#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k1q s ALA 2 N 0.00 1.42 -1.04 3.04 0.00 -1.26 -4.88 121.76 119.04 3k1q s ALA 2 Ca 0.00 -1.71 -0.24 0.00 0.00 0.00 0.00 51.96 50.01 3k1q s ALA 2 Cb 0.00 -4.63 -0.09 0.00 0.00 0.00 0.00 23.12 18.39 3k1q s ALA 2 CO 0.00 -5.47 2.00 -0.65 0.00 0.00 0.00 175.76 171.64 3k1q s GLN 3 N 7.22 2.30 0.02 0.00 -0.21 -1.26 -4.92 119.66 122.80 3k1q s GLN 3 Ca 0.74 -0.62 -0.03 0.00 0.02 0.00 0.00 55.36 55.46 3k1q s GLN 3 Cb -0.05 -5.11 -0.01 0.00 1.00 0.00 0.00 33.01 28.85 3k1q s GLN 3 CO 0.09 -3.96 0.53 0.54 -2.12 0.00 0.00 175.29 170.37 3k1q n ARG 4 N 8.53 -0.04 -1.36 2.91 5.12 -1.26 -1.90 116.66 128.65 3k1q n ARG 4 Ca 0.43 0.52 -0.38 0.00 -1.93 0.00 0.00 57.85 56.49 3k1q n ARG 4 Cb 0.46 -0.78 -0.02 0.00 -1.16 0.00 0.00 32.46 30.96 3k1q n ARG 4 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3k1q n GLN 5 N -2.90 2.78 -0.17 5.56 0.00 -1.26 -4.31 117.38 117.08 3k1q n GLN 5 Ca 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 57.00 54.81 3k1q n GLN 5 Cb 0.02 -2.96 0.00 0.00 0.00 0.00 0.00 30.24 27.31 3k1q n GLN 5 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3k1q n PHE 6 N 5.29 0.00 -1.73 2.61 0.99 -0.80 -4.90 117.46 118.92 3k1q n PHE 6 Ca 0.59 -0.46 -0.42 0.00 -0.00 0.00 0.00 57.45 57.16 3k1q n PHE 6 Cb 0.31 -0.31 -0.03 0.00 -1.00 0.00 0.00 39.48 38.45 3k1q n PHE 6 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.76 176.17 3k1q s PHE 7 N 0.70 1.39 -0.01 1.38 -0.12 -1.26 -4.23 117.98 115.83 3k1q s PHE 7 Ca 0.00 -0.22 0.01 0.00 -0.05 0.00 0.00 56.93 56.68 3k1q s PHE 7 Cb 0.00 -4.15 -0.04 0.00 -0.63 0.00 0.00 43.02 38.20 3k1q s PHE 7 CO 0.00 -5.07 -0.00 0.20 -0.05 0.00 0.00 175.22 170.30 3k1q s GLY 8 N 4.73 1.86 -0.22 1.99 0.00 -0.45 -4.94 107.32 110.28 3k1q s GLY 8 Ca 0.87 -0.95 -0.05 0.00 0.00 0.00 0.00 44.72 44.59 3k1q s GLY 8 CO 0.39 -0.81 0.00 -2.27 0.00 0.00 0.00 173.10 170.41 3k1q s LEU 9 N -1.50 3.14 0.33 0.66 2.96 -1.26 -0.41 118.68 122.59 3k1q s LEU 9 Ca 0.19 -0.29 -0.14 0.00 -0.22 0.00 0.00 54.13 53.66 3k1q s LEU 9 Cb -0.11 -1.81 -0.09 0.00 0.50 0.00 0.00 46.19 44.68 3k1q s LEU 9 CO 0.09 -0.01 0.74 0.42 -1.32 0.00 0.00 176.35 176.28 3k1q s THR 10 N 1.42 4.70 0.36 3.68 -4.23 -1.24 -3.40 115.64 116.94 3k1q s THR 10 Ca 0.05 0.89 -0.26 0.00 -1.18 0.00 0.00 61.69 61.18 3k1q s THR 10 Cb -0.15 -3.63 -0.09 0.00 1.34 0.00 0.00 72.50 69.98 3k1q s THR 10 CO 0.00 -0.24 1.14 -0.47 -0.54 0.00 0.00 174.62 174.51 3k1q s TYR 11 N -2.05 3.25 0.82 3.99 5.04 -1.26 -4.42 117.35 122.72 3k1q s TYR 11 Ca 0.54 1.60 -0.11 0.00 -2.44 0.00 0.00 57.07 56.66 3k1q s TYR 11 Cb -0.10 -3.33 0.08 0.00 0.35 0.00 0.00 41.96 38.96 3k1q s TYR 11 CO 0.20 -1.01 1.09 1.21 -1.34 0.00 0.00 175.55 175.70 3k1q s ASN 12 N -1.09 4.13 -0.12 4.32 3.84 -1.26 -4.88 114.94 119.87 3k1q s ASN 12 Ca 0.53 1.69 -0.04 0.00 0.21 0.00 0.00 52.86 55.25 3k1q s ASN 12 Cb -0.30 -2.38 -0.04 0.00 -0.55 0.00 0.00 41.25 37.98 3k1q s ASN 12 CO 0.38 -2.26 0.03 -0.36 -2.79 0.00 0.00 177.10 172.11 3k1q s PHE 13 N -2.92 3.24 -0.36 0.43 0.08 -1.26 -4.87 117.98 112.32 3k1q s PHE 13 Ca 0.62 0.18 -0.29 0.00 0.12 0.00 0.00 56.93 57.56 3k1q s PHE 13 Cb -0.17 -1.89 -0.31 0.00 -0.57 0.00 0.00 43.02 40.08 3k1q s PHE 13 CO 0.56 0.40 1.75 0.98 -0.10 0.00 0.00 175.22 178.81 3k1q n TYR 14 N 2.53 0.55 -3.96 0.36 9.36 -1.26 -3.77 117.16 120.98 3k1q n TYR 14 Ca -0.18 -0.68 -0.31 0.00 3.32 0.00 0.00 57.90 60.05 3k1q n TYR 14 Cb 0.53 -1.30 0.02 0.00 -0.63 0.00 0.00 39.34 37.96 3k1q n TYR 14 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3k1q n GLY 15 N 5.16 -0.48 3.58 2.98 0.00 -1.26 -4.98 105.19 110.19 3k1q n GLY 15 Ca 0.46 0.18 -0.34 0.00 0.00 0.00 0.00 46.02 46.33 3k1q n GLY 15 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k1q s GLN 16 N -6.65 3.12 0.61 1.61 -0.44 -1.25 -5.01 119.66 111.66 3k1q s GLN 16 Ca 0.65 -0.50 0.35 0.00 -2.50 0.00 0.00 55.36 53.35 3k1q s GLN 16 Cb -0.33 -2.75 2.01 0.00 -1.64 0.00 0.00 33.01 30.31 3k1q s GLN 16 CO 0.85 0.53 2.29 -1.35 0.50 0.00 0.00 175.29 178.11 3k1q h PRO 17 N 5.71 0.00 -5.91 1.67 0.11 -1.94 -3.45 132.00 128.19 3k1q h PRO 17 Ca -0.43 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.16 3k1q h PRO 17 Cb 1.18 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.12 3k1q h PRO 17 CO 0.56 0.00 -0.78 0.00 -0.21 0.00 0.00 178.00 177.58 3k1q s ALA 18 N -4.46 2.00 0.66 -0.75 0.00 -1.26 -5.13 121.76 112.82 3k1q s ALA 18 Ca -0.05 -1.50 -0.18 0.00 0.00 0.00 0.00 51.96 50.24 3k1q s ALA 18 Cb 0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 3k1q s ALA 18 CO 0.50 0.22 1.29 -2.14 0.00 0.00 0.00 175.76 175.64 3k1q s PRO 19 N -2.84 2.48 -1.12 0.00 0.02 -1.26 -4.80 135.00 127.48 3k1q s PRO 19 Ca 0.16 2.06 -0.22 0.00 0.02 0.00 0.00 61.00 63.02 3k1q s PRO 19 Cb -0.05 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.59 3k1q s PRO 19 CO 0.07 -1.65 1.86 -0.51 -0.33 0.00 0.00 177.00 176.44 3k1q s LEU 20 N -4.45 3.25 0.00 -5.54 1.43 -1.26 -4.68 118.68 107.42 3k1q s LEU 20 Ca 0.82 -1.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.39 3k1q s LEU 20 Cb -0.37 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.27 3k1q s LEU 20 CO 0.41 -2.54 0.00 2.22 0.23 0.00 0.00 176.35 176.66 3k1q n PHE 21 N 12.81 0.00 -3.04 0.29 1.16 -1.18 -4.78 117.46 122.72 3k1q n PHE 21 Ca 0.43 0.00 -0.19 0.00 -1.87 0.00 0.00 57.45 55.83 3k1q n PHE 21 Cb 0.47 0.00 0.01 0.00 -1.61 0.00 0.00 39.48 38.35 3k1q n PHE 21 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 3k1q s ASP 22 N 0.00 5.67 0.36 5.98 -4.77 -1.26 -4.61 116.67 118.03 3k1q s ASP 22 Ca 0.00 -0.23 0.14 0.00 -3.30 0.00 0.00 52.55 49.16 3k1q s ASP 22 Cb 0.00 -0.90 0.98 0.00 -1.09 0.00 0.00 42.92 41.91 3k1q s ASP 22 CO 0.00 -0.76 1.75 0.25 0.70 0.00 0.00 175.17 177.11 3k1q h LEU 23 N 0.56 0.57 -0.76 2.11 5.85 -1.97 0.19 115.31 121.87 3k1q h LEU 23 Ca -0.42 0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.33 3k1q h LEU 23 Cb 1.28 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.30 3k1q h LEU 23 CO 0.49 0.11 0.11 0.78 -0.34 0.00 0.00 178.44 179.59 3k1q h ASN 24 N 0.51 1.00 -0.49 1.25 4.21 -1.98 0.29 115.58 120.36 3k1q h ASN 24 Ca 0.62 -0.23 -0.09 0.00 1.21 0.00 0.00 56.30 57.80 3k1q h ASN 24 Cb 1.34 -0.27 -0.02 0.00 -1.12 0.00 0.00 38.32 38.25 3k1q h ASN 24 CO -0.38 1.00 -0.06 -0.78 -1.29 0.00 0.00 177.43 175.91 3k1q h ASP 25 N 0.99 0.90 -0.20 5.81 -0.00 -1.40 0.23 116.42 122.75 3k1q h ASP 25 Ca 0.20 -0.34 -0.16 0.00 -0.00 0.00 0.00 57.03 56.74 3k1q h ASP 25 Cb 0.42 -0.25 -0.01 0.00 -0.00 0.00 0.00 39.33 39.50 3k1q h ASP 25 CO 0.01 1.03 -0.44 0.25 -0.00 0.00 0.00 179.24 180.09 3k1q h LEU 26 N 0.77 0.81 0.11 2.28 5.85 -0.20 -0.62 115.31 124.30 3k1q h LEU 26 Ca 0.13 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.48 3k1q h LEU 26 Cb 0.60 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 3k1q h LEU 26 CO 0.04 1.13 -0.48 -0.61 -0.34 0.00 0.00 178.44 178.18 3k1q h GLN 27 N 0.61 -0.66 -0.31 1.25 4.15 -0.76 0.51 115.11 119.89 3k1q h GLN 27 Ca 0.04 0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.53 3k1q h GLN 27 Cb 1.00 0.15 -0.04 0.00 0.21 0.00 0.00 27.48 28.80 3k1q h GLN 27 CO 0.09 -0.44 -0.18 0.39 -1.93 0.00 0.00 178.83 176.76 3k1q n GLU 28 N -5.20 -0.14 0.00 1.69 4.71 0.05 -2.06 120.64 119.70 3k1q n GLU 28 Ca -0.08 1.03 0.00 0.00 -0.01 0.00 0.00 57.16 58.10 3k1q n GLU 28 Cb 0.38 -1.53 0.00 0.00 -1.01 0.00 0.00 31.44 29.27 3k1q n GLU 28 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3k1q n LEU 29 N -3.67 0.00 0.07 -4.62 4.77 -0.28 -0.59 117.00 112.67 3k1q n LEU 29 Ca 0.01 0.65 -0.04 0.00 -0.03 0.00 0.00 56.01 56.60 3k1q n LEU 29 Cb 0.08 -0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 3k1q n LEU 29 CO -0.05 -0.15 0.51 0.00 -1.33 0.00 0.00 177.39 176.36 3k1q h ALA 30 N -1.76 -0.88 -0.76 -1.18 0.00 -0.05 -1.77 119.26 112.86 3k1q h ALA 30 Ca 0.00 -0.04 0.21 0.00 0.00 0.00 0.00 54.91 55.08 3k1q h ALA 30 Cb 0.00 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 3k1q h ALA 30 CO 0.00 -0.88 0.54 0.78 0.00 0.00 0.00 179.25 179.69 3k1q h GLY 31 N -0.21 0.18 0.86 0.00 0.00 -1.54 -2.99 103.07 99.38 3k1q h GLY 31 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.27 3k1q h GLY 31 CO -0.00 0.00 -0.65 0.00 0.00 0.00 0.00 176.54 175.89 3k1q n TYR 33 N -1.66 0.00 0.01 0.00 4.01 -0.68 -5.05 117.16 113.78 3k1q n TYR 33 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 3k1q n TYR 33 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 3k1q n TYR 33 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3k1q n ALA 34 N -3.00 0.00 -1.69 -0.72 0.00 -1.25 -4.98 120.51 108.87 3k1q n ALA 34 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 3k1q n ALA 34 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 3k1q n ALA 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3k1q n ARG 35 N -2.44 2.51 0.00 0.00 1.74 -1.26 -2.46 116.66 114.75 3k1q n ARG 35 Ca 0.00 0.91 0.00 0.00 -0.77 0.00 0.00 57.85 57.99 3k1q n ARG 35 Cb 0.00 -2.74 0.00 0.00 -1.02 0.00 0.00 32.46 28.70 3k1q n ARG 35 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3k1q n PRO 36 N 4.44 0.19 -4.94 5.56 -0.04 -1.26 -4.80 135.00 134.15 3k1q n PRO 36 Ca 0.17 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.31 3k1q n PRO 36 Cb 0.33 -1.01 -0.15 0.00 -0.04 0.00 0.00 33.50 32.63 3k1q n PRO 36 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3k1q s TRP 37 N -1.87 2.68 -1.62 0.54 0.51 -1.26 -5.02 118.94 112.90 3k1q s TRP 37 Ca 0.00 -0.51 0.00 0.00 -2.12 0.00 0.00 56.10 53.47 3k1q s TRP 37 Cb 0.00 -1.71 0.00 0.00 -0.81 0.00 0.00 33.47 30.95 3k1q s TRP 37 CO 0.00 -0.09 0.33 -2.37 -0.51 0.00 0.00 176.95 174.31 3k1q n THR 38 N 2.98 0.00 -0.27 2.01 5.66 -1.26 -4.15 114.28 119.24 3k1q n THR 38 Ca -0.18 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 60.85 3k1q n THR 38 Cb 0.52 -0.90 0.10 0.00 -1.55 0.00 0.00 70.33 68.50 3k1q n THR 38 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 3k1q h SER 39 N 0.00 -0.70 -0.32 1.09 4.64 -1.95 0.16 113.55 116.47 3k1q h SER 39 Ca 0.00 0.23 -0.01 0.00 -0.47 0.00 0.00 61.79 61.55 3k1q h SER 39 Cb 0.00 0.48 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 3k1q h SER 39 CO 0.00 -0.26 0.17 0.03 -0.87 0.00 0.00 176.83 175.91 3k1q h ARG 40 N 0.01 0.44 -0.23 4.77 3.08 -1.95 0.61 114.38 121.11 3k1q h ARG 40 Ca 0.38 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.36 3k1q h ARG 40 Cb 0.59 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 3k1q h ARG 40 CO -0.80 0.37 0.06 0.35 -1.07 0.00 0.00 179.97 178.88 3k1q h PHE 41 N 0.39 0.38 -0.45 3.04 3.57 -1.19 -2.89 116.94 119.79 3k1q h PHE 41 Ca 0.11 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 3k1q h PHE 41 Cb 0.06 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 3k1q h PHE 41 CO -0.03 0.45 0.18 1.03 -2.23 0.00 0.00 178.31 177.71 3k1q h SER 42 N 0.20 0.57 -0.55 0.41 0.87 -0.41 -2.40 113.55 112.24 3k1q h SER 42 Ca 0.07 -0.06 0.11 0.00 -1.23 0.00 0.00 61.79 60.68 3k1q h SER 42 Cb 0.26 -0.15 -0.10 0.00 -0.44 0.00 0.00 62.40 61.97 3k1q h SER 42 CO -0.00 0.52 -0.13 0.45 -0.53 0.00 0.00 176.83 177.14 3k1q h HIS 43 N 0.63 -0.28 -0.21 2.24 3.86 -0.68 0.16 115.15 120.88 3k1q h HIS 43 Ca 0.15 0.05 0.01 0.00 -1.16 0.00 0.00 60.37 59.43 3k1q h HIS 43 Cb 0.12 0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.79 3k1q h HIS 43 CO 0.01 -0.23 0.09 1.25 0.86 0.00 0.00 177.93 179.91 3k1q h LEU 44 N 0.00 0.13 -0.88 2.43 5.85 -1.35 -3.34 115.31 118.16 3k1q h LEU 44 Ca 0.26 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.96 3k1q h LEU 44 Cb 0.40 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 3k1q h LEU 44 CO -0.56 0.11 0.41 0.00 -0.34 0.00 0.00 178.44 178.05 3k1q h ALA 45 N 1.11 1.13 -0.92 1.25 0.00 -0.56 -3.27 119.26 117.99 3k1q h ALA 45 Ca 0.09 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.92 3k1q h ALA 45 Cb 0.03 -0.33 -0.06 0.00 0.00 0.00 0.00 17.79 17.42 3k1q h ALA 45 CO -0.07 0.66 0.59 -0.84 0.00 0.00 0.00 179.25 179.60 3k1q h ILE 46 N 1.20 1.01 -0.13 0.00 -0.00 -0.90 -3.43 117.51 115.26 3k1q h ILE 46 Ca 0.29 -0.33 -0.01 0.00 -0.00 0.00 0.00 64.86 64.80 3k1q h ILE 46 Cb 0.11 -0.05 -0.00 0.00 -0.00 0.00 0.00 36.82 36.88 3k1q h ILE 46 CO -0.04 0.18 0.18 -1.20 -0.00 0.00 0.00 178.15 177.27 3k1q n SER 47 N -4.52 1.01 -1.90 2.16 7.64 -1.24 -4.59 113.62 112.18 3k1q n SER 47 Ca 0.15 -2.06 0.00 0.00 1.01 0.00 0.00 58.87 57.97 3k1q n SER 47 Cb 0.26 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 61.90 3k1q n SER 47 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3k1q n THR 48 N 8.46 0.00 -1.47 0.44 -2.24 -1.26 -1.99 114.28 116.23 3k1q n THR 48 Ca 0.40 -0.22 -0.04 0.00 -2.27 0.00 0.00 64.05 61.91 3k1q n THR 48 Cb 0.45 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.67 3k1q n THR 48 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k1q n GLY 49 N 1.64 0.18 0.04 3.38 0.00 -1.26 -4.91 105.19 104.25 3k1q n GLY 49 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 3k1q n GLY 49 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3k1q h SER 50 N 0.00 -0.06 -2.89 1.61 4.64 -1.80 -3.46 113.55 111.58 3k1q h SER 50 Ca -0.09 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.68 3k1q h SER 50 Cb 0.48 0.02 0.08 0.00 -0.31 0.00 0.00 62.40 62.67 3k1q h SER 50 CO 0.13 0.01 0.84 -0.11 -0.87 0.00 0.00 176.83 176.83 3k1q n LEU 51 N -2.52 3.86 -4.76 5.97 7.94 -1.26 -4.93 117.00 121.30 3k1q n LEU 51 Ca -0.01 1.12 -0.41 0.00 -1.11 0.00 0.00 56.01 55.60 3k1q n LEU 51 Cb 0.03 -1.53 -0.02 0.00 0.53 0.00 0.00 43.42 42.43 3k1q n LEU 51 CO 0.02 -0.03 1.04 -2.84 -1.11 0.00 0.00 177.39 174.47 3k1q s PRO 52 N 0.04 4.30 0.23 1.96 0.02 -1.26 -4.86 135.00 135.43 3k1q s PRO 52 Ca 0.69 2.28 0.25 0.00 0.02 0.00 0.00 61.00 64.24 3k1q s PRO 52 Cb -0.55 -3.07 0.89 0.00 0.02 0.00 0.00 34.50 31.78 3k1q s PRO 52 CO 0.44 -0.30 1.75 1.33 -0.33 0.00 0.00 177.00 179.89 3k1q n VAL 53 N 1.29 0.69 -2.11 3.83 0.24 -1.26 -4.75 118.33 116.27 3k1q n VAL 53 Ca 0.02 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.34 61.86 3k1q n VAL 53 Cb 0.41 -0.84 -0.02 0.00 -1.47 0.00 0.00 33.84 31.92 3k1q n VAL 53 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 3k1q s TRP 54 N -3.20 3.10 0.30 6.34 0.51 -1.17 -2.49 118.94 122.33 3k1q s TRP 54 Ca 0.08 1.20 -0.15 0.00 -2.12 0.00 0.00 56.10 55.10 3k1q s TRP 54 Cb 0.11 -3.71 0.02 0.00 -0.81 0.00 0.00 33.47 29.07 3k1q s TRP 54 CO 0.51 -2.19 0.62 -1.54 -0.51 0.00 0.00 176.95 173.83 3k1q s SER 55 N 0.11 -0.01 0.38 2.95 1.04 0.63 -4.91 113.70 113.88 3k1q s SER 55 Ca 0.56 -0.93 0.05 0.00 0.48 0.00 0.00 55.95 56.10 3k1q s SER 55 Cb -0.40 0.69 0.75 0.00 0.10 0.00 0.00 66.02 67.17 3k1q s SER 55 CO 0.44 -1.34 2.01 0.00 0.98 0.00 0.00 173.24 175.34 3k1q h ALA 56 N 2.10 1.66 0.06 5.32 0.00 -1.99 -2.75 119.26 123.66 3k1q h ALA 56 Ca -0.25 -0.03 -0.28 0.00 0.00 0.00 0.00 54.91 54.34 3k1q h ALA 56 Cb 1.25 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 3k1q h ALA 56 CO 0.33 0.29 -1.53 -0.09 0.00 0.00 0.00 179.25 178.25 3k1q h ARG 57 N 0.71 0.13 -3.58 0.00 9.65 -1.99 -3.44 114.38 115.86 3k1q h ARG 57 Ca 0.23 -0.21 -0.65 0.00 -1.10 0.00 0.00 59.98 58.24 3k1q h ARG 57 Cb 0.03 0.08 -0.40 0.00 -1.39 0.00 0.00 29.97 28.29 3k1q h ARG 57 CO -0.06 1.10 -0.59 0.71 2.80 0.00 0.00 179.97 183.94 3k1q s TYR 58 N -2.45 3.29 0.23 2.20 4.12 -1.04 -4.74 117.35 118.97 3k1q s TYR 58 Ca -0.25 -3.06 -0.06 0.00 0.02 0.00 0.00 57.07 53.72 3k1q s TYR 58 Cb 0.06 -2.91 0.40 0.00 -1.52 0.00 0.00 41.96 37.98 3k1q s TYR 58 CO 0.68 -0.79 1.72 -1.35 0.02 0.00 0.00 175.55 175.83 3k1q h PRO 59 N 6.74 0.36 -4.90 -1.71 0.11 -1.76 0.18 132.00 131.02 3k1q h PRO 59 Ca -0.06 -0.02 -0.44 0.00 0.11 0.00 0.00 66.00 65.58 3k1q h PRO 59 Cb 0.92 -0.08 -0.14 0.00 0.11 0.00 0.00 31.00 31.81 3k1q h PRO 59 CO 0.68 0.24 -0.54 -1.54 -0.21 0.00 0.00 178.00 176.62 3k1q s SER 60 N -5.32 1.72 0.20 -2.05 1.04 -1.04 -3.07 113.70 105.17 3k1q s SER 60 Ca -0.13 -1.60 -0.11 0.00 0.48 0.00 0.00 55.95 54.59 3k1q s SER 60 Cb 0.20 0.42 0.16 0.00 0.10 0.00 0.00 66.02 66.90 3k1q s SER 60 CO 0.75 -0.92 1.84 0.58 0.98 0.00 0.00 173.24 176.48 3k1q h VAL 61 N 2.15 1.09 -0.06 5.02 2.07 -1.71 -1.89 116.25 122.91 3k1q h VAL 61 Ca -0.33 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 66.87 3k1q h VAL 61 Cb 1.25 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 3k1q h VAL 61 CO 0.50 0.15 -0.20 0.00 0.02 0.00 0.00 177.57 178.04 3k1q h ALA 62 N 1.28 1.55 -0.12 1.67 0.00 -1.94 -0.09 119.26 121.62 3k1q h ALA 62 Ca 0.26 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.99 3k1q h ALA 62 Cb 0.02 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 3k1q h ALA 62 CO -0.10 0.33 -0.51 0.77 0.00 0.00 0.00 179.25 179.73 3k1q h SER 63 N 0.10 -1.62 -0.74 0.00 0.02 -1.64 0.17 113.55 109.84 3k1q h SER 63 Ca 0.02 0.20 0.07 0.00 -0.84 0.00 0.00 61.79 61.23 3k1q h SER 63 Cb 0.41 0.63 -0.05 0.00 0.14 0.00 0.00 62.40 63.54 3k1q h SER 63 CO 0.03 -0.48 0.49 -0.09 -1.14 0.00 0.00 176.83 175.64 3k1q h ARG 64 N -0.57 0.74 -0.33 3.45 2.43 -0.90 -0.77 114.38 118.43 3k1q h ARG 64 Ca 0.04 -0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.24 3k1q h ARG 64 Cb 0.68 -0.17 -0.07 0.00 -0.42 0.00 0.00 29.97 29.99 3k1q h ARG 64 CO -0.42 0.49 -0.18 -0.97 -1.51 0.00 0.00 179.97 177.38 3k1q h ASN 65 N 0.76 -0.60 -0.11 -3.80 -1.24 -0.43 0.21 115.58 110.37 3k1q h ASN 65 Ca 0.32 0.13 -0.01 0.00 0.71 0.00 0.00 56.30 57.46 3k1q h ASN 65 Cb 0.28 0.32 -0.00 0.00 0.73 0.00 0.00 38.32 39.65 3k1q h ASN 65 CO -0.11 -0.21 0.05 0.40 -1.29 0.00 0.00 177.43 176.26 3k1q h ILE 66 N -0.13 1.14 0.00 2.57 2.04 -0.13 -1.66 117.51 121.33 3k1q h ILE 66 Ca 0.17 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 3k1q h ILE 66 Cb 0.39 1.22 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 3k1q h ILE 66 CO -0.41 0.13 -0.13 -0.37 0.00 0.00 0.00 178.15 177.36 3k1q h VAL 67 N 0.03 0.39 0.31 1.67 -1.51 -1.11 -1.06 116.25 114.97 3k1q h VAL 67 Ca 0.04 -0.78 -0.02 0.00 -1.23 0.00 0.00 66.70 64.71 3k1q h VAL 67 Cb 0.16 1.57 0.00 0.00 -2.13 0.00 0.00 31.29 30.90 3k1q h VAL 67 CO -0.00 0.13 -0.15 0.58 -1.23 0.00 0.00 177.57 176.90 3k1q h VAL 68 N 0.00 0.71 -0.33 7.19 2.07 -0.18 -1.21 116.25 124.50 3k1q h VAL 68 Ca -0.00 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 67.50 3k1q h VAL 68 Cb 0.56 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 31.02 3k1q h VAL 68 CO 0.02 0.02 -0.13 -1.13 0.02 0.00 0.00 177.57 176.37 3k1q h ASN 69 N -0.46 -0.44 -0.38 0.57 -1.24 -0.85 -1.54 115.58 111.25 3k1q h ASN 69 Ca -0.04 0.12 -0.07 0.00 0.71 0.00 0.00 56.30 57.01 3k1q h ASN 69 Cb 0.35 0.26 -0.02 0.00 0.73 0.00 0.00 38.32 39.64 3k1q h ASN 69 CO 0.07 -0.16 0.01 0.71 -1.29 0.00 0.00 177.43 176.77 3k1q h THR 70 N -0.06 1.24 0.31 -3.57 1.35 -1.19 0.28 112.91 111.26 3k1q h THR 70 Ca 0.17 -0.97 -0.01 0.00 -0.55 0.00 0.00 66.41 65.05 3k1q h THR 70 Cb 0.31 0.87 -0.02 0.00 -1.73 0.00 0.00 68.15 67.59 3k1q h THR 70 CO -0.38 0.34 -0.38 0.25 -0.25 0.00 0.00 175.52 175.11 3k1q h LEU 71 N 0.71 -1.06 -0.18 3.87 5.85 -0.68 0.24 115.31 124.06 3k1q h LEU 71 Ca 0.14 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.97 3k1q h LEU 71 Cb 0.43 0.36 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 3k1q h LEU 71 CO 0.02 -0.48 -0.11 0.18 -0.34 0.00 0.00 178.44 177.71 3k1q n LEU 72 N -4.67 -0.19 -0.31 2.25 4.77 -0.63 -0.89 117.00 117.33 3k1q n LEU 72 Ca -0.08 1.07 0.14 0.00 -0.03 0.00 0.00 56.01 57.11 3k1q n LEU 72 Cb 0.33 -0.42 0.29 0.00 -2.33 0.00 0.00 43.42 41.30 3k1q n LEU 72 CO 0.18 -0.64 0.87 1.23 -1.33 0.00 0.00 177.39 177.70 3k1q h GLY 73 N 0.00 1.29 0.33 -0.72 0.00 0.18 -1.00 103.07 103.16 3k1q h GLY 73 Ca 0.03 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 3k1q h GLY 73 CO -0.17 -0.45 -0.05 0.00 0.00 0.00 0.00 176.54 175.86 3k1q h ALA 74 N 1.88 -0.15 0.00 3.60 0.00 0.16 -3.38 119.26 121.36 3k1q h ALA 74 Ca 0.57 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3k1q h ALA 74 Cb 1.18 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3k1q h ALA 74 CO -0.78 -0.25 0.00 -2.39 0.00 0.00 0.00 179.25 175.83 3k1q n HIS 75 N -4.87 0.83 -0.02 0.00 1.44 -0.07 -2.45 115.22 110.09 3k1q n HIS 75 Ca -0.08 0.33 -0.17 0.00 -2.01 0.00 0.00 57.72 55.79 3k1q n HIS 75 Cb 0.28 -1.04 -0.08 0.00 0.12 0.00 0.00 29.99 29.27 3k1q n HIS 75 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 3k1q h LEU 76 N 0.00 0.84 -1.79 2.39 3.38 -1.40 -3.28 115.31 115.45 3k1q h LEU 76 Ca 0.00 -0.65 0.36 0.00 0.09 0.00 0.00 57.88 57.68 3k1q h LEU 76 Cb 0.35 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 3k1q h LEU 76 CO 0.00 1.35 0.87 0.78 0.09 0.00 0.00 178.44 181.53 3k1q h ASN 77 N 0.39 0.13 0.00 -0.43 2.35 -1.65 0.26 115.58 116.62 3k1q h ASN 77 Ca -0.05 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3k1q h ASN 77 Cb 1.35 0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.74 3k1q h ASN 77 CO 0.15 -0.00 0.00 -2.65 -1.65 0.00 0.00 177.43 173.28 3k1q n PRO 78 N -4.31 0.00 0.25 0.81 -0.02 -1.24 -2.61 135.00 127.88 3k1q n PRO 78 Ca 0.29 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.85 3k1q n PRO 78 Cb 1.26 -0.19 0.63 0.00 -0.02 0.00 0.00 33.50 35.18 3k1q n PRO 78 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 3k1q h PHE 79 N 0.00 0.00 0.00 6.00 0.04 -0.64 -0.30 116.94 122.04 3k1q h PHE 79 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3k1q h PHE 79 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 3k1q h PHE 79 CO 0.00 0.07 0.00 0.00 -0.60 0.00 0.00 178.31 177.78 3k1q n ALA 80 N -2.49 2.25 -1.51 2.45 0.00 -0.09 -4.51 120.51 116.61 3k1q n ALA 80 Ca -0.03 -0.10 -0.36 0.00 0.00 0.00 0.00 53.44 52.96 3k1q n ALA 80 Cb 0.15 -1.44 0.09 0.00 0.00 0.00 0.00 19.45 18.25 3k1q n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k1q n GLY 81 N 1.26 0.23 0.33 0.00 0.00 -0.56 -4.93 105.19 101.51 3k1q n GLY 81 Ca 0.07 -0.27 0.21 0.00 0.00 0.00 0.00 46.02 46.04 3k1q n GLY 81 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3k1q h GLY 82 N 0.03 1.81 -0.92 -0.02 0.00 -1.87 -1.54 103.07 100.55 3k1q h GLY 82 Ca -0.49 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 3k1q h GLY 82 CO 0.50 -0.53 -0.39 0.61 0.00 0.00 0.00 176.54 176.73 3k1q n GLN 83 N -5.21 0.85 -1.96 4.80 -0.00 -1.26 -5.06 117.38 109.54 3k1q n GLN 83 Ca 0.29 -2.28 0.00 0.00 -0.00 0.00 0.00 57.00 55.01 3k1q n GLN 83 Cb 0.94 -1.06 0.00 0.00 -0.00 0.00 0.00 30.24 30.11 3k1q n GLN 83 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 3k1q n ILE 84 N -0.73-10.64 -4.28 -0.39 5.41 -0.58 -5.04 119.36 103.11 3k1q n ILE 84 Ca 0.11 2.42 -0.26 0.00 1.00 0.00 0.00 62.75 66.02 3k1q n ILE 84 Cb 0.74 -5.24 -0.09 0.00 -0.71 0.00 0.00 39.64 34.34 3k1q n ILE 84 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 3k1q s THR 85 N -0.44 3.29 0.00 1.39 -4.23 -0.23 -4.57 115.64 110.85 3k1q s THR 85 Ca 0.00 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 58.85 3k1q s THR 85 Cb 0.00 -2.65 0.00 0.00 1.34 0.00 0.00 72.50 71.19 3k1q s THR 85 CO 0.00 -0.14 0.00 -0.24 -0.54 0.00 0.00 174.62 173.70 3k1q n SER 86 N -0.09 0.00 -2.71 3.99 2.88 0.29 -2.27 113.62 115.71 3k1q n SER 86 Ca -0.10 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.43 3k1q n SER 86 Cb 0.56 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 64.03 3k1q n SER 86 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3k1q n HIS 87 N 0.00 -0.87 -2.72 0.66 1.44 -0.24 -4.48 115.22 109.01 3k1q n HIS 87 Ca 0.00 -0.76 -0.03 0.00 -2.01 0.00 0.00 57.72 54.92 3k1q n HIS 87 Cb 0.00 0.37 -0.02 0.00 0.12 0.00 0.00 29.99 30.45 3k1q n HIS 87 CO 0.00 0.00 0.00 0.94 -2.81 0.00 0.00 176.34 174.47 3k1q n GLN 88 N -0.54 -3.69 0.00 -1.40 0.00 -1.26 -4.41 117.38 106.07 3k1q n GLN 88 Ca -0.00 2.90 0.00 0.00 -0.00 0.00 0.00 57.00 59.90 3k1q n GLN 88 Cb 0.40 -4.70 0.00 0.00 0.00 0.00 0.00 30.24 25.94 3k1q n GLN 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3k1q n GLY 89 N 1.32 1.55 3.50 1.69 0.00 -1.26 -4.76 105.19 107.23 3k1q n GLY 89 Ca -0.20 0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 3k1q n GLY 89 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k1q s ILE 90 N 0.00 5.00 -0.28 -0.61 -1.09 -1.24 0.09 121.20 123.07 3k1q s ILE 90 Ca 0.00 -0.13 0.02 0.00 -2.23 0.00 0.00 60.65 58.31 3k1q s ILE 90 Cb 0.00 -4.09 0.06 0.00 -1.58 0.00 0.00 42.46 36.86 3k1q s ILE 90 CO 0.00 -0.46 -0.07 -0.89 -1.23 0.00 0.00 174.94 172.29 3k1q s THR 91 N 2.38 2.33 0.03 2.92 2.01 -0.67 -1.08 115.64 123.55 3k1q s THR 91 Ca 0.16 -1.67 -0.35 0.00 0.31 0.00 0.00 61.69 60.13 3k1q s THR 91 Cb -0.16 -2.40 -0.14 0.00 0.01 0.00 0.00 72.50 69.80 3k1q s THR 91 CO 0.15 -0.11 1.61 0.79 -0.69 0.00 0.00 174.62 176.37 3k1q n TRP 92 N 4.45 2.07 -1.65 4.92 7.02 -1.26 -3.05 117.44 129.94 3k1q n TRP 92 Ca -0.12 0.33 -0.23 0.00 -1.02 0.00 0.00 57.50 56.47 3k1q n TRP 92 Cb 0.42 -2.51 -0.05 0.00 -2.42 0.00 0.00 31.31 26.75 3k1q n TRP 92 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 3k1q s ARG 93 N 1.83 1.91 0.40 -0.99 3.52 -0.38 -4.54 118.95 120.70 3k1q s ARG 93 Ca 0.86 0.65 0.00 0.00 -0.13 0.00 0.00 55.73 57.11 3k1q s ARG 93 Cb -0.80 -4.74 0.00 0.00 -1.56 0.00 0.00 34.95 27.85 3k1q s ARG 93 CO 0.47 -3.91 0.00 -3.47 -0.81 0.00 0.00 175.30 167.58 3k1q n ASP 94 N 17.03 -7.19 -0.23 -2.12 4.64 -1.26 -1.10 116.55 126.31 3k1q n ASP 94 Ca 0.42 1.00 0.08 0.00 -1.38 0.00 0.00 54.79 54.91 3k1q n ASP 94 Cb 0.47 -3.65 0.16 0.00 -1.04 0.00 0.00 41.12 37.07 3k1q n ASP 94 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 3k1q n PRO 95 N -0.74 -0.06 0.00 -0.67 -0.02 -1.26 0.04 135.00 132.30 3k1q n PRO 95 Ca 0.00 1.01 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 3k1q n PRO 95 Cb 0.00 -1.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 3k1q n PRO 95 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3k1q n VAL 96 N -4.96 0.00 -2.54 -1.45 0.24 -1.26 -4.81 118.33 103.56 3k1q n VAL 96 Ca 0.14 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 62.26 3k1q n VAL 96 Cb 0.45 -0.23 -0.00 0.00 -1.47 0.00 0.00 33.84 32.59 3k1q n VAL 96 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3k1q n LEU 97 N 0.14 -1.71 -0.21 1.34 4.77 0.11 -4.86 117.00 116.58 3k1q n LEU 97 Ca 0.00 0.01 0.07 0.00 -0.03 0.00 0.00 56.01 56.07 3k1q n LEU 97 Cb 0.09 -2.61 0.35 0.00 -2.33 0.00 0.00 43.42 38.92 3k1q n LEU 97 CO 0.00 -0.12 1.22 0.77 -1.33 0.00 0.00 177.39 177.93 3k1q h SER 98 N -0.20 0.68 -3.49 -1.43 4.64 -1.19 -3.45 113.55 109.11 3k1q h SER 98 Ca -0.42 0.01 0.08 0.00 -0.47 0.00 0.00 61.79 60.98 3k1q h SER 98 Cb 1.31 -0.13 -0.25 0.00 -0.31 0.00 0.00 62.40 63.01 3k1q h SER 98 CO 0.49 0.42 0.51 -0.55 -0.87 0.00 0.00 176.83 176.84 3k1q s SER 99 N -6.12 -0.40 -0.95 4.97 0.15 -1.22 -4.56 113.70 105.58 3k1q s SER 99 Ca -0.10 0.65 -0.26 0.00 0.70 0.00 0.00 55.95 56.94 3k1q s SER 99 Cb 0.20 0.62 -0.16 0.00 -1.71 0.00 0.00 66.02 64.96 3k1q s SER 99 CO 0.78 -0.21 2.21 -0.76 1.20 0.00 0.00 173.24 176.45 3k1q s LEU 100 N -0.29 2.71 -0.12 3.45 1.43 -1.03 -1.25 118.68 123.57 3k1q s LEU 100 Ca 0.02 -0.57 -0.12 0.00 -1.03 0.00 0.00 54.13 52.42 3k1q s LEU 100 Cb -0.03 -2.57 -0.05 0.00 0.03 0.00 0.00 46.19 43.57 3k1q s LEU 100 CO -0.04 -4.06 0.27 0.00 0.23 0.00 0.00 176.35 172.75 3k1q s ALA 101 N 14.93 3.68 -0.62 4.21 0.00 -1.17 -4.75 121.76 138.04 3k1q s ALA 101 Ca 0.84 -0.46 -0.27 0.00 0.00 0.00 0.00 51.96 52.07 3k1q s ALA 101 Cb -0.08 -2.29 -0.01 0.00 0.00 0.00 0.00 23.12 20.74 3k1q s ALA 101 CO 0.11 0.28 1.75 -2.14 0.00 0.00 0.00 175.76 175.77 3k1q s PRO 102 N -0.15 2.75 0.00 0.00 0.02 -1.20 -1.68 135.00 134.75 3k1q s PRO 102 Ca 0.17 0.49 0.00 0.00 0.02 0.00 0.00 61.00 61.68 3k1q s PRO 102 Cb -0.13 -4.34 0.00 0.00 0.02 0.00 0.00 34.50 30.04 3k1q s PRO 102 CO 0.05 -2.59 0.00 1.33 -0.33 0.00 0.00 177.00 175.46 3k1q n VAL 103 N 7.08 0.00 -1.37 3.83 0.24 0.11 -4.78 118.33 123.44 3k1q n VAL 103 Ca 0.17 0.00 -0.47 0.00 -2.04 0.00 0.00 64.34 62.00 3k1q n VAL 103 Cb 0.51 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 32.75 3k1q n VAL 103 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 3k1q n PRO 104 N 0.25 0.00 0.00 7.34 -0.02 -1.26 -4.89 135.00 136.42 3k1q n PRO 104 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3k1q n PRO 104 Cb 0.00 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 3k1q n PRO 104 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k1q n ALA 105 N 9.12 0.00 -1.37 3.55 0.00 -1.26 -1.20 120.51 129.36 3k1q n ALA 105 Ca 0.60 0.00 0.01 0.00 0.00 0.00 0.00 53.44 54.05 3k1q n ALA 105 Cb 0.00 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.66 3k1q n ALA 105 