#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qkn s TRP 34 N 0.00 2.79 0.57 6.00 0.52 -1.26 -5.08 118.94 122.49 2qkn s TRP 34 Ca 0.00 -0.76 -0.20 0.00 0.02 0.00 0.00 56.10 55.16 2qkn s TRP 34 Cb 0.00 -1.85 -0.04 0.00 -1.15 0.00 0.00 33.47 30.43 2qkn s TRP 34 CO 0.00 -0.29 1.30 -2.14 0.02 0.00 0.00 176.95 175.84 2qkn s PRO 35 N 0.48 3.03 0.21 4.98 0.02 -1.26 -4.75 135.00 137.71 2qkn s PRO 35 Ca -0.10 2.07 -0.10 0.00 0.02 0.00 0.00 61.00 62.89 2qkn s PRO 35 Cb -0.16 -2.11 0.29 0.00 0.02 0.00 0.00 34.50 32.54 2qkn s PRO 35 CO 0.05 -1.22 1.69 0.00 -0.33 0.00 0.00 177.00 177.18 2qkn h ALA 36 N 1.20 0.66 -0.30 -1.55 0.00 -1.99 -1.01 119.26 116.27 2qkn h ALA 36 Ca -0.51 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 2qkn h ALA 36 Cb 1.30 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 2qkn h ALA 36 CO 0.56 -0.35 0.17 0.66 0.00 0.00 0.00 179.25 180.29 2qkn h SER 37 N 0.20 0.35 -0.08 0.00 4.64 -1.95 0.93 113.55 117.63 2qkn h SER 37 Ca 0.31 -0.02 -0.06 0.00 -0.47 0.00 0.00 61.79 61.55 2qkn h SER 37 Cb 0.49 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2qkn h SER 37 CO -0.45 0.28 -0.20 0.25 -0.87 0.00 0.00 176.83 175.85 2qkn h LEU 38 N 0.41 0.32 -1.51 5.97 5.85 -1.49 -2.98 115.31 121.87 2qkn h LEU 38 Ca 0.11 -0.58 -0.03 0.00 0.84 0.00 0.00 57.88 58.21 2qkn h LEU 38 Cb 0.00 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 2qkn h LEU 38 CO -0.02 0.84 -0.03 0.00 -0.34 0.00 0.00 178.44 178.90 2qkn h ALA 39 N 0.48 1.60 -0.60 1.25 0.00 -0.89 -1.52 119.26 119.58 2qkn h ALA 39 Ca -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2qkn h ALA 39 Cb 0.80 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2qkn h ALA 39 CO 0.04 0.29 0.35 0.00 0.00 0.00 0.00 179.25 179.93 2qkn h ALA 40 N 1.70 1.48 -0.73 0.00 0.00 -0.74 0.99 119.26 121.96 2qkn h ALA 40 Ca 0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2qkn h ALA 40 Cb 0.23 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2qkn h ALA 40 CO 0.01 0.44 0.37 -0.07 0.00 0.00 0.00 179.25 180.00 2qkn h LEU 41 N 0.83 0.94 -0.11 0.00 3.38 -1.13 0.37 115.31 119.58 2qkn h LEU 41 Ca 0.22 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2qkn h LEU 41 Cb -0.01 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 2qkn h LEU 41 CO -0.04 0.80 -0.07 0.00 0.09 0.00 0.00 178.44 179.21 2qkn h ALA 42 N 1.18 0.16 -0.86 1.53 0.00 -1.29 0.69 119.26 120.67 2qkn h ALA 42 Ca 0.25 -0.27 0.14 0.00 0.00 0.00 0.00 54.91 55.03 2qkn h ALA 42 Cb 0.09 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 2qkn h ALA 42 CO -0.03 -0.04 0.56 1.25 0.00 0.00 0.00 179.25 180.98 2qkn h LEU 43 N -0.12 0.61 -0.28 0.00 5.85 -0.54 0.18 115.31 121.01 2qkn h LEU 43 Ca 0.02 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2qkn h LEU 43 Cb 0.55 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.50 2qkn h LEU 43 CO 0.02 0.31 0.00 0.47 -0.34 0.00 0.00 178.44 178.90 2qkn n ASP 44 N -4.54 0.43 -0.34 1.25 8.00 0.09 -4.89 116.55 116.56 2qkn n ASP 44 Ca 0.16 -1.32 -0.04 0.00 0.71 0.00 0.00 54.79 54.30 2qkn n ASP 44 Cb 0.46 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.53 2qkn n ASP 44 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qkn n GLY 45 N 0.97 0.71 0.11 0.44 0.00 0.65 -4.91 105.19 103.16 2qkn n GLY 45 Ca 0.19 -0.59 0.01 0.00 0.00 0.00 0.00 46.02 45.62 2qkn n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qkn h LYS 46 N 0.18 0.00 -4.13 1.61 1.57 -1.04 -3.42 116.57 111.34 2qkn h LYS 46 Ca -0.09 0.00 -0.76 0.00 -1.87 0.00 0.00 60.65 57.93 2qkn h LYS 46 Cb 0.36 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.43 2qkn h LYS 46 CO 0.13 0.41 -0.22 -0.51 -0.57 0.00 0.00 179.45 178.69 2qkn s LEU 47 N -6.11 6.10 0.06 2.94 2.01 -1.15 -1.03 118.68 121.51 2qkn s LEU 47 Ca 0.00 -1.73 0.00 0.00 0.01 0.00 0.00 54.13 52.42 2qkn s LEU 47 Cb 0.08 -2.21 -0.04 0.00 0.01 0.00 0.00 46.19 44.03 2qkn s LEU 47 CO 0.78 -0.85 0.20 -0.13 1.01 0.00 0.00 176.35 177.36 2qkn s ARG 48 N 1.65 3.37 0.00 1.70 0.52 -0.46 -4.79 118.95 120.94 2qkn s ARG 48 Ca 0.03 -0.47 0.00 0.00 -0.52 0.00 0.00 55.73 54.77 2qkn s ARG 48 Cb -0.29 -3.00 0.00 0.00 0.52 0.00 0.00 34.95 32.18 2qkn s ARG 48 CO 0.03 0.60 0.14 0.25 0.02 0.00 0.00 175.30 176.35 2qkn n THR 49 N 0.29 0.00 -1.71 0.02 -2.24 -1.26 -1.46 114.28 107.91 2qkn n THR 49 Ca -0.05 -0.21 -0.37 0.00 -2.27 0.00 0.00 64.05 61.15 2qkn n THR 49 Cb 0.51 1.40 0.07 0.00 -2.10 0.00 0.00 70.33 70.21 2qkn n THR 49 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2qkn n ASP 50 N -0.13 1.92 -0.22 3.42 5.75 -1.26 -4.73 116.55 121.30 2qkn n ASP 50 Ca 0.00 0.83 0.02 0.00 -0.01 0.00 0.00 54.79 55.62 2qkn n ASP 50 Cb 0.10 -1.54 0.13 0.00 -1.03 0.00 0.00 41.12 38.78 2qkn n ASP 50 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2qkn h SER 51 N 0.54 0.22 -0.59 -1.12 4.64 -1.98 -1.89 113.55 113.37 2qkn h SER 51 Ca -0.51 0.09 0.12 0.00 -0.47 0.00 0.00 61.79 61.02 2qkn h SER 51 Cb 1.34 0.07 -0.10 0.00 -0.31 0.00 0.00 62.40 63.40 2qkn h SER 51 CO 0.53 0.12 -0.04 0.78 -0.87 0.00 0.00 176.83 177.34 2qkn h ASN 52 N 0.41 -0.35 0.51 4.97 4.21 -1.99 0.27 115.58 123.62 2qkn h ASN 52 Ca 0.34 0.15 -0.03 0.00 1.21 0.00 0.00 56.30 57.98 2qkn h ASN 52 Cb 0.45 0.29 0.01 0.00 -1.12 0.00 0.00 38.32 37.95 2qkn h ASN 52 CO -0.34 -0.13 -0.25 0.00 -1.29 0.00 0.00 177.43 175.42 2qkn h ALA 53 N 1.55 -0.69 -0.76 -0.83 0.00 -1.73 -2.75 119.26 114.05 2qkn h ALA 53 Ca 0.30 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.08 2qkn h ALA 53 Cb 0.47 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 2qkn h ALA 53 CO -0.53 -0.75 0.50 1.79 0.00 0.00 0.00 179.25 180.26 2qkn h THR 54 N -0.96 1.04 -0.26 0.00 1.35 -1.07 -2.69 112.91 110.31 2qkn h THR 54 Ca -0.07 -0.28 -0.05 0.00 -0.55 0.00 0.00 66.41 65.46 2qkn h THR 54 Cb 0.61 0.14 -0.01 0.00 -1.73 0.00 0.00 68.15 67.17 2qkn h THR 54 CO 0.12 0.15 -0.02 0.00 -0.25 0.00 0.00 175.52 175.51 2qkn h ALA 55 N 1.58 0.35 -0.17 6.62 0.00 -0.49 -2.85 119.26 124.30 2qkn h ALA 55 Ca 0.33 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2qkn h ALA 55 Cb 0.22 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2qkn h ALA 55 CO -0.11 0.11 0.05 0.00 0.00 0.00 0.00 179.25 179.31 2qkn h ALA 56 N 0.80 1.78 -0.38 0.00 0.00 -1.18 -0.95 119.26 119.33 2qkn h ALA 56 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qkn h ALA 56 Cb 0.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2qkn h ALA 56 CO 0.02 0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.45 2qkn n ALA 57 N -2.51 3.24 0.41 0.00 0.00 -1.05 -4.09 120.51 116.52 2qkn n ALA 57 Ca -0.00 -1.15 0.04 0.00 0.00 0.00 0.00 53.44 52.33 2qkn n ALA 57 Cb 0.13 -1.06 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 2qkn n ALA 57 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2qkn n SER 58 N 0.46 0.80 -4.38 0.00 3.41 -0.36 -4.71 113.62 108.84 2qkn n SER 58 Ca 0.17 -0.90 -0.20 0.00 -0.26 0.00 0.00 58.87 57.69 2qkn n SER 58 Cb 0.78 0.72 -0.10 0.00 -0.26 0.00 0.00 64.21 65.36 2qkn n SER 58 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2qkn s THR 59 N -1.53 1.91 0.33 6.66 -4.23 -1.25 -1.85 115.64 115.68 2qkn s THR 59 Ca 0.05 -2.26 0.07 0.00 -1.18 0.00 0.00 61.69 58.37 2qkn s THR 59 Cb 0.07 -2.12 -0.03 0.00 1.34 0.00 0.00 72.50 71.76 2qkn s THR 59 CO 0.29 -0.54 0.26 1.51 -0.54 0.00 0.00 174.62 175.60 2qkn s ASP 60 N -3.37 1.72 0.44 3.99 1.47 -1.26 -4.98 116.67 114.68 2qkn s ASP 60 Ca 0.25 -1.74 0.16 0.00 1.18 0.00 0.00 52.55 52.40 2qkn s ASP 60 Cb -0.02 0.55 1.08 0.00 -0.34 0.00 0.00 42.92 44.19 2qkn s ASP 60 CO 0.09 -1.04 1.94 0.15 0.68 0.00 0.00 175.17 176.99 2qkn h PHE 61 N 2.12 0.42 -0.86 2.11 3.57 -0.94 -0.84 116.94 122.52 2qkn h PHE 61 Ca -0.26 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.36 2qkn h PHE 61 Cb 1.24 -0.13 -0.08 0.00 2.79 0.00 0.00 35.95 39.76 2qkn h PHE 61 CO 1.63 0.17 0.49 0.78 -2.23 0.00 0.00 178.31 179.15 2qkn h GLY 62 N 0.37 1.38 -2.70 2.40 0.00 -1.46 -3.39 103.07 99.68 2qkn h GLY 62 Ca 0.34 -0.31 -0.39 0.00 0.00 0.00 0.00 47.33 46.96 2qkn h GLY 62 CO -0.10 0.08 -0.47 -2.01 0.00 0.00 0.00 176.54 174.04 2qkn n ASN 63 N -4.76 -5.52 -0.04 0.19 4.05 -0.32 -0.84 115.26 108.01 2qkn n ASN 63 Ca 0.16 0.12 -0.04 0.00 0.45 0.00 0.00 54.58 55.26 2qkn n ASN 63 Cb 0.34 -4.67 -0.04 0.00 1.23 0.00 0.00 39.78 36.64 2qkn n ASN 63 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 2qkn n ILE 64 N -3.57 0.44 -4.33 -1.44 5.41 -1.26 -4.47 119.36 110.14 2qkn n ILE 64 Ca -0.23 -0.21 -0.18 0.00 1.00 0.00 0.00 62.75 63.13 2qkn n ILE 64 Cb 0.67 -0.81 -0.10 0.00 -0.71 0.00 0.00 39.64 38.69 2qkn n ILE 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2qkn s THR 65 N -2.15 1.63 0.03 1.39 -1.32 -1.26 -5.13 115.64 108.82 2qkn s THR 65 Ca -0.07 -2.18 -0.22 0.00 -1.21 0.00 0.00 61.69 58.00 2qkn s THR 65 Cb 0.02 -2.04 0.05 0.00 -1.51 0.00 0.00 72.50 69.02 2qkn s THR 65 CO 0.22 -0.60 0.51 -0.94 -2.21 0.00 0.00 174.62 171.60 2qkn s SER 66 N -3.30 -0.43 -0.26 8.08 1.04 -1.26 -4.47 113.70 113.10 2qkn s SER 66 Ca 0.22 0.23 -0.08 0.00 0.48 0.00 0.00 55.95 56.79 2qkn s SER 66 Cb 0.00 0.47 0.12 0.00 0.10 0.00 0.00 66.02 66.71 2qkn s SER 66 CO 0.06 -0.67 0.56 0.00 0.98 0.00 0.00 173.24 174.17 2qkn s ALA 67 N -2.16 -1.72 0.13 5.32 0.00 -0.77 -5.04 121.76 117.52 2qkn s ALA 67 Ca -0.07 2.00 -0.30 0.00 0.00 0.00 0.00 51.96 53.59 2qkn s ALA 67 Cb -0.01 -1.62 -0.07 0.00 0.00 0.00 0.00 23.12 21.42 2qkn s ALA 67 CO 0.00 -0.88 1.20 -0.51 0.00 0.00 0.00 175.76 175.57 2qkn s LEU 68 N 2.79 4.42 0.62 0.00 1.43 -1.26 -4.39 118.68 122.29 2qkn s LEU 68 Ca -0.03 2.14 -0.02 0.00 -1.03 0.00 0.00 54.13 55.19 2qkn s LEU 68 Cb -0.12 -3.59 0.05 0.00 0.03 0.00 0.00 46.19 42.55 2qkn s LEU 68 CO -0.17 -0.41 0.89 -2.16 0.23 0.00 0.00 176.35 174.72 2qkn s PRO 69 N 0.35 2.36 0.07 1.29 0.04 -1.26 -1.55 135.00 136.30 2qkn s PRO 69 Ca 0.56 -0.57 -0.08 0.00 0.04 0.00 0.00 61.00 60.94 2qkn s PRO 69 Cb -0.31 -2.35 -0.27 0.00 0.04 0.00 0.00 34.50 31.61 2qkn s PRO 69 CO 0.33 -0.97 1.13 0.00 0.04 0.00 0.00 177.00 177.53 2qkn h ALA 70 N -0.24 0.06 -2.85 8.56 0.00 -0.25 -3.43 119.26 121.11 2qkn h ALA 70 Ca -0.43 -0.84 -0.10 0.00 0.00 0.00 0.00 54.91 53.54 2qkn h ALA 70 Cb 1.30 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 19.07 2qkn h ALA 70 CO 0.55 0.85 -0.12 0.00 0.00 0.00 0.00 179.25 180.53 2qkn s ALA 71 N -2.76 -0.03 -0.02 0.00 0.00 -0.63 -4.70 121.76 113.60 2qkn s ALA 71 Ca -0.06 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.89 2qkn s ALA 71 Cb 0.06 1.07 0.02 0.00 0.00 0.00 0.00 23.12 24.27 2qkn s ALA 71 CO 0.90 -0.84 -0.02 0.08 0.00 0.00 0.00 175.76 175.88 2qkn s VAL 72 N -3.72 0.26 -0.18 0.00 1.01 -0.54 -1.88 120.40 115.35 2qkn s VAL 72 Ca 0.24 -0.03 -0.06 0.00 0.00 0.00 0.00 61.98 62.13 2qkn s VAL 72 Cb -0.01 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 36.04 2qkn s VAL 72 CO 0.11 0.13 0.03 -0.22 0.00 0.00 0.00 175.10 175.16 2qkn s LEU 73 N 0.61 3.61 -0.87 3.92 2.96 -0.18 -1.35 118.68 127.37 2qkn s LEU 73 Ca -0.06 -0.01 -0.00 0.00 -0.22 0.00 0.00 54.13 53.83 2qkn s LEU 73 Cb -0.09 -1.90 0.22 0.00 0.50 0.00 0.00 46.19 44.91 2qkn s LEU 73 CO -0.01 0.15 0.79 -1.22 -1.32 0.00 0.00 176.35 174.75 2qkn n TYR 74 N 3.65 3.96 -2.08 5.38 4.01 -0.20 -0.33 117.16 131.55 2qkn n TYR 74 Ca -0.17 -4.07 -0.39 0.00 -0.16 0.00 0.00 57.90 53.11 2qkn n TYR 74 Cb 0.52 -1.04 -0.01 0.00 -0.31 0.00 0.00 39.34 38.51 2qkn n TYR 74 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2qkn s PRO 75 N -1.58 3.96 0.00 -0.72 0.04 -1.26 -4.81 135.00 130.64 2qkn s PRO 75 Ca 0.29 2.12 0.17 0.00 0.04 0.00 0.00 61.00 63.61 2qkn s PRO 75 Cb -0.04 -2.74 -0.15 0.00 0.04 0.00 0.00 34.50 31.61 2qkn s PRO 75 CO -0.11 -0.48 0.75 -1.13 0.04 0.00 0.00 177.00 176.06 2qkn n SER 76 N 0.10 0.95 -3.67 6.66 3.41 -1.26 -2.82 113.62 116.99 2qkn n SER 76 Ca 0.04 -0.97 -0.10 0.00 -0.26 0.00 0.00 58.87 57.58 2qkn n SER 76 Cb 0.44 0.91 -0.02 0.00 -0.26 0.00 0.00 64.21 65.28 2qkn n SER 76 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2qkn s SER 77 N -2.49 -0.37 0.58 4.04 1.04 -1.26 -4.80 113.70 110.43 2qkn s SER 77 Ca 0.08 -0.35 0.33 0.00 0.48 0.00 0.00 55.95 56.49 2qkn s SER 77 Cb 0.13 0.64 1.76 0.00 0.10 0.00 0.00 66.02 68.65 2qkn s SER 77 CO 0.65 -1.13 2.17 0.71 0.98 0.00 0.00 173.24 176.61 2qkn h THR 78 N 2.05 0.33 -0.73 2.02 1.35 -1.95 -1.79 112.91 114.18 2qkn h THR 78 Ca -0.27 -0.31 -0.01 0.00 -0.55 0.00 0.00 66.41 65.27 2qkn h THR 78 Cb 1.28 1.23 -0.04 0.00 -1.73 0.00 0.00 68.15 68.89 2qkn h THR 78 CO 0.32 0.05 0.41 0.00 -0.25 0.00 0.00 175.52 176.06 2qkn h ALA 79 N 1.95 1.36 -0.53 6.62 0.00 -1.99 -1.03 119.26 125.64 2qkn h ALA 79 Ca -0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2qkn h ALA 79 Cb 0.22 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2qkn h ALA 79 CO 0.01 0.54 0.18 -0.44 0.00 0.00 0.00 179.25 179.53 2qkn h ASP 80 N 1.01 0.71 -0.48 0.00 3.32 -1.73 -0.73 116.42 118.53 2qkn h ASP 80 Ca 0.26 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 57.08 2qkn h ASP 80 Cb -0.00 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2qkn h ASP 80 CO -0.04 0.67 -0.21 -0.07 -1.72 0.00 0.00 179.24 177.86 2qkn h LEU 81 N 0.76 1.02 -0.47 1.55 3.38 -1.33 -2.52 115.31 117.70 2qkn h LEU 81 Ca 0.18 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2qkn h LEU 81 Cb 0.21 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2qkn h LEU 81 CO -0.01 1.18 0.30 0.58 0.09 0.00 0.00 178.44 180.59 2qkn h VAL 82 N 0.86 1.12 -0.52 1.22 2.07 -0.52 -1.95 116.25 118.54 2qkn h VAL 82 Ca 0.11 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.44 2qkn h VAL 82 Cb 0.79 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.96 2qkn h VAL 82 CO 0.07 0.12 0.25 0.00 0.02 0.00 0.00 177.57 178.03 2qkn h ALA 83 N 1.16 0.67 0.44 1.67 0.00 -0.96 0.13 119.26 122.37 2qkn h ALA 83 Ca 0.17 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2qkn h ALA 83 Cb -0.06 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2qkn h ALA 83 CO -0.04 -0.11 -0.21 1.25 0.00 0.00 0.00 179.25 180.15 2qkn h LEU 84 N 0.48 -0.50 -1.55 0.00 5.85 -1.23 -1.76 115.31 116.61 2qkn h LEU 84 Ca 0.24 -0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 2qkn h LEU 84 Cb 0.17 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2qkn h LEU 84 CO -0.18 -0.18 -0.15 -0.07 -0.34 0.00 0.00 178.44 177.52 2qkn h LEU 85 N -0.84 0.09 -0.21 2.25 3.38 -1.29 -1.33 115.31 117.36 2qkn h LEU 85 Ca -0.06 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.75 2qkn h LEU 85 Cb 0.56 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2qkn h LEU 85 CO 0.10 0.26 -0.45 0.28 0.09 0.00 0.00 178.44 178.71 2qkn h SER 86 N 0.09 0.76 0.30 -0.43 0.02 -0.72 -1.32 113.55 112.24 2qkn h SER 86 Ca 0.02 -0.56 -0.01 0.00 -0.84 0.00 0.00 61.79 60.40 2qkn h SER 86 Cb 0.33 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 2qkn h SER 86 CO 0.02 1.17 -0.16 0.00 -1.14 0.00 0.00 176.83 176.72 2qkn h ALA 87 N 0.60 -0.43 -0.77 3.77 0.00 -0.92 -0.68 119.26 120.84 2qkn h ALA 87 Ca 0.00 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 54.96 2qkn h ALA 87 Cb 1.06 0.19 -0.09 0.00 0.00 0.00 0.00 17.79 18.95 2qkn h ALA 87 CO 0.10 -0.74 0.35 0.00 0.00 0.00 0.00 179.25 178.96 2qkn h ALA 88 N 0.27 1.10 -0.30 0.00 0.00 -1.24 0.54 119.26 119.62 2qkn h ALA 88 Ca -0.03 0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2qkn h ALA 88 Cb 0.35 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2qkn h ALA 88 CO 0.05 -0.14 -0.36 -0.97 0.00 0.00 0.00 179.25 177.83 2qkn h ASN 89 N 0.53 0.71 0.67 0.00 -1.24 -0.86 -3.28 115.58 112.12 2qkn h ASN 89 Ca 0.41 -0.30 -0.05 0.00 0.71 0.00 0.00 56.30 57.07 2qkn h ASN 89 Cb 0.57 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 39.41 2qkn h ASN 89 CO -0.36 1.00 -1.37 -1.54 -1.29 0.00 0.00 177.43 173.88 2qkn n SER 90 N -4.06 0.63 -4.57 1.15 3.41 -0.29 -4.82 113.62 105.07 2qkn n SER 90 Ca -0.01 0.25 -0.42 0.00 -0.26 0.00 0.00 58.87 58.43 2qkn n SER 90 Cb 0.50 0.75 -0.03 0.00 -0.26 0.00 0.00 64.21 65.17 2qkn n SER 90 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2qkn s THR 91 N -3.27 3.91 0.28 6.66 2.01 0.18 -4.99 115.64 120.42 2qkn s THR 91 Ca -0.03 0.75 -0.30 0.00 0.31 0.00 0.00 61.69 62.42 2qkn s THR 91 Cb 0.10 -4.72 -0.12 0.00 0.01 0.00 0.00 72.50 67.77 2qkn s THR 91 CO 0.82 -1.43 1.57 -2.65 -0.69 0.00 0.00 174.62 172.24 2qkn n PRO 92 N 8.70 2.59 -0.98 4.92 -0.02 -1.26 -2.01 135.00 146.94 2qkn n PRO 92 Ca 0.08 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 2qkn n PRO 92 Cb 0.49 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 2qkn n PRO 92 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qkn n GLY 93 N 2.24 0.65 3.69 -1.23 0.00 -1.26 -4.96 105.19 104.32 2qkn n GLY 93 Ca 0.09 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.56 2qkn n GLY 93 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2qkn n TRP 94 N -2.70 2.09 -0.30 1.61 -0.00 -0.85 -4.85 117.44 112.45 2qkn n TRP 94 Ca 0.00 0.41 0.11 0.00 -0.00 0.00 0.00 57.50 58.02 2qkn n TRP 94 Cb 0.00 -2.50 0.28 0.00 -0.00 0.00 0.00 31.31 29.09 2qkn n TRP 94 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2qkn n PRO 95 N 5.83 2.74 -3.64 5.87 -0.04 -1.26 -4.95 135.00 139.53 2qkn n PRO 95 Ca 0.27 -2.52 -0.38 0.00 -0.04 0.00 0.00 63.50 60.82 