24 -0.17 -0.36 0.98 0.00 0.00 173.24 173.99 3d6k s PHE 265 N -1.36 1.76 -0.17 5.02 0.40 0.83 -0.66 117.98 123.80 3d6k s PHE 265 Ca 0.29 -0.54 0.00 0.00 -0.60 0.00 0.00 56.93 56.08 3d6k s PHE 265 Cb -0.13 -1.20 0.01 0.00 0.51 0.00 0.00 43.02 42.21 3d6k s PHE 265 CO 0.21 -0.20 -0.16 0.12 0.70 0.00 0.00 175.22 175.89 3d6k s PHE 266 N 0.13 2.79 -0.03 0.36 5.36 -0.33 -1.87 117.98 124.39 3d6k s PHE 266 Ca -0.06 -1.29 0.06 0.00 -0.96 0.00 0.00 56.93 54.67 3d6k s PHE 266 Cb -0.13 -1.93 -0.01 0.00 -0.34 0.00 0.00 43.02 40.62 3d6k s PHE 266 CO 0.03 -0.63 -0.20 0.00 -1.46 0.00 0.00 175.22 172.95 3d6k s ALA 267 N 1.10 1.74 0.13 11.12 0.00 0.78 0.24 121.76 136.86 3d6k s ALA 267 Ca 0.00 -0.87 -0.12 0.00 0.00 0.00 0.00 51.96 50.98 3d6k s ALA 267 Cb -0.14 -0.48 0.04 0.00 0.00 0.00 0.00 23.12 22.54 3d6k s ALA 267 CO -0.06 0.39 0.58 0.45 0.00 0.00 0.00 175.76 177.12 3d6k n SER 268 N 2.75 -1.06 -4.70 0.00 2.88 -0.79 -0.76 113.62 111.94 3d6k n SER 268 Ca -0.16 -1.59 -0.30 0.00 -1.33 0.00 0.00 58.87 55.49 3d6k n SER 268 Cb 0.53 1.74 0.14 0.00 -0.75 0.00 0.00 64.21 65.87 3d6k n SER 268 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3d6k s SER 269 N -2.38 3.37 0.19 -3.46 1.04 -1.26 -4.74 113.70 106.45 3d6k s SER 269 Ca 0.13 1.56 -0.12 0.00 0.48 0.00 0.00 55.95 58.00 3d6k s SER 269 Cb -0.02 -2.23 0.16 0.00 0.10 0.00 0.00 66.02 64.03 3d6k s SER 269 CO 0.04 -2.72 1.80 0.11 0.98 0.00 0.00 173.24 173.45 3d6k h LYS 270 N -1.60 0.55 -0.53 4.02 1.57 -1.92 -0.88 116.57 117.78 3d6k h LYS 270 Ca -0.49 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.19 3d6k h LYS 270 Cb 1.28 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.44 3d6k h LYS 270 CO 0.53 0.36 0.06 0.93 -0.57 0.00 0.00 179.45 180.77 3d6k h GLU 271 N 0.57 0.84 -0.28 3.15 5.08 -1.97 -0.92 114.58 121.05 3d6k h GLU 271 Ca 0.24 -0.20 -0.13 0.00 -1.00 0.00 0.00 59.36 58.26 3d6k h GLU 271 Cb 0.13 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 3d6k h GLU 271 CO -0.16 0.80 -0.38 -0.91 -1.00 0.00 0.00 179.01 177.37 3d6k h ASN 272 N 0.80 0.68 -0.31 1.42 2.35 -1.79 -1.72 115.58 117.01 3d6k h ASN 272 Ca 0.16 -0.30 -0.10 0.00 -0.55 0.00 0.00 56.30 55.51 3d6k h ASN 272 Cb 0.39 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 3d6k h ASN 272 CO 0.01 0.99 -0.21 0.40 -1.65 0.00 0.00 177.43 176.97 3d6k h ILE 273 N 0.53 1.30 -0.69 2.81 2.04 -1.00 -0.81 117.51 121.69 3d6k h ILE 273 Ca 0.05 -1.35 -0.03 0.00 1.00 0.00 0.00 64.86 64.53 3d6k h ILE 273 Cb 0.90 1.49 -0.03 0.00 -0.74 0.00 0.00 36.82 38.43 3d6k h ILE 273 CO 0.08 0.44 0.33 -0.33 0.00 0.00 0.00 178.15 178.66 3d6k h GLU 274 N 0.45 1.00 0.16 2.37 5.08 -1.18 -0.68 114.58 121.78 3d6k h GLU 274 Ca 0.06 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3d6k h GLU 274 Cb 0.76 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 3d6k h GLU 274 CO 0.06 0.80 -0.19 2.35 -1.00 0.00 0.00 179.01 181.02 3d6k h TRP 275 N 0.97 -0.50 -0.48 4.33 7.01 -1.23 -1.67 115.95 124.38 3d6k h TRP 275 Ca 0.24 0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.34 3d6k h TRP 275 Cb 0.13 0.20 -0.10 0.00 -2.10 0.00 0.00 29.16 27.29 3d6k h TRP 275 CO 0.01 -0.28 -0.16 -0.92 -2.79 0.00 0.00 178.44 174.30 3d6k h TYR 276 N -0.40 -0.36 -0.68 2.65 3.20 -1.01 -2.53 116.97 117.84 3d6k h TYR 276 Ca 0.01 0.05 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 3d6k h TYR 276 Cb 0.39 0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.86 3d6k h TYR 276 CO -0.16 -0.24 0.30 0.00 -1.64 0.00 0.00 178.16 176.41 3d6k h ALA 277 N 1.39 1.25 0.00 1.82 0.00 -1.02 0.00 119.26 122.70 3d6k h ALA 277 Ca 0.23 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3d6k h ALA 277 Cb 0.40 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3d6k h ALA 277 CO -0.52 0.56 -0.02 0.66 0.00 0.00 0.00 179.25 179.93 3d6k h SER 278 N 0.97 0.00 0.04 0.00 4.64 -0.86 0.16 113.55 118.49 3d6k h SER 278 Ca 0.23 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.31 3d6k h SER 278 Cb 0.14 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 3d6k h SER 278 CO -0.03 0.02 -1.30 0.45 -0.87 0.00 0.00 176.83 175.10 3d6k h HIS 279 N 0.00 0.14 -0.78 4.77 -0.00 -1.31 -3.38 115.15 114.59 3d6k h HIS 279 Ca -0.00 -0.10 0.14 0.00 -0.00 0.00 0.00 60.37 60.41 3d6k h HIS 279 Cb 0.04 -0.01 -0.05 0.00 -0.00 0.00 0.00 27.41 27.39 3d6k h HIS 279 CO 0.00 1.51 0.52 0.00 -0.00 0.00 0.00 177.93 179.96 3d6k h ALA 280 N -0.31 2.01 -0.14 2.45 0.00 -0.90 0.58 119.26 122.94 3d6k h ALA 280 Ca -0.33 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 3d6k h ALA 280 Cb 1.46 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 3d6k h ALA 280 CO -0.11 -0.21 0.08 -0.97 0.00 0.00 0.00 179.25 178.04 3d6k h ASN 281 N 0.51 0.17 0.17 0.00 -1.24 -0.86 -0.97 115.58 113.37 3d6k h ASN 281 Ca 0.38 -0.01 -0.27 0.00 0.71 0.00 0.00 56.30 57.12 3d6k h ASN 281 Cb 0.76 -0.04 0.02 0.00 0.73 0.00 0.00 38.32 39.79 3d6k h ASN 281 CO -0.14 0.13 -1.27 0.58 -1.29 0.00 0.00 177.43 175.44 3d6k h VAL 282 N 0.20 1.26 -0.40 2.57 2.07 -1.08 -3.34 116.25 117.52 3d6k h VAL 282 Ca 0.05 -2.55 -0.01 0.00 0.82 0.00 0.00 66.70 65.02 3d6k h VAL 282 Cb -0.00 2.