#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d6k n ALA 12 N 0.00 1.83 0.13 1.96 0.00 -1.26 -4.41 120.51 118.76 3d6k n ALA 12 Ca 0.00 -0.81 0.06 0.00 0.00 0.00 0.00 53.44 52.69 3d6k n ALA 12 Cb 0.00 -0.13 0.34 0.00 0.00 0.00 0.00 19.45 19.66 3d6k n ALA 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3d6k n GLN 13 N -2.42 0.08 0.00 0.00 1.13 -1.26 -2.31 117.38 112.61 3d6k n GLN 13 Ca -0.19 0.54 0.16 0.00 -1.94 0.00 0.00 57.00 55.57 3d6k n GLN 13 Cb 0.85 -1.97 0.88 0.00 0.11 0.00 0.00 30.24 30.11 3d6k n GLN 13 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3d6k n VAL 14 N -1.96 0.00 -0.22 5.09 0.31 -1.26 -3.88 118.33 116.41 3d6k n VAL 14 Ca -0.01 -0.01 -0.07 0.00 -0.01 0.00 0.00 64.34 64.25 3d6k n VAL 14 Cb 0.22 -0.48 0.03 0.00 -0.91 0.00 0.00 33.84 32.70 3d6k n VAL 14 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 3d6k h ARG 15 N 0.05 0.84 -0.55 5.55 3.08 -1.79 -2.88 114.38 118.68 3d6k h ARG 15 Ca 0.00 -0.09 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 3d6k h ARG 15 Cb 0.10 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 3d6k h ARG 15 CO 0.00 0.63 -0.03 1.49 -1.07 0.00 0.00 179.97 181.00 3d6k h GLU 16 N 0.82 1.00 0.00 0.04 4.57 -1.85 -3.08 114.58 116.07 3d6k h GLU 16 Ca 0.21 -0.33 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 3d6k h GLU 16 Cb 0.03 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.54 3d6k h GLU 16 CO -0.04 1.01 -0.24 1.05 -1.18 0.00 0.00 179.01 179.62 3d6k h GLU 17 N 0.88 0.00 0.16 1.92 4.11 -1.81 -3.10 114.58 116.74 3d6k h GLU 17 Ca 0.15 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 59.26 3d6k h GLU 17 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3d6k h GLU 17 CO 0.03 0.00 -1.60 -0.39 0.07 0.00 0.00 179.01 177.13 3d6k h VAL 18 N 0.00 1.10 -0.42 -1.06 -1.51 -1.47 -1.66 116.25 111.23 3d6k h VAL 18 Ca 0.00 -2.69 -0.04 0.00 -1.23 0.00 0.00 66.70 62.74 3d6k h VAL 18 Cb 0.95 2.80 -0.02 0.00 -2.13 0.00 0.00 31.29 32.90 3d6k h VAL 18 CO 0.00 0.83 0.11 0.71 -1.23 0.00 0.00 177.57 177.99 3d6k h THR 19 N 0.09 1.23 -0.48 7.19 1.35 -1.63 0.35 112.91 121.01 3d6k h THR 19 Ca -0.28 -0.79 -0.06 0.00 -0.55 0.00 0.00 66.41 64.73 3d6k h THR 19 Cb 2.06 0.94 -0.02 0.00 -1.73 0.00 0.00 68.15 69.40 3d6k h THR 19 CO 0.18 0.28 0.04 0.00 -0.25 0.00 0.00 175.52 175.77 3d6k h ALA 20 N 0.96 1.16 -0.56 6.62 0.00 -1.66 0.31 119.26 126.09 3d6k h ALA 20 Ca 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3d6k h ALA 20 Cb 0.31 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3d6k h ALA 20 CO 0.00 0.55 0.27 -0.22 0.00 0.00 0.00 179.25 179.85 3d6k h LYS 21 N 0.73 0.81 -0.45 0.00 3.64 -1.04 -1.25 116.57 119.02 3d6k h LYS 21 Ca 0.15 -0.12 -0.14 0.00 -1.27 0.00 0.00 60.65 59.27 3d6k h LYS 21 Cb 0.39 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 3d6k h LYS 21 CO 0.01 0.66 -0.28 -0.92 -2.27 0.00 0.00 179.45 176.66 3d6k h TYR 22 N 0.76 1.13 -0.96 1.91 3.20 0.26 -0.91 116.97 122.35 3d6k h TYR 22 Ca 0.19 -0.30 0.06 0.00 3.14 0.00 0.00 58.73 61.82 3d6k h TYR 22 Cb 0.12 -0.25 -0.06 0.00 1.54 0.00 0.00 36.73 38.07 3d6k h TYR 22 CO -0.00 1.12 0.62 0.00 -1.64 0.00 0.00 178.16 178.26 3d6k h ALA 23 N 0.85 1.31 0.13 1.82 0.00 -0.28 0.83 119.26 123.92 3d6k h ALA 23 Ca 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3d6k h ALA 23 Cb 0.86 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3d6k h ALA 23 CO 0.08 0.43 -0.06 0.93 0.00 0.00 0.00 179.25 180.63 3d6k h GLU 24 N 1.15 -0.16 -0.76 0.00 5.08 -1.05 -0.40 114.58 118.43 3d6k h GLU 24 Ca 0.41 0.01 0.14 0.00 -1.00 0.00 0.00 59.36 58.92 3d6k h GLU 24 Cb 0.12 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.31 3d6k h GLU 24 CO -0.16 0.03 0.32 1.25 -1.00 0.00 0.00 179.01 179.46 3d6k h LEU 25 N -0.34 0.33 0.01 1.33 5.85 -0.71 -3.09 115.31 118.69 3d6k h LEU 25 Ca -0.02 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 3d6k h LEU 25 Cb 0.27 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.37 3d6k h LEU 25 CO 0.03 0.13 -0.00 0.50 -0.34 0.00 0.00 178.44 178.76 3d6k h LYS 26 N 0.48 -0.01 0.00 1.25 3.64 -0.45 -3.13 116.57 118.35 3d6k h LYS 26 Ca 0.42 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.80 3d6k h LYS 26 Cb 0.61 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 3d6k h LYS 26 CO -0.39 0.27 0.00 0.00 -2.27 0.00 0.00 179.45 177.07 3d6k n ALA 27 N -2.24 1.23 1.48 5.00 0.00 -0.20 -2.43 120.51 123.35 3d6k n ALA 27 Ca -0.08 0.09 0.15 0.00 0.00 0.00 0.00 53.44 53.60 3d6k n ALA 27 Cb 0.16 -1.23 0.77 0.00 0.00 0.00 0.00 19.45 19.15 3d6k n ALA 27 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3d6k n LYS 28 N -1.96 0.51 -4.17 0.00 5.02 -1.18 -4.93 118.16 111.46 3d6k n LYS 28 Ca 0.00 0.01 -0.30 0.00 -2.02 0.00 0.00 58.31 55.99 3d6k n LYS 28 Cb 0.08 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.54 3d6k n LYS 28 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3d6k n ASN 29 N -1.24 -0.51 -4.80 4.39 4.13 -1.02 -4.90 115.26 111.32 3d6k n ASN 29 Ca 0.15 -1.12 -0.34 0.00 1.68 0.00 0.00 54.58 54.96 3d6k n ASN 29 Cb 0.21 -2.41 -0.01 0.00 -1.54 0.00 0.00 39.78 36.04 3d6k n ASN 29 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3d6k s LEU 30 N -7.18 3.68 -0.47 3.41 1.43 -1.26 -5.01 118.68 113.28 3d6k s LEU 30 Ca 0.19 1.92 0.08 0.00 -1.03 0.00 0.00 54.13 55.29 3d6k s LEU 30 Cb -0.11 -4.55 0.28 0.00 0.03 0.00 0.00 46.19 41.84 3d6k s LEU 30 CO 0.94 -1.02 0.67 -0.24 0.23 0.00 0.00 176.35 176.93 3d6k n SER 31 N -1.47 1.72 -4.62 2.29 2.88 -1.24 -4.36 113.62 108.81 3d6k n SER 31 Ca 0.09 -3.06 -0.25 0.00 -1.33 0.00 0.00 58.87 54.32 3d6k n SER 31 Cb 0.52 -0.63 -0.08 0.00 -0.75 0.00 0.00 64.21 63.27 3d6k n SER 31 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3d6k s LEU 32 N -2.02 3.15 -0.10 2.46 1.43 -0.76 -5.05 118.68 117.79 3d6k s LEU 32 Ca 0.39 -0.55 -0.30 0.00 -1.03 0.00 0.00 54.13 52.64 3d6k s LEU 32 Cb 0.21 -1.77 0.08 0.00 0.03 0.00 0.00 46.19 44.75 3d6k s LEU 32 CO -0.08 0.06 0.73 1.51 0.23 0.00 0.00 176.35 178.80 3d6k s ASP 33 N -3.17 -0.63 -0.53 2.29 3.84 -1.26 -0.82 116.67 116.38 3d6k s ASP 33 Ca 0.28 0.78 0.03 0.00 -0.00 0.00 0.00 52.55 53.64 3d6k s ASP 33 Cb -0.08 0.64 0.42 0.00 -1.38 0.00 0.00 42.92 42.52 3d6k s ASP 33 CO 0.18 -0.52 1.49 0.18 -0.00 0.00 0.00 175.17 176.50 3d6k n LEU 34 N 1.16 5.90 -0.06 2.11 4.77 -0.45 -4.63 117.00 125.79 3d6k n LEU 34 Ca -0.17 -4.87 -0.06 0.00 -0.03 0.00 0.00 56.01 50.89 3d6k n LEU 34 Cb 0.57 -0.65 -0.11 0.00 -2.33 0.00 0.00 43.42 40.89 3d6k n LEU 34 CO 0.20 1.97 -0.93 0.41 -1.33 0.00 0.00 177.39 177.71 3d6k n THR 35 N -0.62 0.88 -3.08 -5.08 -1.04 -1.26 -2.35 114.28 101.73 3d6k n THR 35 Ca 0.48 -0.57 -0.43 0.00 -2.04 0.00 0.00 64.05 61.48 3d6k n THR 35 Cb 0.64 -0.57 -0.06 0.00 -1.82 0.00 0.00 70.33 68.52 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 -2.39 3.22 -0.14 -2.82 0.52 -1.26 -4.91 118.95 111.18 3d6k s ARG 36 Ca -0.07 -0.56 -0.05 0.00 -0.52 0.00 0.00 55.73 54.53 3d6k s ARG 36 Cb 0.05 -4.03 -0.17 0.00 0.52 0.00 0.00 34.95 31.32 3d6k s ARG 36 CO 0.57 -1.18 3.38 0.41 0.02 0.00 0.00 175.30 178.50 3d6k n GLY 37 N 5.10 3.40 3.29 -3.53 0.00 -1.26 -4.33 105.19 107.87 3d6k n GLY 37 Ca -0.03 -1.41 -0.22 0.00 0.00 0.00 0.00 46.02 44.35 3d6k n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d6k s LYS 38 N 0.19 1.16 0.50 1.61 1.02 -1.26 -5.07 119.74 117.90 3d6k s LYS 38 Ca 0.65 -1.25 -0.22 0.00 0.02 0.00 0.00 55.97 55.16 3d6k s LYS 38 Cb 0.34 -1.30 -0.07 0.00 -0.52 0.00 0.00 37.83 36.27 3d6k s LYS 38 CO -0.07 0.29 1.20 -2.30 -0.92 0.00 0.00 175.35 173.55 3d6k n PRO 39 N 0.76 1.55 -0.91 -1.68 -0.02 -1.26 -3.34 135.00 130.10 3d6k n PRO 39 Ca -0.17 0.57 -0.29 0.00 -2.02 0.00 0.00 63.50 61.58 3d6k n PRO 39 Cb 0.55 -2.36 0.19 0.00 -0.02 0.00 0.00 33.50 31.86 3d6k n PRO 39 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3d6k s SER 40 N -0.85 2.38 0.20 2.55 1.04 -1.24 -4.74 113.70 113.05 3d6k s SER 40 Ca 0.68 1.54 -0.09 0.00 0.48 0.00 0.00 55.95 58.56 3d6k s SER 40 Cb -0.46 -2.21 0.13 0.00 0.10 0.00 0.00 66.02 63.57 3d6k s SER 40 CO 0.52 -3.33 1.74 0.00 0.98 0.00 0.00 173.24 173.15 3d6k h ALA 41 N -2.03 0.96 -0.53 5.32 0.00 -1.92 -1.06 119.26 120.00 3d6k h ALA 41 Ca -0.54 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.25 3d6k h ALA 41 Cb 1.31 -0.28 -0.11 0.00 0.00 0.00 0.00 17.79 18.71 3d6k h ALA 41 CO 0.52 0.63 -0.36 1.49 0.00 0.00 0.00 179.25 181.53 3d6k h GLU 42 N 1.08 -0.20 -0.47 0.00 4.81 -1.95 0.22 114.58 118.07 3d6k h GLU 42 Ca 0.24 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.48 3d6k h GLU 42 Cb 0.29 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 3d6k h GLU 42 CO -0.01 -0.13 0.29 1.96 -0.73 0.00 0.00 179.01 180.39 3d6k h GLN 43 N -0.21 0.63 -0.69 1.92 4.20 -1.87 -2.48 115.11 116.61 3d6k h GLN 43 Ca 0.20 -0.05 0.09 0.00 0.06 0.00 0.00 58.65 58.95 3d6k h GLN 43 Cb 0.55 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 3d6k h GLN 43 CO -0.64 0.45 0.46 -0.07 -0.67 0.00 0.00 178.83 178.36 3d6k h LEU 44 N 0.63 0.52 -1.84 1.46 3.38 -0.14 -1.18 115.31 118.14 3d6k h LEU 44 Ca 0.17 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 3d6k h LEU 44 Cb -0.02 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 3d6k h LEU 44 CO -0.03 0.32 -0.13 0.44 0.09 0.00 0.00 178.44 179.12 3d6k h ASP 45 N 0.58 0.00 -0.74 -0.43 3.32 -0.13 -2.48 116.42 116.55 3d6k h ASP 45 Ca 0.32 0.00 0.21 0.00 0.02 0.00 0.00 57.03 57.58 3d6k h ASP 45 Cb 0.46 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 3d6k h ASP 45 CO -0.10 0.13 0.58 -0.07 -1.72 0.00 0.00 179.24 178.06 3d6k h LEU 46 N 0.00 0.00 -3.05 1.55 4.07 -1.10 -2.64 115.31 114.14 3d6k h LEU 46 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3d6k h LEU 46 Cb 0.27 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.01 3d6k h LEU 46 CO 0.02 0.00 0.00 -1.20 -1.08 0.00 0.00 178.44 176.18 3d6k n SER 47 N -4.10 3.61 0.18 -0.43 7.64 -0.93 -4.74 113.62 114.84 3d6k n SER 47 Ca 0.15 -2.41 0.15 0.00 1.01 0.00 0.00 58.87 57.76 3d6k n SER 47 Cb 0.85 -0.40 0.74 0.00 -1.01 0.00 0.00 64.21 64.39 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 2.39 0.00 -0.27 6.43 4.21 -1.58 -1.65 115.58 125.12 3d6k h ASN 48 Ca 0.00 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.44 3d6k h ASN 48 Cb 1.10 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.29 3d6k h ASN 48 CO 0.12 0.00 -0.06 0.44 -1.29 0.00 0.00 177.43 176.63 3d6k h ASP 49 N 0.00 0.63 -0.46 5.81 3.32 -1.86 -1.70 116.42 122.16 3d6k h ASP 49 Ca 0.10 -0.16 0.10 0.00 0.02 0.00 0.00 57.03 57.09 3d6k h ASP 49 Cb 0.43 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 3d6k h ASP 49 CO -0.00 0.74 0.32 0.25 -1.72 0.00 0.00 179.24 178.83 3d6k h LEU 50 N 0.61 0.18 -2.28 1.55 5.85 -1.67 -1.76 115.31 117.77 3d6k h LEU 50 Ca 0.12 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.84 3d6k h LEU 50 Cb 0.47 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3d6k h LEU 50 CO 0.02 0.11 0.05 -0.07 -0.34 0.00 0.00 178.44 178.21 3d6k h LEU 51 N 0.20 0.00 -2.44 2.25 3.38 -1.38 -1.24 115.31 116.08 3d6k h LEU 51 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3d6k h LEU 51 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3d6k h LEU 51 CO -0.04 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 177.29 3d6k n SER 52 N -2.74 2.87 -4.91 -0.43 7.64 -0.66 -5.02 113.62 110.37 3d6k n SER 52 Ca -0.02 -1.87 -0.30 0.00 1.01 0.00 0.00 58.87 57.68 3d6k n SER 52 Cb 0.10 -0.20 -0.04 0.00 -1.01 0.00 0.00 64.21 63.06 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 -1.06 4.30 0.00 -3.43 1.02 -0.47 -2.83 118.68 116.21 3d6k s LEU 53 Ca 0.25 0.23 0.29 0.00 0.02 0.00 0.00 54.13 54.93 3d6k s LEU 53 Cb 0.14 -2.91 1.32 0.00 0.02 0.00 0.00 46.19 44.76 3d6k s LEU 53 CO 0.19 0.16 1.92 -0.81 0.02 0.00 0.00 176.35 177.83 3d6k n PRO 54 N 0.23 0.61 0.00 1.29 -0.04 -1.26 -4.80 135.00 131.02 3d6k n PRO 54 Ca -0.06 -0.16 0.00 0.00 -0.04 0.00 0.00 63.50 63.25 3d6k n PRO 54 Cb 0.51 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 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 1.28 1.47 0.00 0.55 0.00 -1.13 -2.70 105.19 104.65 3d6k n GLY 55 Ca 0.14 -0.60 0.09 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.89 2.87 -0.02 0.00 -1.26 -4.20 105.19 101.70 3d6k n GLY 56 Ca 0.00 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 3d6k n GLY 56 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3d6k n ASP 57 N -1.27 5.36 -1.57 1.61 8.00 -1.10 -4.76 116.55 122.83 3d6k n ASP 57 Ca 0.09 -3.16 0.09 0.00 0.71 0.00 0.00 54.79 52.52 3d6k n ASP 57 Cb 0.14 -1.44 0.36 0.00 -0.02 0.00 0.00 41.12 40.16 3d6k n ASP 57 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 3d6k n PHE 58 N 3.39 1.49 -4.16 1.24 1.16 -1.26 -4.79 117.46 114.52 3d6k n PHE 58 Ca 0.38 -0.62 -0.34 0.00 -1.87 0.00 0.00 57.45 55.00 3d6k n PHE 58 Cb 0.35 -0.25 -0.08 0.00 -1.61 0.00 0.00 39.48 37.89 3d6k n PHE 58 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 3d6k s ARG 59 N -1.89 3.09 1.28 3.97 0.52 -1.26 -1.83 118.95 122.82 3d6k s ARG 59 Ca 0.51 -0.40 -0.16 0.00 -0.52 0.00 0.00 55.73 55.16 3d6k s ARG 59 Cb 0.33 -2.89 0.33 0.00 0.52 0.00 0.00 34.95 33.24 3d6k s ARG 59 CO 0.24 0.69 0.98 0.95 0.02 0.00 0.00 175.30 178.18 3d6k s THR 60 N -1.06 1.75 0.30 0.02 -4.23 -0.30 -4.83 115.64 107.28 3d6k s THR 60 Ca 0.18 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.68 3d6k s THR 60 Cb -0.12 -2.02 0.25 0.00 1.34 0.00 0.00 72.50 71.95 3d6k s THR 60 CO 