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3k1q n ILE 106 N -0.41 2.39 -1.30 0.00 -5.35 -1.26 -4.68 119.36 108.75 3k1q n ILE 106 Ca 0.00 -2.64 0.01 0.00 -0.27 0.00 0.00 62.75 59.85 3k1q n ILE 106 Cb 0.00 -0.29 0.21 0.00 -1.74 0.00 0.00 39.64 37.82 3k1q n ILE 106 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3k1q n GLN 107 N -1.05 2.05 -0.32 6.28 3.00 -0.34 -4.90 117.38 122.09 3k1q n GLN 107 Ca 0.27 -3.04 0.09 0.00 -0.01 0.00 0.00 57.00 54.31 3k1q n GLN 107 Cb 0.92 -1.78 0.30 0.00 0.00 0.00 0.00 30.24 29.68 3k1q n GLN 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.06 175.71 3k1q h PRO 108 N 1.11 0.85 -1.54 -1.09 0.11 -1.83 -3.38 132.00 126.22 3k1q h PRO 108 Ca 0.12 -0.05 0.47 0.00 0.11 0.00 0.00 66.00 66.65 3k1q h PRO 108 Cb 1.48 -0.19 -0.09 0.00 0.11 0.00 0.00 31.00 32.31 3k1q h PRO 108 CO 0.27 0.56 1.06 -1.35 -0.21 0.00 0.00 178.00 178.34 3k1q h PRO 109 N 0.87 0.05 -6.07 1.05 0.11 -1.92 -3.37 132.00 122.73 3k1q h PRO 109 Ca 0.47 -0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.99 3k1q h PRO 109 Cb 0.56 -0.01 -0.10 0.00 0.11 0.00 0.00 31.00 31.56 3k1q h PRO 109 CO -0.23 0.03 1.09 -1.25 -0.21 0.00 0.00 178.00 177.43 3k1q s PRO 110 N -5.08 3.32 1.06 1.05 0.04 -1.26 -4.95 135.00 129.18 3k1q s PRO 110 Ca -0.06 -0.67 -0.17 0.00 0.04 0.00 0.00 61.00 60.14 3k1q s PRO 110 Cb 0.27 -4.56 0.08 0.00 0.04 0.00 0.00 34.50 30.33 3k1q s PRO 110 CO 0.85 -2.09 0.11 1.33 0.04 0.00 0.00 177.00 177.23 3k1q n VAL 111 N 6.39 0.00 -2.96 -0.36 0.24 -1.26 -1.00 118.33 119.39 3k1q n VAL 111 Ca 0.12 -0.26 -0.44 0.00 -2.04 0.00 0.00 64.34 61.71 3k1q n VAL 111 Cb 0.49 -0.59 -0.03 0.00 -1.47 0.00 0.00 33.84 32.23 3k1q n VAL 111 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 3k1q s TRP 112 N -2.28 3.04 -0.65 6.34 -0.00 -1.26 -0.54 118.94 123.58 3k1q s TRP 112 Ca 0.56 -1.17 -0.26 0.00 -0.00 0.00 0.00 56.10 55.23 3k1q s TRP 112 Cb -0.15 -4.21 -0.12 0.00 -0.00 0.00 0.00 33.47 28.99 3k1q s TRP 112 CO 0.67 -1.47 2.47 0.00 -0.00 0.00 0.00 176.95 178.62 3k1q n ALA 113 N 6.62 0.64 -0.53 5.86 0.00 -1.26 -4.92 120.51 126.91 3k1q n ALA 113 Ca 0.12 -0.86 -0.36 0.00 0.00 0.00 0.00 53.44 52.34 3k1q n ALA 113 Cb 0.47 -3.00 -0.08 0.00 0.00 0.00 0.00 19.45 16.84 3k1q n ALA 113 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3k1q n VAL 114 N 7.90 0.41 -2.16 0.00 0.24 -1.26 -4.79 118.33 118.67 3k1q n VAL 114 Ca 0.45 -0.33 -0.32 0.00 -2.04 0.00 0.00 64.34 62.11 3k1q n VAL 114 Cb 0.41 -1.97 -0.01 0.00 -1.47 0.00 0.00 33.84 30.80 3k1q n VAL 114 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k1q s ALA 115 N 6.17 2.94 0.00 2.33 0.00 -1.26 -5.10 121.76 126.84 3k1q s ALA 115 Ca 0.54 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.70 3k1q s ALA 115 Cb 0.12 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 20.09 3k1q s ALA 115 CO 0.23 -0.54 0.00 0.39 0.00 0.00 0.00 175.76 175.84 3k1q n GLU 116 N -1.99 0.00 -3.56 0.00 1.02 -1.26 -4.97 120.64 109.89 3k1q n GLU 116 Ca 0.07 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.80 3k1q n GLU 116 Cb 0.54 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.87 3k1q n GLU 116 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3k1q s ASN 117 N -1.00 5.70 -0.20 1.62 4.22 -1.26 -4.95 114.94 119.08 3k1q s ASN 117 Ca 0.00 -1.91 -0.04 0.00 -2.14 0.00 0.00 52.86 48.77 3k1q s ASN 117 Cb 0.00 -2.01 0.09 0.00 1.28 0.00 0.00 41.25 40.61 3k1q s ASN 117 CO 0.00 -0.69 0.25 0.54 -2.04 0.00 0.00 177.10 175.16 3k1q s VAL 118 N 1.36 -0.38 0.28 3.54 0.11 -1.26 -5.04 120.40 119.01 3k1q s VAL 118 Ca 0.06 -0.04 -0.27 0.00 -2.93 0.00 0.00 61.98 58.80 3k1q s VAL 118 Cb -0.26 -0.66 -0.15 0.00 -1.53 0.00 0.00 36.38 33.78 3k1q s VAL 118 CO -0.01 -0.14 0.81 -0.11 -3.33 0.00 0.00 175.10 172.32 3k1q n LEU 119 N 5.33 0.69 -4.15 2.54 -0.00 -1.26 -3.58 117.00 116.57 3k1q n LEU 119 Ca -0.05 1.13 -0.15 0.00 -0.00 0.00 0.00 56.01 56.94 3k1q n LEU 119 Cb 0.50 -1.17 -0.11 0.00 -0.00 0.00 0.00 43.42 42.64 3k1q n LEU 119 CO 0.07 -2.06 -0.42 -0.76 -0.00 0.00 0.00 177.39 174.22 3k1q s LEU 120 N 1.34 2.35 -0.36 -1.96 1.43 0.45 -4.97 118.68 116.96 3k1q s LEU 120 Ca 0.61 -0.71 -0.07 0.00 -1.03 0.00 0.00 54.13 52.92 3k1q s LEU 120 Cb -0.75 -0.31 0.05 0.00 0.03 0.00 0.00 46.19 45.21 3k1q s LEU 120 CO 0.59 -0.22 0.15 -0.62 0.23 0.00 0.00 176.35 176.48 3k1q s ASP 121 N -2.11 5.42 0.15 2.29 2.15 -1.26 -1.34 116.67 121.97 3k1q s ASP 121 Ca 0.00 -1.22 -0.17 0.00 0.43 0.00 0.00 52.55 51.59 3k1q s ASP 121 Cb -0.06 -1.91 0.04 0.00 -0.30 0.00 0.00 42.92 40.70 3k1q s ASP 121 CO 0.00 -0.38 1.72 0.77 -0.17 0.00 0.00 175.17 177.12 3k1q h SER 122 N 8.27 -0.04 0.13 -0.34 4.64 -1.90 -0.85 113.55 123.47 3k1q h SER 122 Ca -0.23 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3k1q h SER 122 Cb 1.08 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3k1q h SER 122 CO 0.64 0.02 0.00 0.59 -0.87 0.00 0.00 176.83 177.21 3k1q n ASN 123 N -5.12 0.50 0.04 4.97 4.13 -1.26 -1.78 115.26 116.74 3k1q n ASN 123 Ca 0.00 0.71 0.13 0.00 1.68 0.00 0.00 54.58 57.10 3k1q n ASN 123 Cb 0.15 -0.78 0.51 0.00 -1.54 0.00 0.00 39.78 38.11 3k1q n ASN 123 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3k1q n ASN 124 N -2.14 0.31 -4.49 6.41 5.03 -0.32 -4.66 115.26 115.39 3k1q n ASN 124 Ca -0.01 0.54 -0.43 0.00 0.87 0.00 0.00 54.58 55.55 3k1q n ASN 124 Cb 0.06 -0.62 -0.08 0.00 -1.02 0.00 0.00 39.78 38.13 3k1q n ASN 124 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 3k1q s TYR 125 N -3.06 3.12 0.39 3.10 4.12 -0.74 -4.98 117.35 119.30 3k1q s TYR 125 Ca 0.11 -0.26 0.21 0.00 0.02 0.00 0.00 57.07 57.16 3k1q s TYR 125 Cb 0.15 -3.13 1.24 0.00 -1.52 0.00 0.00 41.96 38.71 3k1q s TYR 125 CO 0.51 -0.80 1.65 -1.00 0.02 0.00 0.00 175.55 175.94 3k1q h PRO 126 N 8.81 0.20 -0.13 -1.71 0.13 -1.87 -1.60 132.00 135.83 3k1q h PRO 126 Ca -0.26 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3k1q h PRO 126 Cb 1.10 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 3k1q h PRO 126 CO 0.85 0.13 0.08 1.79 -0.23 0.00 0.00 178.00 180.62 3k1q h THR 127 N 0.21 1.08 -0.01 1.56 1.35 -1.94 -0.92 112.91 114.24 3k1q h THR 127 Ca 0.76 -0.20 0.03 0.00 -0.55 0.00 0.00 66.41 66.45 3k1q h THR 127 Cb 2.04 0.97 -0.03 0.00 -1.73 0.00 0.00 68.15 69.40 3k1q h THR 127 CO -0.53 0.07 -0.17 1.88 -0.25 0.00 0.00 175.52 176.52 3k1q h TYR 128 N 0.14 -0.45 0.00 4.73 -1.99 -1.59 -2.38 116.97 115.43 3k1q h TYR 128 Ca 0.05 0.02 -0.08 0.00 2.00 0.00 0.00 58.73 60.71 3k1q h TYR 128 Cb 0.04 0.20 -0.01 0.00 2.00 0.00 0.00 36.73 38.97 3k1q h TYR 128 CO -0.05 -0.25 -0.37 -0.24 -0.00 0.00 0.00 178.16 177.25 3k1q h VAL 129 N -0.28 1.05 0.11 -2.88 3.04 -1.30 -2.92 116.25 113.07 3k1q h VAL 129 Ca 0.06 -1.38 0.02 0.00 -1.01 0.00 0.00 66.70 64.38 3k1q h VAL 129 Cb 0.35 1.79 -0.03 0.00 -2.01 0.00 0.00 31.29 31.40 3k1q h VAL 129 CO -0.17 0.36 -0.22 -0.07 -1.01 0.00 0.00 177.57 176.46 3k1q h LEU 130 N 0.00 -0.63 -4.07 3.16 3.38 -0.65 -3.20 115.31 113.29 3k1q h LEU 130 Ca -0.00 0.07 -0.33 0.00 0.09 0.00 0.00 57.88 57.71 3k1q h LEU 130 Cb 0.76 0.24 -0.12 0.00 0.09 0.00 0.00 40.66 41.63 3k1q h LEU 130 CO 0.05 -0.31 0.10 -0.46 0.09 0.00 0.00 178.44 177.91 3k1q n ASN 131 N -5.35 5.97 -0.35 -0.43 2.04 -1.05 -4.65 115.26 111.44 3k1q n ASN 131 Ca -0.07 -2.88 0.09 0.00 -0.44 0.00 0.00 54.58 51.28 3k1q n ASN 131 Cb 0.26 -1.26 0.26 0.00 -2.53 0.00 0.00 39.78 36.51 3k1q n ASN 131 CO 0.00 0.00 0.00 0.25 -0.44 0.00 0.00 177.26 177.07 3k1q h LEU 132 N 4.00 0.85 0.71 -4.53 5.85 -1.59 0.26 115.31 120.86 3k1q h LEU 132 Ca 0.28 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 59.03 3k1q h LEU 132 Cb 1.04 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 3k1q h LEU 132 CO 0.57 0.41 -0.47 0.77 -0.34 0.00 0.00 178.44 179.38 3k1q h SER 133 N 0.90 -1.22 0.59 1.25 4.64 -1.91 -2.73 113.55 115.07 3k1q h SER 133 Ca 0.52 0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 61.87 3k1q h SER 133 Cb 0.61 0.37 -0.01 0.00 -0.31 0.00 0.00 62.40 63.06 3k1q h SER 133 CO -0.30 -0.71 -0.19 0.28 -0.87 0.00 0.00 176.83 175.04 3k1q h SER 134 N -1.12 0.00 -1.00 4.97 0.02 -1.43 -2.49 113.55 112.50 3k1q h SER 134 Ca -0.09 0.00 0.16 0.00 -0.84 0.00 0.00 61.79 61.01 3k1q h SER 134 Cb 0.92 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.36 3k1q h SER 134 CO 0.07 0.19 0.62 -0.03 -1.14 0.00 0.00 176.83 176.54 3k1q h MET 135 N 0.00 0.84 -0.51 3.45 -1.53 -0.61 -3.30 114.93 113.27 3k1q h MET 135 Ca -0.00 -0.05 0.05 0.00 -3.44 0.00 0.00 59.70 56.26 3k1q h MET 135 Cb 0.53 -0.19 -0.05 0.00 -0.55 0.00 0.00 31.60 31.35 3k1q h MET 135 CO 0.02 0.56 0.25 -1.49 0.14 0.00 0.00 176.91 176.39 3k1q h TRP 136 N 0.87 0.46 -0.46 1.39 -0.00 -1.12 -0.64 115.95 116.45 3k1q h TRP 136 Ca 0.53 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 59.44 3k1q h TRP 136 Cb 0.70 -0.13 -0.02 0.00 -0.00 0.00 0.00 29.16 29.71 3k1q h TRP 136 CO -0.00 0.21 0.25 -1.35 -0.00 0.00 0.00 178.44 177.55 3k1q h PRO 137 N 0.49 0.64 0.00 0.49 0.11 -1.75 -3.22 132.00 128.76 3k1q h PRO 137 Ca 0.23 -0.08 -0.04 0.00 0.11 0.00 0.00 66.00 66.23 3k1q h PRO 137 Cb 0.16 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.14 3k1q h PRO 137 CO -0.17 0.51 -0.18 0.97 -0.21 0.00 0.00 178.00 178.92 3k1q h ILE 138 N 0.60 1.06 -0.69 4.15 6.09 -1.62 -2.91 117.51 124.19 3k1q h ILE 138 Ca 0.16 -0.62 0.01 0.00 -1.37 0.00 0.00 64.86 63.04 3k1q h ILE 138 Cb 0.06 1.34 -0.04 0.00 0.47 0.00 0.00 36.82 38.65 3k1q h ILE 138 CO -0.03 0.17 0.45 0.78 -3.07 0.00 0.00 178.15 176.46 3k1q h ASN 139 N 0.00 0.76 -0.53 2.19 4.21 -1.13 0.14 115.58 121.23 3k1q h ASN 139 Ca -0.00 -0.01 0.11 0.00 1.21 0.00 0.00 56.30 57.60 3k1q h ASN 139 Cb 0.33 -0.18 -0.11 0.00 -1.12 0.00 0.00 38.32 37.24 3k1q h ASN 139 CO 0.02 0.55 -0.21 1.56 -1.29 0.00 0.00 177.43 178.05 3k1q h GLN 140 N 0.90 -0.09 -0.54 0.81 4.20 -1.54 0.24 115.11 119.10 3k1q h GLN 140 Ca 0.26 0.01 0.06 0.00 0.06 0.00 0.00 58.65 59.03 3k1q h GLN 140 Cb -0.07 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 27.68 3k1q h GLN 140 CO -0.07 -0.06 0.25 -0.44 -0.67 0.00 0.00 178.83 177.84 3k1q h ASP 141 N -0.09 0.34 0.07 1.46 3.32 -1.34 -3.05 116.42 117.13 3k1q h ASP 141 Ca 0.25 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.35 3k1q h ASP 141 Cb 0.47 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.97 3k1q h ASP 141 CO -0.59 0.23 -0.40 0.58 -1.72 0.00 0.00 179.24 177.34 3k1q h VAL 142 N 0.48 0.00 -0.97 -1.35 2.07 0.10 -1.17 116.25 115.41 3k1q h VAL 142 Ca 0.25 0.00 0.31 0.00 0.82 0.00 0.00 66.70 68.08 3k1q h VAL 142 Cb 0.20 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 29.79 3k1q h VAL 142 CO -0.20 0.00 0.24 0.45 0.02 0.00 0.00 177.57 178.09 3k1q h HIS 143 N -0.55 0.33 -0.31 1.57 3.86 -0.57 -1.87 115.15 117.61 3k1q h HIS 143 Ca -0.00 0.06 0.02 0.00 -1.16 0.00 0.00 60.37 59.29 3k1q h HIS 143 Cb 0.56 0.02 -0.03 0.00 1.06 0.00 0.00 27.41 29.02 3k1q h HIS 143 CO -0.43 -0.40 0.15 0.82 0.86 0.00 0.00 177.93 178.93 3k1q h ILE 144 N 0.05 0.98 0.00 2.45 2.04 -1.12 0.34 117.51 122.25 3k1q h ILE 144 Ca 0.67 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 66.43 3k1q h ILE 144 Cb 1.54 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 3k1q h ILE 144 CO -0.82 0.06 0.00 0.80 0.00 0.00 0.00 178.15 178.19 3k1q n MET 145 N -4.97 0.00 -0.32 2.37 0.00 -0.91 -2.08 117.12 111.21 3k1q n MET 145 Ca -0.00 0.67 0.00 0.00 0.00 0.00 0.00 57.70 58.37 3k1q n MET 145 Cb 0.08 -1.31 0.07 0.00 0.00 0.00 0.00 33.22 32.06 3k1q n MET 145 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 3k1q h THR 146 N 0.00 0.08 0.00 1.12 2.02 -0.62 0.12 112.91 115.62 3k1q h THR 146 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3k1q h THR 146 Cb 0.00 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.49 3k1q h THR 146 CO 0.00 0.00 0.00 0.23 0.37 0.00 0.00 175.52 176.12 3k1q n MET 147 N -5.51 0.49 -0.10 6.66 2.81 0.11 0.36 117.12 121.93 3k1q n MET 147 Ca 0.10 0.04 -0.24 0.00 -1.81 0.00 0.00 57.70 55.79 3k1q n MET 147 Cb 0.41 -1.50 -0.11 0.00 -0.71 0.00 0.00 33.22 31.31 3k1q n MET 147 CO 0.00 0.00 0.00 1.87 1.51 0.00 0.00 175.97 179.35 3k1q n TRP 148 N -1.20 0.65 0.07 2.03 -0.00 -0.50 -1.99 117.44 116.51 3k1q n TRP 148 Ca 0.14 0.24 0.02 0.00 -0.00 0.00 0.00 57.50 57.91 3k1q n TRP 148 Cb 0.16 -1.07 0.39 0.00 -0.00 0.00 0.00 31.31 30.79 3k1q n TRP 148 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3k1q h ALA 149 N -0.54 1.55 -0.88 5.87 0.00 0.54 -3.08 119.26 122.72 3k1q h ALA 149 Ca -0.49 -0.15 0.34 0.00 0.00 0.00 0.00 54.91 54.61 3k1q h ALA 149 Cb 1.55 -0.11 -0.16 0.00 0.00 0.00 0.00 17.79 19.06 3k1q h ALA 149 CO -0.23 0.33 0.36 -0.11 0.00 0.00 0.00 179.25 179.59 3k1q n LEU 150 N -4.34 0.20 0.00 0.00 7.94 0.16 -4.71 117.00 116.24 3k1q n LEU 150 Ca 0.01 1.48 -0.26 0.00 -1.11 0.00 0.00 56.01 56.13 3k1q n LEU 150 Cb 0.20 -0.67 -0.03 0.00 0.53 0.00 0.00 43.42 43.45 3k1q n LEU 150 CO 0.37 -1.61 -0.10 -0.24 -1.11 0.00 0.00 177.39 174.71 3k1q n SER 151 N -5.07 2.91 -0.97 1.96 2.88 -1.16 -4.80 113.62 109.37 3k1q n SER 151 Ca 0.30 -2.78 0.08 0.00 -1.33 0.00 0.00 58.87 55.13 3k1q n SER 151 Cb 1.02 0.16 0.24 0.00 -0.75 0.00 0.00 64.21 64.88 3k1q n SER 151 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3k1q n ASP 152 N -1.51 3.69 -3.09 -3.46 5.75 -1.26 -5.02 116.55 111.64 3k1q n ASP 152 Ca -0.11 -2.40 -0.10 0.00 -0.01 0.00 0.00 54.79 52.18 3k1q n ASP 152 Cb 0.54 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 3k1q n ASP 152 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k1q n GLN 153 N 0.42 1.13 -1.36 0.11 3.00 -1.26 -4.93 117.38 114.49 3k1q n GLN 153 Ca 0.18 -1.29 -0.36 0.00 -0.01 0.00 0.00 57.00 55.52 3k1q n GLN 153 Cb 0.68 0.10 0.08 0.00 0.00 0.00 0.00 30.24 31.10 3k1q n GLN 153 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3k1q n GLY 154 N 2.44 -0.52 3.69 1.08 0.00 0.03 -4.93 105.19 106.98 3k1q n GLY 154 Ca 0.00 -0.33 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 3k1q n GLY 154 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3k1q n PRO 155 N -1.74 1.45 -2.91 1.61 -0.02 -1.26 -2.79 135.00 129.34 3k1q n PRO 155 Ca 0.13 0.54 -0.43 0.00 -2.02 0.00 0.00 63.50 61.71 3k1q n PRO 155 Cb 0.49 -2.39 -0.04 0.00 -0.02 0.00 0.00 33.50 31.54 3k1q n PRO 155 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3k1q s ILE 156 N -1.34 4.45 -0.17 4.25 