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.73 3d6k h VAL 282 CO -0.01 0.76 0.20 -0.09 0.02 0.00 0.00 177.57 178.45 3d6k h ARG 283 N -0.15 0.55 -1.93 1.57 2.43 -0.97 -3.47 114.38 112.42 3d6k h ARG 283 Ca -0.24 -0.05 0.25 0.00 -0.81 0.00 0.00 59.98 59.13 3d6k h ARG 283 Cb 1.88 -0.11 -0.10 0.00 -0.42 0.00 0.00 29.97 31.22 3d6k h ARG 283 CO 0.17 0.42 0.66 0.20 -1.51 0.00 0.00 179.97 179.91 3d6k s GLY 284 N -3.72 -0.30 0.14 2.80 0.00 -0.40 -5.01 107.32 100.83 3d6k s GLY 284 Ca -0.08 0.36 0.07 0.00 0.00 0.00 0.00 44.72 45.07 3d6k s GLY 284 CO 0.74 0.29 1.33 -2.22 0.00 0.00 0.00 173.10 173.25 3d6k h ILE 285 N 2.00 1.66 0.00 0.90 2.04 -1.82 -3.38 117.51 118.91 3d6k h ILE 285 Ca -0.27 -3.18 0.00 0.00 1.00 0.00 0.00 64.86 62.40 3d6k h ILE 285 Cb 1.22 2.73 0.00 0.00 -0.74 0.00 0.00 36.82 40.03 3d6k h ILE 285 CO 0.27 0.91 0.00 0.61 0.00 0.00 0.00 178.15 179.94 3d6k n GLY 286 N 1.17 -0.83 1.77 5.37 0.00 -1.26 -4.08 105.19 107.32 3d6k n GLY 286 Ca -0.01 -1.66 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 3d6k n GLY 286 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d6k n PRO 287 N -1.53 -0.53 -2.47 1.61 -0.04 -1.26 -4.95 135.00 125.82 3d6k n PRO 287 Ca 0.00 -0.97 -0.41 0.00 -0.04 0.00 0.00 63.50 62.08 3d6k n PRO 287 Cb 0.00 -0.61 -0.03 0.00 -0.04 0.00 0.00 33.50 32.83 3d6k n PRO 287 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 3d6k s ASN 288 N -3.21 6.10 0.29 3.54 3.84 -1.26 -4.87 114.94 119.38 3d6k s ASN 288 Ca 0.34 -0.16 0.13 0.00 0.21 0.00 0.00 52.86 53.38 3d6k s ASN 288 Cb -0.01 -2.55 0.40 0.00 -0.55 0.00 0.00 41.25 38.54 3d6k s ASN 288 CO 0.24 -1.82 1.62 0.11 -2.79 0.00 0.00 177.10 174.45 3d6k h LYS 289 N 10.65 0.00 -0.24 0.43 1.57 -1.93 -3.17 116.57 123.88 3d6k h LYS 289 Ca -0.27 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.37 3d6k h LYS 289 Cb 1.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 3d6k h LYS 289 CO 1.24 0.56 -0.42 -0.07 -0.57 0.00 0.00 179.45 180.20 3d6k h LEU 290 N 0.00 0.62 -0.43 2.94 3.38 -1.90 -2.08 115.31 117.84 3d6k h LEU 290 Ca -0.01 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 3d6k h LEU 290 Cb 1.10 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 3d6k h LEU 290 CO 0.07 0.96 0.02 -1.13 0.09 0.00 0.00 178.44 178.45 3d6k h ASN 291 N 0.48 0.72 -0.63 -0.43 -1.24 -1.95 -2.28 115.58 110.25 3d6k h ASN 291 Ca 0.04 -0.30 0.04 0.00 0.71 0.00 0.00 56.30 56.79 3d6k h ASN 291 Cb 0.93 -0.19 -0.05 0.00 0.73 0.00 0.00 38.32 39.74 3d6k h ASN 291 CO 0.08 0.84 0.37 1.56 -1.29 0.00 0.00 177.43 179.00 3d6k h GLN 292 N 0.58 0.69 0.26 6.67 4.20 -1.50 -1.85 115.11 124.16 3d6k h GLN 292 Ca 0.12 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 3d6k h GLN 292 Cb 0.46 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 3d6k h GLN 292 CO 0.02 0.46 -0.16 1.25 -0.67 0.00 0.00 178.83 179.73 3d6k h LEU 293 N 0.71 -0.40 -0.70 1.46 5.85 -1.35 -0.17 115.31 120.71 3d6k h LEU 293 Ca 0.27 0.03 0.15 0.00 0.84 0.00 0.00 57.88 59.16 3d6k h LEU 293 Cb 0.09 0.12 -0.10 0.00 0.37 0.00 0.00 40.66 41.13 3d6k h LEU 293 CO -0.14 -0.26 0.15 0.00 -0.34 0.00 0.00 178.44 177.86 3d6k h ALA 294 N 0.33 0.87 -0.47 1.25 0.00 -1.29 0.30 119.26 120.24 3d6k h ALA 294 Ca -0.02 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3d6k h ALA 294 Cb 0.34 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3d6k h ALA 294 CO 0.02 -0.34 0.12 0.45 0.00 0.00 0.00 179.25 179.51 3d6k h HIS 295 N 0.25 0.78 -0.66 0.00 3.86 -1.09 0.17 115.15 118.47 3d6k h HIS 295 Ca 0.39 -0.09 -0.08 0.00 -1.16 0.00 0.00 60.37 59.43 3d6k h HIS 295 Cb 0.64 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.86 3d6k h HIS 295 CO -0.27 0.71 0.11 0.00 0.86 0.00 0.00 177.93 179.33 3d6k h ALA 296 N 0.98 0.88 -0.60 2.45 0.00 -0.18 -1.44 119.26 121.34 3d6k h ALA 296 Ca 0.15 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 3d6k h ALA 296 Cb 0.32 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3d6k h ALA 296 CO 0.00 0.64 -0.02 1.96 0.00 0.00 0.00 179.25 181.83 3d6k h GLN 297 N 1.01 1.08 -0.27 0.00 4.20 -0.23 -2.15 115.11 118.75 3d6k h GLN 297 Ca 0.20 -0.36 -0.05 0.00 0.06 0.00 0.00 58.65 58.50 3d6k h GLN 297 Cb 0.44 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 3d6k h GLN 297 CO 0.01 1.06 -0.03 0.35 -0.67 0.00 0.00 178.83 179.55 3d6k h PHE 298 N 0.98 0.56 -0.12 2.96 3.04 -0.61 -3.10 116.94 120.64 3d6k h PHE 298 Ca 0.17 -0.11 -0.17 0.00 3.98 0.00 0.00 57.97 61.84 3d6k h PHE 298 Cb 0.59 -0.14 -0.01 0.00 2.56 0.00 0.00 35.95 38.95 3d6k h PHE 298 CO 0.04 0.68 -0.63 0.74 -2.02 0.00 0.00 178.31 177.13 3d6k h PHE 299 N 0.28 0.56 0.00 0.41 0.05 -1.30 -3.47 116.94 113.46 3d6k h PHE 299 Ca 0.07 -0.22 0.00 0.00 3.82 0.00 0.00 57.97 61.64 3d6k h PHE 299 Cb 0.48 -0.10 0.00 0.00 2.00 0.00 0.00 35.95 38.33 3d6k h PHE 299 CO 0.04 0.94 0.00 0.41 -0.18 0.00 0.00 178.31 179.53 3d6k n GLY 300 N 0.36 1.85 3.45 -1.45 0.00 -0.81 -3.57 105.19 105.03 3d6k n GLY 300 Ca -0.03 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 3d6k n GLY 300 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3d6k n ASP 301 N 3.95 -1.88 -0.29 1.61 3.85 -1.26 -4.94 116.55 117.59 3d6k n ASP 301 Ca 0.00 -2.62 -0.02 0.00 -0.71 0.00 0.00 54.79 51.45 3d6k n ASP 301 Cb 0.00 3.23 0.11 0.00 -1.35 0.00 0.00 41.12 43.11 3d6k n ASP 301 CO 0.00 0.00 0.00 0.58 -1.01 0.00 0.00 177.20 176.77 3d6k h VAL 302 N 1.95 1.10 -0.74 2.12 2.07 -1.86 -1.74 116.25 119.15 3d6k h VAL 302 Ca -0.30 -0.34 0.13 0.00 0.82 0.00 0.00 