0.08 0.00 1.95 0.11 -0.54 0.00 0.00 174.62 176.22 3d6k h LYS 61 N -2.99 1.04 -0.06 3.99 6.56 -2.00 -0.88 116.57 122.23 3d6k h LYS 61 Ca -0.58 -0.08 0.00 0.00 -1.06 0.00 0.00 60.65 58.93 3d6k h LYS 61 Cb 1.34 -0.22 0.00 0.00 -0.57 0.00 0.00 32.23 32.78 3d6k h LYS 61 CO 0.44 0.71 0.00 -0.25 -2.06 0.00 0.00 179.45 178.29 3d6k n ASP 62 N -4.39 0.45 0.00 0.86 10.43 -1.26 -4.91 116.55 117.72 3d6k n ASP 62 Ca 0.08 -1.64 0.00 0.00 2.57 0.00 0.00 54.79 55.81 3d6k n ASP 62 Cb 0.05 -0.04 0.00 0.00 1.84 0.00 0.00 41.12 42.98 3d6k n ASP 62 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3d6k n GLY 63 N 0.81 0.76 3.72 0.44 0.00 -0.33 -5.04 105.19 105.54 3d6k n GLY 63 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.08 4.17 -0.28 1.61 0.11 -1.26 -4.70 120.40 117.97 3d6k s VAL 64 Ca 0.00 1.61 -0.29 0.00 -2.93 0.00 0.00 61.98 60.37 3d6k s VAL 64 Cb 0.00 -4.03 -0.02 0.00 -1.53 0.00 0.00 36.38 30.80 3d6k s VAL 64 CO 0.00 0.15 1.77 -0.62 -3.33 0.00 0.00 175.10 173.07 3d6k s ASP 65 N 0.83 6.04 0.00 3.54 -1.08 -1.26 -1.15 116.67 123.58 3d6k s ASP 65 Ca 0.56 1.47 0.30 0.00 -0.52 0.00 0.00 52.55 54.36 3d6k s ASP 65 Cb -0.28 -2.53 1.77 0.00 -1.46 0.00 0.00 42.92 40.42 3d6k s ASP 65 CO 0.30 -1.56 2.14 0.00 0.52 0.00 0.00 175.17 176.56 3d6k h ARG 67 N 0.00 0.00 -5.68 0.00 3.08 -1.91 -3.38 114.38 106.49 3d6k h ARG 67 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 3d6k h ARG 67 Cb 0.05 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 29.99 3d6k h ARG 67 CO 0.00 0.00 -0.55 1.21 -1.07 0.00 0.00 179.97 179.56 3d6k s ASN 68 N -4.93 4.08 0.64 7.04 3.84 -1.25 -5.10 114.94 119.26 3d6k s ASN 68 Ca 0.07 -1.32 -0.18 0.00 0.21 0.00 0.00 52.86 51.64 3d6k s ASN 68 Cb 0.10 -0.29 -0.01 0.00 -0.55 0.00 0.00 41.25 40.49 3d6k s ASN 68 CO 0.55 -0.54 1.24 -0.31 -2.79 0.00 0.00 177.10 175.24 3d6k s TYR 69 N -2.70 2.22 0.00 0.43 2.02 -1.26 -4.99 117.35 113.06 3d6k s TYR 69 Ca 0.33 1.52 0.00 0.00 -0.37 0.00 0.00 57.07 58.55 3d6k s TYR 69 Cb 0.07 -3.56 0.00 0.00 -0.40 0.00 0.00 41.96 38.07 3d6k s TYR 69 CO 0.18 -2.54 0.00 0.41 -1.57 0.00 0.00 175.55 172.02 3d6k n GLY 70 N 0.62 4.37 0.54 0.71 0.00 -1.26 -5.13 105.19 105.03 3d6k n GLY 70 Ca 0.14 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.60 -3.22 0.07 -0.02 0.00 -1.26 -4.91 105.19 94.25 3d6k n GLY 71 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.24 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 0.22 -0.66 0.99 7.94 -1.25 -4.14 117.00 120.10 3d6k n LEU 72 Ca 0.00 0.10 0.07 0.00 -1.11 0.00 0.00 56.01 55.07 3d6k n LEU 72 Cb 0.00 0.21 0.10 0.00 0.53 0.00 0.00 43.42 44.27 3d6k n LEU 72 CO 0.00 0.23 0.54 0.18 -1.11 0.00 0.00 177.39 177.23 3d6k n LEU 73 N -2.61 2.52 0.00 -1.96 4.32 -1.26 -4.38 117.00 113.63 3d6k n LEU 73 Ca -0.17 -1.33 0.00 0.00 -0.02 0.00 0.00 56.01 54.50 3d6k n LEU 73 Cb 0.86 -0.10 0.00 0.00 -1.62 0.00 0.00 43.42 42.57 3d6k n LEU 73 CO 0.44 0.53 0.00 0.61 -1.22 0.00 0.00 177.39 177.75 3d6k n GLY 74 N 0.81 1.51 3.84 -0.72 0.00 -1.18 -0.60 105.19 108.84 3d6k n GLY 74 Ca 0.11 -2.02 -0.35 0.00 0.00 0.00 0.00 46.02 43.76 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 -2.02 4.72 0.29 -0.61 -4.36 -1.26 -4.90 121.20 113.06 3d6k s ILE 75 Ca 0.00 0.99 0.03 0.00 -0.26 0.00 0.00 60.65 61.41 3d6k s ILE 75 Cb 0.00 -3.75 0.29 0.00 1.25 0.00 0.00 42.46 40.25 3d6k s ILE 75 CO 0.00 0.11 1.69 0.00 0.24 0.00 0.00 174.94 176.98 3d6k h ALA 76 N 3.15 1.39 -0.75 2.27 0.00 -1.99 -2.54 119.26 120.79 3d6k h ALA 76 Ca -0.48 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 3d6k h ALA 76 Cb 1.19 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 3d6k h ALA 76 CO 0.66 -0.36 0.45 -0.44 0.00 0.00 0.00 179.25 179.56 3d6k h ASP 77 N 0.37 0.90 0.66 0.00 5.19 -1.97 0.16 116.42 121.73 3d6k h ASP 77 Ca 0.55 -0.06 -0.27 0.00 -0.62 0.00 0.00 57.03 56.63 3d6k h ASP 77 Cb 1.05 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 40.33 3d6k h ASP 77 CO -0.54 0.69 -1.22 -0.29 -3.12 0.00 0.00 179.24 174.77 3d6k h ILE 78 N 1.02 1.52 -0.27 0.35 6.09 -1.78 -3.10 117.51 121.33 3d6k h ILE 78 Ca 0.27 -3.09 -0.07 0.00 -1.37 0.00 0.00 64.86 60.59 3d6k h ILE 78 Cb -0.04 2.93 -0.01 0.00 0.47 0.00 0.00 36.82 40.18 3d6k h ILE 78 CO -0.05 0.90 -0.12 0.03 -3.07 0.00 0.00 178.15 175.84 3d6k h ARG 79 N 0.07 0.56 -0.36 2.19 3.08 -1.01 -1.19 114.38 117.73 3d6k h ARG 79 Ca -0.12 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 59.64 3d6k h ARG 79 Cb 1.95 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.97 3d6k h ARG 79 CO 0.20 0.80 0.06 0.93 -1.07 0.00 0.00 179.97 180.89 3d6k h GLU 80 N 0.30 0.59 0.55 0.04 5.08 -0.84 -0.98 114.58 119.32 3d6k h GLU 80 Ca 0.06 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 3d6k h GLU 80 Cb 0.63 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.82 3d6k h GLU 80 CO 0.04 0.66 -0.26 1.25 -1.00 0.00 0.00 179.01 179.69 3d6k h LEU 81 N 0.43 -0.63 -0.62 1.33 6.46 -1.49 -1.55 115.31 119.24 3d6k h LEU 81 Ca 0.11 -0.03 0.07 0.00 -0.12 0.00 0.00 57.88 57.91 3d6k h LEU 81 Cb 0.35 0.16 -0.06 0.00 -0.73 0.00 0.00 40.66 40.39 3d6k h LEU 81 CO 0.01 -0.35 0.31 -0.25 -0.62 0.00 0.00 178.44 177.54 3d6k h TRP 82 N -0.87 0.57 -0.66 1.25 2.91 -1.27 0.86 115.95 118.74 3d6k h TRP 82 Ca -0.08 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.97 3d6k h TRP 82 Cb 0.62 -0.16 -0.03 0.00 -0.51 0.00 0.00 29.16 29.07 3d6k h TRP 82 CO -0.01 0.24 0.41 0.00 -1.03 0.00 0.00 178.44 178.05 3d6k h ALA 83 N 1.35 0.83 -0.36 2.65 0.00 -1.13 -0.43 119.26 122.18 3d6k h ALA 83 Ca 0.29 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3d6k h ALA 83 Cb 0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3d6k h ALA 83 CO -0.21 0.29 0.21 1.49 0.00 0.00 0.00 179.25 181.03 3d6k h GLU 84 N 0.89 0.49 -0.50 0.00 4.81 -0.77 0.28 114.58 119.77 3d6k h GLU 84 Ca 0.24 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.46 3d6k h GLU 84 Cb -0.06 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 3d6k h GLU 84 CO -0.05 0.37 0.34 0.00 -0.73 0.00 0.00 179.01 178.94 3d6k h ALA 85 N 1.09 1.79 -0.00 2.92 0.00 -0.21 -2.74 119.26 122.11 3d6k h ALA 85 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3d6k h ALA 85 Cb 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3d6k h ALA 85 CO -0.02 0.14 -0.65 1.28 0.00 0.00 0.00 179.25 180.00 3d6k n LEU 86 N -4.47 0.68 0.00 0.00 4.77 -0.23 -4.96 117.00 112.79 3d6k n LEU 86 Ca 0.06 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 3d6k n LEU 86 Cb 0.17 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3d6k n LEU 86 CO 0.35 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 3d6k n GLY 87 N 1.50 0.56 3.60 -0.72 0.00 0.24 -4.78 105.19 105.58 3d6k n GLY 87 Ca 0.05 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 44.97 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 0.00 3.16 0.26 0.99 1.43 0.74 -4.96 118.68 120.29 3d6k s LEU 88 Ca 0.00 -0.24 -0.31 0.00 -1.03 0.00 0.00 54.13 52.55 3d6k s LEU 88 Cb 0.00 -1.88 -0.12 0.00 0.03 0.00 0.00 46.19 44.23 3d6k s LEU 88 CO 0.00 0.23 1.65 -2.84 0.23 0.00 0.00 176.35 175.62 3d6k s PRO 89 N -1.83 4.12 0.27 1.29 0.02 -1.26 -4.17 135.00 133.45 3d6k s PRO 89 Ca 0.20 2.59 0.00 0.00 0.02 0.00 0.00 61.00 63.81 3d6k s PRO 89 Cb -0.11 -3.04 0.56 0.00 0.02 0.00 0.00 34.50 31.92 3d6k s PRO 89 CO 0.11 -0.68 1.78 0.00 -0.33 0.00 0.00 177.00 177.88 3d6k h ALA 90 N 5.67 1.37 0.00 -1.55 0.00 -1.91 -1.58 119.26 121.27 3d6k h ALA 90 Ca -0.45 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3d6k h ALA 90 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3d6k h ALA 90 CO 0.86 -0.01 0.00 0.38 0.00 0.00 0.00 179.25 180.48 3d6k h ASP 91 N 0.73 0.00 -0.54 0.00 -0.00 -1.94 -1.52 116.42 113.14 3d6k h ASP 91 Ca 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.51 3d6k h ASP 91 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.97 3d6k h ASP 91 CO -0.34 0.00 0.00 0.18 -0.00 0.00 0.00 179.24 179.08 3d6k n LEU 92 N -2.46 3.59 -4.35 0.15 4.32 -0.59 -4.91 117.00 112.75 3d6k n LEU 92 Ca -0.00 -2.09 -0.33 0.00 -0.02 0.00 0.00 56.01 53.57 3d6k n LEU 92 Cb 0.14 -0.39 -0.15 0.00 -1.62 0.00 0.00 43.42 41.40 3d6k n LEU 92 CO 0.16 0.85 -0.47 -0.69 -1.22 0.00 0.00 177.39 176.02 3d6k s VAL 93 N -1.16 2.86 -0.05 4.08 1.01 -0.57 -2.53 120.40 124.03 3d6k s VAL 93 Ca 0.38 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.67 3d6k s VAL 93 Cb 0.21 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 3d6k s VAL 93 CO 0.24 0.53 -0.18 -0.69 0.00 0.00 0.00 175.10 175.00 3d6k s VAL 94 N 0.28 2.72 -0.12 2.92 1.01 0.27 -4.96 120.40 122.52 3d6k s VAL 94 Ca -0.11 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.04 3d6k s VAL 94 Cb -0.16 -2.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.17 3d6k s VAL 94 CO 0.06 0.58 -0.16 0.00 0.00 0.00 0.00 175.10 175.58 3d6k s ALA 95 N -0.52 2.49 0.00 5.51 0.00 0.23 -1.29 121.76 128.18 3d6k s ALA 95 Ca 0.07 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.11 3d6k s ALA 95 Cb -0.11 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 21.91 3d6k s ALA 95 CO 0.01 0.25 0.00 1.04 0.00 0.00 0.00 175.76 177.06 3d6k n GLN 96 N 3.55 0.00 0.00 0.00 1.13 -0.09 -3.12 117.38 118.85 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 0.53 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.88 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 -0.59 1.08 10.43 -1.26 -4.48 116.55 121.73 3d6k n ASP 97 Ca 0.00 0.00 0.13 0.00 2.57 0.00 0.00 54.79 57.49 3d6k n ASP 97 Cb 0.00 0.00 0.39 0.00 1.84 0.00 0.00 41.12 43.35 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 0.22 2.89 0.44 0.00 -1.25 -0.32 105.19 112.17 3d6k n GLY 98 Ca 0.00 -0.51 -0.16 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.05 0.74 0.35 1.61 0.15 -1.26 -4.20 113.70 109.04 3d6k s SER 99 Ca 0.34 0.29 0.15 0.00 0.70 0.00 0.00 55.95 57.43 3d6k s SER 99 Cb 0.21 0.50 0.65 0.00 -1.71 0.00 0.00 66.02 65.66 3d6k s SER 99 CO 0.35 -0.27 1.74 0.77 1.20 0.00 0.00 173.24 177.03 3d6k h SER 100 N 8.31 0.00 -0.89 5.45 4.64 -1.90 -3.02 113.55 126.14 3d6k h SER 100 Ca -0.15 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.19 3d6k h SER 100 Cb 1.13 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.17 3d6k h SER 100 CO 0.18 0.43 0.59 0.25 -0.87 0.00 0.00 176.83 177.41 3d6k h LEU 101 N 0.00 1.01 -0.64 5.97 5.85 -1.97 -1.66 115.31 123.87 3d6k h LEU 101 Ca -0.00 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.76 3d6k h LEU 101 Cb 0.86 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.58 3d6k h LEU 101 CO 0.06 0.72 0.33 0.78 -0.34 0.00 0.00 178.44 179.98 3d6k h ASN 102 N 1.18 0.46 0.00 1.25 -0.26 -1.95 0.15 115.58 116.41 3d6k h ASN 102 Ca 0.33 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 56.11 3d6k h ASN 102 Cb -0.10 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.12 3d6k h ASN 102 CO -0.08 0.30 0.00 -0.38 -1.06 0.00 0.00 177.43 176.21 3d6k n ILE 103 N -4.84 0.01 0.00 2.81 5.41 -0.63 -1.73 119.36 120.39 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 0.19 -0.09 0.00 0.00 -0.71 0.00 0.00 39.64 39.03 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 0.45 0.00 -0.09 1.39 7.35 0.04 -0.71 117.46 125.89 3d6k n PHE 105 Ca 0.00 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.56 3d6k n PHE 105 Cb 0.04 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 39.86 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 0.92 -0.24 -2.13 3.32 -1.58 0.20 116.42 116.92 3d6k h ASP 106 Ca 0.00 -0.44 0.01 0.00 0.02 0.00 0.00 57.03 56.62 3d6k h ASP 106 Cb 0.00 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 3d6k h ASP 106 CO 0.00 1.22 0.13 -0.07 -1.72 0.00 0.00 179.24 178.80 3d6k h LEU 107 N 0.69 0.21 -0.20 1.55 3.38 -1.20 0.17 115.31 119.90 3d6k h LEU 107 Ca 0.04 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 3d6k h LEU 107 Cb 1.02 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.73 3d6k h LEU 107 CO 0.10 0.16 -0.18 0.40 0.09 0.00 0.00 178.44 179.01 3d6k h ILE 108 N 0.27 1.32 -0.46 1.22 2.04 -1.77 -1.88 117.51 118.26 3d6k h ILE 108 Ca 0.09 -1.32 0.05 0.00 1.00 0.00 0.00 64.86 64.69 3d6k h ILE 108 Cb 0.00 1.73 -0.05 0.00 -0.74 0.00 0.00 36.82 37.77 3d6k h ILE 108 CO -0.05 0.40 0.18 -1.28 0.00 0.00 0.00 178.15 177.41 3d6k h SER 109 N 0.16 0.22 0.95 1.72 0.87 -0.51 -0.28 113.55 116.68 3d6k h SER 109 Ca 0.04 0.05 -0.14 0.00 -1.23 0.00 0.00 61.79 60.50 3d6k h SER 109 Cb 0.71 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.67 3d6k h SER 109 CO 0.05 0.16 -0.69 -0.50 -0.53 0.00 0.00 176.83 175.31 3d6k h TRP 110 N 0.37 0.00 -0.57 2.24 6.55 -0.68 -1.41 115.95 122.45 3d6k h TRP 110 Ca 0.21 0.00 -0.07 0.00 0.95 0.00 0.00 58.89 59.98 3d6k h TRP 110 Cb 0.19 0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 28.46 3d6k h TRP 110 CO -0.14 0.69 0.07 0.77 -1.05 0.00 0.00 178.44 178.78 3d6k h SER 111 N 0.00 0.88 -0.43 -3.49 0.02 -1.16 0.42 113.55 109.79 3d6k h SER 111 Ca -0.01 -0.20 -0.15 0.00 -0.84 0.00 0.00 61.79 60.60 3d6k h SER 111 Cb 1.35 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 3d6k h SER 111 CO 0.09 0.90 -0.30 0.22 -1.14 0.00 0.00 176.83 176.60 3d6k h TYR 112 N 0.87 1.13 0.06 3.45 3.20 -0.62 0.36 116.97 125.42 3d6k h TYR 112 Ca 0.18 -0.31 -0.10 0.00 3.14 0.00 0.00 58.73 61.64 3d6k h TYR 112 Cb 0.41 -0.25 0.01 0.00 1.54 0.00 0.00 36.73 38.44 3d6k h TYR 112 CO 0.03 1.14 -0.43 1.15 -1.64 0.00 0.00 178.16 178.40 3d6k h THR 113 N 0.80 1.60 0.00 1.81 2.02 -1.23 -1.28 112.91 116.63 3d6k h THR 113 Ca 0.09 -2.31 0.00 0.00 0.77 0.00 0.00 66.41 64.95 3d6k h THR 113 Cb 0.89 3.11 0.00 0.00 -1.74 0.00 0.00 68.15 70.41 3d6k h THR 113 CO 0.08 0.64 0.00 0.79 0.37 0.00 0.00 175.52 177.40 3d6k n TRP 114 N -4.36 0.00 -0.10 3.16 8.01 0.12 -4.76 117.44 119.51 3d6k n TRP 114 Ca -0.12 0.00 0.01 0.00 -1.31 0.00 0.00 57.50 56.09 3d6k n TRP 114 Cb 0.64 0.00 -0.01 0.00 -2.01 0.00 0.00 31.31 29.93 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 0.65 -2.55 3.97 6.99 0.00 0.12 -4.50 105.19 109.86 3d6k n GLY 115 Ca 0.00 -1.43 -0.25 0.00 0.00 0.00 0.00 46.02 44.34 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 -4.41 4.09 0.58 1.61 2.20 -1.26 -4.31 114.94 113.44 3d6k s ASN 116 Ca 0.00 -0.11 0.29 0.00 -0.94 0.00 0.00 52.86 52.10 3d6k s ASN 116 Cb 0.00 -0.22 1.48 0.00 -2.00 0.00 0.00 41.25 40.51 3d6k s ASN 116 CO 0.00 -2.05 1.91 -0.55 -2.94 0.00 0.00 177.10 173.47 3d6k h ASN 117 N -0.81 0.00 -0.18 3.54 -1.07 -1.94 0.16 115.58 115.27 3d6k h ASN 117 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.98 3d6k h ASN 117 Cb 1.26 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.51 3d6k h ASN 117 CO 0.42 0.00 0.00 0.47 0.07 0.00 0.00 177.43 178.39 3d6k n ASP 118 N -3.79 2.33 -4.79 6.14 8.00 -1.26 -4.99 116.55 118.19 3d6k n ASP 118 Ca 0.09 -1.80 -0.37 0.00 0.71 0.00 0.00 54.79 53.42 3d6k n ASP 118 Cb 0.68 -0.11 -0.06 0.00 -0.02 0.00 0.00 41.12 41.60 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 -1.68 7.23 -0.02 -2.24 0.01 0.54 -4.19 113.70 113.36 3d6k s SER 119 Ca 0.34 1.67 0.20 0.00 1.31 0.00 0.00 55.95 59.47 3d6k s SER 119 Cb 0.20 -2.52 -0.29 0.00 0.21 0.00 0.00 66.02 63.62 3d6k s SER 119 CO 0.29 -0.03 0.47 -1.54 0.41 0.00 0.00 173.24 172.84 3d6k n SER 120 N 0.62 0.58 -4.03 2.44 3.41 -1.26 -4.87 113.62 110.51 3d6k n SER 120 Ca 0.00 -0.10 -0.08 0.00 -0.26 0.00 0.00 58.87 58.43 3d6k n SER 120 Cb 0.50 1.80 -0.11 0.00 -0.26 0.00 0.00 64.21 66.14 3d6k n SER 120 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d6k s ARG 121 N -3.29 0.44 0.62 4.33 1.70 -1.26 -5.12 118.95 116.36 3d6k s ARG 121 Ca -0.06 -0.85 -0.19 0.00 -0.47 0.00 0.00 55.73 54.16 3d6k s ARG 121 Cb 0.13 0.13 -0.02 0.00 -0.57 0.00 0.00 34.95 34.61 3d6k s ARG 121 CO 0.81 -0.07 1.28 -1.25 -1.08 0.00 0.00 175.30 174.99 3d6k s PRO 122 N -2.41 2.74 0.54 3.89 0.04 -1.26 -4.62 135.00 133.92 3d6k s PRO 122 Ca -0.07 2.02 0.31 0.00 0.04 0.00 0.00 61.00 63.30 3d6k s PRO 122 Cb -0.03 -1.92 1.54 0.00 0.04 0.00 0.00 34.50 34.13 3d6k s PRO 122 CO -0.04 -1.44 2.08 -1.49 0.04 0.00 0.00 177.00 176.15 3d6k h TRP 123 N 0.75 0.00 -0.12 0.56 6.55 -1.26 -1.51 115.95 120.92 3d6k h TRP 123 Ca -0.51 0.00 0.04 0.00 0.95 0.00 0.00 58.89 59.37 3d6k h TRP 123 Cb 1.32 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 29.62 3d6k h TRP 123 CO 0.43 0.09 0.15 0.66 -1.05 0.00 0.00 178.44 178.72 3d6k h SER 124 N 0.00 0.00 1.60 -3.49 4.64 -1.49 -2.81 113.55 112.01 3d6k h SER 124 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d6k h SER 124 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3d6k h SER 124 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 3d6k h ALA 125 N 1.81 1.00 -2.70 5.18 0.00 -1.53 -3.46 119.26 119.57 3d6k h ALA 125 Ca 0.06 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.45 3d6k h ALA 125 Cb 0.36 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.18 3d6k h ALA 125 CO -0.00 0.00 0.61 -1.21 0.00 0.00 0.00 179.25 178.65 3d6k s GLU 126 N -3.28 4.43 0.43 0.00 0.41 -1.06 -4.92 118.70 114.72 3d6k s GLU 126 Ca 0.06 2.00 0.11 0.00 -0.41 0.00 0.00 54.97 56.73 3d6k s GLU 126 Cb 0.08 -3.20 0.98 0.00 -1.78 0.00 0.00 34.13 30.21 3d6k s GLU 126 CO 0.61 -0.16 2.05 1.05 -0.49 0.00 0.00 175.26 178.31 3d6k h GLU 127 N 5.03 0.41 -3.20 1.61 9.09 -1.89 -3.42 114.58 122.21 3d6k h GLU 127 Ca -0.45 -0.02 -0.20 0.00 0.05 0.00 0.00 59.36 58.73 3d6k h GLU 127 Cb 1.22 -0.09 -0.28 0.00 -1.65 0.00 0.00 28.75 27.94 3d6k h GLU 127 CO 0.74 0.27 -0.52 0.21 0.05 0.00 0.00 179.01 179.77 3d6k s LYS 128 N -5.40 0.19 -0.24 1.06 2.20 -1.26 -5.13 119.74 111.16 3d6k s LYS 128 Ca -0.08 0.36 -0.02 0.00 -0.36 0.00 0.00 55.97 55.88 3d6k s LYS 128 Cb 0.18 -0.02 0.02 0.00 -1.51 0.00 0.00 37.83 36.50 3d6k s LYS 128 CO 0.73 -0.10 -0.07 0.08 -0.36 0.00 0.00 175.35 175.63 3d6k s VAL 129 N 0.68 2.86 -0.03 4.02 1.01 -1.26 -4.82 120.40 122.86 3d6k s VAL 129 Ca -0.05 -0.96 -0.13 0.00 0.00 0.00 0.00 61.98 60.85 3d6k s VAL 129 Cb -0.06 -2.42 -0.05 0.00 0.00 0.00 0.00 36.38 33.85 3d6k s VAL 129 CO -0.04 0.25 0.34 -0.54 0.00 0.00 0.00 175.10 175.11 3d6k s LYS 130 N 1.34 3.79 -0.04 2.72 1.02 -0.14 0.18 119.74 128.61 3d6k s LYS 130 Ca 0.01 0.27 0.01 0.00 0.02 0.00 0.00 55.97 56.28 3d6k s LYS 130 Cb -0.16 -3.21 0.02 0.00 -0.52 0.00 0.00 37.83 33.96 3d6k s LYS 130 CO -0.05 0.71 -0.03 -0.46 -0.92 0.00 0.00 175.35 174.61 3d6k s TRP 131 N -1.07 0.62 -0.05 3.18 -0.11 -0.71 -0.86 118.94 119.94 3d6k s TRP 131 Ca 0.22 -0.14 -0.27 0.00 1.22 0.00 0.00 56.10 57.13 3d6k s TRP 131 Cb -0.15 -0.61 -0.03 0.00 -1.50 0.00 0.00 33.47 31.17 3d6k s TRP 131 CO 0.11 -0.19 0.84 -0.51 -4.62 0.00 0.00 176.95 172.58 3d6k s LEU 132 N 1.09 4.32 -0.55 5.86 1.43 0.21 -1.58 118.68 129.46 3d6k s LEU 132 Ca -0.09 1.40 0.02 0.00 -1.03 0.00 0.00 54.13 54.44 3d6k s LEU 132 Cb -0.14 -3.32 0.14 0.00 0.03 0.00 0.00 46.19 42.90 3d6k s LEU 132 CO -0.01 -0.21 0.32 0.00 0.23 0.00 0.00 176.35 176.67 3d6k s PRO 134 N -0.26 3.99 -0.02 0.00 0.02 -1.26 0.11 135.00 137.58 3d6k s PRO 134 Ca 0.17 2.49 -0.03 0.00 0.02 0.00 0.00 61.00 63.65 3d6k s PRO 134 Cb -0.24 -2.87 0.01 0.00 0.02 0.00 0.00 34.50 31.41 3d6k s PRO 134 CO -0.01 -0.60 0.07 0.54 -0.33 0.00 0.00 177.00 176.67 3d6k s VAL 135 N -1.15 0.01 0.35 3.83 0.11 0.42 -3.85 120.40 120.12 3d6k s VAL 135 Ca 0.55 -0.11 -0.27 0.00 -2.93 0.00 0.00 61.98 59.22 3d6k s VAL 135 Cb -0.45 -0.15 -0.12 0.00 -1.53 0.00 0.00 36.38 34.13 3d6k s VAL 135 CO 0.60 -0.06 1.17 -2.65 -3.33 0.00 0.00 175.10 170.83 3d6k n PRO 136 N 2.83 1.78 -0.48 1.54 -0.02 -1.26 -4.58 135.00 134.81 3d6k n PRO 136 Ca -0.14 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3d6k n PRO 136 Cb 0.59 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 3d6k n PRO 136 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d6k n GLY 137 N 0.96 5.12 3.47 -1.23 0.00 -0.20 -4.46 105.19 108.84 3d6k n GLY 137 Ca 0.07 -1.54 -0.38 0.00 0.00 0.00 0.00 46.02 44.17 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 -1.06 3.15 0.33 1.61 6.04 -1.24 -4.28 117.35 121.89 3d6k s TYR 138 Ca 0.00 -0.39 0.05 0.00 0.04 0.00 0.00 57.07 56.77 3d6k s TYR 138 Cb 0.00 -2.31 0.70 0.00 -1.04 0.00 0.00 41.96 39.31 3d6k s TYR 138 CO 0.00 -0.36 1.87 0.38 -1.54 0.00 0.00 175.55 175.90 3d6k h ASP 139 N 8.31 0.77 0.43 4.32 -0.00 -1.89 -1.74 116.42 126.62 3d6k h ASP 139 Ca -0.35 0.04 -0.09 0.00 -0.00 0.00 0.00 57.03 56.62 3d6k h ASP 139 Cb 1.17 -0.12 -0.01 0.00 -0.00 0.00 0.00 39.33 40.36 3d6k h ASP 139 CO 0.59 0.42 -0.43 0.03 -0.00 0.00 0.00 179.24 179.85 3d6k h ARG 140 N 0.83 0.00 0.81 4.15 3.08 -1.94 -0.06 114.38 121.25 3d6k h ARG 140 Ca 0.45 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.46 3d6k h ARG 140 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.60 3d6k h ARG 140 CO -0.21 0.43 -0.45 0.45 -1.07 0.00 0.00 179.97 179.12 3d6k h HIS 141 N 0.00 -1.18 0.00 3.04 3.86 -1.75 -3.05 115.15 116.07 3d6k h HIS 141 Ca -0.00 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.17 3d6k h HIS 141 Cb 0.76 0.41 -0.00 0.00 1.06 0.00 0.00 27.41 29.63 3d6k h HIS 141 CO 0.00 -0.69 -0.10 0.74 0.86 0.00 0.00 177.93 178.73 3d6k h PHE 142 N -1.16 0.00 -0.24 2.45 0.04 -1.19 0.72 116.94 117.55 3d6k h PHE 142 Ca -0.11 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.57 3d6k h PHE 142 Cb 0.92 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 3d6k h PHE 142 CO -0.07 0.10 -0.23 1.15 -0.60 0.00 0.00 178.31 178.66 3d6k h THR 143 N 0.00 1.26 -0.21 -1.55 2.02 -1.01 -1.12 112.91 112.30 3d6k h THR 143 Ca -0.00 -1.21 -0.05 0.00 0.77 0.00 0.00 66.41 65.92 3d6k h THR 143 Cb 0.28 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 3d6k h THR 143 CO 0.01 0.38 -0.07 0.40 0.37 0.00 0.00 175.52 176.61 3d6k h ILE 144 N 0.39 1.29 0.00 3.11 2.04 -0.74 -1.53 117.51 122.08 3d6k h ILE 144 Ca 0.06 -1.09 -0.19 0.00 1.00 0.00 0.00 64.86 64.64 3d6k h ILE 144 Cb 0.63 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 3d6k h ILE 144 CO 0.04 0.33 -0.86 0.71 0.00 0.00 0.00 178.15 178.37 3d6k h THR 145 N 0.14 1.53 -0.66 -0.27 1.35 -1.49 -1.92 112.91 111.58 3d6k h THR 145 Ca 0.05 -2.70 0.08 0.00 -0.55 0.00 0.00 66.41 63.29 3d6k h THR 145 Cb 0.54 2.49 -0.06 0.00 -1.73 0.00 0.00 68.15 69.39 3d6k h THR 145 CO 0.02 0.78 0.33 -0.08 -0.25 0.00 0.00 175.52 176.33 3d6k h GLU 146 N 0.07 0.58 0.00 4.72 4.81 -1.12 -1.40 114.58 122.23 3d6k h GLU 146 Ca -0.03 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 3d6k h GLU 146 Cb 1.50 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.74 3d6k h GLU 146 CO 0.13 0.38 -0.13 1.25 -0.73 0.00 0.00 179.01 179.91 3d6k h HIS 147 N 0.59 0.00 -0.30 0.92 2.76 -0.48 -0.80 115.15 117.84 3d6k h HIS 147 Ca 0.31 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.48 3d6k h HIS 147 Cb 0.28 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.24 3d6k h HIS 147 CO -0.10 0.13 0.00 1.19 -1.30 0.00 0.00 177.93 177.85 3d6k n PHE 148 N -3.99 0.39 -2.16 5.26 3.01 -0.88 -4.94 117.46 114.15 3d6k n PHE 148 Ca -0.02 -0.19 -0.11 0.00 1.01 0.00 0.00 57.45 58.13 3d6k n PHE 148 Cb 0.22 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.68 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 1.36 -0.01 3.79 1.37 0.00 -0.31 -5.00 105.19 106.39 3d6k n GLY 149 Ca 0.18 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.56 3.34 0.26 1.61 0.08 -0.58 -4.76 117.98 115.36 3d6k s PHE 150 Ca 0.00 1.66 -0.03 0.00 0.12 0.00 0.00 56.93 58.69 3d6k s PHE 150 Cb 0.00 -3.05 0.06 0.00 -0.57 0.00 0.00 43.02 39.46 3d6k s PHE 150 CO 0.00 -0.41 0.36 -1.91 -0.10 0.00 0.00 175.22 173.16 3d6k n GLU 151 N -0.08 0.00 -3.44 0.44 2.13 0.13 -4.67 120.64 115.15 3d6k n GLU 151 Ca 0.05 -0.74 0.01 0.00 0.66 0.00 0.00 57.16 57.14 3d6k n GLU 151 Cb 0.50 -0.31 -0.04 0.00 0.27 0.00 0.00 31.44 31.86 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 -1.34 -0.43 0.14 6.31 1.01 -0.61 -1.74 121.20 124.54 3d6k s ILE 153 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 60.65 60.57 3d6k s ILE 153 Cb -0.01 -1.00 -0.07 0.00 0.01 0.00 0.00 42.46 41.39 3d6k s ILE 153 CO 0.15 0.00 1.21 0.20 0.00 0.00 0.00 174.94 176.50 3d6k s ASN 154 N 2.28 7.07 -0.06 3.58 -0.87 -1.26 0.24 114.94 125.92 3d6k s ASN 154 Ca -0.04 2.16 0.06 0.00 -1.57 0.00 0.00 52.86 53.47 3d6k s ASN 154 Cb -0.06 -2.60 -0.01 0.00 -0.02 0.00 0.00 41.25 38.57 3d6k s ASN 154 CO -0.17 -0.42 -0.24 0.68 -2.57 0.00 0.00 177.10 174.38 3d6k s VAL 155 N 0.41 2.01 0.00 1.60 -7.23 0.31 -4.84 120.40 112.66 3d6k s VAL 155 Ca 0.56 -1.03 0.00 0.00 -1.81 0.00 0.00 61.98 59.70 3d6k s VAL 155 Cb -0.32 -1.71 0.00 0.00 0.56 0.00 0.00 36.38 34.92 3d6k s VAL 155 CO 0.33 0.56 0.00 -2.65 -0.31 0.00 0.00 175.10 173.03 3d6k n PRO 156 N 3.07 1.92 -3.03 4.82 -0.02 -1.26 -0.44 135.00 140.07 3d6k n PRO 156 Ca -0.18 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.25 3d6k n PRO 156 Cb 0.52 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 34.02 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 -0.19 0.00 1.72 3.45 -2.24 0.42 -1.29 114.28 116.15 3d6k n THR 158 Ca 0.00 -0.64 0.09 0.00 -2.27 0.00 0.00 64.05 61.24 3d6k n THR 158 Cb 0.00 0.67 0.47 0.00 -2.10 0.00 0.00 70.33 69.37 3d6k n THR 158 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3d6k n ASP 159 N -1.31 0.60 -0.00 3.42 8.00 -1.26 -2.46 116.55 123.53 3d6k n ASP 159 Ca -0.05 -1.54 0.07 0.00 0.71 0.00 0.00 54.79 53.98 3d6k n ASP 159 Cb 0.42 -0.04 -0.10 0.00 -0.02 0.00 0.00 41.12 41.38 3d6k n ASP 159 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3d6k n GLU 160 N -0.38 1.33 0.00 -1.24 -0.58 -1.26 -4.75 120.64 113.76 3d6k n GLU 160 Ca 0.14 -0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.82 3d6k n GLU 160 Cb 0.16 -1.28 0.00 0.00 -0.57 0.00 0.00 31.44 29.75 3d6k n GLU 160 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3d6k n GLY 161 N 1.48 0.51 3.75 0.62 0.00 -1.03 -1.22 105.19 109.30 3d6k n GLY 161 Ca 0.00 -2.00 -0.38 0.00 0.00 0.00 0.00 46.02 43.65 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 -0.64 3.11 1.06 1.61 0.02 -1.26 -0.43 135.00 138.47 3d6k s PRO 162 Ca 0.00 2.07 -0.13 0.00 0.02 0.00 0.00 61.00 62.96 3d6k s PRO 162 Cb 0.00 -2.16 0.22 0.00 0.02 0.00 0.00 34.50 32.58 3d6k s PRO 162 CO 0.00 -1.16 1.08 0.34 -0.33 0.00 0.00 177.00 176.93 3d6k s ASP 163 N -1.19 2.04 0.00 2.53 -1.08 -0.41 -4.76 116.67 113.80 3d6k s ASP 163 Ca 0.73 1.15 0.00 0.00 -0.52 0.00 0.00 52.55 53.91 3d6k s ASP 163 Cb -0.37 -1.79 0.00 0.00 -1.46 0.00 0.00 42.92 39.30 3d6k s ASP 163 CO 0.42 -3.49 0.00 0.61 0.52 0.00 0.00 175.17 173.23 3d6k n GLY 165 N -0.74 0.00 0.10 2.66 0.00 -1.26 -1.67 105.19 104.28 3d6k n GLY 165 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 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 1.11 0.10 1.61 2.07 -1.99 -2.86 116.25 116.29 3d6k h VAL 166 Ca 0.00 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 3d6k h VAL 166 Cb 0.00 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 3d6k h VAL 166 CO 0.00 0.10 -0.05 0.58 0.02 