2qkn n PRO 95 Cb 0.16 -1.51 -0.12 0.00 -0.04 0.00 0.00 33.50 32.00 2qkn n PRO 95 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2qkn s TYR 96 N -1.02 3.18 0.58 0.54 2.02 -1.26 -4.88 117.35 116.50 2qkn s TYR 96 Ca 0.43 -0.45 -0.16 0.00 -0.37 0.00 0.00 57.07 56.52 2qkn s TYR 96 Cb 0.23 -2.36 -0.04 0.00 -0.40 0.00 0.00 41.96 39.39 2qkn s TYR 96 CO 0.30 -0.41 1.06 0.95 -1.57 0.00 0.00 175.55 175.89 2qkn s THR 97 N 1.64 3.71 -0.07 -0.71 -4.23 -1.26 -4.73 115.64 109.99 2qkn s THR 97 Ca 0.05 0.86 0.03 0.00 -1.18 0.00 0.00 61.69 61.45 2qkn s THR 97 Cb -0.17 -3.36 0.01 0.00 1.34 0.00 0.00 72.50 70.32 2qkn s THR 97 CO 0.07 -0.44 -0.15 -0.63 -0.54 0.00 0.00 174.62 172.94 2qkn s ILE 98 N -2.34 1.32 0.20 2.99 1.01 0.26 -0.68 121.20 123.96 2qkn s ILE 98 Ca 0.65 -0.60 0.11 0.00 0.00 0.00 0.00 60.65 60.82 2qkn s ILE 98 Cb -0.17 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.08 2qkn s ILE 98 CO 0.35 0.39 -0.23 0.00 0.00 0.00 0.00 174.94 175.44 2qkn s ALA 99 N 0.52 2.56 -0.44 9.38 0.00 -0.63 -0.03 121.76 133.12 2qkn s ALA 99 Ca -0.14 -1.67 -0.01 0.00 0.00 0.00 0.00 51.96 50.14 2qkn s ALA 99 Cb -0.15 -0.32 0.12 0.00 0.00 0.00 0.00 23.12 22.76 2qkn s ALA 99 CO 0.04 0.41 0.22 -0.06 0.00 0.00 0.00 175.76 176.37 2qkn s PHE 100 N -1.79 3.57 -0.37 0.00 0.08 -1.26 -0.19 117.98 118.02 2qkn s PHE 100 Ca 0.22 -2.59 -0.29 0.00 0.12 0.00 0.00 56.93 54.39 2qkn s PHE 100 Cb -0.07 -3.16 0.02 0.00 -0.57 0.00 0.00 43.02 39.24 2qkn s PHE 100 CO 0.10 -0.94 1.10 0.50 -0.10 0.00 0.00 175.22 175.88 2qkn s ARG 101 N 0.85 3.96 0.00 0.44 3.52 0.07 -4.93 118.95 122.86 2qkn s ARG 101 Ca 0.10 0.93 0.00 0.00 -0.13 0.00 0.00 55.73 56.63 2qkn s ARG 101 Cb -0.22 -3.79 0.00 0.00 -1.56 0.00 0.00 34.95 29.38 2qkn s ARG 101 CO -0.04 -1.05 0.00 0.41 -0.81 0.00 0.00 175.30 173.81 2qkn n GLY 102 N 4.17 1.60 0.00 8.12 0.00 -1.26 -2.47 105.19 115.34 2qkn n GLY 102 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2qkn n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qkn n ARG 103 N -0.49 0.37 -2.79 1.61 5.12 -1.26 -4.50 116.66 114.73 2qkn n ARG 103 Ca 0.00 -0.62 -0.16 0.00 -1.93 0.00 0.00 57.85 55.14 2qkn n ARG 103 Cb 0.00 -0.79 0.03 0.00 -1.16 0.00 0.00 32.46 30.53 2qkn n ARG 103 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qkn n GLY 104 N -0.12 -0.19 0.00 -0.13 0.00 -1.26 -4.88 105.19 98.61 2qkn n GLY 104 Ca 0.00 -0.13 0.13 0.00 0.00 0.00 0.00 46.02 46.02 2qkn n GLY 104 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2qkn n HIS 105 N -4.16 0.00 -1.19 1.61 8.25 -1.26 -0.98 115.22 117.49 2qkn n HIS 105 Ca -0.09 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.02 2qkn n HIS 105 Cb 0.59 0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.79 2qkn n HIS 105 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2qkn n SER 106 N -0.94 -0.50 -0.08 0.41 7.64 -1.26 -4.55 113.62 114.34 2qkn n SER 106 Ca 0.19 0.57 -0.06 0.00 1.01 0.00 0.00 58.87 60.59 2qkn n SER 106 Cb 0.09 -1.32 -0.16 0.00 -1.01 0.00 0.00 64.21 61.81 2qkn n SER 106 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2qkn n LEU 107 N -1.33 0.00 -2.63 -3.43 4.77 -1.26 -1.67 117.00 111.44 2qkn n LEU 107 Ca 0.11 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.98 2qkn n LEU 107 Cb 0.50 0.39 0.03 0.00 -2.33 0.00 0.00 43.42 42.01 2qkn n LEU 107 CO 0.50 0.39 -0.04 0.23 -1.33 0.00 0.00 177.39 177.14 2qkn n MET 108 N -2.64 1.73 -1.10 3.23 2.81 -1.26 -4.03 117.12 115.86 2qkn n MET 108 Ca -0.27 -3.54 -0.03 0.00 -1.81 0.00 0.00 57.70 52.05 2qkn n MET 108 Cb 1.03 -1.52 -0.01 0.00 -0.71 0.00 0.00 33.22 32.01 2qkn n MET 108 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qkn n GLY 109 N -0.25 0.63 0.33 3.03 0.00 -1.26 -4.92 105.19 102.74 2qkn n GLY 109 Ca 0.15 -0.43 0.21 0.00 0.00 0.00 0.00 46.02 45.96 2qkn n GLY 109 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2qkn h GLN 110 N 0.32 0.00 -0.70 1.61 7.50 -1.92 -1.40 115.11 120.51 2qkn h GLN 110 Ca -0.07 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.08 2qkn h GLN 110 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.88 2qkn h GLN 110 CO 0.10 0.00 0.00 0.00 -1.50 0.00 0.00 178.83 177.43 2qkn n ALA 111 N -2.10 2.39 -2.34 3.87 0.00 -1.26 -4.23 120.51 116.84 2qkn n ALA 111 Ca -0.03 -1.27 -0.25 0.00 0.00 0.00 0.00 53.44 51.90 2qkn n ALA 111 Cb 0.10 -0.93 0.01 0.00 0.00 0.00 0.00 19.45 18.63 2qkn n ALA 111 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2qkn s PHE 112 N -1.06 3.38 -0.44 0.00 0.08 -0.53 -4.60 117.98 114.82 2qkn s PHE 112 Ca 0.48 0.50 0.05 0.00 0.12 0.00 0.00 56.93 58.08 2qkn s PHE 112 Cb 0.25 -2.30 0.19 0.00 -0.57 0.00 0.00 43.02 40.59 2qkn s PHE 112 CO 0.34 -0.32 0.40 0.00 -0.10 0.00 0.00 175.22 175.54 2qkn n ALA 113 N -2.16 2.86 -1.49 5.36 0.00 -1.26 -3.72 120.51 120.10 2qkn n ALA 113 Ca 0.00 -3.33 -0.53 0.00 0.00 0.00 0.00 53.44 49.58 2qkn n ALA 113 Cb 0.57 -0.79 -0.08 0.00 0.00 0.00 0.00 19.45 19.15 2qkn n ALA 113 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2qkn n PRO 114 N 2.44 1.03 -1.11 0.00 -0.02 -1.26 -0.15 135.00 135.93 2qkn n PRO 114 Ca 0.27 0.31 -0.04 0.00 -2.02 0.00 0.00 63.50 62.03 2qkn n PRO 114 Cb 0.48 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 2qkn n PRO 114 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qkn n GLY 115 N 6.05 0.51 0.00 -1.23 0.00 -0.59 -4.81 105.19 105.12 2qkn n GLY 115 Ca 0.39 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.32 2qkn n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qkn n GLY 116 N -0.48 4.62 3.21 -0.02 0.00 0.79 -4.00 105.19 109.30 2qkn n GLY 116 Ca -0.04 -1.68 -0.33 0.00 0.00 0.00 0.00 46.02 43.97 2qkn n GLY 116 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qkn s VAL 117 N 3.57 2.22 -0.22 1.61 1.01 0.15 0.34 120.40 129.08 2qkn s VAL 117 Ca 0.00 -0.93 -0.08 0.00 0.00 0.00 0.00 61.98 60.97 2qkn s VAL 117 Cb 0.00 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 2qkn s VAL 117 CO 0.00 0.54 0.07 -0.69 0.00 0.00 0.00 175.10 175.03 2qkn s VAL 118 N 0.70 4.61 -0.26 2.92 1.01 -0.79 -1.61 120.40 126.99 2qkn s VAL 118 Ca -0.09 -0.08 -0.20 0.00 0.00 0.00 0.00 61.98 61.61 2qkn s VAL 118 Cb -0.16 -3.12 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 2qkn s VAL 118 CO 0.01 0.39 0.60 -0.69 0.00 0.00 0.00 175.10 175.42 2qkn s VAL 119 N 0.98 5.00 -1.30 2.92 1.01 0.73 -1.01 120.40 128.72 2qkn s VAL 119 Ca 0.04 1.06 -0.15 0.00 0.00 0.00 0.00 61.98 62.93 2qkn s VAL 119 Cb -0.14 -3.91 0.10 0.00 0.00 0.00 0.00 36.38 32.43 2qkn s VAL 119 CO 0.03 0.03 1.75 -3.20 0.00 0.00 0.00 175.10 173.71 2qkn n ASN 120 N 5.68 4.86 -0.39 3.32 2.85 0.54 -0.75 115.26 131.38 2qkn n ASN 120 Ca -0.01 -2.94 0.31 0.00 -0.11 0.00 0.00 54.58 51.82 2qkn n ASN 120 Cb 0.49 -1.66 0.58 0.00 1.24 0.00 0.00 39.78 40.43 2qkn n ASN 120 CO 0.00 0.00 0.00 0.24 -2.11 0.00 0.00 177.26 175.39 2qkn h MET 121 N 7.02 0.19 -0.37 1.20 2.86 -1.75 0.00 114.93 124.08 2qkn h MET 121 Ca 0.43 -0.01 0.11 0.00 -2.06 0.00 0.00 59.70 58.17 2qkn h MET 121 Cb 0.81 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.41 2qkn h MET 121 CO 1.49 0.13 0.45 0.00 1.06 0.00 0.00 176.91 180.03 2qkn h ALA 122 N 1.68 2.04 0.00 6.32 0.00 -1.79 -1.01 119.26 126.50 2qkn h ALA 122 Ca 0.75 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.64 2qkn h ALA 122 Cb 2.13 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.94 2qkn h ALA 122 CO -0.45 -0.64 -0.06 0.77 0.00 0.00 0.00 179.25 178.87 2qkn h SER 123 N 0.00 0.00 0.50 0.00 0.02 -1.20 -1.79 113.55 111.08 2qkn h SER 123 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2qkn h SER 123 Cb 1.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.61 2qkn h SER 123 CO -0.00 0.06 0.00 -0.07 -1.14 0.00 0.00 176.83 175.68 2qkn h LEU 124 N 0.00 0.00 -3.24 5.07 3.38 -1.01 -2.62 115.31 116.89 2qkn h LEU 124 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qkn h LEU 124 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2qkn h LEU 124 CO 0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2qkn n GLY 125 N -0.51 3.38 0.18 0.83 0.00 -0.67 -4.65 105.19 103.75 2qkn n GLY 125 Ca -0.01 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 45.02 2qkn n GLY 125 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qkn h ASP 126 N 2.72 -0.31 -2.98 1.61 3.32 -1.58 -3.45 116.42 115.75 2qkn h ASP 126 Ca 0.00 -0.22 -0.58 0.00 0.02 0.00 0.00 57.03 56.25 2qkn h ASP 126 Cb 1.44 0.08 0.16 0.00 0.22 0.00 0.00 39.33 41.23 2qkn h ASP 126 CO 0.24 0.13 -0.26 0.00 -1.72 0.00 0.00 179.24 177.63 2qkn n ALA 127 N -2.54 -0.86 1.35 3.45 0.00 -1.26 -4.87 120.51 115.77 2qkn n ALA 127 Ca -0.09 0.03 0.11 0.00 0.00 0.00 0.00 53.44 53.49 2qkn n ALA 127 Cb 0.26 -1.89 0.41 0.00 0.00 0.00 0.00 19.45 18.24 2qkn n ALA 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qkn n ALA 128 N -1.48 2.54 -3.61 0.00 0.00 -1.26 -4.88 120.51 111.81 2qkn n ALA 128 Ca 0.12 -0.47 -0.07 0.00 0.00 0.00 0.00 53.44 53.02 2qkn n ALA 128 Cb 0.46 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.73 2qkn n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qkn s ALA 129 N -1.83 -2.03 0.72 0.00 0.00 -1.26 -4.56 121.76 112.80 2qkn s ALA 129 Ca 0.32 1.73 -0.11 0.00 0.00 0.00 0.00 51.96 53.91 2qkn s ALA 129 Cb 0.17 -1.20 0.02 0.00 0.00 0.00 0.00 23.12 22.11 2qkn s ALA 129 CO 0.26 -0.25 1.07 -1.25 0.00 0.00 0.00 175.76 175.59 2qkn s PRO 130 N -0.66 2.76 0.54 0.00 0.04 -1.26 -5.10 135.00 131.32 2qkn s PRO 130 Ca 0.03 0.92 -0.21 0.00 0.04 0.00 0.00 61.00 61.77 2qkn s PRO 130 Cb -0.02 -1.97 -0.06 0.00 0.04 0.00 0.00 34.50 32.49 2qkn s PRO 130 CO -0.05 -1.21 1.20 -0.35 0.04 0.00 0.00 177.00 176.63 2qkn n PRO 131 N -3.20 1.45 0.00 0.56 -0.04 -1.26 -4.89 135.00 127.61 2qkn n PRO 131 Ca 0.08 0.54 0.12 0.00 -0.04 0.00 0.00 63.50 64.19 2qkn n PRO 131 Cb 0.54 -2.38 0.23 0.00 -0.04 0.00 0.00 33.50 31.84 2qkn n PRO 131 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2qkn n ARG 132 N -0.79 1.53 -3.69 0.54 5.12 -1.26 -4.77 116.66 113.34 2qkn n ARG 132 Ca 0.11 -1.13 -0.26 0.00 -1.93 0.00 0.00 57.85 54.64 2qkn n ARG 132 Cb 0.44 -1.48 -0.17 0.00 -1.16 0.00 0.00 32.46 30.10 2qkn n ARG 132 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2qkn s ILE 133 N -2.25 0.21 -0.15 0.55 1.01 -1.26 0.14 121.20 119.46 2qkn s ILE 133 Ca 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.71 2qkn s ILE 133 Cb 0.20 -0.70 0.02 0.00 0.01 0.00 0.00 42.46 41.99 2qkn s ILE 133 CO 0.43 -0.13 -0.14 0.20 0.00 0.00 0.00 174.94 175.31 2qkn s ASN 134 N 2.01 2.67 0.20 3.58 0.01 0.69 -4.96 114.94 119.13 2qkn s ASN 134 Ca 0.02 -0.48 -0.30 0.00 -0.71 0.00 0.00 52.86 51.39 2qkn s ASN 134 Cb -0.15 -1.17 -0.08 0.00 0.41 0.00 0.00 41.25 40.26 2qkn s ASN 134 CO -0.07 -0.06 1.05 -0.69 -1.51 0.00 0.00 177.10 175.82 2qkn s VAL 135 N 1.49 3.91 0.65 1.60 1.01 -1.26 -0.48 120.40 127.32 2qkn s VAL 135 Ca 0.05 1.74 -0.17 0.00 0.00 0.00 0.00 61.98 63.59 2qkn s VAL 135 Cb -0.13 -4.11 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 2qkn s VAL 135 CO -0.11 0.34 1.23 -0.94 0.00 0.00 0.00 175.10 175.63 2qkn s SER 136 N -0.44 4.71 0.37 3.32 1.04 -0.12 -4.89 113.70 117.70 2qkn s SER 136 Ca 0.47 2.45 0.07 0.00 0.48 0.00 0.00 55.95 59.41 2qkn s SER 136 Cb -0.28 -2.60 0.78 0.00 0.10 0.00 0.00 66.02 64.02 2qkn s SER 136 CO 0.35 -1.92 1.96 0.00 0.98 0.00 0.00 173.24 174.61 2qkn h ALA 137 N 0.42 1.75 -0.04 5.32 0.00 -1.94 0.29 119.26 125.06 2qkn h ALA 137 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2qkn h ALA 137 Cb 1.31 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2qkn h ALA 137 CO 0.53 0.13 0.00 -0.40 0.00 0.00 0.00 179.25 179.51 2qkn n ASP 138 N -4.48 0.94 -2.04 0.00 5.68 -1.26 -4.93 116.55 110.45 2qkn n ASP 138 Ca 0.11 -1.39 -0.20 0.00 -0.50 0.00 0.00 54.79 52.81 2qkn n ASP 138 Cb 0.25 -0.02 -0.03 0.00 -1.14 0.00 0.00 41.12 40.19 2qkn n ASP 138 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2qkn n GLY 139 N 1.07 0.18 0.07 6.12 0.00 0.09 -4.88 105.19 107.84 2qkn n GLY 139 Ca 0.19 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.26 2qkn n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qkn n ARG 140 N -2.76 0.63 -3.92 1.61 5.12 -1.26 -4.81 116.66 111.27 2qkn n ARG 140 Ca -0.22 -0.02 -0.10 0.00 -1.93 0.00 0.00 57.85 55.58 2qkn n ARG 140 Cb 0.67 -1.69 -0.02 0.00 -1.16 0.00 0.00 32.46 30.26 2qkn n ARG 140 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 2qkn s TYR 141 N -3.43 0.34 -0.04 -1.55 -0.85 -1.26 -2.62 117.35 107.94 2qkn s TYR 141 Ca -0.04 -0.80 -0.01 0.00 -0.52 0.00 0.00 57.07 55.70 2qkn s TYR 141 Cb 0.12 0.46 0.03 0.00 0.38 0.00 0.00 41.96 42.95 2qkn s TYR 141 CO 0.84 -1.29 0.02 0.54 -1.52 0.00 0.00 175.55 174.15 2qkn s VAL 142 N -3.14 0.10 -0.07 -3.49 0.11 0.76 -0.94 120.40 113.74 2qkn s VAL 142 Ca 0.20 0.21 -0.23 0.00 -2.93 0.00 0.00 61.98 59.23 2qkn s VAL 142 Cb -0.03 -0.27 -0.04 0.00 -1.53 0.00 0.00 36.38 34.51 2qkn s VAL 142 CO 0.12 0.17 0.68 -1.81 -3.33 0.00 0.00 175.10 170.94 2qkn s ASP 143 N 1.58 6.96 0.01 3.54 1.01 0.37 -0.67 116.67 129.46 2qkn s ASP 143 Ca -0.02 1.16 0.02 0.00 0.71 0.00 0.00 52.55 54.41 2qkn s ASP 143 Cb -0.13 -2.40 -0.01 0.00 1.01 0.00 0.00 42.92 41.39 2qkn s ASP 143 CO -0.03 -0.11 -0.05 0.00 0.21 0.00 0.00 175.17 175.19 2qkn s ALA 144 N 0.79 0.43 0.43 5.23 0.00 -0.54 -0.22 121.76 127.87 2qkn s ALA 144 Ca 0.37 -0.33 -0.25 0.00 0.00 0.00 0.00 51.96 51.75 2qkn s ALA 144 Cb -0.17 -0.07 -0.08 0.00 0.00 0.00 0.00 23.12 22.80 2qkn s ALA 144 CO 0.17 0.07 1.27 0.20 0.00 0.00 0.00 175.76 177.47 2qkn s GLY 145 N -0.43 2.89 0.62 0.00 0.00 0.12 -0.87 107.32 109.65 2qkn s GLY 145 Ca -0.01 1.16 0.31 0.00 0.00 0.00 0.00 44.72 46.19 2qkn s GLY 145 CO -0.00 1.71 2.08 -1.33 0.00 0.00 0.00 173.10 175.56 2qkn h GLY 146 N 2.46 0.00 1.21 0.20 0.00 -1.26 -1.10 103.07 104.59 2qkn h GLY 146 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 2qkn h GLY 146 CO 0.62 0.00 -0.58 -1.84 0.00 0.00 0.00 176.54 174.73 2qkn n GLU 147 N -3.49 0.29 -1.91 4.80 0.00 -1.26 -0.76 120.64 118.29 2qkn n GLU 147 Ca 0.01 0.09 -0.38 0.00 0.00 0.00 0.00 57.16 56.88 2qkn n GLU 147 Cb 0.34 -1.69 0.03 0.00 0.00 0.00 0.00 31.44 30.11 2qkn n GLU 147 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.13 176.48 2qkn s GLN 148 N -3.16 3.31 0.04 3.44 -1.52 -0.42 -4.70 119.66 116.65 2qkn s GLN 148 Ca 0.07 2.11 -0.14 0.00 -1.95 0.00 0.00 55.36 55.44 2qkn s GLN 148 Cb 0.13 -2.30 -0.06 0.00 -0.22 0.00 0.00 33.01 30.57 2qkn s GLN 148 CO 0.71 -1.02 0.43 0.14 -0.25 0.00 0.00 175.29 175.31 2qkn s VAL 149 N -1.37 5.00 0.46 1.09 -7.23 -1.26 -0.63 120.40 116.47 2qkn s VAL 149 Ca 0.69 0.78 0.24 0.00 -1.81 0.00 0.00 61.98 61.88 2qkn s VAL 149 Cb -0.37 -3.71 0.43 0.00 0.56 0.00 0.00 36.38 33.29 2qkn s VAL 149 CO 0.44 0.48 1.84 -0.50 -0.31 0.00 0.00 175.10 177.05 2qkn h TRP 150 N 4.35 0.35 -0.83 2.82 4.06 -0.74 -0.91 115.95 125.04 2qkn h TRP 150 Ca -0.51 0.01 0.03 0.00 2.06 0.00 0.00 58.89 60.49 2qkn h TRP 150 Cb 1.21 -0.10 -0.05 0.00 -1.00 0.00 0.00 29.16 29.22 2qkn h TRP 150 CO 0.69 0.07 0.53 0.97 -3.56 0.00 0.00 178.44 177.14 2qkn h ILE 151 N 0.24 1.14 -0.03 1.49 6.09 -1.55 0.09 117.51 124.97 2qkn h ILE 151 Ca 0.49 -0.36 -0.14 0.00 -1.37 0.00 0.00 64.86 63.49 2qkn h ILE 151 Cb 1.52 0.00 -0.02 0.00 0.47 0.00 0.00 36.82 38.80 2qkn h ILE 151 CO -0.14 0.19 -0.63 0.44 -3.07 0.00 0.00 178.15 174.95 2qkn h ASP 152 N 1.04 0.14 -0.59 2.19 3.32 -1.48 -2.14 116.42 118.90 2qkn h ASP 152 Ca 0.33 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.26 2qkn h ASP 152 Cb -0.00 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 2qkn h ASP 152 CO -0.11 0.73 0.24 0.58 -1.72 0.00 0.00 179.24 178.96 2qkn h VAL 153 N 0.09 1.23 0.43 -1.35 2.07 -1.08 -1.57 116.25 116.07 2qkn h VAL 153 Ca -0.01 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 2qkn h VAL 153 Cb 1.13 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 2qkn h VAL 153 CO 0.09 0.27 -0.32 0.25 0.02 0.00 0.00 177.57 177.88 2qkn h LEU 154 N 0.81 -0.83 -0.40 2.57 5.85 -0.72 -1.21 115.31 121.37 2qkn h LEU 154 Ca 0.20 0.06 0.06 0.00 0.84 0.00 0.00 57.88 59.04 2qkn h LEU 154 Cb 0.19 0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 2qkn h LEU 154 CO -0.02 -0.48 0.09 0.03 -0.34 0.00 0.00 178.44 177.73 2qkn h ARG 155 N -0.74 0.22 -0.76 1.25 3.08 -1.26 0.64 114.38 116.81 2qkn h ARG 155 Ca -0.04 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 2qkn h ARG 155 Cb 0.63 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.60 2qkn h ARG 155 CO 0.01 0.15 0.41 0.00 -1.07 0.00 0.00 179.97 179.47 2qkn h ALA 156 N 1.30 1.30 -0.02 0.04 0.00 -1.21 -1.61 119.26 119.05 2qkn h ALA 156 Ca 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2qkn h ALA 156 Cb 0.22 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2qkn h ALA 156 CO -0.24 0.57 -0.01 0.77 0.00 0.00 0.00 179.25 180.34 2qkn h SER 157 N 1.06 0.04 -0.74 0.00 0.02 -0.48 -3.08 113.55 110.37 2qkn h SER 157 Ca 0.27 -0.40 0.07 0.00 -0.84 0.00 0.00 61.79 60.88 2qkn h SER 157 Cb 0.03 -0.01 -0.05 0.00 0.14 0.00 0.00 62.40 62.51 2qkn h SER 157 CO -0.04 0.44 0.48 -0.07 -1.14 0.00 0.00 176.83 176.50 2qkn h LEU 158 N -0.35 0.68 -2.70 5.07 3.38 -0.21 0.43 115.31 121.60 2qkn h LEU 158 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2qkn h LEU 158 Cb 0.42 