1.09 -0.84 -4.23 121.20 124.42 3k1q s ILE 156 Ca 0.71 -0.28 -0.12 0.00 -1.10 0.00 0.00 60.65 59.86 3k1q s ILE 156 Cb -0.44 -4.59 -0.05 0.00 -1.06 0.00 0.00 42.46 36.33 3k1q s ILE 156 CO 0.50 -1.27 0.22 -0.47 -0.10 0.00 0.00 174.94 173.82 3k1q s TYR 157 N 3.74 3.46 0.04 3.97 6.14 0.56 -4.89 117.35 130.37 3k1q s TYR 157 Ca 0.22 0.50 -0.11 0.00 0.64 0.00 0.00 57.07 58.33 3k1q s TYR 157 Cb -0.17 -2.24 -0.06 0.00 0.42 0.00 0.00 41.96 39.91 3k1q s TYR 157 CO 0.12 0.30 0.37 -1.58 0.64 0.00 0.00 175.55 175.41 3k1q s HIS 158 N 0.28 3.63 0.13 4.97 5.65 -1.26 -0.51 115.29 128.18 3k1q s HIS 158 Ca 0.13 0.81 0.11 0.00 0.25 0.00 0.00 55.06 56.36 3k1q s HIS 158 Cb -0.12 -2.17 -0.04 0.00 -1.18 0.00 0.00 32.58 29.07 3k1q s HIS 158 CO 0.02 0.58 -0.25 -0.51 -0.65 0.00 0.00 174.74 173.93 3k1q s LEU 159 N -1.59 2.42 -0.16 8.88 2.01 0.13 -4.63 118.68 125.75 3k1q s LEU 159 Ca 0.29 -0.72 -0.06 0.00 0.01 0.00 0.00 54.13 53.65 3k1q s LEU 159 Cb -0.15 -1.29 0.07 0.00 0.01 0.00 0.00 46.19 44.83 3k1q s LEU 159 CO 0.16 0.17 0.34 -0.70 1.01 0.00 0.00 176.35 177.33 3k1q s GLU 160 N -2.15 0.25 -0.56 1.70 2.56 -1.26 -2.99 118.70 116.26 3k1q s GLU 160 Ca 0.16 0.85 0.03 0.00 0.00 0.00 0.00 54.97 56.00 3k1q s GLU 160 Cb -0.10 0.10 0.14 0.00 2.00 0.00 0.00 34.13 36.27 3k1q s GLU 160 CO 0.07 -0.25 0.31 0.08 -0.56 0.00 0.00 175.26 174.92 3k1q s VAL 161 N 2.28 2.83 -0.33 3.70 1.01 0.85 -4.37 120.40 126.38 3k1q s VAL 161 Ca -0.02 -3.33 -0.28 0.00 0.00 0.00 0.00 61.98 58.34 3k1q s VAL 161 Cb -0.11 -2.93 -0.02 0.00 0.00 0.00 0.00 36.38 33.32 3k1q s VAL 161 CO -0.11 -0.83 1.77 -2.16 0.00 0.00 0.00 175.10 173.77 3k1q s PRO 162 N -0.35 3.38 -0.17 2.72 0.04 -1.26 -2.21 135.00 137.14 3k1q s PRO 162 Ca 0.18 1.41 -0.15 0.00 0.04 0.00 0.00 61.00 62.49 3k1q s PRO 162 Cb -0.23 -4.18 -0.04 0.00 0.04 0.00 0.00 34.50 30.08 3k1q s PRO 162 CO -0.02 -1.81 0.33 0.08 0.04 0.00 0.00 177.00 175.63 3k1q s VAL 163 N 6.71 5.27 0.00 -0.36 1.01 0.30 -4.75 120.40 128.58 3k1q s VAL 163 Ca 0.79 0.61 0.00 0.00 0.00 0.00 0.00 61.98 63.38 3k1q s VAL 163 Cb -0.22 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.49 3k1q s VAL 163 CO 0.34 0.34 0.00 0.47 0.00 0.00 0.00 175.10 176.25 3k1q n ASP 164 N 3.88 0.00 -4.55 3.32 10.43 -1.26 -4.65 116.55 123.72 3k1q n ASP 164 Ca -0.11 0.00 -0.39 0.00 2.57 0.00 0.00 54.79 56.87 3k1q n ASP 164 Cb 0.52 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.45 3k1q n ASP 164 CO 0.00 0.00 0.00 -2.16 -1.07 0.00 0.00 177.20 173.97 3k1q s PRO 165 N 0.00 2.63 -0.19 -0.24 0.04 -1.26 -4.92 135.00 131.06 3k1q s PRO 165 Ca 0.00 0.67 0.01 0.00 0.04 0.00 0.00 61.00 61.72 3k1q s PRO 165 Cb 0.00 -4.39 0.03 0.00 0.04 0.00 0.00 34.50 30.18 3k1q s PRO 165 CO 0.00 -2.72 -0.15 1.41 0.04 0.00 0.00 177.00 175.58 3k1q s MET 166 N 7.03 2.52 0.19 4.56 1.75 -1.26 -5.06 119.30 129.03 3k1q s MET 166 Ca 0.69 -0.87 -0.30 0.00 -1.25 0.00 0.00 55.69 53.95 3k1q s MET 166 Cb -0.13 -2.51 -0.08 0.00 2.84 0.00 0.00 34.83 34.95 3k1q s MET 166 CO 0.21 -0.33 1.28 -2.14 -0.65 0.00 0.00 175.02 173.40 3k1q s PRO 167 N 1.32 4.41 0.28 4.11 0.02 -1.26 -4.92 135.00 138.96 3k1q s PRO 167 Ca 0.01 2.00 -0.01 0.00 0.02 0.00 0.00 61.00 63.02 3k1q s PRO 167 Cb -0.15 -3.21 0.40 0.00 0.02 0.00 0.00 34.50 31.56 3k1q s PRO 167 CO -0.10 -0.21 1.80 0.00 -0.33 0.00 0.00 177.00 178.16 3k1q h ALA 168 N 5.43 1.19 -0.94 -1.55 0.00 -2.01 -0.79 119.26 120.59 3k1q h ALA 168 Ca -0.44 -0.23 0.14 0.00 0.00 0.00 0.00 54.91 54.38 3k1q h ALA 168 Cb 1.21 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.73 3k1q h ALA 168 CO 0.77 0.54 0.60 0.00 0.00 0.00 0.00 179.25 181.16 3k1q h ALA 169 N 1.33 1.72 0.15 0.00 0.00 -2.00 -2.07 119.26 118.39 3k1q h ALA 169 Ca 0.15 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3k1q h ALA 169 Cb 0.37 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3k1q h ALA 169 CO 0.01 0.03 -0.07 1.15 0.00 0.00 0.00 179.25 180.36 3k1q h THR 170 N 0.80 0.94 -0.41 0.00 2.02 -1.54 -2.18 112.91 112.55 3k1q h THR 170 Ca 0.48 -0.43 0.04 0.00 0.77 0.00 0.00 66.41 67.27 3k1q h THR 170 Cb 0.66 1.21 -0.06 0.00 -1.74 0.00 0.00 68.15 68.22 3k1q h THR 170 CO -0.24 0.10 -0.39 0.74 0.37 0.00 0.00 175.52 176.10 3k1q h THR 171 N -0.41 0.00 -0.31 3.16 2.02 -1.23 -0.19 112.91 115.95 3k1q h THR 171 Ca -0.02 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.23 3k1q h THR 171 Cb 0.32 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.65 3k1q h THR 171 CO 0.03 0.00 -0.30 0.00 0.37 0.00 0.00 175.52 175.62 3k1q h ALA 172 N -0.30 -0.20 0.97 6.16 0.00 -1.31 -2.00 119.26 122.59 3k1q h ALA 172 Ca 0.07 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3k1q h ALA 172 Cb 0.36 0.64 0.01 0.00 0.00 0.00 0.00 17.79 18.80 3k1q h ALA 172 CO -0.48 -0.72 -0.47 0.00 0.00 0.00 0.00 179.25 177.58 3k1q h ALA 173 N 0.71 -1.30 -1.20 0.00 0.00 -1.32 -3.15 119.26 113.00 3k1q h ALA 173 Ca 0.15 -0.29 0.34 0.00 0.00 0.00 0.00 54.91 55.12 3k1q h ALA 173 Cb 0.52 0.50 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 3k1q h ALA 173 CO -0.47 -1.23 0.83 1.25 0.00 0.00 0.00 179.25 179.64 3k1q h LEU 174 N -1.31 0.16 -1.41 0.00 5.85 -0.69 0.10 115.31 118.01 3k1q h LEU 174 Ca -0.13 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 3k1q h LEU 174 Cb 1.00 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 3k1q h LEU 174 CO 0.22 0.01 -0.00 -0.03 -0.34 0.00 0.00 178.44 178.30 3k1q h MET 175 N 0.13 0.39 0.00 1.25 4.05 -1.33 -2.21 114.93 117.21 3k1q h MET 175 Ca 0.62 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.97 3k1q h MET 175 Cb 2.16 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 32.90 3k1q h MET 175 CO -0.14 0.42 0.00 0.00 0.23 0.00 0.00 176.91 177.42 3k1q h ALA 176 N 1.63 1.00 -0.17 0.39 0.00 -0.80 -2.58 119.26 118.73 3k1q h ALA 176 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3k1q h ALA 176 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3k1q h ALA 176 CO 0.01 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.92 3k1q n TYR 177 N -2.38 0.22 -2.10 0.00 0.53 -0.83 -4.91 117.16 107.70 3k1q n TYR 177 Ca -0.01 -0.11 -0.42 0.00 -1.02 0.00 0.00 57.90 56.34 3k1q n TYR 177 Cb 0.10 0.00 -0.03 0.00 -1.03 0.00 0.00 39.34 38.38 3k1q n TYR 177 CO 0.00 0.00 0.00 0.99 -1.02 0.00 0.00 176.86 176.83 3k1q s THR 178 N -1.78 3.13 0.00 -0.72 2.01 -0.97 -2.26 115.64 115.05 3k1q s THR 178 Ca 0.29 0.80 0.00 0.00 0.31 0.00 0.00 61.69 63.08 3k1q s THR 178 Cb 0.15 -3.51 0.00 0.00 0.01 0.00 0.00 72.50 69.15 3k1q s THR 178 CO 0.23 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.82 3k1q n GLY 179 N 3.58 1.73 3.88 4.40 0.00 -1.16 -5.09 105.19 112.53 3k1q n GLY 179 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3k1q n GLY 179 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k1q s VAL 180 N -1.83 4.98 0.40 1.61 -7.23 -0.96 -4.91 120.40 112.46 3k1q s VAL 180 Ca 0.00 0.35 -0.23 0.00 -1.81 0.00 0.00 61.98 60.29 3k1q s VAL 180 Cb 0.00 -3.63 -0.10 0.00 0.56 0.00 0.00 36.38 33.21 3k1q s VAL 180 CO 0.00 -0.09 1.00 -2.84 -0.31 0.00 0.00 175.10 172.86 3k1q s PRO 181 N -2.91 4.24 0.30 4.82 0.02 -1.26 -3.11 135.00 137.11 3k1q s PRO 181 Ca 0.46 1.36 0.16 0.00 0.02 0.00 0.00 61.00 63.01 3k1q s PRO 181 Cb -0.11 -2.48 1.09 0.00 0.02 0.00 0.00 34.50 33.02 3k1q s PRO 181 CO 0.23 -0.04 1.31 0.44 -0.33 0.00 0.00 177.00 178.61 3k1q n ILE 182 N -0.14 -0.35 -0.00 2.83 -6.64 -1.15 -1.73 119.36 112.19 3k1q n ILE 182 Ca 0.05 1.69 -0.14 0.00 -1.77 0.00 0.00 62.75 62.58 3k1q n ILE 182 Cb 0.51 -2.73 -0.08 0.00 -1.44 0.00 0.00 39.64 35.90 3k1q n ILE 182 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3k1q h ALA 183 N 1.66 -0.74 -0.17 -1.28 0.00 -1.92 -0.62 119.26 116.19 3k1q h ALA 183 Ca 0.69 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.51 3k1q h ALA 183 Cb 1.82 0.90 -0.01 0.00 0.00 0.00 0.00 17.79 20.49 3k1q h ALA 183 CO -0.65 -1.01 -0.14 1.25 0.00 0.00 0.00 179.25 178.71 3k1q h HIS 184 N -0.54 0.29 -0.86 0.00 -0.00 -1.69 0.41 115.15 112.77 3k1q h HIS 184 Ca 0.06 -0.04 0.12 0.00 -0.00 0.00 0.00 60.37 60.51 3k1q h HIS 184 Cb 0.66 -0.08 -0.06 0.00 -0.00 0.00 0.00 27.41 27.93 3k1q h HIS 184 CO -0.53 0.42 0.56 1.37 -0.00 0.00 0.00 177.93 179.74 3k1q h LEU 185 N 0.26 0.69 -0.19 0.26 -0.00 -1.36 -2.88 115.31 112.09 3k1q h LEU 185 Ca 0.05 0.03 -0.02 0.00 -0.00 0.00 0.00 57.88 57.94 3k1q h LEU 185 Cb 0.41 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 40.95 3k1q h LEU 185 CO 0.02 0.39 0.03 0.00 -0.00 0.00 0.00 178.44 178.88 3k1q h ALA 186 N 1.59 0.25 -0.23 0.17 0.00 0.60 -2.16 119.26 119.48 3k1q h ALA 186 Ca 0.41 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.21 3k1q h ALA 186 Cb 0.55 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 3k1q h ALA 186 CO -0.18 -0.08 -0.31 1.96 0.00 0.00 0.00 179.25 180.64 3k1q h GLN 187 N 0.11 -0.31 -0.07 0.00 7.50 -1.41 -0.67 115.11 120.25 3k1q h GLN 187 Ca 0.06 0.02 0.04 0.00 0.50 0.00 0.00 58.65 59.27 3k1q h GLN 187 Cb 0.31 0.07 -0.05 0.00 0.05 0.00 0.00 27.48 27.86 3k1q h GLN 187 CO 0.00 -0.21 -0.20 1.79 -1.50 0.00 0.00 178.83 178.72 3k1q h THR 188 N -0.33 0.51 -0.63 -0.54 1.35 -1.26 -1.44 112.91 110.58 3k1q h THR 188 Ca 0.13 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 66.05 3k1q h THR 188 Cb 0.53 0.51 -0.10 0.00 -1.73 0.00 0.00 68.15 67.37 3k1q h THR 188 CO -0.42 0.00 -0.56 0.00 -0.25 0.00 0.00 175.52 174.30 3k1q h ALA 189 N 0.68 -0.68 -0.81 6.62 0.00 -1.39 -0.28 119.26 123.40 3k1q h ALA 189 Ca 0.08 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.13 3k1q h ALA 189 Cb 0.39 1.22 -0.07 0.00 0.00 0.00 0.00 17.79 19.33 3k1q h ALA 189 CO -0.24 -1.00 0.45 0.10 0.00 0.00 0.00 179.25 178.56 3k1q h TYR 190 N -0.23 0.82 -0.92 0.00 -0.00 -0.77 -1.50 116.97 114.38 3k1q h TYR 190 Ca 0.11 0.03 0.03 0.00 0.00 0.00 0.00 58.73 58.89 3k1q h TYR 190 Cb 0.51 -0.25 -0.05 0.00 0.00 0.00 0.00 36.73 36.94 3k1q h TYR 190 CO -0.85 0.33 0.60 0.00 -0.00 0.00 0.00 178.16 178.24 3k1q h ARG 191 N 0.76 1.15 -0.10 0.10 3.08 -0.59 -0.17 114.38 118.61 3k1q h ARG 191 Ca 0.39 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.36 3k1q h ARG 191 Cb 0.37 -0.26 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 3k1q h ARG 191 CO -0.25 0.76 0.01 0.74 -1.07 0.00 0.00 179.97 180.16 3k1q h PHE 192 N 1.19 0.19 -0.31 3.04 0.04 -0.93 0.17 116.94 120.32 3k1q h PHE 192 Ca 0.36 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 61.07 3k1q h PHE 192 Cb -0.05 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.04 3k1q h PHE 192 CO -0.01 0.40 0.07 0.00 -0.60 0.00 0.00 178.31 178.17 3k1q h ALA 193 N 0.76 1.53 0.13 2.45 0.00 -0.53 -0.74 119.26 122.87 3k1q h ALA 193 Ca 0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3k1q h ALA 193 Cb 0.32 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3k1q h ALA 193 CO 0.00 0.35 -0.06 0.78 0.00 0.00 0.00 179.25 180.32 3k1q h GLY 194 N 0.69 -0.19 -0.09 0.00 0.00 -0.73 -3.34 103.07 99.41 3k1q h GLY 194 Ca 0.11 0.07 0.27 0.00 0.00 0.00 0.00 47.33 47.78 3k1q h GLY 194 CO -0.00 -0.07 0.68 1.46 0.00 0.00 0.00 176.54 178.61 3k1q h GLN 195 N -0.93 0.30 -4.94 4.80 4.20 -0.51 -3.35 115.11 114.69 3k1q h GLN 195 Ca -0.02 -0.02 -0.67 0.00 0.06 0.00 0.00 58.65 58.00 3k1q h GLN 195 Cb 0.50 -0.07 -0.32 0.00 0.30 0.00 0.00 27.48 27.89 3k1q h GLN 195 CO 0.03 0.20 -0.76 -1.17 -0.67 0.00 0.00 178.83 176.46 3k1q s LEU 196 N -9.36 3.00 -0.41 1.46 2.96 -0.30 -5.06 118.68 110.98 3k1q s LEU 196 Ca -0.08 -0.79 -0.41 0.00 -0.22 0.00 0.00 54.13 52.64 3k1q s LEU 196 Cb 0.24 -1.65 -0.18 0.00 0.50 0.00 0.00 46.19 45.11 3k1q s LEU 196 CO 0.80 -0.10 1.37 -2.65 -1.32 0.00 0.00 176.35 174.45 3k1q n PRO 197 N 4.67 0.00 -2.02 0.98 -0.02 -1.26 -4.50 135.00 132.85 3k1q n PRO 197 Ca -0.17 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 60.89 3k1q n PRO 197 Cb 0.48 -1.32 -0.03 0.00 -0.02 0.00 0.00 33.50 32.62 3k1q n PRO 197 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 3k1q s GLN 198 N 2.43 4.27 0.15 -0.52 0.00 -1.26 -4.98 119.66 119.74 3k1q s GLN 198 Ca 0.91 2.28 -0.21 0.00 -0.00 0.00 0.00 55.36 58.34 3k1q s GLN 198 Cb -1.30 -3.14 -0.08 0.00 0.00 0.00 0.00 33.01 28.50 3k1q s GLN 198 CO 0.70 -0.45 0.67 0.45 0.00 0.00 0.00 175.29 176.66 3k1q s SER 199 N 0.60 7.15 0.07 12.60 0.15 -1.26 -4.96 113.70 128.05 3k1q s SER 199 Ca 0.62 1.41 0.06 0.00 0.70 0.00 0.00 55.95 58.74 3k1q s SER 199 Cb -0.41 -2.41 0.32 0.00 -1.71 0.00 0.00 66.02 61.80 3k1q s SER 199 CO 0.39 0.18 1.20 -0.81 1.20 0.00 0.00 173.24 175.39 3k1q n PRO 200 N 1.34 0.03 -2.03 5.44 -0.04 -1.26 -4.62 135.00 133.86 3k1q n PRO 200 Ca -0.06 0.50 -0.33 0.00 -0.04 0.00 0.00 63.50 63.57 3k1q n PRO 200 Cb 0.50 -1.60 -0.04 0.00 -0.04 0.00 0.00 33.50 32.33 3k1q n PRO 200 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3k1q s ASP 201 N -3.23 5.17 0.36 3.54 2.15 -1.26 -4.80 116.67 118.61 3k1q s ASP 201 Ca 0.00 -0.12 0.18 0.00 0.43 0.00 0.00 52.55 53.04 3k1q s ASP 201 Cb 0.03 -2.54 0.97 0.00 -0.30 0.00 0.00 42.92 41.08 3k1q s ASP 201 CO 0.08 -2.58 1.49 0.77 -0.17 0.00 0.00 175.17 174.75 3k1q h SER 202 N 13.32 0.00 -0.08 -0.34 4.64 -2.01 -3.29 113.55 125.79 3k1q h SER 202 Ca -0.09 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.24 3k1q h SER 202 Cb 1.