#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qk1 s ALA 2 N 0.00 3.41 0.06 0.00 0.00 -1.26 -5.07 121.76 118.90 1qk1 s ALA 2 Ca 0.00 -1.88 -0.21 0.00 0.00 0.00 0.00 51.96 49.87 1qk1 s ALA 2 Cb 0.00 -2.81 -0.06 0.00 0.00 0.00 0.00 23.12 20.24 1qk1 s ALA 2 CO 0.00 -1.53 0.63 0.45 0.00 0.00 0.00 175.76 175.31 1qk1 s SER 3 N 1.93 7.10 0.00 0.00 0.15 -1.26 -4.93 113.70 116.70 1qk1 s SER 3 Ca 0.04 1.31 0.30 0.00 0.70 0.00 0.00 55.95 58.30 1qk1 s SER 3 Cb -0.21 -2.40 1.59 0.00 -1.71 0.00 0.00 66.02 63.29 1qk1 s SER 3 CO 0.07 0.18 2.05 -1.84 1.20 0.00 0.00 173.24 174.90 1qk1 n GLU 4 N 2.13 1.15 0.00 5.44 0.28 -1.26 -3.19 120.64 125.19 1qk1 n GLU 4 Ca -0.08 -0.30 0.10 0.00 -0.16 0.00 0.00 57.16 56.72 1qk1 n GLU 4 Cb 0.50 -1.49 -0.05 0.00 1.43 0.00 0.00 31.44 31.84 1qk1 n GLU 4 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 1qk1 n ARG 5 N -0.66 0.90 -3.16 3.44 0.63 -1.26 -4.94 116.66 111.61 1qk1 n ARG 5 Ca 0.21 -0.62 -0.33 0.00 -0.92 0.00 0.00 57.85 56.19 1qk1 n ARG 5 Cb 0.20 -1.46 -0.06 0.00 0.45 0.00 0.00 32.46 31.59 1qk1 n ARG 5 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1qk1 s ARG 6 N -2.60 4.02 0.09 -0.14 0.52 -1.19 -5.05 118.95 114.61 1qk1 s ARG 6 Ca 0.14 0.66 -0.22 0.00 -0.52 0.00 0.00 55.73 55.79 1qk1 s ARG 6 Cb 0.17 -2.53 -0.07 0.00 0.52 0.00 0.00 34.95 33.04 1qk1 s ARG 6 CO 0.66 0.21 0.67 1.03 0.02 0.00 0.00 175.30 177.89 1qk1 s ARG 7 N -2.79 4.38 0.30 3.54 1.81 -1.26 -5.02 118.95 119.91 1qk1 s ARG 7 Ca 0.51 0.92 -0.17 0.00 -1.72 0.00 0.00 55.73 55.27 1qk1 s ARG 7 Cb -0.11 -3.27 -0.09 0.00 -0.45 0.00 0.00 34.95 31.02 1qk1 s ARG 7 CO 0.18 0.55 0.76 -0.51 -0.68 0.00 0.00 175.30 175.60 1qk1 s LEU 8 N -0.90 4.15 0.21 2.53 1.43 -1.26 -4.98 118.68 119.86 1qk1 s LEU 8 Ca 0.33 1.39 -0.32 0.00 -1.03 0.00 0.00 54.13 54.49 1qk1 s LEU 8 Cb -0.21 -3.97 -0.13 0.00 0.03 0.00 0.00 46.19 41.91 1qk1 s LEU 8 CO 0.22 -0.14 1.57 -1.22 0.23 0.00 0.00 176.35 177.00 1qk1 n TYR 9 N -0.02 2.43 -1.29 0.29 4.01 -1.26 -4.90 117.16 116.42 1qk1 n TYR 9 Ca 0.02 0.26 -0.32 0.00 -0.16 0.00 0.00 57.90 57.70 1qk1 n TYR 9 Cb 0.52 -2.56 0.10 0.00 -0.31 0.00 0.00 39.34 37.10 1qk1 n TYR 9 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1qk1 s PRO 10 N 0.43 2.07 0.24 -0.72 0.04 -1.26 -4.87 135.00 130.93 1qk1 s PRO 10 Ca 0.73 1.46 -0.09 0.00 0.04 0.00 0.00 61.00 63.15 1qk1 s PRO 10 Cb -0.61 -1.85 0.39 0.00 0.04 0.00 0.00 34.50 32.47 1qk1 s PRO 10 CO 0.41 -1.83 1.63 -1.35 0.04 0.00 0.00 177.00 175.90 1qk1 h PRO 11 N -0.81 0.06 -0.02 0.56 0.11 -1.96 0.69 132.00 130.64 1qk1 h PRO 11 Ca -0.45 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.66 1qk1 h PRO 11 Cb 1.26 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1qk1 h PRO 11 CO 0.49 0.04 0.02 0.77 -0.21 0.00 0.00 178.00 179.12 1qk1 h SER 12 N 0.06 0.00 0.74 -2.05 0.02 -1.93 -0.77 113.55 109.61 1qk1 h SER 12 Ca 0.39 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.32 1qk1 h SER 12 Cb 0.67 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.21 1qk1 h SER 12 CO -0.70 0.00 -0.11 0.00 -1.14 0.00 0.00 176.83 174.88 1qk1 h ALA 13 N 1.97 1.08 -0.01 3.77 0.00 -1.19 -2.74 119.26 122.15 1qk1 h ALA 13 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1qk1 h ALA 13 Cb 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1qk1 h ALA 13 CO -0.00 0.14 -0.70 0.39 0.00 0.00 0.00 179.25 179.08 1qk1 n GLU 14 N -3.34 0.62 -1.67 0.00 -0.58 -0.32 -4.99 120.64 110.35 1qk1 n GLU 14 Ca -0.00 -0.50 -0.45 0.00 -0.42 0.00 0.00 57.16 55.78 1qk1 n GLU 14 Cb 0.32 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.66 1qk1 n GLU 14 CO 0.00 0.00 0.00 0.98 -0.48 0.00 0.00 177.13 177.63 1qk1 n TYR 15 N -0.75 2.19 -2.32 -0.32 9.36 -1.03 -4.94 117.16 119.34 1qk1 n TYR 15 Ca 0.07 0.39 -0.33 0.00 3.32 0.00 0.00 57.90 61.34 1qk1 n TYR 15 Cb 0.40 -2.48 -0.01 0.00 -0.63 0.00 0.00 39.34 36.61 1qk1 n TYR 15 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1qk1 s PRO 16 N 0.00 3.59 -0.64 2.98 0.04 -1.26 -4.98 135.00 134.74 1qk1 s PRO 16 Ca 0.72 1.29 -0.22 0.00 0.04 0.00 0.00 61.00 62.82 1qk1 s PRO 16 Cb -0.66 -2.07 0.07 0.00 0.04 0.00 0.00 34.50 31.88 1qk1 s PRO 16 CO 0.46 -0.60 0.92 0.34 0.04 0.00 0.00 177.00 178.17 1qk1 s ASP 17 N -2.35 6.19 -0.22 6.66 -1.08 -1.26 -4.86 116.67 119.75 1qk1 s ASP 17 Ca 0.66 -0.97 0.14 0.00 -0.52 0.00 0.00 52.55 51.86 1qk1 s ASP 17 Cb -0.16 -2.40 0.56 0.00 -1.46 0.00 0.00 42.92 39.46 1qk1 s ASP 17 CO 0.28 -1.37 1.49 0.18 0.52 0.00 0.00 175.17 176.27 1qk1 n LEU 18 N 7.48 4.25 0.20 -1.34 4.77 -1.26 -4.72 117.00 126.39 1qk1 n LEU 18 Ca -0.04 -3.18 0.09 0.00 -0.03 0.00 0.00 56.01 52.84 1qk1 n LEU 18 Cb 0.45 -0.59 0.62 0.00 -2.33 0.00 0.00 43.42 41.57 1qk1 n LEU 18 CO 0.63 0.80 1.09 0.03 -1.33 0.00 0.00 177.39 178.61 1qk1 h ARG 19 N 1.81 0.06 -0.54 3.23 3.08 -2.00 -2.19 114.38 117.84 1qk1 h ARG 19 Ca 0.07 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1qk1 h ARG 19 Cb 1.61 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.65 1qk1 h ARG 19 CO 0.33 0.04 0.00 1.63 -1.07 0.00 0.00 179.97 180.90 1qk1 n LYS 20 N -4.52 3.01 -2.71 0.04 5.02 -1.26 -5.01 118.16 112.73 1qk1 n LYS 20 Ca -0.01 -2.50 -0.30 0.00 -2.02 0.00 0.00 58.31 53.48 1qk1 n LYS 20 Cb 0.14 -1.54 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 1qk1 n LYS 20 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1qk1 s HIS 21 N -1.30 3.49 -0.43 2.13 3.76 -0.82 -4.87 115.29 117.24 1qk1 s HIS 21 Ca 0.39 1.09 0.05 0.00 -0.15 0.00 0.00 55.06 56.45 1qk1 s HIS 21 Cb 0.23 -2.49 0.19 0.00 1.11 0.00 0.00 32.58 31.62 1qk1 s HIS 21 CO 0.23 -0.19 0.48 -1.71 -0.85 0.00 0.00 174.74 172.70 1qk1 n ASN 22 N -1.52 -1.14 -3.72 1.40 5.15 0.57 -4.99 115.26 111.01 1qk1 n ASN 22 Ca 0.03 -2.59 -0.10 0.00 -0.60 0.00 0.00 54.58 51.32 1qk1 n ASN 22 Cb 0.54 0.05 -0.05 0.00 -0.53 0.00 0.00 39.78 39.79 1qk1 n ASN 22 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1qk1 s ASN 23 N -0.07 -0.15 0.26 1.20 2.20 -1.26 -4.03 114.94 113.08 1qk1 s ASN 23 Ca 0.33 -0.45 -0.02 0.00 -0.94 0.00 0.00 52.86 51.77 1qk1 s ASN 23 Cb 0.06 0.46 0.46 0.00 -2.00 0.00 0.00 41.25 40.23 1qk1 s ASN 23 CO -0.16 -0.86 1.80 0.00 -2.94 0.00 0.00 177.10 174.94 1qk1 h MET 25 N 0.77 0.01 -0.11 0.00 1.85 -1.47 -2.20 114.93 113.79 1qk1 h MET 25 Ca 0.43 -0.00 -0.04 0.00 -0.61 0.00 0.00 59.70 59.48 1qk1 h MET 25 Cb 0.47 -0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.49 1qk1 h MET 25 CO -0.28 0.01 -0.11 0.00 -0.40 0.00 0.00 176.91 176.12 1qk1 h ALA 26 N 1.21 1.61 0.00 0.39 0.00 -1.73 -1.42 119.26 119.31 1qk1 h ALA 26 Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1qk1 h ALA 26 Cb 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1qk1 h ALA 26 CO -0.21 0.29 0.00 0.43 0.00 0.00 0.00 179.25 179.76 1qk1 n SER 27 N -4.32 0.64 0.00 0.00 7.64 -0.85 -3.80 113.62 112.93 1qk1 n SER 27 Ca -0.01 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.50 1qk1 n SER 27 Cb 0.24 -0.78 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 1qk1 n SER 27 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1qk1 n HIS 28 N -2.18 0.00 -2.57 1.43 8.25 -0.84 -5.01 115.22 114.30 1qk1 n HIS 28 Ca 0.03 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.08 1qk1 n HIS 28 Cb 0.27 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.34 1qk1 n HIS 28 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1qk1 s LEU 29 N -1.80 4.51 0.11 2.41 2.96 -0.60 -4.98 118.68 121.29 1qk1 s LEU 29 Ca 0.00 2.03 0.01 0.00 -0.22 0.00 0.00 54.13 55.95 1qk1 s LEU 29 Cb 0.00 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.05 1qk1 s LEU 29 CO 0.00 -0.16 -0.04 0.42 -1.32 0.00 0.00 176.35 175.25 1qk1 s THR 30 N -0.30 0.56 0.30 3.68 -4.23 -1.26 -4.98 115.64 109.41 1qk1 s THR 30 Ca 0.48 -1.92 0.01 0.00 -1.18 0.00 0.00 61.69 59.08 1qk1 s THR 30 Cb -0.28 -1.78 0.28 0.00 1.34 0.00 0.00 72.50 72.07 1qk1 s THR 30 CO 0.34 -0.78 1.89 -0.65 -0.54 0.00 0.00 174.62 174.88 1qk1 h PRO 31 N 2.93 0.97 -0.50 3.99 0.11 -1.99 -0.30 132.00 137.22 1qk1 h PRO 31 Ca -0.35 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.68 1qk1 h PRO 31 Cb 1.17 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 1qk1 h PRO 31 CO 0.64 0.64 0.25 0.00 -0.21 0.00 0.00 178.00 179.33 1qk1 h