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2qkn h LEU 158 CO 0.00 0.43 0.09 0.00 0.09 0.00 0.00 178.44 179.06 2qkn h ALA 159 N 1.60 1.14 -0.26 1.53 0.00 -1.20 0.16 119.26 122.22 2qkn h ALA 159 Ca 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2qkn h ALA 159 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2qkn h ALA 159 CO -0.11 -0.09 0.00 0.54 0.00 0.00 0.00 179.25 179.59 2qkn n ARG 160 N -3.09 2.85 -1.19 0.00 5.12 0.15 -4.97 116.66 115.53 2qkn n ARG 160 Ca -0.03 -2.64 -0.06 0.00 -1.93 0.00 0.00 57.85 53.19 2qkn n ARG 160 Cb 0.16 -1.70 -0.03 0.00 -1.16 0.00 0.00 32.46 29.73 2qkn n ARG 160 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qkn n GLY 161 N -0.33 0.81 3.48 -0.13 0.00 0.54 -5.00 105.19 104.57 2qkn n GLY 161 Ca 0.19 -0.28 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 2qkn n GLY 161 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qkn s VAL 162 N -2.00 0.57 -0.23 1.61 -7.23 -0.78 -0.48 120.40 111.86 2qkn s VAL 162 Ca 0.00 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.89 2qkn s VAL 162 Cb 0.00 -2.39 0.15 0.00 0.56 0.00 0.00 36.38 34.70 2qkn s VAL 162 CO 0.00 0.00 1.15 0.00 -0.31 0.00 0.00 175.10 175.94 2qkn s ALA 163 N -3.26 -2.03 0.89 1.32 0.00 -0.79 -1.94 121.76 115.95 2qkn s ALA 163 Ca 0.26 1.73 -0.13 0.00 0.00 0.00 0.00 51.96 53.82 2qkn s ALA 163 Cb 0.03 -1.18 0.05 0.00 0.00 0.00 0.00 23.12 22.01 2qkn s ALA 163 CO 0.16 -0.25 0.64 -2.30 0.00 0.00 0.00 175.76 174.00 2qkn n PRO 164 N 1.03 -0.16 -0.04 0.00 -0.02 -1.26 -1.45 135.00 133.10 2qkn n PRO 164 Ca -0.08 0.01 0.03 0.00 -2.02 0.00 0.00 63.50 61.44 2qkn n PRO 164 Cb 0.58 -2.01 -0.16 0.00 -0.02 0.00 0.00 33.50 31.89 2qkn n PRO 164 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2qkn n ARG 165 N -2.13 0.67 -5.24 -0.52 1.74 -1.25 -4.74 116.66 105.19 2qkn n ARG 165 Ca 0.09 -0.11 -0.31 0.00 -0.77 0.00 0.00 57.85 56.74 2qkn n ARG 165 Cb 0.52 -1.53 -0.17 0.00 -1.02 0.00 0.00 32.46 30.27 2qkn n ARG 165 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2qkn s SER 166 N -4.92 3.03 0.00 0.55 0.15 -1.26 -4.85 113.70 106.40 2qkn s SER 166 Ca -0.09 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.05 2qkn s SER 166 Cb 0.11 -0.95 0.00 0.00 -1.71 0.00 0.00 66.02 63.47 2qkn s SER 166 CO 0.88 0.22 0.00 0.79 1.20 0.00 0.00 173.24 176.33 2qkn n TRP 167 N 3.08 0.00 -4.26 3.44 7.02 -1.26 -4.77 117.44 120.68 2qkn n TRP 167 Ca -0.18 0.00 -0.19 0.00 -1.02 0.00 0.00 57.50 56.11 2qkn n TRP 167 Cb 0.52 0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.30 2qkn n TRP 167 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2qkn s THR 168 N -0.91 1.45 0.49 -0.99 -4.23 -1.26 -2.83 115.64 107.36 2qkn s THR 168 Ca 0.00 -1.72 0.15 0.00 -1.18 0.00 0.00 61.69 58.94 2qkn s THR 168 Cb 0.00 -1.57 0.23 0.00 1.34 0.00 0.00 72.50 72.50 2qkn s THR 168 CO 0.00 -0.35 2.08 0.44 -0.54 0.00 0.00 174.62 176.25 2qkn h ASP 169 N 3.56 0.01 -3.31 3.99 3.32 -1.94 -3.40 116.42 118.65 2qkn h ASP 169 Ca -0.41 -0.00 -0.66 0.00 0.02 0.00 0.00 57.03 55.98 2qkn h ASP 169 Cb 1.20 -0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.46 2qkn h ASP 169 CO 0.49 0.09 -0.76 -0.47 -1.72 0.00 0.00 179.24 176.87 2qkn s TYR 170 N -4.89 2.87 -1.06 4.55 5.04 -1.26 -4.46 117.35 118.14 2qkn s TYR 170 Ca -0.05 -0.93 0.28 0.00 -2.44 0.00 0.00 57.07 53.93 2qkn s TYR 170 Cb 0.16 -1.97 0.98 0.00 0.35 0.00 0.00 41.96 41.49 2qkn s TYR 170 CO 0.68 -0.45 1.74 1.28 -1.34 0.00 0.00 175.55 177.46 2qkn n LEU 171 N 4.24 0.22 -2.71 6.97 4.77 -1.26 -4.37 117.00 124.85 2qkn n LEU 171 Ca -0.19 0.28 -0.29 0.00 -0.03 0.00 0.00 56.01 55.78 2qkn n LEU 171 Cb 0.51 -0.38 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 2qkn n LEU 171 CO 0.29 0.05 1.82 -1.22 -1.33 0.00 0.00 177.39 177.01 2qkn n TYR 172 N -1.45 1.73 -4.33 -1.77 4.02 -1.26 -1.52 117.16 112.57 2qkn n TYR 172 Ca 0.07 -2.14 -0.20 0.00 -0.01 0.00 0.00 57.90 55.62 2qkn n TYR 172 Cb 0.33 -1.53 -0.11 0.00 -0.02 0.00 0.00 39.34 38.01 2qkn n TYR 172 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2qkn s LEU 173 N -1.95 2.48 0.43 7.72 1.43 -1.26 -4.91 118.68 122.62 2qkn s LEU 173 Ca 0.59 -0.92 -0.06 0.00 -1.03 0.00 0.00 54.13 52.71 2qkn s LEU 173 Cb 0.33 -0.74 -0.04 0.00 0.03 0.00 0.00 46.19 45.76 2qkn s LEU 173 CO -0.17 -0.10 0.73 0.42 0.23 0.00 0.00 176.35 177.46 2qkn s THR 174 N -2.42 4.92 0.08 5.49 -4.23 -1.26 -0.68 115.64 117.54 2qkn s THR 174 Ca 0.18 0.20 -0.26 0.00 -1.18 0.00 0.00 61.69 60.63 2qkn s THR 174 Cb -0.04 -3.83 -0.16 0.00 1.34 0.00 0.00 72.50 69.82 2qkn s THR 174 CO 0.06 -0.70 1.71 0.58 -0.54 0.00 0.00 174.62 175.73 2qkn h VAL 175 N 0.57 0.81 0.00 2.29 2.07 -0.87 -1.96 116.25 119.15 2qkn h VAL 175 Ca -0.47 -0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 2qkn h VAL 175 Cb 1.20 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 31.78 2qkn h VAL 175 CO 0.62 0.00 -0.15 1.23 0.02 0.00 0.00 177.57 179.29 2qkn h GLY 176 N -0.27 0.00 0.47 2.17 0.00 -1.22 -1.81 103.07 102.41 2qkn h GLY 176 Ca -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 2qkn h GLY 176 CO 0.04 0.00 -0.04 -1.33 0.00 0.00 0.00 176.54 175.22 2qkn h GLY 177 N 0.46 -0.11 1.81 4.60 0.00 -1.68 -2.51 103.07 105.64 2qkn h GLY 177 Ca -0.00 0.04 -0.08 0.00 0.00 0.00 0.00 47.33 47.29 2qkn h GLY 177 CO 0.02 -0.04 -0.28 -0.91 0.00 0.00 0.00 176.54 175.32 2qkn h THR 178 N -0.64 1.25 0.00 4.70 1.35 -1.29 -2.31 112.91 115.97 2qkn h THR 178 Ca -0.01 -1.18 -0.02 0.00 -0.55 0.00 0.00 66.41 64.65 2qkn h THR 178 Cb 0.52 1.48 -0.00 0.00 -1.73 0.00 0.00 68.15 68.42 2qkn h THR 178 CO 0.02 0.36 -0.11 -0.07 -0.25 0.00 0.00 175.52 175.47 2qkn h LEU 179 N 0.20 0.00 -0.05 3.87 3.38 -1.37 0.10 115.31 121.44 2qkn h LEU 179 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2qkn h LEU 179 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2qkn h LEU 179 CO 0.04 0.11 -0.05 -1.20 0.09 0.00 0.00 178.44 177.43 2qkn n SER 180 N -3.23 0.13 0.00 -0.43 7.64 -0.87 -0.02 113.62 116.83 2qkn n SER 180 Ca 0.01 -0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.80 2qkn n SER 180 Cb 0.38 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2qkn n SER 180 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2qkn n ASN 181 N -1.28 0.00 0.02 6.43 3.02 -0.85 0.70 115.26 123.30 2qkn n ASN 181 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 2qkn n ASN 181 Cb 0.28 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 2qkn n ASN 181 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qkn n ALA 182 N -2.39 0.00 -1.11 5.41 0.00 0.29 -4.16 120.51 118.56 2qkn n ALA 182 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2qkn n ALA 182 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2qkn n ALA 182 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qkn n GLY 183 N -1.05 -2.01 3.38 0.00 0.00 -1.17 -2.14 105.19 102.19 2qkn n GLY 183 Ca 0.00 -0.37 -0.25 0.00 0.00 0.00 0.00 46.02 45.40 2qkn n GLY 183 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qkn s ILE 184 N -0.06 2.09 0.00 -0.61 -4.36 -1.24 -0.50 121.20 116.52 2qkn s ILE 184 Ca 0.00 -1.93 0.00 0.00 -0.26 0.00 0.00 60.65 58.46 2qkn s ILE 184 Cb 0.00 -1.96 0.00 0.00 1.25 0.00 0.00 42.46 41.75 2qkn s ILE 184 CO 0.00 -0.17 0.00 -0.24 0.24 0.00 0.00 174.94 174.77 2qkn n SER 185 N 0.39 0.00 0.00 4.36 2.88 -1.13 -4.05 113.62 116.07 2qkn n SER 185 Ca -0.14 -0.91 0.04 0.00 -1.33 0.00 0.00 58.87 56.53 2qkn n SER 185 Cb 0.56 0.00 0.19 0.00 -0.75 0.00 0.00 64.21 64.20 2qkn n SER 185 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qkn n GLY 186 N 0.00 -0.68 0.03 0.46 0.00 -1.26 -2.25 105.19 101.49 2qkn n GLY 186 Ca 0.00 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.10 2qkn n GLY 186 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qkn n GLN 187 N -1.41 0.26 0.29 1.61 3.00 -1.26 -1.52 117.38 118.35 2qkn n GLN 187 Ca 0.03 -0.01 0.15 0.00 -0.01 0.00 0.00 57.00 57.16 2qkn n GLN 187 Cb 0.08 -1.58 0.89 0.00 0.00 0.00 0.00 30.24 29.63 2qkn n GLN 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2qkn h ALA 188 N 2.59 1.48 -0.15 -1.58 0.00 -1.64 -1.27 119.26 118.69 2qkn h ALA 188 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2qkn h ALA 188 Cb 0.71 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2qkn h ALA 188 CO 0.00 0.03 -0.05 0.27 0.00 0.00 0.00 179.25 179.50 2qkn h PHE 189 N 0.00 0.22 0.00 0.00 -5.15 -1.80 0.16 116.94 110.37 2qkn h PHE 189 Ca -0.00 -0.01 -0.23 0.00 -0.20 0.00 0.00 57.97 57.53 2qkn h PHE 189 Cb 0.05 -0.07 -0.04 0.00 0.22 0.00 0.00 35.95 36.11 2qkn h PHE 189 CO 0.00 0.28 -1.87 2.89 -2.00 0.00 0.00 178.31 177.61 2qkn n ARG 190 N -4.36 1.84 0.00 6.09 1.85 -0.89 -4.36 116.66 116.83 2qkn n ARG 190 Ca -0.01 0.00 0.09 0.00 -1.00 0.00 0.00 57.85 56.93 2qkn n ARG 190 Cb 0.20 -1.32 0.00 0.00 -1.05 0.00 0.00 32.46 30.29 2qkn n ARG 190 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2qkn n HIS 191 N -2.50 0.00 -0.17 2.89 8.25 -0.53 -5.02 115.22 118.14 2qkn n HIS 191 Ca -0.21 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.27 2qkn n HIS 191 Cb 0.90 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 32.00 2qkn n HIS 191 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qkn n GLY 192 N 1.20 -2.11 3.51 -1.41 0.00 0.04 -4.73 105.19 101.70 2qkn n GLY 192 Ca 0.08 -1.45 -0.29 0.00 0.00 0.00 0.00 46.02 44.36 2qkn n GLY 192 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qkn s PRO 193 N -2.28 -1.04 0.47 1.61 0.04 -1.26 -4.32 135.00 128.22 2qkn s PRO 193 Ca 0.00 0.50 0.17 0.00 0.04 0.00 0.00 61.00 61.70 2qkn s PRO 193 Cb 0.00 -1.57 1.14 0.00 0.04 0.00 0.00 34.50 34.11 2qkn s PRO 193 CO 0.00 -3.71 2.00 1.96 0.04 0.00 0.00 177.00 177.29 2qkn h GLN 194 N -2.60 0.26 0.00 4.56 4.20 -0.45 0.23 115.11 121.31 2qkn h GLN 194 Ca -0.55 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.14 2qkn h GLN 194 Cb 1.33 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.05 2qkn h GLN 194 CO 0.47 0.17 0.00 0.44 -0.67 0.00 0.00 178.83 179.24 2qkn n ILE 195 N -4.46 1.19 0.27 2.54 -5.35 -0.91 -1.29 119.36 111.36 2qkn n ILE 195 Ca 0.08 0.30 0.12 0.00 -0.27 0.00 0.00 62.75 62.98 2qkn n ILE 195 Cb 0.39 -1.11 0.25 0.00 -1.74 0.00 0.00 39.64 37.43 2qkn n ILE 195 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 2qkn n SER 196 N -1.53 3.40 -1.71 7.28 7.64 0.07 -4.25 113.62 124.51 2qkn n SER 196 Ca 0.03 -1.98 -0.10 0.00 1.01 0.00 0.00 58.87 57.83 2qkn n SER 196 Cb 0.14 -0.28 0.08 0.00 -1.01 0.00 0.00 64.21 63.13 2qkn n SER 196 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2qkn n ASN 197 N 1.43 3.17 -4.20 6.43 3.02 -0.41 -4.98 115.26 119.72 2qkn n ASN 197 Ca 0.20 -3.36 -0.33 0.00 -0.03 0.00 0.00 54.58 51.06 2qkn n ASN 197 Cb 0.59 -0.41 -0.16 0.00 -0.61 0.00 0.00 39.78 39.19 2qkn n ASN 197 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2qkn s VAL 198 N -3.69 2.31 -0.01 2.41 1.01 -1.25 -1.79 120.40 119.38 2qkn s VAL 198 Ca 0.42 -0.89 -0.17 0.00 0.00 0.00 0.00 61.98 61.34 2qkn s VAL 198 Cb 0.38 -1.95 -0.33 0.00 0.00 0.00 0.00 36.38 34.48 2qkn s VAL 198 CO -0.02 0.53 0.89 -0.07 0.00 0.00 0.00 175.10 176.43 2qkn h LEU 199 N 7.38 0.69 -7.62 3.92 4.07 -1.10 -3.49 115.31 119.16 2qkn h LEU 199 Ca -0.34 -0.93 0.15 0.00 0.08 0.00 0.00 57.88 56.85 2qkn h LEU 199 Cb 1.19 -0.22 -0.08 0.00 1.08 0.00 0.00 40.66 42.62 2qkn h LEU 199 CO 0.57 1.64 0.45 -1.83 -1.08 0.00 0.00 178.44 178.18 2qkn s GLU 200 N -2.54 1.24 0.13 1.13 -1.05 -1.25 -4.49 118.70 111.86 2qkn s GLU 200 Ca -0.12 -0.66 -0.09 0.00 -0.15 0.00 0.00 54.97 53.95 2qkn s GLU 200 Cb 0.03 0.44 -0.00 0.00 -0.44 0.00 0.00 34.13 34.16 2qkn s GLU 200 CO 0.89 -0.56 0.25 -1.64 0.95 0.00 0.00 175.26 175.15 2qkn s MET 201 N -3.36 1.00 -0.20 -4.83 -1.94 -0.47 -0.53 119.30 108.97 2qkn s MET 201 Ca 0.11 -1.04 -0.04 0.00 -1.71 0.00 0.00 55.69 53.01 2qkn s MET 201 Cb -0.02 0.37 -0.02 0.00 2.01 0.00 0.00 34.83 37.17 2qkn s MET 201 CO 0.01 -0.35 -0.02 -0.51 -0.01 0.00 0.00 175.02 174.15 2qkn s ASP 202 N -2.91 4.68 -0.01 3.03 1.01 -0.21 -0.64 116.67 121.63 2qkn s ASP 202 Ca 0.10 -0.24 0.04 0.00 0.71 0.00 0.00 52.55 53.16 2qkn s ASP 202 Cb 0.04 -1.79 -0.01 0.00 1.01 0.00 0.00 42.92 42.16 2qkn s ASP 202 CO -0.06 0.06 -0.12 -0.69 0.21 0.00 0.00 175.17 174.57 2qkn s VAL 203 N 1.02 0.94 -0.32 -1.27 1.01 0.74 -1.00 120.40 121.52 2qkn s VAL 203 Ca 0.01 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 2qkn s VAL 203 Cb -0.14 -0.79 0.03 0.00 0.00 0.00 0.00 36.38 35.47 2qkn s VAL 203 CO 0.01 0.24 0.09 -0.63 0.00 0.00 0.00 175.10 174.82 2qkn s ILE 204 N -0.32 3.86 1.02 2.22 1.01 -0.83 0.43 121.20 128.60 2qkn s ILE 204 Ca 0.04 -0.95 -0.14 0.00 0.00 0.00 0.00 60.65 59.60 2qkn s ILE 204 Cb -0.05 -3.10 0.20 0.00 0.01 0.00 0.00 42.46 39.52 2qkn s ILE 204 CO -0.00 -0.07 1.13 0.42 0.00 0.00 0.00 174.94 176.42 2qkn s THR 205 N 1.44 1.91 -0.26 2.92 -4.23 -0.72 -1.83 115.64 114.88 2qkn s THR 205 Ca 0.00 0.00 0.23 0.00 -1.18 0.00 0.00 61.69 60.74 2qkn s THR 205 Cb -0.18 -2.62 0.23 0.00 1.34 0.00 0.00 72.50 71.27 2qkn s THR 205 CO 0.03 0.00 1.70 0.61 -0.54 0.00 0.00 174.62 176.41 2qkn n GLY 206 N -1.63 -1.01 0.06 3.99 0.00 0.13 -0.07 105.19 106.66 2qkn n GLY 206 Ca 0.08 0.17 0.13 0.00 0.00 0.00 0.00 46.02 46.40 2qkn n GLY 206 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2qkn n HIS 207 N -2.28 0.52 -0.43 1.61 8.25 -1.24 -4.38 115.22 117.26 2qkn n HIS 207 Ca -0.00 0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 2qkn n HIS 207 Cb 0.10 -0.67 0.00 0.00 1.12 0.00 0.00 29.99 30.54 2qkn n HIS 207 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qkn n GLY 208 N 1.38 0.76 3.75 -1.41 0.00 0.91 -4.46 105.19 106.11 2qkn n GLY 208 Ca 0.05 -0.25 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 2qkn n GLY 208 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qkn s GLU 209 N -0.72 4.19 -0.37 1.61 2.12 -1.26 -4.67 118.70 119.59 2qkn s GLU 209 Ca 0.00 0.17 -0.28 0.00 0.36 0.00 0.00 54.97 55.22 2qkn s GLU 209 Cb 0.00 -3.39 0.02 0.00 0.26 0.00 0.00 34.13 31.02 2qkn s GLU 209 CO 0.00 0.31 1.03 1.41 -0.54 0.00 0.00 175.26 177.46 2qkn s MET 210 N 0.24 3.90 -0.07 4.30 -2.45 -1.26 -1.75 119.30 122.21 2qkn s MET 210 Ca 0.18 0.76 0.03 0.00 -1.25 0.00 0.00 55.69 55.42 2qkn s MET 210 Cb -0.14 -3.80 0.01 0.00 1.25 0.00 0.00 34.83 32.15 2qkn s MET 210 CO 0.06 -1.02 -0.15 0.08 1.05 0.00 0.00 175.02 175.03 2qkn s VAL 211 N 3.75 1.36 -0.06 10.11 1.01 0.17 -4.97 120.40 131.77 2qkn s VAL 211 Ca 0.43 -0.62 -0.16 0.00 0.00 0.00 0.00 61.98 61.62 2qkn s VAL 211 Cb -0.11 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.01 2qkn s VAL 211 CO 0.20 0.40 0.43 -0.89 0.00 0.00 0.00 175.10 175.25 2qkn s THR 212 N 0.48 5.11 0.07 3.92 2.01 -1.26 -0.18 115.64 125.79 2qkn s THR 212 Ca -0.13 0.87 0.00 0.00 0.31 0.00 0.00 61.69 62.75 2qkn s THR 212 Cb -0.15 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.56 2qkn s THR 212 CO 0.04 0.45 -0.05 0.00 -0.69 0.00 0.00 174.62 174.38 2qkn n SER 214 N 0.12 -0.06 0.22 0.00 3.41 0.20 -1.37 113.62 116.15 2qkn n SER 214 Ca -0.14 -1.03 0.08 0.00 -0.26 0.00 0.00 58.87 57.53 2qkn n SER 214 Cb 0.61 0.09 0.51 0.00 -0.26 0.00 0.00 64.21 65.15 2qkn n SER 214 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2qkn h LYS 215 N 0.00 0.00 0.08 4.33 1.79 -1.91 -2.97 116.57 117.89 2qkn h LYS 215 Ca -0.01 0.00 -0.35 0.00 -2.18 0.00 0.00 60.65 58.11 2qkn h LYS 215 Cb 0.04 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.66 2qkn h LYS 215 CO 0.01 0.26 -1.97 1.04 -1.08 0.00 0.00 179.45 177.71 2qkn n GLN 216 N -3.71 0.72 -4.51 3.15 3.00 -1.26 -4.61 117.38 110.16 2qkn n GLN 216 Ca -0.01 0.25 -0.33 0.00 -0.01 0.00 0.00 57.00 56.90 2qkn n GLN 216 Cb 0.37 -1.71 -0.16 0.00 0.00 0.00 0.00 30.24 28.74 2qkn n GLN 216 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 2qkn s LEU 217 N -6.71 2.29 -1.34 1.08 2.96 -1.20 -4.71 118.68 111.06 2qkn s LEU 217 Ca -0.18 -0.55 -0.03 0.00 -0.22 0.00 0.00 54.13 53.15 2qkn s LEU 217 Cb 0.07 -1.51 -0.00 0.00 0.50 0.00 0.00 46.19 45.25 2qkn s LEU 217 CO 0.77 0.07 0.54 0.59 -1.32 0.00 0.00 176.35 177.00 2qkn n ASN 218 N 4.17 -1.23 0.23 3.68 5.03 -1.26 0.60 115.26 126.48 2qkn n ASN 218 Ca -0.20 -0.96 0.07 0.00 0.87 0.00 0.00 54.58 54.36 2qkn n ASN 218 Cb 0.51 -3.34 0.61 0.00 -1.02 0.00 0.00 39.78 36.53 2qkn n ASN 218 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2qkn h ALA 219 N 0.84 1.94 -0.57 5.41 0.00 -1.77 -2.25 119.26 122.85 2qkn h ALA 219 Ca -0.63 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.17 2qkn h ALA 219 Cb 1.37 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 2qkn h ALA 219 CO 0.59 0.05 0.02 0.38 0.00 0.00 0.00 179.25 180.29 2qkn h ASP 220 N 0.05 0.94 -0.18 0.00 2.03 -1.88 -1.01 116.42 116.37 2qkn h ASP 220 Ca 0.01 -0.24 -0.19 0.00 -0.73 0.00 0.00 57.03 55.88 2qkn h ASP 220 Cb 0.03 -0.25 0.01 0.00 -0.83 0.00 0.00 39.33 38.28 2qkn h ASP 220 CO -0.00 0.98 -0.63 0.25 -1.03 0.00 0.00 179.24 178.82 2qkn h LEU 221 N 0.90 0.87 -0.00 0.15 5.85 -1.82 -2.39 115.31 118.88 2qkn h LEU 221 Ca 0.17 -0.60 0.03 0.00 0.84 0.00 0.00 57.88 58.32 2qkn h LEU 221 Cb 0.49 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 2qkn h LEU 221 CO 0.02 1.32 -0.18 0.15 -0.34 0.00 0.00 178.44 179.41 2qkn h PHE 222 N 0.47 -0.47 -0.54 1.25 3.57 -1.20 -0.98 116.94 119.04 2qkn h PHE 222 