66.70 67.02 3d6k h VAL 302 Cb 1.16 0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 3d6k h VAL 302 CO 0.39 0.18 0.49 0.00 0.02 0.00 0.00 177.57 178.65 3d6k h ALA 303 N 1.35 2.02 0.16 1.67 0.00 -1.96 -0.41 119.26 122.10 3d6k h ALA 303 Ca 0.33 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 55.01 3d6k h ALA 303 Cb 0.05 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.78 3d6k h ALA 303 CO -0.13 -0.21 -1.04 0.78 0.00 0.00 0.00 179.25 178.65 3d6k h GLY 304 N 0.48 0.40 -0.01 0.00 0.00 -1.47 -1.80 103.07 100.67 3d6k h GLY 304 Ca 0.36 -1.02 0.09 0.00 0.00 0.00 0.00 47.33 46.76 3d6k h GLY 304 CO -0.12 0.89 -0.20 -2.00 0.00 0.00 0.00 176.54 175.11 3d6k h LEU 305 N -0.25 -0.70 -0.72 3.11 5.85 -1.01 -0.94 115.31 120.66 3d6k h LEU 305 Ca -0.19 0.16 -0.08 0.00 0.84 0.00 0.00 57.88 58.60 3d6k h LEU 305 Cb 1.78 0.37 -0.02 0.00 0.37 0.00 0.00 40.66 43.16 3d6k h LEU 305 CO 0.17 -0.23 0.05 0.11 -0.34 0.00 0.00 178.44 178.20 3d6k h LYS 306 N -0.13 1.04 -0.65 1.25 1.57 -1.10 -2.46 116.57 116.09 3d6k h LYS 306 Ca 0.20 -0.29 0.09 0.00 -1.87 0.00 0.00 60.65 58.77 3d6k h LYS 306 Cb 0.44 -0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.56 3d6k h LYS 306 CO -0.49 0.98 0.29 0.00 -0.57 0.00 0.00 179.45 179.67 3d6k h ALA 307 N 1.08 0.86 0.00 3.86 0.00 -1.07 -1.46 119.26 122.53 3d6k h ALA 307 Ca 0.18 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3d6k h ALA 307 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3d6k h ALA 307 CO 0.02 -0.11 0.00 1.58 0.00 0.00 0.00 179.25 180.74 3d6k n HIS 308 N -4.92 0.00 0.00 0.00 -0.00 -0.38 -2.61 115.22 107.32 3d6k n HIS 308 Ca 0.09 -0.20 0.00 0.00 -0.00 0.00 0.00 57.72 57.61 3d6k n HIS 308 Cb 0.26 -0.18 0.00 0.00 -0.00 0.00 0.00 29.99 30.06 3d6k n HIS 308 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3d6k n LEU 310 N 1.00 0.00 -0.20 0.27 4.32 -0.55 -2.78 117.00 119.06 3d6k n LEU 310 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 56.01 55.89 3d6k n LEU 310 Cb 0.17 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 41.99 3d6k n LEU 310 CO 0.00 0.00 0.79 0.11 -1.22 0.00 0.00 177.39 177.07 3d6k h LYS 311 N 0.00 1.03 -0.10 3.23 1.57 -1.79 -0.79 116.57 119.72 3d6k h LYS 311 Ca 0.00 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 3d6k h LYS 311 Cb 0.00 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 3d6k h LYS 311 CO 0.00 1.04 0.06 0.45 -0.57 0.00 0.00 179.45 180.43 3d6k h HIS 312 N 0.92 0.13 -0.65 -1.35 3.86 -1.83 -2.07 115.15 114.16 3d6k h HIS 312 Ca 0.16 0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.49 3d6k h HIS 312 Cb 0.60 -0.04 -0.12 0.00 1.06 0.00 0.00 27.41 28.90 3d6k h HIS 312 CO 0.04 0.11 -0.22 0.00 0.86 0.00 0.00 177.93 178.72 3d6k h ALA 313 N 1.01 0.29 -0.84 2.45 0.00 -1.71 0.16 119.26 120.62 3d6k h ALA 313 Ca 0.04 0.23 0.01 0.00 0.00 0.00 0.00 54.91 55.19 3d6k h ALA 313 Cb 0.02 0.60 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 3d6k h ALA 313 CO -0.01 -0.50 0.56 0.00 0.00 0.00 0.00 179.25 179.30 3d6k h ALA 314 N 1.46 1.07 -0.45 0.00 0.00 -0.83 0.43 119.26 120.93 3d6k h ALA 314 Ca 0.30 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 3d6k h ALA 314 Cb 0.52 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3d6k h ALA 314 CO -0.69 0.48 -0.27 1.03 0.00 0.00 0.00 179.25 179.80 3d6k h SER 315 N 1.14 1.01 0.15 0.00 0.87 -0.68 -3.35 113.55 112.70 3d6k h SER 315 Ca 0.31 -0.41 -0.30 0.00 -1.23 0.00 0.00 61.79 60.16 3d6k h SER 315 Cb -0.13 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 61.56 3d6k h SER 315 CO -0.07 1.21 -1.49 -0.07 -0.53 0.00 0.00 176.83 175.88 3d6k h LEU 316 N 0.83 0.49 -0.80 2.23 3.38 -0.56 -3.40 115.31 117.48 3d6k h LEU 316 Ca 0.10 -0.89 0.19 0.00 0.09 0.00 0.00 57.88 57.36 3d6k h LEU 316 Cb 0.85 -0.16 -0.13 0.00 0.09 0.00 0.00 40.66 41.32 3d6k h LEU 316 CO 0.08 1.67 0.18 0.00 0.09 0.00 0.00 178.44 180.46 3d6k h ALA 317 N 0.02 1.07 -0.02 1.53 0.00 -0.29 -0.13 119.26 121.44 3d6k h ALA 317 Ca -0.31 0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 3d6k h ALA 317 Cb 1.88 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.95 3d6k h ALA 317 CO 0.11 -0.39 -0.28 -1.35 0.00 0.00 0.00 179.25 177.34 3d6k h PRO 318 N 0.23 0.03 -0.31 0.00 0.11 -1.76 -2.04 132.00 128.27 3d6k h PRO 318 Ca 0.47 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.50 3d6k h PRO 318 Cb 0.87 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.97 3d6k h PRO 318 CO -0.59 0.32 -0.08 0.87 -0.21 0.00 0.00 178.00 178.30 3d6k h LYS 319 N 0.03 0.60 -0.41 1.05 1.57 -1.25 -2.26 116.57 115.92 3d6k h LYS 319 Ca 0.00 -0.24 -0.15 0.00 -1.87 0.00 0.00 60.65 58.40 3d6k h LYS 319 Cb 0.52 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 3d6k h LYS 319 CO 0.04 0.80 -0.33 0.74 -0.57 0.00 0.00 179.45 180.13 3d6k h PHE 320 N 0.37 1.09 0.29 -1.35 -1.00 -1.29 -2.52 116.94 112.54 3d6k h PHE 320 Ca 0.08 -0.30 -0.01 0.00 2.81 0.00 0.00 57.97 60.54 3d6k h PHE 320 Cb 0.58 -0.24 -0.00 0.00 3.61 0.00 0.00 35.95 39.90 3d6k h PHE 320 CO 0.05 1.12 -0.16 1.49 -1.61 0.00 0.00 178.31 179.20 3d6k h GLU 321 N 0.77 -0.41 -0.36 1.51 4.81 -1.35 -0.71 114.58 118.84 3d6k h GLU 321 Ca 0.08 0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.41 3d6k h GLU 321 Cb 0.91 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 30.30 3d6k