ALA 32 N 1.52 0.64 -0.35 -0.75 0.00 -1.99 -0.21 119.26 118.12 1qk1 h ALA 32 Ca 0.42 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 55.12 1qk1 h ALA 32 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1qk1 h ALA 32 CO -0.18 0.18 -0.18 0.28 0.00 0.00 0.00 179.25 179.35 1qk1 h VAL 33 N 0.66 1.29 -0.34 0.00 2.07 -1.82 -1.79 116.25 116.31 1qk1 h VAL 33 Ca 0.17 -1.30 0.00 0.00 0.82 0.00 0.00 66.70 66.39 1qk1 h VAL 33 Cb 0.09 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1qk1 h VAL 33 CO -0.02 0.43 0.22 0.22 0.02 0.00 0.00 177.57 178.44 1qk1 h TYR 34 N 0.52 0.43 -0.47 1.57 3.20 -0.88 -1.65 116.97 119.69 1qk1 h TYR 34 Ca 0.08 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.88 1qk1 h TYR 34 Cb 0.72 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.83 1qk1 h TYR 34 CO 0.06 0.28 -0.01 0.00 -1.64 0.00 0.00 178.16 176.85 1qk1 h ALA 35 N 1.12 1.10 -0.23 1.82 0.00 -0.95 0.37 119.26 122.48 1qk1 h ALA 35 Ca 0.12 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1qk1 h ALA 35 Cb -0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1qk1 h ALA 35 CO -0.03 0.57 -0.29 -0.09 0.00 0.00 0.00 179.25 179.42 1qk1 h ARG 36 N 0.73 0.46 0.00 0.00 2.43 -1.03 -3.33 114.38 113.64 1qk1 h ARG 36 Ca 0.14 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1qk1 h ARG 36 Cb 0.46 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1qk1 h ARG 36 CO 0.02 0.71 -1.21 1.28 -1.51 0.00 0.00 179.97 179.26 1qk1 n LEU 37 N -4.10 0.50 0.18 3.80 4.77 -0.65 -4.56 117.00 116.95 1qk1 n LEU 37 Ca -0.01 -0.31 0.12 0.00 -0.03 0.00 0.00 56.01 55.79 1qk1 n LEU 37 Cb 0.43 0.00 0.66 0.00 -2.33 0.00 0.00 43.42 42.18 1qk1 n LEU 37 CO 0.42 0.13 0.87 0.00 -1.33 0.00 0.00 177.39 177.48 1qk1 n ASP 39 N -2.36 0.28 -4.79 0.00 8.00 -1.26 -4.83 116.55 111.60 1qk1 n ASP 39 Ca -0.01 0.11 -0.32 0.00 0.71 0.00 0.00 54.79 55.28 1qk1 n ASP 39 Cb 0.05 1.46 0.06 0.00 -0.02 0.00 0.00 41.12 42.67 1qk1 n ASP 39 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1qk1 s LYS 40 N -3.44 2.66 0.03 -1.24 1.02 -0.75 -5.08 119.74 112.93 1qk1 s LYS 40 Ca -0.06 1.16 -0.13 0.00 0.02 0.00 0.00 55.97 56.96 1qk1 s LYS 40 Cb 0.12 -1.95 0.02 0.00 -0.52 0.00 0.00 37.83 35.51 1qk1 s LYS 40 CO 0.87 -1.33 0.29 -0.08 -0.92 0.00 0.00 175.35 174.18 1qk1 s THR 41 N -2.79 0.08 0.55 2.17 -1.32 -1.26 -4.53 115.64 108.53 1qk1 s THR 41 Ca 0.62 -0.65 -0.01 0.00 -1.21 0.00 0.00 61.69 60.44 1qk1 s THR 41 Cb -0.17 -0.84 0.02 0.00 -1.51 0.00 0.00 72.50 70.01 1qk1 s THR 41 CO 0.51 -0.36 0.80 0.42 -2.21 0.00 0.00 174.62 173.78 1qk1 s THR 42 N -2.19 3.18 0.52 5.08 -4.23 -0.85 -4.92 115.64 112.23 1qk1 s THR 42 Ca -0.08 -0.45 0.27 0.00 -1.18 0.00 0.00 61.69 60.25 1qk1 s THR 42 Cb -0.02 -3.22 0.43 0.00 1.34 0.00 0.00 72.50 71.02 1qk1 s THR 42 CO -0.01 -0.18 1.94 -0.65 -0.54 0.00 0.00 174.62 175.18 1qk1 h PRO 43 N 0.04 0.05 -0.62 3.99 0.11 -1.97 0.34 132.00 133.94 1qk1 h PRO 43 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1qk1 h PRO 43 Cb 1.28 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1qk1 h PRO 43 CO 0.56 0.03 0.00 0.25 -0.21 0.00 0.00 178.00 178.63 1qk1 n THR 44 N -4.35 1.26 -0.53 -1.15 -2.24 -1.26 -4.95 114.28 101.06 1qk1 n THR 44 Ca 0.14 -0.90 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1qk1 n THR 44 Cb 0.75 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.14 1qk1 n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qk1 n GLY 45 N 1.14 0.75 3.75 3.38 0.00 0.11 -5.06 105.19 109.25 1qk1 n GLY 45 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 1qk1 n GLY 45 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1qk1 s TRP 46 N -2.41 3.29 0.42 1.61 -0.11 -1.26 -4.71 118.94 115.77 1qk1 s TRP 46 Ca 0.00 1.35 0.07 0.00 1.22 0.00 0.00 56.10 58.74 1qk1 s TRP 46 Cb 0.00 -3.55 -0.06 0.00 -1.50 0.00 0.00 33.47 28.36 1qk1 s TRP 46 CO 0.00 -1.59 0.12 0.95 -4.62 0.00 0.00 176.95 171.81 1qk1 s THR 47 N -0.31 2.14 0.12 5.86 -4.23 -1.26 -2.01 115.64 115.95 1qk1 s THR 47 Ca 0.53 -1.81 -0.18 0.00 -1.18 0.00 0.00 61.69 59.05 1qk1 s THR 47 Cb -0.36 -2.95 -0.03 0.00 1.34 0.00 0.00 72.50 70.49 1qk1 s THR 47 CO 0.41 0.00 1.69 0.25 -0.54 0.00 0.00 174.62 176.43 1qk1 h LEU 48 N 1.53 0.42 -1.23 4.79 5.85 -1.82 -2.20 115.31 122.66 1qk1 h LEU 48 Ca -0.43 -0.13 0.07 0.00 0.84 0.00 0.00 57.88 58.22 1qk1 h LEU 48 Cb 1.25 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.12 1qk1 h LEU 48 CO 0.74 0.44 0.55 0.44 -0.34 0.00 0.00 178.44 180.26 1qk1 h ASP 49 N 0.38 0.81 0.46 1.25 3.32 -1.94 -1.12 116.42 119.58 1qk1 h ASP 49 Ca 0.11 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 57.06 1qk1 h ASP 49 Cb 0.13 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1qk1 h ASP 49 CO -0.01 0.52 -0.49 1.56 -1.72 0.00 0.00 179.24 179.09 1qk1 h GLN 50 N 0.92 0.04 -0.15 3.56 4.20 -1.86 -1.66 115.11 120.16 1qk1 h GLN 50 Ca 0.36 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 59.04 1qk1 h GLN 50 Cb 0.23 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1qk1 h GLN 50 CO -0.13 0.53 0.04 0.00 -0.67 0.00 0.00 178.83 178.59 1qk1 n ILE 52 N -4.83 0.00 -0.22 0.00 -5.35 -0.87 -1.59 119.36 106.50 1qk1 n ILE 52 Ca -0.05 -0.14 0.02 0.00 -0.27 0.00 0.00 62.75 62.31 1qk1 n ILE 52 Cb 0.16 0.34 0.13 0.00 -1.74 0.00 0.00 39.64 38.53 1qk1 n ILE 52 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 1qk1 h GLN 53 N 1.33 0.18 -0.58 6.28 5.75 -1.35 0.81 115.11 127.53 1qk1 h GLN 53 Ca 0.00 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 1qk1 h GLN 53 Cb 0.48 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.96 1qk1 h GLN 53 CO 0.00 0.12 0.37 0.00 -2.65 0.00 0.00 178.83 176.67 1qk1 h THR 54 N 0.18 1.16 0.00 2.39 1.03 -1.78 -0.87 112.91 115.02 1qk1 h THR 54 Ca 0.35 -0.30 -0.09 0.00 -0.01 0.00 0.00 66.41 66.36 1qk1 h THR 54 Cb 0.57 0.31 -0.01 0.00 -1.07 0.00 0.00 68.15 67.95 1qk1 h THR 54 CO -0.51 0.15 -0.44 1.23 -0.01 0.00 0.00 175.52 175.95 1qk1 h GLY 55 N 0.81 0.00 0.97 2.99 0.00 0.05 -1.91 103.07 105.98 1qk1 h GLY 55 Ca 0.21 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.31 1qk1 h GLY 55 CO -0.04 0.00 -0.94 -2.08 0.00 0.00 0.00 176.54 173.47 1qk1 h VAL 56 N 0.00 1.38 0.00 4.60 2.07 -0.46 -3.31 116.25 120.53 1qk1 h VAL 56 Ca -0.00 -2.34 -0.05 0.00 0.82 0.00 0.00 66.70 65.12 1qk1 h VAL 56 Cb 0.82 2.76 -0.01 0.00 -1.52 0.00 0.00 31.29 33.34 1qk1 h VAL 56 CO 0.06 0.69 -0.25 0.44 0.02 0.00 0.00 177.57 178.53 1qk1 h ASP 57 N 0.03 0.00 -4.11 0.57 5.19 -1.11 -3.39 116.42 113.60 1qk1 h ASP 57 Ca -0.14 0.00 -0.64 0.00 -0.62 0.00 0.00 57.03 55.63 1qk1 h ASP 57 Cb 1.66 0.00 -0.41 0.00 0.18 0.00 0.00 39.33 40.76 1qk1 h ASP 57 CO 0.18 0.25 -0.66 0.20 -3.12 0.00 0.00 179.24 176.09 1qk1 s ASN 58 N -6.29 4.37 0.39 6.45 0.01 -0.73 -4.97 114.94 114.17 1qk1 s ASN 58 Ca -0.01 -2.74 0.11 0.00 -0.71 0.00 0.00 52.86 49.51 1qk1 s ASN 58 Cb 0.11 -1.57 0.90 0.00 0.41 0.00 0.00 41.25 41.10 1qk1 s ASN 58 CO 0.64 -0.27 1.91 -0.65 -1.51 0.00 0.00 177.10 177.22 1qk1 h PRO 59 N 6.83 0.57 0.00 -0.60 0.11 -1.76 -3.44 132.00 133.71 1qk1 h PRO 59 Ca -0.07 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1qk1 h PRO 59 Cb 0.93 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1qk1 h PRO 59 CO 0.63 0.38 0.00 0.41 -0.21 0.00 0.00 178.00 179.21 1qk1 n GLY 60 N -1.47 -2.29 3.28 -0.55 0.00 -1.26 -0.32 105.19 102.57 1qk1 n GLY 60 Ca 0.15 -2.12 -0.31 0.00 0.00 0.00 0.00 46.02 43.73 1qk1 n GLY 60 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1qk1 s HIS 61 N -0.42 2.40 0.59 1.61 2.46 -1.25 -4.89 115.29 115.79 1qk1 s HIS 61 Ca 0.00 -0.65 0.29 0.00 0.47 0.00 0.00 55.06 55.17 1qk1 s HIS 61 Cb 0.00 -1.56 1.55 0.00 -0.13 0.00 0.00 32.58 32.44 1qk1 s HIS 61 CO 0.00 -0.17 1.98 -1.35 -2.47 0.00 0.00 174.74 172.73 1qk1 h PRO 62 N 5.91 0.00 0.00 2.88 0.11 -1.94 -3.19 132.00 135.77 1qk1 h PRO 62 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1qk1 h PRO 62 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1qk1 h PRO 62 CO 0.47 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.45 1qk1 n PHE 63 N -3.74 0.00 -3.25 0.65 3.72 -1.26 -4.85 117.46 108.73 1qk1 n PHE 63 Ca 0.05 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.06 1qk1 n PHE 63 Cb 0.52 -0.50 -0.07 0.00 -0.94 0.00 0.00 39.48 