Ca -0.03 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.42 2qkn h PHE 222 Cb 1.25 0.21 -0.02 0.00 2.79 0.00 0.00 35.95 40.18 2qkn h PHE 222 CO 0.09 -0.26 0.09 -0.44 -2.23 0.00 0.00 178.31 175.56 2qkn h ASP 223 N -0.29 0.86 -0.42 0.41 3.32 -1.24 -3.03 116.42 116.03 2qkn h ASP 223 Ca 0.06 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.84 2qkn h ASP 223 Cb 0.36 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 2qkn h ASP 223 CO -0.17 0.90 0.26 0.00 -1.72 0.00 0.00 179.24 178.52 2qkn h ALA 224 N 0.99 0.54 -0.60 3.45 0.00 -1.17 -2.66 119.26 119.82 2qkn h ALA 224 Ca 0.16 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2qkn h ALA 224 Cb 0.41 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2qkn h ALA 224 CO 0.01 0.02 0.04 0.28 0.00 0.00 0.00 179.25 179.61 2qkn h VAL 225 N 0.57 1.26 -2.60 0.00 2.07 -1.17 -3.14 116.25 113.23 2qkn h VAL 225 Ca 0.15 -1.09 -0.58 0.00 0.82 0.00 0.00 66.70 66.01 2qkn h VAL 225 Cb -0.02 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2qkn h VAL 225 CO -0.03 0.40 1.30 -0.76 0.02 0.00 0.00 177.57 178.49 2qkn s LEU 226 N -9.41 3.51 0.00 2.57 1.43 -1.15 0.24 118.68 115.88 2qkn s LEU 226 Ca -0.12 1.39 0.00 0.00 -1.03 0.00 0.00 54.13 54.37 2qkn s LEU 226 Cb 0.13 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.83 2qkn s LEU 226 CO 0.85 -1.72 0.00 0.61 0.23 0.00 0.00 176.35 176.32 2qkn n GLY 227 N 5.44 0.49 0.00 -3.19 0.00 0.97 -2.27 105.19 106.64 2qkn n GLY 227 Ca 0.24 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.23 2qkn n GLY 227 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qkn n GLY 228 N -2.98 -0.95 3.74 -0.02 0.00 0.14 -3.54 105.19 101.57 2qkn n GLY 228 Ca 0.00 -0.14 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 2qkn n GLY 228 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qkn n LEU 229 N -1.14 -2.52 -2.70 0.99 4.77 0.22 -2.33 117.00 114.28 2qkn n LEU 229 Ca 0.16 -0.66 -0.19 0.00 -0.03 0.00 0.00 56.01 55.29 2qkn n LEU 229 Cb 0.14 -2.59 0.00 0.00 -2.33 0.00 0.00 43.42 38.64 2qkn n LEU 229 CO 0.17 0.43 -0.14 0.61 -1.33 0.00 0.00 177.39 177.13 2qkn n GLY 230 N -1.65 -0.50 0.08 -0.72 0.00 -1.26 -4.86 105.19 96.28 2qkn n GLY 230 Ca 0.02 0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.20 2qkn n GLY 230 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qkn n GLN 231 N -3.28 0.61 -0.00 1.61 1.13 -0.98 -3.51 117.38 112.96 2qkn n GLN 231 Ca -0.15 0.03 0.05 0.00 -1.94 0.00 0.00 57.00 55.00 2qkn n GLN 231 Cb 0.62 -1.74 -0.07 0.00 0.11 0.00 0.00 30.24 29.16 2qkn n GLN 231 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 2qkn n PHE 232 N -2.55 0.00 0.00 1.08 3.72 -1.26 -4.63 117.46 113.82 2qkn n PHE 232 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2qkn n PHE 232 Cb 0.55 -0.10 0.00 0.00 -0.94 0.00 0.00 39.48 38.99 2qkn n PHE 232 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qkn n GLY 233 N 1.48 0.13 3.67 1.37 0.00 -1.26 -3.31 105.19 107.26 2qkn n GLY 233 Ca 0.01 -1.23 -0.35 0.00 0.00 0.00 0.00 46.02 44.45 2qkn n GLY 233 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qkn s VAL 234 N -2.00 4.81 -0.34 1.61 0.11 -0.76 -4.79 120.40 119.05 2qkn s VAL 234 Ca 0.00 -0.03 -0.28 0.00 -2.93 0.00 0.00 61.98 58.74 2qkn s VAL 234 Cb 0.00 -3.14 0.02 0.00 -1.53 0.00 0.00 36.38 31.73 2qkn s VAL 234 CO 0.00 0.50 1.02 -0.63 -3.33 0.00 0.00 175.10 172.66 2qkn s ILE 235 N 0.01 4.54 -0.22 7.04 1.01 -1.26 -1.96 121.20 130.36 2qkn s ILE 235 Ca 0.06 1.54 0.22 0.00 0.00 0.00 0.00 60.65 62.47 2qkn s ILE 235 Cb -0.12 -4.38 -0.28 0.00 0.01 0.00 0.00 42.46 37.69 2qkn s ILE 235 CO 0.01 -0.50 0.63 0.35 0.00 0.00 0.00 174.94 175.43 2qkn n THR 236 N 5.91 0.07 -3.69 2.92 -2.24 -0.17 -3.80 114.28 113.28 2qkn n THR 236 Ca 0.10 -0.42 -0.12 0.00 -2.27 0.00 0.00 64.05 61.34 2qkn n THR 236 Cb 0.47 0.12 -0.09 0.00 -2.10 0.00 0.00 70.33 68.73 2qkn n THR 236 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2qkn s ARG 237 N -3.41 0.57 -0.06 -0.78 3.52 -1.19 -1.22 118.95 116.38 2qkn s ARG 237 Ca -0.04 0.77 0.01 0.00 -0.13 0.00 0.00 55.73 56.34 2qkn s ARG 237 Cb 0.14 0.22 0.02 0.00 -1.56 0.00 0.00 34.95 33.77 2qkn s ARG 237 CO 0.89 -0.09 -0.07 0.00 -0.81 0.00 0.00 175.30 175.21 2qkn s ALA 238 N 0.60 0.96 -0.47 6.12 0.00 -0.05 -1.04 121.76 127.88 2qkn s ALA 238 Ca -0.03 -0.24 -0.21 0.00 0.00 0.00 0.00 51.96 51.48 2qkn s ALA 238 Cb -0.05 -0.55 0.03 0.00 0.00 0.00 0.00 23.12 22.56 2qkn s ALA 238 CO -0.04 -0.04 0.67 0.50 0.00 0.00 0.00 175.76 176.85 2qkn s ARG 239 N 0.98 3.24 -0.17 0.00 6.06 0.31 -1.47 118.95 127.91 2qkn s ARG 239 Ca -0.10 -0.49 -0.09 0.00 -2.50 0.00 0.00 55.73 52.55 2qkn s ARG 239 Cb -0.15 -4.00 -0.05 0.00 0.06 0.00 0.00 34.95 30.82 2qkn s ARG 239 CO 0.00 -1.12 0.13 0.42 -2.50 0.00 0.00 175.30 172.24 2qkn s ILE 240 N 2.90 5.43 0.44 4.11 1.01 0.15 -0.41 121.20 134.83 2qkn s ILE 240 Ca 0.22 0.19 -0.24 0.00 0.00 0.00 0.00 60.65 60.82 2qkn s ILE 240 Cb -0.15 -3.44 -0.08 0.00 0.01 0.00 0.00 42.46 38.80 2qkn s ILE 240 CO 0.17 0.51 1.17 0.00 0.00 0.00 0.00 174.94 176.79 2qkn s ALA 241 N -0.15 3.05 0.33 9.38 0.00 -0.74 -0.17 121.76 133.45 2qkn s ALA 241 Ca 0.10 0.96 0.03 0.00 0.00 0.00 0.00 51.96 53.06 2qkn s ALA 241 Cb -0.11 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 2qkn s ALA 241 CO 0.00 -0.62 0.15 0.14 0.00 0.00 0.00 175.76 175.43 2qkn s VAL 242 N -1.49 0.45 0.09 0.00 -7.23 -1.08 -3.88 120.40 107.28 2qkn s VAL 242 Ca 0.61 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.74 2qkn s VAL 242 Cb -0.30 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.11 2qkn s VAL 242 CO 0.37 0.00 0.08 -1.83 -0.31 0.00 0.00 175.10 173.41 2qkn s GLU 243 N -3.80 0.81 0.19 4.82 -1.05 -0.53 -4.80 118.70 114.35 2qkn s GLU 243 Ca 0.34 -1.21 -0.33 0.00 -0.15 0.00 0.00 54.97 53.62 2qkn s GLU 243 Cb 0.05 0.27 -0.13 0.00 -0.44 0.00 0.00 34.13 33.87 2qkn s GLU 243 CO 0.17 -0.22 1.56 -2.30 0.95 0.00 0.00 175.26 175.42 2qkn n PRO 244 N -0.02 2.24 -2.01 -4.83 -0.02 -1.26 -1.89 135.00 127.21 2qkn n PRO 244 Ca -0.11 0.81 -0.42 0.00 -2.02 0.00 0.00 63.50 61.75 2qkn n PRO 244 Cb 0.62 -2.56 -0.03 0.00 -0.02 0.00 0.00 33.50 31.51 2qkn n PRO 244 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qkn s ALA 245 N 0.67 3.63 0.73 3.55 0.00 0.37 -4.77 121.76 125.93 2qkn s ALA 245 Ca 0.75 0.99 -0.11 0.00 0.00 0.00 0.00 51.96 53.59 2qkn s ALA 245 Cb -0.64 -3.72 0.03 0.00 0.00 0.00 0.00 23.12 18.79 2qkn s ALA 245 CO 0.40 -1.29 1.07 -1.25 0.00 0.00 0.00 175.76 174.70 2qkn s PRO 246 N 3.58 2.66 -0.15 0.00 0.04 -1.26 -4.89 135.00 134.98 2qkn s PRO 246 Ca 0.72 0.96 0.04 0.00 0.04 0.00 0.00 61.00 62.76 2qkn s PRO 246 Cb -0.34 -1.96 -0.23 0.00 0.04 0.00 0.00 34.50 32.01 2qkn s PRO 246 CO 0.30 -1.30 0.23 0.00 0.04 0.00 0.00 177.00 176.27 2qkn n ALA 247 N -3.26 1.26 -2.19 8.56 0.00 -0.36 -4.70 120.51 119.82 2qkn n ALA 247 Ca 0.08 -0.88 -0.11 0.00 0.00 0.00 0.00 53.44 52.53 2qkn n ALA 247 Cb 0.54 -0.49 -0.10 0.00 0.00 0.00 0.00 19.45 19.40 2qkn n ALA 247 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qkn s ARG 248 N -2.55 1.08 -0.07 0.00 0.52 0.22 -1.54 118.95 116.61 2qkn s ARG 248 Ca -0.20 -1.54 -0.01 0.00 -0.52 0.00 0.00 55.73 53.47 2qkn s ARG 248 Cb 0.07 0.26 0.03 0.00 0.52 0.00 0.00 34.95 35.83 2qkn s ARG 248 CO 0.75 -0.33 -0.02 0.00 0.02 0.00 0.00 175.30 175.72 2qkn s ALA 249 N -4.11 0.78 -0.33 2.13 0.00 -0.00 -1.14 121.76 119.09 2qkn s ALA 249 Ca 0.32 -0.17 -0.29 0.00 0.00 0.00 0.00 51.96 51.82 2qkn s ALA 249 Cb 0.07 -0.72 0.02 0.00 0.00 0.00 0.00 23.12 22.49 2qkn s ALA 249 CO 0.07 -0.39 1.06 0.50 0.00 0.00 0.00 175.76 177.00 2qkn s ARG 250 N 1.78 4.02 -0.25 0.00 6.06 -0.18 -2.54 118.95 127.84 2qkn s ARG 250 Ca 0.03 0.98 -0.08 0.00 -2.50 0.00 0.00 55.73 54.16 2qkn s ARG 250 Cb -0.13 -3.75 -0.03 0.00 0.06 0.00 0.00 34.95 31.10 2qkn s ARG 250 CO -0.05 -0.93 0.09 -0.46 -2.50 0.00 0.00 175.30 171.45 2qkn s TRP 251 N 3.68 3.11 0.10 5.12 -0.11 0.37 -0.83 118.94 130.39 2qkn s TRP 251 Ca 0.45 -0.31 0.06 0.00 1.22 0.00 0.00 56.10 57.52 2qkn s TRP 251 Cb -0.12 -2.26 -0.03 0.00 -1.50 0.00 0.00 33.47 29.56 2qkn s TRP 251 CO 0.17 -0.31 -0.15 0.54 -4.62 0.00 0.00 176.95 172.58 2qkn s VAL 252 N 1.60 1.30 -0.05 5.86 0.11 0.71 -0.44 120.40 129.49 2qkn s VAL 252 Ca 0.06 -1.57 0.02 0.00 -2.93 0.00 0.00 61.98 57.56 2qkn s VAL 252 Cb -0.15 -1.39 0.01 0.00 -1.53 0.00 0.00 36.38 33.32 2qkn s VAL 252 CO 0.05 -0.32 -0.09 -0.13 -3.33 0.00 0.00 175.10 171.28 2qkn s ARG 253 N -2.30 1.34 -0.06 1.54 0.52 0.07 -1.09 118.95 118.97 2qkn s ARG 253 Ca 0.05 -0.30 0.04 0.00 -0.52 0.00 0.00 55.73 55.00 2qkn s ARG 253 Cb -0.07 -1.17 -0.02 0.00 0.52 0.00 0.00 34.95 34.21 2qkn s ARG 253 CO 0.03 0.01 -0.19 -0.51 0.02 0.00 0.00 175.30 174.66 2qkn s LEU 254 N 0.68 2.46 -0.08 2.53 2.01 -0.15 -0.55 118.68 125.59 2qkn s LEU 254 Ca -0.12 -0.34 -0.02 0.00 0.01 0.00 0.00 54.13 53.65 2qkn s LEU 254 Cb -0.15 -1.49 -0.03 0.00 0.01 0.00 0.00 46.19 44.53 2qkn s LEU 254 CO 0.02 0.28 0.03 -0.69 1.01 0.00 0.00 176.35 177.00 2qkn s VAL 255 N -0.35 4.51 0.07 -1.59 1.01 -0.92 -0.43 120.40 122.70 2qkn s VAL 255 Ca 0.03 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2qkn s VAL 255 Cb -0.12 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 2qkn s VAL 255 CO 0.02 0.58 -0.07 -0.31 0.00 0.00 0.00 175.10 175.32 2qkn s TYR 256 N -0.94 0.79 0.00 5.22 2.02 0.17 -2.01 117.35 122.60 2qkn s TYR 256 Ca 0.15 -0.74 0.00 0.00 -0.37 0.00 0.00 57.07 56.10 2qkn s TYR 256 Cb -0.11 -0.46 0.00 0.00 -0.40 0.00 0.00 41.96 40.98 2qkn s TYR 256 CO 0.04 -0.13 0.10 0.25 -1.57 0.00 0.00 175.55 174.24 2qkn n THR 257 N 0.60 0.00 -3.80 -0.71 -2.24 -1.26 -0.55 114.28 106.32 2qkn n THR 257 Ca -0.17 -0.48 -0.37 0.00 -2.27 0.00 0.00 64.05 60.76 2qkn n THR 257 Cb 0.58 1.01 -0.13 0.00 -2.10 0.00 0.00 70.33 69.69 2qkn n THR 257 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qkn s ASP 258 N -0.76 5.09 0.31 3.42 2.15 -1.26 -4.88 116.67 120.75 2qkn s ASP 258 Ca 0.00 -0.99 0.01 0.00 0.43 0.00 0.00 52.55 52.00 2qkn s ASP 258 Cb 0.00 -1.83 0.56 0.00 -0.30 0.00 0.00 42.92 41.35 2qkn s ASP 258 CO 0.00 -0.25 1.93 0.15 -0.17 0.00 0.00 175.17 176.82 2qkn h PHE 259 N 8.17 0.99 -0.33 -5.34 3.57 -1.95 -1.78 116.94 120.28 2qkn h PHE 259 Ca -0.27 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.28 2qkn h PHE 259 Cb 1.10 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 39.48 2qkn h PHE 259 CO 0.60 0.54 0.17 0.00 -2.23 0.00 0.00 178.31 177.39 2qkn h ALA 260 N 1.52 0.41 -0.55 2.41 0.00 -1.99 0.34 119.26 121.40 2qkn h ALA 260 Ca 0.36 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.18 2qkn h ALA 260 Cb 0.16 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2qkn h ALA 260 CO -0.13 -0.20 -0.04 0.00 0.00 0.00 0.00 179.25 178.88 2qkn h ALA 261 N 1.17 0.75 0.36 0.00 0.00 -1.86 -1.31 119.26 118.37 2qkn h ALA 261 Ca 0.14 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2qkn h ALA 261 Cb 0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2qkn h ALA 261 CO -0.09 0.61 -0.35 0.35 0.00 0.00 0.00 179.25 179.77 2qkn h PHE 262 N 0.88 -0.96 -0.27 0.00 3.57 -0.84 -0.82 116.94 118.51 2qkn h PHE 262 Ca 0.15 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.56 2qkn h PHE 262 Cb 0.60 0.37 -0.01 0.00 2.79 0.00 0.00 35.95 39.69 2qkn h PHE 262 CO 0.04 -0.50 -0.24 0.66 -2.23 0.00 0.00 178.31 176.04 2qkn h SER 263 N -0.74 0.52 -0.65 0.41 4.64 -0.93 -2.15 113.55 114.66 2qkn h SER 263 Ca -0.02 -0.18 -0.03 0.00 -0.47 0.00 0.00 61.79 61.09 2qkn h SER 263 Cb 0.66 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 62.58 2qkn h SER 263 CO -0.06 0.76 0.31 0.00 -0.87 0.00 0.00 176.83 176.97 2qkn h ALA 264 N 1.28 0.84 -0.18 5.18 0.00 -1.08 -1.34 119.26 123.97 2qkn h ALA 264 Ca 0.07 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 2qkn h ALA 264 Cb 0.67 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2qkn h ALA 264 CO 0.05 0.41 -0.41 -0.44 0.00 0.00 0.00 179.25 178.86 2qkn h ASP 265 N 0.91 0.45 -0.56 0.00 3.32 -0.91 -0.40 116.42 119.22 2qkn h ASP 265 Ca 0.22 -0.20 -0.10 0.00 0.02 0.00 0.00 57.03 56.98 2qkn h ASP 265 Cb 0.12 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2qkn h ASP 265 CO -0.03 0.81 -0.02 1.56 -1.72 0.00 0.00 179.24 179.84 2qkn h GLN 266 N 0.35 1.01 -0.22 3.56 4.20 -1.11 -0.52 115.11 122.38 2qkn h GLN 266 Ca 0.03 -0.33 -0.09 0.00 0.06 0.00 0.00 58.65 58.32 2qkn h GLN 266 Cb 0.87 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.55 2qkn h GLN 266 CO 0.07 1.01 -0.26 0.93 -0.67 0.00 0.00 178.83 179.92 2qkn h GLU 267 N 0.89 0.42 -0.28 1.46 5.08 -1.07 -2.04 114.58 119.04 2qkn h GLU 267 Ca 0.16 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 2qkn h GLU 267 Cb 0.58 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2qkn h GLU 267 CO 0.03 0.65 -0.06 -0.09 -1.00 0.00 0.00 179.01 178.55 2qkn h ARG 268 N 0.37 0.53 0.00 2.33 2.43 -0.64 -0.89 114.38 118.51 2qkn h ARG 268 Ca 0.06 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 59.02 2qkn h ARG 268 Cb 0.65 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.17 2qkn h ARG 268 CO 0.05 0.73 -0.05 -0.07 -1.51 0.00 0.00 179.97 179.11 2qkn h LEU 269 N 0.30 0.00 -2.11 3.80 3.38 -0.91 -3.12 115.31 116.64 2qkn h LEU 269 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2qkn h LEU 269 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2qkn h LEU 269 CO 0.03 0.05 0.00 0.35 0.09 0.00 0.00 178.44 178.96 2qkn n THR 270 N -3.20 0.49 -2.17 0.22 -2.24 -0.78 -4.51 114.28 102.09 2qkn n THR 270 Ca -0.00 -0.75 -0.40 0.00 -2.27 0.00 0.00 64.05 60.64 2qkn n THR 270 Cb 0.30 0.84 -0.02 0.00 -2.10 0.00 0.00 70.33 69.36 2qkn n THR 270 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qkn s ALA 271 N -0.85 3.34 0.29 6.98 0.00 -0.35 -4.91 121.76 126.26 2qkn s ALA 271 Ca 0.14 1.16 -0.29 0.00 0.00 0.00 0.00 51.96 52.96 2qkn s ALA 271 Cb 0.08 -3.45 -0.10 0.00 0.00 0.00 0.00 23.12 19.65 2qkn s ALA 271 CO 0.11 -0.63 1.37 -2.14 0.00 0.00 0.00 175.76 174.47 2qkn s PRO 272 N -2.01 4.31 -0.14 0.00 0.02 -1.26 -4.22 135.00 131.70 2qkn s PRO 272 Ca 0.53 2.26 -0.16 0.00 0.02 0.00 0.00 61.00 63.65 2qkn s PRO 272 Cb -0.37 -3.09 -0.13 0.00 0.02 0.00 0.00 34.50 30.93 2qkn s PRO 272 CO 0.48 -0.31 0.29 0.00 -0.33 0.00 0.00 177.00 177.13 2qkn h ARG 273 N 4.19 0.00 -1.90 5.54 2.47 -2.00 -3.48 114.38 119.20 2qkn h ARG 273 Ca -0.47 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.25 2qkn h ARG 273 Cb 1.22 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.54 2qkn h ARG 273 CO 0.71 0.55 -0.43 0.45 0.56 0.00 0.00 179.97 181.82 2qkn n SER 280 N -4.63 -5.33 -4.32 7.04 2.88 -1.26 -5.15 113.62 102.86 2qkn n SER 280 Ca -0.11 0.61 -0.17 0.00 -1.33 0.00 0.00 58.87 57.87 2qkn n SER 280 Cb 0.34 -1.82 -0.10 0.00 -0.75 0.00 0.00 64.21 61.88 2qkn n SER 280 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2qkn s PHE 281 N -1.33 1.52 0.00 0.66 0.08 -1.26 -5.03 117.98 112.61 2qkn s PHE 281 Ca 0.00 -0.83 0.00 0.00 0.12 0.00 0.00 56.93 56.22 2qkn s PHE 281 Cb 0.00 -0.84 0.00 0.00 -0.57 0.00 0.00 43.02 41.61 2qkn s PHE 281 CO 0.00 0.05 0.00 0.41 -0.10 0.00 0.00 175.22 175.58 2qkn n GLY 282 N -0.37 -2.47 0.20 4.36 0.00 -1.26 -4.93 105.19 100.73 2qkn n GLY 282 Ca -0.07 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 44.97 2qkn n GLY 282 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2qkn h PRO 283 N 0.00 0.67 -6.34 1.61 0.11 -1.99 -3.47 132.00 122.60 2qkn h PRO 283 Ca 0.00 -0.52 -0.65 0.00 0.11 0.00 0.00 66.00 64.94 2qkn h PRO 283 Cb 0.00 0.10 0.06 0.00 0.11 0.00 0.00 31.00 31.27 2qkn h PRO 283 CO 0.00 1.14 0.47 -1.33 -0.21 0.00 0.00 178.00 178.07 2qkn n MET 284 N -4.11 1.36 0.10 1.05 2.81 -1.26 -4.86 117.12 112.21 2qkn n MET 284 Ca -0.07 0.49 0.12 0.00 -1.81 0.00 0.00 57.70 56.42 2qkn n MET 284 Cb 0.65 -2.12 0.02 0.00 -0.71 0.00 0.00 33.22 31.06 2qkn n MET 284 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 2qkn h SER 285 N 4.45 0.00 -3.71 7.83 0.02 -1.55 -3.47 113.55 117.11 2qkn h SER 285 Ca -0.46 -0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 60.37 2qkn h SER 285 Cb 1.32 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.63 2qkn h SER 285 CO 0.77 0.01 -0.14 -0.47 -1.14 0.00 0.00 176.83 175.86 2qkn s TYR 286 N -3.34 -0.61 -0.13 3.45 5.04 -1.23 -4.33 117.35 116.20 2qkn s TYR 286 Ca 0.00 1.41 -0.04 0.00 -2.44 0.00 0.00 57.07 56.00 2qkn s TYR 286 Cb 0.10 0.24 0.06 0.00 0.35 0.00 0.00 41.96 42.72 2qkn s TYR 286 CO 0.78 -0.30 0.22 0.08 -1.34 0.00 0.00 175.55 174.99 2qkn s VAL 287 N 0.60 -0.34 0.25 3.14 1.01 -0.58 -2.07 120.40 122.41 2qkn s VAL 287 Ca -0.03 0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.21 2qkn s VAL 287 Cb -0.05 -0.44 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 2qkn s VAL 287 CO -0.04 0.06 0.15 -0.62 0.00 0.00 0.00 175.10 174.65 2qkn n GLU 288 N 5.34 0.48 -3.67 2.72 1.02 0.59 -4.52 120.64 122.59 2qkn n GLU 288 Ca -0.05 -2.34 -0.10 0.00 -0.02 0.00 0.00 57.16 54.64 2qkn n GLU 288 Cb 0.50 1.60 -0.04 0.00 -0.02 0.00 0.00 31.44 33.47 2qkn n GLU 288 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2qkn s GLY 289 N -2.67 -0.20 0.04 0.62 0.00 -0.76 -0.97 107.32 103.38 2qkn s GLY 289 Ca 0.21 -0.12 0.03 0.00 0.00 0.00 0.00 44.72 44.84 2qkn s GLY 289 CO 0.15 -0.31 -0.08 -0.56 0.00 0.00 0.00 173.10 172.29 