h GLU 321 CO 0.08 -0.27 -0.18 -0.09 -0.73 0.00 0.00 179.01 177.82 3d6k h ARG 322 N -0.42 -0.12 -0.31 1.92 9.65 -1.46 -0.98 114.38 122.66 3d6k h ARG 322 Ca -0.03 0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.90 3d6k h ARG 322 Cb 0.34 0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.90 3d6k h ARG 322 CO 0.05 -0.08 0.02 0.28 2.80 0.00 0.00 179.97 183.04 3d6k h VAL 323 N -0.12 0.80 -0.22 0.20 2.07 -1.27 -1.83 116.25 115.88 3d6k h VAL 323 Ca 0.18 -0.04 -0.07 0.00 0.82 0.00 0.00 66.70 67.59 3d6k h VAL 323 Cb 0.40 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3d6k h VAL 323 CO -0.44 0.02 -0.19 -0.07 0.02 0.00 0.00 177.57 176.91 3d6k h LEU 324 N 0.11 0.37 -0.36 2.57 3.38 -0.75 -1.11 115.31 119.53 3d6k h LEU 324 Ca 0.15 -0.10 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 3d6k h LEU 324 Cb 0.19 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3d6k h LEU 324 CO -0.23 0.58 -0.60 1.05 0.09 0.00 0.00 178.44 179.33 3d6k h GLU 325 N 0.35 0.72 -0.31 1.13 4.11 -0.80 -2.13 114.58 117.66 3d6k h GLU 325 Ca 0.06 -0.49 -0.05 0.00 0.07 0.00 0.00 59.36 58.96 3d6k h GLU 325 Cb 0.54 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 3d6k h GLU 325 CO 0.04 1.11 0.01 0.82 0.07 0.00 0.00 179.01 181.05 3d6k h ILE 326 N 0.54 1.26 -0.02 -1.06 2.04 -1.15 0.26 117.51 119.38 3d6k h ILE 326 Ca -0.00 -0.93 0.03 0.00 1.00 0.00 0.00 64.86 64.96 3d6k h ILE 326 Cb 1.19 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 38.47 3d6k h ILE 326 CO 0.12 0.30 -0.29 -0.07 0.00 0.00 0.00 178.15 178.22 3d6k h LEU 327 N 0.34 -0.86 0.37 1.44 3.38 -1.18 0.15 115.31 118.95 3d6k h LEU 327 Ca 0.09 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 3d6k h LEU 327 Cb 0.43 0.35 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 3d6k h LEU 327 CO 0.01 -0.35 -0.36 -0.78 0.09 0.00 0.00 178.44 177.05 3d6k h ASP 328 N -0.42 -0.99 -0.89 -0.43 3.58 -1.27 0.77 116.42 116.77 3d6k h ASP 328 Ca 0.07 0.08 0.07 0.00 0.42 0.00 0.00 57.03 57.67 3d6k h ASP 328 Cb 0.52 0.32 -0.06 0.00 1.72 0.00 0.00 39.33 41.83 3d6k h ASP 328 CO -0.26 -0.48 0.58 -1.28 -2.88 0.00 0.00 179.24 174.92 3d6k h SER 329 N -0.73 0.87 0.69 2.28 0.87 -0.35 -0.83 113.55 116.34 3d6k h SER 329 Ca -0.05 0.01 -0.18 0.00 -1.23 0.00 0.00 61.79 60.34 3d6k h SER 329 Cb 0.63 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.38 3d6k h SER 329 CO -0.04 0.55 -1.43 -0.09 -0.53 0.00 0.00 176.83 175.29 3d6k h ARG 330 N 0.98 0.00 0.00 2.24 9.65 -0.61 -3.41 114.38 123.23 3d6k h ARG 330 Ca 0.39 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 59.25 3d6k h ARG 330 Cb 0.25 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.83 3d6k h ARG 330 CO -0.15 0.32 -1.31 1.28 2.80 0.00 0.00 179.97 182.91 3d6k n LEU 331 N -2.92 0.00 0.18 3.80 4.77 0.25 -4.91 117.00 118.18 3d6k n LEU 331 Ca -0.10 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.78 3d6k n LEU 331 Cb 0.87 0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.93 3d6k n LEU 331 CO 0.43 0.03 0.51 0.28 -1.33 0.00 0.00 177.39 177.32 3d6k h SER 332 N 0.00 -0.70 -0.14 -1.43 0.02 -1.22 -2.35 113.55 107.73 3d6k h SER 332 Ca -0.03 0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.01 3d6k h SER 332 Cb 0.51 0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 3d6k h SER 332 CO 0.00 -0.37 0.43 1.05 -1.14 0.00 0.00 176.83 176.81 3d6k h GLU 333 N -0.57 0.00 0.03 3.45 4.11 -1.89 -2.96 114.58 116.75 3d6k h GLU 333 Ca -0.04 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 59.17 3d6k h GLU 333 Cb 0.48 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 3d6k h GLU 333 CO -0.00 0.00 -1.00 1.88 0.07 0.00 0.00 179.01 179.96 3d6k h TYR 334 N 0.00 0.20 -4.21 2.06 -1.99 -1.77 -3.48 116.97 107.77 3d6k h TYR 334 Ca 0.06 -0.13 -0.05 0.00 2.00 0.00 0.00 58.73 60.61 3d6k h TYR 334 Cb 0.93 -0.01 0.04 0.00 2.00 0.00 0.00 36.73 39.69 3d6k h TYR 334 CO 0.00 1.04 -0.19 0.41 -0.00 0.00 0.00 178.16 179.42 3d6k n GLY 335 N 1.20 -0.50 0.00 3.88 0.00 -1.12 -4.97 105.19 103.68 3d6k n GLY 335 Ca -0.03 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3d6k n GLY 335 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3d6k n VAL 336 N -1.81 0.00 -3.94 1.61 0.31 -1.26 -5.04 118.33 108.20 3d6k n VAL 336 Ca -0.02 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.21 3d6k n VAL 336 Cb 0.53 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 33.34 3d6k n VAL 336 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3d6k s ALA 337 N -1.00 0.02 0.14 3.52 0.00 -1.26 -2.59 121.76 120.58 3d6k s ALA 337 Ca 0.00 -0.36 0.10 0.00 0.00 0.00 0.00 51.96 51.70 3d6k s ALA 337 Cb 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.17 3d6k s ALA 337 CO 0.00 -0.13 -0.24 -1.59 0.00 0.00 0.00 175.76 173.80 3d6k s LYS 338 N -1.06 1.34 0.07 0.00 -2.85 -0.31 -4.95 119.74 111.98 3d6k s LYS 338 Ca -0.12 -1.34 -0.06 0.00 -1.00 0.00 0.00 55.97 53.46 3d6k s LYS 338 Cb -0.07 -1.73 -0.01 0.00 -2.06 0.00 0.00 37.83 33.96 3d6k s LYS 338 CO -0.00 0.40 0.12 1.67 0.10 0.00 0.00 175.35 177.63 3d6k s TRP 339 N -1.25 0.26 0.39 1.78 -2.14 -1.26 0.28 118.94 117.00 3d6k s TRP 339 Ca 0.13 -0.72 -0.22 0.00 2.66 0.00 0.00 56.10 57.95 3d6k s TRP 339 Cb -0.09 -0.16 -0.10 0.00 -3.10 0.00 0.00 33.47 30.01 3d6k s TRP 339 CO 0.06 -0.49 0.92 0.95 -2.66 0.00 0.00 176.95 