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.17 3k1q h SER 202 CO 1.21 0.00 -0.04 0.35 -0.87 0.00 0.00 176.83 177.48 3k1q n THR 203 N -2.21 -0.05 -0.27 2.95 -2.24 -1.26 0.25 114.28 111.45 3k1q n THR 203 Ca -0.01 1.20 0.08 0.00 -2.27 0.00 0.00 64.05 63.05 3k1q n THR 203 Cb 0.23 -1.59 0.22 0.00 -2.10 0.00 0.00 70.33 67.09 3k1q n THR 203 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 3k1q h MET 204 N 0.00 0.32 0.59 -0.78 -1.53 -1.98 -2.26 114.93 109.29 3k1q h MET 204 Ca 0.01 -0.02 -0.03 0.00 -3.44 0.00 0.00 59.70 56.22 3k1q h MET 204 Cb 0.03 -0.07 0.01 0.00 -0.55 0.00 0.00 31.60 31.01 3k1q h MET 204 CO -0.07 0.21 -0.28 0.28 0.14 0.00 0.00 176.91 177.19 3k1q h VAL 205 N 0.33 0.00 -0.94 -5.77 2.07 -1.11 -1.32 116.25 109.51 3k1q h VAL 205 Ca 0.45 -0.38 0.17 0.00 0.82 0.00 0.00 66.70 67.77 3k1q h VAL 205 Cb 0.79 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.39 3k1q h VAL 205 CO -0.50 0.00 -0.30 0.77 0.02 0.00 0.00 177.57 177.55 3k1q h SER 206 N -1.17 -1.11 -0.34 0.57 4.64 -0.13 -2.12 113.55 113.89 3k1q h SER 206 Ca -0.08 0.29 0.05 0.00 -0.47 0.00 0.00 61.79 61.58 3k1q h SER 206 Cb 0.61 0.65 -0.04 0.00 -0.31 0.00 0.00 62.40 63.31 3k1q h SER 206 CO 0.13 -0.30 0.08 0.74 -0.87 0.00 0.00 176.83 176.61 3k1q h THR 207 N -0.01 0.84 -0.73 2.95 2.02 -0.92 0.11 112.91 117.17 3k1q h THR 207 Ca 0.40 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.51 3k1q h THR 207 Cb 0.65 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 3k1q h THR 207 CO -0.96 0.04 0.47 0.40 0.37 0.00 0.00 175.52 175.84 3k1q h ILE 208 N 0.20 1.19 -0.08 3.11 2.04 -0.72 -1.44 117.51 121.80 3k1q h ILE 208 Ca 0.16 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 3k1q h ILE 208 Cb 0.17 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.38 3k1q h ILE 208 CO -0.20 0.19 0.02 0.03 0.00 0.00 0.00 178.15 178.19 3k1q h ARG 209 N 0.99 0.13 -0.01 2.37 3.08 -0.47 -1.66 114.38 118.82 3k1q h ARG 209 Ca 0.27 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.31 3k1q h ARG 209 Cb -0.10 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 3k1q h ARG 209 CO -0.06 0.33 -0.19 -1.49 -1.07 0.00 0.00 179.97 177.49 3k1q h TRP 210 N -0.08 -0.50 -0.94 3.04 -0.00 -0.66 -2.95 115.95 113.85 3k1q h TRP 210 Ca 0.03 0.02 0.26 0.00 -0.00 0.00 0.00 58.89 59.20 3k1q h TRP 210 Cb 0.26 0.22 -0.17 0.00 -0.00 0.00 0.00 29.16 29.47 3k1q h TRP 210 CO 0.01 -0.27 0.12 -0.07 -0.00 0.00 0.00 178.44 178.22 3k1q h LEU 211 N -0.30 -0.28 -0.11 -4.49 3.38 -0.82 -1.15 115.31 111.53 3k1q h LEU 211 Ca 0.06 0.25 0.01 0.00 0.09 0.00 0.00 57.88 58.29 3k1q h LEU 211 Cb 0.38 0.40 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 3k1q h LEU 211 CO -0.19 -0.30 0.03 -1.28 0.09 0.00 0.00 178.44 176.79 3k1q h SER 212 N 0.07 0.02 0.32 -0.43 0.87 -1.28 0.29 113.55 113.41 3k1q h SER 212 Ca 0.59 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 61.16 3k1q h SER 212 Cb 1.24 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 63.20 3k1q h SER 212 CO -0.82 0.03 -0.26 0.00 -0.53 0.00 0.00 176.83 175.25 3k1q h ALA 213 N 1.08 -0.59 -1.01 6.23 0.00 -1.17 -0.22 119.26 123.58 3k1q h ALA 213 Ca 0.05 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.95 3k1q h ALA 213 Cb 0.04 0.36 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 3k1q h ALA 213 CO -0.06 -0.85 0.64 0.82 0.00 0.00 0.00 179.25 179.80 3k1q h ILE 214 N -0.59 1.02 0.55 0.00 2.04 -0.91 0.79 117.51 120.40 3k1q h ILE 214 Ca -0.02 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.43 3k1q h ILE 214 Cb 0.52 -0.18 0.01 0.00 -0.74 0.00 0.00 36.82 36.43 3k1q h ILE 214 CO -0.02 0.20 -0.26 -0.25 0.00 0.00 0.00 178.15 177.82 3k1q h TRP 215 N 1.11 -0.69 -0.66 1.37 7.01 -0.45 -0.39 115.95 123.25 3k1q h TRP 215 Ca 0.46 -0.02 0.12 0.00 2.11 0.00 0.00 58.89 61.56 3k1q h TRP 215 Cb 0.29 0.23 -0.08 0.00 -2.10 0.00 0.00 29.16 27.50 3k1q h TRP 215 CO -0.00 -0.37 0.23 0.35 -2.79 0.00 0.00 178.44 175.86 3k1q h PHE 216 N -0.90 0.39 -0.92 2.65 3.57 0.07 0.22 116.94 122.02 3k1q h PHE 216 Ca -0.08 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 3k1q h PHE 216 Cb 0.62 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.24 3k1q h PHE 216 CO -0.01 0.06 0.58 0.78 -2.23 0.00 0.00 178.31 177.49 3k1q h GLY 217 N 0.39 1.32 0.77 2.40 0.00 0.61 -1.94 103.07 106.62 3k1q h GLY 217 Ca 0.35 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 3k1q h GLY 217 CO -0.36 0.52 -0.27 1.76 0.00 0.00 0.00 176.54 178.18 3k1q h SER 218 N 1.26 -0.71 -0.34 0.19 0.02 -0.29 -1.62 113.55 112.07 3k1q h SER 218 Ca 0.33 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 3k1q h SER 218 Cb -0.09 0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 3k1q h SER 218 CO -0.07 -0.41 0.22 0.25 -1.14 0.00 0.00 176.83 175.68 3k1q h LEU 219 N -0.62 0.40 -0.34 5.07 5.85 -0.35 -1.63 115.31 123.70 3k1q h LEU 219 Ca -0.02 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 3k1q h LEU 219 Cb 0.54 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 3k1q h LEU 219 CO -0.02 0.30 0.02 0.71 -0.34 0.00 0.00 178.44 179.11 3k1q h THR 220 N 0.47 1.25 0.00 1.05 1.35 -1.38 -3.45 112.91 112.20 3k1q h THR 220 Ca 0.12 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 3k1q h THR 220 Cb -0.03 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 67.58 3k1q h THR 220 CO -0.03 0.31 0.00 0.61 -0.25 0.00 0.00 175.52 176.16 3k1q n GLY 221 N -0.38 0.93 0.35 5.82 0.00 -0.61 -3.15 105.19 108.15 3k1q n GLY 221 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.04 3k1q n GLY 221 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3k1q h ARG 222 N 0.00 0.88 -5.41 1.61 9.65 -1.54 -3.41 114.38 116.15 3k1q h ARG 222 Ca 0.00 -0.05 -0.64 0.00 -1.10 0.00 0.00 59.98 58.19 3k1q h ARG 222 Cb 0.00 -0.20 -0.19 0.00 -1.39 0.00 0.00 29.97 28.19 3k1q h ARG 222 CO 0.00 0.58 -0.64 -0.51 2.80 0.00 0.00 179.97 182.20 3k1q s LEU 223 N -9.83 3.40 0.00 3.80 1.43 -0.82 -4.83 118.68 111.84 3k1q s LEU 223 Ca -0.11 -0.05 -0.19 0.00 -1.03 0.00 0.00 54.13 52.76 3k1q s LEU 223 Cb 0.19 -1.82 0.07 0.00 0.03 0.00 0.00 46.19 44.66 3k1q s LEU 223 CO 0.78 0.21 0.91 -0.46 0.23 0.00 0.00 176.35 178.02 3k1q n ASN 224 N 3.30 -1.73 -0.39 2.29 0.23 -0.61 -4.06 115.26 114.28 3k1q n ASN 224 Ca -0.17 -1.99 0.32 0.00 -0.53 0.00 0.00 54.58 52.21 3k1q n ASN 224 Cb 0.53 2.84 0.59 0.00 -2.08 0.00 0.00 39.78 41.65 3k1q n ASN 224 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 3k1q h ARG 225 N 0.00 0.18 0.00 -3.83 -0.00 -1.94 -2.74 114.38 106.04 3k1q h ARG 225 Ca -0.27 -0.01 -0.25 0.00 -0.00 0.00 0.00 59.98 59.45 3k1q h ARG 225 Cb 1.13 -0.04 -0.05 0.00 -0.00 0.00 0.00 29.97 31.01 3k1q h ARG 225 CO 0.35 0.12 -2.22 0.43 -0.00 0.00 0.00 179.97 178.65 3k1q n SER 226 N -4.77 0.05 -4.14 0.08 7.64 -1.26 -4.24 113.62 106.98 3k1q n SER 226 Ca 0.34 0.02 -0.38 0.00 1.01 0.00 0.00 58.87 59.86 3k1q n SER 226 Cb 1.24 1.25 -0.10 0.00 -1.01 0.00 0.00 64.21 65.59 3k1q n SER 226 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3k1q s ARG 227 N -2.82 2.32 0.28 1.43 0.52 -1.03 -1.65 118.95 117.99 3k1q s ARG 227 Ca -0.09 -2.03 0.09 0.00 -0.52 0.00 0.00 55.73 53.18 3k1q s ARG 227 Cb 0.09 -3.73 -0.04 0.00 0.52 0.00 0.00 34.95 31.78 3k1q s ARG 227 CO 0.85 -1.14 0.03 0.95 0.02 0.00 0.00 175.30 176.02 3k1q s THR 228 N 0.81 3.47 -1.30 0.02 -4.23 -0.47 -1.57 115.64 112.37 3k1q s THR 228 Ca 0.10 -1.84 -0.16 0.00 -1.18 0.00 0.00 61.69 58.61 3k1q s THR 228 Cb -0.22 -2.92 0.09 0.00 1.34 0.00 0.00 72.50 70.79 3k1q s THR 228 CO -0.03 -0.34 1.74 0.00 -0.54 0.00 0.00 174.62 175.44 3k1q n ASN 230 N 7.40 0.00 0.00 0.00 3.02 -1.26 -0.88 115.26 123.54 3k1q n ASN 230 Ca 0.47 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 55.02 3k1q n ASN 230 Cb 0.44 -1.29 0.00 0.00 -0.61 0.00 0.00 39.78 38.32 3k1q n ASN 230 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k1q n GLY 231 N -2.00 1.26 3.66 7.41 0.00 -1.25 -4.77 105.19 109.50 3k1q n GLY 231 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3k1q n GLY 231 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k1q s PHE 232 N 0.00 3.26 0.35 1.61 2.99 -0.06 -0.53 117.98 125.61 3k1q s PHE 232 Ca 0.00 1.39 -0.04 0.00 0.00 0.00 0.00 56.93 58.28 3k1q s PHE 232 Cb 0.00 -3.31 0.01 0.00 0.00 0.00 0.00 43.02 39.72 3k1q s PHE 232 CO 0.00 -0.68 0.52 1.52 -0.00 0.00 0.00 175.22 176.58 3k1q s TYR 233 N 3.25 0.96 -0.16 0.36 -0.85 0.29 -0.99 117.35 120.21 3k1q s TYR 233 Ca 0.46 -1.24 -0.02 0.00 -0.52 0.00 0.00 57.07 55.75 3k1q s TYR 233 Cb -0.16 0.03 -0.01 0.00 0.38 0.00 0.00 41.96 42.20 3k1q s TYR 233 CO 0.07 -1.20 -0.09 -0.06 -1.52 0.00 0.00 175.55 172.75 3k1q s PHE 234 N -2.92 2.89 -0.23 -3.49 0.40 -1.26 -0.95 117.98 112.41 3k1q s PHE 234 Ca 0.29 -0.72 -0.14 0.00 -0.60 0.00 0.00 56.93 55.76 3k1q s PHE 234 Cb -0.01 -1.95 -0.04 0.00 0.51 0.00 0.00 43.02 41.53 3k1q s PHE 234 CO 0.19 -0.31 0.30 -2.00 0.70 0.00 0.00 175.22 174.11 3k1q s GLU 235 N 0.74 4.09 -1.27 0.44 2.12 0.18 -4.85 118.70 120.15 3k1q s GLU 235 Ca -0.04 -0.02 -0.13 0.00 0.36 0.00 0.00 54.97 55.14 3k1q s GLU 235 Cb -0.15 -3.57 0.15 0.00 0.26 0.00 0.00 34.13 30.81 3k1q s GLU 235 CO 0.02 -0.07 1.68 1.19 -0.54 0.00 0.00 175.26 177.53 3k1q n PHE 236 N 4.66 4.18 -2.20 5.30 3.01 -1.26 -1.74 117.46 129.40 3k1q n PHE 236 Ca -0.11 -3.08 -0.42 0.00 1.01 0.00 0.00 57.45 54.85 3k1q n PHE 236 Cb 0.51 -2.20 -0.03 0.00 -0.01 0.00 0.00 39.48 37.75 3k1q n PHE 236 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3k1q s ALA 237 N 1.68 3.61 0.00 4.37 0.00 -0.71 -4.45 121.76 126.26 3k1q s ALA 237 Ca 0.44 0.82 0.00 0.00 0.00 0.00 0.00 51.96 53.22 3k1q s ALA 237 Cb 0.03 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.52 3k1q s ALA 237 CO 0.01 -1.08 0.00 1.17 0.00 0.00 0.00 175.76 175.85 3k1q n LYS 238 N 6.03 0.00 0.00 0.00 0.00 -1.26 -0.11 118.16 122.82 3k1q n LYS 238 Ca 0.14 0.04 0.00 0.00 0.00 0.00 0.00 58.31 58.49 3k1q n LYS 238 Cb 0.44 -0.10 0.00 0.00 0.00 0.00 0.00 35.03 35.37 3k1q n LYS 238 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 3k1q n PRO 239 N -0.02 0.33 0.00 1.64 -0.04 -1.26 -4.44 135.00 131.21 3k1q n PRO 239 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3k1q n PRO 239 Cb 0.00 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 3k1q n PRO 239 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3k1q n ALA 240 N 0.13 0.00 -1.69 0.55 0.00 -1.26 -4.49 120.51 113.74 3k1q n ALA 240 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 3k1q n ALA 240 Cb 0.06 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.53 3k1q n ALA 240 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3k1q n LEU 241 N 0.00 4.13 -0.09 0.00 7.94 -1.26 -4.74 117.00 122.97 3k1q n LEU 241 Ca 0.00 1.06 0.15 0.00 -1.11 0.00 0.00 56.01 56.10 3k1q n LEU 241 Cb 0.00 -1.49 0.22 0.00 0.53 0.00 0.00 43.42 42.68 3k1q n LEU 241 CO 0.00 -0.81 0.70 -3.20 -1.11 0.00 0.00 177.39 172.98 3k1q n ASN 242 N -0.05 0.00 -4.56 1.96 2.85 -1.26 -4.29 115.26 109.91 3k1q n ASN 242 Ca 0.08 0.42 -0.23 0.00 -0.11 0.00 0.00 54.58 54.74 3k1q n ASN 242 Cb 0.41 -0.13 -0.06 0.00 1.24 0.00 0.00 39.78 41.23 3k1q n ASN 242 CO 0.00 0.00 0.00 -2.84 -2.11 0.00 0.00 177.26 172.31 3k1q s PRO 243 N -3.34 2.21 -0.68 1.20 0.02 -1.26 -4.84 135.00 128.31 3k1q s PRO 243 Ca -0.01 -0.25 0.01 0.00 0.02 0.00 0.00 61.00 60.77 3k1q s PRO 243 Cb 0.07 -5.02 0.17 0.00 0.02 0.00 0.00 34.50 29.74 3k1q s PRO 243 CO 0.24 -3.89 0.49 -0.51 -0.33 0.00 0.00 177.00 173.00 3k1q s ASP 244 N 8.52 5.09 -0.14 2.53 1.11 -1.25 -4.50 116.67 128.04 3k1q s ASP 244 Ca 0.76 -3.32 -0.29 0.00 0.18 0.00 0.00 52.55 49.88 3k1q s ASP 244 Cb -0.07 -1.77 -0.03 0.00 1.07 0.00 0.00 42.92 42.12 3k1q s ASP 244 CO 0.05 -0.23 1.43 -1.10 1.18 0.00 0.00 175.17 176.50 3k1q s GLN 245 N -0.73 4.16 -0.65 8.23 -1.52 0.84 -4.39 119.66 125.60 3k1q s GLN 245 Ca 0.21 1.83 -0.27 0.00 -1.95 0.00 0.00 55.36 55.18 3k1q s GLN 245 Cb -0.15 -3.87 0.02 0.00 -0.22 0.00 0.00 33.01 28.78 3k1q s GLN 245 CO -0.08 -0.83 1.38 0.00 -0.25 0.00 0.00 175.29 175.52 3k1q s ALA 246 N 3.88 2.73 -0.16 6.09 0.00 -1.25 -1.73 121.76 131.32 3k1q s ALA 246 Ca 0.63 -1.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.50 3k1q s ALA 246 Cb -0.26 -4.19 -0.04 0.00 0.00 0.00 0.00 23.12 18.63 3k1q s ALA 246 CO 0.22 -3.18 0.12 0.08 0.00 0.00 0.00 175.76 172.99 3k1q s VAL 247 N 6.14 5.29 -0.46 0.00 1.01 -0.71 -2.92 120.40 128.75 3k1q s VAL 247 Ca 0.45 0.14 -0.44 0.00 0.00 0.00 0.00 61.98 62.13 3k1q s VAL 247 Cb -0.09 -3.36 -0.18 0.00 0.00 0.00 0.00 36.38 32.75 3k1q s VAL 247 CO 0.20 0.52 1.91 -0.11 0.00 0.00 0.00 175.10 177.62 3k1q n LEU 248 N 2.88 1.27 -4.03 3.92 7.94 -1.18 0.48 117.00 128.28 3k1q n LEU 248 Ca -0.18 0.88 -0.24 0.00 -1.11 0.00 0.00 56.01 55.36 3k1q n LEU 248 Cb 0.53 -0.96 -0.16 0.00 0.53 0.00 0.00 43.42 43.36 3k1q n LEU 248 CO 0.34 -0.74 -0.47 -0.54 -1.11 0.00 0.00 177.39 174.87 3k1q s LYS 249 N 4.69 1.65 -0.59 1.96 -0.14 -0.12 -2.99 119.74 124.20 3k1q s LYS 249 Ca 1.11 -0.42 -0.14 0.00 -1.36 0.00 0.00 55.97 55.17 3k1q s LYS 249 Cb -1.38 -1.38 0.15 0.00 -1.68 0.00 0.00 37.83 33.54 3k1q s LYS 249 CO 0.70 0.05 0.52 -0.46 -0.76 0.00 0.00 175.35 175.39 3k1q s TRP 250 N 0.59 3.40 -0.08 3.18 -0.11 -1.25 -0.55 118.94 124.13 3k1q s TRP 250 Ca -0.13 -1.62 0.02 0.00 1.22 0.00 0.00 56.10 55.59 3k1q s TRP 250 Cb -0.15 -3.72 0.01 0.00 -1.50 0.00 0.00 33.47 28.12 3k1q s TRP 250 CO 0.03 -1.00 -0.14 -0.80 -4.62 0.00 0.00 176.95 170.42 3k1q s ASN 251 N 2.98 2.09 -0.61 5.86 0.02 0.31 -4.99 114.94 120.61 3k1q s ASN 251 Ca 0.07 -0.36 -0.27 0.00 -1.02 0.00 0.00 52.86 51.29 3k1q s ASN 251 Cb -0.25 -0.96 -0.01 0.00 0.02 0.00 0.00 41.25 40.06 3k1q s ASN 251 CO -0.01 0.04 1.70 -1.81 0.02 0.00 0.00 177.10 177.05 3k1q s ASP 252 N 0.70 5.57 0.00 -1.22 1.01 -1.26 -3.96 116.67 117.51 3k1q s ASP 252 Ca -0.13 0.27 0.00 0.00 0.71 0.00 0.00 52.55 53.39 3k1q s ASP 252 Cb -0.16 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.23 3k1q s ASP 252 CO 0.03 -2.16 0.00 0.61 0.21 0.00 0.00 175.17 173.87 3k1q n GLY 253 N 5.57 0.32 3.30 0.21 0.00 -1.26 -5.06 105.19 108.27 3k1q n GLY 253 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 3k1q n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k1q s ALA 254 N -2.21 1.82 -0.51 4.61 0.00 -0.66 -5.03 121.76 119.78 3k1q s ALA 254 Ca 0.00 -1.36 -0.23 0.00 0.00 0.00 0.00 51.96 50.37 3k1q s ALA 254 Cb 0.00 -0.18 0.04 0.00 0.00 0.00 0.00 23.12 22.98 3k1q s ALA 254 CO 0.00 0.25 0.84 1.03 0.00 0.00 0.00 175.76 177.87 3k1q s ARG 255 N -2.46 3.33 0.48 0.00 3.00 -1.26 -1.37 118.95 120.66 3k1q s ARG 255 Ca 0.11 -0.30 -0.24 0.00 0.00 0.00 0.00 55.73 55.30 3k1q s ARG 255 Cb -0.07 -4.02 -0.07 0.00 0.00 0.00 0.00 34.95 30.79 3k1q s ARG 255 CO 0.05 -1.31 1.37 0.00 0.00 0.00 0.00 175.30 175.41 3k1q s ALA 256 N 3.51 3.09 -0.65 2.13 0.00 0.68 -4.87 121.76 125.64 3k1q s ALA 256 Ca 0.28 1.36 -0.35 0.00 0.00 0.00 0.00 51.96 53.25 3k1q s ALA 256 Cb -0.13 -3.56 -0.17 0.00 0.00 0.00 0.00 23.12 19.26 3k1q s ALA 256 CO 0.19 -1.18 2.39 0.00 0.00 0.00 0.00 175.76 177.16 3k1q n ALA 257 N -0.45 0.49 -1.53 0.00 0.00 -1.26 -4.91 120.51 112.85 3k1q n ALA 257 Ca 0.07 -0.15 -0.53 0.00 0.00 0.00 0.00 53.44 52.83 3k1q n ALA 257 Cb 0.43 -2.37 -0.07 0.00 0.00 0.00 0.00 19.45 17.45 3k1q n ALA 257 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3k1q n PRO 258 N 8.17 1.16 -0.50 0.00 -0.02 -1.26 -4.50 135.00 138.05 3k1q n PRO 258 Ca 0.54 0.37 -0.29 0.00 -2.02 0.00 