2qkn s SER 290 N -2.83 0.94 -0.12 1.64 0.01 0.61 -1.85 113.70 112.10 2qkn s SER 290 Ca 0.05 -0.49 0.02 0.00 1.31 0.00 0.00 55.95 56.84 2qkn s SER 290 Cb 0.01 0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.24 2qkn s SER 290 CO -0.09 -0.14 -0.19 -0.69 0.41 0.00 0.00 173.24 172.53 2qkn s VAL 291 N -1.17 2.49 -0.19 3.43 1.01 -0.40 -1.63 120.40 123.94 2qkn s VAL 291 Ca -0.07 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.06 2qkn s VAL 291 Cb -0.09 -2.00 0.03 0.00 0.00 0.00 0.00 36.38 34.31 2qkn s VAL 291 CO 0.01 0.54 -0.18 -0.36 0.00 0.00 0.00 175.10 175.10 2qkn s PHE 292 N 0.42 2.80 0.30 5.22 0.08 0.66 -4.32 117.98 123.14 2qkn s PHE 292 Ca -0.14 -1.71 -0.28 0.00 0.12 0.00 0.00 56.93 54.93 2qkn s PHE 292 Cb -0.17 -1.90 -0.09 0.00 -0.57 0.00 0.00 43.02 40.29 2qkn s PHE 292 CO 0.06 -0.81 0.99 0.14 -0.10 0.00 0.00 175.22 175.51 2qkn s VAL 293 N 1.28 3.93 0.31 -0.44 -7.23 -1.26 -0.66 120.40 116.33 2qkn s VAL 293 Ca 0.03 1.75 0.04 0.00 -1.81 0.00 0.00 61.98 61.99 2qkn s VAL 293 Cb -0.14 -4.03 0.30 0.00 0.56 0.00 0.00 36.38 33.06 2qkn s VAL 293 CO -0.12 0.27 1.85 -1.13 -0.31 0.00 0.00 175.10 175.66 2qkn h ASN 294 N 3.48 0.82 -0.89 4.85 -1.24 -1.11 -2.83 115.58 118.65 2qkn h ASN 294 Ca -0.46 0.04 0.18 0.00 0.71 0.00 0.00 56.30 56.76 2qkn h ASN 294 Cb 1.20 -0.12 -0.10 0.00 0.73 0.00 0.00 38.32 40.03 2qkn h ASN 294 CO 0.66 0.43 0.46 -0.61 -1.29 0.00 0.00 177.43 177.07 2qkn h GLN 295 N 0.87 0.57 -0.09 6.67 5.75 -1.93 -2.54 115.11 124.42 2qkn h GLN 295 Ca 0.47 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.87 2qkn h GLN 295 Cb 0.57 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.94 2qkn h GLN 295 CO -0.24 0.38 -0.54 -1.13 -2.65 0.00 0.00 178.83 174.65 2qkn n SER 296 N -4.90 2.09 0.07 -0.69 3.41 -1.16 -4.88 113.62 107.56 2qkn n SER 296 Ca 0.20 -3.88 -0.14 0.00 -0.26 0.00 0.00 58.87 54.78 2qkn n SER 296 Cb 0.52 -0.51 -0.07 0.00 -0.26 0.00 0.00 64.21 63.89 2qkn n SER 296 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2qkn h LEU 297 N 1.14 -1.28 -0.43 1.04 5.85 -1.20 0.23 115.31 120.66 2qkn h LEU 297 Ca 0.04 0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.98 2qkn h LEU 297 Cb 1.07 0.50 -0.05 0.00 0.37 0.00 0.00 40.66 42.54 2qkn h LEU 297 CO 0.09 -0.47 0.12 0.00 -0.34 0.00 0.00 178.44 177.84 2qkn h ALA 298 N -0.08 0.49 -0.27 1.25 0.00 -1.89 0.49 119.26 119.24 2qkn h ALA 298 Ca 0.04 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2qkn h ALA 298 Cb 0.66 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2qkn h ALA 298 CO -0.30 -0.28 -0.01 1.15 0.00 0.00 0.00 179.25 179.81 2qkn h THR 299 N 0.26 1.26 -0.36 0.00 2.02 -1.92 -1.38 112.91 112.80 2qkn h THR 299 Ca 0.21 -0.94 -0.07 0.00 0.77 0.00 0.00 66.41 66.37 2qkn h THR 299 Cb 0.23 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2qkn h THR 299 CO -0.24 0.30 -0.09 0.44 0.37 0.00 0.00 175.52 176.30 2qkn h ASP 300 N 0.27 0.59 -0.30 4.18 3.32 -0.64 0.13 116.42 123.98 2qkn h ASP 300 Ca 0.08 -0.15 -0.08 0.00 0.02 0.00 0.00 57.03 56.90 2qkn h ASP 300 Cb 0.44 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2qkn h ASP 300 CO 0.02 0.72 -0.12 -0.07 -1.72 0.00 0.00 179.24 178.07 2qkn h LEU 301 N 0.57 0.62 -1.04 1.55 3.38 -0.84 -2.88 115.31 116.67 2qkn h LEU 301 Ca 0.11 -0.40 -0.05 0.00 0.09 0.00 0.00 57.88 57.63 2qkn h LEU 301 Cb 0.49 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2qkn h LEU 301 CO 0.03 0.88 0.11 0.00 0.09 0.00 0.00 178.44 179.54 2qkn h ALA 302 N 0.76 1.22 0.00 1.53 0.00 -0.95 -2.42 119.26 119.40 2qkn h ALA 302 Ca 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2qkn h ALA 302 Cb 0.63 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2qkn h ALA 302 CO 0.04 0.54 0.00 0.09 0.00 0.00 0.00 179.25 179.91 2qkn n ASN 303 N -4.27 0.00 0.18 0.00 3.02 0.44 -3.13 115.26 111.50 2qkn n ASN 303 Ca 0.04 -1.57 0.06 0.00 -0.03 0.00 0.00 54.58 53.07 2qkn n ASN 303 Cb 0.23 0.00 0.15 0.00 -0.61 0.00 0.00 39.78 39.56 2qkn n ASN 303 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 2qkn h THR 304 N 0.00 0.61 0.00 3.41 1.35 -1.25 -3.47 112.91 113.56 2qkn h THR 304 Ca 0.00 -1.71 0.00 0.00 -0.55 0.00 0.00 66.41 64.15 2qkn h THR 304 Cb 0.00 2.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 2qkn h THR 304 CO 0.00 0.33 0.00 0.61 -0.25 0.00 0.00 175.52 176.21 2qkn n GLY 305 N 0.96 0.61 0.29 5.82 0.00 -1.18 -4.83 105.19 106.85 2qkn n GLY 305 Ca 0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.85 2qkn n GLY 305 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2qkn n PHE 306 N -2.37 0.00 -2.91 1.61 7.35 -1.26 -5.02 117.46 114.86 2qkn n PHE 306 Ca 0.00 0.00 -0.36 0.00 -0.76 0.00 0.00 57.45 56.33 2qkn n PHE 306 Cb 0.05 -0.72 -0.06 0.00 0.35 0.00 0.00 39.48 39.09 2qkn n PHE 306 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2qkn s PHE 307 N -2.37 3.61 0.56 -5.13 0.08 -1.26 -5.07 117.98 108.41 2qkn s PHE 307 Ca -0.27 1.60 -0.05 0.00 0.12 0.00 0.00 56.93 58.33 2qkn s PHE 307 Cb 0.09 -2.79 0.01 0.00 -0.57 0.00 0.00 43.02 39.76 2qkn s PHE 307 CO 0.38 0.21 0.86 0.95 -0.10 0.00 0.00 175.22 177.51 2qkn s THR 308 N -1.67 3.72 0.51 0.64 -4.23 -1.26 -4.85 115.64 108.50 2qkn s THR 308 Ca 0.49 -0.09 0.23 0.00 -1.18 0.00 0.00 61.69 61.15 2qkn s THR 308 Cb -0.16 -3.46 0.28 0.00 1.34 0.00 0.00 72.50 70.50 2qkn s THR 308 CO 0.21 -0.44 2.14 0.44 -0.54 0.00 0.00 174.62 176.42 2qkn h ASP 309 N -0.07 0.00 -0.26 3.99 3.32 -1.98 -0.08 116.42 121.34 2qkn h ASP 309 Ca -0.45 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.48 2qkn h ASP 309 Cb 1.26 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.80 2qkn h ASP 309 CO 0.60 0.06 -0.30 0.00 -1.72 0.00 0.00 179.24 177.88 2qkn h ALA 310 N 1.94 0.39 -0.55 3.45 0.00 -2.00 -2.10 119.26 120.39 2qkn h ALA 310 Ca -0.00 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 2qkn h ALA 310 Cb 0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2qkn h ALA 310 CO 0.01 0.41 0.33 -0.44 0.00 0.00 0.00 179.25 179.56 2qkn h ASP 311 N 0.39 0.66 -0.56 0.00 3.32 -1.57 -2.62 116.42 116.03 2qkn h ASP 311 Ca 0.04 -0.06 0.05 0.00 0.02 0.00 0.00 57.03 57.07 2qkn h ASP 311 Cb 0.88 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 40.21 2qkn h ASP 311 CO 0.07 0.53 0.30 0.58 -1.72 0.00 0.00 179.24 179.00 2qkn h VAL 312 N 0.74 0.97 -0.76 -1.35 2.07 -0.96 -1.60 116.25 115.36 2qkn h VAL 312 Ca 0.20 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2qkn h VAL 312 Cb -0.01 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.07 2qkn h VAL 312 CO -0.04 0.10 0.49 0.00 0.02 0.00 0.00 177.57 178.15 2qkn h ALA 313 N 1.29 0.96 -0.27 1.67 0.00 -1.13 -0.28 119.26 121.51 2qkn h ALA 313 Ca 0.24 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2qkn h ALA 313 Cb 0.13 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2qkn h ALA 313 CO -0.16 0.40 0.09 0.00 0.00 0.00 0.00 179.25 179.58 2qkn h ARG 314 N 1.03 0.41 -0.62 0.00 3.08 -1.06 -1.05 114.38 116.17 2qkn h ARG 314 Ca 0.28 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 60.17 2qkn h ARG 314 Cb -0.09 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 2qkn h ARG 314 CO -0.06 0.47 0.12 0.82 -1.07 0.00 0.00 179.97 180.26 2qkn h ILE 315 N 0.27 1.26 -0.83 2.04 2.04 -1.11 0.14 117.51 121.31 2qkn h ILE 315 Ca 0.09 -0.97 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 2qkn h ILE 315 Cb 0.23 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 2qkn h ILE 315 CO -0.00 0.36 0.48 0.58 0.00 0.00 0.00 178.15 179.57 2qkn h VAL 316 N 0.92 1.24 -0.36 1.67 2.07 -0.94 -0.70 116.25 120.15 2qkn h VAL 316 Ca 0.19 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 67.10 2qkn h VAL 316 Cb 0.40 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 2qkn h VAL 316 CO 0.01 0.26 0.03 0.00 0.02 0.00 0.00 177.57 177.88 2qkn h ALA 317 N 1.26 0.48 -0.33 1.67 0.00 -0.65 -2.53 119.26 119.15 2qkn h ALA 317 Ca 0.30 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2qkn h ALA 317 Cb -0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 2qkn h ALA 317 CO -0.05 0.22 -0.03 1.25 0.00 0.00 0.00 179.25 180.64 2qkn h LEU 318 N 0.44 -0.19 -0.52 0.00 5.85 -0.21 -0.99 115.31 119.69 2qkn h LEU 318 Ca 0.10 0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.99 2qkn h LEU 318 Cb 0.41 0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.54 2qkn h LEU 318 CO 0.01 -0.06 0.16 0.00 -0.34 0.00 0.00 178.44 178.21 2qkn h ALA 319 N 1.30 0.62 -0.65 1.25 0.00 -0.98 -0.33 119.26 120.47 2qkn h ALA 319 Ca 0.16 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 2qkn h ALA 319 Cb 0.23 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2qkn h ALA 319 CO -0.30 -0.25 0.22 0.78 0.00 0.00 0.00 179.25 179.71 2qkn h GLY 320 N 0.32 1.05 0.93 0.00 0.00 -0.99 0.28 103.07 104.66 2qkn h GLY 320 Ca 0.26 -0.58 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 2qkn h GLY 320 CO -0.28 0.54 0.11 0.83 0.00 0.00 0.00 176.54 177.74 2qkn h GLU 321 N 0.95 0.62 -0.00 4.80 5.08 -0.09 -2.54 114.58 123.40 2qkn h GLU 321 Ca 0.21 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2qkn h GLU 321 Cb 0.24 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2qkn h GLU 321 CO -0.01 0.63 -0.12 0.54 -1.00 0.00 0.00 179.01 179.05 2qkn n ARG 322 N -4.59 0.31 -3.67 2.33 5.12 -0.24 -4.92 116.66 111.00 2qkn n ARG 322 Ca -0.00 -0.08 -0.25 0.00 -1.93 0.00 0.00 57.85 55.58 2qkn n ARG 322 Cb 0.19 -1.50 0.07 0.00 -1.16 0.00 0.00 32.46 30.06 2qkn n ARG 322 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2qkn n ASN 323 N -1.28 -5.91 -4.78 0.55 5.15 0.90 -4.96 115.26 104.94 2qkn n ASN 323 Ca 0.11 -0.60 -0.39 0.00 -0.60 0.00 0.00 54.58 53.09 2qkn n ASN 323 Cb 0.30 -4.77 -0.06 0.00 -0.53 0.00 0.00 39.78 34.72 2qkn n ASN 323 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qkn s ALA 324 N -3.32 3.46 -0.96 5.20 0.00 -0.61 -4.95 121.76 120.59 2qkn s ALA 324 Ca 0.59 0.33 0.24 0.00 0.00 0.00 0.00 51.96 53.12 2qkn s ALA 324 Cb -0.27 -2.92 0.35 0.00 0.00 0.00 0.00 23.12 20.28 2qkn s ALA 324 CO 0.75 0.30 1.30 0.25 0.00 0.00 0.00 175.76 178.36 2qkn n THR 325 N 1.64 0.03 -3.87 0.00 -2.24 -1.26 -4.75 114.28 103.83 2qkn n THR 325 Ca -0.06 -0.03 -0.11 0.00 -2.27 0.00 0.00 64.05 61.58 2qkn n THR 325 Cb 0.49 0.35 -0.10 0.00 -2.10 0.00 0.00 70.33 68.97 2qkn n THR 325 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2qkn s THR 326 N -3.02 0.08 0.01 4.28 -4.23 -1.26 -0.54 115.64 110.95 2qkn s THR 326 Ca 0.10 -0.66 0.05 0.00 -1.18 0.00 0.00 61.69 60.00 2qkn s THR 326 Cb 0.17 -0.43 -0.02 0.00 1.34 0.00 0.00 72.50 73.56 2qkn s THR 326 CO 0.74 -0.36 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.60 2qkn s VAL 327 N -1.34 1.27 0.08 2.29 1.01 0.16 -4.78 120.40 119.09 2qkn s VAL 327 Ca -0.14 -0.84 0.09 0.00 0.00 0.00 0.00 61.98 61.10 2qkn s VAL 327 Cb -0.07 -1.09 -0.03 0.00 0.00 0.00 0.00 36.38 35.19 2qkn s VAL 327 CO 0.02 0.24 -0.25 -0.31 0.00 0.00 0.00 175.10 174.79 2qkn s TYR 328 N -0.56 2.17 -0.03 5.22 2.02 0.29 -0.24 117.35 126.22 2qkn s TYR 328 Ca 0.05 -0.40 -0.00 0.00 -0.37 0.00 0.00 57.07 56.35 2qkn s TYR 328 Cb -0.07 -1.25 0.03 0.00 -0.40 0.00 0.00 41.96 40.27 2qkn s TYR 328 CO 0.00 0.19 0.02 0.45 -1.57 0.00 0.00 175.55 174.65 2qkn s SER 329 N -1.53 0.61 0.09 2.29 0.15 -0.65 0.43 113.70 115.08 2qkn s SER 329 Ca 0.11 0.01 -0.21 0.00 0.70 0.00 0.00 55.95 56.57 2qkn s SER 329 Cb -0.10 -0.18 -0.07 0.00 -1.71 0.00 0.00 66.02 63.97 2qkn s SER 329 CO 0.03 -0.16 0.61 -0.63 1.20 0.00 0.00 173.24 174.30 2qkn s ILE 330 N 1.42 4.67 -0.16 6.45 1.01 0.43 -0.29 121.20 134.74 2qkn s ILE 330 Ca -0.04 1.32 0.01 0.00 0.00 0.00 0.00 60.65 61.94 2qkn s ILE 330 Cb -0.13 -3.95 0.02 0.00 0.01 0.00 0.00 42.46 38.41 2qkn s ILE 330 CO -0.03 0.54 -0.18 -0.70 0.00 0.00 0.00 174.94 174.58 2qkn s GLU 331 N -1.07 2.66 0.07 2.79 2.12 -0.14 -0.97 118.70 124.16 2qkn s GLU 331 Ca 0.30 -0.71 -0.03 0.00 0.36 0.00 0.00 54.97 54.90 2qkn s GLU 331 Cb -0.20 -2.32 -0.03 0.00 0.26 0.00 0.00 34.13 31.84 2qkn s GLU 331 CO 0.20 -0.18 0.04 0.00 -0.54 0.00 0.00 175.26 174.78 2qkn s ALA 332 N 1.28 0.35 0.11 6.30 0.00 -0.25 -0.30 121.76 129.25 2qkn s ALA 332 Ca 0.03 -1.08 -0.00 0.00 0.00 0.00 0.00 51.96 50.91 2qkn s ALA 332 Cb -0.13 0.39 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 2qkn s ALA 332 CO -0.10 -0.42 0.00 0.95 0.00 0.00 0.00 175.76 176.19 2qkn s THR 333 N -3.92 0.33 -0.23 0.00 -4.23 -0.88 -0.21 115.64 106.51 2qkn s THR 333 Ca 0.08 -1.89 -0.02 0.00 -1.18 0.00 0.00 61.69 58.68 2qkn s THR 333 Cb 0.07 -1.83 0.07 0.00 1.34 0.00 0.00 72.50 72.15 2qkn s THR 333 CO -0.09 -0.70 0.03 -0.76 -0.54 0.00 0.00 174.62 172.56 2qkn s LEU 334 N -3.03 1.69 0.30 4.79 1.43 -0.01 -1.33 118.68 122.52 2qkn s LEU 334 Ca 0.17 -1.08 -0.28 0.00 -1.03 0.00 0.00 54.13 51.91 2qkn s LEU 334 Cb 0.07 -0.77 -0.09 0.00 0.03 0.00 0.00 46.19 45.43 2qkn s LEU 334 CO -0.03 -0.32 1.00 0.20 0.23 0.00 0.00 176.35 177.44 2qkn s ASN 335 N 1.71 7.32 0.24 2.29 0.01 -1.26 -1.01 114.94 124.25 2qkn s ASN 335 Ca 0.01 2.02 -0.17 0.00 -0.71 0.00 0.00 52.86 54.00 2qkn s ASN 335 Cb -0.17 -2.60 0.01 0.00 0.41 0.00 0.00 41.25 38.90 2qkn s ASN 335 CO -0.12 -0.09 0.58 -0.72 -1.51 0.00 0.00 177.10 175.24 2qkn s TYR 336 N -1.37 0.01 0.24 2.20 -0.85 -0.29 -4.97 117.35 112.31 2qkn s TYR 336 Ca 0.47 -0.40 0.03 0.00 -0.52 0.00 0.00 57.07 56.65 2qkn s TYR 336 Cb -0.25 0.44 0.03 0.00 0.38 0.00 0.00 41.96 42.56 2qkn s TYR 336 CO 0.32 -1.06 0.22 -0.40 -1.52 0.00 0.00 175.55 173.10 2qkn n ASP 337 N -0.40 1.55 0.00 -0.18 5.68 -1.26 -0.61 116.55 121.33 2qkn n ASP 337 Ca -0.05 -1.78 0.08 0.00 -0.50 0.00 0.00 54.79 52.55 2qkn n ASP 337 Cb 0.61 -0.06 0.50 0.00 -1.14 0.00 0.00 41.12 41.03 2qkn n ASP 337 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2qkn n ASN 338 N -2.12 0.00 -4.44 -1.12 3.02 -1.26 -4.72 115.26 104.62 2qkn n ASN 338 Ca 0.01 -0.65 -0.44 0.00 -0.03 0.00 0.00 54.58 53.47 2qkn n ASN 338 Cb 0.27 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.43 2qkn n ASN 338 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qkn n ALA 339 N -0.95 -1.94 0.22 5.41 0.00 -1.26 -4.80 120.51 117.19 2qkn n ALA 339 Ca 0.13 0.28 0.11 0.00 0.00 0.00 0.00 53.44 53.95 2qkn n ALA 339 Cb 0.06 -1.72 0.67 0.00 0.00 0.00 0.00 19.45 18.46 2qkn n ALA 339 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2qkn h THR 340 N 1.01 0.92 0.00 0.00 1.35 -2.07 -2.31 112.91 111.81 2qkn h THR 340 Ca -0.36 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 2qkn h THR 340 Cb 1.41 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 2qkn h THR 340 CO 0.54 0.00 -0.89 0.00 -0.25 0.00 0.00 175.52 174.92 2qkn n ALA 341 N -2.54 4.17 -0.10 6.62 0.00 -1.26 -4.62 120.51 122.79 2qkn n ALA 341 Ca -0.01 -0.50 -0.05 0.00 0.00 0.00 0.00 53.44 52.88 2qkn n ALA 341 Cb 0.17 -0.90 -0.04 0.00 0.00 0.00 0.00 19.45 18.68 2qkn n ALA 341 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qkn h ALA 342 N 2.91 -0.41 -0.99 0.00 0.00 -1.70 -1.08 119.26 117.99 2qkn h ALA 342 Ca 0.00 0.02 0.19 0.00 0.00 0.00 0.00 54.91 55.11 2qkn h ALA 342 Cb 0.55 0.97 -0.18 0.00 0.00 0.00 0.00 17.79 19.13 2qkn h ALA 342 CO 0.00 -0.54 -0.28 0.00 0.00 0.00 0.00 179.25 178.42 2qkn n ALA 343 N -2.94 0.14 0.04 0.00 0.00 -1.26 -0.15 120.51 116.34 2qkn n ALA 343 Ca -0.01 1.06 -0.07 0.00 0.00 0.00 0.00 53.44 54.43 2qkn n ALA 343 Cb 0.13 -0.60 0.10 0.00 0.00 0.00 0.00 19.45 19.08 2qkn n ALA 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qkn h ALA 344 N 1.82 0.81 -0.51 0.00 0.00 -1.80 -2.45 119.26 117.13 2qkn h ALA 344 Ca 0.44 -0.51 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2qkn h ALA 344 Cb 0.69 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2qkn h ALA 344 CO -1.01 0.69 -0.08 0.00 0.00 0.00 0.00 179.25 178.85 2qkn h ALA 345 N 1.10 0.90 -0.65 0.00 0.00 0.78 -2.55 119.26 118.84 2qkn h ALA 345 Ca 0.01 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 2qkn h ALA 345 Cb 1.05 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2qkn h ALA 345 CO 0.09 0.64 0.06 0.28 0.00 0.00 0.00 179.25 180.32 2qkn h VAL 346 N 0.83 1.26 0.11 0.00 2.07 -0.48 -1.50 116.25 118.54 2qkn h VAL 346 Ca 0.14 -1.09 0.01 0.00 0.82 0.00 0.00 66.70 66.58 2qkn h VAL 346 Cb 0.60 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2qkn h VAL 346 CO 0.04 0.41 -0.17 0.44 0.02 0.00 0.00 177.57 178.31 2qkn h ASP 347 N 1.02 -0.46 -0.54 0.57 3.32 -1.15 0.37 116.42 119.55 2qkn h ASP 347 Ca 0.19 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.29 2qkn h ASP 347 Cb 0.49 0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.19 2qkn h ASP 347 CO 0.02 -0.25 0.33 1.56 -1.72 0.00 0.00 179.24 179.19 2qkn h GLN 348 N -0.34 0.72 0.24 3.56 4.20 -1.36 0.11 115.11 122.24 2qkn h GLN 348 Ca 0.02 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 2qkn h GLN 348 Cb 0.35 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 2qkn h GLN 348 CO -0.08 0.52 -0.17 1.49 -0.67 0.00 0.00 178.83 179.91 2qkn h GLU 349 N 0.72 -0.40 -0.46 1.46 4.57 -0.91 -1.05 114.58 118.52 2qkn h GLU 349 Ca 0.19 0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.46 2qkn h GLU 349 Cb -0.03 0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.60 2qkn h GLU 349 CO -0.04 -0.26 0.17 1.25 -1.18 0.00 0.00 179.01 178.95 2qkn h LEU 350 N -0.41 0.18 -0.61 1.64 5.85 0.00 -1.78 115.31 120.18 