38.49 1qk1 n PHE 63 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 1qk1 s ILE 64 N -1.01 5.11 -0.08 4.37 -0.00 -1.20 -5.06 121.20 123.32 1qk1 s ILE 64 Ca 0.00 0.92 -0.20 0.00 -0.00 0.00 0.00 60.65 61.38 1qk1 s ILE 64 Cb 0.00 -3.83 -0.04 0.00 -0.00 0.00 0.00 42.46 38.59 1qk1 s ILE 64 CO 0.00 0.17 0.54 -0.75 -0.00 0.00 0.00 174.94 174.90 1qk1 s LYS 65 N 1.73 4.34 0.42 0.37 2.20 -1.26 -3.76 119.74 123.78 1qk1 s LYS 65 Ca 0.23 0.59 0.08 0.00 -0.36 0.00 0.00 55.97 56.51 1qk1 s LYS 65 Cb -0.15 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 32.76 1qk1 s LYS 65 CO 0.09 0.20 0.53 0.95 -0.36 0.00 0.00 175.35 176.76 1qk1 s THR 66 N 0.45 2.89 -0.06 3.43 -4.23 -1.26 -4.95 115.64 111.91 1qk1 s THR 66 Ca 0.29 -1.08 -0.27 0.00 -1.18 0.00 0.00 61.69 59.45 1qk1 s THR 66 Cb -0.16 -2.97 -0.22 0.00 1.34 0.00 0.00 72.50 70.48 1qk1 s THR 66 CO 0.13 0.00 1.10 0.58 -0.54 0.00 0.00 174.62 175.89 1qk1 h VAL 67 N 0.72 1.52 0.00 2.29 2.07 -1.94 -1.39 116.25 119.52 1qk1 h VAL 67 Ca -0.40 -1.57 0.00 0.00 0.82 0.00 0.00 66.70 65.55 1qk1 h VAL 67 Cb 1.28 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 33.62 1qk1 h VAL 67 CO 0.48 0.41 0.00 0.61 0.02 0.00 0.00 177.57 179.09 1qk1 n GLY 68 N 0.70 0.67 3.52 2.17 0.00 -1.26 -1.30 105.19 109.69 1qk1 n GLY 68 Ca -0.09 -0.09 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 1qk1 n GLY 68 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1qk1 s MET 69 N -0.47 0.97 0.21 1.61 0.23 -1.26 -1.68 119.30 118.91 1qk1 s MET 69 Ca 0.00 0.13 0.05 0.00 -1.03 0.00 0.00 55.69 54.84 1qk1 s MET 69 Cb 0.00 0.46 -0.05 0.00 -1.53 0.00 0.00 34.83 33.71 1qk1 s MET 69 CO 0.00 -0.32 -0.06 0.14 -2.03 0.00 0.00 175.02 172.75 1qk1 s VAL 70 N -1.54 1.24 -0.03 5.16 -7.23 -0.62 -4.50 120.40 112.88 1qk1 s VAL 70 Ca -0.07 -2.07 -0.07 0.00 -1.81 0.00 0.00 61.98 57.96 1qk1 s VAL 70 Cb -0.00 -2.17 -0.05 0.00 0.56 0.00 0.00 36.38 34.72 1qk1 s VAL 70 CO 0.05 -0.48 0.23 0.00 -0.31 0.00 0.00 175.10 174.59 1qk1 s ALA 71 N -3.29 3.86 -0.14 1.32 0.00 -0.55 -4.51 121.76 118.45 1qk1 s ALA 71 Ca 0.24 -0.59 0.21 0.00 0.00 0.00 0.00 51.96 51.82 1qk1 s ALA 71 Cb 0.04 -2.04 -0.17 0.00 0.00 0.00 0.00 23.12 20.94 1qk1 s ALA 71 CO 0.06 0.64 0.70 0.41 0.00 0.00 0.00 175.76 177.57 1qk1 n GLY 72 N 1.39 -1.20 3.86 0.00 0.00 -1.26 -4.59 105.19 103.39 1qk1 n GLY 72 Ca -0.14 -0.32 -0.04 0.00 0.00 0.00 0.00 46.02 45.52 1qk1 n GLY 72 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1qk1 s ASP 73 N -5.18 -0.01 0.24 1.61 1.47 -1.26 -0.96 116.67 112.58 1qk1 s ASP 73 Ca -0.05 -0.76 -0.06 0.00 1.18 0.00 0.00 52.55 52.87 1qk1 s ASP 73 Cb 0.10 0.57 0.25 0.00 -0.34 0.00 0.00 42.92 43.51 1qk1 s ASP 73 CO 0.84 -1.13 1.85 -0.08 0.68 0.00 0.00 175.17 177.32 1qk1 h GLU 74 N 2.00 1.18 0.00 2.11 4.81 -1.96 -2.71 114.58 120.01 1qk1 h GLU 74 Ca -0.28 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 58.77 1qk1 h GLU 74 Cb 1.23 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.38 1qk1 h GLU 74 CO 0.36 0.89 -0.09 0.93 -0.73 0.00 0.00 179.01 180.38 1qk1 h GLU 75 N 1.17 0.00 -0.66 1.92 3.07 -2.01 -3.18 114.58 114.89 1qk1 h GLU 75 Ca 0.29 0.00 0.13 0.00 -0.50 0.00 0.00 59.36 59.28 1qk1 h GLU 75 Cb 0.09 0.00 -0.10 0.00 -0.84 0.00 0.00 28.75 27.90 1qk1 h GLU 75 CO -0.04 0.09 0.14 1.15 -1.40 0.00 0.00 179.01 178.94 1qk1 h THR 76 N 0.00 0.58 0.00 1.13 2.02 -1.89 -0.08 112.91 114.67 1qk1 h THR 76 Ca -0.00 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 67.09 1qk1 h THR 76 Cb 0.39 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1qk1 h THR 76 CO 0.01 0.05 -0.02 1.88 0.37 0.00 0.00 175.52 177.81 1qk1 h TYR 77 N 0.26 0.00 0.00 3.16 0.05 -1.74 -1.59 116.97 117.11 1qk1 h TYR 77 Ca 0.36 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.87 1qk1 h TYR 77 Cb 0.56 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.27 1qk1 h TYR 77 CO -0.26 0.02 -1.53 -1.91 -1.05 0.00 0.00 178.16 173.42 1qk1 n GLU 78 N -3.43 0.56 -0.32 4.88 2.13 -0.16 -3.31 120.64 120.98 1qk1 n GLU 78 Ca -0.03 0.47 0.02 0.00 0.66 0.00 0.00 57.16 58.28 1qk1 n GLU 78 Cb 0.12 -1.65 0.16 0.00 0.27 0.00 0.00 31.44 30.33 1qk1 n GLU 78 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1qk1 h VAL 79 N -1.00 1.02 -0.66 6.31 2.07 -1.20 -2.57 116.25 120.23 1qk1 h VAL 79 Ca -0.40 -0.34 -0.30 0.00 0.82 0.00 0.00 66.70 66.48 1qk1 h VAL 79 Cb 1.29 -0.05 -0.18 0.00 -1.52 0.00 0.00 31.29 30.83 1qk1 h VAL 79 CO -0.24 0.18 0.27 0.49 0.02 0.00 0.00 177.57 178.29 1qk1 n PHE 80 N -4.61 2.07 -0.18 1.57 3.72 -0.60 -4.72 117.46 114.70 1qk1 n PHE 80 Ca 0.14 -1.58 0.17 0.00 -0.05 0.00 0.00 57.45 56.13 1qk1 n PHE 80 Cb 0.21 -0.69 0.52 0.00 -0.94 0.00 0.00 39.48 38.58 1qk1 n PHE 80 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1qk1 h ALA 81 N 1.34 2.18 0.00 4.37 0.00 -1.45 -1.43 119.26 124.27 1qk1 h ALA 81 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1qk1 h ALA 81 Cb 2.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.97 1qk1 h ALA 81 CO 0.71 -0.41 0.00 -0.44 0.00 0.00 0.00 179.25 179.12 1qk1 h ASP 82 N 0.38 0.00 0.00 0.00 3.32 -1.85 -0.24 116.42 118.03 1qk1 h ASP 82 Ca 0.40 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 57.13 1qk1 h ASP 82 Cb 0.97 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.47 1qk1 h ASP 82 CO -0.13 0.00 -2.13 -0.11 -1.72 0.00 0.00 179.24 175.16 1qk1 n LEU 83 N -3.05 2.25 -0.22 1.55 0.00 -0.61 -4.58 117.00 112.34 1qk1 n LEU 83 Ca -0.03 0.07 -0.07 0.00 0.00 0.00 0.00 56.01 55.98 1qk1 n LEU 83 Cb 0.07 -0.64 0.03 0.00 0.00 0.00 0.00 43.42 42.88 1qk1 n LEU 83 CO 0.20 0.64 1.02 -0.26 0.00 0.00 0.00 177.39 178.98 1qk1 h PHE 84 N -0.36 0.91 -0.01 1.96 0.04 -1.20 -3.03 116.94 115.25 1qk1 h PHE 84 Ca -0.48 -0.05 0.01 0.00 2.80 0.00 0.00 57.97 60.25 1qk1 h PHE 84 Cb 1.57 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 39.43 1qk1 h PHE 84 CO -0.02 0.70 -0.06 -0.44 -0.60 0.00 0.00 178.31 177.89 1qk1 h ASP 85 N 0.86 -0.16 -0.88 2.17 3.32 -1.30 0.27 116.42 120.70 1qk1 h ASP 85 Ca 0.21 0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.34 1qk1 h ASP 85 Cb 0.15 0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.72 1qk1 h ASP 85 CO -0.02 -0.08 0.57 -0.65 -1.72 0.00 0.00 179.24 177.34 1qk1 h PRO 86 N -0.09 1.02 -0.19 3.56 0.11 -1.78 0.89 132.00 135.51 1qk1 h PRO 86 Ca 0.03 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.02 1qk1 h PRO 86 Cb 0.13 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.01 1qk1 h PRO 86 CO -0.07 0.67 -0.09 0.28 -0.21 0.00 0.00 178.00 178.59 1qk1 h VAL 87 N 1.05 1.31 -0.66 3.15 2.07 -1.31 -2.00 116.25 119.85 1qk1 h VAL 87 Ca 0.36 -1.14 0.02 0.00 0.82 0.00 0.00 66.70 66.76 1qk1 h VAL 87 Cb 0.11 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.50 1qk1 h VAL 87 CO -0.12 0.34 0.43 0.40 0.02 0.00 0.00 177.57 178.64 1qk1 h ILE 88 N 0.09 1.13 -0.76 4.57 2.04 0.07 -0.96 117.51 123.69 1qk1 h ILE 88 Ca 0.04 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 1qk1 h ILE 88 Cb 0.57 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 1qk1 h ILE 88 CO 0.03 0.16 0.38 -0.61 0.00 0.00 0.00 178.15 178.11 1qk1 h GLN 89 N 0.86 1.08 -0.24 2.37 4.15 -0.74 -1.09 115.11 121.49 1qk1 h GLN 89 Ca 0.25 -0.15 -0.08 0.00 0.77 0.00 0.00 58.65 59.45 1qk1 h GLN 89 Cb -0.05 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.44 1qk1 h GLN 89 CO -0.08 0.82 -0.16 1.49 -1.93 0.00 0.00 178.83 178.98 1qk1 h GLU 90 N 1.06 0.54 -0.38 1.69 4.81 -0.94 -1.61 114.58 119.75 1qk1 h GLU 90 Ca 0.26 -0.26 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 1qk1 h GLU 90 Cb 0.09 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1qk1 h GLU 90 CO -0.04 0.83 -0.01 -0.09 -0.73 0.00 0.00 179.01 178.97 1qk1 h ARG 91 N 0.26 0.60 -0.89 1.92 9.65 -1.02 -2.76 114.38 122.13 1qk1 h ARG 91 Ca 0.05 -0.14 -0.62 0.00 -1.10 0.00 0.00 59.98 58.16 1qk1 h ARG 91 Cb 0.69 -0.08 -0.35 0.00 -1.39 0.00 0.00 29.97 28.84 1qk1 h ARG 91 CO 0.04 0.63 0.16 0.72 2.80 0.00 0.00 179.97 184.32 1qk1 n HIS 92 N -4.25 3.02 -0.46 2.20 8.25 -0.43 -4.99 115.22 118.56 1qk1 n HIS 92 Ca 0.02 -2.68 0.00 0.00 -0.26 0.00 0.00 57.72 54.79 1qk1 n HIS 92 Cb 0.27 -0.98 0.00 0.00 1.12 0.00 0.00 29.99 30.40 1qk1 n HIS 92 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1qk1 