0.00 0.00 177.57 178.22 3d6k h VAL 167 N 0.13 0.93 -0.19 2.57 2.07 -1.71 -2.01 116.25 118.05 3d6k h VAL 167 Ca 0.05 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.45 3d6k h VAL 167 Cb 0.09 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 3d6k h VAL 167 CO -0.01 0.03 0.13 0.03 0.02 0.00 0.00 177.57 177.77 3d6k h ARG 168 N -0.19 0.24 -0.36 1.57 3.08 -1.85 -0.91 114.38 115.95 3d6k h ARG 168 Ca -0.01 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 59.89 3d6k h ARG 168 Cb 0.16 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3d6k h ARG 168 CO 0.02 0.16 -0.30 1.49 -1.07 0.00 0.00 179.97 180.27 3d6k h GLU 169 N 0.25 0.84 -0.01 0.04 4.57 -1.30 -3.35 114.58 115.62 3d6k h GLU 169 Ca 0.07 -0.42 -0.15 0.00 -1.18 0.00 0.00 59.36 57.67 3d6k h GLU 169 Cb -0.01 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 3d6k h GLU 169 CO -0.02 1.06 -0.70 -0.07 -1.18 0.00 0.00 179.01 178.11 3d6k h LEU 170 N 0.64 0.09 -0.43 1.64 3.38 -0.44 -3.18 115.31 117.01 3d6k h LEU 170 Ca 0.07 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3d6k h LEU 170 Cb 0.88 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.60 3d6k h LEU 170 CO 0.08 0.76 0.00 1.33 0.09 0.00 0.00 178.44 180.70 3d6k n VAL 171 N -3.74 0.73 0.27 1.22 0.24 -0.65 -2.07 118.33 114.32 3d6k n VAL 171 Ca -0.02 0.03 0.12 0.00 -2.04 0.00 0.00 64.34 62.43 3d6k n VAL 171 Cb 0.68 -0.93 0.57 0.00 -1.47 0.00 0.00 33.84 32.69 3d6k n VAL 171 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 3d6k h LYS 172 N 0.00 0.00 -5.75 7.34 1.57 -1.68 0.41 116.57 118.46 3d6k h LYS 172 Ca 0.00 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.19 3d6k h LYS 172 Cb 0.51 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.74 3d6k h LYS 172 CO 0.00 0.00 0.23 0.34 -0.57 0.00 0.00 179.45 179.45 3d6k s ASP 173 N -4.21 6.78 0.52 0.86 -1.08 -0.88 -4.64 116.67 114.03 3d6k s ASP 173 Ca 0.00 0.95 0.21 0.00 -0.52 0.00 0.00 52.55 53.19 3d6k s ASP 173 Cb 0.08 -2.39 1.33 0.00 -1.46 0.00 0.00 42.92 40.48 3d6k s ASP 173 CO 0.29 -0.33 2.07 -0.65 0.52 0.00 0.00 175.17 177.08 3d6k h PRO 174 N 7.46 0.01 0.00 4.34 0.11 -1.88 -2.05 132.00 139.98 3d6k h PRO 174 Ca -0.30 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3d6k h PRO 174 Cb 1.14 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3d6k h PRO 174 CO 0.80 0.00 0.00 1.96 -0.21 0.00 0.00 178.00 180.55 3d6k h GLN 175 N 0.01 0.00 -6.64 1.05 4.20 -1.92 -3.39 115.11 108.42 3d6k h GLN 175 Ca 0.13 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.28 3d6k h GLN 175 Cb 0.50 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.22 3d6k h GLN 175 CO -0.00 0.00 0.98 0.08 -0.67 0.00 0.00 178.83 179.22 3d6k s VAL 176 N -3.37 4.08 -0.60 -0.54 1.01 -0.77 -0.97 120.40 119.23 3d6k s VAL 176 Ca 0.03 1.07 0.22 0.00 0.00 0.00 0.00 61.98 63.30 3d6k s VAL 176 Cb 0.09 -4.52 -0.24 0.00 0.00 0.00 0.00 36.38 31.71 3d6k s VAL 176 CO 0.38 -1.01 0.79 0.29 0.00 0.00 0.00 175.10 175.55 3d6k n LYS 177 N 8.04 0.27 0.00 2.72 4.76 -0.04 -4.45 118.16 129.47 3d6k n LYS 177 Ca 0.13 -0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 3d6k n LYS 177 Cb 0.49 -1.52 0.00 0.00 -1.84 0.00 0.00 35.03 32.15 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 1.40 -0.82 3.41 0.72 0.00 -1.25 -1.81 105.19 106.84 3d6k n GLY 178 Ca 0.01 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 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 -4.00 2.61 0.04 1.61 0.52 -0.72 0.66 118.94 119.66 3d6k s TRP 180 Ca 0.00 -0.32 0.02 0.00 0.02 0.00 0.00 56.10 55.83 3d6k s TRP 180 Cb 0.00 -1.62 -0.02 0.00 -1.15 0.00 0.00 33.47 30.68 3d6k s TRP 180 CO 0.00 0.06 -0.08 0.95 0.02 0.00 0.00 176.95 177.90 3d6k s THR 181 N -0.55 0.59 -0.45 2.01 -4.23 -0.29 -4.20 115.64 108.51 3d6k s THR 181 Ca 0.08 -1.04 0.03 0.00 -1.18 0.00 0.00 61.69 59.57 3d6k s THR 181 Cb -0.11 -0.63 0.13 0.00 1.34 0.00 0.00 72.50 73.22 3d6k s THR 181 CO 0.01 -0.33 0.22 -0.69 -0.54 0.00 0.00 174.62 173.28 3d6k s VAL 182 N -1.28 1.97 -0.70 2.29 1.01 -1.26 -2.15 120.40 120.28 3d6k s VAL 182 Ca -0.08 -2.78 0.25 0.00 0.00 0.00 0.00 61.98 59.37 3d6k s VAL 182 Cb -0.09 -2.39 0.26 0.00 0.00 0.00 0.00 36.38 34.16 3d6k s VAL 182 CO 0.01 -0.81 1.76 -0.81 0.00 0.00 0.00 175.10 175.25 3d6k n PRO 183 N 3.53 0.20 -4.49 2.72 -0.04 -1.26 -3.93 135.00 131.73 3d6k n PRO 183 Ca 0.06 0.26 -0.25 0.00 -0.04 0.00 0.00 63.50 63.53 3d6k n PRO 183 Cb 0.35 -1.77 -0.17 0.00 -0.04 0.00 0.00 33.50 31.87 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 -3.15 1.11 -1.24 0.52 1.01 -1.26 0.14 120.40 117.53 3d6k s VAL 184 Ca 0.09 -0.45 -0.19 0.00 0.00 0.00 0.00 61.98 61.43 3d6k s VAL 184 Cb 0.12 -1.03 0.01 0.00 0.00 0.00 0.00 36.38 35.48 3d6k s VAL 184 CO 0.51 0.35 0.63 0.49 0.00 0.00 0.00 175.10 177.08 3d6k n PHE 185 N 3.95 -1.67 -1.61 5.22 3.72 -1.12 -4.27 117.46 121.68 3d6k n PHE 185 Ca -0.22 0.42 -0.47 0.00 -0.05 0.00 0.00 57.45 57.14 3d6k n PHE 185 Cb 0.51 -3.29 -0.03 0.00 -0.94 0.00 0.00 39.48 35.73 3d6k n PHE 185 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d6k n GLY 186 N -1.92 0.21 3.62 1.37 0.00 0.25 -4.52 105.19 104.19 3d6k n GLY 186 Ca -0.16 0.48 -0.43 0.00 0.00 0.00 0.00 46.02 45.91 3d6k n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3d6k s ASN 187 N -0.03 6.79 0.00 1.61 3.84 -1.26 0.10 114.94 126.00 3d6k s ASN 187 Ca 0.69 0.80 0.19 0.00 0.21 0.00 0.00 52.86 54.75 3d6k s ASN 187 Cb -0.76 -2.55 -0.07 0.00 -0.55 0.00 0.00 41.25 37.32 3d6k s ASN 187 CO 0.53 -1.05 0.92 -0.81 -2.79 0.00 0.00 177.10 173.90 3d6k n PRO 188 N 7.31 1.22 0.11 0.43 -0.04 -1.26 -3.61 135.00 139.16 3d6k n PRO 188 Ca 0.12 -0.61 0.12 0.00 -0.04 0.00 0.00 63.50 63.09 3d6k n PRO 188 Cb 0.48 -1.39 0.45 0.00 -0.04 0.00 0.00 33.50 33.00 3d6k n PRO 188 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3d6k n THR 189 N -0.53 0.69 -0.89 0.52 -2.24 -0.64 -3.64 114.28 107.55 3d6k n THR 189 Ca 0.07 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 3d6k n THR 189 Cb 0.37 -0.85 0.00 0.00 -2.10 0.00 0.00 70.33 67.76 3d6k n THR 189 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d6k n GLY 190 N 0.71 0.52 3.73 3.38 0.00 0.28 -4.80 105.19 109.01 3d6k n GLY 190 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 3d6k n GLY 190 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d6k s VAL 191 N -2.42 3.99 -0.15 1.61 1.01 -1.26 -3.93 120.40 119.26 3d6k s VAL 191 Ca 0.00 1.65 -0.03 0.00 0.00 0.00 0.00 61.98 63.60 3d6k s VAL 191 Cb 0.00 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 3d6k s VAL 191 CO 0.00 0.25 -0.06 0.42 0.00 0.00 0.00 175.10 175.71 3d6k s THR 192 N 0.05 3.65 0.13 3.92 -4.23 -1.26 -0.58 115.64 117.32 3d6k s THR 192 Ca 0.51 -0.44 -0.31 0.00 -1.18 0.00 0.00 61.69 60.26 3d6k s THR 192 Cb -0.28 -2.59 -0.10 0.00 1.34 0.00 0.00 72.50 70.87 3d6k s THR 192 CO 0.33 0.50 1.63 -0.36 -0.54 0.00 0.00 174.62 176.19 3d6k s PHE 193 N 0.38 2.75 1.06 3.99 2.99 0.12 -4.66 117.98 124.62 3d6k s PHE 193 Ca -0.06 0.44 -0.13 0.00 0.00 0.00 0.00 56.93 57.18 3d6k s PHE 193 Cb -0.15 -3.98 0.18 0.00 0.00 0.00 0.00 43.02 39.08 3d6k s PHE 193 CO 0.04 -3.78 0.81 -1.13 -0.00 0.00 0.00 175.22 171.16 3d6k n SER 194 N 4.68 -1.26 -0.06 1.36 3.41 -0.35 -4.78 113.62 116.62 3d6k n SER 194 Ca 0.15 0.09 -0.08 0.00 -0.26 0.00 0.00 58.87 58.77 3d6k n SER 194 Cb 0.39 -1.27 -0.02 0.00 -0.26 0.00 0.00 64.21 63.05 3d6k n SER 194 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3d6k h GLU 195 N -2.20 0.18 -0.99 4.33 4.81 -1.93 -2.08 114.58 116.70 3d6k h GLU 195 Ca -0.52 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 58.76 3d6k h GLU 195 Cb 1.31 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.59 3d6k h GLU 195 CO 0.43 0.12 0.65 0.37 -0.73 0.00 0.00 179.01 179.84 3d6k h GLN 196 N 0.18 1.15 -0.49 1.92 4.15 -1.96 -1.38 115.11 118.68 3d6k h GLN 196 Ca 0.11 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.44 3d6k h GLN 196 Cb 0.08 -0.26 -0.02 0.00 0.21 0.00 0.00 27.48 27.49 3d6k h GLN 196 CO -0.11 0.76 0.23 1.15 -1.93 0.00 0.00 178.83 178.93 3d6k h THR 197 N 1.18 1.19 -0.50 2.39 2.02 -1.79 -0.19 112.91 117.22 3d6k h THR 197 Ca 0.42 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 3d6k h THR 197 Cb 0.14 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 3d6k h THR 197 CO -0.16 0.21 0.29 0.00 0.37 0.00 0.00 175.52 176.23 3d6k h ARG 199 N 0.69 0.43 -0.28 0.00 3.08 -0.64 -2.86 114.38 114.79 3d6k h ARG 199 Ca 0.18 -0.42 -0.00 0.00 0.07 0.00 0.00 59.98 59.81 3d6k h ARG 199 Cb -0.00 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3d6k h ARG 199 CO -0.03 1.08 0.17 0.93 -1.07 0.00 0.00 179.97 181.05 3d6k h GLU 200 N -0.05 0.38 -0.01 0.04 5.08 -0.88 -0.08 114.58 119.06 3d6k h GLU 200 Ca -0.06 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.10 3d6k h GLU 200 Cb 1.25 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 3d6k h GLU 200 CO 0.11 0.27 -0.78 -0.07 -1.00 0.00 0.00 179.01 177.53 3d6k h LEU 201 N 0.39 0.15 -0.10 1.33 3.38 -1.32 -3.16 115.31 115.97 3d6k h LEU 201 Ca 0.10 -0.11 -0.23 0.00 0.09 0.00 0.00 57.88 57.73 3d6k h LEU 201 Cb -0.02 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3d6k h LEU 201 CO -0.02 0.87 -1.02 0.00 0.09 0.00 0.00 178.44 178.37 3d6k h ALA 202 N 1.12 0.34 -1.89 1.53 0.00 -1.20 -3.49 119.26 115.66 3d6k h ALA 202 Ca -0.02 -0.80 -0.74 0.00 0.00 0.00 0.00 54.91 53.34 3d6k h ALA 202 Cb 1.37 -0.06 -0.20 0.00 0.00 0.00 0.00 17.79 18.91 3d6k h ALA 202 CO 0.11 0.98 1.10 -1.21 0.00 0.00 0.00 179.25 180.23 3d6k s GLU 203 N -2.96 4.03 -0.04 0.00 2.02 -0.09 -4.55 118.70 117.12 3d6k s GLU 203 Ca -0.03 -2.58 0.01 0.00 0.02 0.00 0.00 54.97 52.39 3d6k s GLU 203 Cb 0.09 -4.94 0.02 0.00 0.10 0.00 0.00 34.13 29.40 3d6k s GLU 203 CO 0.85 -1.67 -0.03 -1.54 0.02 0.00 0.00 175.26 172.89 3d6k s SER 205 N 2.67 0.88 0.18 -0.19 1.04 -1.26 -5.05 113.70 111.97 3d6k s SER 205 Ca 0.39 -0.10 0.06 0.00 0.48 0.00 0.00 55.95 56.77 3d6k s SER 205 Cb -0.04 -0.40 -0.04 0.00 0.10 0.00 0.00 66.02 65.64 3d6k s SER 205 CO -0.03 -0.07 0.11 0.42 0.98 0.00 0.00 173.24 174.64 3d6k s THR 206 N 1.02 4.27 0.13 2.02 -4.23 -1.26 -4.71 115.64 112.89 3d6k s THR 206 Ca -0.10 -1.21 -0.11 0.00 -1.18 0.00 0.00 61.69 59.10 3d6k s THR 206 Cb -0.14 -3.19 -0.10 0.00 1.34 0.00 0.00 72.50 70.42 3d6k s THR 206 CO -0.01 -0.14 1.40 0.00 -0.54 0.00 0.00 174.62 175.34 3d6k h ALA 207 N 2.39 0.47 -2.43 3.99 0.00 -0.42 -3.43 119.26 119.82 3d6k h ALA 207 Ca -0.47 -0.53 -0.54 0.00 0.00 0.00 0.00 54.91 53.37 3d6k h ALA 207 Cb 1.21 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.93 3d6k h ALA 207 CO 0.62 0.68 0.79 0.00 0.00 0.00 0.00 179.25 181.34 3d6k s ALA 208 N -4.05 3.57 0.13 0.00 0.00 -1.26 -4.83 121.76 115.32 3d6k s ALA 208 Ca -0.10 0.96 0.24 0.00 0.00 0.00 0.00 51.96 53.05 3d6k s ALA 208 Cb 0.10 -3.57 0.93 0.00 0.00 0.00 0.00 23.12 20.57 3d6k s ALA 208 CO 0.89 -0.81 1.83 -1.00 0.00 0.00 0.00 175.76 176.67 3d6k h PRO 209 N 7.51 0.00 -0.35 0.00 0.13 -1.88 -3.19 132.00 134.23 3d6k h PRO 209 Ca -0.39 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.59 3d6k h PRO 209 Cb 1.19 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 3d6k h PRO 209 CO 0.89 0.22 -0.02 -0.40 -0.23 0.00 0.00 178.00 178.45 3d6k n ASP 210 N -3.39 2.89 -4.65 1.44 5.75 -1.26 -4.92 116.55 112.41 3d6k n ASP 210 Ca 0.00 -3.56 -0.45 0.00 -0.01 0.00 0.00 54.79 50.77 3d6k n ASP 210 Cb 0.43 -0.62 -0.02 0.00 -1.03 0.00 0.00 41.12 39.88 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 -0.97 1.97 -4.27 2.11 7.35 -1.21 -4.92 117.46 117.52 3d6k n PHE 211 Ca 0.31 0.52 -0.19 0.00 -0.76 0.00 0.00 57.45 57.33 3d6k n PHE 211 Cb 1.02 -2.40 -0.15 0.00 0.35 0.00 0.00 39.48 38.30 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 -0.82 0.75 -0.22 -4.13 1.81 -0.75 -4.55 118.95 111.03 3d6k s ARG 212 Ca 0.65 -0.22 -0.07 0.00 -1.72 0.00 0.00 55.73 54.36 3d6k s ARG 212 Cb -0.67 -0.72 -0.04 0.00 -0.45 0.00 0.00 34.95 33.08 3d6k s ARG 212 CO 0.54 0.08 0.07 0.42 -0.68 0.00 0.00 175.30 175.72 3d6k s ILE 213 N 0.24 4.58 -0.51 1.52 1.01 0.88 -4.24 121.20 124.68 3d6k s ILE 213 Ca -0.03 -0.09 -0.28 0.00 0.00 0.00 0.00 60.65 60.25 3d6k s ILE 213 Cb -0.08 -3.11 0.03 0.00 0.01 0.00 0.00 42.46 39.32 3d6k s ILE 213 CO 0.00 0.39 1.11 -0.69 0.00 0.00 0.00 174.94 175.75 3d6k s VAL 214 N 1.04 4.19 -1.14 2.92 1.01 -1.26 -1.34 120.40 125.82 3d6k s VAL 214 Ca 0.04 1.00 -0.11 0.00 0.00 0.00 0.00 61.98 62.91 3d6k s VAL 214 Cb -0.14 -4.62 0.23 0.00 0.00 0.00 0.00 36.38 31.85 3d6k s VAL 214 CO 0.03 -1.10 1.25 0.86 0.00 0.00 0.00 175.10 176.14 3d6k s TRP 215 N 4.49 3.90 -1.25 5.22 -0.11 0.94 -1.14 118.94 130.97 3d6k s TRP 215 Ca 0.44 -2.40 -0.18 0.00 1.22 0.00 0.00 56.10 55.18 3d6k s TRP 215 Cb -0.08 -4.06 0.09 0.00 -1.50 0.00 0.00 33.47 27.92 3d6k s TRP 215 CO 0.28 -1.16 1.65 0.34 -4.62 0.00 0.00 176.95 173.44 3d6k s ASP 216 N 2.06 6.86 -1.49 5.86 2.15 -0.91 -4.17 116.67 127.02 3d6k s ASP 216 Ca 0.36 -2.48 -0.10 0.00 0.43 0.00 0.00 52.55 50.76 3d6k s ASP 216 Cb -0.07 -2.54 -0.09 0.00 -0.30 0.00 0.00 42.92 39.92 3d6k s ASP 216 CO -0.05 -1.11 2.99 -3.20 -0.17 0.00 0.00 175.17 173.64 3d6k n ASN 217 N 7.84 8.49 0.05 -0.34 2.85 -1.26 -4.14 115.26 128.75 3d6k n ASN 217 Ca 0.45 -2.59 0.16 0.00 -0.11 0.00 0.00 54.58 52.49 3d6k n ASN 217 Cb 0.46 -1.54 0.66 0.00 1.24 0.00 0.00 39.78 40.59 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 4.83 2.32 -0.13 5.20 0.00 -1.89 -3.15 119.26 126.44 3d6k h ALA 218 Ca 0.82 