2qkn h LEU 350 Ca -0.02 0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.82 2qkn h LEU 350 Cb 0.36 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.36 2qkn h LEU 350 CO -0.00 0.14 0.30 0.00 -0.34 0.00 0.00 178.44 178.54 2qkn h ALA 351 N 1.30 0.80 0.28 1.25 0.00 -0.49 -0.40 119.26 122.00 2qkn h ALA 351 Ca 0.21 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2qkn h ALA 351 Cb 0.20 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2qkn h ALA 351 CO -0.21 -0.06 -0.24 0.77 0.00 0.00 0.00 179.25 179.50 2qkn h SER 352 N 0.55 -0.64 0.16 0.00 0.02 -0.38 -1.35 113.55 111.91 2qkn h SER 352 Ca 0.28 0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.30 2qkn h SER 352 Cb 0.23 0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.96 2qkn h SER 352 CO -0.21 -0.36 -0.29 0.58 -1.14 0.00 0.00 176.83 175.41 2qkn h VAL 353 N -0.54 0.38 -0.73 2.27 2.07 -0.99 -1.83 116.25 116.88 2qkn h VAL 353 Ca -0.01 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.68 2qkn h VAL 353 Cb 0.49 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 2qkn h VAL 353 CO -0.03 0.00 0.50 -0.07 0.02 0.00 0.00 177.57 177.99 2qkn h LEU 354 N -0.53 0.25 -2.32 2.57 3.38 -1.00 0.23 115.31 117.89 2qkn h LEU 354 Ca 0.02 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2qkn h LEU 354 Cb 0.54 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 2qkn h LEU 354 CO -0.14 0.12 -0.04 1.23 0.09 0.00 0.00 178.44 179.70 2qkn h GLY 355 N 0.26 0.00 0.14 0.83 0.00 -0.35 -2.03 103.07 101.92 2qkn h GLY 355 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2qkn h GLY 355 CO -0.08 0.00 -0.28 -1.30 0.00 0.00 0.00 176.54 174.87 2qkn n THR 356 N -3.35 0.00 -2.80 4.70 -2.24 0.80 -4.96 114.28 106.43 2qkn n THR 356 Ca -0.02 -0.14 -0.21 0.00 -2.27 0.00 0.00 64.05 61.41 2qkn n THR 356 Cb 0.17 0.47 0.08 0.00 -2.10 0.00 0.00 70.33 68.95 2qkn n THR 356 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2qkn s LEU 357 N -2.51 3.07 -0.17 3.22 1.43 -0.77 -5.07 118.68 117.88 2qkn s LEU 357 Ca 0.23 -0.57 0.16 0.00 -1.03 0.00 0.00 54.13 52.93 2qkn s LEU 357 Cb 0.19 -1.88 0.44 0.00 0.03 0.00 0.00 46.19 44.97 2qkn s LEU 357 CO 0.53 -1.58 1.18 -1.20 0.23 0.00 0.00 176.35 175.52 2qkn n SER 358 N -2.53 2.07 -4.72 2.29 7.64 -1.26 -5.07 113.62 112.04 2qkn n SER 358 Ca 0.15 -3.05 -0.29 0.00 1.01 0.00 0.00 58.87 56.68 2qkn n SER 358 Cb 0.61 -0.42 0.14 0.00 -1.01 0.00 0.00 64.21 63.53 2qkn n SER 358 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 2qkn s TYR 359 N -2.43 2.31 0.21 1.43 -0.85 -1.26 -4.91 117.35 111.85 2qkn s TYR 359 Ca 0.38 1.16 -0.32 0.00 -0.52 0.00 0.00 57.07 57.77 2qkn s TYR 359 Cb 0.38 -3.19 -0.11 0.00 0.38 0.00 0.00 41.96 39.41 2qkn s TYR 359 CO -0.08 -2.48 1.66 0.08 -1.52 0.00 0.00 175.55 173.22 2qkn s VAL 360 N -2.97 2.20 -0.19 -3.49 1.01 -0.85 -4.84 120.40 111.27 2qkn s VAL 360 Ca 0.64 0.14 -0.41 0.00 0.00 0.00 0.00 61.98 62.35 2qkn s VAL 360 Cb -0.18 -3.09 -0.18 0.00 0.00 0.00 0.00 36.38 32.93 2qkn s VAL 360 CO 0.57 0.01 1.49 1.21 0.00 0.00 0.00 175.10 178.38 2qkn n GLU 361 N 3.69 0.68 -0.54 2.72 4.07 -1.26 -0.38 120.64 129.62 2qkn n GLU 361 Ca 0.14 0.25 0.00 0.00 -0.06 0.00 0.00 57.16 57.49 2qkn n GLU 361 Cb 0.36 -1.85 0.00 0.00 -0.06 0.00 0.00 31.44 29.90 2qkn n GLU 361 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qkn n GLY 362 N 3.24 1.25 2.69 8.31 0.00 -1.26 -4.95 105.19 114.47 2qkn n GLY 362 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.89 2qkn n GLY 362 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qkn n PHE 363 N -2.00 3.03 -4.26 1.61 3.72 0.48 -4.89 117.46 115.15 2qkn n PHE 363 Ca 0.00 -2.56 -0.34 0.00 -0.05 0.00 0.00 57.45 54.50 2qkn n PHE 363 Cb 0.00 -1.29 -0.12 0.00 -0.94 0.00 0.00 39.48 37.13 2qkn n PHE 363 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2qkn s ALA 364 N -3.92 3.07 -0.12 4.37 0.00 -1.26 -2.17 121.76 121.73 2qkn s ALA 364 Ca 0.57 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.69 2qkn s ALA 364 Cb 0.46 -1.66 0.02 0.00 0.00 0.00 0.00 23.12 21.93 2qkn s ALA 364 CO -0.27 0.12 -0.16 -0.06 0.00 0.00 0.00 175.76 175.39 2qkn s PHE 365 N 0.52 2.11 0.12 0.00 0.08 0.29 -4.98 117.98 116.11 2qkn s PHE 365 Ca -0.02 -1.04 0.08 0.00 0.12 0.00 0.00 56.93 56.08 2qkn s PHE 365 Cb -0.14 -1.51 -0.04 0.00 -0.57 0.00 0.00 43.02 40.76 2qkn s PHE 365 CO 0.02 -0.53 -0.14 -0.65 -0.10 0.00 0.00 175.22 173.83 2qkn s GLN 366 N 1.04 1.95 0.05 0.44 -0.21 -1.26 -0.75 119.66 120.92 2qkn s GLN 366 Ca -0.05 -1.13 -0.07 0.00 0.02 0.00 0.00 55.36 54.12 2qkn s GLN 366 Cb -0.15 -2.19 -0.00 0.00 1.00 0.00 0.00 33.01 31.67 2qkn s GLN 366 CO -0.03 0.48 0.15 1.03 -2.12 0.00 0.00 175.29 174.80 2qkn s ARG 367 N -2.26 0.68 -0.06 2.91 1.81 0.42 -5.01 118.95 117.44 2qkn s ARG 367 Ca 0.20 -0.77 -0.01 0.00 -1.72 0.00 0.00 55.73 53.43 2qkn s ARG 367 Cb -0.11 0.27 0.03 0.00 -0.45 0.00 0.00 34.95 34.70 2qkn s ARG 367 CO 0.12 -0.19 0.02 0.34 -0.68 0.00 0.00 175.30 174.91 2qkn s ASP 368 N -2.30 1.45 0.24 0.23 2.15 -1.26 -0.48 116.67 116.71 2qkn s ASP 368 Ca -0.02 -0.04 0.01 0.00 0.43 0.00 0.00 52.55 52.93 2qkn s ASP 368 Cb 0.01 -0.36 -0.04 0.00 -0.30 0.00 0.00 42.92 42.23 2qkn s ASP 368 CO -0.06 -0.21 0.14 0.68 -0.17 0.00 0.00 175.17 175.55 2qkn s VAL 369 N 2.01 0.22 0.43 1.11 -7.23 -1.05 -5.00 120.40 110.88 2qkn s VAL 369 Ca 0.05 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 57.98 2qkn s VAL 369 Cb -0.12 -2.54 -0.08 0.00 0.56 0.00 0.00 36.38 34.20 2qkn s VAL 369 CO -0.05 0.00 1.14 0.00 -0.31 0.00 0.00 175.10 175.88 2qkn s ALA 370 N -3.89 3.05 0.17 1.32 0.00 -1.26 -0.82 121.76 120.33 2qkn s ALA 370 Ca 0.38 0.89 -0.16 0.00 0.00 0.00 0.00 51.96 53.07 2qkn s ALA 370 Cb 0.07 -3.36 0.12 0.00 0.00 0.00 0.00 23.12 19.95 2qkn s ALA 370 CO 0.15 -0.51 1.67 -0.92 0.00 0.00 0.00 175.76 176.14 2qkn h TYR 371 N 2.33 -0.17 -0.50 0.00 3.20 -1.55 -1.33 116.97 118.94 2qkn h TYR 371 Ca -0.49 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.40 2qkn h TYR 371 Cb 1.24 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.62 2qkn h TYR 371 CO 0.55 -0.16 0.25 0.00 -1.64 0.00 0.00 178.16 177.16 2qkn h ALA 372 N 1.42 1.50 -0.48 1.82 0.00 -1.90 -1.23 119.26 120.40 2qkn h ALA 372 Ca 0.21 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2qkn h ALA 372 Cb 0.32 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2qkn h ALA 372 CO -0.42 0.40 0.17 0.00 0.00 0.00 0.00 179.25 179.40 2qkn h ALA 373 N 1.58 0.62 0.12 0.00 0.00 -1.64 -1.58 119.26 118.36 2qkn h ALA 373 Ca 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2qkn h ALA 373 Cb 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2qkn h ALA 373 CO -0.03 0.26 -0.06 0.35 0.00 0.00 0.00 179.25 179.77 2qkn h PHE 374 N 0.63 -0.15 -0.85 0.00 3.57 -0.77 -2.10 116.94 117.27 2qkn h PHE 374 Ca 0.16 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.75 2qkn h PHE 374 Cb 0.24 0.05 -0.06 0.00 2.79 0.00 0.00 35.95 38.97 2qkn h PHE 374 CO 0.01 0.01 0.55 -0.07 -2.23 0.00 0.00 178.31 176.58 2qkn h LEU 375 N -0.28 0.73 -3.28 0.59 3.38 -1.12 -1.48 115.31 113.85 2qkn h LEU 375 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qkn h LEU 375 Cb 0.23 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2qkn h LEU 375 CO 0.03 0.43 0.00 -0.67 0.09 0.00 0.00 178.44 178.32 2qkn n ASP 376 N -4.52 5.20 -0.28 -0.43 2.03 -0.61 -4.64 116.55 113.30 2qkn n ASP 376 Ca 0.14 -2.73 0.19 0.00 0.52 0.00 0.00 54.79 52.91 2qkn n ASP 376 Cb 0.32 -0.64 0.48 0.00 -0.72 0.00 0.00 41.12 40.56 2qkn n ASP 376 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 2qkn h ARG 377 N 3.82 0.45 0.00 -0.67 0.11 -0.55 -2.26 114.38 115.29 2qkn h ARG 377 Ca 0.00 -0.03 -0.05 0.00 0.10 0.00 0.00 59.98 60.00 2qkn h ARG 377 Cb 1.74 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 32.71 2qkn h ARG 377 CO 0.39 0.30 -0.25 0.28 0.10 0.00 0.00 179.97 180.79 2qkn h VAL 378 N 0.47 0.61 -0.76 0.08 2.07 -1.82 -3.27 116.25 113.62 2qkn h VAL 378 Ca 0.51 -1.20 0.13 0.00 0.82 0.00 0.00 66.70 66.95 2qkn h VAL 378 Cb 1.19 1.80 -0.09 0.00 -1.52 0.00 0.00 31.29 32.68 2qkn h VAL 378 CO -0.23 0.25 0.35 -0.74 0.02 0.00 0.00 177.57 177.22 2qkn h HIS 379 N 0.00 0.62 -0.57 1.57 6.17 -1.76 -0.52 115.15 120.66 2qkn h HIS 379 Ca -0.00 0.03 0.02 0.00 0.71 0.00 0.00 60.37 61.13 2qkn h HIS 379 Cb 0.78 -0.16 -0.03 0.00 2.52 0.00 0.00 27.41 30.52 2qkn h HIS 379 CO 0.00 0.15 0.38 0.78 0.71 0.00 0.00 177.93 179.95 2qkn h GLY 380 N 0.54 0.77 1.74 5.26 0.00 -1.75 -0.97 103.07 108.66 2qkn h GLY 380 Ca 0.40 -0.27 -0.11 0.00 0.00 0.00 0.00 47.33 47.35 2qkn h GLY 380 CO -0.35 0.25 -0.41 -2.09 0.00 0.00 0.00 176.54 173.94 2qkn h GLU 381 N 0.70 0.29 -0.01 4.80 4.81 -1.30 -2.37 114.58 121.51 2qkn h GLU 381 Ca 0.22 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2qkn h GLU 381 Cb 0.02 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 2qkn h GLU 381 CO -0.05 0.66 -0.00 1.49 -0.73 0.00 0.00 179.01 180.37 2qkn h GLU 382 N 0.24 0.02 -0.14 1.92 4.81 -0.66 -1.38 114.58 119.38 2qkn h GLU 382 Ca 0.02 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.29 2qkn h GLU 382 Cb 0.84 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.16 2qkn h GLU 382 CO 0.07 0.36 -0.17 0.28 -0.73 0.00 0.00 179.01 178.82 2qkn h VAL 383 N -0.33 0.56 0.04 0.32 2.07 -1.30 0.06 116.25 117.66 2qkn h VAL 383 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2qkn h VAL 383 Cb 0.35 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 2qkn h VAL 383 CO 0.00 0.00 -0.15 0.00 0.02 0.00 0.00 177.57 177.44 2qkn h ALA 384 N 0.85 -0.21 -0.70 1.67 0.00 -1.41 -1.97 119.26 117.49 2qkn h ALA 384 Ca 0.10 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2qkn h ALA 384 Cb 0.35 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 2qkn h ALA 384 CO -0.26 -0.65 0.46 -0.07 0.00 0.00 0.00 179.25 178.72 2qkn h LEU 385 N -0.27 0.78 -0.39 0.00 3.38 -0.98 -2.53 115.31 115.31 2qkn h LEU 385 Ca 0.04 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 2qkn h LEU 385 Cb 0.31 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2qkn h LEU 385 CO -0.12 0.56 -0.12 -1.13 0.09 0.00 0.00 178.44 177.72 2qkn h ASN 386 N 0.92 0.78 -0.89 -0.43 -1.24 -0.62 0.97 115.58 115.06 2qkn h ASN 386 Ca 0.26 -0.37 0.04 0.00 0.71 0.00 0.00 56.30 56.94 2qkn h ASN 386 Cb -0.06 -0.21 -0.05 0.00 0.73 0.00 0.00 38.32 38.73 2qkn h ASN 386 CO -0.06 0.97 0.59 0.11 -1.29 0.00 0.00 177.43 177.74 2qkn h LYS 387 N 0.57 1.05 0.00 6.67 1.79 -1.05 0.45 116.57 126.05 2qkn h LYS 387 Ca 0.10 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2qkn h LYS 387 Cb 0.64 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 2qkn h LYS 387 CO 0.04 0.70 0.00 1.28 -1.08 0.00 0.00 179.45 180.39 2qkn n LEU 388 N -4.46 0.00 -1.26 2.94 4.77 -0.98 -4.84 117.00 113.17 2qkn n LEU 388 Ca 0.12 0.09 -0.14 0.00 -0.03 0.00 0.00 56.01 56.05 2qkn n LEU 388 Cb 0.13 -0.09 -0.04 0.00 -2.33 0.00 0.00 43.42 41.10 2qkn n LEU 388 CO 0.34 -0.01 -0.15 0.61 -1.33 0.00 0.00 177.39 176.85 2qkn n GLY 389 N 0.81 0.81 1.28 -0.72 0.00 0.16 -4.88 105.19 102.65 2qkn n GLY 389 Ca 0.18 -0.35 0.02 0.00 0.00 0.00 0.00 46.02 45.88 2qkn n GLY 389 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qkn n LEU 390 N -1.73 4.60 -0.07 0.99 4.77 0.33 -4.51 117.00 121.37 2qkn n LEU 390 Ca -0.15 -3.22 -0.14 0.00 -0.03 0.00 0.00 56.01 52.47 2qkn n LEU 390 Cb 0.52 -0.62 -0.06 0.00 -2.33 0.00 0.00 43.42 40.93 2qkn n LEU 390 CO 0.20 0.82 -0.99 1.87 -1.33 0.00 0.00 177.39 177.96 2qkn n TRP 391 N -0.49 0.00 -1.86 -1.77 -0.00 -1.08 -4.69 117.44 107.55 2qkn n TRP 391 Ca 0.29 0.00 -0.41 0.00 -0.00 0.00 0.00 57.50 57.38 2qkn n TRP 391 Cb 1.07 -0.53 -0.01 0.00 -0.00 0.00 0.00 31.31 31.84 2qkn n TRP 391 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 2qkn n ARG 392 N -3.49 3.79 -4.36 5.87 1.74 -1.26 -4.86 116.66 114.09 2qkn n ARG 392 Ca -0.28 -3.00 -0.18 0.00 -0.77 0.00 0.00 57.85 53.63 2qkn n ARG 392 Cb 0.72 -2.88 -0.10 0.00 -1.02 0.00 0.00 32.46 29.18 2qkn n ARG 392 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2qkn s VAL 393 N 0.91 0.83 0.33 1.55 -7.23 -1.26 -5.12 120.40 110.41 2qkn s VAL 393 Ca 0.53 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.41 2qkn s VAL 393 Cb 0.15 -2.63 -0.11 0.00 0.56 0.00 0.00 36.38 34.36 2qkn s VAL 393 CO -0.06 -0.07 1.45 -2.84 -0.31 0.00 0.00 175.10 173.28 2qkn s PRO 394 N -3.96 4.20 -0.60 4.82 0.02 -1.26 -4.67 135.00 133.54 2qkn s PRO 394 Ca 0.36 2.44 0.04 0.00 0.02 0.00 0.00 61.00 63.86 2qkn s PRO 394 Cb 0.08 -3.03 0.15 0.00 0.02 0.00 0.00 34.50 31.72 2qkn s PRO 394 CO 0.13 -0.45 0.38 -1.01 -0.33 0.00 0.00 177.00 175.72 2qkn s HIS 395 N -0.75 3.18 -1.49 6.54 3.76 -0.02 -1.00 115.29 125.51 2qkn s HIS 395 Ca 0.55 -3.16 -0.12 0.00 -0.15 0.00 0.00 55.06 52.18 2qkn s HIS 395 Cb -0.44 -2.60 0.01 0.00 1.11 0.00 0.00 32.58 30.66 2qkn s HIS 395 CO 0.55 -0.65 2.45 -0.35 -0.85 0.00 0.00 174.74 175.89 2qkn n PRO 396 N 2.57 3.33 -2.33 8.40 -0.04 -1.22 -4.78 135.00 140.93 2qkn n PRO 396 Ca 0.14 -2.62 -0.38 0.00 -0.04 0.00 0.00 63.50 60.60 2qkn n PRO 396 Cb 0.34 -3.05 -0.02 0.00 -0.04 0.00 0.00 33.50 30.73 2qkn n PRO 396 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2qkn s TRP 397 N 2.28 3.12 -0.23 0.54 0.52 -1.26 -4.49 118.94 119.42 2qkn s TRP 397 Ca 0.54 1.57 0.01 0.00 0.02 0.00 0.00 56.10 58.25 2qkn s TRP 397 Cb 0.15 -3.36 0.04 0.00 -1.15 0.00 0.00 33.47 29.15 2qkn s TRP 397 CO -0.07 -1.20 -0.14 -1.17 0.02 0.00 0.00 176.95 174.39 2qkn s LEU 398 N -2.45 2.86 -0.06 2.99 2.96 -0.72 -5.01 118.68 119.25 2qkn s LEU 398 Ca 0.56 -0.99 0.04 0.00 -0.22 0.00 0.00 54.13 53.52 2qkn s LEU 398 Cb -0.30 -1.54 0.00 0.00 0.50 0.00 0.00 46.19 44.85 2qkn s LEU 398 CO 0.37 -0.10 -0.17 0.20 -1.32 0.00 0.00 176.35 175.33 2qkn s ASN 399 N 1.22 2.21 0.24 3.68 -0.87 -1.26 -0.76 114.94 119.39 2qkn s ASN 399 Ca -0.02 -0.37 -0.21 0.00 -1.57 0.00 0.00 52.86 50.69 2qkn s ASN 399 Cb -0.16 -0.79 0.03 0.00 -0.02 0.00 0.00 41.25 40.31 2qkn s ASN 399 CO -0.08 0.12 0.67 0.00 -2.57 0.00 0.00 177.10 175.24 2qkn s MET 400 N 0.25 1.62 -0.19 -0.60 0.23 0.24 -1.70 119.30 119.14 2qkn s MET 400 Ca -0.09 -0.85 -0.03 0.00 -1.03 0.00 0.00 55.69 53.69 2qkn s MET 400 Cb -0.14 0.59 -0.01 0.00 -1.53 0.00 0.00 34.83 33.75 2qkn s MET 400 CO 0.04 -0.73 -0.07 -0.06 -2.03 0.00 0.00 175.02 172.17 2qkn s PHE 401 N -3.87 2.93 -0.16 3.16 0.08 0.15 -0.12 117.98 120.14 2qkn s PHE 401 Ca 0.09 -0.80 0.00 0.00 0.12 0.00 0.00 56.93 56.33 2qkn s PHE 401 Cb -0.04 -2.02 0.00 0.00 -0.57 0.00 0.00 43.02 40.39 2qkn s PHE 401 CO 0.01 -0.41 -0.15 0.08 -0.10 0.00 0.00 175.22 174.65 2qkn s VAL 402 N 1.06 2.63 0.33 -0.44 1.01 0.50 -1.60 120.40 123.89 2qkn s VAL 402 Ca 0.00 -0.78 -0.29 0.00 0.00 0.00 0.00 61.98 60.92 2qkn s VAL 402 Cb -0.15 -2.11 -0.12 0.00 0.00 0.00 0.00 36.38 34.00 2qkn s VAL 402 CO -0.01 0.51 1.41 -0.81 0.00 0.00 0.00 175.10 176.20 2qkn n PRO 403 N 4.14 2.36 -0.34 2.72 -0.04 -1.26 0.76 135.00 143.33 2qkn n PRO 403 Ca -0.19 0.83 0.14 0.00 -0.04 0.00 0.00 63.50 64.24 2qkn n PRO 403 Cb 0.52 -2.49 0.33 0.00 -0.04 0.00 0.00 33.50 31.82 2qkn n PRO 403 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2qkn h ARG 404 N 3.21 0.66 0.00 0.54 2.43 -1.65 -0.81 114.38 118.76 2qkn h ARG 404 Ca -0.47 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 2qkn h ARG 404 Cb 1.26 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2qkn h ARG 404 CO 0.67 0.44 0.05 0.66 -1.51 0.00 0.00 179.97 180.28 2qkn h SER 405 N 0.68 0.00 0.00 -3.80 4.64 -1.89 -2.27 113.55 110.91 2qkn h SER 405 Ca 0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.91 2qkn h SER 405 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2qkn h SER 405 CO -0.42 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.08 2qkn n ARG 406 N -2.64 2.15 0.11 4.77 5.12 -0.33 -4.73 116.66 121.12 2qkn n ARG 406 Ca -0.02 -1.27 0.02 0.00 -1.93 0.00 0.00 57.85 54.65 2qkn n ARG 406 Cb 0.10 -0.97 0.37 0.00 -1.16 0.00 0.00 32.46 30.80 2qkn n ARG 406 CO 0.00 0.00 0.00 0.97 -1.93 0.00 0.00 177.63 176.67 2qkn h ILE 407 N 0.16 1.20 -0.44 0.55 6.09 -1.16 -1.20 117.51 122.71 2qkn h ILE 407 Ca 0.00 -0.88 -0.12 0.00 -1.37 0.00 0.00 64.86 62.49 2qkn h ILE 407 Cb 0.44 1.27 -0.01 0.00 0.47 0.00 0.00 36.82 38.98 2qkn h ILE 407 CO 0.00 0.27 -0.19 0.00 -3.07 0.00 0.00 178.15 175.16 2qkn h ALA 408 N 1.61 0.82 -0.47 0.18 0.00 -1.85 -0.32 119.26 119.23 2qkn h ALA 408 Ca 0.04 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.46 2qkn h ALA 408 Cb 0.43 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2qkn h ALA 408 CO 0.03 0.65 -0.19 -0.44 0.00 0.00 0.00 179.25 179.30 2qkn h ASP 409 N 0.77 0.95 -0.29 0.00 3.32 -1.78 -1.63 116.42 117.76 2qkn h ASP 409 Ca 0.11 -0.34 0.00 0.00 0.02 0.00 0.00 57.03 56.82 2qkn h ASP 409 Cb 0.73 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 2qkn h ASP 409 CO 0.06 1.11 0.19 0.15 -1.72 0.00 0.00 179.24 179.03 2qkn h PHE 410 N 0.82 0.37 -0.41 4.55 3.57 -0.89 0.12 116.94 125.07 2qkn h PHE 410 Ca 0.11 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.69 2qkn h PHE 410 Cb 0.74 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 39.30 2qkn h PHE 410 CO 0.05 0.25 0.07 0.22 -2.23 0.00 0.00 178.31 176.67 2qkn h ASP 411 N 0.39 -0.01 -0.28 0.41 3.58 -0.77 0.18 116.42 119.92 2qkn h ASP 411 Ca 0.11 0.07 -0.03 0.00 0.42 0.00 0.00 57.03 57.61 2qkn h ASP 411 Cb -0.03 0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 2qkn h ASP 411 CO -0.02 0.03 0.08 0.03 -2.88 0.00 0.00 179.24 176.47 2qkn h ARG 412 N 0.20 0.44 0.00 0.28 3.08 -0.88 -0.77 114.38 116.73 2qkn h ARG 412 Ca 0.20 -0.10 -0.11 0.00 0.07 0.00 0.00 59.98 60.04 2qkn h ARG 412 Cb 0.25 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2qkn h ARG 412 CO -0.27 0.52 -0.54 0.78 -1.07 0.00 0.00 179.97 179.39 2qkn h GLY 413 N 0.29 0.00 0.00 0.04 0.00 -0.48 -2.88 103.07 100.04 2qkn h GLY 413 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2qkn h GLY 413 CO -0.00 0.00 -0.40 -0.62 0.00 0.00 0.00 176.54 175.52 2qkn n VAL 414 N -3.46 1.01 -0.19 4.60 0.31 0.62 -1.83 118.33 119.39 2qkn n VAL 414 Ca 0.00 0.27 -0.07 0.00 -0.01 0.00 0.00 64.34 64.53 2qkn n VAL 414 Cb 0.65 -1.81 0.08 0.00 -0.91 0.00 0.00 33.84 31.86 2qkn n VAL 414 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2qkn h PHE 415 N -0.40 1.06 -0.13 3.52 0.04 -1.47 -0.42 116.94 119.13 2qkn h PHE 415 Ca 0.00 -0.15 0.00 0.00 2.80 0.00 0.00 57.97 60.62 2qkn h PHE 415 Cb 0.40 -0.29 0.00 0.00 2.20 0.00 0.00 35.95 38.26 2qkn h PHE 415 CO -0.17 0.92 0.00 1.63 -0.60 0.00 0.00 178.31 180.09 2qkn n LYS 416 N -4.20 2.38 0.00 1.51 5.02 -0.37 -4.32 118.16 118.18 2qkn n LYS 416 Ca 0.03 -2.02 0.00 0.00 -2.02 0.00 0.00 58.31 54.30 2qkn n LYS 416 Cb 0.31 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 2qkn n LYS 416 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qkn n GLY 417 N 1.40 1.03 0.31 0.72 0.00 -1.09 -4.77 105.19 102.79 2qkn n GLY 417 Ca 0.16 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.26 2qkn n GLY 417 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2qkn h ILE 418 N 0.00 0.27 0.00 -0.61 2.04 -1.27 -0.88 117.51 117.06 2qkn h ILE 418 Ca 0.00 -0.