175.74 3d6k s THR 340 N -3.82 4.38 -0.82 0.66 -4.23 -0.52 -4.99 115.64 106.31 3d6k s THR 340 Ca 0.05 1.51 0.00 0.00 -1.18 0.00 0.00 61.69 62.07 3d6k s THR 340 Cb 0.06 -3.70 0.20 0.00 1.34 0.00 0.00 72.50 70.39 3d6k s THR 340 CO -0.10 -0.18 0.67 -0.44 -0.54 0.00 0.00 174.62 174.02 3d6k s SER 341 N -2.04 5.61 0.54 3.99 0.01 -1.26 -4.69 113.70 115.86 3d6k s SER 341 Ca 0.58 -3.69 -0.17 0.00 1.31 0.00 0.00 55.95 53.98 3d6k s SER 341 Cb -0.12 -1.83 -0.06 0.00 0.21 0.00 0.00 66.02 64.22 3d6k s SER 341 CO 0.16 -0.17 1.03 -2.16 0.41 0.00 0.00 173.24 172.52 3d6k s PRO 342 N -1.28 3.61 -0.05 12.44 0.04 -1.26 -4.92 135.00 143.58 3d6k s PRO 342 Ca 0.26 1.21 0.14 0.00 0.04 0.00 0.00 61.00 62.64 3d6k s PRO 342 Cb -0.08 -2.08 0.43 0.00 0.04 0.00 0.00 34.50 32.82 3d6k s PRO 342 CO -0.13 -0.57 1.36 -2.37 0.04 0.00 0.00 177.00 175.33 3d6k n THR 343 N -1.57 1.33 -3.96 1.26 5.66 -1.26 -5.01 114.28 110.72 3d6k n THR 343 Ca 0.08 -1.18 0.03 0.00 -3.05 0.00 0.00 64.05 59.93 3d6k n THR 343 Cb 0.53 0.32 0.01 0.00 -1.55 0.00 0.00 70.33 69.64 3d6k n THR 343 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 3d6k s GLY 344 N -1.16 -0.18 0.00 1.09 0.00 -1.26 -1.53 107.32 104.28 3d6k s GLY 344 Ca 0.33 0.15 0.00 0.00 0.00 0.00 0.00 44.72 45.19 3d6k s GLY 344 CO 0.17 5.40 0.00 0.61 0.00 0.00 0.00 173.10 179.28 3d6k n GLY 345 N -0.88 -1.69 0.00 0.20 0.00 -0.60 -4.67 105.19 97.54 3d6k n GLY 345 Ca 0.03 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.49 3d6k n GLY 345 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3d6k n TYR 346 N 0.00 0.00 -4.06 1.61 4.02 -1.26 -4.94 117.16 112.53 3d6k n TYR 346 Ca 0.00 -0.08 -0.08 0.00 -0.01 0.00 0.00 57.90 57.73 3d6k n TYR 346 Cb 0.00 -0.01 -0.10 0.00 -0.02 0.00 0.00 39.34 39.21 3d6k n TYR 346 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 3d6k s PHE 347 N -0.16 0.47 -0.04 -0.72 0.08 -1.26 -4.21 117.98 112.12 3d6k s PHE 347 Ca 0.00 -0.85 0.06 0.00 0.12 0.00 0.00 56.93 56.26 3d6k s PHE 347 Cb 0.00 -0.33 -0.01 0.00 -0.57 0.00 0.00 43.02 42.11 3d6k s PHE 347 CO 0.00 -0.29 -0.23 0.42 -0.10 0.00 0.00 175.22 175.03 3d6k s ILE 348 N -2.97 1.84 -0.20 0.64 1.01 -1.01 -4.65 121.20 115.86 3d6k s ILE 348 Ca -0.01 -0.96 -0.05 0.00 0.00 0.00 0.00 60.65 59.62 3d6k s ILE 348 Cb 0.01 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 3d6k s ILE 348 CO -0.06 0.52 0.01 -0.55 0.00 0.00 0.00 174.94 174.85 3d6k s SER 349 N -0.21 4.88 -0.09 3.58 0.15 -1.23 -0.26 113.70 120.52 3d6k s SER 349 Ca -0.00 -0.19 0.03 0.00 0.70 0.00 0.00 55.95 56.48 3d6k s SER 349 Cb -0.12 -1.84 -0.02 0.00 -1.71 0.00 0.00 66.02 62.34 3d6k s SER 349 CO 0.02 0.06 -0.17 -0.69 1.20 0.00 0.00 173.24 173.67 3d6k s VAL 350 N 1.00 2.74 -0.21 4.45 1.01 0.37 -1.44 120.40 128.32 3d6k s VAL 350 Ca 0.02 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.15 3d6k s VAL 350 Cb -0.14 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 3d6k s VAL 350 CO 0.02 0.56 -0.02 -1.81 0.00 0.00 0.00 175.10 173.85 3d6k s ASP 351 N -0.04 4.58 0.29 3.32 1.01 0.14 -0.15 116.67 125.83 3d6k s ASP 351 Ca -0.05 -0.30 0.04 0.00 0.71 0.00 0.00 52.55 52.96 3d6k s ASP 351 Cb -0.14 -1.79 0.04 0.00 1.01 0.00 0.00 42.92 42.04 3d6k s ASP 351 CO 0.04 0.02 0.34 1.33 0.21 0.00 0.00 175.17 177.11 3d6k n VAL 352 N 4.55 0.00 -1.68 -1.27 0.24 0.21 -1.16 118.33 119.23 3d6k n VAL 352 Ca -0.18 -1.04 -0.50 0.00 -2.04 0.00 0.00 64.34 60.59 3d6k n VAL 352 Cb 0.51 -0.58 -0.05 0.00 -1.47 0.00 0.00 33.84 32.25 3d6k n VAL 352 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 3d6k n VAL 353 N -1.49 0.41 -1.69 3.34 0.31 -1.07 -4.74 118.33 113.41 3d6k n VAL 353 Ca 0.05 -0.07 -0.43 0.00 -0.01 0.00 0.00 64.34 63.87 3d6k n VAL 353 Cb 0.31 -1.66 -0.02 0.00 -0.91 0.00 0.00 33.84 31.57 3d6k n VAL 353 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3d6k n PRO 354 N 5.69 2.12 -0.34 5.55 -0.02 -1.26 -1.94 135.00 144.80 3d6k n PRO 354 Ca 0.22 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 3d6k n PRO 354 Cb 0.26 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 3d6k n PRO 354 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d6k n GLY 355 N 1.49 0.68 0.00 -1.23 0.00 -0.24 -4.91 105.19 100.99 3d6k n GLY 355 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3d6k n GLY 355 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d6k n THR 356 N -2.00 0.00 -0.21 2.61 -2.24 -0.82 -4.79 114.28 106.83 3d6k n THR 356 Ca 0.00 -0.32 -0.02 0.00 -2.27 0.00 0.00 64.05 61.44 3d6k n THR 356 Cb 0.00 0.83 0.05 0.00 -2.10 0.00 0.00 70.33 69.11 3d6k n THR 356 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d6k h ALA 357 N 0.00 0.28 -0.75 6.98 0.00 -1.34 0.15 119.26 124.57 3d6k h ALA 357 Ca 0.00 0.22 0.14 0.00 0.00 0.00 0.00 54.91 55.27 3d6k h ALA 357 Cb 0.00 0.59 -0.09 0.00 0.00 0.00 0.00 17.79 18.28 3d6k h ALA 357 CO 0.00 -0.51 0.31 0.77 0.00 0.00 0.00 179.25 179.83 3d6k h SER 358 N -0.06 0.31 -0.29 0.00 0.02 -1.87 -1.83 113.55 109.83 3d6k h SER 358 Ca 0.29 0.10 -0.15 0.00 -0.84 0.00 0.00 61.79 61.19 3d6k h SER 358 Cb 0.51 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 3d6k h SER 358 CO -0.67 0.13 -0.36 -0.09 -1.14 0.00 0.00 176.83 174.69 3d6k h ARG 359 N 0.47 0.83 -0.31 3.45 9.65 -1.12 -1.75 114.38 125.60 3d6k h ARG 359 Ca 0.41 -0.42 0.04 0.00 -1.10 0.00 0.00 