0.00 63.50 62.10 3k1q n PRO 258 Cb 0.10 -2.34 0.25 0.00 -0.02 0.00 0.00 33.50 31.49 3k1q n PRO 258 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3k1q n PRO 259 N 7.28 -2.28 -2.36 0.52 -0.02 -0.91 -4.92 135.00 132.31 3k1q n PRO 259 Ca 0.36 -0.63 -0.36 0.00 -2.02 0.00 0.00 63.50 60.85 3k1q n PRO 259 Cb 0.20 -2.16 -0.04 0.00 -0.02 0.00 0.00 33.50 31.48 3k1q n PRO 259 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k1q s ALA 260 N -2.41 2.33 0.00 3.55 0.00 -1.24 -4.79 121.76 119.21 3k1q s ALA 260 Ca 0.68 -2.02 0.00 0.00 0.00 0.00 0.00 51.96 50.62 3k1q s ALA 260 Cb -0.25 -4.55 0.00 0.00 0.00 0.00 0.00 23.12 18.32 3k1q s ALA 260 CO 0.65 -4.09 0.00 0.00 0.00 0.00 0.00 175.76 172.32 3k1q n ALA 261 N 10.88 0.00 -3.61 0.00 0.00 -1.26 -4.50 120.51 122.02 3k1q n ALA 261 Ca 0.37 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.54 3k1q n ALA 261 Cb 0.49 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.77 3k1q n ALA 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k1q s ALA 262 N -0.46 0.48 -0.20 0.00 0.00 -1.26 0.11 121.76 120.42 3k1q s ALA 262 Ca 0.00 -0.44 -0.05 0.00 0.00 0.00 0.00 51.96 51.48 3k1q s ALA 262 Cb 0.00 -1.09 -0.02 0.00 0.00 0.00 0.00 23.12 22.01 3k1q s ALA 262 CO 0.00 -1.24 -0.02 -0.65 0.00 0.00 0.00 175.76 173.85 3k1q s GLN 263 N 2.12 3.54 -0.07 0.00 -1.52 -0.94 -4.99 119.66 117.80 3k1q s GLN 263 Ca 0.03 -0.56 0.01 0.00 -1.95 0.00 0.00 55.36 52.89 3k1q s GLN 263 Cb -0.16 -3.04 0.02 0.00 -0.22 0.00 0.00 33.01 29.60 3k1q s GLN 263 CO -0.13 -0.04 -0.08 0.45 -0.25 0.00 0.00 175.29 175.24 3k1q s SER 264 N 1.12 1.60 0.17 5.90 0.15 -1.26 -0.10 113.70 121.28 3k1q s SER 264 Ca 0.02 -0.23 0.04 0.00 0.70 0.00 0.00 55.95 56.48 3k1q s SER 264 Cb -0.14 -0.68 -0.05 0.00 -1.71 0.00 0.00 66.02 63.44 3k1q s SER 264 CO 0.01 -0.05 -0.06 -0.94 1.20 0.00 0.00 173.24 173.40 3k1q s SER 265 N 1.09 1.75 -0.04 5.45 1.04 -1.16 -5.00 113.70 116.83 3k1q s SER 265 Ca -0.07 -1.09 0.02 0.00 0.48 0.00 0.00 55.95 55.29 3k1q s SER 265 Cb -0.14 0.01 0.01 0.00 0.10 0.00 0.00 66.02 65.99 3k1q s SER 265 CO -0.01 -0.41 -0.10 -0.31 0.98 0.00 0.00 173.24 173.40 3k1q s TYR 266 N -3.39 1.08 -0.13 5.02 1.51 -1.26 0.22 117.35 120.41 3k1q s TYR 266 Ca 0.21 -0.31 -0.05 0.00 -1.01 0.00 0.00 57.07 55.91 3k1q s TYR 266 Cb 0.04 -0.80 -0.04 0.00 -0.11 0.00 0.00 41.96 41.05 3k1q s TYR 266 CO 0.03 -0.16 0.05 0.96 -1.11 0.00 0.00 175.55 175.32 3k1q s ILE 267 N 0.41 4.70 0.15 2.71 -4.36 0.33 -0.54 121.20 124.61 3k1q s ILE 267 Ca -0.07 -0.09 0.09 0.00 -0.26 0.00 0.00 60.65 60.32 3k1q s ILE 267 Cb -0.11 -3.04 -0.04 0.00 1.25 0.00 0.00 42.46 40.51 3k1q s ILE 267 CO 0.01 0.56 -0.20 0.00 0.24 0.00 0.00 174.94 175.55 3k1q s ARG 268 N -0.48 1.27 -0.39 0.37 1.70 0.19 -0.32 118.95 121.29 3k1q s ARG 268 Ca 0.10 -1.36 -0.14 0.00 -0.47 0.00 0.00 55.73 53.85 3k1q s ARG 268 Cb -0.12 -1.43 0.01 0.00 -0.57 0.00 0.00 34.95 32.84 3k1q s ARG 268 CO 0.02 0.30 0.28 0.00 -1.08 0.00 0.00 175.30 174.83 3k1q h ILE 270 N 5.61 0.18 -3.56 0.00 -0.00 -1.46 0.13 117.51 118.41 3k1q h ILE 270 Ca -0.28 -0.81 -0.61 0.00 -0.00 0.00 0.00 64.86 63.16 3k1q h ILE 270 Cb 1.13 1.69 -0.13 0.00 -0.00 0.00 0.00 36.82 39.51 3k1q h ILE 270 CO 0.70 0.08 -0.30 -0.55 -0.00 0.00 0.00 178.15 178.08 3k1q s SER 271 N -5.94 6.31 0.58 2.16 0.15 -1.26 -4.68 113.70 111.02 3k1q s SER 271 Ca 0.02 0.36 0.30 0.00 0.70 0.00 0.00 55.95 57.33 3k1q s SER 271 Cb 0.09 -2.19 1.39 0.00 -1.71 0.00 0.00 66.02 63.60 3k1q s SER 271 CO 0.60 -0.06 1.76 -0.65 1.20 0.00 0.00 173.24 176.09 3k1q h PRO 272 N 7.57 0.00 -0.07 5.44 0.11 -1.85 -2.59 132.00 140.60 3k1q h PRO 272 Ca -0.36 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.77 3k1q h PRO 272 Cb 1.16 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3k1q h PRO 272 CO 0.68 0.00 0.91 0.45 -0.21 0.00 0.00 178.00 179.84 3k1q h HIS 273 N 0.00 0.00 -0.97 0.65 3.86 -1.94 -2.49 115.15 114.26 3k1q h HIS 273 Ca 0.36 0.00 0.27 0.00 -1.16 0.00 0.00 60.37 59.83 3k1q h HIS 273 Cb 1.79 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 30.13 3k1q h HIS 273 CO 0.00 0.00 0.51 0.11 0.86 0.00 0.00 177.93 179.41 3k1q h TRP 274 N 0.00 0.84 -0.49 2.45 5.08 -1.82 -2.29 115.95 119.72 3k1q h TRP 274 Ca 0.03 0.04 0.17 0.00 1.08 0.00 0.00 58.89 60.21 3k1q h TRP 274 Cb 1.86 -0.22 -0.09 0.00 -3.00 0.00 0.00 29.16 27.71 3k1q h TRP 274 CO 0.00 -0.08 0.13 1.04 -1.28 0.00 0.00 178.44 178.26 3k1q n GLN 275 N -5.02 -0.03 -0.45 0.12 6.02 -0.94 -0.69 117.38 116.40 3k1q n GLN 275 Ca 0.27 0.70 0.09 0.00 -0.01 0.00 0.00 57.00 58.05 3k1q n GLN 275 Cb 0.81 -1.18 0.29 0.00 1.02 0.00 0.00 30.24 31.17 3k1q n GLN 275 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3k1q n HIS 276 N -4.33 1.08 -3.74 1.08 8.25 -0.86 -3.66 115.22 113.03 3k1q n HIS 276 Ca 0.15 -0.60 -0.34 0.00 -0.26 0.00 0.00 57.72 56.67 3k1q n HIS 276 Cb 0.50 -0.16 -0.09 0.00 1.12 0.00 0.00 29.99 31.36 3k1q n HIS 276 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3k1q s GLN 277 N -1.64 2.83 0.55 -0.41 -1.52 0.14 -4.93 119.66 114.68 3k1q s GLN 277 Ca 0.43 -3.08 0.27 0.00 -1.95 0.00 0.00 55.36 51.02 3k1q s GLN 277 Cb 0.27 -3.74 1.46 0.00 -0.22 0.00 0.00 33.01 30.78 3k1q s GLN 277 CO 0.22 -1.24 2.00 -0.84 -0.25 0.00 0.00 175.29 175.17 3k1q h ILE 278 N 4.52 0.62 0.44 1.08 3.07 -1.90 -1.83 117.51 123.51 3k1q h ILE 278 Ca 0.10 0.00 -0.01 0.00 1.55 0.00 0.00 64.86 66.50 3k1q h ILE 278 Cb 0.84 0.73 -0.02 0.00 -0.27 0.00 0.00 36.82 38.09 3k1q h ILE 278 CO 0.78 0.00 -0.45 -0.37 -1.05 0.00 0.00 178.15 177.06 3k1q h VAL 279 N 0.00 0.11 -0.10 0.16 -1.51 -1.94 0.11 116.25 113.09 3k1q h VAL 279 Ca 0.22 0.00 0.04 0.00 -1.23 0.00 0.00 66.70 65.72 3k1q h VAL 279 Cb 0.95 0.11 -0.04 0.00 -2.13 0.00 0.00 31.29 30.18 3k1q h VAL 279 CO -0.00 0.00 -0.14 -0.33 -1.23 0.00 0.00 177.57 175.87 3k1q h GLU 280 N -0.91 -0.18 -0.65 5.19 5.08 -1.70 -2.33 114.58 119.08 3k1q h GLU 280 Ca -0.05 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 3k1q h GLU 280 Cb 0.80 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.05 3k1q h GLU 280 CO -0.07 -0.12 0.41 0.28 -1.00 0.00 0.00 179.01 178.51 3k1q h VAL 281 N -0.19 1.09 -0.44 3.13 2.07 -1.19 -2.79 116.25 117.95 3k1q h VAL 281 Ca 0.08 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 3k1q h VAL 281 Cb 0.30 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 3k1q h VAL 281 CO -0.21 0.15 0.13 0.00 0.02 0.00 0.00 177.57 177.66 3k1q h ALA 282 N 1.28 1.42 -0.32 1.67 0.00 -0.39 -1.42 119.26 121.50 3k1q h ALA 282 Ca 0.26 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3k1q h ALA 282 Cb 0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3k1q h ALA 282 CO -0.10 0.43 0.16 0.78 0.00 0.00 0.00 179.25 180.52 3k1q h GLY 283 N 0.82 0.43 0.57 0.00 0.00 -1.17 -1.16 103.07 102.56 3k1q h GLY 283 Ca 0.15 -0.11 0.10 0.00 0.00 0.00 0.00 47.33 47.47 3k1q h GLY 283 CO -0.01 0.08 0.64 0.00 0.00 0.00 0.00 176.54 177.25 3k1q h ALA 284 N 1.17 1.46 -0.19 3.60 0.00 -1.17 -0.58 119.26 123.55 3k1q h ALA 284 Ca 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 3k1q h ALA 284 Cb 0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3k1q h ALA 284 CO -0.10 0.31 -0.16 1.25 0.00 0.00 0.00 179.25 180.55 3k1q h LEU 285 N 1.06 0.31 -0.40 0.00 5.85 -0.96 -2.09 115.31 119.07 3k1q h LEU 285 Ca 0.47 -0.08 0.02 0.00 0.84 0.00 0.00 57.88 59.14 3k1q h LEU 285 Cb 0.37 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3k1q h LEU 285 CO -0.23 0.50 0.22 0.24 -0.34 0.00 0.00 178.44 178.83 3k1q h MET 286 N 0.30 0.43 0.00 1.25 2.86 -0.44 -2.75 114.93 116.58 3k1q h MET 286 Ca 0.06 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.60 3k1q h MET 286 Cb 0.46 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 3k1q h MET 286 CO 0.03 0.28 -0.32 0.66 1.06 0.00 0.00 176.91 178.62 3k1q h SER 287 N 0.44 0.00 -0.30 1.22 4.64 -0.73 -1.65 113.55 117.18 3k1q h SER 287 Ca 0.17 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.48 3k1q h SER 287 Cb 0.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 3k1q h SER 287 CO -0.10 0.32 0.14 1.56 -0.87 0.00 0.00 176.83 177.89 3k1q h GLN 288 N 0.00 0.43 -0.46 4.77 1.08 -1.09 -2.33 115.11 117.50 3k1q h GLN 288 Ca -0.00 -0.06 0.06 0.00 -1.45 0.00 0.00 58.65 57.19 3k1q h GLN 288 Cb 0.73 -0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 28.03 3k1q h GLN 288 CO 0.04 0.40 0.18 0.66 -0.95 0.00 0.00 178.83 179.17 3k1q h SER 289 N 0.35 0.21 -0.94 1.46 4.64 -1.18 -2.72 113.55 115.37 3k1q h SER 289 Ca 0.10 0.05 0.25 0.00 -0.47 0.00 0.00 61.79 61.72 3k1q h SER 289 Cb 0.12 0.02 -0.17 0.00 -0.31 0.00 0.00 62.40 62.06 3k1q h SER 289 CO -0.01 0.15 0.04 0.58 -0.87 0.00 0.00 176.83 176.72 3k1q h VAL 290 N 0.37 0.10 -0.95 0.95 2.07 -1.21 -2.20 116.25 115.38 3k1q h VAL 290 Ca 0.22 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.75 3k1q h VAL 290 Cb 0.20 0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 29.97 3k1q h VAL 290 CO -0.20 0.01 0.62 0.74 0.02 0.00 0.00 177.57 178.76 3k1q h THR 291 N 0.04 1.19 -0.71 2.57 2.02 -1.10 -2.43 112.91 114.49 3k1q h THR 291 Ca 0.56 -0.42 0.06 0.00 0.77 0.00 0.00 66.41 67.38 3k1q h THR 291 Cb 1.12 -0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 67.34 3k1q h THR 291 CO -0.86 0.22 0.47 0.00 0.37 0.00 0.00 175.52 175.73 3k1q h ALA 292 N 1.37 1.69 0.07 6.16 0.00 -1.35 -1.61 119.26 125.59 3k1q h ALA 292 Ca 0.37 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.99 3k1q h ALA 292 Cb -0.06 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.54 3k1q h ALA 292 CO -0.10 0.21 -1.12 0.28 0.00 0.00 0.00 179.25 178.52 3k1q h VAL 293 N 0.77 1.40 -4.17 0.00 2.07 -1.51 -3.47 116.25 111.34 3k1q h VAL 293 Ca 0.30 -2.64 -0.51 0.00 0.82 0.00 0.00 66.70 64.68 3k1q h VAL 293 Cb 0.22 2.65 -0.27 0.00 -1.52 0.00 0.00 31.29 32.37 3k1q h VAL 293 CO -0.10 0.79 -0.82 0.28 0.02 0.00 0.00 177.57 177.74 3k1q s THR 294 N -3.00 1.29 -1.12 2.57 -1.32 -0.60 -4.72 115.64 108.73 3k1q s THR 294 Ca -0.06 -0.88 -0.10 0.00 -1.21 0.00 0.00 61.69 59.44 3k1q s THR 294 Cb 0.07 -1.11 0.26 0.00 -1.51 0.00 0.00 72.50 70.22 3k1q s THR 294 CO 0.89 0.22 1.15 -0.83 -2.21 0.00 0.00 174.62 173.84 3k1q s GLY 295 N -0.77 3.11 0.45 6.08 0.00 -1.26 -4.52 107.32 110.41 3k1q s GLY 295 Ca 0.05 -3.77 -0.23 0.00 0.00 0.00 0.00 44.72 40.77 3k1q s GLY 295 CO 0.00 1.43 0.91 1.04 0.00 0.00 0.00 173.10 176.49 3k1q n LEU 296 N 3.15 2.28 -4.66 0.66 4.77 -1.26 -4.86 117.00 117.08 3k1q n LEU 296 Ca 0.25 0.97 -0.45 0.00 -0.03 0.00 0.00 56.01 56.75 3k1q n LEU 296 Cb 0.40 -1.31 -0.04 0.00 -2.33 0.00 0.00 43.42 40.14 3k1q n LEU 296 CO 0.49 -1.82 1.59 -2.65 -1.33 0.00 0.00 177.39 173.67 3k1q n PRO 297 N 0.04 2.46 -0.81 3.23 -0.02 -1.26 -4.61 135.00 134.03 3k1q n PRO 297 Ca 0.10 0.88 -0.25 0.00 -2.02 0.00 0.00 63.50 62.21 3k1q n PRO 297 Cb 0.41 -2.87 -0.08 0.00 -0.02 0.00 0.00 33.50 30.94 3k1q n PRO 297 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k1q n ALA 298 N 7.64 0.15 0.00 3.55 0.00 -1.26 -4.57 120.51 126.03 3k1q n ALA 298 Ca 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.57 3k1q n ALA 298 Cb 0.36 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.57 3k1q n ALA 298 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3k1q n LEU 299 N 5.49 0.00 0.00 0.00 4.32 -0.74 -4.65 117.00 121.42 3k1q n LEU 299 Ca 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.35 3k1q n LEU 299 Cb 0.01 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.81 3k1q n LEU 299 CO 0.52 0.00 0.00 -0.38 -1.22 0.00 0.00 177.39 176.31 3k1q n ILE 300 N 0.00 0.00 -1.69 -0.08 2.08 -1.26 -3.83 119.36 114.57 3k1q n ILE 300 Ca 0.00 0.00 -0.43 0.00 0.56 0.00 0.00 62.75 62.88 3k1q n ILE 300 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 39.64 38.86 3k1q n ILE 300 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 3k1q n ASP 301 N 0.00 3.93 0.03 4.38 8.00 -1.12 -4.66 116.55 127.11 3k1q n ASP 301 Ca 0.00 1.01 0.00 0.00 0.71 0.00 0.00 54.79 56.51 3k1q n ASP 301 Cb 0.00 -1.53 0.00 0.00 -0.02 0.00 0.00 41.12 39.57 3k1q n ASP 301 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 3k1q n GLU 302 N 5.10 0.00 -0.12 -1.24 0.28 -1.25 -3.14 120.64 120.28 3k1q n GLU 302 Ca 0.18 0.09 0.21 0.00 -0.16 0.00 0.00 57.16 57.48 3k1q n GLU 302 Cb 0.36 -0.44 0.64 0.00 1.43 0.00 0.00 31.44 33.42 3k1q n GLU 302 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3k1q h ALA 303 N 0.00 2.48 -0.39 -1.84 0.00 -1.88 -2.37 119.26 115.25 3k1q h ALA 303 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 3k1q h ALA 303 Cb 0.29 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.02 3k1q h ALA 303 CO 0.00 -0.69 0.03 0.25 0.00 0.00 0.00 179.25 178.85 3k1q n THR 304 N -4.39 2.52 -5.09 0.00 -2.24 -1.19 -4.99 114.28 98.90 3k1q n THR 304 Ca 0.14 -2.25 -0.30 0.00 -2.27 0.00 0.00 64.05 59.38 3k1q n THR 304 Cb 0.70 -0.31 -0.17 0.00 -2.10 0.00 0.00 70.33 68.46 3k1q n THR 304 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3k1q s LEU 305 N -3.06 2.00 0.50 3.22 1.43 -0.90 -4.99 118.68 116.89 3k1q s LEU 305 Ca 0.45 -0.47 -0.21 0.00 -1.03 0.00 0.00 54.13 52.88 3k1q s LEU 305 Cb 0.39 -1.23 -0.09 0.00 0.03 0.00 0.00 46.19 45.28 3k1q s LEU 305 CO 0.05 0.18 0.75 -0.81 0.23 0.00 0.00 176.35 176.75 3k1q n PRO 306 N 3.23 0.83 -0.19 1.29 -0.04 -1.26 -4.81 135.00 134.05 3k1q n PRO 306 Ca -0.19 0.31 0.26 0.00 -0.04 0.00 0.00 63.50 63.84 3k1q n PRO 306 Cb 0.52 -1.84 0.66 0.00 -0.04 0.00 0.00 33.50 32.81 3k1q n PRO 306 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3k1q h ALA 307 N 0.78 2.65 0.00 0.55 0.00 -1.97 0.50 119.26 121.76 3k1q h ALA 307 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3k1q h ALA 307 Cb 1.38 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.21 3k1q h ALA 307 CO 0.51 -0.91 0.00 0.11 0.00 0.00 0.00 179.25 178.96 3k1q h TRP 308 N 0.11 0.00 -0.10 0.00 5.08 -1.99 -2.72 115.95 116.33 3k1q h TRP 308 Ca 0.43 0.00 -0.07 0.00 1.08 0.00 0.00 58.89 60.33 3k1q h TRP 308 Cb 1.53 0.00 -0.05 0.00 -3.00 0.00 0.00 29.16 27.64 3k1q h TRP 308 CO -0.00 0.00 -0.54 0.45 -1.28 0.00 0.00 178.44 177.07 3k1q n SER 309 N -3.04 2.12 -4.89 0.11 2.88 0.16 -4.98 113.62 105.98 3k1q n SER 309 Ca -0.00 -3.89 -0.32 0.00 -1.33 0.00 0.00 58.87 53.33 3k1q n SER 309 Cb 0.25 -0.51 -0.05 0.00 -0.75 0.00 0.00 64.21 63.16 3k1q n SER 309 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 