n ASN 93 N -0.83 0.00 0.00 0.41 6.94 -1.04 -2.51 115.26 118.23 1qk1 n ASN 93 Ca 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 55.11 1qk1 n ASN 93 Cb 0.80 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.22 1qk1 n ASN 93 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1qk1 n GLY 94 N 0.31 3.04 3.70 4.83 0.00 -0.62 -5.04 105.19 111.41 1qk1 n GLY 94 Ca 0.00 -0.86 -0.53 0.00 0.00 0.00 0.00 46.02 44.63 1qk1 n GLY 94 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1qk1 n TYR 95 N 0.00 2.17 -3.70 1.61 9.36 -1.04 -4.92 117.16 120.64 1qk1 n TYR 95 Ca 0.00 0.30 -0.38 0.00 3.32 0.00 0.00 57.90 61.13 1qk1 n TYR 95 Cb 0.00 -2.55 -0.11 0.00 -0.63 0.00 0.00 39.34 36.05 1qk1 n TYR 95 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1qk1 s ASP 96 N 3.75 5.41 0.00 2.98 2.15 -1.26 -3.76 116.67 125.93 1qk1 s ASP 96 Ca 0.96 -1.53 0.05 0.00 0.43 0.00 0.00 52.55 52.46 1qk1 s ASP 96 Cb -0.90 -1.90 0.25 0.00 -0.30 0.00 0.00 42.92 40.07 1qk1 s ASP 96 CO 0.59 -0.47 1.11 -0.81 -0.17 0.00 0.00 175.17 175.43 1qk1 n PRO 97 N 4.79 0.03 0.11 4.34 -0.04 -1.26 -0.84 135.00 142.13 1qk1 n PRO 97 Ca -0.09 0.34 0.08 0.00 -0.04 0.00 0.00 63.50 63.79 1qk1 n PRO 97 Cb 0.43 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.40 1qk1 n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qk1 h ARG 98 N 0.00 0.00 0.00 0.54 3.08 -1.94 -3.40 114.38 112.66 1qk1 h ARG 98 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1qk1 h ARG 98 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1qk1 h ARG 98 CO 0.00 0.11 -0.01 0.25 -1.07 0.00 0.00 179.97 179.26 1qk1 n THR 99 N -2.85 0.00 -4.03 2.04 -2.24 -0.91 -5.10 114.28 101.20 1qk1 n THR 99 Ca -0.01 -0.23 -0.23 0.00 -2.27 0.00 0.00 64.05 61.31 1qk1 n THR 99 Cb 0.63 0.99 -0.06 0.00 -2.10 0.00 0.00 70.33 69.79 1qk1 n THR 99 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1qk1 s MET 100 N -0.47 2.48 0.07 -0.78 -1.94 -0.02 -5.07 119.30 113.57 1qk1 s MET 100 Ca 0.00 -1.47 0.06 0.00 -1.71 0.00 0.00 55.69 52.57 1qk1 s MET 100 Cb 0.00 -2.26 -0.03 0.00 2.01 0.00 0.00 34.83 34.55 1qk1 s MET 100 CO 0.00 0.12 -0.17 0.15 -0.01 0.00 0.00 175.02 175.11 1qk1 s LYS 101 N -3.88 0.97 -0.13 2.03 1.02 -1.26 -4.66 119.74 113.83 1qk1 s LYS 101 Ca 0.38 -0.97 -0.05 0.00 0.02 0.00 0.00 55.97 55.35 1qk1 s LYS 101 Cb -0.04 -1.06 -0.04 0.00 -0.52 0.00 0.00 37.83 36.17 1qk1 s LYS 101 CO 0.24 0.25 0.05 -1.58 -0.92 0.00 0.00 175.35 173.39 1qk1 s HIS 102 N -1.12 3.28 -0.10 3.18 5.65 0.08 -4.86 115.29 121.39 1qk1 s HIS 102 Ca 0.02 0.19 0.02 0.00 0.25 0.00 0.00 55.06 55.54 1qk1 s HIS 102 Cb -0.09 -1.93 -0.01 0.00 -1.18 0.00 0.00 32.58 29.36 1qk1 s HIS 102 CO 0.03 0.39 -0.16 -0.08 -0.65 0.00 0.00 174.74 174.26 1qk1 s THR 103 N -0.40 2.83 -0.04 0.89 -1.32 -1.26 -4.79 115.64 111.55 1qk1 s THR 103 Ca 0.09 -0.76 -0.14 0.00 -1.21 0.00 0.00 61.69 59.67 1qk1 s THR 103 Cb -0.12 -2.15 -0.05 0.00 -1.51 0.00 0.00 72.50 68.67 1qk1 s THR 103 CO 0.02 0.55 0.36 -0.89 -2.21 0.00 0.00 174.62 172.44 1qk1 s THR 104 N 0.07 5.14 -0.26 5.08 2.01 -1.26 -3.85 115.64 122.57 1qk1 s THR 104 Ca -0.07 0.71 -0.01 0.00 0.31 0.00 0.00 61.69 62.64 1qk1 s THR 104 Cb -0.15 -3.66 0.13 0.00 0.01 0.00 0.00 72.50 68.84 1qk1 s THR 104 CO 0.05 0.55 0.33 -0.62 -0.69 0.00 0.00 174.62 174.24 1qk1 s ASP 105 N -0.80 0.97 -0.42 3.53 -1.08 -1.26 -4.97 116.67 112.63 1qk1 s ASP 105 Ca 0.22 -0.32 0.04 0.00 -0.52 0.00 0.00 52.55 51.97 1qk1 s ASP 105 Cb -0.15 0.78 0.48 0.00 -1.46 0.00 0.00 42.92 42.57 1qk1 s ASP 105 CO 0.11 -0.35 1.58 0.18 0.52 0.00 0.00 175.17 177.21 1qk1 n LEU 106 N 5.34 5.71 -4.39 -1.34 4.77 -1.26 -3.01 117.00 122.81 1qk1 n LEU 106 Ca -0.02 -4.27 -0.45 0.00 -0.03 0.00 0.00 56.01 51.23 1qk1 n LEU 106 Cb 0.49 -0.66 -0.02 0.00 -2.33 0.00 0.00 43.42 40.90 1qk1 n LEU 106 CO 0.03 1.61 0.73 -0.62 -1.33 0.00 0.00 177.39 177.81 1qk1 s ASP 107 N -2.60 6.72 0.67 -1.43 2.15 -1.26 -4.85 116.67 116.07 1qk1 s ASP 107 Ca 0.54 -2.42 0.42 0.00 0.43 0.00 0.00 52.55 51.53 1qk1 s ASP 107 Cb 0.45 -2.31 2.30 0.00 -0.30 0.00 0.00 42.92 43.06 1qk1 s ASP 107 CO 0.02 -0.80 2.31 0.00 -0.17 0.00 0.00 175.17 176.52 1qk1 h ALA 108 N 8.24 1.08 0.00 3.66 0.00 -1.90 -2.23 119.26 128.10 1qk1 h ALA 108 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1qk1 h ALA 108 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1qk1 h ALA 108 CO 0.94 -0.05 0.00 -1.13 0.00 0.00 0.00 179.25 179.01 1qk1 n SER 109 N -3.10 0.60 -0.12 0.00 3.41 -1.26 -1.82 113.62 111.33 1qk1 n SER 109 Ca -0.03 0.69 0.15 0.00 -0.26 0.00 0.00 58.87 59.42 1qk1 n SER 109 Cb 0.12 -0.80 0.81 0.00 -0.26 0.00 0.00 64.21 64.08 1qk1 n SER 109 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1qk1 n LYS 110 N -2.20 1.08 -2.72 4.33 5.02 -0.84 -4.84 118.16 117.99 1qk1 n LYS 110 Ca 0.01 -0.24 -0.42 0.00 -2.02 0.00 0.00 58.31 55.64 1qk1 n LYS 110 Cb 0.16 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.65 1qk1 n LYS 110 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1qk1 s ILE 111 N -2.08 4.78 -0.16 -0.18 -1.09 -0.76 -5.02 121.20 116.68 1qk1 s ILE 111 Ca 0.43 1.96 -0.08 0.00 -2.23 0.00 0.00 60.65 60.73 1qk1 s ILE 111 Cb 0.21 -4.28 -0.04 0.00 -1.58 0.00 0.00 42.46 36.77 1qk1 s ILE 111 CO 0.38 -0.03 0.11 -0.13 -1.23 0.00 0.00 174.94 174.04 1qk1 s ARG 112 N 2.29 3.80 3.68 2.79 0.52 -1.26 -4.94 118.95 125.83 1qk1 s ARG 112 Ca 0.45 -0.23 0.00 0.00 -0.52 0.00 0.00 55.73 55.43 1qk1 s ARG 112 Cb -0.17 -3.25 0.00 0.00 0.52 0.00 0.00 34.95 32.05 1qk1 s ARG 112 CO 0.14 0.48 0.00 0.45 0.02 0.00 0.00 175.30 176.39 1qk1 n SER 113 N 2.91 0.00 0.00 0.23 2.88 -1.26 -4.96 113.62 113.42 1qk1 n SER 113 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 1qk1 n SER 113 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 1qk1 n SER 113 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1qk1 n GLY 114 N 0.00 1.27 2.93 0.46 0.00 -1.26 -4.73 105.19 103.86 1qk1 n GLY 114 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1qk1 n GLY 114 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1qk1 s TYR 115 N -2.00 3.05 0.56 1.61 6.14 -1.26 -1.48 117.35 123.97 1qk1 s TYR 115 Ca 0.00 -2.52 -0.16 0.00 0.64 0.00 0.00 57.07 55.03 1qk1 s TYR 115 Cb 0.00 -2.44 -0.06 0.00 0.42 0.00 0.00 41.96 39.89 1qk1 s TYR 115 CO 0.00 -0.91 1.02 -0.06 0.64 0.00 0.00 175.55 176.24 1qk1 s PHE 116 N 1.15 3.24 -0.31 4.97 0.08 0.44 -4.96 117.98 122.60 1qk1 s PHE 116 Ca 0.09 1.48 -0.28 0.00 0.12 0.00 0.00 56.93 58.33 1qk1 s PHE 116 Cb -0.19 -2.89 -0.02 0.00 -0.57 0.00 0.00 43.02 39.35 1qk1 s PHE 116 CO -0.13 -0.74 1.88 0.34 -0.10 0.00 0.00 175.22 176.47 1qk1 s ASP 117 N -3.01 5.80 0.00 1.36 -1.08 -1.26 -4.54 116.67 113.94 1qk1 s ASP 117 Ca 0.61 1.41 0.00 0.00 -0.52 0.00 0.00 52.55 54.05 1qk1 s ASP 117 Cb -0.13 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.81 1qk1 s ASP 117 CO 0.35 -1.77 0.38 -0.62 0.52 0.00 0.00 175.17 174.04 1qk1 n GLU 118 N 8.50 0.41 0.00 4.34 1.02 -1.26 -1.86 120.64 131.78 1qk1 n GLU 118 Ca 0.24 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.49 1qk1 n GLU 118 Cb 0.46 -1.03 0.01 0.00 -0.02 0.00 0.00 31.44 30.87 1qk1 n GLU 118 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1qk1 n ARG 119 N -0.40 0.06 0.00 3.49 0.63 -1.26 -4.35 116.66 114.83 1qk1 n ARG 119 Ca 0.00 -0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1qk1 n ARG 119 Cb 0.01 -1.51 0.00 0.00 0.45 0.00 0.00 32.46 31.41 1qk1 n ARG 119 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1qk1 n TYR 120 N -1.59 0.00 -3.36 -0.14 4.01 -0.78 -4.89 117.16 110.41 1qk1 n TYR 120 Ca 0.04 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.37 1qk1 n TYR 120 Cb 0.35 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.29 1qk1 n TYR 120 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1qk1 s VAL 121 N -1.99 5.13 0.03 -0.72 1.01 -0.99 -0.37 120.40 122.49 1qk1 s VAL 121 Ca 0.00 0.04 -0.16 0.00 0.00 0.00 0.00 61.98 61.87 1qk1 s VAL 121 Cb 0.00 -3.88 -0.36 0.00 0.00 0.00 0.00 36.38 32.14 1qk1 s VAL 121 CO 0.00 -0.17 0.99 -0.07 0.00 0.00 0.00 175.10 175.85 1qk1 h LEU 122 N 8.86 0.85 -7.36 3.92 3.38 -0.58 -3.39 115.31 120.99 1qk1 h LEU 122 Ca -0.29 -0.92 -0.06 0.00 0.09 0.00 0.00 57.88 56.70 1qk1 h LEU 122 Cb 1.13 -0.28 -0.15 