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.62 3d6k h ALA 218 Cb 0.37 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.09 3d6k h ALA 218 CO 1.66 -0.43 -0.58 0.66 0.00 0.00 0.00 179.25 180.55 3d6k n TYR 219 N -4.43 0.46 0.26 0.00 4.01 -1.26 -4.70 117.16 111.50 3d6k n TYR 219 Ca 0.07 -1.58 0.11 0.00 -0.16 0.00 0.00 57.90 56.33 3d6k n TYR 219 Cb 0.45 -0.26 0.50 0.00 -0.31 0.00 0.00 39.34 39.73 3d6k n TYR 219 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3d6k n ALA 220 N -0.97 1.31 -0.56 -0.72 0.00 -1.19 -2.27 120.51 116.09 3d6k n ALA 220 Ca 0.22 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.80 3d6k n ALA 220 Cb 0.76 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.89 3d6k n ALA 220 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3d6k n LEU 221 N -2.17 0.53 -3.34 0.00 4.77 -1.26 -4.69 117.00 110.83 3d6k n LEU 221 Ca 0.00 -0.53 -0.38 0.00 -0.03 0.00 0.00 56.01 55.07 3d6k n LEU 221 Cb 0.11 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 3d6k n LEU 221 CO 0.13 0.13 2.67 1.41 -1.33 0.00 0.00 177.39 180.40 3d6k n HIS 222 N -0.05 2.43 -2.58 -1.77 8.25 -0.96 -4.95 115.22 115.59 3d6k n HIS 222 Ca 0.00 -2.83 -0.34 0.00 -0.26 0.00 0.00 57.72 54.29 3d6k n HIS 222 Cb 0.20 -2.02 -0.04 0.00 1.12 0.00 0.00 29.99 29.25 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 -0.10 3.94 -0.74 1.59 -1.32 -1.26 -0.94 115.64 116.81 3d6k s THR 223 Ca 0.60 1.19 0.23 0.00 -1.21 0.00 0.00 61.69 62.49 3d6k s THR 223 Cb 0.20 -3.49 -0.14 0.00 -1.51 0.00 0.00 72.50 67.56 3d6k s THR 223 CO -0.09 -0.28 1.01 0.18 -2.21 0.00 0.00 174.62 173.24 3d6k n LEU 224 N -0.95 0.66 0.00 9.08 4.77 0.32 -4.36 117.00 126.52 3d6k n LEU 224 Ca 0.09 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 3d6k n LEU 224 Cb 0.53 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 3d6k n LEU 224 CO 0.39 0.11 0.00 -1.54 -1.33 0.00 0.00 177.39 175.03 3d6k n SER 225 N -1.78 0.63 0.05 -1.43 3.41 -1.26 -4.64 113.62 108.60 3d6k n SER 225 Ca 0.03 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.76 3d6k n SER 225 Cb 0.40 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.59 3d6k n SER 225 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3d6k n ASP 226 N 0.00 0.64 -4.67 4.04 3.85 -1.26 -4.91 116.55 114.23 3d6k n ASP 226 Ca 0.00 0.13 -0.35 0.00 -0.71 0.00 0.00 54.79 53.86 3d6k n ASP 226 Cb 0.00 0.04 -0.09 0.00 -1.35 0.00 0.00 41.12 39.72 3d6k n ASP 226 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 3d6k s GLU 227 N -3.12 3.76 0.03 0.11 0.41 -1.26 -5.09 118.70 113.54 3d6k s GLU 227 Ca 0.08 -0.32 -0.19 0.00 -0.41 0.00 0.00 54.97 54.13 3d6k s GLU 227 Cb 0.14 -3.15 -0.06 0.00 -1.78 0.00 0.00 34.13 29.29 3d6k s GLU 227 CO 0.69 0.41 0.55 -0.06 -0.49 0.00 0.00 175.26 176.36 3d6k s PHE 228 N -0.00 3.74 0.69 1.61 0.08 -1.26 -4.80 117.98 118.03 3d6k s PHE 228 Ca 0.06 1.19 -0.14 0.00 0.12 0.00 0.00 56.93 58.16 3d6k s PHE 228 Cb -0.12 -2.51 0.01 0.00 -0.57 0.00 0.00 43.02 39.83 3d6k s PHE 228 CO 0.01 0.49 1.10 -1.25 -0.10 0.00 0.00 175.22 175.47 3d6k s PRO 229 N -0.70 2.70 -0.07 0.24 0.04 -1.26 -4.97 135.00 130.98 3d6k s PRO 229 Ca 0.29 1.28 -0.30 0.00 0.04 0.00 0.00 61.00 62.31 3d6k s PRO 229 Cb -0.18 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 3d6k s PRO 229 CO 0.17 -1.31 1.40 0.42 0.04 0.00 0.00 177.00 177.72 3d6k s ILE 230 N -2.55 3.90 -0.68 0.56 1.01 -1.26 -4.96 121.20 117.22 3d6k s ILE 230 Ca 0.64 1.18 -0.19 0.00 0.00 0.00 0.00 60.65 62.29 3d6k s ILE 230 Cb -0.19 -3.76 0.12 0.00 0.01 0.00 0.00 42.46 38.64 3d6k s ILE 230 CO 0.46 -0.06 0.81 -0.69 0.00 0.00 0.00 174.94 175.46 3d6k s VAL 231 N 3.12 4.85 0.17 2.92 1.01 -1.26 -5.03 120.40 126.18 3d6k s VAL 231 Ca 0.63 -1.20 -0.31 0.00 0.00 0.00 0.00 61.98 61.09 3d6k s VAL 231 Cb -0.28 -4.56 -0.09 0.00 0.00 0.00 0.00 36.38 31.45 3d6k s VAL 231 CO 0.23 -1.21 1.49 -1.00 0.00 0.00 0.00 175.10 174.61 3d6k s HIS 232 N 2.52 3.11 -1.19 5.22 0.09 -1.26 -4.87 115.29 118.91 3d6k s HIS 232 Ca 0.17 0.80 -0.15 0.00 -0.00 0.00 0.00 55.06 55.87 3d6k s HIS 232 Cb -0.19 -3.84 0.14 0.00 -0.00 0.00 0.00 32.58 28.70 3d6k s HIS 232 CO 0.02 -2.98 1.46 1.21 -0.00 0.00 0.00 174.74 174.45 3d6k s ASN 233 N 0.96 6.97 0.55 1.40 2.47 -1.26 -4.80 114.94 121.22 3d6k s ASN 233 Ca 0.66 -2.75 0.29 0.00 0.42 0.00 0.00 52.86 51.48 3d6k s ASN 233 Cb -0.41 -2.44 1.58 0.00 -1.45 0.00 0.00 41.25 38.52 3d6k s ASN 233 CO 0.33 -0.88 2.12 -0.37 -3.72 0.00 0.00 177.10 174.59 3d6k h VAL 234 N 5.01 0.51 -0.51 -5.21 -1.51 -1.94 -0.28 116.25 112.33 3d6k h VAL 234 Ca 0.32 -0.39 -0.00 0.00 -1.23 0.00 0.00 66.70 65.40 3d6k h VAL 234 Cb 0.89 1.26 -0.02 0.00 -2.13 0.00 0.00 31.29 31.28 3d6k h VAL 234 CO 1.28 0.08 0.31 0.40 -1.23 0.00 0.00 177.57 178.41 3d6k h ILE 235 N 0.00 1.16 0.03 7.19 2.04 -1.94 0.11 117.51 126.09 3d6k h ILE 235 Ca -0.00 -0.35 -0.22 0.00 1.00 0.00 0.00 64.86 65.29 3d6k h ILE 235 Cb 0.25 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.78 3d6k h ILE 235 CO 0.01 0.16 -0.97 -0.08 0.00 0.00 0.00 178.15 177.27 3d6k h GLU 236 N 0.69 0.27 -0.67 2.37 4.57 -1.74 -1.36 114.58 118.70 3d6k h GLU 236 Ca 0.19 -0.33 0.12 0.00 -1.18 0.00 0.00 59.36 58.15 3d6k h GLU 236 Cb -0.02 0.10 -0.08 0.00 -0.16 0.00 0.00 28.75 28.59 3d6k h GLU 236 CO -0.04 1.05 0.25 0.74 -1.18 0.00 0.00 179.01 179.84 3d6k h PHE 237 N 0.14 0.43 -0.25 0.92 -1.00 -0.98 -2.17 116.94 114.03 3d6k h PHE 237 Ca -0.07 0.03 -0.19 0.00 2.81 0.00 0.00 57.97 60.55 3d6k h PHE 237 Cb 1.63 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 41.10 3d6k h PHE 237 CO 0.04 0.08 -0.59 0.00 -1.61 0.00 0.00 178.31 176.23 3d6k h ALA 238 N 1.48 0.47 -0.75 2.45 0.00 -0.51 -2.18 119.26 120.22 3d6k h ALA 238 Ca 0.35 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 3d6k h ALA 238 Cb 0.49 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 3d6k h ALA 238 CO -0.36 0.68 0.29 0.37 0.00 0.00 0.00 179.25 180.24 3d6k h GLN 239 N 0.61 1.12 0.00 0.00 4.15 -1.14 0.10 115.11 119.96 3d6k h GLN 239 Ca 0.00 -0.20 0.00 0.00 0.77 0.00 0.00 58.65 59.22 3d6k h GLN 239 Cb 1.20 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.71 3d6k h GLN 239 CO 0.13 0.92 0.00 0.00 -1.93 0.00 0.00 178.83 177.95 3d6k h ALA 240 N 1.22 1.00 -0.00 3.38 0.00 -1.28 -2.81 119.26 120.76 3d6k h ALA 240 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3d6k h ALA 240 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3d6k h ALA 240 CO -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 179.25 178.81 3d6k n ALA 241 N -2.08 3.41 -0.54 0.00 0.00 -0.83 -4.93 120.51 115.54 3d6k n ALA 241 Ca 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.09 3d6k n ALA 241 Cb 0.43 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 1.44 0.73 2.59 0.00 0.00 -0.97 -4.92 105.19 104.07 3d6k n GLY 242 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 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 4.86 0.12 1.61 3.02 0.32 -4.93 115.26 120.26 3d6k n ASN 243 Ca 0.00 -3.72 0.17 0.00 -0.03 0.00 0.00 54.58 51.00 3d6k n ASN 243 Cb 0.00 -0.52 0.74 0.00 -0.61 0.00 0.00 39.78 39.39 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 2.70 0.00 -0.61 3.52 0.13 -1.82 -2.37 132.00 133.55 3d6k h PRO 244 Ca 0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.41 3d6k h PRO 244 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3d6k h PRO 244 CO 0.88 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.74 3d6k n ASN 245 N -4.13 3.61 -0.12 1.44 5.03 -1.26 -4.48 115.26 115.34 3d6k n ASN 245 Ca 0.05 -1.99 -0.03 0.00 0.87 0.00 0.00 54.58 53.47 3d6k n ASN 245 Cb 0.44 -0.40 0.18 0.00 -1.02 0.00 0.00 39.78 38.97 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 4.12 0.81 -5.38 3.52 2.43 -1.66 -3.44 114.38 114.78 3d6k h ARG 246 Ca 0.00 -0.18 -0.63 0.00 -0.81 0.00 0.00 59.98 58.36 3d6k h ARG 246 Cb 0.93 -0.11 -0.16 0.00 -0.42 0.00 0.00 29.97 30.21 3d6k h ARG 246 CO 0.00 0.76 -0.57 -0.06 -1.51 0.00 0.00 179.97 178.59 3d6k s PHE 247 N -5.13 3.25 -0.45 2.20 0.08 -1.26 -0.08 117.98 116.59 3d6k s PHE 247 Ca -0.10 0.09 -0.10 0.00 0.12 0.00 0.00 56.93 56.94 3d6k s PHE 247 Cb 0.15 -2.03 0.10 0.00 -0.57 0.00 0.00 43.02 40.67 3d6k s PHE 247 CO 0.80 0.21 0.33 -1.58 -0.10 0.00 0.00 175.22 174.88 3d6k s TRP 248 N 0.14 3.36 0.18 0.36 0.51 -0.45 -4.52 118.94 118.52 3d6k s TRP 248 Ca 0.04 -1.59 0.01 0.00 -2.12 0.00 0.00 56.10 52.44 3d6k s TRP 248 Cb -0.12 -3.26 -0.04 0.00 -0.81 0.00 0.00 33.47 29.23 3d6k s TRP 248 CO 0.01 -0.92 0.34 0.12 -0.51 0.00 0.00 176.95 176.00 3d6k s PHE 249 N 1.44 3.48 0.00 -1.98 5.99 0.34 -0.04 117.98 127.21 3d6k s PHE 249 Ca 0.04 0.24 0.00 0.00 0.00 0.00 0.00 56.93 57.21 3d6k s PHE 249 Cb -0.25 -1.77 0.00 0.00 0.00 0.00 0.00 43.02 41.00 3d6k s PHE 249 CO 0.01 0.44 0.00 -1.13 -0.00 0.00 0.00 175.22 174.54 3d6k n SER 251 N -0.61 0.00 -3.57 6.13 3.41 -0.69 0.52 113.62 118.81 3d6k n SER 251 Ca -0.06 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.48 3d6k n SER 251 Cb 0.54 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.47 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 -0.32 -0.01 4.04 1.04 -1.26 0.03 113.70 117.22 3d6k s SER 252 Ca 0.00 -0.10 0.10 0.00 0.48 0.00 0.00 55.95 56.43 3d6k s SER 252 Cb 0.00 0.42 0.31 0.00 0.10 0.00 0.00 66.02 66.84 3d6k s SER 252 CO 0.00 -0.70 1.23 0.35 0.98 0.00 0.00 173.24 175.10 3d6k n THR 253 N -0.31 0.54 -0.28 2.02 -2.24 0.74 -4.60 114.28 110.16 3d6k n THR 253 Ca -0.08 -0.47 0.05 0.00 -2.27 0.00 0.00 64.05 61.27 3d6k n THR 253 Cb 0.62 0.16 0.19 0.00 -2.10 0.00 0.00 70.33 69.20 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 1.97 0.52 -0.71 3.42 0.02 -1.87 0.50 113.55 117.40 3d6k h SER 254 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3d6k h SER 254 Cb 0.53 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.07 3d6k h SER 254 CO 0.02 0.25 0.00 0.29 -1.14 0.00 0.00 176.83 176.25 3d6k n LYS 255 N -4.86 2.97 -0.09 3.45 5.02 -1.26 -2.60 118.16 120.79 3d6k n LYS 255 Ca 0.15 -2.69 -0.19 0.00 -2.02 0.00 0.00 58.31 53.56 3d6k n LYS 255 Cb 0.37 -1.66 -0.06 0.00 -0.02 0.00 0.00 35.03 33.66 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 1.51 1.12 0.00 -0.18 5.41 0.33 -4.98 119.36 122.56 3d6k n ILE 256 Ca 0.25 -0.21 0.00 0.00 1.00 0.00 0.00 62.75 63.79 3d6k n ILE 256 Cb 0.69 -1.81 0.00 0.00 -0.71 0.00 0.00 39.64 37.80 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 -3.92 0.00 -3.86 1.39 -2.24 0.15 -4.89 114.28 100.91 3d6k n THR 257 Ca -0.35 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.08 3d6k n THR 257 Cb 0.72 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.82 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 1.64 3.35 -0.17 4.78 3.76 -1.26 -4.85 115.29 122.54 3d6k s HIS 258 Ca 0.00 -1.96 -0.32 0.00 -0.15 0.00 0.00 55.06 52.63 3d6k s HIS 258 Cb 0.00 -2.41 -0.09 0.00 1.11 0.00 0.00 32.58 31.19 3d6k s HIS 258 CO 0.00 -0.84 2.06 0.00 -0.85 0.00 0.00 174.74 175.11 3d6k n ALA 259 N 4.63 1.25 0.00 -1.40 0.00 -1.07 -0.06 120.51 123.87 3d6k n ALA 259 Ca -0.10 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3d6k n ALA 259 Cb 0.43 -2.65 0.00 0.00 0.00 0.00 0.00 19.45 17.23 3d6k n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d6k n GLY 260 N 5.27 2.10 0.35 0.00 0.00 -1.26 -4.84 105.19 106.81 3d6k n GLY 260 Ca 0.28 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.38 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 1.90 -1.03 1.61 7.64 0.92 -4.78 113.62 119.88 3d6k n SER 261 Ca 0.00 -3.25 0.00 0.00 1.01 0.00 0.00 58.87 56.63 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 -1.14 1.36 3.01 0.23 0.00 -0.65 -4.72 105.19 103.28 3d6k n GLY 262 Ca 0.15 -1.81 -0.20 0.00 0.00 0.00 0.00 46.02 44.16 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 1.73 0.81 0.14 1.61 1.01 -1.24 -3.74 120.40 120.73 3d6k s VAL 263 Ca 0.00 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.65 3d6k s VAL 263 Cb 0.00 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 3d6k s VAL 263 CO 0.00 0.25 0.07 -0.94 0.00 0.00 0.00 175.10 174.48 3d6k s SER 264 N 0.14 5.25 -0.01 3.32 1.04 0.56 -0.18 113.70 123.82 3d6k s SER 264 Ca -0.02 -0.19 0.03 0.00 0.48 0.00 0.00 55.95 56.26 3d6k s SER 264 Cb -0.08 -1.30 -0.01 0.00 0.10 0.00 0.00 66.02 64.73 3d6k s SER 264 CO 0.00 0.11 -0.12 -0.36 0.98 0.00 0.00 173.24 173.86 3d6k s PHE 265 N -1.61 1.07 -0.16 5.02 0.40 0.10 -0.91 117.98 121.89 3d6k s PHE 265 Ca 0.29 -0.22 -0.00 0.00 -0.60 0.00 0.00 56.93 56.40 3d6k s PHE 265 Cb -0.10 -0.71 0.03 0.00 0.51 0.00 0.00 43.02 42.75 3d6k s PHE 265 CO 0.21 -0.04 -0.09 0.12 0.70 0.00 0.00 175.22 176.12 3d6k s PHE 266 N -0.18 1.91 0.01 0.36 5.36 -0.41 -1.71 117.98 123.32 3d6k s PHE 266 Ca 0.03 -1.15 0.07 0.00 -0.96 0.00 0.00 56.93 54.91 3d6k s PHE 266 Cb -0.06 -1.42 -0.03 0.00 -0.34 0.00 0.00 43.02 41.17 3d6k s PHE 266 CO -0.00 -0.63 -0.19 0.00 -1.46 0.00 0.00 175.22 172.93 3d6k s ALA 267 N 1.57 2.50 0.00 11.12 0.00 0.18 -0.57 121.76 136.56 3d6k s ALA 267 Ca 0.02 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.85 3d6k s ALA 267 Cb -0.14 -0.74 0.00 0.00 0.00 0.00 0.00 23.12 22.24 3d6k s ALA 267 CO -0.09 0.56 0.00 0.45 0.00 0.00 0.00 175.76 176.68 3d6k n SER 268 N 1.95 0.00 -4.85 0.00 2.88 -1.05 -0.51 113.62 112.05 3d6k n SER 268 Ca -0.16 -0.85 -0.30 0.00 -1.33 0.00 0.00 58.87 56.22 3d6k n SER 268 Cb 0.52 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.03 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 -0.55 5.30 0.30 -3.46 1.04 -1.26 -4.75 113.70 110.32 3d6k s SER 269 Ca 0.00 1.33 0.01 0.00 0.48 0.00 0.00 55.95 57.77 3d6k s SER 269 Cb 0.00 -2.17 0.54 0.00 0.10 0.00 0.00 66.02 64.49 3d6k s SER 269 CO 0.00 -1.46 1.90 0.50 0.98 0.00 0.00 173.24 175.17 3d6k h LYS 270 N -0.73 0.98 -0.18 4.02 3.64 -1.93 0.47 116.57 122.83 3d6k h LYS 270 Ca -0.45 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 58.86 3d6k h LYS 270 Cb 1.24 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 3d6k h LYS 270 CO 0.61 0.65 0.09 0.93 -2.27 0.00 0.00 179.45 179.46 3d6k h GLU 271 N 1.01 0.26 -0.73 1.90 5.08 -1.97 0.12 114.58 120.25 3d6k h GLU 271 Ca 0.40 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.70 3d6k h GLU 271 Cb 0.25 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 3d6k h GLU 271 CO -0.16 0.29 0.37 -0.91 -1.00 0.00 0.00 179.01 177.60 3d6k h ASN 272 N 0.17 0.95 -0.62 1.42 4.21 -1.76 -0.04 115.58 119.90 3d6k h ASN 272 Ca 0.06 -0.12 -0.06 0.00 1.21 0.00 0.00 56.30 57.39 3d6k h ASN 272 Cb 0.11 -0.24 -0.03 0.00 -1.12 0.00 0.00 38.32 37.04 3d6k h ASN 272 CO -0.01 0.80 0.16 0.40 -1.29 0.00 0.00 177.43 177.50 3d6k h ILE 273 N 1.02 1.25 -0.23 2.81 2.04 -0.68 -0.18 117.51 123.55 3d6k h ILE 273 Ca 0.25 -0.89 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 3d6k h ILE 273 Cb 0.09 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3d6k h ILE 273 CO -0.03 0.34 -0.26 -0.33 0.00 0.00 0.00 178.15 177.87 3d6k h GLU 274 N 0.90 0.44 0.42 2.37 5.08 -0.42 -0.14 114.58 123.23 3d6k h GLU 274 Ca 0.20 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 3d6k h GLU 274 Cb 0.34 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3d6k h GLU 274 CO -0.00 0.66 -0.20 2.35 -1.00 0.00 0.00 179.01 180.82 3d6k h TRP 275 N 0.39 -0.52 -0.88 4.33 7.01 -0.82 -1.82 115.95 123.64 3d6k h TRP 275 Ca 0.06 -0.01 0.23 0.00 2.11 0.00 0.00 58.89 61.27 3d6k h TRP 275 Cb 0.66 0.17 -0.15 0.00 -2.10 0.00 0.00 29.16 27.73 3d6k h TRP 275 CO 0.02 -0.24 0.09 -0.92 -2.79 0.00 0.00 178.44 174.59 3d6k h TYR 276 N -0.72 0.07 0.00 2.65 3.20 -0.73 -1.72 116.97 119.72 3d6k h TYR 276 Ca -0.06 0.06 -0.10 0.00 3.14 0.00 0.00 58.73 61.78 3d6k h TYR 276 Cb 0.51 0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 3d6k h TYR 276 CO -0.01 -0.30 -0.46 0.00 -1.64 0.00 0.00 178.16 175.75 3d6k h ALA 277 N 1.83 1.06 -0.05 1.82 0.00 -0.69 0.19 119.26 123.43 3d6k h ALA 277 Ca 0.53 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 3d6k h ALA 277 Cb 1.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 3d6k h ALA 277 CO -0.76 0.57 -0.40 0.66 0.00 0.00 0.00 179.25 179.32 3d6k h SER 278 N 0.00 0.11 0.04 0.00 4.64 -0.46 -0.52 113.55 117.36 3d6k h SER 278 Ca -0.00 -0.04 -0.18 0.00 -0.47 0.00 0.00 61.79 61.10 3d6k h SER 278 Cb 0.91 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.96 3d6k h SER 278 CO 0.06 0.50 -0.94 0.45 -0.87 0.00 0.00 176.83 176.03 3d6k h HIS 279 N 0.09 0.14 -0.40 4.77 -0.00 -1.37 -3.37 115.15 115.02 3d6k h HIS 279 Ca 0.01 -0.10 0.12 0.00 -0.00 0.00 0.00 60.37 60.39 3d6k h HIS 279 Cb 0.75 -0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 28.14 3d6k h HIS 279 CO 0.01 1.37 0.31 0.00 -0.00 0.00 0.00 177.93 179.61 3d6k h ALA 280 N -0.21 2.30 0.00 2.45 0.00 -0.96 0.12 119.26 122.96 3d6k h ALA 280 Ca -0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3d6k h ALA 280 Cb 1.36 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.18 3d6k h ALA 280 CO -0.07 -0.52 0.00 -0.97 0.00 0.00 0.00 179.25 177.70 3d6k h ASN 281 N 0.00 0.00 0.13 0.00 -1.24 -1.25 -2.05 115.58 111.17 3d6k h ASN 281 Ca 0.19 0.00 -0.35 0.00 0.71 0.00 0.00 56.30 56.85 3d6k h ASN 281 Cb 0.81 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.85 3d6k h ASN 281 CO -0.00 0.00 -1.89 0.58 -1.29 0.00 0.00 177.43 174.82 3d6k h VAL 282 N 0.00 0.71 0.00 2.57 2.07 -0.94 -3.35 116.25 117.31 3d6k h VAL 282 Ca 0.00 -2.36 -0.01 0.00 0.82 0.00 0.00 66.70 65.15 3d6k h VAL 282 Cb 0.61 2.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.92 3d6k h VAL 282 CO 0.00 0.86 -0.06 -0.09 0.02 0.00 0.00 177.57 178.29 3d6k h ARG 283 N 0.00 0.00 0.00 1.57 2.43 -1.20 -3.47 114.38 113.71 3d6k h ARG 283 Ca -0.40 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 3d6k h ARG 283 Cb 1.99 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.54 3d6k h ARG 283 CO 0.08 0.06 0.00 0.41 -1.51 0.00 0.00 179.97 179.02 3d6k n GLY 284 N -1.18 -1.24 0.11 2.80 0.00 -0.79 -5.04 105.19 99.86 3d6k n GLY 284 Ca -0.03 -0.99 -0.15 0.00 0.00 0.00 0.00 46.02 44.85 3d6k n GLY 284 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3d6k n ILE 285 N 4.21 1.64 0.00 -0.61 5.41 -1.26 -4.32 119.36 124.44 3d6k n ILE 285 Ca 0.00 -0.72 0.00 0.00 1.00 0.00 0.00 62.75 63.03 3d6k n ILE 285 Cb 0.00 -1.31 0.00 0.00 -0.71 0.00 0.00 39.64 37.62 3d6k n ILE 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3d6k n GLY 286 N 1.85 -0.81 3.61 7.39 0.00 -1.26 -3.95 105.19 112.03 3d6k n GLY 286 Ca -0.29 -1.19 -0.25 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.61 -0.72 -2.14 1.61 -0.04 -1.26 -4.98 135.00 126.87 3d6k n PRO 287 Ca 0.00 -2.19 -0.32 0.00 -0.04 0.00 0.00 63.50 60.95 3d6k n PRO 287 Cb 0.00 -1.00 -0.04 0.00 -0.04 0.00 0.00 33.50 32.42 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 -5.22 5.41 0.35 3.54 3.84 -1.26 -4.84 114.94 116.75 3d6k s ASN 288 Ca 0.67 -0.52 0.13 0.00 0.21 0.00 0.00 52.86 53.35 3d6k s ASN 288 Cb -0.03 -2.55 0.65 0.00 -0.55 0.00 0.00 41.25 38.77 3d6k s ASN 288 CO 0.46 -2.44 1.77 0.11 -2.79 0.00 0.00 177.10 174.21 3d6k h LYS 289 N 11.91 0.00 -0.09 0.43 1.57 -1.92 -2.89 116.57 125.58 3d6k h LYS 289 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.62 3d6k h LYS 289 Cb 1.05 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 3d6k h LYS 289 CO 1.24 0.43 -0.66 -0.07 -0.57 0.00 0.00 179.45 179.82 3d6k h LEU 290 N 0.00 0.40 -0.45 2.94 3.38 -1.89 0.75 115.31 120.44 3d6k h LEU 290 Ca -0.00 -0.25 -0.12 0.00 0.09 0.00 0.00 57.88 57.60 3d6k h LEU 290 Cb 0.78 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 3d6k h LEU 290 CO 0.06 0.95 -0.20 -1.13 0.09 0.00 0.00 178.44 178.20 3d6k h ASN 291 N 0.25 0.96 -0.36 -0.43 -1.24 -1.93 -0.87 115.58 111.96 3d6k h ASN 291 Ca -0.02 -0.40 0.02 0.00 0.71 0.00 0.00 56.30 56.61 3d6k h ASN 291 Cb 1.20 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 39.96 3d6k h ASN 291 CO 0.11 1.14 0.21 1.56 -1.29 0.00 0.00 177.43 179.16 3d6k h GLN 292 N 0.77 0.41 -0.38 6.67 4.20 -1.38 -1.57 115.11 123.83 3d6k h GLN 292 Ca 0.10 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.79 3d6k h GLN 292 Cb 0.77 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.44 3d6k h GLN 292 CO 0.06 0.27 0.25 1.25 -0.67 0.00 0.00 178.83 179.99 3d6k h LEU 293 N 0.42 0.44 -0.65 1.46 5.85 -0.79 -1.84 115.31 120.21 3d6k h LEU 293 Ca 0.14 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.88 3d6k h LEU 293 Cb 0.01 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 3d6k h LEU 293 CO -0.07 0.33 0.39 0.00 -0.34 0.00 0.00 178.44 178.75 3d6k h ALA 294 N 1.13 0.85 -0.57 1.25 0.00 -1.02 -1.32 119.26 119.59 3d6k h ALA 294 Ca 0.14 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 3d6k h ALA 294 Cb -0.05 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3d6k h ALA 294 CO -0.03 0.12 0.10 0.45 0.00 0.00 0.00 179.25 179.89 3d6k h HIS 295 N 0.76 0.95 -0.10 0.00 3.86 -1.09 0.11 115.15 119.63 3d6k h HIS 295 Ca 0.27 -0.11 -0.18 0.00 -1.16 0.00 0.00 60.37 59.19 3d6k h HIS 295 Cb 0.06 -0.27 -0.00 0.00 1.06 0.00 0.00 27.41 28.26 3d6k h HIS 295 CO -0.06 0.81 -0.68 0.00 0.86 0.00 0.00 177.93 178.86 3d6k h ALA 296 N 1.24 0.62 -0.27 2.45 0.00 -1.04 -0.95 119.26 121.31 3d6k h ALA 296 Ca 0.18 -0.58 -0.10 0.00 0.00 0.00 0.00 54.91 54.40 3d6k h ALA 296 Cb 0.37 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3d6k h ALA 296 CO 0.01 0.74 -0.23 1.96 0.00 0.00 0.00 179.25 181.72 3d6k h GLN 297 N 0.31 0.64 0.43 0.00 4.20 -1.07 0.61 115.11 120.23 3d6k h GLN 297 Ca -0.02 -0.32 -0.01 0.00 0.06 0.00 0.00 58.65 58.35 3d6k h GLN 297 Cb 1.25 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 3d6k h GLN 297 CO 0.12 0.92 -0.27 0.35 -0.67 0.00 0.00 178.83 179.28 3d6k h PHE 298 N 0.37 -0.71 -0.43 2.96 3.04 -0.68 -3.01 116.94 118.49 3d6k h PHE 298 Ca 0.05 -0.01 -0.13 0.00 3.98 0.00 0.00 57.97 61.86 3d6k h PHE 298 Cb 0.79 0.26 -0.01 0.00 2.56 0.00 0.00 35.95 39.54 3d6k h PHE 298 CO 0.07 -0.42 -0.25 0.74 -2.02 0.00 0.00 178.31 176.43 3d6k h PHE 299 N -0.67 1.08 0.00 0.41 0.05 -1.23 -3.47 116.94 113.11 3d6k h PHE 299 Ca -0.05 -0.28 0.00 0.00 3.82 0.00 0.00 57.97 61.46 3d6k h PHE 299 Cb 0.56 -0.24 0.00 0.00 2.00 0.00 0.00 35.95 38.26 3d6k h PHE 299 CO -0.10 1.09 0.00 0.41 -0.18 0.00 0.00 178.31 179.53 3d6k n GLY 300 N -0.02 1.27 3.61 -1.45 0.00 0.21 -4.07 105.19 104.73 3d6k n GLY 300 Ca -0.01 -0.02 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 3d6k n GLY 300 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3d6k s ASP 301 N 0.00 0.36 0.23 1.61 3.84 -1.26 -4.91 116.67 116.54 3d6k s ASP 301 Ca 0.00 -1.21 -0.07 0.00 -0.00 0.00 0.00 52.55 51.27 3d6k s ASP 301 Cb 0.00 0.69 0.24 0.00 -1.38 0.00 0.00 42.92 42.47 3d6k s ASP 301 CO 0.00 -1.34 1.90 1.62 -0.00 0.00 0.00 175.17 177.34 3d6k h VAL 302 N 2.12 1.19 -0.51 2.11 3.04 -1.86 -1.01 116.25 121.34 3d6k h VAL 302 Ca -0.28 -0.40 0.09 0.00 -1.01 0.00 0.00 66.70 65.10 3d6k h VAL 302 Cb 1.25 -0.07 -0.07 0.00 -2.01 0.00 0.00 31.29 30.38 3d6k h VAL 302 CO 0.38 0.21 0.11 0.00 -1.01 0.00 0.00 177.57 177.26 3d6k h ALA 303 N 1.34 0.58 -0.35 3.17 0.00 -1.97 0.28 119.26 122.31 3d6k h ALA 303 Ca 0.34 0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.41 3d6k h ALA 303 Cb -0.07 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 3d6k h ALA 303 CO -0.09 -0.30 0.05 0.78 0.00 0.00 0.00 179.25 179.68 3d6k h GLY 304 N 0.25 0.39 0.90 0.00 0.00 -1.57 0.13 103.07 103.18 3d6k h GLY 304 Ca 0.26 -0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.60 3d6k h GLY 304 CO -0.33 -0.04 0.04 -2.00 0.00 0.00 0.00 176.54 174.21 3d6k h LEU 305 N 0.16 0.05 -1.25 3.11 5.85 -0.68 -0.13 115.31 122.43 3d6k h LEU 305 Ca 0.17 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 3d6k h LEU 305 Cb 0.21 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 3d6k h LEU 305 CO -0.24 0.05 0.21 0.11 -0.34 0.00 0.00 178.44 178.23 3d6k h LYS 306 N 0.11 0.73 -0.58 1.25 1.57 -0.16 -2.04 116.57 117.46 3d6k h LYS 306 Ca 0.05 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 3d6k h LYS 306 Cb 0.03 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 3d6k h LYS 306 CO -0.06 0.60 0.23 0.00 -0.57 0.00 0.00 179.45 179.65 3d6k h ALA 307 N 1.51 0.75 0.00 3.86 0.00 -0.56 -2.23 119.26 122.60 3d6k h ALA 307 Ca 0.18 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d6k h ALA 307 Cb 0.13 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3d6k h ALA 307 CO -0.02 0.37 0.00 1.58 0.00 0.00 0.00 179.25 181.18 3d6k n HIS 308 N -4.48 0.00 0.00 0.00 -0.00 -0.08 -2.60 115.22 108.07 3d6k n HIS 308 Ca 0.03 -0.02 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 3d6k n HIS 308 Cb 0.17 -0.08 0.00 0.00 -0.00 0.00 0.00 29.99 30.08 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 0.81 0.00 -0.00 0.27 4.32 -0.84 -2.56 117.00 119.00 3d6k n LEU 310 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.90 3d6k n LEU 310 Cb 0.03 0.00 0.06 0.00 -1.62 0.00 0.00 43.42 41.88 3d6k n LEU 310 CO 0.00 0.00 0.50 0.11 -1.22 0.00 0.00 177.39 176.78 3d6k h LYS 311 N 0.00 0.58 -0.33 3.23 1.57 -1.80 -2.21 116.57 117.61 3d6k h LYS 311 Ca 0.00 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.42 3d6k h LYS 311 Cb 0.00 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 3d6k h LYS 311 CO 0.00 0.96 0.18 0.45 -0.57 0.00 0.00 179.45 180.47 3d6k h HIS 312 N 0.45 0.45 -0.80 -1.35 3.86 -1.80 -2.77 115.15 113.20 3d6k h HIS 312 Ca 0.02 -0.01 0.12 0.00 -1.16 0.00 0.00 60.37 59.34 3d6k h HIS 312 Cb 1.06 -0.15 -0.08 0.00 1.06 0.00 0.00 27.41 29.30 3d6k h HIS 312 CO 0.05 0.36 0.41 0.00 0.86 0.00 0.00 177.93 179.60 3d6k h ALA 313 N 1.05 1.16 0.00 2.45 0.00 -1.73 0.20 119.26 122.38 3d6k h ALA 313 Ca 0.12 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 3d6k h ALA 313 Cb 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3d6k h ALA 313 CO -0.02 -0.05 -0.33 0.00 0.00 0.00 0.00 179.25 178.84 3d6k h ALA 314 N 1.50 1.40 0.24 0.00 0.00 -1.13 0.79 119.26 122.07 3d6k h ALA 314 Ca 0.42 -0.30 -0.32 0.00 0.00 0.00 0.00 54.91 54.70 3d6k h ALA 314 Cb 0.52 -0.05 0.04 0.00 0.00 0.00 0.00 17.79 18.29 3d6k h ALA 314 CO -0.32 0.42 -1.40 1.03 0.00 0.00 0.00 179.25 178.97 3d6k h SER 315 N 0.00 0.81 0.01 0.00 0.87 -1.16 -3.40 113.55 110.68 3d6k h SER 315 Ca -0.00 -0.92 -0.07 0.00 -1.23 0.00 0.00 61.79 59.56 3d6k h SER 315 Cb 0.61 -0.26 0.01 0.00 -0.44 0.00 0.00 62.40 62.31 3d6k h SER 315 CO 0.04 1.68 -0.30 -0.07 -0.53 0.00 0.00 176.83 177.65 3d6k h LEU 316 N 0.08 0.25 -0.91 2.23 4.07 0.08 -3.38 115.31 117.74 3d6k h LEU 316 Ca -0.25 -0.81 0.15 0.00 0.08 0.00 0.00 57.88 57.05 3d6k h LEU 316 Cb 2.11 -0.08 -0.09 0.00 1.08 0.00 0.00 40.66 43.68 3d6k h LEU 316 CO 0.26 1.02 0.51 0.00 -1.08 0.00 0.00 178.44 179.16 3d6k h ALA 317 N 0.23 1.39 0.00 1.53 0.00 0.37 0.39 119.26 123.17 3d6k h ALA 317 Ca -0.04 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3d6k h ALA 317 Cb 1.08 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3d6k h ALA 317 CO 0.06 -0.00 -0.19 -1.35 