3k1q s GLN 310 N -3.29 3.36 -1.11 -1.46 -0.21 -1.03 -4.44 119.66 111.49 3k1q s GLN 310 Ca 0.40 -0.42 0.00 0.00 0.02 0.00 0.00 55.36 55.35 3k1q s GLN 310 Cb 0.38 -3.02 0.00 0.00 1.00 0.00 0.00 33.01 31.37 3k1q s GLN 310 CO -0.06 0.63 0.00 0.41 -2.12 0.00 0.00 175.29 174.16 3k1q n GLY 311 N 0.61 1.01 3.61 3.09 0.00 -1.26 -4.97 105.19 107.28 3k1q n GLY 311 Ca -0.08 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.99 3k1q n GLY 311 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k1q s VAL 312 N -2.42 3.83 0.00 1.61 1.01 -1.26 -4.89 120.40 118.27 3k1q s VAL 312 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 61.98 62.85 3k1q s VAL 312 Cb 0.00 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.37 3k1q s VAL 312 CO 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 175.10 174.53 3k1q n ALA 313 N 8.83 0.00 -1.38 5.51 0.00 -1.26 -0.43 120.51 131.78 3k1q n ALA 313 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.69 3k1q n ALA 313 Cb 0.47 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.11 3k1q n ALA 313 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3k1q n ASN 314 N 1.48 2.07 0.00 0.00 5.03 -1.26 -4.91 115.26 117.66 3k1q n ASN 314 Ca 0.00 -3.58 0.00 0.00 0.87 0.00 0.00 54.58 51.87 3k1q n ASN 314 Cb 0.00 -0.50 0.00 0.00 -1.02 0.00 0.00 39.78 38.26 3k1q n ASN 314 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3k1q n LEU 315 N -1.21 0.05 -4.76 3.41 4.77 0.42 -4.71 117.00 114.97 3k1q n LEU 315 Ca 0.19 0.02 -0.39 0.00 -0.03 0.00 0.00 56.01 55.80 3k1q n LEU 315 Cb 0.71 -0.33 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 3k1q n LEU 315 CO 0.00 -0.33 0.74 0.42 -1.33 0.00 0.00 177.39 176.89 3k1q s THR 316 N -0.66 3.69 0.00 -5.08 -4.23 -1.20 -1.79 115.64 106.37 3k1q s THR 316 Ca 0.00 1.59 0.00 0.00 -1.18 0.00 0.00 61.69 62.10 3k1q s THR 316 Cb 0.00 -3.97 0.00 0.00 1.34 0.00 0.00 72.50 69.87 3k1q s THR 316 CO 0.00 0.30 0.00 0.61 -0.54 0.00 0.00 174.62 174.99 3k1q n GLY 317 N 1.02 5.46 0.00 3.99 0.00 -1.25 -4.60 105.19 109.82 3k1q n GLY 317 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.88 3k1q n GLY 317 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3k1q n ASN 318 N 0.00 0.33 -3.18 1.61 0.23 -1.26 -3.84 115.26 109.14 3k1q n ASN 318 Ca 0.00 0.00 -0.21 0.00 -0.53 0.00 0.00 54.58 53.84 3k1q n ASN 318 Cb 0.00 0.05 -0.05 0.00 -2.08 0.00 0.00 39.78 37.70 3k1q n ASN 318 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3k1q n GLY 319 N 0.40 3.62 0.00 4.83 0.00 -1.26 -4.98 105.19 107.80 3k1q n GLY 319 Ca 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.21 3k1q n GLY 319 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k1q n GLN 320 N 0.61 0.77 -2.04 1.61 10.64 -1.26 -5.13 117.38 122.58 3k1q n GLN 320 Ca 0.25 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 55.00 3k1q n GLN 320 Cb 0.58 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.93 3k1q n GLN 320 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 3k1q s GLY 321 N -0.37 1.86 -0.69 2.61 0.00 -1.26 -4.07 107.32 105.39 3k1q s GLY 321 Ca 0.00 1.26 -0.07 0.00 0.00 0.00 0.00 44.72 45.91 3k1q s GLY 321 CO 0.00 2.45 0.65 -0.62 0.00 0.00 0.00 173.10 175.58 3k1q n VAL 322 N 3.67 -7.08 0.01 1.40 0.31 -1.26 -4.60 118.33 110.78 3k1q n VAL 322 Ca 0.12 0.03 -0.12 0.00 -0.01 0.00 0.00 64.34 64.36 3k1q n VAL 322 Cb 0.40 -5.13 -0.08 0.00 -0.91 0.00 0.00 33.84 28.12 3k1q n VAL 322 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3k1q h VAL 323 N 0.60 1.18 -2.99 2.52 2.07 -1.94 -3.39 116.25 114.31 3k1q h VAL 323 Ca -0.30 -0.54 -0.61 0.00 0.82 0.00 0.00 66.70 66.07 3k1q h VAL 323 Cb 1.20 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 32.44 3k1q h VAL 323 CO 0.30 0.14 -0.36 -2.16 0.02 0.00 0.00 177.57 175.52 3k1q s PRO 324 N -5.29 3.61 0.08 1.57 0.04 -1.26 -2.81 135.00 130.93 3k1q s PRO 324 Ca -0.14 -0.07 -0.18 0.00 0.04 0.00 0.00 61.00 60.65 3k1q s PRO 324 Cb 0.04 -3.02 -0.07 0.00 0.04 0.00 0.00 34.50 31.50 3k1q s PRO 324 CO 0.67 0.60 0.55 0.00 0.04 0.00 0.00 177.00 178.86 3k1q s LEU 326 N -1.27 4.13 -0.06 0.00 1.02 0.30 -4.85 118.68 117.95 3k1q s LEU 326 Ca 0.30 1.47 0.04 0.00 0.02 0.00 0.00 54.13 55.96 3k1q s LEU 326 Cb -0.18 -3.54 -0.00 0.00 0.02 0.00 0.00 46.19 42.48 3k1q s LEU 326 CO 0.18 -0.67 -0.20 -1.81 0.02 0.00 0.00 176.35 173.87 3k1q s ASP 327 N 1.36 2.54 0.02 2.29 1.11 -1.26 0.56 116.67 123.29 3k1q s ASP 327 Ca 0.47 -0.43 -0.00 0.00 0.18 0.00 0.00 52.55 52.76 3k1q s ASP 327 Cb -0.17 -0.88 -0.02 0.00 1.07 0.00 0.00 42.92 42.92 3k1q s ASP 327 CO 0.09 0.16 -0.02 -0.72 1.18 0.00 0.00 175.17 175.86 3k1q s TYR 328 N 0.16 0.28 -0.29 4.23 -0.85 -0.57 -1.36 117.35 118.95 3k1q s TYR 328 Ca -0.09 -0.57 -0.09 0.00 -0.52 0.00 0.00 57.07 55.80 3k1q s TYR 328 Cb -0.14 -0.20 -0.02 0.00 0.38 0.00 0.00 41.96 41.97 3k1q s TYR 328 CO 0.04 -0.21 0.13 1.21 -1.52 0.00 0.00 175.55 175.20 3k1q s ASN 329 N -1.60 5.47 0.36 -0.18 3.84 -1.26 -1.21 114.94 120.37 3k1q s ASN 329 Ca -0.14 -0.35 0.07 0.00 0.21 0.00 0.00 52.86 52.64 3k1q s ASN 329 Cb -0.08 -1.99 0.76 0.00 -0.55 0.00 0.00 41.25 39.39 3k1q s ASN 329 CO -0.02 -0.12 1.94 1.55 -2.79 0.00 0.00 177.10 177.66 3k1q h PRO 330 N 8.31 0.71 -0.07 0.43 0.13 -1.98 -2.71 132.00 136.83 3k1q h PRO 330 Ca -0.35 -0.04 -0.25 0.00 -0.87 0.00 0.00 66.00 64.49 3k1q h PRO 330 Cb 1.16 -0.16 0.02 0.00 0.13 0.00 0.00 31.00 32.15 3k1q h PRO 330 CO 0.59 0.47 -0.92 0.28 -0.23 0.00 0.00 178.00 178.19 3k1q h VAL 331 N 0.73 1.28 -0.31 1.56 2.07 -1.96 -2.20 116.25 117.42 3k1q h VAL 331 Ca 0.34 -2.12 0.06 0.00 0.82 0.00 0.00 66.70 65.79 3k1q h VAL 331 Cb 0.35 2.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 3k1q h VAL 331 CO -0.12 0.66 0.21 1.55 0.02 0.00 0.00 177.57 179.90 3k1q h PRO 332 N 0.46 0.17 -0.77 1.57 0.13 -1.88 -2.28 132.00 129.40 3k1q h PRO 332 Ca -0.09 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.99 3k1q h PRO 332 Cb 1.56 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.62 3k1q h PRO 332 CO 0.18 0.11 0.35 1.98 -0.23 0.00 0.00 178.00 180.40 3k1q h MET 333 N 0.17 1.12 -0.50 0.86 4.05 -1.32 -1.73 114.93 117.59 3k1q h MET 333 Ca 0.14 -0.17 0.11 0.00 -0.28 0.00 0.00 59.70 59.49 3k1q h MET 333 Cb 0.33 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 30.91 3k1q h MET 333 CO -0.02 0.88 0.34 0.00 0.23 0.00 0.00 176.91 178.34 3k1q h ALA 334 N 1.18 2.22 -0.38 0.39 0.00 -1.31 0.15 119.26 121.50 3k1q h ALA 334 Ca 0.26 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.02 3k1q h ALA 334 Cb 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3k1q h ALA 334 CO -0.03 -0.34 -0.31 0.00 0.00 0.00 0.00 179.25 178.57 3k1q h ALA 335 N 1.75 0.54 0.02 0.00 0.00 -1.45 -1.63 119.26 118.50 3k1q h ALA 335 Ca 0.23 -0.42 0.01 0.00 0.00 0.00 0.00 54.91 54.74 3k1q h ALA 335 Cb 0.67 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3k1q h ALA 335 CO -0.04 0.59 -0.10 0.00 0.00 0.00 0.00 179.25 179.70 3k1q h ALA 336 N 0.77 -0.13 -0.80 0.00 0.00 -0.35 0.64 119.26 119.39 3k1q h ALA 336 Ca 0.07 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.08 3k1q h ALA 336 Cb 0.89 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.78 3k1q h ALA 336 CO 0.08 -0.60 0.44 -0.09 0.00 0.00 0.00 179.25 179.07 3k1q h ARG 337 N -0.19 0.70 -0.30 0.00 2.43 -0.70 -1.92 114.38 114.40 3k1q h ARG 337 Ca 0.03 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 3k1q h ARG 337 Cb 0.22 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 3k1q h ARG 337 CO -0.09 0.46 -0.02 0.45 -1.51 0.00 0.00 179.97 179.27 3k1q h HIS 338 N 0.72 0.59 -0.65 2.20 3.86 -0.83 -1.57 115.15 119.47 3k1q h HIS 338 Ca 0.39 -0.11 0.06 0.00 -1.16 0.00 0.00 60.37 59.55 3k1q h HIS 338 Cb 0.39 -0.15 -0.08 0.00 1.06 0.00 0.00 27.41 28.64 3k1q h HIS 338 CO -0.08 0.69 -0.38 -0.11 0.86 0.00 0.00 177.93 178.91 3k1q n LEU 339 N -4.55 -0.69 0.03 2.43 7.94 0.18 -0.83 117.00 121.51 3k1q n LEU 339 Ca -0.03 1.27 -0.10 0.00 -1.11 0.00 0.00 56.01 56.04 3k1q n LEU 339 Cb 0.27 -0.21 -0.04 0.00 0.53 0.00 0.00 43.42 43.98 3k1q n LEU 339 CO 0.39 -1.00 0.78 -0.61 -1.11 0.00 0.00 177.39 175.84 3k1q h GLN 340 N 0.00 -0.18 -0.70 1.96 4.15 -0.94 0.22 115.11 119.62 3k1q h GLN 340 Ca 0.10 0.01 0.12 0.00 0.77 0.00 0.00 58.65 59.66 3k1q h GLN 340 Cb 0.27 0.04 -0.09 0.00 0.21 0.00 0.00 27.48 27.91 3k1q h GLN 340 CO -0.61 -0.12 0.27 -1.49 -1.93 0.00 0.00 178.83 174.95 3k1q h TRP 341 N -0.19 0.45 -0.23 3.99 4.06 -1.08 0.13 115.95 123.10 3k1q h TRP 341 Ca 0.07 0.03 -0.05 0.00 2.06 0.00 0.00 58.89 61.00 3k1q h TRP 341 Cb 0.28 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.33 3k1q h TRP 341 CO -0.22 0.07 -0.06 -0.09 -3.56 0.00 0.00 178.44 174.58 3k1q h ARG 342 N 0.42 0.45 -0.97 0.49 1.12 -0.30 -2.18 114.38 113.42 3k1q h ARG 342 Ca 0.37 -0.18 0.19 0.00 -1.11 0.00 0.00 59.98 59.26 3k1q h ARG 342 Cb 0.54 -0.02 -0.09 0.00 -0.01 0.00 0.00 29.97 30.38 3k1q h ARG 342 CO -0.38 0.69 0.61 1.96 -3.11 0.00 0.00 179.97 179.75 3k1q h GLN 343 N 0.18 0.64 0.00 0.20 4.20 0.14 -1.24 115.11 119.23 3k1q h GLN 343 Ca 0.06 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3k1q h GLN 343 Cb 0.53 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.16 3k1q h GLN 343 CO 0.02 0.42 0.00 -0.44 -0.67 0.00 0.00 178.83 178.17 3k1q h ASP 344 N 0.66 0.00 -2.37 1.46 3.32 -0.67 -3.48 116.42 115.33 3k1q h ASP 344 Ca 0.53 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 57.20 3k1q h ASP 344 Cb 0.96 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.47 3k1q h ASP 344 CO -0.29 0.00 -0.46 0.61 -1.72 0.00 0.00 179.24 177.37 3k1q n GLY 345 N 0.42 0.04 0.37 2.75 0.00 -0.47 -4.90 105.19 103.39 3k1q n GLY 345 Ca 0.03 -0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.10 3k1q n GLY 345 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3k1q h LEU 346 N 0.00 0.71 -7.19 0.99 3.38 -1.65 -3.45 115.31 108.10 3k1q h LEU 346 Ca -0.44 0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.52 3k1q h LEU 346 Cb 1.32 -0.06 -0.19 0.00 0.09 0.00 0.00 40.66 41.82 3k1q h LEU 346 CO 0.54 0.28 0.02 -0.51 0.09 0.00 0.00 178.44 178.87 3k1q s ILE 347 N -5.76 0.02 0.08 1.22 1.10 -1.26 -5.05 121.20 111.55 3k1q s ILE 347 Ca -0.11 -0.18 -0.31 0.00 -0.51 0.00 0.00 60.65 59.55 3k1q s ILE 347 Cb 0.24 -0.86 -0.07 0.00 0.15 0.00 0.00 42.46 41.92 3k1q s ILE 347 CO 0.80 -0.10 1.30 0.42 -2.11 0.00 0.00 174.94 175.25 3k1q s THR 348 N -1.31 3.68 0.24 4.00 -4.23 -1.26 -4.34 115.64 112.42 3k1q s THR 348 Ca -0.12 1.20 -0.06 0.00 -1.18 0.00 0.00 61.69 61.53 3k1q s THR 348 Cb -0.02 -3.77 0.22 0.00 1.34 0.00 0.00 72.50 70.27 3k1q s THR 348 CO 0.07 0.08 1.88 0.00 -0.54 0.00 0.00 174.62 176.12 3k1q h ALA 349 N 6.89 1.18 0.00 3.99 0.00 -1.95 -3.32 119.26 126.06 3k1q h ALA 349 Ca -0.41 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3k1q h ALA 349 Cb 1.21 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3k1q h ALA 349 CO 0.84 0.42 0.00 0.00 0.00 0.00 0.00 179.25 180.52 3k1q n ALA 350 N -2.35 0.00 -0.05 0.00 0.00 -1.26 -1.25 120.51 115.60 3k1q n ALA 350 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.52 3k1q n ALA 350 Cb 0.10 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.44 3k1q n ALA 350 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k1q n GLN 351 N -0.56 1.49 0.13 0.00 -0.00 -1.26 -4.24 117.38 112.95 3k1q n GLN 351 Ca 0.00 -0.04 -0.09 0.00 -0.00 0.00 0.00 57.00 56.87 3k1q n GLN 351 Cb 0.00 -1.34 -0.05 0.00 -0.00 0.00 0.00 30.24 28.85 3k1q n GLN 351 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 3k1q h GLU 352 N 0.00 -0.40 -0.14 2.61 4.57 -1.27 -1.92 114.58 118.03 3k1q h GLU 352 Ca -0.27 0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 57.93 3k1q h GLU 352 Cb 1.52 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 30.20 3k1q h GLU 352 CO 0.01 -0.13 0.03 0.00 -1.18 0.00 0.00 179.01 177.75 3k1q h ALA 353 N -0.79 0.18 -0.21 2.92 0.00 -1.45 -2.48 119.26 117.43 3k1q h ALA 353 Ca -0.04 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.78 3k1q h ALA 353 Cb 0.46 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 3k1q h ALA 353 CO 0.07 -0.18 -0.28 1.96 0.00 0.00 0.00 179.25 180.82 3k1q h GLN 354 N 0.02 -0.29 0.32 0.00 7.50 -1.68 -2.03 115.11 118.95 3k1q h GLN 354 Ca 0.04 0.02 -0.00 0.00 0.50 0.00 0.00 58.65 59.21 3k1q h GLN 354 Cb 0.26 0.07 -0.03 0.00 0.05 0.00 0.00 27.48 27.83 3k1q h GLN 354 CO 0.00 -0.19 -0.52 -0.07 -1.50 0.00 0.00 178.83 176.55 3k1q h LEU 355 N -0.30 -1.49 -1.24 1.46 4.07 -0.95 -0.86 115.31 116.00 3k1q h LEU 355 Ca 0.12 0.14 -0.03 0.00 0.08 0.00 0.00 57.88 58.19 3k1q h LEU 355 Cb 0.50 0.52 -0.02 0.00 1.08 0.00 0.00 40.66 42.73 3k1q h LEU 355 CO -0.38 -0.62 0.16 -1.13 -1.08 0.00 0.00 178.44 175.39 3k1q h ASN 356 N -0.89 0.63 -0.71 -0.43 -0.73 -1.37 -1.66 115.58 110.42 3k1q h ASN 356 Ca -0.03 -0.08 -0.01 0.00 1.87 0.00 0.00 56.30 58.04 3k1q h ASN 356 Cb 0.82 -0.16 -0.03 0.00 0.27 0.00 0.00 38.32 39.22 3k1q h ASN 356 CO -0.17 0.59 0.41 0.78 -0.37 0.00 0.00 177.43 178.67 3k1q h ASN 357 N 0.68 0.88 -0.54 1.15 2.35 -0.98 -0.95 115.58 118.17 3k1q h ASN 357 Ca 0.16 -0.06 0.09 0.00 -0.55 0.00 0.00 56.30 55.93 3k1q h ASN 357 Cb 0.19 -0.22 -0.07 0.00 0.05 0.00 0.00 38.32 38.26 3k1q h ASN 357 CO -0.01 0.70 0.15 0.44 -1.65 0.00 0.00 177.43 177.06 3k1q h ASP 358 N 1.00 0.10 -0.04 5.81 3.32 -0.26 -1.58 116.42 124.78 3k1q h ASP 358 Ca 0.26 0.08 -0.19 0.00 0.02 0.00 0.00 57.03 57.20 3k1q h ASP 358 Cb 0.00 0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 3k1q h ASP 358 CO -0.04 0.08 -0.64 1.88 -1.72 0.00 0.00 179.24 178.80 3k1q h TYR 359 N 0.31 0.84 0.00 4.55 0.05 -0.90 -2.46 116.97 119.37 3k1q h TYR 359 Ca 0.27 -0.33 -0.05 0.00 0.05 0.00 0.00 58.73 58.67 3k1q h TYR 359 Cb 0.34 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 3k1q h TYR 359 CO -0.20 1.11 -0.25 1.79 -1.05 0.00 0.00 178.16 179.56 3k1q h THR 360 N 0.48 0.67 -0.58 -2.88 1.35 -1.09 -0.69 112.91 110.16 3k1q h THR 360 Ca -0.01 -1.14 -0.05 0.00 -0.55 0.00 0.00 66.41 64.66 3k1q h THR 360 Cb 1.22 1.74 -0.02 0.00 -1.73 0.00 0.00 68.15 69.35 3k1q h THR 360 CO 0.12 0.25 0.18 0.00 -0.25 0.00 0.00 175.52 175.82 3k1q h ALA 361 N 1.75 0.76 0.50 6.62 0.00 -0.84 0.18 119.26 128.24 3k1q h ALA 361 Ca -0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3k1q h ALA 361 Cb 0.72 