0.00 0.09 0.00 0.00 40.66 41.46 1qk1 h LEU 122 CO 0.72 1.72 -0.07 -0.94 0.09 0.00 0.00 178.44 179.97 1qk1 s SER 123 N -7.59 -0.28 -0.01 -0.43 1.04 -1.18 0.49 113.70 105.74 1qk1 s SER 123 Ca -0.09 -0.15 0.04 0.00 0.48 0.00 0.00 55.95 56.23 1qk1 s SER 123 Cb 0.04 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.61 1qk1 s SER 123 CO 0.95 -0.77 -0.14 -0.44 0.98 0.00 0.00 173.24 173.82 1qk1 s SER 124 N -2.42 1.63 -0.02 7.02 0.01 -0.48 -1.57 113.70 117.87 1qk1 s SER 124 Ca -0.01 -0.25 -0.19 0.00 1.31 0.00 0.00 55.95 56.81 1qk1 s SER 124 Cb 0.01 -0.21 0.04 0.00 0.21 0.00 0.00 66.02 66.06 1qk1 s SER 124 CO -0.07 0.16 0.41 0.00 0.41 0.00 0.00 173.24 174.15 1qk1 s ARG 125 N -0.27 0.79 -0.07 12.44 1.70 -0.38 -1.88 118.95 131.27 1qk1 s ARG 125 Ca 0.04 -0.10 0.01 0.00 -0.47 0.00 0.00 55.73 55.22 1qk1 s ARG 125 Cb -0.06 0.36 0.02 0.00 -0.57 0.00 0.00 34.95 34.69 1qk1 s ARG 125 CO -0.00 -0.23 -0.10 0.08 -1.08 0.00 0.00 175.30 173.97 1qk1 s VAL 126 N -1.40 0.99 0.10 4.99 1.01 -0.14 -0.96 120.40 125.00 1qk1 s VAL 126 Ca -0.12 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 61.56 1qk1 s VAL 126 Cb -0.04 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 1qk1 s VAL 126 CO 0.05 0.33 -0.17 -0.60 0.00 0.00 0.00 175.10 174.71 1qk1 s ARG 127 N 0.97 1.02 0.39 2.72 3.52 -0.49 -1.21 118.95 125.86 1qk1 s ARG 127 Ca -0.09 -1.13 -0.13 0.00 -0.13 0.00 0.00 55.73 54.25 1qk1 s ARG 127 Cb -0.15 -1.12 0.05 0.00 -1.56 0.00 0.00 34.95 32.17 1qk1 s ARG 127 CO 0.00 0.25 0.73 -0.08 -0.81 0.00 0.00 175.30 175.39 1qk1 s THR 128 N -1.45 0.00 0.07 4.11 -1.32 -0.52 -1.15 115.64 115.39 1qk1 s THR 128 Ca 0.05 -1.12 0.01 0.00 -1.21 0.00 0.00 61.69 59.42 1qk1 s THR 128 Cb -0.09 -2.89 -0.04 0.00 -1.51 0.00 0.00 72.50 67.97 1qk1 s THR 128 CO 0.04 0.00 -0.05 -0.83 -2.21 0.00 0.00 174.62 171.56 1qk1 s GLY 129 N -3.11 0.61 -0.02 6.08 0.00 -1.26 -0.50 107.32 109.12 1qk1 s GLY 129 Ca 0.19 -1.21 -0.04 0.00 0.00 0.00 0.00 44.72 43.66 1qk1 s GLY 129 CO 0.14 -1.31 0.09 0.50 0.00 0.00 0.00 173.10 172.52 1qk1 s ARG 130 N -3.54 0.23 -0.01 2.90 1.81 -0.85 -4.93 118.95 114.55 1qk1 s ARG 130 Ca 0.07 -0.10 0.05 0.00 -1.72 0.00 0.00 55.73 54.03 1qk1 s ARG 130 Cb 0.04 0.10 -0.03 0.00 -0.45 0.00 0.00 34.95 34.61 1qk1 s ARG 130 CO -0.06 -0.04 -0.16 -1.12 -0.68 0.00 0.00 175.30 173.24 1qk1 s SER 131 N -0.51 3.90 -0.26 0.23 0.01 -1.26 -2.52 113.70 113.29 1qk1 s SER 131 Ca -0.06 -0.30 -0.22 0.00 1.31 0.00 0.00 55.95 56.69 1qk1 s SER 131 Cb -0.04 -0.73 -0.01 0.00 0.21 0.00 0.00 66.02 65.45 1qk1 s SER 131 CO 0.00 0.31 0.70 -0.63 0.41 0.00 0.00 173.24 174.03 1qk1 s ILE 132 N -0.81 4.92 0.37 1.44 -1.09 -1.26 -0.45 121.20 124.33 1qk1 s ILE 132 Ca 0.13 1.21 -0.28 0.00 -2.23 0.00 0.00 60.65 59.48 1qk1 s ILE 132 Cb -0.11 -4.02 -0.11 0.00 -1.58 0.00 0.00 42.46 36.65 1qk1 s ILE 132 CO 0.03 -0.06 1.47 -1.14 -1.23 0.00 0.00 174.94 174.01 1qk1 n ARG 133 N 5.87 2.63 -0.11 2.79 0.63 0.01 -2.91 116.66 125.58 1qk1 n ARG 133 Ca 0.01 0.92 0.00 0.00 -0.92 0.00 0.00 57.85 57.87 1qk1 n ARG 133 Cb 0.48 -2.64 0.00 0.00 0.45 0.00 0.00 32.46 30.76 1qk1 n ARG 133 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1qk1 n GLY 134 N 0.48 0.83 3.26 5.14 0.00 -1.26 -4.74 105.19 108.90 1qk1 n GLY 134 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1qk1 n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qk1 s LEU 135 N 0.00 2.04 0.78 0.99 1.43 -1.15 -5.13 118.68 117.65 1qk1 s LEU 135 Ca 0.00 -0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 52.53 1qk1 s LEU 135 Cb 0.00 -1.24 0.07 0.00 0.03 0.00 0.00 46.19 45.05 1qk1 s LEU 135 CO 0.00 0.27 1.16 -0.44 0.23 0.00 0.00 176.35 177.57 1qk1 s SER 136 N -0.41 3.99 0.72 2.29 0.01 -1.26 -4.82 113.70 114.22 1qk1 s SER 136 Ca 0.05 2.19 -0.11 0.00 1.31 0.00 0.00 55.95 59.39 1qk1 s SER 136 Cb -0.10 -2.57 0.02 0.00 0.21 0.00 0.00 66.02 63.58 1qk1 s SER 136 CO 0.00 -2.39 1.10 -0.76 0.41 0.00 0.00 173.24 171.60 1qk1 s LEU 137 N -5.64 2.87 0.42 2.44 1.43 -0.13 -4.45 118.68 115.61 1qk1 s LEU 137 Ca 0.69 1.14 0.27 0.00 -1.03 0.00 0.00 54.13 55.20 1qk1 s LEU 137 Cb -0.25 -3.92 1.36 0.00 0.03 0.00 0.00 46.19 43.42 1qk1 s LEU 137 CO 0.50 -1.40 1.63 -0.65 0.23 0.00 0.00 176.35 176.65 1qk1 h PRO 138 N -0.70 0.11 0.00 1.29 0.11 -1.88 -0.26 132.00 130.68 1qk1 h PRO 138 Ca -0.45 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 1qk1 h PRO 138 Cb 1.26 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1qk1 h PRO 138 CO 0.63 0.07 -0.36 -1.35 -0.21 0.00 0.00 178.00 176.79 1qk1 h PRO 139 N 0.12 0.00 0.00 1.05 0.11 -1.81 -3.37 132.00 128.09 1qk1 h PRO 139 Ca 0.80 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.91 1qk1 h PRO 139 Cb 2.38 0.00 0.00 0.00 0.11 0.00 0.00 31.00 33.49 1qk1 h PRO 139 CO -0.48 0.36 -0.89 0.00 -0.21 0.00 0.00 178.00 176.78 1qk1 n ALA 140 N -2.42 2.24 -1.76 -0.75 0.00 -0.26 -4.72 120.51 112.83 1qk1 n ALA 140 Ca -0.02 -0.10 -0.40 0.00 0.00 0.00 0.00 53.44 52.93 1qk1 n ALA 140 Cb 0.42 -0.13 0.02 0.00 0.00 0.00 0.00 19.45 19.75 1qk1 n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qk1 s THR 142 N -1.21 2.10 0.23 0.00 -4.23 -1.26 -4.84 115.64 106.42 1qk1 s THR 142 Ca 0.62 -0.17 -0.07 0.00 -1.18 0.00 0.00 61.69 60.89 1qk1 s THR 142 Cb -0.43 -2.93 0.20 0.00 1.34 0.00 0.00 72.50 70.68 1qk1 s THR 142 CO 0.55 0.00 1.85 0.03 -0.54 0.00 0.00 174.62 176.51 1qk1 h ARG 143 N -1.06 1.23 -0.66 3.99 3.08 -1.99 -0.97 114.38 118.00 1qk1 h ARG 143 Ca -0.43 -0.15 -0.05 0.00 0.07 0.00 0.00 59.98 59.42 1qk1 h ARG 143 Cb 1.28 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 31.06 1qk1 h ARG 143 CO 0.50 0.90 0.21 0.00 -1.07 0.00 0.00 179.97 180.51 1qk1 h ALA 144 N 1.26 0.86 -0.53 0.04 0.00 -1.98 -0.44 119.26 118.46 1qk1 h ALA 144 Ca 0.31 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1qk1 h ALA 144 Cb 0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1qk1 h ALA 144 CO -0.05 0.52 0.12 0.93 0.00 0.00 0.00 179.25 180.77 1qk1 h GLU 145 N 0.95 0.86 -0.52 0.00 5.08 -1.82 -0.86 114.58 118.26 1qk1 h GLU 145 Ca 0.21 -0.21 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1qk1 h GLU 145 Cb 0.28 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1qk1 h GLU 145 CO -0.01 0.82 0.11 -0.09 -1.00 0.00 0.00 179.01 178.84 1qk1 h ARG 146 N 0.75 0.80 -0.01 2.33 2.43 -0.94 -1.91 114.38 117.84 1qk1 h ARG 146 Ca 0.17 -0.17 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1qk1 h ARG 146 Cb 0.35 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1qk1 h ARG 146 CO 0.00 0.73 -0.48 0.00 -1.51 0.00 0.00 179.97 178.72 1qk1 h ARG 147 N 0.77 0.01 -0.15 0.20 3.08 -0.68 -2.63 114.38 114.98 1qk1 h ARG 147 Ca 0.17 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 1qk1 h ARG 147 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1qk1 h ARG 147 CO 0.00 0.49 0.00 1.49 -1.07 0.00 0.00 179.97 180.88 1qk1 h GLU 148 N 0.01 0.26 -0.71 0.04 4.57 -0.41 -1.36 114.58 116.98 1qk1 h GLU 148 Ca -0.00 -0.08 0.12 0.00 -1.18 0.00 0.00 59.36 58.22 1qk1 h GLU 148 Cb 0.85 -0.02 -0.09 0.00 -0.16 0.00 0.00 28.75 29.33 1qk1 h GLU 148 CO 0.06 0.49 0.29 0.28 -1.18 0.00 0.00 179.01 178.95 1qk1 h VAL 149 N 0.01 0.71 -0.15 0.32 2.07 -1.14 0.33 116.25 118.40 1qk1 h VAL 149 Ca 0.04 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 1qk1 h VAL 149 Cb 0.37 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1qk1 h VAL 149 CO 0.01 0.08 0.00 -0.08 0.02 0.00 0.00 177.57 177.60 1qk1 h GLU 150 N 0.46 0.27 -0.18 1.57 4.81 -1.28 -1.51 114.58 118.71 1qk1 h GLU 150 Ca 0.38 -0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.55 1qk1 h GLU 150 Cb 0.52 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 1qk1 h GLU 150 CO -0.36 0.49 0.03 0.00 -0.73 0.00 0.00 179.01 178.44 1qk1 h ARG 151 N 0.01 0.10 -0.47 1.92 3.08 -0.49 1.00 114.38 119.53 1qk1 h ARG 151 Ca 0.04 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1qk1 h ARG 151 Cb 0.37 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 1qk1 h ARG 151 CO 0.01 0.07 0.30 0.28 -1.07 0.00 0.00 179.97 179.56 1qk1 h VAL 152 N 0.10 1.13 -0.10 2.04 2.07 -0.93 -1.77 116.25 118.78 1qk1 h VAL 152 Ca 0.08 -0.26 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 1qk1 h VAL 152 Cb 0.08 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1qk1 h VAL 152 CO -0.11 0.13 -0.11 0.58 0.02 0.00 0.00 177.57 178.08 1qk1 h VAL 153 N 0.63 1.36 -0.74 2.57 2.07 -1.04 -2.89 116.25 118.22 1qk1 h VAL 153 Ca 0.17 -1.27 0.04 0.00 0.82 0.00 0.00 66.70 66.46 1qk1 h VAL 153 Cb -0.05 1.