59.98 58.91 3d6k h ARG 359 Cb 0.60 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.14 3d6k h ARG 359 CO -0.39 1.06 0.07 0.28 2.80 0.00 0.00 179.97 183.79 3d6k h VAL 360 N 0.69 0.86 -0.48 0.20 2.07 -0.53 0.35 116.25 119.42 3d6k h VAL 360 Ca 0.06 -0.06 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 3d6k h VAL 360 Cb 0.92 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 3d6k h VAL 360 CO 0.09 0.03 0.23 0.58 0.02 0.00 0.00 177.57 178.52 3d6k h VAL 361 N 0.19 1.19 -0.49 2.57 2.07 -1.22 -1.04 116.25 119.51 3d6k h VAL 361 Ca 0.15 -0.53 -0.04 0.00 0.82 0.00 0.00 66.70 67.09 3d6k h VAL 361 Cb 0.15 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3d6k h VAL 361 CO -0.18 0.21 0.14 -0.08 0.02 0.00 0.00 177.57 177.67 3d6k h GLU 362 N 0.62 0.77 -0.13 1.57 4.81 -0.99 -0.84 114.58 120.40 3d6k h GLU 362 Ca 0.16 -0.18 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 3d6k h GLU 362 Cb 0.12 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 3d6k h GLU 362 CO -0.02 0.74 -0.06 -0.07 -0.73 0.00 0.00 179.01 178.87 3d6k h LEU 363 N 0.67 0.18 -0.01 1.64 3.38 -0.11 -1.70 115.31 119.35 3d6k h LEU 363 Ca 0.16 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 3d6k h LEU 363 Cb 0.30 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3d6k h LEU 363 CO -0.00 0.27 -0.23 0.00 0.09 0.00 0.00 178.44 178.56 3d6k h ALA 364 N 1.76 0.04 -0.39 1.53 0.00 -0.75 -2.88 119.26 118.57 3d6k h ALA 364 Ca 0.04 -0.45 0.08 0.00 0.00 0.00 0.00 54.91 54.58 3d6k h ALA 364 Cb 0.23 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.95 3d6k h ALA 364 CO 0.01 0.07 -0.14 -0.22 0.00 0.00 0.00 179.25 178.97 3d6k h LYS 365 N -0.47 -0.05 0.00 0.00 3.64 -0.43 0.18 116.57 119.43 3d6k h LYS 365 Ca -0.03 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 3d6k h LYS 365 Cb 0.97 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.80 3d6k h LYS 365 CO 0.05 -0.04 -0.02 0.93 -2.27 0.00 0.00 179.45 178.10 3d6k h GLU 366 N -0.06 0.00 -0.53 1.90 5.08 -1.38 0.26 114.58 119.85 3d6k h GLU 366 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3d6k h GLU 366 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 3d6k h GLU 366 CO -0.43 0.02 0.00 0.00 -1.00 0.00 0.00 179.01 177.60 3d6k n ALA 367 N -2.22 3.64 -1.77 3.43 0.00 -0.13 -4.96 120.51 118.51 3d6k n ALA 367 Ca -0.03 -1.95 -0.10 0.00 0.00 0.00 0.00 53.44 51.37 3d6k n ALA 367 Cb 0.12 -1.04 -0.02 0.00 0.00 0.00 0.00 19.45 18.51 3d6k n ALA 367 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d6k n GLY 368 N 0.50 0.51 3.34 0.00 0.00 0.91 -4.27 105.19 106.18 3d6k n GLY 368 Ca 0.26 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 3d6k n GLY 368 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d6k s ILE 369 N -2.43 3.23 -0.29 -0.61 1.01 0.44 -1.18 121.20 121.37 3d6k s ILE 369 Ca 0.00 -0.57 -0.16 0.00 0.00 0.00 0.00 60.65 59.92 3d6k s ILE 369 Cb 0.00 -2.42 -0.03 0.00 0.01 0.00 0.00 42.46 40.02 3d6k s ILE 369 CO 0.00 0.47 0.44 0.00 0.00 0.00 0.00 174.94 175.86 3d6k s ALA 370 N 0.96 3.55 0.14 9.38 0.00 0.18 -1.88 121.76 134.08 3d6k s ALA 370 Ca -0.01 -0.81 0.09 0.00 0.00 0.00 0.00 51.96 51.23 3d6k s ALA 370 Cb -0.15 -2.83 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 3d6k s ALA 370 CO -0.00 -0.81 -0.16 -0.51 0.00 0.00 0.00 175.76 174.27 3d6k s LEU 371 N 2.20 2.76 0.36 0.00 1.43 -1.26 0.15 118.68 124.32 3d6k s LEU 371 Ca 0.17 -0.59 -0.28 0.00 -1.03 0.00 0.00 54.13 52.41 3d6k s LEU 371 Cb -0.16 -1.54 -0.10 0.00 0.03 0.00 0.00 46.19 44.42 3d6k s LEU 371 CO 0.10 0.15 1.31 0.42 0.23 0.00 0.00 176.35 178.56 3d6k s THR 372 N -1.36 2.68 0.20 5.49 -4.23 -1.26 -4.89 115.64 112.27 3d6k s THR 372 Ca 0.20 0.66 -0.32 0.00 -1.18 0.00 0.00 61.69 61.05 3d6k s THR 372 Cb -0.10 -3.41 -0.12 0.00 1.34 0.00 0.00 72.50 70.22 3d6k s THR 372 CO 0.12 0.14 1.75 -0.83 -0.54 0.00 0.00 174.62 175.25 3d6k s GLY 373 N -0.58 1.21 0.15 3.99 0.00 -1.26 -4.76 107.32 106.07 3d6k s GLY 373 Ca 0.52 1.58 -0.34 0.00 0.00 0.00 0.00 44.72 46.48 3d6k s GLY 373 CO 0.51 2.94 1.26 0.00 0.00 0.00 0.00 173.10 177.81 3d6k n ALA 374 N 4.28 -0.54 -0.25 3.20 0.00 -1.26 -2.05 120.51 123.89 3d6k n ALA 374 Ca 0.16 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.08 3d6k n ALA 374 Cb 0.36 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.72 3d6k n ALA 374 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d6k n GLY 375 N 2.26 0.84 0.03 0.00 0.00 -1.26 -4.85 105.19 102.21 3d6k n GLY 375 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 3d6k n GLY 375 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3d6k n SER 376 N 0.00 0.15 -0.76 1.61 2.88 -0.87 -1.60 113.62 115.02 3d6k n SER 376 Ca 0.00 0.54 0.04 0.00 -1.33 0.00 0.00 58.87 58.13 3d6k n SER 376 Cb 0.00 -0.57 0.15 0.00 -0.75 0.00 0.00 64.21 63.04 3d6k n SER 376 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3d6k n SER 377 N -1.67 2.15 -4.19 -3.46 7.64 -1.26 -3.98 113.62 108.85 3d6k n SER 377 Ca 0.02 -2.13 -0.19 0.00 1.01 0.00 0.00 58.87 57.58 3d6k n SER 377 Cb 0.13 -0.33 -0.12 0.00 -1.01 0.00 0.00 64.21 62.88 3d6k n SER 377 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3d6k s PHE 378 N -1.63 1.28 0.41 1.43 0.08 -0.63 0.25 117.98 119.17 3d6k s PHE 378 Ca 0.22 -0.48 -0.26 0.00 0.12 0.00 0.00 56.93 56.53 3d6k s PHE 378 Cb 0.13 -0.71 -0.10 