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3k1q h ALA 361 CO 0.03 0.44 -0.34 1.88 0.00 0.00 0.00 179.25 181.25 3k1q h TYR 362 N 0.83 -0.91 -0.80 0.00 0.99 -1.28 -2.81 116.97 112.98 3k1q h TYR 362 Ca 0.19 -0.01 0.11 0.00 2.00 0.00 0.00 58.73 61.02 3k1q h TYR 362 Cb 0.29 0.33 -0.08 0.00 1.00 0.00 0.00 36.73 38.28 3k1q h TYR 362 CO 0.02 -0.51 0.43 0.00 -0.00 0.00 0.00 178.16 178.10 3k1q h ALA 363 N -0.41 1.15 -0.66 3.88 0.00 -0.75 -1.51 119.26 120.96 3k1q h ALA 363 Ca -0.06 0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.99 3k1q h ALA 363 Cb 0.68 -0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.29 3k1q h ALA 363 CO 0.03 0.01 -0.50 1.25 0.00 0.00 0.00 179.25 180.04 3k1q h LEU 364 N 0.69 -1.75 -0.32 0.00 6.46 -0.66 -1.79 115.31 117.94 3k1q h LEU 364 Ca 0.40 0.27 0.06 0.00 -0.12 0.00 0.00 57.88 58.50 3k1q h LEU 364 Cb 0.45 0.78 -0.06 0.00 -0.73 0.00 0.00 40.66 41.09 3k1q h LEU 364 CO -0.29 -0.33 -0.08 0.74 -0.62 0.00 0.00 178.44 177.87 3k1q h THR 365 N -0.20 0.69 0.44 1.05 2.02 -1.04 0.69 112.91 116.56 3k1q h THR 365 Ca 0.16 -0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.32 3k1q h THR 365 Cb 0.54 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3k1q h THR 365 CO -0.75 0.00 -0.21 0.16 0.37 0.00 0.00 175.52 175.09 3k1q h ILE 366 N 0.00 0.56 0.04 3.11 -0.00 -1.26 -0.15 117.51 119.81 3k1q h ILE 366 Ca 0.15 -0.10 0.03 0.00 -0.00 0.00 0.00 64.86 64.94 3k1q h ILE 366 Cb 0.23 0.61 -0.05 0.00 -0.00 0.00 0.00 36.82 37.62 3k1q h ILE 366 CO -0.32 0.02 -0.33 -0.33 -0.00 0.00 0.00 178.15 177.18 3k1q h GLU 367 N -0.66 -0.49 -0.39 0.16 5.08 -0.48 0.17 114.58 117.97 3k1q h GLU 367 Ca -0.06 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 3k1q h GLU 367 Cb 0.49 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.81 3k1q h GLU 367 CO 0.10 -0.33 0.16 -0.09 -1.00 0.00 0.00 179.01 177.86 3k1q h ARG 368 N -0.51 0.33 -0.36 2.33 2.43 0.83 0.77 114.38 120.20 3k1q h ARG 368 Ca 0.05 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.14 3k1q h ARG 368 Cb 0.58 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 3k1q h ARG 368 CO -0.25 0.22 -0.05 1.12 -1.51 0.00 0.00 179.97 179.49 3k1q h HIS 369 N 0.34 0.62 -0.03 2.20 2.07 -0.77 -1.43 115.15 118.14 3k1q h HIS 369 Ca 0.18 -0.08 -0.03 0.00 -2.85 0.00 0.00 60.37 57.59 3k1q h HIS 369 Cb 0.13 -0.17 0.00 0.00 2.57 0.00 0.00 27.41 29.94 3k1q h HIS 369 CO -0.13 0.63 -0.09 -0.07 -3.07 0.00 0.00 177.93 175.21 3k1q h LEU 370 N 0.55 0.13 -0.74 6.12 3.38 -0.17 -0.65 115.31 123.93 3k1q h LEU 370 Ca 0.11 -0.60 0.06 0.00 0.09 0.00 0.00 57.88 57.54 3k1q h LEU 370 Cb 0.43 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 3k1q h LEU 370 CO 0.02 0.71 0.43 0.71 0.09 0.00 0.00 178.44 180.40 3k1q h THR 371 N -0.44 0.99 -0.62 0.22 1.35 -0.90 0.27 112.91 113.77 3k1q h THR 371 Ca -0.00 -0.27 0.03 0.00 -0.55 0.00 0.00 66.41 65.62 3k1q h THR 371 Cb 0.69 0.14 -0.04 0.00 -1.73 0.00 0.00 68.15 67.21 3k1q h THR 371 CO 0.02 0.14 0.39 0.00 -0.25 0.00 0.00 175.52 175.82 3k1q h ALA 372 N 1.37 0.81 -0.13 6.62 0.00 -1.18 -0.35 119.26 126.39 3k1q h ALA 372 Ca 0.33 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 3k1q h ALA 372 Cb 0.19 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3k1q h ALA 372 CO -0.18 0.14 -0.08 1.98 0.00 0.00 0.00 179.25 181.11 3k1q h MET 373 N 0.76 0.29 -0.77 0.00 -1.53 -0.27 -1.67 114.93 111.75 3k1q h MET 373 Ca 0.25 -0.14 0.03 0.00 -3.44 0.00 0.00 59.70 56.40 3k1q h MET 373 Cb 0.01 -0.00 -0.04 0.00 -0.55 0.00 0.00 31.60 31.01 3k1q h MET 373 CO -0.10 0.64 0.49 -0.07 0.14 0.00 0.00 176.91 178.02 3k1q h LEU 374 N -0.06 0.82 -2.17 3.39 -0.00 -0.46 -3.05 115.31 113.79 3k1q h LEU 374 Ca 0.03 -0.01 0.01 0.00 -0.00 0.00 0.00 57.88 57.91 3k1q h LEU 374 Cb 0.56 -0.19 -0.00 0.00 -0.00 0.00 0.00 40.66 41.03 3k1q h LEU 374 CO 0.02 0.57 0.02 1.62 -0.00 0.00 0.00 178.44 180.68 3k1q h VAL 375 N 0.97 0.81 -0.92 1.22 3.04 -0.47 -2.80 116.25 118.11 3k1q h VAL 375 Ca 0.30 0.00 0.16 0.00 -1.01 0.00 0.00 66.70 66.15 3k1q h VAL 375 Cb -0.02 0.98 -0.10 0.00 -2.01 0.00 0.00 31.29 30.14 3k1q h VAL 375 CO -0.10 0.00 0.51 0.00 -1.01 0.00 0.00 177.57 176.97 3k1q h ALA 376 N 1.98 1.44 0.56 3.17 0.00 -1.21 0.36 119.26 125.56 3k1q h ALA 376 Ca 0.01 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3k1q h ALA 376 Cb 0.05 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.81 3k1q h ALA 376 CO -0.00 -0.07 -0.27 -0.91 0.00 0.00 0.00 179.25 178.00 3k1q h ASN 377 N 0.68 -0.64 -0.91 0.00 2.35 -1.65 -2.30 115.58 113.11 3k1q h ASN 377 Ca 0.51 0.02 0.19 0.00 -0.55 0.00 0.00 56.30 56.47 3k1q h ASN 377 Cb 0.75 0.16 -0.07 0.00 0.05 0.00 0.00 38.32 39.21 3k1q h ASN 377 CO -0.37 -0.40 0.59 -0.65 -1.65 0.00 0.00 177.43 174.95 3k1q h PRO 378 N -0.86 0.51 -1.99 0.81 0.11 -1.67 -0.38 132.00 128.53 3k1q h PRO 378 Ca -0.08 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.81 3k1q h PRO 378 Cb 0.58 -0.12 -0.07 0.00 0.11 0.00 0.00 31.00 31.50 3k1q h PRO 378 CO 0.13 0.34 -0.25 -0.89 -0.21 0.00 0.00 178.00 177.11 3k1q n ILE 379 N -4.56 2.87 0.00 4.15 2.08 0.12 -2.69 119.36 121.33 3k1q n ILE 379 Ca 0.19 -1.47 0.00 0.00 0.56 0.00 0.00 62.75 62.04 3k1q n ILE 379 Cb 0.62 -1.88 0.00 0.00 -0.75 0.00 0.00 39.64 37.63 3k1q n ILE 379 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3k1q n ALA 380 N 2.18 0.00 -2.61 -1.39 0.00 -0.86 -4.87 120.51 112.95 3k1q n ALA 380 Ca 0.37 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.50 3k1q n ALA 380 Cb 0.82 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.18 3k1q n ALA 380 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k1q s ALA 381 N -0.19 3.06 -0.45 0.00 0.00 -0.21 -5.01 121.76 118.97 3k1q s ALA 381 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 50.80 3k1q s ALA 381 Cb 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 23.12 22.10 3k1q s ALA 381 CO 0.00 0.65 0.55 0.41 0.00 0.00 0.00 175.76 177.37 3k1q n GLY 382 N 0.84 -0.13 3.75 0.00 0.00 -1.26 -4.54 105.19 103.85 3k1q n GLY 382 Ca -0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 3k1q n GLY 382 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3k1q s ARG 383 N -2.09 3.23 -0.35 1.61 1.70 -1.26 -4.40 118.95 117.39 3k1q s ARG 383 Ca 0.00 -0.30 -0.01 0.00 -0.47 0.00 0.00 55.73 54.95 3k1q s ARG 383 Cb 0.00 -2.97 0.12 0.00 -0.57 0.00 0.00 34.95 31.53 3k1q s ARG 383 CO 0.00 0.69 0.16 1.41 -1.08 0.00 0.00 175.30 176.49 3k1q s MET 384 N -0.83 0.70 -0.76 3.89 1.75 -1.26 -4.16 119.30 118.63 3k1q s MET 384 Ca 0.13 -1.24 -0.01 0.00 -1.25 0.00 0.00 55.69 53.31 3k1q s MET 384 Cb -0.12 -1.74 0.38 0.00 2.84 0.00 0.00 34.83 36.20 3k1q s MET 384 CO 0.03 -1.09 1.95 -0.35 -0.65 0.00 0.00 175.02 174.91 3k1q n PRO 385 N 4.43 2.80 -3.58 4.11 -0.04 -1.26 -3.12 135.00 138.34 3k1q n PRO 385 Ca 0.03 -3.55 -0.08 0.00 -0.04 0.00 0.00 63.50 59.87 3k1q n PRO 385 Cb 0.39 -2.27 -0.04 0.00 -0.04 0.00 0.00 33.50 31.53 3k1q n PRO 385 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3k1q s ILE 386 N -5.03 0.00 0.15 0.52 2.07 -1.26 -4.58 121.20 113.07 3k1q s ILE 386 Ca 0.55 0.00 -0.34 0.00 -1.41 0.00 0.00 60.65 59.45 3k1q s ILE 386 Cb 0.45 -1.00 -0.14 0.00 0.13 0.00 0.00 42.46 41.90 3k1q s ILE 386 CO -0.29 0.00 1.56 1.67 -1.91 0.00 0.00 174.94 175.97 3k1q n GLN 387 N 0.46 2.06 -3.17 3.50 7.27 -1.26 -5.00 117.38 121.24 3k1q n GLN 387 Ca -0.07 0.74 -0.39 0.00 0.07 0.00 0.00 57.00 57.36 3k1q n GLN 387 Cb 0.59 -2.50 -0.06 0.00 2.41 0.00 0.00 30.24 30.67 3k1q n GLN 387 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 3k1q s PRO 388 N 0.90 4.33 0.00 3.69 0.04 -1.26 -5.00 135.00 137.70 3k1q s PRO 388 Ca 0.79 0.85 0.00 0.00 0.04 0.00 0.00 61.00 62.69 3k1q s PRO 388 Cb -0.70 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 30.56 3k1q s PRO 388 CO 0.39 0.53 0.00 1.97 0.04 0.00 0.00 177.00 179.93 3k1q n PHE 389 N 2.01 0.00 -1.63 0.56 1.16 -1.26 -5.00 117.46 113.31 3k1q n PHE 389 Ca -0.08 0.00 -0.32 0.00 -1.87 0.00 0.00 57.45 55.18 3k1q n PHE 389 Cb 0.50 0.00 0.05 0.00 -1.61 0.00 0.00 39.48 38.43 3k1q n PHE 389 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 3k1q s ASN 390 N 0.00 5.11 0.16 5.98 2.20 -1.26 -5.05 114.94 122.09 3k1q s ASN 390 Ca 0.00 1.84 -0.15 0.00 -0.94 0.00 0.00 52.86 53.61 3k1q s ASN 390 Cb 0.00 -2.53 0.04 0.00 -2.00 0.00 0.00 41.25 36.76 3k1q s ASN 390 CO 0.00 -1.62 1.78 0.00 -2.94 0.00 0.00 177.10 174.32 3k1q h ALA 391 N -0.37 0.61 0.00 3.54 0.00 -2.03 0.39 119.26 121.40 3k1q h ALA 391 Ca -0.45 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3k1q h ALA 391 Cb 1.23 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3k1q h ALA 391 CO 0.54 0.11 0.51 0.00 0.00 0.00 0.00 179.25 180.42 3k1q n ALA 392 N -2.26 0.26 0.20 0.00 0.00 -1.26 -2.29 120.51 115.15 3k1q n ALA 392 Ca 0.02 0.04 0.07 0.00 0.00 0.00 0.00 53.44 53.57 3k1q n ALA 392 Cb 0.07 -0.31 0.35 0.00 0.00 0.00 0.00 19.45 19.55 3k1q n ALA 392 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3k1q h ASP 393 N 0.00 0.00 0.50 0.00 3.32 -1.30 -2.44 116.42 116.49 3k1q h ASP 393 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3k1q h ASP 393 Cb 1.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.57 3k1q h ASP 393 CO 0.00 0.33 0.00 -0.26 -1.72 0.00 0.00 179.24 177.59 3k1q h PHE 394 N 0.00 0.00 -1.01 4.55 -1.00 -1.63 -3.40 116.94 114.45 3k1q h PHE 394 Ca -0.00 0.00 -0.77 0.00 2.81 0.00 0.00 57.97 60.01 3k1q h PHE 394 Cb 0.90 0.00 0.06 0.00 3.61 0.00 0.00 35.95 40.52 3k1q h PHE 394 CO 0.00 0.00 -0.03 0.41 -1.61 0.00 0.00 178.31 177.08 3k1q n GLY 395 N -0.49 -0.51 1.12 -1.45 0.00 -0.92 -4.85 105.19 98.09 3k1q n GLY 395 Ca 0.00 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.71 3k1q n GLY 395 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3k1q n GLN 396 N 1.43 0.07 0.00 1.61 3.00 -1.26 -4.60 117.38 117.62 3k1q n GLN 396 Ca 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 3k1q n GLN 396 Cb 0.11 -1.47 0.00 0.00 0.00 0.00 0.00 30.24 28.88 3k1q n GLN 396 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3k1q n ALA 397 N 1.09 0.00 -2.49 -1.58 0.00 -1.26 -4.90 120.51 111.37 3k1q n ALA 397 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 3k1q n ALA 397 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.48 3k1q n ALA 397 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k1q n GLY 398 N 4.63 -0.39 2.49 0.00 0.00 -1.26 -3.38 105.19 107.27 3k1q n GLY 398 Ca 0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 46.02 45.89 3k1q n GLY 398 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3k1q n GLN 399 N -2.99 -1.05 -0.23 1.61 0.00 -1.26 -3.22 117.38 110.23 3k1q n GLN 399 Ca -0.19 0.58 -0.01 0.00 -0.00 0.00 0.00 57.00 57.37 3k1q n GLN 399 Cb 0.65 -4.53 0.02 0.00 0.00 0.00 0.00 30.24 26.38 3k1q n GLN 399 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 3k1q n THR 400 N -2.51 -0.33 0.14 1.69 -1.04 -0.47 -0.54 114.28 111.23 3k1q n THR 400 Ca -0.05 1.42 0.02 0.00 -2.04 0.00 0.00 64.05 63.39 3k1q n THR 400 Cb 0.35 -1.86 0.03 0.00 -1.82 0.00 0.00 70.33 67.03 3k1q n THR 400 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3k1q h ALA 401 N 0.78 0.67 0.12 2.41 0.00 -1.89 -3.24 119.26 118.10 3k1q h ALA 401 Ca 0.20 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3k1q h ALA 401 Cb 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3k1q h ALA 401 CO -0.60 0.66 -0.06 0.00 0.00 0.00 0.00 179.25 179.26 3k1q h ALA 402 N 1.47 -0.16 -1.00 0.00 0.00 -1.14 -1.30 119.26 117.14 3k1q h ALA 402 Ca -0.01 -0.09 0.29 0.00 0.00 0.00 0.00 54.91 55.11 3k1q h ALA 402 Cb 1.39 0.06 -0.18 0.00 0.00 0.00 0.00 17.79 19.05 3k1q h ALA 402 CO 0.07 -0.52 0.10 0.00 0.00 0.00 0.00 179.25 178.90 3k1q h ALA 403 N 0.58 1.32 -0.32 0.00 0.00 -1.43 0.17 119.26 119.57 3k1q h ALA 403 Ca -0.02 0.33 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 3k1q h ALA 403 Cb 0.24 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3k1q h ALA 403 CO 0.03 -0.63 0.07 0.28 0.00 0.00 0.00 179.25 179.00 3k1q h VAL 404 N 0.00 1.22 -0.37 0.00 2.07 -1.49 0.13 116.25 117.81 3k1q h VAL 404 Ca 0.64 -0.75 -0.15 0.00 0.82 0.00 0.00 66.70 67.26 3k1q h VAL 404 Cb 1.39 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 3k1q h VAL 404 CO -0.91 0.25 -0.37 0.00 0.02 0.00 0.00 177.57 176.56 3k1q h ALA 405 N 0.91 0.64 -0.25 1.67 0.00 -0.45 -0.65 119.26 121.12 3k1q h ALA 405 Ca 0.10 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3k1q h ALA 405 Cb 0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3k1q h ALA 405 CO 0.00 0.67 0.16 -0.07 0.00 0.00 0.00 179.25 180.01 3k1q h LEU 406 N 0.72 0.30 -0.83 0.00 3.38 -0.85 -1.40 115.31 116.62 3k1q h LEU 406 Ca 0.06 -0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.15 3k1q h LEU 406 Cb 0.95 -0.08 -0.10 0.00 0.09 0.00 0.00 40.66 41.53 3k1q h LEU 406 CO 0.09 0.25 0.39 0.00 0.09 0.00 0.00 178.44 179.26 3k1q h ALA 407 N 1.07 1.25 0.16 1.53 0.00 0.68 -1.25 119.26 122.69 3k1q h ALA 407 Ca 0.09 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3k1q h ALA 407 Cb -0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3k1q h ALA 407 CO -0.02 -0.16 -0.08 1.96 0.00 0.00 0.00 179.25 180.95 3k1q h GLN 408 N 0.54 -0.21 -0.79 0.00 4.20 -0.92 -2.45 115.11 115.49 3k1q h GLN 408 Ca 0.47 0.01 0.03 0.00 0.06 0.00 0.00 58.65 59.22 3k1q h GLN 408 Cb 0.71 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.50 3k1q h GLN 408 CO -0.40 -0.05 0.52 0.00 -0.67 0.00 0.00 178.83 178.23 3k1q h ALA 409 N 0.51 1.51 -1.07 3.87 0.00 -0.82 -1.11 119.26 122.15 3k1q h ALA 409 Ca -0.02 -0.04 0.29 0.00 0.00 0.00 0.00 54.91 55.14 3k1q h ALA 409 Cb 0.25 -0.28 -0.10 0.00 0.00 0.00 0.00 17.79 17.66 3k1q h ALA 409 CO 0.04 0.41 0.69 0.52 0.00 0.00 0.00 179.25 180.91 3k1q h MET 410 N 0.99 0.34 0.00 0.00 2.86 -0.76 -2.32 114.93 116.04 3k1q h MET 410 Ca 0.31 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 3k1q h MET 410 Cb 0.02 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.60 3k1q h MET 410 CO -0.09 0.23 0.00 0.74 1.06 0.00 0.00 176.91 178.85 3k1q h PHE 411 N 0.36 0.00 0.00 -0.22 -1.00 -1.00 -3.44 116.94 111.64 3k1q h PHE 411 Ca 0.63 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.41 3k1q h PHE 411 Cb 1.65 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.21 3k1q h PHE 411 CO -0.00 0.00 0.00 0.28 -1.61 0.00 0.00 178.31 176.98