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 1qk1 h VAL 153 CO -0.04 0.36 0.49 0.58 0.02 0.00 0.00 177.57 178.98 1qk1 h VAL 154 N -0.15 1.09 -0.46 2.57 2.07 -0.76 -0.13 116.25 120.49 1qk1 h VAL 154 Ca 0.02 -0.30 -0.11 0.00 0.82 0.00 0.00 66.70 67.13 1qk1 h VAL 154 Cb 0.63 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1qk1 h VAL 154 CO 0.03 0.16 -0.13 0.44 0.02 0.00 0.00 177.57 178.08 1qk1 h ASP 155 N 0.86 0.87 -0.18 0.57 5.19 -1.31 -2.53 116.42 119.89 1qk1 h ASP 155 Ca 0.30 -0.28 -0.06 0.00 -0.62 0.00 0.00 57.03 56.37 1qk1 h ASP 155 Cb 0.11 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 39.38 1qk1 h ASP 155 CO -0.09 1.00 -0.13 0.00 -3.12 0.00 0.00 179.24 176.90 1qk1 h ALA 156 N 1.07 0.26 -0.36 3.45 0.00 -1.13 -3.11 119.26 119.44 1qk1 h ALA 156 Ca 0.12 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1qk1 h ALA 156 Cb 0.65 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1qk1 h ALA 156 CO 0.05 0.12 0.24 -0.07 0.00 0.00 0.00 179.25 179.59 1qk1 h LEU 157 N 0.07 0.42 0.00 0.00 3.38 -1.00 -0.53 115.31 117.65 1qk1 h LEU 157 Ca 0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1qk1 h LEU 157 Cb 0.64 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1qk1 h LEU 157 CO 0.03 0.31 0.00 -1.54 0.09 0.00 0.00 178.44 177.33 1qk1 n SER 158 N -4.48 0.00 -0.50 -0.43 3.41 -0.96 -1.77 113.62 108.89 1qk1 n SER 158 Ca 0.02 0.25 0.12 0.00 -0.26 0.00 0.00 58.87 59.00 1qk1 n SER 158 Cb 0.06 -0.37 0.18 0.00 -0.26 0.00 0.00 64.21 63.83 1qk1 n SER 158 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qk1 n GLY 159 N -0.06 0.01 3.77 5.00 0.00 -0.21 -4.93 105.19 108.76 1qk1 n GLY 159 Ca 0.05 -0.56 -0.39 0.00 0.00 0.00 0.00 46.02 45.13 1qk1 n GLY 159 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qk1 s LEU 160 N -2.35 4.36 0.39 0.99 1.43 -0.73 -5.05 118.68 117.73 1qk1 s LEU 160 Ca 0.24 2.20 0.04 0.00 -1.03 0.00 0.00 54.13 55.58 1qk1 s LEU 160 Cb 0.19 -3.87 -0.03 0.00 0.03 0.00 0.00 46.19 42.51 1qk1 s LEU 160 CO 0.48 -0.34 0.11 -0.54 0.23 0.00 0.00 176.35 176.30 1qk1 s LYS 161 N -1.92 1.87 7.20 1.70 1.02 -1.26 -4.24 119.74 124.11 1qk1 s LYS 161 Ca 0.51 -2.12 0.00 0.00 0.02 0.00 0.00 55.97 54.38 1qk1 s LYS 161 Cb -0.28 -0.67 0.00 0.00 -0.52 0.00 0.00 37.83 36.36 1qk1 s LYS 161 CO 0.36 -0.42 0.00 0.41 -0.92 0.00 0.00 175.35 174.79 1qk1 n GLY 162 N -0.86 2.57 0.00 -3.33 0.00 -1.26 -2.00 105.19 100.31 1qk1 n GLY 162 Ca -0.05 -0.31 0.14 0.00 0.00 0.00 0.00 46.02 45.80 1qk1 n GLY 162 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1qk1 n ASP 163 N 5.25 0.00 -0.72 1.61 5.75 -1.26 -2.75 116.55 124.43 1qk1 n ASP 163 Ca 0.00 -0.46 0.11 0.00 -0.01 0.00 0.00 54.79 54.43 1qk1 n ASP 163 Cb 0.00 -0.17 0.05 0.00 -1.03 0.00 0.00 41.12 39.97 1qk1 n ASP 163 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1qk1 n LEU 164 N -1.17 2.50 -4.77 -2.12 4.77 -0.85 -4.67 117.00 110.70 1qk1 n LEU 164 Ca 0.17 -0.88 -0.39 0.00 -0.03 0.00 0.00 56.01 54.88 1qk1 n LEU 164 Cb 0.17 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.25 1qk1 n LEU 164 CO 0.20 0.44 0.91 0.00 -1.33 0.00 0.00 177.39 177.61 1qk1 s ALA 165 N -2.20 3.24 0.00 -1.18 0.00 -1.11 -4.60 121.76 115.90 1qk1 s ALA 165 Ca 0.23 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.32 1qk1 s ALA 165 Cb 0.19 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.86 1qk1 s ALA 165 CO 0.43 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.90 1qk1 n GLY 166 N 0.69 3.44 3.03 0.00 0.00 -1.26 -1.13 105.19 109.96 1qk1 n GLY 166 Ca 0.04 -0.83 -0.14 0.00 0.00 0.00 0.00 46.02 45.09 1qk1 n GLY 166 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1qk1 s ARG 167 N 1.14 0.49 -0.03 1.61 3.52 -0.76 -4.91 118.95 120.01 1qk1 s ARG 167 Ca 0.00 -0.60 0.03 0.00 -0.13 0.00 0.00 55.73 55.04 1qk1 s ARG 167 Cb 0.00 -0.31 -0.03 0.00 -1.56 0.00 0.00 34.95 33.05 1qk1 s ARG 167 CO 0.00 0.06 -0.11 -0.47 -0.81 0.00 0.00 175.30 173.97 1qk1 s TYR 168 N -1.04 2.79 -0.08 5.12 5.04 -1.26 -2.43 117.35 125.49 1qk1 s TYR 168 Ca -0.07 -0.09 0.02 0.00 -2.44 0.00 0.00 57.07 54.48 1qk1 s TYR 168 Cb -0.08 -1.63 0.02 0.00 0.35 0.00 0.00 41.96 40.62 1qk1 s TYR 168 CO 0.00 0.27 -0.12 0.71 -1.34 0.00 0.00 175.55 175.08 1qk1 s TYR 169 N -0.83 1.56 -0.12 4.97 1.51 0.11 -4.98 117.35 119.57 1qk1 s TYR 169 Ca 0.13 -0.65 -0.22 0.00 -1.01 0.00 0.00 57.07 55.33 1qk1 s TYR 169 Cb -0.11 -1.17 -0.03 0.00 -0.11 0.00 0.00 41.96 40.54 1qk1 s TYR 169 CO 0.03 -0.36 0.64 1.03 -1.11 0.00 0.00 175.55 175.78 1qk1 s ARG 170 N 0.91 4.35 0.48 -0.62 0.52 -1.26 -0.71 118.95 122.62 1qk1 s ARG 170 Ca -0.10 0.72 0.16 0.00 -0.52 0.00 0.00 55.73 55.99 1qk1 s ARG 170 Cb -0.15 -3.49 1.17 0.00 0.52 0.00 0.00 34.95 33.00 1qk1 s ARG 170 CO 0.01 -0.01 2.05 -0.07 0.02 0.00 0.00 175.30 177.29 1qk1 h LEU 171 N 7.21 0.18 -0.86 2.53 3.38 -1.80 -2.20 115.31 123.74 1qk1 h LEU 171 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1qk1 h LEU 171 Cb 1.18 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1qk1 h LEU 171 CO 0.76 0.12 0.00 0.77 0.09 0.00 0.00 178.44 180.18 1qk1 h SER 172 N 0.20 0.00 0.00 -0.43 4.64 -1.81 -3.23 113.55 112.92 1qk1 h SER 172 Ca 0.16 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.46 1qk1 h SER 172 Cb 0.37 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.42 1qk1 h SER 172 CO -0.03 0.00 -0.35 -1.84 -0.87 0.00 0.00 176.83 173.74 1qk1 n GLU 173 N -2.77 0.79 -2.52 4.77 0.28 -0.88 -5.05 120.64 115.25 1qk1 n GLU 173 Ca 0.02 -2.14 -0.41 0.00 -0.16 0.00 0.00 57.16 54.47 1qk1 n GLU 173 Cb 0.34 -1.04 -0.04 0.00 1.43 0.00 0.00 31.44 32.13 1qk1 n GLU 173 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 177.13 178.38 1qk1 s MET 174 N -1.72 4.57 0.61 3.44 1.75 -0.92 -4.92 119.30 122.12 1qk1 s MET 174 Ca 0.23 1.70 -0.08 0.00 -1.25 0.00 0.00 55.69 56.29 1qk1 s MET 174 Cb 0.22 -3.30 -0.00 0.00 2.84 0.00 0.00 34.83 34.59 1qk1 s MET 174 CO -0.02 0.02 0.95 0.95 -0.65 0.00 0.00 175.02 176.27 1qk1 s THR 175 N 0.04 3.91 0.43 10.11 -4.23 -1.26 -4.87 115.64 119.77 1qk1 s THR 175 Ca 0.51 0.24 0.11 0.00 -1.18 0.00 0.00 61.69 61.37 1qk1 s THR 175 Cb -0.29 -3.57 0.21 0.00 1.34 0.00 0.00 72.50 70.20 1qk1 s THR 175 CO 0.33 -0.64 2.00 -0.33 -0.54 0.00 0.00 174.62 175.45 1qk1 h GLU 176 N -0.25 0.22 0.16 3.99 5.08 -1.99 0.71 114.58 122.50 1qk1 h GLU 176 Ca -0.45 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 57.87 1qk1 h GLU 176 Cb 1.24 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1qk1 h GLU 176 CO 0.62 0.27 -0.08 0.00 -1.00 0.00 0.00 179.01 178.82 1qk1 h ALA 177 N 1.76 -0.21 -0.52 3.43 0.00 -2.00 -2.10 119.26 119.63 1qk1 h ALA 177 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1qk1 h ALA 177 Cb 0.20 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1qk1 h ALA 177 CO 0.01 -0.48 0.34 0.93 0.00 0.00 0.00 179.25 180.05 1qk1 h GLU 178 N -0.50 0.69 -0.52 0.00 5.08 -1.83 -1.72 114.58 115.79 1qk1 h GLU 178 Ca -0.02 -0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.35 1qk1 h GLU 178 Cb 0.39 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.43 1qk1 h GLU 178 CO 0.04 0.47 0.22 0.37 -1.00 0.00 0.00 179.01 179.11 1qk1 h GLN 179 N 0.70 0.42 -0.59 2.33 4.15 -0.85 -1.32 115.11 119.95 1qk1 h GLN 179 Ca 0.19 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.52 1qk1 h GLN 179 Cb -0.06 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.51 1qk1 h GLN 179 CO -0.04 0.28 0.12 0.37 -1.93 0.00 0.00 178.83 177.63 1qk1 h GLN 180 N 0.43 0.96 -0.45 1.69 5.75 -1.07 -1.74 115.11 120.68 1qk1 h GLN 180 Ca 0.24 -0.24 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1qk1 h GLN 180 Cb 0.22 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 1qk1 h GLN 180 CO -0.21 0.90 0.29 0.37 -2.65 0.00 0.00 178.83 177.52 1qk1 h GLN 181 N 0.86 0.60 -0.25 1.69 5.75 -0.86 -1.72 115.11 121.19 1qk1 h GLN 181 Ca 0.18 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.60 1qk1 h GLN 181 Cb 0.38 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.79 