0.00 -0.57 0.00 0.00 43.02 41.77 3d6k s PHE 378 CO 0.12 0.08 1.23 -2.30 -0.10 0.00 0.00 175.22 174.25 3d6k n PRO 379 N 1.10 1.86 -1.61 0.24 -0.02 -1.26 -0.85 135.00 134.46 3d6k n PRO 379 Ca -0.20 0.66 -0.13 0.00 -2.02 0.00 0.00 63.50 61.81 3d6k n PRO 379 Cb 0.55 -2.32 -0.05 0.00 -0.02 0.00 0.00 33.50 31.66 3d6k n PRO 379 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3d6k n LEU 380 N 0.33 -1.03 -2.54 2.45 4.77 -1.26 -1.70 117.00 118.02 3d6k n LEU 380 Ca 0.07 0.30 -0.18 0.00 -0.03 0.00 0.00 56.01 56.17 3d6k n LEU 380 Cb 0.39 -2.07 -0.00 0.00 -2.33 0.00 0.00 43.42 39.41 3d6k n LEU 380 CO 0.59 -0.58 -0.18 1.41 -1.33 0.00 0.00 177.39 177.29 3d6k n HIS 381 N -2.22 -1.31 -3.81 -1.77 8.25 -0.03 -4.98 115.22 109.34 3d6k n HIS 381 Ca -0.14 0.08 -0.36 0.00 -0.26 0.00 0.00 57.72 57.04 3d6k n HIS 381 Cb 0.48 -3.53 -0.13 0.00 1.12 0.00 0.00 29.99 27.94 3d6k n HIS 381 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3d6k s ASN 382 N -2.15 5.15 -0.47 0.41 2.47 -0.69 -4.53 114.94 115.12 3d6k s ASN 382 Ca 0.06 -1.47 -0.19 0.00 0.42 0.00 0.00 52.86 51.68 3d6k s ASN 382 Cb -0.03 -1.80 0.04 0.00 -1.45 0.00 0.00 41.25 38.01 3d6k s ASN 382 CO 0.07 -0.37 0.61 -0.62 -3.72 0.00 0.00 177.10 173.06 3d6k s ASP 383 N 1.50 6.26 0.56 -4.21 -1.08 -1.26 -4.68 116.67 113.76 3d6k s ASP 383 Ca -0.00 -0.66 0.25 0.00 -0.52 0.00 0.00 52.55 51.63 3d6k s ASP 383 Cb -0.21 -2.29 1.55 0.00 -1.46 0.00 0.00 42.92 40.51 3d6k s ASP 383 CO -0.01 -0.81 2.11 1.55 0.52 0.00 0.00 175.17 178.54 3d6k h PRO 384 N 8.91 0.00 -0.02 4.34 0.13 -1.98 -1.36 132.00 142.03 3d6k h PRO 384 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3d6k h PRO 384 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3d6k h PRO 384 CO 0.91 0.00 -0.36 0.09 -0.23 0.00 0.00 178.00 178.41 3d6k n ASN 385 N -4.07 1.94 -4.07 1.44 3.02 -1.26 -5.00 115.26 107.26 3d6k n ASN 385 Ca 0.02 -1.46 -0.27 0.00 -0.03 0.00 0.00 54.58 52.83 3d6k n ASN 385 Cb 0.30 0.34 -0.05 0.00 -0.61 0.00 0.00 39.78 39.76 3d6k n ASN 385 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3d6k n ASN 386 N 0.04 0.02 -0.00 6.41 5.15 -0.51 -1.07 115.26 125.29 3d6k n ASN 386 Ca 0.11 -1.10 0.00 0.00 -0.60 0.00 0.00 54.58 52.99 3d6k n ASN 386 Cb 0.46 -2.57 -0.01 0.00 -0.53 0.00 0.00 39.78 37.13 3d6k n ASN 386 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 3d6k n GLU 387 N -4.47 1.78 -3.56 1.20 0.28 -1.26 -1.29 120.64 113.32 3d6k n GLU 387 Ca -0.31 -0.01 -0.38 0.00 -0.16 0.00 0.00 57.16 56.30 3d6k n GLU 387 Cb 0.69 -1.04 -0.06 0.00 1.43 0.00 0.00 31.44 32.46 3d6k n GLU 387 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 3d6k s ASN 388 N -2.66 6.73 -0.03 -1.84 3.84 -1.26 0.68 114.94 120.40 3d6k s ASN 388 Ca -0.01 0.87 -0.00 0.00 0.21 0.00 0.00 52.86 53.93 3d6k s ASN 388 Cb 0.01 -2.22 0.03 0.00 -0.55 0.00 0.00 41.25 38.52 3d6k s ASN 388 CO 0.07 0.33 0.03 -0.63 -2.79 0.00 0.00 177.10 174.10 3d6k s ILE 389 N -0.99 0.03 0.08 -5.21 1.01 0.79 -4.01 121.20 112.90 3d6k s ILE 389 Ca 0.22 0.23 -0.24 0.00 0.00 0.00 0.00 60.65 60.86 3d6k s ILE 389 Cb -0.16 -0.19 -0.06 0.00 0.01 0.00 0.00 42.46 42.06 3d6k s ILE 389 CO 0.12 0.14 0.72 -0.60 0.00 0.00 0.00 174.94 175.32 3d6k s ARG 390 N 1.40 4.46 -0.07 2.79 3.52 -1.26 -0.48 118.95 129.30 3d6k s ARG 390 Ca -0.05 1.01 0.02 0.00 -0.13 0.00 0.00 55.73 56.58 3d6k s ARG 390 Cb -0.13 -3.31 -0.02 0.00 -1.56 0.00 0.00 34.95 29.92 3d6k s ARG 390 CO -0.03 0.42 -0.12 -0.51 -0.81 0.00 0.00 175.30 174.26 3d6k s LEU 391 N -0.53 2.86 -0.44 -0.88 1.43 0.63 -4.34 118.68 117.42 3d6k s LEU 391 Ca 0.35 -0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.30 3d6k s LEU 391 Cb -0.21 -1.61 0.13 0.00 0.03 0.00 0.00 46.19 44.53 3d6k s LEU 391 CO 0.23 0.31 0.22 0.00 0.23 0.00 0.00 176.35 177.33 3d6k s ALA 392 N -0.49 2.45 -2.13 4.21 0.00 -0.90 -2.42 121.76 122.47 3d6k s ALA 392 Ca 0.07 -2.68 0.19 0.00 0.00 0.00 0.00 51.96 49.53 3d6k s ALA 392 Cb -0.12 -1.94 0.51 0.00 0.00 0.00 0.00 23.12 21.57 3d6k s ALA 392 CO 0.02 -1.99 1.42 -0.35 0.00 0.00 0.00 175.76 174.86 3d6k n PRO 393 N 3.60 2.21 -0.12 0.00 -0.04 -1.26 -4.16 135.00 135.23 3d6k n PRO 393 Ca 0.06 -1.86 -0.10 0.00 -0.04 0.00 0.00 63.50 61.57 3d6k n PRO 393 Cb 0.35 -1.43 0.05 0.00 -0.04 0.00 0.00 33.50 32.42 3d6k n PRO 393 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3d6k h SER 394 N 3.24 0.89 0.09 3.54 4.64 -1.81 -3.38 113.55 120.76 3d6k h SER 394 Ca 0.00 -0.34 -0.00 0.00 -0.47 0.00 0.00 61.79 60.98 3d6k h SER 394 Cb 0.73 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 3d6k h SER 394 CO 0.00 1.09 -0.04 0.25 -0.87 0.00 0.00 176.83 177.26 3d6k h LEU 395 N 0.75 -0.10-10.08 5.97 5.85 -1.76 -3.32 115.31 112.62 3d6k h LEU 395 Ca 0.10 -0.18 -0.52 0.00 0.84 0.00 0.00 57.88 58.12 3d6k h LEU 395 Cb 0.78 0.03 0.10 0.00 0.37 0.00 0.00 40.66 41.94 3d6k h LEU 395 CO 0.06 0.47 0.48 -2.84 -0.34 0.00 0.00 178.44 176.27 3d6k s PRO 396 N -2.16 3.16 0.67 5.25 0.02 -1.26 -4.66 135.00 136.02 3d6k s PRO 396 Ca -0.05 1.81 -0.17 0.00 0.02 0.00 0.00 61.00 62.61 3d6k s PRO 396 Cb -0.00 -2.03 -0.00 0.00 0.02 0.00 0.00 34.50 32.49 3d6k s PRO 396 CO 0.19 -1.06 1.22 -2.30 -0.33 0.00 0.00 177.00 174.73 3d6k n PRO 397 N -1.35 0.93 -0.21 5.54 -0.02 -1.26 -4.77 135.00 133.86 3d6k n PRO 397 Ca 0.12 0.38 0.08 0.00 -2.02 0.00 0.00 63.50 