0.00 0.00 0.00 179.25 177.77 3d6k h PRO 318 N 0.74 0.00 -0.44 0.00 0.11 -1.78 0.61 132.00 131.24 3d6k h PRO 318 Ca 0.49 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.48 3d6k h PRO 318 Cb 0.64 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.74 3d6k h PRO 318 CO -0.34 0.19 -0.18 0.87 -0.21 0.00 0.00 178.00 178.33 3d6k h LYS 319 N 0.00 0.84 -0.01 1.05 1.57 -0.41 -2.42 116.57 117.19 3d6k h LYS 319 Ca -0.00 -0.32 -0.09 0.00 -1.87 0.00 0.00 60.65 58.37 3d6k h LYS 319 Cb 0.42 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.69 3d6k h LYS 319 CO 0.02 0.96 -0.33 0.74 -0.57 0.00 0.00 179.45 180.27 3d6k h PHE 320 N 0.74 0.36 -0.87 -1.35 -1.00 -1.25 -2.50 116.94 111.07 3d6k h PHE 320 Ca 0.11 -0.19 0.10 0.00 2.81 0.00 0.00 57.97 60.80 3d6k h PHE 320 Cb 0.70 -0.05 -0.12 0.00 3.61 0.00 0.00 35.95 40.09 3d6k h PHE 320 CO 0.04 0.97 -0.52 1.49 -1.61 0.00 0.00 178.31 178.69 3d6k h GLU 321 N -0.35 -0.07 -0.60 1.51 4.81 -0.87 0.25 114.58 119.25 3d6k h GLU 321 Ca -0.04 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 3d6k h GLU 321 Cb 1.05 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 3d6k h GLU 321 CO 0.07 -0.05 0.26 -0.09 -0.73 0.00 0.00 179.01 178.46 3d6k h ARG 322 N -0.08 0.85 0.32 1.92 9.65 -1.51 0.13 114.38 125.68 3d6k h ARG 322 Ca 0.20 -0.12 -0.02 0.00 -1.10 0.00 0.00 59.98 58.94 3d6k h ARG 322 Cb 0.50 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.93 3d6k h ARG 322 CO -0.88 0.69 -0.16 0.28 2.80 0.00 0.00 179.97 182.70 3d6k h VAL 323 N 0.85 0.68 -0.66 0.20 2.07 -0.58 0.46 116.25 119.27 3d6k h VAL 323 Ca 0.20 -0.52 0.12 0.00 0.82 0.00 0.00 66.70 67.33 3d6k h VAL 323 Cb 0.14 0.94 -0.09 0.00 -1.52 0.00 0.00 31.29 30.76 3d6k h VAL 323 CO -0.02 0.10 0.18 -0.07 0.02 0.00 0.00 177.57 177.78 3d6k h LEU 324 N -0.73 0.09 0.11 2.57 3.38 -1.01 -0.98 115.31 118.74 3d6k h LEU 324 Ca -0.04 0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3d6k h LEU 324 Cb 0.50 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 3d6k h LEU 324 CO 0.07 0.04 -0.16 -0.33 0.09 0.00 0.00 178.44 178.15 3d6k h GLU 325 N 0.32 -0.31 -0.81 1.13 5.08 -0.65 -1.84 114.58 117.50 3d6k h GLU 325 Ca 0.35 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.72 3d6k h GLU 325 Cb 0.53 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.81 3d6k h GLU 325 CO -0.41 -0.21 0.47 0.82 -1.00 0.00 0.00 179.01 178.68 3d6k h ILE 326 N -0.33 1.23 -0.70 3.13 2.04 -0.59 0.19 117.51 122.48 3d6k h ILE 326 Ca 0.02 -0.54 0.02 0.00 1.00 0.00 0.00 64.86 65.36 3d6k h ILE 326 Cb 0.33 0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.48 3d6k h ILE 326 CO -0.08 0.25 0.45 -0.07 0.00 0.00 0.00 178.15 178.70 3d6k h LEU 327 N 1.12 0.76 0.54 1.44 4.07 -1.01 -2.07 115.31 120.16 3d6k h LEU 327 Ca 0.29 -0.01 -0.03 0.00 0.08 0.00 0.00 57.88 58.21 3d6k h LEU 327 Cb -0.02 -0.18 0.01 0.00 1.08 0.00 0.00 40.66 41.55 3d6k h LEU 327 CO -0.05 0.54 -0.26 -0.78 -1.08 0.00 0.00 178.44 176.81 3d6k h ASP 328 N 0.90 -0.62 -0.95 -0.43 3.58 -0.67 -0.42 116.42 117.81 3d6k h ASP 328 Ca 0.27 -0.02 0.12 0.00 0.42 0.00 0.00 57.03 57.81 3d6k h ASP 328 Cb -0.04 0.16 -0.13 0.00 1.72 0.00 0.00 39.33 41.03 3d6k h ASP 328 CO -0.08 -0.22 -0.46 -1.20 -2.88 0.00 0.00 179.24 174.40 3d6k n SER 329 N -5.27 -0.80 -0.00 2.28 7.64 0.59 -2.08 113.62 115.98 3d6k n SER 329 Ca -0.10 1.67 0.10 0.00 1.01 0.00 0.00 58.87 61.55 3d6k n SER 329 Cb 0.31 -0.30 -0.14 0.00 -1.01 0.00 0.00 64.21 63.07 3d6k n SER 329 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3d6k n ARG 330 N -5.30 0.28 -0.05 1.43 1.74 -0.79 -4.68 116.66 109.29 3d6k n ARG 330 Ca 0.06 -0.07 -0.06 0.00 -0.77 0.00 0.00 57.85 57.01 3d6k n ARG 330 Cb 0.32 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.21 3d6k n ARG 330 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3d6k n LEU 331 N -1.76 2.16 -0.02 0.55 4.32 -0.18 -4.97 117.00 117.11 3d6k n LEU 331 Ca 0.01 -0.04 -0.01 0.00 -0.02 0.00 0.00 56.01 55.96 3d6k n LEU 331 Cb 0.41 -0.19 -0.01 0.00 -1.62 0.00 0.00 43.42 42.01 3d6k n LEU 331 CO 0.44 0.53 0.28 -0.24 -1.22 0.00 0.00 177.39 177.17 3d6k n SER 332 N -2.65 -0.06 -0.63 -1.43 2.88 -0.88 -1.81 113.62 109.04 3d6k n SER 332 Ca -0.16 0.60 0.11 0.00 -1.33 0.00 0.00 58.87 58.09 3d6k n SER 332 Cb 0.70 -0.26 0.37 0.00 -0.75 0.00 0.00 64.21 64.27 3d6k n SER 332 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3d6k n GLU 333 N -2.77 1.83 0.03 -1.46 4.71 -1.26 -3.07 120.64 118.65 3d6k n GLU 333 Ca 0.00 -1.24 0.12 0.00 -0.01 0.00 0.00 57.16 56.03 3d6k n GLU 333 Cb 0.01 -1.42 0.15 0.00 -1.01 0.00 0.00 31.44 29.17 3d6k n GLU 333 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 3d6k n TYR 334 N 0.47 0.26 -1.11 -0.32 4.02 -0.75 -4.96 117.16 114.77 3d6k n TYR 334 Ca 0.17 0.07 -0.04 0.00 -0.01 0.00 0.00 57.90 58.10 3d6k n TYR 334 Cb 0.38 -0.43 -0.02 0.00 -0.02 0.00 0.00 39.34 39.25 3d6k n TYR 334 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3d6k n GLY 335 N 1.41 0.42 0.00 2.72 0.00 -1.17 -4.82 105.19 103.75 3d6k n GLY 335 Ca 0.04 -0.03 0.10 0.00 0.00 0.00 0.00 46.02 46.13 3d6k n GLY 335 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3d6k n VAL 336 N -2.20 0.50 -3.65 1.61 0.24 -1.26 -4.81 118.33 108.76 3d6k n VAL 336 Ca -0.04 0.12 -0.15 0.00 -2.04 0.00 0.00 64.34 62.24 3d6k n VAL 336 Cb 0.47 -0.76 -0.08 0.00 -1.47 0.00 0.00 33.84 32.00 3d6k n VAL 336 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d6k s ALA 337 N -2.91 -1.31 0.20 2.33 0.00 -1.26 -2.34 121.76 116.47 3d6k s ALA 337 Ca 0.12 1.02 0.09 0.00 0.00 0.00 0.00 51.96 53.20 3d6k s ALA 337 Cb 0.14 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 3d6k s ALA 337 CO 0.38 -0.30 -0.10 0.21 0.00 0.00 0.00 175.76 175.95 3d6k s LYS 338 N -0.84 2.04 0.05 0.00 2.20 -0.68 -4.85 119.74 117.66 3d6k s LYS 338 Ca -0.09 -1.33 -0.18 0.00 -0.36 0.00 0.00 55.97 54.00 3d6k s LYS 338 Cb -0.03 -2.12 0.04 0.00 -1.51 0.00 0.00 37.83 34.21 3d6k s LYS 338 CO 0.05 0.42 0.42 1.67 -0.36 0.00 0.00 175.35 177.56 3d6k s TRP 339 N -1.84 -0.28 0.79 4.03 -2.14 -1.26 -1.18 118.94 117.07 3d6k s TRP 339 Ca 0.26 0.21 -0.12 0.00 2.66 0.00 0.00 56.10 59.11 3d6k s TRP 339 Cb -0.08 0.24 0.07 0.00 -3.10 0.00 0.00 33.47 30.60 3d6k s TRP 339 CO 0.15 -0.60 1.13 0.95 -2.66 0.00 0.00 176.95 175.93 3d6k s THR 340 N -2.64 2.78 -0.40 0.66 -4.23 -0.41 -4.99 115.64 106.41 3d6k s THR 340 Ca -0.04 0.29 0.02 0.00 -1.18 0.00 0.00 61.69 60.77 3d6k s THR 340 Cb -0.00 -2.65 0.15 0.00 1.34 0.00 0.00 72.50 71.33 3d6k s THR 340 CO -0.04 -0.30 0.26 -0.94 -0.54 0.00 0.00 174.62 173.06 3d6k s SER 341 N -2.85 2.84 0.42 3.99 1.04 -1.26 -4.70 113.70 113.18 3d6k s SER 341 Ca 0.66 -2.54 -0.14 0.00 0.48 0.00 0.00 55.95 54.41 3d6k s SER 341 Cb -0.21 -0.59 -0.08 0.00 0.10 0.00 0.00 66.02 65.24 3d6k s SER 341 CO 0.53 -0.26 0.84 -2.16 0.98 0.00 0.00 173.24 173.16 3d6k s PRO 342 N 0.59 3.91 0.00 4.02 0.05 -1.26 -5.01 135.00 137.31 3d6k s PRO 342 Ca 0.22 0.70 0.18 0.00 0.05 0.00 0.00 61.00 62.15 3d6k s PRO 342 Cb -0.17 -2.31 0.18 0.00 0.05 0.00 0.00 34.50 32.25 3d6k s PRO 342 CO -0.05 -0.06 1.12 2.41 0.05 0.00 0.00 177.00 180.48 3d6k n THR 343 N -1.11 0.09 -3.86 1.26 -1.04 -1.26 -4.98 114.28 103.38 3d6k n THR 343 Ca 0.04 -0.54 0.00 0.00 -2.04 0.00 0.00 64.05 61.51 3d6k n THR 343 Cb 0.54 1.31 0.01 0.00 -1.82 0.00 0.00 70.33 70.37 3d6k n THR 343 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3d6k n GLY 344 N 1.06 0.57 5.05 3.41 0.00 -1.26 -0.52 105.19 113.50 3d6k n GLY 344 Ca 0.12 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.13 3d6k n GLY 344 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d6k n GLY 345 N -0.53 -1.68 0.00 -0.02 0.00 -0.12 -4.74 105.19 98.10 3d6k n GLY 345 Ca 0.01 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.51 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 -4.08 1.61 4.02 -1.26 -4.95 117.16 112.50 3d6k n TYR 346 Ca 0.00 -0.06 -0.09 0.00 -0.01 0.00 0.00 57.90 57.74 3d6k n TYR 346 Cb 0.00 -0.01 -0.09 0.00 -0.02 0.00 0.00 39.34 39.22 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 -0.13 0.61 -0.02 -0.72 0.08 -1.26 -4.21 117.98 112.34 3d6k s PHE 347 Ca 0.00 -1.05 0.05 0.00 0.12 0.00 0.00 56.93 56.05 3d6k s PHE 347 Cb 0.00 -0.36 -0.01 0.00 -0.57 0.00 0.00 43.02 42.08 3d6k s PHE 347 CO 0.00 -0.49 -0.18 0.42 -0.10 0.00 0.00 175.22 174.87 3d6k s ILE 348 N -3.97 1.42 -0.26 0.64 1.01 -0.83 -4.66 121.20 114.55 3d6k s ILE 348 Ca 0.15 -0.76 -0.04 0.00 0.00 0.00 0.00 60.65 60.00 3d6k s ILE 348 Cb 0.07 -1.18 0.01 0.00 0.01 0.00 0.00 42.46 41.37 3d6k s ILE 348 CO -0.04 0.40 -0.00 -0.55 0.00 0.00 0.00 174.94 174.75 3d6k s SER 349 N -0.36 4.61 -0.11 3.58 0.15 -1.24 -0.85 113.70 119.48 3d6k s SER 349 Ca 0.06 -0.68 -0.01 0.00 0.70 0.00 0.00 55.95 56.02 3d6k s SER 349 Cb -0.07 -1.76 -0.03 0.00 -1.71 0.00 0.00 66.02 62.45 3d6k s SER 349 CO -0.00 -0.12 -0.08 -0.69 1.20 0.00 0.00 173.24 173.55 3d6k s VAL 350 N 1.43 3.57 -0.19 4.45 1.01 -0.49 -1.29 120.40 128.89 3d6k s VAL 350 Ca 0.03 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 3d6k s VAL 350 Cb -0.16 -2.50 0.01 0.00 0.00 0.00 0.00 36.38 33.73 3d6k s VAL 350 CO -0.02 0.55 -0.15 -1.81 0.00 0.00 0.00 175.10 173.68 3d6k s ASP 351 N -0.19 3.55 0.48 3.32 1.01 -0.32 -0.87 116.67 123.65 3d6k s ASP 351 Ca 0.02 -0.55 0.07 0.00 0.71 0.00 0.00 52.55 52.80 3d6k s ASP 351 Cb -0.13 -1.57 0.07 0.00 1.01 0.00 0.00 42.92 42.30 3d6k s ASP 351 CO 0.03 0.00 0.58 1.33 0.21 0.00 0.00 175.17 177.32 3d6k n VAL 352 N 4.60 0.00 -1.68 -1.27 0.24 1.00 -1.69 118.33 119.53 3d6k n VAL 352 Ca -0.20 -1.67 -0.50 0.00 -2.04 0.00 0.00 64.34 59.93 3d6k n VAL 352 Cb 0.50 -0.46 -0.05 0.00 -1.47 0.00 0.00 33.84 32.36 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 -1.92 0.37 -1.70 3.34 0.31 -0.99 -4.74 118.33 113.00 3d6k n VAL 353 Ca 0.09 -0.07 -0.44 0.00 -0.01 0.00 0.00 64.34 63.92 3d6k n VAL 353 Cb 0.51 -1.60 -0.03 0.00 -0.91 0.00 0.00 33.84 31.81 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 5.42 2.40 0.00 5.55 -0.02 -1.26 -1.10 135.00 145.99 3d6k n PRO 354 Ca 0.22 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.56 3d6k n PRO 354 Cb 0.25 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.12 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 2.81 0.48 0.02 -1.23 0.00 -0.55 -4.95 105.19 101.76 3d6k n GLY 355 Ca 0.13 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.18 3d6k n GLY 355 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3d6k n THR 356 N -1.59 0.16 -0.15 2.61 -1.04 -0.26 -4.72 114.28 109.29 3d6k n THR 356 Ca 0.00 -0.30 -0.03 0.00 -2.04 0.00 0.00 64.05 61.67 3d6k n THR 356 Cb 0.00 0.03 0.03 0.00 -1.82 0.00 0.00 70.33 68.57 3d6k n THR 356 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3d6k h ALA 357 N 0.93 0.29 -0.71 2.41 0.00 -1.25 -2.12 119.26 118.82 3d6k h ALA 357 Ca -0.06 0.19 0.10 0.00 0.00 0.00 0.00 54.91 55.13 3d6k h ALA 357 Cb 0.77 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 18.89 3d6k h ALA 357 CO 0.00 -0.46 0.34 0.77 0.00 0.00 0.00 179.25 179.90 3d6k h SER 358 N -0.02 0.43 -0.29 0.00 0.02 -1.84 -2.22 113.55 109.63 3d6k h SER 358 Ca 0.23 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.23 3d6k h SER 358 Cb 0.38 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 3d6k h SER 358 CO -0.51 0.24 0.11 -0.09 -1.14 0.00 0.00 176.83 175.44 3d6k h ARG 359 N 0.58 0.44 -0.23 3.45 9.65 -1.71 -1.43 114.38 125.13 3d6k h ARG 359 Ca 0.35 -0.09 0.04 0.00 -1.10 0.00 0.00 59.98 59.19 3d6k h ARG 359 Cb 0.39 -0.07 -0.04 0.00 -1.39 0.00 0.00 29.97 28.86 3d6k h ARG 359 CO -0.28 0.47 -0.01 0.28 2.80 0.00 0.00 179.97 183.24 3d6k h VAL 360 N 0.32 0.83 -0.44 0.20 2.07 -1.08 0.49 116.25 118.63 3d6k h VAL 360 Ca 0.10 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.67 3d6k h VAL 360 Cb 0.20 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 30.66 3d6k h VAL 360 CO -0.01 0.01 0.07 0.58 0.02 0.00 0.00 177.57 178.24 3d6k h VAL 361 N 0.07 0.73 0.62 2.57 2.07 -1.24 -1.46 116.25 119.61 3d6k h VAL 361 Ca 0.11 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 3d6k h VAL 361 Cb 0.15 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 3d6k h VAL 361 CO -0.19 0.04 -0.39 -0.08 0.02 0.00 0.00 177.57 176.96 3d6k h GLU 362 N 0.19 -0.93 -0.93 1.57 4.81 -0.29 -0.93 114.58 118.08 3d6k h GLU 362 Ca 0.22 0.06 0.21 0.00 -0.13 0.00 0.00 59.36 59.73 3d6k h GLU 362 Cb 0.29 0.21 -0.17 0.00 0.63 0.00 0.00 28.75 29.71 3d6k h GLU 362 CO -0.31 -0.62 -0.11 -0.07 -0.73 0.00 0.00 179.01 177.18 3d6k h LEU 363 N -0.96 -0.66 -0.35 1.64 -0.00 0.20 0.53 115.31 115.70 3d6k h LEU 363 Ca -0.08 0.27 -0.02 0.00 -0.00 0.00 0.00 57.88 58.05 3d6k h LEU 363 Cb 0.78 0.51 -0.02 0.00 -0.00 0.00 0.00 40.66 41.94 3d6k h LEU 363 CO 0.07 -0.31 0.13 0.00 -0.00 0.00 0.00 178.44 178.34 3d6k h ALA 364 N 1.92 0.46 -0.98 1.53 0.00 -0.92 -2.62 119.26 118.64 3d6k h ALA 364 Ca 0.50 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.36 3d6k h ALA 364 Cb 0.88 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.46 3d6k h ALA 364 CO -0.91 0.07 0.62 -0.22 0.00 0.00 0.00 179.25 178.81 3d6k h LYS 365 N 0.42 1.02 0.00 0.00 3.64 0.48 0.14 116.57 122.26 3d6k h LYS 365 Ca 0.12 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3d6k h LYS 365 Cb 0.20 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 3d6k h LYS 365 CO -0.01 0.67 0.00 0.39 -2.27 0.00 0.00 179.45 178.24 3d6k n GLU 366 N -4.58 0.07 -0.46 1.90 1.02 -0.62 -3.22 120.64 114.74 3d6k n GLU 