1qk1 h GLN 181 CO 0.01 0.41 -0.03 -0.07 -2.65 0.00 0.00 178.83 176.50 1qk1 h LEU 182 N 0.61 0.35 -0.51 -2.39 3.38 -1.04 -1.56 115.31 114.13 1qk1 h LEU 182 Ca 0.16 -0.06 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 1qk1 h LEU 182 Cb -0.05 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1qk1 h LEU 182 CO -0.03 0.43 -0.45 0.40 0.09 0.00 0.00 178.44 178.88 1qk1 h ILE 183 N 0.36 1.29 -0.40 1.22 2.04 -0.87 -0.14 117.51 121.02 1qk1 h ILE 183 Ca 0.08 -1.64 -0.10 0.00 1.00 0.00 0.00 64.86 64.20 1qk1 h ILE 183 Cb 0.29 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.91 1qk1 h ILE 183 CO 0.01 0.53 -0.18 0.44 0.00 0.00 0.00 178.15 178.95 1qk1 h ASP 184 N 0.57 0.76 1.05 1.72 3.32 -0.64 -2.28 116.42 120.92 1qk1 h ASP 184 Ca 0.04 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.83 1qk1 h ASP 184 Cb 1.00 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1qk1 h ASP 184 CO 0.09 0.93 0.00 0.47 -1.72 0.00 0.00 179.24 179.02 1qk1 n ASP 185 N -4.13 0.31 -2.14 6.45 8.00 -0.65 -4.91 116.55 119.46 1qk1 n ASP 185 Ca 0.01 0.54 -0.12 0.00 0.71 0.00 0.00 54.79 55.92 1qk1 n ASP 185 Cb 0.40 -0.62 0.04 0.00 -0.02 0.00 0.00 41.12 40.93 1qk1 n ASP 185 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1qk1 n HIS 186 N -1.80 -1.49 0.21 1.24 8.25 -0.77 -4.95 115.22 115.91 1qk1 n HIS 186 Ca 0.06 0.53 0.05 0.00 -0.26 0.00 0.00 57.72 58.10 1qk1 n HIS 186 Cb 0.34 -3.17 -0.07 0.00 1.12 0.00 0.00 29.99 28.20 1qk1 n HIS 186 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1qk1 n PHE 187 N -3.72 0.00 -2.51 4.41 3.72 -0.14 -5.02 117.46 114.20 1qk1 n PHE 187 Ca -0.01 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.07 1qk1 n PHE 187 Cb 0.54 -0.15 -0.04 0.00 -0.94 0.00 0.00 39.48 38.89 1qk1 n PHE 187 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1qk1 s LEU 188 N -3.24 3.70 0.05 4.37 2.96 -1.16 -5.01 118.68 120.35 1qk1 s LEU 188 Ca -0.01 1.56 0.01 0.00 -0.22 0.00 0.00 54.13 55.47 1qk1 s LEU 188 Cb 0.07 -4.48 -0.03 0.00 0.50 0.00 0.00 46.19 42.26 1qk1 s LEU 188 CO 0.45 -0.53 -0.05 0.72 -1.32 0.00 0.00 176.35 175.62 1qk1 s PHE 189 N -2.52 0.57 0.32 5.38 -0.12 -1.26 -5.00 117.98 115.34 1qk1 s PHE 189 Ca 0.59 -0.75 0.02 0.00 -0.05 0.00 0.00 56.93 56.74 1qk1 s PHE 189 Cb -0.10 -0.37 -0.01 0.00 -0.63 0.00 0.00 43.02 41.92 1qk1 s PHE 189 CO 0.28 -0.21 0.06 -0.40 -0.05 0.00 0.00 175.22 174.91 1qk1 n ASP 190 N 0.81 1.87 -4.60 1.98 5.68 -1.26 -5.09 116.55 115.94 1qk1 n ASP 190 Ca -0.18 -2.55 -0.51 0.00 -0.50 0.00 0.00 54.79 51.04 1qk1 n ASP 190 Cb 0.58 0.55 -0.05 0.00 -1.14 0.00 0.00 41.12 41.05 1qk1 n ASP 190 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1qk1 n LYS 191 N -0.75 1.27 -1.84 0.11 4.81 -1.26 -4.86 118.16 115.64 1qk1 n LYS 191 Ca -0.08 0.46 -0.40 0.00 -0.87 0.00 0.00 58.31 57.41 1qk1 n LYS 191 Cb 0.44 -2.09 0.01 0.00 0.02 0.00 0.00 35.03 33.41 1qk1 n LYS 191 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1qk1 s PRO 192 N 0.38 3.93 -0.02 1.64 0.02 -1.26 -4.92 135.00 134.77 1qk1 s PRO 192 Ca 0.82 2.45 0.05 0.00 0.02 0.00 0.00 61.00 64.33 1qk1 s PRO 192 Cb -0.90 -2.82 -0.07 0.00 0.02 0.00 0.00 34.50 30.73 1qk1 s PRO 192 CO 0.47 -0.63 0.07 1.33 -0.33 0.00 0.00 177.00 177.91 1qk1 n VAL 193 N 0.17 0.13 -1.67 3.83 0.24 -1.26 -4.86 118.33 114.89 1qk1 n VAL 193 Ca 0.03 -0.15 -0.49 0.00 -2.04 0.00 0.00 64.34 61.70 1qk1 n VAL 193 Cb 0.41 -0.12 -0.05 0.00 -1.47 0.00 0.00 33.84 32.61 1qk1 n VAL 193 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1qk1 n SER 194 N -1.87 3.12 0.20 -1.34 2.88 -1.26 -4.84 113.62 110.51 1qk1 n SER 194 Ca -0.04 1.03 0.14 0.00 -1.33 0.00 0.00 58.87 58.68 1qk1 n SER 194 Cb 0.34 -1.36 0.66 0.00 -0.75 0.00 0.00 64.21 63.11 1qk1 n SER 194 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1qk1 h PRO 195 N 7.63 0.00 0.00 -1.46 0.13 -1.99 -0.94 132.00 135.38 1qk1 h PRO 195 Ca -0.47 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.59 1qk1 h PRO 195 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 1qk1 h PRO 195 CO 0.92 0.00 -0.34 -0.07 -0.23 0.00 0.00 178.00 178.28 1qk1 h LEU 196 N 0.00 0.00 0.09 1.56 3.38 -1.93 -2.09 115.31 116.33 1qk1 h LEU 196 Ca 0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 1qk1 h LEU 196 Cb 0.25 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1qk1 h LEU 196 CO 0.00 0.34 -1.98 0.18 0.09 0.00 0.00 178.44 177.08 1qk1 n LEU 197 N -3.93 2.57 0.03 1.67 4.32 -0.43 -3.92 117.00 117.32 1qk1 n LEU 197 Ca -0.02 0.20 -0.06 0.00 -0.02 0.00 0.00 56.01 56.11 1qk1 n LEU 197 Cb 0.40 -1.07 0.13 0.00 -1.62 0.00 0.00 43.42 41.26 1qk1 n LEU 197 CO 0.37 0.79 0.57 0.71 -1.22 0.00 0.00 177.39 178.61 1qk1 h THR 198 N -0.09 1.32 0.00 -5.08 1.35 -1.40 -2.28 112.91 106.72 1qk1 h THR 198 Ca -0.44 -1.66 -0.02 0.00 -0.55 0.00 0.00 66.41 63.74 1qk1 h THR 198 Cb 1.92 1.69 -0.00 0.00 -1.73 0.00 0.00 68.15 70.03 1qk1 h THR 198 CO 0.02 0.51 -0.07 0.00 -0.25 0.00 0.00 175.52 175.73 1qk1 h ALA 199 N 1.16 1.08 -0.39 6.62 0.00 -1.57 -1.56 119.26 124.61 1qk1 h ALA 199 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1qk1 h ALA 199 Cb 0.95 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1qk1 h ALA 199 CO 0.08 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.42 1qk1 n ALA 200 N -2.17 2.54 -1.48 0.00 0.00 -0.89 -4.33 120.51 114.18 1qk1 n ALA 200 Ca -0.01 -0.74 -0.12 0.00 0.00 0.00 0.00 53.44 52.57 1qk1 n ALA 200 Cb 0.27 -0.98 -0.05 0.00 0.00 0.00 0.00 19.45 18.69 1qk1 n ALA 200 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qk1 n GLY 201 N 1.02 1.12 0.34 0.00 0.00 -0.59 -4.40 105.19 102.69 1qk1 n GLY 201 Ca 0.13 -0.44 0.06 0.00 0.00 0.00 0.00 46.02 45.78 1qk1 n GLY 201 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1qk1 n MET 202 N -2.58 1.43 -0.01 1.61 2.00 -1.01 -3.64 117.12 114.93 1qk1 n MET 202 Ca -0.13 -0.66 0.00 0.00 0.00 0.00 0.00 57.70 56.92 1qk1 n MET 202 Cb 0.44 -1.24 0.01 0.00 0.00 0.00 0.00 33.22 32.42 1qk1 n MET 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1qk1 n ALA 203 N -0.04 2.06 -1.75 3.04 0.00 -1.26 -4.90 120.51 117.66 1qk1 n ALA 203 Ca 0.11 -0.96 -0.39 0.00 0.00 0.00 0.00 53.44 52.20 1qk1 n ALA 203 Cb 0.19 -0.03 0.04 0.00 0.00 0.00 0.00 19.45 19.65 1qk1 n ALA 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1qk1 n ARG 204 N -0.38 1.77 -1.18 0.00 1.74 -1.24 -3.11 116.66 114.25 1qk1 n ARG 204 Ca 0.01 0.65 -0.09 0.00 -0.77 0.00 0.00 57.85 57.65 1qk1 n ARG 204 Cb 0.24 -2.59 -0.04 0.00 -1.02 0.00 0.00 32.46 29.05 1qk1 n ARG 204 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1qk1 n ASP 205 N -0.91 -4.98 -4.67 0.55 8.00 -1.26 -4.88 116.55 108.40 1qk1 n ASP 205 Ca 0.10 0.21 -0.44 0.00 0.71 0.00 0.00 54.79 55.37 1qk1 n ASP 205 Cb 0.44 -3.65 -0.02 0.00 -0.02 0.00 0.00 41.12 37.87 1qk1 n ASP 205 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 1qk1 n TRP 206 N -1.95 2.10 -0.92 1.24 -0.00 -1.18 -0.77 117.44 115.95 1qk1 n TRP 206 Ca -0.09 0.52 0.05 0.00 -0.00 0.00 0.00 57.50 57.98 1qk1 n TRP 206 Cb 0.51 -2.41 0.40 0.00 -0.00 0.00 0.00 31.31 29.80 1qk1 n TRP 206 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 1qk1 n PRO 207 N 1.27 4.79 -1.66 5.87 -0.04 -1.26 -5.12 135.00 138.85 1qk1 n PRO 207 Ca 0.09 -3.16 -0.56 0.00 -0.04 0.00 0.00 63.50 59.83 1qk1 n PRO 207 Cb 0.33 -2.27 -0.07 0.00 -0.04 0.00 0.00 33.50 31.45 1qk1 n PRO 207 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1qk1 n ASP 208 N 0.53 2.02 -0.36 3.54 -0.08 0.05 -1.86 116.55 120.38 1qk1 n ASP 208 Ca 0.30 1.10 -0.05 0.00 -1.51 0.00 0.00 54.79 54.63 1qk1 n ASP 208 Cb 1.23 -1.15 -0.02 0.00 2.34 0.00 0.00 41.12 43.52 1qk1 n ASP 208 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1qk1 n ALA 209 N 4.14 -0.07 -2.70 -1.67 0.00 -1.26 -4.98 120.51 113.96 1qk1 n ALA 209 Ca 0.23 0.08 -0.32 0.00 0.00 0.00 0.00 53.44 53.43 1qk1 n ALA 209 Cb 0.15 -1.26 -0.05 0.00 0.00 0.00 0.00 19.45 18.29 1qk1 n ALA 209 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1qk1 s ARG 210 N -2.03 3.60 0.31 0.00 1.81 -0.78 -4.67 118.95 117.20 1qk1 s ARG 210 Ca 0.00 -0.11 -0.18 0.00 -1.72 0.00 0.00 55.73 53.72 1qk1 s ARG 210 Cb 0.00 -2.89 0.03 0.00 -0.45 0.00 0.00 34.95 31.64 1qk1 s ARG 210 CO 0.00 0.50 0.70 0.20 -0.68 0.00 0.00 175.30 176.02 1qk1 s GLY 