62.06 3d6k n PRO 397 Cb 0.49 -2.46 0.37 0.00 -0.02 0.00 0.00 33.50 31.88 3d6k n PRO 397 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3d6k h VAL 398 N 0.29 0.96 -0.86 -1.45 2.07 -1.96 -0.86 116.25 114.44 3d6k h VAL 398 Ca -0.50 -0.25 0.05 0.00 0.82 0.00 0.00 66.70 66.82 3d6k h VAL 398 Cb 1.34 0.17 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 3d6k h VAL 398 CO 0.51 0.13 0.55 0.00 0.02 0.00 0.00 177.57 178.79 3d6k h ALA 399 N 1.60 1.16 -0.31 1.67 0.00 -2.00 0.17 119.26 121.56 3d6k h ALA 399 Ca 0.35 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.13 3d6k h ALA 399 Cb 0.41 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3d6k h ALA 399 CO -0.13 0.35 -0.21 0.93 0.00 0.00 0.00 179.25 180.19 3d6k h GLU 400 N 1.04 0.69 -0.94 0.00 5.08 -1.56 -3.12 114.58 115.77 3d6k h GLU 400 Ca 0.36 -0.33 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 3d6k h GLU 400 Cb 0.07 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 3d6k h GLU 400 CO -0.14 0.93 0.60 -0.07 -1.00 0.00 0.00 179.01 179.33 3d6k h LEU 401 N 0.45 0.96 -0.64 1.33 3.38 -0.65 0.51 115.31 120.65 3d6k h LEU 401 Ca 0.06 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.08 3d6k h LEU 401 Cb 0.76 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.27 3d6k h LEU 401 CO 0.06 0.61 0.38 -0.33 0.09 0.00 0.00 178.44 179.25 3d6k h GLU 402 N 1.09 0.71 0.10 1.13 5.08 -0.96 -3.22 114.58 118.52 3d6k h GLU 402 Ca 0.41 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.72 3d6k h GLU 402 Cb 0.16 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3d6k h GLU 402 CO -0.17 0.47 -0.05 0.28 -1.00 0.00 0.00 179.01 178.54 3d6k h VAL 403 N 0.73 0.99 0.00 3.13 2.07 -1.30 -1.56 116.25 120.32 3d6k h VAL 403 Ca 0.27 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.43 3d6k h VAL 403 Cb 0.09 1.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 3d6k h VAL 403 CO -0.13 0.28 0.00 0.00 0.02 0.00 0.00 177.57 177.74 3d6k n ALA 404 N -2.58 0.50 0.00 1.67 0.00 0.10 -1.57 120.51 118.63 3d6k n ALA 404 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3d6k n ALA 404 Cb 0.28 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.25 3d6k n ALA 404 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3d6k n ASP 406 N 0.19 0.00 -0.03 0.00 5.68 -0.59 -0.89 116.55 120.91 3d6k n ASP 406 Ca 0.00 0.00 -0.16 0.00 -0.50 0.00 0.00 54.79 54.13 3d6k n ASP 406 Cb 0.00 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 39.90 3d6k n ASP 406 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3d6k h GLY 407 N 0.00 0.57 0.14 6.12 0.00 -1.56 -1.68 103.07 106.66 3d6k h GLY 407 Ca 0.00 -0.79 0.06 0.00 0.00 0.00 0.00 47.33 46.61 3d6k h GLY 407 CO 0.00 0.70 -0.23 -2.75 0.00 0.00 0.00 176.54 174.26 3d6k h PHE 408 N 0.12 -0.60 -0.99 5.60 3.57 -1.27 0.36 116.94 123.73 3d6k h PHE 408 Ca -0.03 0.04 0.18 0.00 3.53 0.00 0.00 57.97 61.69 3d6k h PHE 408 Cb 1.12 0.30 -0.10 0.00 2.79 0.00 0.00 35.95 40.06 3d6k h PHE 408 CO 0.11 -0.30 0.62 0.00 -2.23 0.00 0.00 178.31 176.50 3d6k h ALA 409 N 0.87 1.70 -0.37 2.41 0.00 -1.80 0.89 119.26 122.95 3d6k h ALA 409 Ca 0.15 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 3d6k h ALA 409 Cb 0.44 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3d6k h ALA 409 CO -0.40 -0.03 0.00 1.15 0.00 0.00 0.00 179.25 179.98 3d6k h THR 410 N 0.78 1.26 -0.65 0.00 2.02 0.05 -2.48 112.91 113.89 3d6k h THR 410 Ca 0.55 -0.98 -0.04 0.00 0.77 0.00 0.00 66.41 66.70 3d6k h THR 410 Cb 0.83 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 68.37 3d6k h THR 410 CO -0.33 0.33 0.24 0.00 0.37 0.00 0.00 175.52 176.12 3d6k h VAL 412 N 0.92 1.06 0.00 0.00 2.07 -0.78 -1.22 116.25 118.30 3d6k h VAL 412 Ca 0.21 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3d6k h VAL 412 Cb 0.24 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 3d6k h VAL 412 CO -0.01 0.14 0.00 0.18 0.02 0.00 0.00 177.57 177.89 3d6k n LEU 413 N -4.73 1.59 0.00 2.57 7.99 -0.94 -2.03 117.00 121.45 3d6k n LEU 413 Ca 0.06 -0.80 0.00 0.00 -0.01 0.00 0.00 56.01 55.27 3d6k n LEU 413 Cb 0.10 -0.32 0.00 0.00 -0.11 0.00 0.00 43.42 43.09 3d6k n LEU 413 CO 0.32 0.28 0.00 0.00 -1.51 0.00 0.00 177.39 176.48 3d6k n ALA 415 N 0.56 0.00 0.02 -1.18 0.00 -0.46 -1.32 120.51 118.13 3d6k n ALA 415 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 3d6k n ALA 415 Cb 0.28 0.00 0.54 0.00 0.00 0.00 0.00 19.45 20.27 3d6k n ALA 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d6k h ALA 416 N 0.00 2.02 -0.58 0.00 0.00 -1.66 -2.84 119.26 116.20 3d6k h ALA 416 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3d6k h ALA 416 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3d6k h ALA 416 CO 0.00 -0.10 0.00 1.28 0.00 0.00 0.00 179.25 180.43 3d6k n LEU 417 N -4.47 4.46 -1.05 0.00 4.77 -0.43 -4.24 117.00 116.03 3d6k n LEU 417 Ca 0.06 -2.45 0.08 0.00 -0.03 0.00 0.00 56.01 53.67 3d6k n LEU 417 Cb 0.28 -0.53 0.26 0.00 -2.33 0.00 0.00 43.42 41.10 3d6k n LEU 417 CO 0.35 0.79 0.72 -0.62 -1.33 0.00 0.00 177.39 177.31 3d6k n GLU 418 N 0.89 3.25 0.00 3.23 1.02 -1.07 -5.02 120.64 122.94 3d6k n GLU 418 Ca 0.24 -2.66 0.00 0.00 -0.02 0.00 0.00 57.16 54.72 3d6k n GLU 418 Cb 0.84 -1.73 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 3d6k n GLU 418 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64