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 2qkn h ILE 418 Cb 0.00 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.18 2qkn h ILE 418 CO 0.00 0.03 -0.16 -0.07 0.00 0.00 0.00 178.15 177.95 2qkn h LEU 419 N 0.15 0.00 -9.97 1.44 4.07 -1.34 -3.46 115.31 106.20 2qkn h LEU 419 Ca 0.54 0.00 -0.54 0.00 0.08 0.00 0.00 57.88 57.96 2qkn h LEU 419 Cb 1.08 0.00 0.11 0.00 1.08 0.00 0.00 40.66 42.93 2qkn h LEU 419 CO -0.70 0.16 0.68 -1.10 -1.08 0.00 0.00 178.44 176.40 2qkn s GLN 420 N -3.51 3.80 0.00 1.13 -1.52 -0.34 -2.88 119.66 116.35 2qkn s GLN 420 Ca 0.02 2.35 0.00 0.00 -1.95 0.00 0.00 55.36 55.78 2qkn s GLN 420 Cb 0.09 -2.71 0.00 0.00 -0.22 0.00 0.00 33.01 30.17 2qkn s GLN 420 CO 0.63 -0.70 0.00 0.41 -0.25 0.00 0.00 175.29 175.38 2qkn n GLY 421 N 0.60 0.56 3.38 3.09 0.00 -1.26 -5.00 105.19 106.55 2qkn n GLY 421 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 2qkn n GLY 421 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qkn s THR 422 N -2.03 2.08 -0.32 2.61 -4.23 -1.14 -5.10 115.64 107.51 2qkn s THR 422 Ca 0.00 -1.95 -0.24 0.00 -1.18 0.00 0.00 61.69 58.32 2qkn s THR 422 Cb 0.00 -1.97 0.00 0.00 1.34 0.00 0.00 72.50 71.88 2qkn s THR 422 CO 0.00 -0.20 0.81 -1.81 -0.54 0.00 0.00 174.62 172.88 2qkn s ASP 423 N -2.62 6.67 -0.18 3.99 1.01 -1.26 -4.92 116.67 119.36 2qkn s ASP 423 Ca 0.18 0.65 -0.08 0.00 0.71 0.00 0.00 52.55 54.00 2qkn s ASP 423 Cb -0.07 -2.42 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 2qkn s ASP 423 CO 0.08 -0.66 0.09 -0.63 0.21 0.00 0.00 175.17 174.26 2qkn s ILE 424 N 3.05 5.09 -0.26 0.77 1.01 -1.26 -5.06 121.20 124.54 2qkn s ILE 424 Ca 0.33 0.07 0.00 0.00 0.00 0.00 0.00 60.65 61.06 2qkn s ILE 424 Cb -0.14 -3.30 0.07 0.00 0.01 0.00 0.00 42.46 39.11 2qkn s ILE 424 CO 0.14 0.47 0.00 -0.69 0.00 0.00 0.00 174.94 174.86 2qkn s VAL 425 N 0.20 1.39 0.00 2.92 1.01 -1.26 -5.02 120.40 119.64 2qkn s VAL 425 Ca 0.06 -1.35 0.00 0.00 0.00 0.00 0.00 61.98 60.70 2qkn s VAL 425 Cb -0.12 -1.81 0.00 0.00 0.00 0.00 0.00 36.38 34.45 2qkn s VAL 425 CO -0.00 -0.30 0.00 0.61 0.00 0.00 0.00 175.10 175.40 2qkn n GLY 426 N 4.69 4.17 3.84 4.51 0.00 -1.26 -0.62 105.19 120.51 2qkn n GLY 426 Ca -0.07 -1.49 -0.32 0.00 0.00 0.00 0.00 46.02 44.14 2qkn n GLY 426 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qkn s PRO 427 N -3.71 3.97 -0.36 1.61 0.04 -1.26 -4.80 135.00 130.49 2qkn s PRO 427 Ca 0.00 0.98 -0.02 0.00 0.04 0.00 0.00 61.00 62.00 2qkn s PRO 427 Cb 0.00 -2.14 0.09 0.00 0.04 0.00 0.00 34.50 32.49 2qkn s PRO 427 CO 0.00 -0.25 0.12 -0.51 0.04 0.00 0.00 177.00 176.39 2qkn s LEU 428 N -3.97 4.73 -0.19 -3.56 1.43 -1.26 -1.49 118.68 114.37 2qkn s LEU 428 Ca 0.59 -1.76 -0.09 0.00 -1.03 0.00 0.00 54.13 51.84 2qkn s LEU 428 Cb -0.10 -1.77 -0.05 0.00 0.03 0.00 0.00 46.19 44.30 2qkn s LEU 428 CO 0.29 -0.43 0.13 -0.63 0.23 0.00 0.00 176.35 175.94 2qkn s ILE 429 N 1.16 5.38 -0.05 -0.59 1.01 0.54 -1.27 121.20 127.39 2qkn s ILE 429 Ca 0.04 0.18 -0.02 0.00 0.00 0.00 0.00 60.65 60.85 2qkn s ILE 429 Cb -0.21 -3.44 0.04 0.00 0.01 0.00 0.00 42.46 38.85 2qkn s ILE 429 CO -0.03 0.46 0.10 -0.69 0.00 0.00 0.00 174.94 174.78 2qkn s VAL 430 N 0.20 -0.10 -0.17 2.92 1.01 -0.77 -0.48 120.40 123.01 2qkn s VAL 430 Ca 0.09 0.27 -0.29 0.00 0.00 0.00 0.00 61.98 62.05 2qkn s VAL 430 Cb -0.11 -0.18 0.10 0.00 0.00 0.00 0.00 36.38 36.18 2qkn s VAL 430 CO -0.01 0.11 0.86 -0.72 0.00 0.00 0.00 175.10 175.34 2qkn s TYR 431 N 1.52 -0.54 0.55 5.22 -0.85 -0.91 -1.83 117.35 120.51 2qkn s TYR 431 Ca -0.04 1.08 -0.17 0.00 -0.52 0.00 0.00 57.07 57.42 2qkn s TYR 431 Cb -0.12 0.39 -0.06 0.00 0.38 0.00 0.00 41.96 42.55 2qkn s TYR 431 CO -0.04 -0.41 1.03 -1.25 -1.52 0.00 0.00 175.55 173.35 2qkn s PRO 432 N -0.65 3.61 0.05 -3.49 0.04 -1.26 -0.29 135.00 133.01 2qkn s PRO 432 Ca -0.03 1.12 0.03 0.00 0.04 0.00 0.00 61.00 62.16 2qkn s PRO 432 Cb -0.02 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 2qkn s PRO 432 CO 0.03 -0.56 -0.10 -0.51 0.04 0.00 0.00 177.00 175.89 2qkn s LEU 433 N -4.23 2.27 -0.33 -3.56 1.43 0.87 -4.67 118.68 110.45 2qkn s LEU 433 Ca 0.62 -0.58 -0.12 0.00 -1.03 0.00 0.00 54.13 53.02 2qkn s LEU 433 Cb -0.14 -0.30 -0.01 0.00 0.03 0.00 0.00 46.19 45.77 2qkn s LEU 433 CO 0.33 -0.16 0.21 0.20 0.23 0.00 0.00 176.35 177.16 2qkn s ASN 434 N -1.66 5.85 0.52 2.29 0.01 -1.26 -2.17 114.94 118.51 2qkn s ASN 434 Ca -0.07 -0.52 0.24 0.00 -0.71 0.00 0.00 52.86 51.80 2qkn s ASN 434 Cb -0.10 -2.08 1.35 0.00 0.41 0.00 0.00 41.25 40.83 2qkn s ASN 434 CO 0.01 -0.24 1.99 0.50 -1.51 0.00 0.00 177.10 177.85 2qkn h LYS 435 N 8.44 0.06 -0.19 -0.60 3.64 -1.08 -1.26 116.57 125.58 2qkn h LYS 435 Ca -0.31 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.12 2qkn h LYS 435 Cb 1.15 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 2qkn h LYS 435 CO 0.63 0.04 0.19 0.66 -2.27 0.00 0.00 179.45 178.70 2qkn h SER 436 N 0.06 0.00 -0.44 4.20 4.64 -1.94 0.64 113.55 120.71 2qkn h SER 436 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2qkn h SER 436 Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 2qkn h SER 436 CO -0.02 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.17 2qkn n MET 437 N -3.92 2.01 -4.78 4.77 2.81 -0.47 -4.82 117.12 112.71 2qkn n MET 437 Ca 0.02 -1.56 -0.33 0.00 -1.81 0.00 0.00 57.70 54.01 2qkn n MET 437 Cb 0.32 -1.34 -0.13 0.00 -0.71 0.00 0.00 33.22 31.36 2qkn n MET 437 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 2qkn s TRP 438 N -1.42 2.79 -0.59 2.03 0.52 0.21 -4.21 118.94 118.27 2qkn s TRP 438 Ca 0.29 -0.30 -0.19 0.00 0.02 0.00 0.00 56.10 55.92 2qkn s TRP 438 Cb 0.15 -1.73 0.10 0.00 -1.15 0.00 0.00 33.47 30.84 2qkn s TRP 438 CO 0.20 0.06 0.70 0.34 0.02 0.00 0.00 176.95 178.27 2qkn s ASP 439 N -0.32 6.18 0.01 2.95 -1.08 -1.26 -4.91 116.67 118.25 2qkn s ASP 439 Ca 0.03 -1.43 0.04 0.00 -0.52 0.00 0.00 52.55 50.67 2qkn s ASP 439 Cb -0.13 -2.30 0.19 0.00 -1.46 0.00 0.00 42.92 39.22 2qkn s ASP 439 CO 0.03 -1.11 1.14 -0.67 0.52 0.00 0.00 175.17 175.07 2qkn n ASP 440 N 6.32 0.02 0.23 -0.34 2.03 -1.26 -0.67 116.55 122.89 2qkn n ASP 440 Ca -0.10 0.51 0.12 0.00 0.52 0.00 0.00 54.79 55.84 2qkn n ASP 440 Cb 0.42 -0.51 0.41 0.00 -0.72 0.00 0.00 41.12 40.72 2qkn n ASP 440 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2qkn h GLY 441 N 0.61 0.00 -0.88 0.27 0.00 -1.93 -3.44 103.07 97.69 2qkn h GLY 441 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.86 2qkn h GLY 441 CO 0.00 0.00 0.33 1.06 0.00 0.00 0.00 176.54 177.93 2qkn s MET 442 N -3.47 1.73 0.30 4.80 -1.94 0.16 -4.71 119.30 116.17 2qkn s MET 442 Ca 0.03 0.42 0.06 0.00 -1.71 0.00 0.00 55.69 54.49 2qkn s MET 442 Cb 0.08 -1.90 0.46 0.00 2.01 0.00 0.00 34.83 35.49 2qkn s MET 442 CO 0.63 -1.82 1.71 0.77 -0.01 0.00 0.00 175.02 176.30 2qkn h SER 443 N -1.23 0.29 -2.18 3.03 0.02 -1.08 -3.45 113.55 108.95 2qkn h SER 443 Ca -0.48 -0.11 -0.62 0.00 -0.84 0.00 0.00 61.79 59.73 2qkn h SER 443 Cb 1.30 -0.08 0.07 0.00 0.14 0.00 0.00 62.40 63.83 2qkn h SER 443 CO 0.61 0.65 0.49 0.00 -1.14 0.00 0.00 176.83 177.44 2qkn n ALA 444 N -2.48 0.10 -2.80 3.77 0.00 -1.22 -4.88 120.51 113.01 2qkn n ALA 444 Ca -0.01 0.45 -0.36 0.00 0.00 0.00 0.00 53.44 53.52 2qkn n ALA 444 Cb 0.46 -2.16 -0.07 0.00 0.00 0.00 0.00 19.45 17.68 2qkn n ALA 444 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qkn s ALA 445 N 0.13 3.74 0.10 0.00 0.00 -1.26 -4.91 121.76 119.56 2qkn s ALA 445 Ca 0.74 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 52.04 2qkn s ALA 445 Cb -0.78 -2.05 -0.04 0.00 0.00 0.00 0.00 23.12 20.24 2qkn s ALA 445 CO 0.48 0.36 -0.06 0.95 0.00 0.00 0.00 175.76 177.50 2qkn s THR 446 N -0.24 0.66 0.95 0.00 -4.23 -1.26 -4.92 115.64 106.60 2qkn s THR 446 Ca 0.11 -1.93 -0.11 0.00 -1.18 0.00 0.00 61.69 58.57 2qkn s THR 446 Cb -0.12 -1.72 0.16 0.00 1.34 0.00 0.00 72.50 72.17 2qkn s THR 446 CO 0.01 -0.84 1.10 -2.84 -0.54 0.00 0.00 174.62 171.51 2qkn s PRO 447 N -3.85 0.77 0.30 3.99 0.02 -1.26 -4.95 135.00 130.02 2qkn s PRO 447 Ca 0.13 1.18 0.15 0.00 0.02 0.00 0.00 61.00 62.48 2qkn s PRO 447 Cb 0.06 -1.73 0.27 0.00 0.02 0.00 0.00 34.50 33.12 2qkn s PRO 447 CO -0.04 -2.68 1.54 0.66 -0.33 0.00 0.00 177.00 176.15 2qkn h SER 448 N -1.89 0.00 -4.08 2.53 4.64 -1.98 -3.47 113.55 109.31 2qkn h SER 448 Ca -0.49 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.30 2qkn h SER 448 Cb 1.28 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 63.49 2qkn h SER 448 CO 0.48 0.52 0.51 -1.61 -0.87 0.00 0.00 176.83 175.85 2qkn s GLU 449 N -3.19 3.04 0.51 4.77 2.02 -1.26 -4.92 118.70 119.68 2qkn s GLU 449 Ca 0.02 1.93 0.16 0.00 0.02 0.00 0.00 54.97 57.11 2qkn s GLU 449 Cb 0.09 -2.04 1.25 0.00 0.10 0.00 0.00 34.13 33.53 2qkn s GLU 449 CO 0.73 -1.18 2.12 -0.44 0.02 0.00 0.00 175.26 176.51 2qkn h ASP 450 N 1.09 0.05 -3.40 -0.19 3.32 -1.95 -3.40 116.42 111.93 2qkn h ASP 450 Ca -0.50 -0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.00 2qkn h ASP 450 Cb 1.30 -0.01 -0.33 0.00 0.22 0.00 0.00 39.33 40.50 2qkn h ASP 450 CO 0.56 0.03 -0.83 -0.69 -1.72 0.00 0.00 179.24 176.60 2qkn s VAL 451 N -5.11 1.29 0.03 -1.35 1.01 -1.26 -0.55 120.40 114.47 2qkn s VAL 451 Ca -0.05 -0.57 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 2qkn s VAL 451 Cb 0.17 -1.17 -0.01 0.00 0.00 0.00 0.00 36.38 35.38 2qkn s VAL 451 CO 0.69 0.39 0.07 0.72 0.00 0.00 0.00 175.10 176.97 2qkn s PHE 452 N 0.61 0.22 -0.06 5.22 -0.12 -0.92 -1.68 117.98 121.25 2qkn s PHE 452 Ca -0.15 -0.53 -0.05 0.00 -0.05 0.00 0.00 56.93 56.15 2qkn s PHE 452 Cb -0.16 -0.16 -0.04 0.00 -0.63 0.00 0.00 43.02 42.03 2qkn s PHE 452 CO 0.05 -0.34 0.15 0.71 -0.05 0.00 0.00 175.22 175.74 2qkn s TYR 453 N -2.49 3.54 -0.16 3.49 1.51 0.23 -0.09 117.35 123.38 2qkn s TYR 453 Ca -0.06 0.42 -0.21 0.00 -1.01 0.00 0.00 57.07 56.22 2qkn s TYR 453 Cb -0.02 -1.87 -0.03 0.00 -0.11 0.00 0.00 41.96 39.93 2qkn s TYR 453 CO -0.04 0.68 0.62 0.00 -1.11 0.00 0.00 175.55 175.70 2qkn s ALA 454 N -1.16 3.49 -0.19 3.71 0.00 0.60 -0.37 121.76 127.84 2qkn s ALA 454 Ca 0.21 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 52.00 2qkn s ALA 454 Cb -0.12 -2.91 0.04 0.00 0.00 0.00 0.00 23.12 20.12 2qkn s ALA 454 CO 0.11 -0.37 -0.12 0.08 0.00 0.00 0.00 175.76 175.46 2qkn s VAL 455 N 1.46 1.73 -0.26 0.00 1.01 0.83 -2.14 120.40 123.03 2qkn s VAL 455 Ca 0.30 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.32 2qkn s VAL 455 Cb -0.16 -1.73 0.07 0.00 0.00 0.00 0.00 36.38 34.56 2qkn s VAL 455 CO 0.12 0.27 -0.01 -0.44 0.00 0.00 0.00 175.10 175.03 2qkn s SER 456 N 1.38 3.94 -0.55 3.32 0.01 0.37 -0.59 113.70 121.58 2qkn s SER 456 Ca 0.00 -1.34 -0.14 0.00 1.31 0.00 0.00 55.95 55.78 2qkn s SER 456 Cb -0.15 -1.15 0.14 0.00 0.21 0.00 0.00 66.02 65.06 2qkn s SER 456 CO -0.09 -0.28 0.49 -0.76 0.41 0.00 0.00 173.24 173.00 2qkn s LEU 457 N 1.39 6.11 -1.31 2.44 1.43 0.06 -0.34 118.68 128.46 2qkn s LEU 457 Ca -0.01 -1.91 -0.08 0.00 -1.03 0.00 0.00 54.13 51.09 2qkn s LEU 457 Cb -0.19 -2.16 0.14 0.00 0.03 0.00 0.00 46.19 44.01 2qkn s LEU 457 CO -0.09 -0.79 2.09 0.18 0.23 0.00 0.00 176.35 177.96 2qkn n LEU 458 N 5.03 7.17 -4.73 1.79 4.77 -0.55 -1.76 117.00 128.73 2qkn n LEU 458 Ca -0.10 -4.69 -0.42 0.00 -0.03 0.00 0.00 56.01 50.78 2qkn n LEU 458 Cb 0.41 -1.45 -0.03 0.00 -2.33 0.00 0.00 43.42 40.02 2qkn n LEU 458 CO 0.49 1.60 1.09 -0.36 -1.33 0.00 0.00 177.39 178.89 2qkn s PHE 459 N 0.11 3.15 -0.16 -1.77 0.08 -1.26 -3.99 117.98 114.14 2qkn s PHE 459 Ca 0.45 0.96 -0.03 0.00 0.12 0.00 0.00 56.93 58.43 2qkn s PHE 459 Cb 0.13 -3.75 -0.02 0.00 -0.57 0.00 0.00 43.02 38.80 2qkn s PHE 459 CO -0.03 -2.57 -0.05 -1.12 -0.10 0.00 0.00 175.22 171.35 2qkn s SER 460 N 0.77 4.57 -1.34 1.36 0.01 0.20 -3.40 113.70 115.87 2qkn s SER 460 Ca 0.63 -0.21 -0.10 0.00 1.31 0.00 0.00 55.95 57.57 2qkn s SER 460 Cb -0.39 -1.75 0.12 0.00 0.21 0.00 0.00 66.02 64.21 2qkn s SER 460 CO 0.35 0.13 2.03 -0.24 0.41 0.00 0.00 173.24 175.92 2qkn n SER 461 N 3.76 4.98 -0.03 2.44 2.88 -0.17 -4.68 113.62 122.80 2qkn n SER 461 Ca -0.18 -3.03 -0.14 0.00 -1.33 0.00 0.00 58.87 54.19 2qkn n SER 461 Cb 0.52 -1.52 -0.09 0.00 -0.75 0.00 0.00 64.21 62.37 2qkn n SER 461 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2qkn h VAL 462 N 3.73 1.44 -3.20 2.46 -1.51 -1.93 -3.38 116.25 113.85 2qkn h VAL 462 Ca 0.47 -1.60 -0.55 0.00 -1.23 0.00 0.00 66.70 63.78 2qkn h VAL 462 Cb 0.61 2.32 0.20 0.00 -2.13 0.00 0.00 31.29 32.29 2qkn h VAL 462 CO 1.70 0.45 -0.51 0.00 -1.23 0.00 0.00 177.57 177.98 2qkn n ALA 463 N -2.47 -1.96 -0.45 5.19 0.00 -1.26 -4.93 120.51 114.63 2qkn n ALA 463 Ca -0.08 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.01 2qkn n ALA 463 Cb 0.43 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.07 2qkn n ALA 463 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2qkn n PRO 464 N -0.81 0.00 -3.23 0.00 -0.02 -1.26 -3.36 135.00 126.32 2qkn n PRO 464 Ca 0.09 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.25 2qkn n PRO 464 Cb 0.51 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.94 2qkn n PRO 464 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2qkn n ASN 465 N 0.00 4.74 -0.84 2.55 3.02 -1.26 -4.72 115.26 118.75 2qkn n ASN 465 Ca 0.00 -3.47 0.12 0.00 -0.03 0.00 0.00 54.58 51.20 2qkn n ASN 465 Cb 0.00 -0.85 0.24 0.00 -0.61 0.00 0.00 39.78 38.57 2qkn n ASN 465 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2qkn n ASP 466 N 0.83 2.61 0.15 6.41 2.03 -1.21 -4.45 116.55 122.91 2qkn n ASP 466 Ca 0.30 -1.86 -0.14 0.00 0.52 0.00 0.00 54.79 53.61 2qkn n ASP 466 Cb 0.38 -0.05 -0.08 0.00 -0.72 0.00 0.00 41.12 40.65 2qkn n ASP 466 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2qkn h LEU 467 N 3.91 -0.30 -1.03 -2.67 5.85 -1.84 -2.84 115.31 116.39 2qkn h LEU 467 Ca 0.00 -0.12 0.21 0.00 0.84 0.00 0.00 57.88 58.81 2qkn h LEU 467 Cb 0.84 0.08 -0.11 0.00 0.37 0.00 0.00 40.66 41.83 2qkn h LEU 467 CO 0.00 -0.06 0.61 0.00 -0.34 0.00 0.00 178.44 178.65 2qkn h ALA 468 N 0.13 1.74 -0.19 1.25 0.00 -2.00 0.09 119.26 120.29 2qkn h ALA 468 Ca -0.04 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2qkn h ALA 468 Cb 0.40 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2qkn h ALA 468 CO 0.06 -0.14 0.01 -0.09 0.00 0.00 0.00 179.25 179.09 2qkn h ARG 469 N 0.69 0.32 -0.85 0.00 2.43 -1.84 -2.18 114.38 112.96 2qkn h ARG 469 Ca 0.60 -0.10 -0.03 0.00 -0.81 0.00 0.00 59.98 59.64 2qkn h ARG 469 Cb 1.02 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.50 2qkn h ARG 469 CO -0.40 0.51 0.42 -0.07 -1.51 0.00 0.00 179.97 178.93 2qkn h LEU 470 N 0.09 1.10 -1.04 3.80 3.38 -0.92 0.11 115.31 121.82 2qkn h LEU 470 Ca 0.05 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 2qkn h LEU 470 Cb 0.36 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2qkn h LEU 470 CO 0.01 0.91 0.06 1.56 0.09 0.00 0.00 178.44 181.07 2qkn h GLN 471 N 1.21 0.75 -0.20 1.13 4.20 -0.96 -0.27 115.11 120.96 2qkn h GLN 471 Ca 0.29 -0.17 -0.18 0.00 0.06 0.00 0.00 58.65 58.65 2qkn h GLN 471 Cb 0.09 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.77 2qkn h GLN 471 CO -0.04 0.72 -0.62 1.49 -0.67 0.00 0.00 178.83 179.71 2qkn h GLU 472 N 0.71 0.69 -0.52 1.46 4.57 -0.79 -2.49 114.58 118.21 2qkn h GLU 472 Ca 0.15 -0.48 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 2qkn h GLU 472 Cb 0.35 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 2qkn h GLU 472 CO 0.01 1.10 0.33 0.37 -1.18 0.00 0.00 179.01 179.63 2qkn h GLN 473 N 0.51 0.70 -0.66 1.92 4.15 -0.16 0.59 115.11 122.17 2qkn h GLN 473 Ca -0.01 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 2qkn h GLN 473 Cb 1.20 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 28.71 2qkn h GLN 473 CO 0.12 0.49 0.31 -0.91 -1.93 0.00 0.00 178.83 176.92 2qkn h ASN 474 N 0.71 0.84 -0.55 -0.69 2.35 -0.97 -0.10 115.58 117.16 2qkn h ASN 474 Ca 0.19 -0.09 -0.05 0.00 -0.55 0.00 0.00 56.30 55.80 2qkn h ASN 474 Cb -0.05 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.09 2qkn h ASN 474 CO -0.04 0.71 0.15 0.03 -1.65 0.00 0.00 177.43 176.63 2qkn h ARG 475 N 0.93 0.88 -0.51 0.81 3.08 -0.89 -1.40 114.38 117.29 2qkn h ARG 475 Ca 0.23 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2qkn h ARG 475 Cb 0.10 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 2qkn h ARG 475 CO -0.03 0.82 0.33 0.00 -1.07 0.00 0.00 179.97 180.01 2qkn h ARG 476 N 0.78 0.68 -0.11 0.04 3.08 -0.08 0.16 114.38 118.94 2qkn h ARG 476 Ca 0.18 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.18 2qkn h ARG 476 Cb 0.32 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 2qkn h ARG 476 CO -0.00 0.46 0.05 0.82 -1.07 0.00 0.00 179.97 180.24 2qkn h ILE 477 N 0.68 1.00 -0.79 2.04 2.04 -0.81 0.23 117.51 121.91 2qkn h ILE 477 Ca 0.18 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.98 2qkn h ILE 477 Cb -0.05 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 2qkn h ILE 477 CO -0.04 0.02 0.42 -0.07 0.00 0.00 0.00 178.15 178.48 2qkn h LEU 478 N 0.12 1.00 -0.19 1.44 3.38 -1.01 -1.70 115.31 118.35 2qkn h LEU 478 Ca 0.04 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2qkn h LEU 478 Cb 0.00 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2qkn h LEU 478 CO -0.03 0.82 0.08 -0.09 0.09 0.00 0.00 178.44 179.32 2qkn h ARG 479 N 1.10 0.18 -0.56 1.13 2.43 -0.17 0.12 114.38 118.61 2qkn h ARG 479 Ca 0.28 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.52 2qkn h ARG 479 Cb 0.05 -0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 29.50 2qkn h ARG 479 CO -0.04 0.12 0.21 0.35 -1.51 0.00 0.00 179.97 179.09 2qkn h PHE 480 N 0.18 0.36 -0.61 2.20 3.57 -0.14 -0.71 116.94 121.79 2qkn h PHE 480 Ca 0.08 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 2qkn h PHE 480 Cb 0.03 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 2qkn h PHE 480 CO -0.10 0.10 0.16 0.00 -2.23 0.00 0.00 178.31 176.24 2qkn h ASP 482 N 0.89 0.69 0.30 0.00 3.32 -0.37 -1.48 116.42 119.77 2qkn h ASP 482 Ca 0.19 -0.20 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 2qkn h ASP 482 Cb 0.34 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 2qkn h ASP 482 CO -0.00 0.71 -0.39 -0.07 -1.72 0.00 0.00 179.24 177.76 2qkn h LEU 483 N 0.64 0.14 -0.03 1.55 3.38 -1.01 -2.73 115.31 117.25 2qkn h LEU 483 Ca 0.16 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2qkn h LEU 483 Cb 0.26 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2qkn h LEU 483 CO -0.01 0.53 -0.02 0.00 0.09 0.00 0.00 178.44 179.03 2qkn n ALA 484 N -2.47 2.54 -1.07 1.53 0.00 -0.33 -4.91 120.51 115.81 2qkn n ALA 484 Ca -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 53.44 53.25 2qkn n ALA 484 Cb 0.45 -1.47 -0.00 0.00 0.00 0.00 0.00 19.45 18.43 2qkn n ALA 484 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qkn n GLY 485 N 1.27 0.45 3.66 0.00 0.00 -0.94 -5.01 105.19 104.62 2qkn n GLY 485 Ca 0.15 -1.04 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 2qkn n GLY 485 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qkn s ILE 486 N -2.04 4.55 -1.39 -0.61 1.01 -0.60 -4.95 121.20 117.17 2qkn s ILE 486 Ca 0.00 1.87 -0.11 0.00 0.00 0.00 0.00 60.65 62.41 2qkn s ILE 486 Cb 0.00 -4.21 0.09 0.00 0.01 0.00 0.00 42.46 38.34 2qkn s ILE 486 CO 0.00 -0.17 2.16 0.00 0.00 0.00 0.00 174.94 176.93 2qkn n GLN 487 N 6.42 3.34 -2.31 2.79 1.13 -1.26 -4.68 117.38 122.81 2qkn n GLN 487 Ca 0.13 -2.99 -0.25 0.00 -1.94 0.00 0.00 57.00 51.95 2qkn n GLN 487 Cb 0.46 -3.06 0.06 0.00 0.11 0.00 0.00 30.24 27.81 2qkn n GLN 487 CO 0.00 0.00 0.00 1.52 -1.44 0.00 0.00 177.06 177.14 2qkn s TYR 488 N 1.71 2.85 -0.02 1.08 -0.85 -1.26 -4.56 117.35 116.30 2qkn s TYR 488 Ca 0.46 0.31 0.04 0.00 -0.52 0.00 0.00 57.07 57.36 2qkn s TYR 488 Cb 0.13 -3.10 -0.01 0.00 0.38 0.00 0.00 41.96 39.36 2qkn s TYR 488 CO -0.05 -1.31 -0.13 0.15 -1.52 0.00 0.00 175.55 172.70 2qkn s LYS 489 N -5.14 1.14 0.60 -3.49 -0.14 -0.63 -4.96 119.74 107.13 2qkn s LYS 489 Ca 0.60 -0.45 -0.08 0.00 -1.36 0.00 0.00 55.97 54.68 2qkn s LYS 489 Cb -0.10 -1.07 -0.01 0.00 -1.68 0.00 0.00 37.83 34.96 2qkn s LYS 489 CO 0.43 0.23 0.96 0.95 -0.76 0.00 0.00 175.35 177.16 2qkn s THR 490 N -0.13 4.19 -0.01 2.17 -4.23 -1.26 0.29 115.64 116.67 2qkn s THR 490 Ca 0.02 0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.93 2qkn s THR 490 Cb -0.07 -3.67 0.01 0.00 1.34 0.00 0.00 72.50 70.12 2qkn s THR 490 CO 0.00 -0.78 0.01 -0.47 -0.54 0.00 0.00 174.62 172.84 2qkn s TYR 491 N -3.07 0.03 0.00 3.99 5.04 -0.69 -4.76 117.35 117.88 2qkn s TYR 491 Ca 0.54 0.06 0.00 0.00 -2.44 0.00 0.00 57.07 55.23 2qkn s TYR 491 Cb -0.11 -0.13 0.00 0.00 0.35 0.00 0.00 41.96 42.08 2qkn s TYR 491 CO 0.49 -0.05 0.00 1.28 -1.34 0.00 0.00 175.55 175.94 2qkn n LEU 492 N 3.62 0.46 -4.77 6.97 4.77 -1.26 -4.32 117.00 122.46 2qkn n LEU 492 Ca -0.20 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.50 2qkn n LEU 492 Cb 0.55 -1.21 -0.06 0.00 -2.33 0.00 0.00 43.42 40.37 2qkn n LEU 492 CO 0.24 -0.40 -0.25 0.00 -1.33 0.00 0.00 177.39 175.65 2qkn s ALA 493 N -1.85 3.52 -0.15 -1.18 0.00 -1.26 -4.66 121.76 116.18 2qkn s ALA 493 Ca 0.00 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.83 2qkn s ALA 493 Cb 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 23.12 21.77 2qkn s ALA 493 CO 0.00 0.61 -0.18 -0.98 0.00 0.00 0.00 175.76 175.21 2qkn s ARG 494 N -2.75 3.13 0.47 0.00 1.04 -1.26 -5.06 118.95 114.52 2qkn s ARG 494 Ca 0.30 -0.79 -0.09 0.00 -1.04 0.00 0.00 55.73 54.10 2qkn s ARG 494 Cb -0.11 -2.54 -0.05 0.00 -2.04 0.00 0.00 34.95 30.21 2qkn s ARG 494 CO 0.22 0.00 0.82 -1.01 -0.04 0.00 0.00 175.30 175.30 2qkn s HIS 495 N 0.82 3.53 -0.34 5.89 3.76 -1.26 -5.00 115.29 122.68 2qkn s HIS 495 Ca -0.06 1.01 0.08 0.00 -0.15 0.00 0.00 55.06 55.94 2qkn s HIS 495 Cb -0.15 -2.45 0.19 0.00 1.11 0.00 0.00 32.58 31.28 2qkn s HIS 495 CO -0.01 -0.27 1.15 0.25 -0.85 0.00 0.00 174.74 175.01 2qkn n THR 496 N -1.89 1.24 -4.24 1.30 -2.24 -1.26 -4.62 114.28 102.57 2qkn n THR 496 Ca 0.02 -1.25 -0.21 0.00 -2.27 0.00 0.00 64.05 60.34 2qkn n THR 496 Cb 0.54 0.33 -0.16 0.00 -2.10 0.00 0.00 70.33 68.94 2qkn n THR 496 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qkn s ASP 497 N -1.33 1.19 0.26 3.42 -1.08 -1.26 -5.04 116.67 112.83 2qkn s ASP 497 Ca 0.16 -0.17 -0.01 0.00 -0.52 0.00 0.00 52.55 52.01 2qkn s ASP 497 Cb 0.11 -0.55 0.57 0.00 -1.46 0.00 0.00 42.92 41.59 2qkn s ASP 497 CO 0.06 -0.04 1.70 -0.09 0.52 0.00 0.00 175.17 177.33 2qkn h ARG 498 N 7.19 0.38 0.00 4.34 9.65 -1.91 0.18 114.38 134.20 2qkn h ARG 498 Ca -0.36 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.49 2qkn h ARG 498 Cb 1.16 -0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 29.65 2qkn h ARG 498 CO 0.46 0.25 -0.05 0.66 2.80 0.00 0.00 179.97 184.09 2qkn h SER 499 N 0.39 0.00 -0.18 -3.80 4.64 -1.99 -1.24 113.55 111.37 2qkn h SER 499 Ca 0.48 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.59 2qkn h SER 499 Cb 0.82 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.92 2qkn h SER 499 CO -0.48 0.05 -0.70 0.44 -0.87 0.00 0.00 176.83 175.26 2qkn h ASP 500 N 0.00 0.94 0.24 4.97 3.32 -1.06 -2.29 116.42 122.54 2qkn h ASP 500 Ca -0.00 -0.58 -0.15 0.00 0.02 0.00 0.00 57.03 56.32 2qkn h ASP 500 Cb 0.11 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 2qkn h ASP 500 CO 0.01 1.38 -0.56 -0.50 -1.72 0.00 0.00 179.24 177.84 2qkn h TRP 501 N 0.58 0.43 -0.53 4.55 4.06 -1.04 0.45 115.95 124.44 2qkn h TRP 501 Ca -0.03 -0.15 -0.05 0.00 2.06 0.00 0.00 58.89 60.72 2qkn h TRP 501 Cb 1.32 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 29.38 2qkn h TRP 501 CO 0.08 0.82 0.14 0.28 -3.56 0.00 0.00 178.44 176.20 2qkn h VAL 502 N 0.26 1.24 -0.31 1.49 2.07 -1.25 -1.80 116.25 117.95 2qkn h VAL 502 Ca 0.00 -0.85 -0.13 0.00 0.82 0.00 0.00 66.70 66.54 2qkn h VAL 502 Cb 1.07 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 2qkn h VAL 502 CO 0.09 0.31 -0.34 -0.09 0.02 0.00 0.00 177.57 177.56 2qkn h ARG 503 N 0.75 0.69 -0.07 1.57 2.43 -1.26 0.16 114.38 118.66 2qkn h ARG 503 Ca 0.17 -0.33 0.03 0.00 -0.81 0.00 0.00 59.98 59.04 2qkn h ARG 503 Cb 0.33 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 2qkn h ARG 503 CO 0.00 0.93 -0.09 1.25 -1.51 0.00 0.00 179.97 180.55 2qkn h HIS 504 N 0.58 -0.23 0.11 2.20 2.76 -0.48 -3.12 115.15 116.96 2qkn h HIS 504 Ca 0.06 0.01 -0.28 0.00 -2.20 0.00 0.00 60.37 57.96 2qkn h HIS 504 Cb 0.86 0.11 -0.00 0.00 1.55 0.00 0.00 27.41 29.93 2qkn h HIS 504 CO 0.04 -0.14 -1.33 0.74 -1.30 0.00 0.00 177.93 175.94 2qkn h PHE 505 N -0.13 0.43 0.00 5.26 0.04 -1.33 -3.46 116.94 117.75 2qkn h PHE 505 Ca 0.06 -0.31 0.00 0.00 2.80 0.00 0.00 57.97 60.52 2qkn h PHE 505 Cb 0.21 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.35 2qkn h PHE 505 CO -0.19 1.28 0.00 0.41 -0.60 0.00 0.00 178.31 179.21 2qkn n GLY 506 N 1.56 2.58 0.25 -1.45 0.00 0.56 -4.52 105.19 104.18 2qkn n GLY 506 Ca -0.10 -1.50 0.02 0.00 0.00 0.00 0.00 46.02 44.43 2qkn n GLY 506 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qkn h ALA 507 N 0.00 0.60 -0.21 4.61 0.00 -1.88 0.41 119.26 122.79 2qkn h ALA 507 Ca 0.00 0.22 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 2qkn h ALA 507 Cb 0.00 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2qkn h ALA 507 CO 0.00 -0.41 -0.11 0.00 0.00 0.00 0.00 179.25 178.73 2qkn h ALA 508 N 1.62 0.29 0.00 0.00 0.00 -1.92 -2.45 119.26 116.81 2qkn h ALA 508 Ca 0.34 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2qkn h ALA 508 Cb 0.56 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2qkn h ALA 508 CO -0.60 0.14 -0.29 -0.22 0.00 0.00 0.00 179.25 178.28 2qkn h LYS 509 N 0.14 0.00 -0.39 0.00 3.64 -1.66 -2.47 116.57 115.83 2qkn h LYS 509 Ca 0.05 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2qkn h LYS 509 Cb 0.60 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 2qkn h LYS 509 CO 0.03 0.29 0.16 2.35 -2.27 0.00 0.00 179.45 180.01 2qkn h TRP 510 N 0.00 0.59 -0.77 1.91 2.91 0.03 -1.38 115.95 119.25 2qkn h TRP 510 Ca -0.00 -0.04 0.04 0.00 1.13 0.00 0.00 58.89 60.02 2qkn h TRP 510 Cb 0.51 -0.18 -0.04 0.00 -0.51 0.00 0.00 29.16 28.94 2qkn h TRP 510 CO 0.00 0.52 0.50 -0.91 -1.03 0.00 0.00 178.44 177.53 2qkn h ASN 511 N 0.48 0.79 -0.59 2.65 2.35 -0.98 -0.11 115.58 120.16 2qkn h ASN 511 Ca 0.13 -0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.78 2qkn h ASN 511 Cb 0.18 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 2qkn h ASN 511 CO -0.01 0.53 -0.01 -0.09 -1.65 0.00 0.00 177.43 176.21 2qkn h ARG 512 N 0.91 1.06 -0.54 0.81 2.43 -1.20 -0.29 114.38 117.55 2qkn h ARG 512 Ca 0.31 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2qkn h ARG 512 Cb 0.10 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 2qkn h ARG 512 CO -0.10 1.04 0.34 0.35 -1.51 0.00 0.00 179.97 180.09 2qkn h PHE 513 N 0.97 0.70 -0.51 2.20 3.57 -0.03 -1.73 116.94 122.12 2qkn h PHE 513 Ca 0.17 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 2qkn h PHE 513 Cb 0.56 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 2qkn h PHE 513 CO 0.04 0.47 0.03 0.28 -2.23 0.00 0.00 178.31 176.90 2qkn h VAL 514 N 0.73 1.26 -0.68 1.41 2.07 -0.80 -1.10 116.25 119.15 2qkn h VAL 514 Ca 0.20 -1.03 0.06 0.00 0.82 0.00 0.00 66.70 66.75 2qkn h VAL 514 Cb -0.04 0.93 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 2qkn h VAL 514 CO -0.04 0.36 0.38 -0.08 0.02 0.00 0.00 177.57 178.21 2qkn h GLU 515 N 0.74 0.68 0.00 1.57 4.81 -0.67 0.12 114.58 121.82 2qkn h GLU 515 Ca 0.15 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.30 2qkn h GLU 515 Cb 0.47 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2qkn h GLU 515 CO 0.02 0.45 -0.19 0.52 -0.73 0.00 0.00 179.01 179.08 2qkn h MET 516 N 0.70 0.00 -0.03 1.92 2.86 -1.06 -2.29 114.93 117.03 2qkn h MET 516 Ca 0.30 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.89 2qkn h MET 516 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 2qkn h MET 516 CO -0.18 0.19 -0.18 -0.22 1.06 0.00 0.00 176.91 177.57 2qkn h LYS 517 N 0.00 0.17 0.00 1.72 1.63 0.33 -1.71 116.57 118.71 2qkn h LYS 517 Ca -0.00 -0.15 -0.02 0.00 -0.85 0.00 0.00 60.65 59.63 2qkn h LYS 517 Cb 0.71 0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.37 2qkn h LYS 517 CO 0.02 0.83 -0.09 -0.91 -3.45 0.00 0.00 179.45 175.85 2qkn h ASN 518 N -0.43 0.00 0.20 4.20 2.35 -0.74 0.16 115.58 121.31 2qkn h ASN 518 Ca -0.02 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.39 2qkn h ASN 518 Cb 0.87 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.25 2qkn h ASN 518 CO 0.04 0.09 -1.67 0.50 -1.65 0.00 0.00 177.43 174.74 2qkn h LYS 519 N 0.00 0.42 0.00 0.81 3.64 -1.37 -3.35 116.57 116.72 2qkn h LYS 519 Ca -0.00 -0.71 0.00 0.00 -1.27 0.00 0.00 60.65 58.67 2qkn h LYS 519 Cb 0.19 0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2qkn h LYS 519 CO 0.01 1.34 -1.53 0.66 -2.27 0.00 0.00 179.45 177.66 2qkn n TYR 520 N -3.65 0.00 -2.97 1.91 4.01 -0.65 -4.72 117.16 111.09 2qkn n TYR 520 Ca -0.23 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.37 2qkn n TYR 520 Cb 1.07 -0.29 0.03 0.00 -0.31 0.00 0.00 39.34 39.83 2qkn n TYR 520 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2qkn n ASP 521 N -1.92 -0.69 0.19 7.72 2.03 0.53 0.22 116.55 124.63 2qkn n ASP 521 Ca -0.02 -3.35 0.18 0.00 0.52 0.00 0.00 54.79 52.12 2qkn n ASP 521 Cb 0.40 0.61 0.81 0.00 -0.72 0.00 0.00 41.12 42.22 2qkn n ASP 521 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2qkn h PRO 522 N 3.00 0.00 -0.01 -0.67 0.13 -1.64 -0.19 132.00 132.62 2qkn h PRO 522 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2qkn h PRO 522 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2qkn h PRO 522 CO 0.32 0.00 -0.08 1.63 -0.23 0.00 0.00 178.00 179.64 2qkn n LYS 523 N -3.81 1.00 -3.74 0.86 5.02 -1.26 -4.95 118.16 111.28 2qkn n LYS 523 Ca 0.02 -0.40 -0.30 0.00 -2.02 0.00 0.00 58.31 55.61 2qkn n LYS 523 Cb 0.37 -1.49 0.03 0.00 -0.02 0.00 0.00 35.03 33.92 2qkn n LYS 523 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qkn n ARG 524 N -0.65 -1.78 -0.03 1.97 1.74 -0.08 -4.91 116.66 112.92 2qkn n ARG 524 Ca 0.17 0.44 -0.00 0.00 -0.77 0.00 0.00 57.85 57.69 2qkn n ARG 524 Cb 0.27 -4.21 -0.08 0.00 -1.02 0.00 0.00 32.46 27.43 2qkn n ARG 524 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2qkn n LEU 525 N -4.26 0.00 -4.72 0.55 4.77 -1.26 -4.91 117.00 107.17 2qkn n LEU 525 Ca -0.15 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.42 2qkn n LEU 525 Cb 0.61 0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.79 2qkn n LEU 525 CO 0.69 0.12 0.79 -0.76 -1.33 0.00 0.00 177.39 176.90 2qkn s LEU 526 N -4.22 4.42 -1.23 2.23 1.43 -1.26 0.90 118.68 120.95 2qkn s LEU 526 Ca -0.04 1.94 -0.27 0.00 -1.03 0.00 0.00 54.13 54.73 2qkn s LEU 526 Cb 0.04 -3.59 0.03 0.00 0.03 0.00 0.00 46.19 42.70 2qkn s LEU 526 CO 0.40 -0.30 0.66 -1.20 0.23 0.00 0.00 176.35 176.14 2qkn n SER 527 N 3.28 -3.95 0.30 2.29 7.64 0.96 -4.62 113.62 119.51 2qkn n SER 527 Ca 0.05 -1.21 0.16 0.00 1.01 0.00 0.00 58.87 58.89 2qkn n SER 527 Cb 0.48 -2.21 0.93 0.00 -1.01 0.00 0.00 64.21 62.39 2qkn n SER 527 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2qkn h PRO 528 N -2.35 0.00 0.00 1.43 0.13 -1.78 -2.58 132.00 126.86 2qkn h PRO 528 Ca -0.69 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 2qkn h PRO 528 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 2qkn h PRO 528 CO 0.53 0.03 0.00 0.41 -0.23 0.00 0.00 178.00 178.74 2qkn n GLY 529 N -1.02 -0.72 0.20 1.56 0.00 -1.24 -0.90 105.19 103.06 2qkn n GLY 529 Ca -0.02 0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.23 2qkn n GLY 529 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2qkn h GLN 530 N 0.00 0.00 -2.96 1.61 1.08 -1.65 -3.33 115.11 109.86 2qkn h GLN 530 Ca 0.00 0.00 -0.40 0.00 -1.45 0.00 0.00 58.65 56.80 2qkn h GLN 530 Cb 0.02 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 2qkn h GLN 530 CO 0.00 0.00 -0.52 -0.25 -0.95 0.00 0.00 178.83 177.11 2qkn n ASP 531 N -2.82 -5.76 -0.08 1.46 8.00 -0.08 -4.30 116.55 112.97 2qkn n ASP 531 Ca 0.04 -0.04 -0.09 0.00 0.71 0.00 0.00 54.79 55.41 2qkn n ASP 531 Cb 0.44 -4.77 -0.05 0.00 -0.02 0.00 0.00 41.12 36.73 2qkn n ASP 531 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2qkn h ILE 532 N -0.09 0.31 -0.30 0.53 2.04 -1.84 -3.41 117.51 114.77 2qkn h ILE 532 Ca -0.48 -1.38 0.00 0.00 1.00 0.00 0.00 64.86 64.00 2qkn h ILE 532 Cb 1.35 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 2qkn h ILE 532 CO 0.56 0.11 0.00 0.49 0.00 0.00 0.00 178.15 179.31 2qkn n PHE 533 N -4.58 0.75 -1.14 1.37 3.72 -1.26 -4.93 117.46 111.39 2qkn n PHE 533 Ca -0.14 -0.72 0.00 0.00 -0.05 0.00 0.00 57.45 56.54 2qkn n PHE 533 Cb 0.37 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 2qkn n PHE 533 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80