366 Ca 0.17 0.13 0.08 0.00 -0.02 0.00 0.00 57.16 57.52 3d6k n GLU 366 Cb 0.27 -1.59 0.26 0.00 -0.02 0.00 0.00 31.44 30.36 3d6k n GLU 366 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d6k n ALA 367 N -1.58 2.97 -0.90 0.62 0.00 0.15 -4.87 120.51 116.90 3d6k n ALA 367 Ca 0.06 -2.09 0.00 0.00 0.00 0.00 0.00 53.44 51.41 3d6k n ALA 367 Cb 0.32 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.04 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 -0.20 0.63 3.17 0.00 0.00 -0.75 -4.57 105.19 103.46 3d6k n GLY 368 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.34 2.77 -0.05 -0.61 1.01 0.24 -1.82 121.20 120.39 3d6k s ILE 369 Ca 0.00 -1.21 -0.30 0.00 0.00 0.00 0.00 60.65 59.14 3d6k s ILE 369 Cb 0.00 -2.48 -0.03 0.00 0.01 0.00 0.00 42.46 39.97 3d6k s ILE 369 CO 0.00 0.10 1.11 0.00 0.00 0.00 0.00 174.94 176.15 3d6k s ALA 370 N 1.27 3.41 0.06 9.38 0.00 -0.00 -2.64 121.76 133.25 3d6k s ALA 370 Ca -0.02 0.56 0.10 0.00 0.00 0.00 0.00 51.96 52.59 3d6k s ALA 370 Cb -0.18 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.45 3d6k s ALA 370 CO -0.04 -0.61 -0.26 -0.51 0.00 0.00 0.00 175.76 174.34 3d6k s LEU 371 N 1.87 2.20 0.23 0.00 1.02 -1.26 -1.34 118.68 121.39 3d6k s LEU 371 Ca 0.53 -0.62 -0.31 0.00 0.02 0.00 0.00 54.13 53.75 3d6k s LEU 371 Cb -0.23 -1.26 -0.11 0.00 0.02 0.00 0.00 46.19 44.61 3d6k s LEU 371 CO 0.22 0.24 1.60 0.42 0.02 0.00 0.00 176.35 178.85 3d6k s THR 372 N -0.86 2.30 0.43 5.49 -4.23 -1.26 -4.91 115.64 112.59 3d6k s THR 372 Ca 0.12 0.23 -0.22 0.00 -1.18 0.00 0.00 61.69 60.63 3d6k s THR 372 Cb -0.10 -3.15 -0.12 0.00 1.34 0.00 0.00 72.50 70.47 3d6k s THR 372 CO 0.03 0.03 0.60 0.61 -0.54 0.00 0.00 174.62 175.35 3d6k n GLY 373 N 3.11 -1.33 3.64 3.99 0.00 -1.26 -4.67 105.19 108.68 3d6k n GLY 373 Ca 0.12 0.05 -0.53 0.00 0.00 0.00 0.00 46.02 45.66 3d6k n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d6k n ALA 374 N -0.85 -0.37 -0.77 4.61 0.00 -1.26 -2.12 120.51 119.73 3d6k n ALA 374 Ca 0.11 0.45 0.00 0.00 0.00 0.00 0.00 53.44 54.01 3d6k n ALA 374 Cb 0.40 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.67 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 3.28 0.72 0.11 0.00 0.00 -1.26 -4.80 105.19 103.23 3d6k n GLY 375 Ca 0.21 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.33 3d6k n GLY 375 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d6k n SER 376 N 0.00 0.50 -1.13 1.61 3.41 -0.90 -1.25 113.62 115.85 3d6k n SER 376 Ca 0.00 0.66 0.06 0.00 -0.26 0.00 0.00 58.87 59.33 3d6k n SER 376 Cb 0.00 -0.75 0.23 0.00 -0.26 0.00 0.00 64.21 63.43 3d6k n SER 376 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3d6k n SER 377 N -2.09 3.28 -4.22 4.04 7.64 -1.26 -3.83 113.62 117.18 3d6k n SER 377 Ca 0.01 -2.30 -0.21 0.00 1.01 0.00 0.00 58.87 57.38 3d6k n SER 377 Cb 0.15 -0.47 -0.12 0.00 -1.01 0.00 0.00 64.21 62.76 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 -1.76 1.48 0.35 1.43 0.08 -0.38 -1.03 117.98 118.15 3d6k s PHE 378 Ca 0.33 -0.42 -0.27 0.00 0.12 0.00 0.00 56.93 56.69 3d6k s PHE 378 Cb 0.22 -0.83 -0.12 0.00 -0.57 0.00 0.00 43.02 41.71 3d6k s PHE 378 CO 0.16 0.11 1.09 -2.30 -0.10 0.00 0.00 175.22 174.18 3d6k n PRO 379 N 1.33 1.57 -1.91 0.24 -0.02 -1.26 -1.45 135.00 133.50 3d6k n PRO 379 Ca -0.20 0.56 -0.16 0.00 -2.02 0.00 0.00 63.50 61.68 3d6k n PRO 379 Cb 0.54 -2.05 -0.04 0.00 -0.02 0.00 0.00 33.50 31.93 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 0.83 -1.29 -4.06 2.45 4.77 -1.26 -2.45 117.00 116.00 3d6k n LEU 380 Ca 0.08 0.26 -0.34 0.00 -0.03 0.00 0.00 56.01 55.98 3d6k n LEU 380 Cb 0.36 -2.36 -0.02 0.00 -2.33 0.00 0.00 43.42 39.07 3d6k n LEU 380 CO 0.59 -0.51 -0.01 1.41 -1.33 0.00 0.00 177.39 177.55 3d6k n HIS 381 N -2.78 -1.82 -3.87 -1.77 8.25 -0.53 -4.93 115.22 107.78 3d6k n HIS 381 Ca -0.17 0.76 -0.30 0.00 -0.26 0.00 0.00 57.72 57.74 3d6k n HIS 381 Cb 0.57 -3.02 -0.15 0.00 1.12 0.00 0.00 29.99 28.51 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 -3.19 4.38 -0.34 0.41 2.47 -1.02 -4.59 114.94 113.06 3d6k s ASN 382 Ca 0.69 -1.88 -0.26 0.00 0.42 0.00 0.00 52.86 51.83 3d6k s ASN 382 Cb -0.37 -1.23 0.01 0.00 -1.45 0.00 0.00 41.25 38.21 3d6k s ASN 382 CO 0.85 -0.40 0.91 -0.62 -3.72 0.00 0.00 177.10 174.12 3d6k s ASP 383 N 1.28 6.72 0.12 -4.21 2.15 -1.26 -4.71 116.67 116.75 3d6k s ASP 383 Ca 0.10 0.69 0.18 0.00 0.43 0.00 0.00 52.55 53.95 3d6k s ASP 383 Cb -0.18 -2.46 0.76 0.00 -0.30 0.00 0.00 42.92 40.74 3d6k s ASP 383 CO -0.17 -0.79 1.56 -0.81 -0.17 0.00 0.00 175.17 174.78 3d6k n PRO 384 N 6.63 0.09 0.00 4.34 -0.04 -1.26 -2.08 135.00 142.68 3d6k n PRO 384 Ca 0.07 0.34 0.08 0.00 -0.04 0.00 0.00 63.50 63.95 3d6k n PRO 384 Cb 0.48 -1.67 -0.09 0.00 -0.04 0.00 0.00 33.50 32.18 3d6k n PRO 384 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3d6k n ASN 385 N -1.83 0.82 -3.99 3.54 3.02 -1.26 -5.00 115.26 110.56 3d6k n ASN 385 Ca 0.03 -0.91 -0.28 0.00 -0.03 0.00 0.00 54.58 53.38 3d6k n ASN 385 Cb 0.19 0.98 -0.02 0.00 -0.61 0.00 0.00 39.78 40.31 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 -1.33 -0.88 0.00 6.41 5.15 -0.88 -1.50 115.26 122.22 3d6k n ASN 386 Ca 0.03 -1.07 0.00 0.00 -0.60 0.00 0.00 54.58 52.94 3d6k n ASN 386 Cb 0.26 -2.77 0.00 0.00 -0.53 0.00 0.00 39.78 36.75 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 -4.45 1.93 -3.55 1.20 0.28 -1.26 -1.06 120.64 113.73 3d6k n GLU 387 Ca -0.28 0.00 -0.38 0.00 -0.16 0.00 0.00 57.16 56.34 3d6k n GLU 387 Cb 0.67 -0.85 -0.06 0.00 1.43 0.00 0.00 31.44 32.63 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 -1.57 6.74 -0.04 -1.84 3.84 -1.26 -0.00 114.94 120.82 3d6k s ASN 388 Ca 0.00 0.88 -0.01 0.00 0.21 0.00 0.00 52.86 53.94 3d6k s ASN 388 Cb 0.00 -2.23 0.03 0.00 -0.55 0.00 0.00 41.25 38.51 3d6k s ASN 388 CO 0.00 0.32 0.06 -0.63 -2.79 0.00 0.00 177.10 174.06 3d6k s ILE 389 N -0.99 -0.10 -0.04 -5.21 1.01 -0.05 -4.20 121.20 111.62 3d6k s ILE 389 Ca 0.22 0.36 -0.25 0.00 0.00 0.00 0.00 60.65 60.98 3d6k s ILE 389 Cb -0.16 -0.14 -0.04 0.00 0.01 0.00 0.00 42.46 42.14 3d6k s ILE 389 CO 0.12 0.15 0.75 -0.60 0.00 0.00 0.00 174.94 175.35 3d6k s ARG 390 N 1.81 4.46 -0.13 2.79 3.52 -1.26 -1.39 118.95 128.75 3d6k s ARG 390 Ca 0.00 0.98 -0.03 0.00 -0.13 0.00 0.00 55.73 56.56 3d6k s ARG 390 Cb -0.12 -3.43 -0.03 0.00 -1.56 0.00 0.00 34.95 29.80 3d6k s ARG 390 CO -0.03 0.09 -0.03 -0.51 -0.81 0.00 0.00 175.30 174.00 3d6k s LEU 391 N 0.68 3.30 -0.32 -0.88 1.43 -0.03 -4.38 118.68 118.49 3d6k s LEU 391 Ca 0.40 -0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.46 3d6k s LEU 391 Cb -0.19 -1.78 0.09 0.00 0.03 0.00 0.00 46.19 44.35 3d6k s LEU 391 CO 0.20 0.23 0.02 0.00 0.23 0.00 0.00 176.35 177.04 3d6k s ALA 392 N -0.03 2.83 -0.84 4.21 0.00 -0.99 -1.96 121.76 124.99 3d6k s ALA 392 Ca 0.01 -2.32 0.25 0.00 0.00 0.00 0.00 51.96 49.90 3d6k s ALA 392 Cb -0.13 -1.91 0.55 0.00 0.00 0.00 0.00 23.12 21.63 3d6k s ALA 392 CO 0.03 -1.56 1.46 -0.35 0.00 0.00 0.00 175.76 175.34 3d6k n PRO 393 N 4.33 0.13 -0.18 0.00 -0.04 -1.26 -4.50 135.00 133.48 3d6k n PRO 393 Ca -0.02 0.05 -0.06 0.00 -0.04 0.00 0.00 63.50 63.43 3d6k n PRO 393 Cb 0.42 -1.59 0.03 0.00 -0.04 0.00 0.00 33.50 32.32 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 0.00 0.56 0.11 3.54 4.64 -1.81 -3.36 113.55 117.23 3d6k h SER 394 Ca 0.00 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3d6k h SER 394 Cb 0.61 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 3d6k h SER 394 CO 0.00 0.40 -0.05 0.25 -0.87 0.00 0.00 176.83 176.56 3d6k h LEU 395 N 0.68 -0.13-10.01 5.97 6.46 -1.74 -3.29 115.31 113.24 3d6k h LEU 395 Ca 0.21 -0.21 -0.56 0.00 -0.12 0.00 0.00 57.88 57.20 3d6k h LEU 395 Cb -0.03 0.03 0.15 0.00 -0.73 0.00 0.00 40.66 40.08 3d6k h LEU 395 CO -0.07 0.44 0.53 -2.65 -0.62 0.00 0.00 178.44 176.07 3d6k n PRO 396 N -4.85 1.52 -1.43 5.25 -0.02 -1.26 -4.56 135.00 129.65 3d6k n PRO 396 Ca -0.04 0.56 -0.32 0.00 -2.02 0.00 0.00 63.50 61.68 3d6k n PRO 396 Cb 0.16 -2.51 0.08 0.00 -0.02 0.00 0.00 33.50 31.21 3d6k n PRO 396 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3d6k s PRO 397 N -2.92 2.30 0.39 0.52 0.04 -1.26 -4.72 135.00 129.35 3d6k s PRO 397 Ca 0.73 1.42 0.11 0.00 0.04 0.00 0.00 61.00 63.31 3d6k s PRO 397 Cb -0.42 -1.89 0.91 0.00 0.04 0.00 0.00 34.50 33.14 3d6k s PRO 397 CO 0.48 -1.64 1.91 -0.24 0.04 0.00 0.00 177.00 177.54 3d6k h VAL 398 N -0.58 0.85 -0.39 -0.36 3.04 -1.95 -1.15 116.25 115.70 3d6k h VAL 398 Ca -0.46 -0.20 0.01 0.00 -1.01 0.00 0.00 66.70 65.04 3d6k h VAL 398 Cb 1.25 0.21 -0.02 0.00 -2.01 0.00 0.00 31.29 30.73 3d6k h VAL 398 CO 0.51 0.11 0.25 0.00 -1.01 0.00 0.00 177.57 177.43 3d6k h ALA 399 N 1.62 0.50 -0.21 3.17 0.00 -2.01 -1.41 119.26 120.91 3d6k h ALA 399 Ca 0.39 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.24 3d6k h ALA 399 Cb 0.70 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3d6k h ALA 399 CO -0.15 -0.06 -0.04 0.93 0.00 0.00 0.00 179.25 179.93 3d6k h GLU 400 N 0.52 0.40 -0.74 0.00 5.08 -1.60 -3.14 114.58 115.09 3d6k h GLU 400 Ca 0.15 -0.15 0.17 0.00 -1.00 0.00 0.00 59.36 58.53 3d6k h GLU 400 Cb -0.05 -0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.05 3d6k h GLU 400 CO -0.04 0.64 0.08 1.25 -1.00 0.00 0.00 179.01 179.93 3d6k h LEU 401 N 0.14 -0.20 -0.92 1.33 5.85 -1.15 0.98 115.31 121.33 3d6k h LEU 401 Ca 0.06 0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.97 3d6k h LEU 401 Cb 0.48 0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.75 3d6k h LEU 401 CO 0.02 -0.13 0.61 -0.33 -0.34 0.00 0.00 178.44 178.27 3d6k h GLU 402 N 0.16 1.19 0.05 1.25 5.08 -1.21 -3.00 114.58 118.10 3d6k h GLU 402 Ca 0.42 -0.07 -0.13 0.00 -1.00 0.00 0.00 59.36 58.57 3d6k h GLU 402 Cb 0.74 -0.27 0.01 0.00 0.50 0.00 0.00 28.75 29.73 3d6k h GLU 402 CO -0.60 0.79 -0.56 0.28 -1.00 0.00 0.00 179.01 177.92 3d6k h VAL 403 N 1.22 1.51 0.00 3.13 2.07 -1.18 -1.68 116.25 121.33 3d6k h VAL 403 Ca 0.35 -2.24 0.00 0.00 0.82 0.00 0.00 66.70 65.63 3d6k h VAL 403 Cb -0.10 2.92 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 3d6k h VAL 403 CO -0.09 0.63 0.00 0.00 0.02 0.00 0.00 177.57 178.13 3d6k n ALA 404 N -2.61 0.91 0.00 1.67 0.00 0.19 -0.82 120.51 119.85 3d6k n ALA 404 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 3d6k n ALA 404 Cb 0.68 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.33 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 0.16 0.00 -0.35 0.00 3.85 -0.63 0.01 116.55 119.59 3d6k n ASP 406 Ca 0.00 0.00 0.30 0.00 -0.71 0.00 0.00 54.79 54.38 3d6k n ASP 406 Cb 0.00 0.00 0.56 0.00 -1.35 0.00 0.00 41.12 40.33 3d6k n ASP 406 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 3d6k h GLY 407 N 0.00 2.05 0.99 6.12 0.00 -1.21 0.57 103.07 111.59 3d6k h GLY 407 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 3d6k h GLY 407 CO 0.00 -0.64 -0.00 -2.75 0.00 0.00 0.00 176.54 173.15 3d6k h PHE 408 N 0.12 -0.00 -0.89 5.60 3.57 -0.64 -2.77 116.94 121.92 3d6k h PHE 408 Ca 0.81 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 62.39 3d6k h PHE 408 Cb 2.13 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 40.81 3d6k h PHE 408 CO -0.01 0.01 0.58 0.00 -2.23 0.00 0.00 178.31 176.66 3d6k h ALA 409 N 0.99 1.56 -0.40 2.41 0.00 -0.29 -0.47 119.26 123.06 3d6k h ALA 409 Ca -0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3d6k h ALA 409 Cb 0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3d6k h ALA 409 CO 0.00 0.29 -0.08 1.15 0.00 0.00 0.00 179.25 180.60 3d6k h THR 410 N 0.97 1.24 0.28 0.00 2.02 -0.55 -2.08 112.91 114.79 3d6k h THR 410 Ca 0.40 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 3d6k h THR 410 Cb 0.28 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 3d6k h THR 410 CO -0.16 0.36 -0.14 0.00 0.37 0.00 0.00 175.52 175.96 3d6k h VAL 412 N -1.01 0.37 0.00 0.00 3.04 -1.13 0.41 116.25 117.93 3d6k h VAL 412 Ca -0.04 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 3d6k h VAL 412 Cb 0.45 0.08 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 3d6k h VAL 412 CO 0.06 0.05 0.00 0.18 -1.01 0.00 0.00 177.57 176.85 3d6k n LEU 413 N -4.65 0.72 0.00 3.16 4.77 -0.79 -1.76 117.00 118.46 3d6k n LEU 413 Ca 0.30 -0.36 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3d6k n LEU 413 Cb 1.10 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 3d6k n LEU 413 CO 0.24 0.18 0.00 0.00 -1.33 0.00 0.00 177.39 176.48 3d6k n ALA 415 N 0.08 0.00 0.11 -1.18 0.00 0.14 -1.01 120.51 118.65 3d6k n ALA 415 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 3d6k n ALA 415 Cb 0.18 0.00 0.37 0.00 0.00 0.00 0.00 19.45 20.00 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 1.46 0.00 0.00 0.00 -1.57 -2.92 119.26 116.24 3d6k h ALA 416 Ca 0.00 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 3d6k h ALA 416 Cb 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3d6k h ALA 416 CO 0.00 0.38 -0.44 -0.07 0.00 0.00 0.00 179.25 179.12 3d6k h LEU 417 N 0.25 0.00 -0.38 0.00 3.38 -1.33 -3.11 115.31 114.12 3d6k h LEU 417 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3d6k h LEU 417 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3d6k h LEU 417 CO 0.02 0.44 0.00 -0.62 0.09 0.00 0.00 178.44 178.37 3d6k n GLU 418 N -3.42 0.57 0.00 1.13 1.02 -1.10 -5.19 120.64 113.65 3d6k n GLU 418 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 3d6k n GLU 418 Cb 0.60 -1.11 0.00 0.00 -0.02 0.00 0.00 31.44 30.91 3d6k n GLU 418 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86