211 N -2.36 0.16 -0.02 -3.53 0.00 -0.97 -2.62 107.32 97.98 1qk1 s GLY 211 Ca 0.39 -0.54 0.04 0.00 0.00 0.00 0.00 44.72 44.61 1qk1 s GLY 211 CO 0.24 -0.24 -0.13 -0.42 0.00 0.00 0.00 173.10 172.55 1qk1 s ILE 212 N -3.46 1.04 -0.01 0.90 1.01 0.11 -1.10 121.20 119.69 1qk1 s ILE 212 Ca 0.14 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.27 1qk1 s ILE 212 Cb -0.05 -0.88 0.00 0.00 0.01 0.00 0.00 42.46 41.54 1qk1 s ILE 212 CO 0.09 0.30 -0.05 0.86 0.00 0.00 0.00 174.94 176.14 1qk1 s TRP 213 N -0.13 0.46 0.03 3.97 -0.00 -0.46 0.06 118.94 122.87 1qk1 s TRP 213 Ca 0.02 -0.09 -0.09 0.00 -0.00 0.00 0.00 56.10 55.94 1qk1 s TRP 213 Cb -0.07 -0.32 0.00 0.00 -0.00 0.00 0.00 33.47 33.08 1qk1 s TRP 213 CO 0.00 -0.03 0.19 -3.38 -0.00 0.00 0.00 176.95 173.73 1qk1 s HIS 214 N 0.03 0.04 0.77 5.86 -3.43 -1.02 -0.23 115.29 117.32 1qk1 s HIS 214 Ca 0.00 -0.22 -0.11 0.00 -0.80 0.00 0.00 55.06 53.93 1qk1 s HIS 214 Cb -0.04 -0.03 0.05 0.00 -1.43 0.00 0.00 32.58 31.14 1qk1 s HIS 214 CO -0.00 -0.40 1.09 0.54 -2.00 0.00 0.00 174.74 173.97 1qk1 s ASN 215 N -1.91 4.81 0.27 7.38 4.22 -0.81 -1.83 114.94 127.07 1qk1 s ASN 215 Ca -0.07 1.28 -0.02 0.00 -2.14 0.00 0.00 52.86 51.90 1qk1 s ASN 215 Cb -0.02 -2.04 0.41 0.00 1.28 0.00 0.00 41.25 40.88 1qk1 s ASN 215 CO -0.02 -1.77 1.91 0.78 -2.04 0.00 0.00 177.10 175.96 1qk1 h ASN 216 N -0.95 1.02 -0.02 3.54 2.35 -1.40 -1.59 115.58 118.53 1qk1 h ASN 216 Ca -0.46 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 1qk1 h ASN 216 Cb 1.26 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 39.41 1qk1 h ASN 216 CO 0.60 0.68 0.00 -1.84 -1.65 0.00 0.00 177.43 175.22 1qk1 n GLU 217 N -4.47 1.07 -3.68 0.81 0.28 -1.26 -4.91 120.64 108.49 1qk1 n GLU 217 Ca 0.14 -0.11 -0.23 0.00 -0.16 0.00 0.00 57.16 56.79 1qk1 n GLU 217 Cb 0.14 -1.21 0.05 0.00 1.43 0.00 0.00 31.44 31.85 1qk1 n GLU 217 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1qk1 n LYS 218 N -0.59 -6.17 0.00 3.44 5.02 -0.60 -4.91 118.16 114.35 1qk1 n LYS 218 Ca 0.10 0.71 0.00 0.00 -2.02 0.00 0.00 58.31 57.10 1qk1 n LYS 218 Cb 0.07 -5.57 0.00 0.00 -0.02 0.00 0.00 35.03 29.51 1qk1 n LYS 218 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1qk1 n SER 219 N -3.01 0.70 -3.72 4.39 3.41 -1.26 -4.93 113.62 109.20 1qk1 n SER 219 Ca -0.14 -0.89 -0.24 0.00 -0.26 0.00 0.00 58.87 57.34 1qk1 n SER 219 Cb 0.61 0.16 -0.17 0.00 -0.26 0.00 0.00 64.21 64.55 1qk1 n SER 219 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1qk1 s PHE 220 N -0.16 0.59 -0.05 7.33 5.36 -1.26 -1.90 117.98 127.88 1qk1 s PHE 220 Ca 0.00 -0.29 0.06 0.00 -0.96 0.00 0.00 56.93 55.74 1qk1 s PHE 220 Cb 0.00 -0.79 -0.02 0.00 -0.34 0.00 0.00 43.02 41.87 1qk1 s PHE 220 CO 0.00 -0.40 -0.23 -1.17 -1.46 0.00 0.00 175.22 171.96 1qk1 s LEU 221 N 2.00 2.22 -0.07 6.12 0.20 0.68 -1.92 118.68 127.92 1qk1 s LEU 221 Ca 0.03 -0.44 0.01 0.00 0.69 0.00 0.00 54.13 54.42 1qk1 s LEU 221 Cb -0.14 -1.41 0.02 0.00 -0.43 0.00 0.00 46.19 44.23 1qk1 s LEU 221 CO -0.06 0.27 -0.06 -0.63 -0.29 0.00 0.00 176.35 175.58 1qk1 s ILE 222 N -0.33 0.73 -0.21 6.68 1.01 0.68 -0.05 121.20 129.71 1qk1 s ILE 222 Ca 0.02 -0.18 -0.08 0.00 0.00 0.00 0.00 60.65 60.40 1qk1 s ILE 222 Cb -0.12 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.55 1qk1 s ILE 222 CO 0.02 0.29 0.09 0.26 0.00 0.00 0.00 174.94 175.60 1qk1 s TRP 223 N 1.22 3.23 -0.22 3.97 0.51 -0.15 -1.35 118.94 126.16 1qk1 s TRP 223 Ca -0.06 0.02 -0.08 0.00 -2.12 0.00 0.00 56.10 53.86 1qk1 s TRP 223 Cb -0.14 -2.17 -0.04 0.00 -0.81 0.00 0.00 33.47 30.32 1qk1 s TRP 223 CO -0.02 0.02 0.09 0.08 -0.51 0.00 0.00 176.95 176.61 1qk1 s VAL 224 N 0.82 4.74 -1.51 4.03 1.01 -0.26 -1.52 120.40 127.71 1qk1 s VAL 224 Ca 0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.94 1qk1 s VAL 224 Cb -0.13 -3.18 0.01 0.00 0.00 0.00 0.00 36.38 33.07 1qk1 s VAL 224 CO 0.02 0.38 0.71 0.59 0.00 0.00 0.00 175.10 176.80 1qk1 n ASN 225 N 4.28 -6.16 0.00 3.32 3.02 0.41 -2.30 115.26 117.83 1qk1 n ASN 225 Ca -0.16 -0.33 0.00 0.00 -0.03 0.00 0.00 54.58 54.06 1qk1 n ASN 225 Cb 0.52 -4.94 0.00 0.00 -0.61 0.00 0.00 39.78 34.75 1qk1 n ASN 225 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1qk1 n GLU 226 N -4.17 0.00 -0.56 3.52 2.13 -1.26 -4.80 120.64 115.50 1qk1 n GLU 226 Ca -0.09 0.00 0.09 0.00 0.66 0.00 0.00 57.16 57.82 1qk1 n GLU 226 Cb 0.61 0.00 0.34 0.00 0.27 0.00 0.00 31.44 32.66 1qk1 n GLU 226 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 1qk1 n GLU 227 N 0.00 3.47 -3.77 5.31 0.28 -1.26 -4.92 120.64 119.75 1qk1 n GLU 227 Ca 0.00 -2.71 -0.04 0.00 -0.16 0.00 0.00 57.16 54.25 1qk1 n GLU 227 Cb 0.00 -1.82 -0.01 0.00 1.43 0.00 0.00 31.44 31.03 1qk1 n GLU 227 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1qk1 s ASP 228 N -0.89 -0.19 0.17 -1.84 1.01 -1.26 -4.70 116.67 108.97 1qk1 s ASP 228 Ca 0.49 -0.43 -0.15 0.00 0.71 0.00 0.00 52.55 53.18 1qk1 s ASP 228 Cb 0.30 0.52 0.13 0.00 1.01 0.00 0.00 42.92 44.88 1qk1 s ASP 228 CO 0.25 -0.96 1.72 0.45 0.21 0.00 0.00 175.17 176.85 1qk1 h HIS 229 N 2.00 0.13 -3.50 4.23 3.86 -1.92 -3.13 115.15 116.83 1qk1 h HIS 229 Ca -0.23 0.03 -0.17 0.00 -1.16 0.00 0.00 60.37 58.83 1qk1 h HIS 229 Cb 1.23 0.00 -0.24 0.00 1.06 0.00 0.00 27.41 29.47 1qk1 h HIS 229 CO 0.39 0.01 -0.55 0.95 0.86 0.00 0.00 177.93 179.58 1qk1 s THR 230 N -6.15 0.04 -0.17 2.45 -4.23 -1.05 -0.44 115.64 106.09 1qk1 s THR 230 Ca -0.13 -0.34 0.01 0.00 -1.18 0.00 0.00 61.69 60.05 1qk1 s THR 230 Cb 0.14 -0.29 0.02 0.00 1.34 0.00 0.00 72.50 73.71 1qk1 s THR 230 CO 0.72 -0.19 -0.18 -0.13 -0.54 0.00 0.00 174.62 174.30 1qk1 s ARG 231 N -0.60 2.79 -0.19 3.99 1.81 -0.58 -2.02 118.95 124.16 1qk1 s ARG 231 Ca -0.07 -0.75 -0.06 0.00 -1.72 0.00 0.00 55.73 53.13 1qk1 s ARG 231 Cb -0.04 -2.42 -0.04 0.00 -0.45 0.00 0.00 34.95 32.00 1qk1 s ARG 231 CO 0.01 -0.20 0.04 0.08 -0.68 0.00 0.00 175.30 174.54 1qk1 s VAL 232 N 1.31 4.47 -0.04 3.52 1.01 0.35 -0.97 120.40 130.05 1qk1 s VAL 232 Ca 0.04 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 61.90 1qk1 s VAL 232 Cb -0.13 -3.01 0.01 0.00 0.00 0.00 0.00 36.38 33.25 1qk1 s VAL 232 CO -0.12 0.45 -0.07 -0.63 0.00 0.00 0.00 175.10 174.73 1qk1 s ILE 233 N 0.57 0.72 -0.15 2.22 1.01 0.93 -1.43 121.20 125.06 1qk1 s ILE 233 Ca 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.39 1qk1 s ILE 233 Cb -0.13 -0.67 -0.00 0.00 0.01 0.00 0.00 42.46 41.66 1qk1 s ILE 233 CO 0.02 0.25 -0.15 -0.55 0.00 0.00 0.00 174.94 174.50 1qk1 s SER 234 N 0.53 3.69 0.08 3.58 0.15 -0.35 -0.23 113.70 121.15 1qk1 s SER 234 Ca -0.08 -0.45 -0.06 0.00 0.70 0.00 0.00 55.95 56.06 1qk1 s SER 234 Cb -0.12 -1.56 -0.02 0.00 -1.71 0.00 0.00 66.02 62.61 1qk1 s SER 234 CO 0.01 0.10 0.11 0.00 1.20 0.00 0.00 173.24 174.65 1qk1 s MET 235 N 0.72 0.76 -0.06 5.44 0.23 -0.80 -0.97 119.30 124.63 1qk1 s MET 235 Ca -0.07 -1.07 -0.30 0.00 -1.03 0.00 0.00 55.69 53.22 1qk1 s MET 235 Cb -0.16 0.29 0.08 0.00 -1.53 0.00 0.00 34.83 33.52 1qk1 s MET 235 CO 0.01 -0.21 0.75 -1.21 -2.03 0.00 0.00 175.02 172.34 1qk1 s GLU 236 N -3.89 0.96 0.39 3.16 2.02 -0.79 -4.58 118.70 115.97 1qk1 s GLU 236 Ca 0.06 0.17 -0.20 0.00 0.02 0.00 0.00 54.97 55.02 1qk1 s GLU 236 Cb 0.06 0.45 -0.10 0.00 0.10 0.00 0.00 34.13 34.64 1qk1 s GLU 236 CO -0.10 -0.31 0.90 0.15 0.02 0.00 0.00 175.26 175.91 1qk1 s LYS 237 N -1.41 4.22 0.00 1.61 1.02 -1.26 -1.38 119.74 122.55 1qk1 s LYS 237 Ca -0.08 1.04 0.00 0.00 0.02 0.00 0.00 55.97 56.95 1qk1 s LYS 237 Cb -0.00 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.99 1qk1 s LYS 237 CO 0.06 0.06 0.00 0.41 -0.92 0.00 0.00 175.35 174.96 1qk1 n GLY 238 N -0.41 -1.61 0.84 -3.33 0.00 0.18 -4.74 105.19 96.11 1qk1 n GLY 238 Ca 0.05 -2.05 0.05 0.00 0.00 0.00 0.00 46.02 44.08 1qk1 n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qk1 n GLY 239 N 0.00 3.33 2.70 -0.02 0.00 -1.26 -2.99 105.19 106.95 1qk1 n GLY 239 Ca 0.00 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.58 1qk1 n GLY 239 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1qk1 n ASN 240 N -0.51 5.68 -0.34 1.61 4.05 -1.26 -0.42 115.26 124.07 1qk1 n ASN 240 Ca 0.13 -2.99 0.11 0.00 0.45 0.00 0.00 54.58 52.28 1qk1 n ASN 240 Cb 0.84 -1.51 0.32 0.00 1.23 0.00 0.00 39.78 40.65 1qk1 n ASN 240 CO 0.00 0.00 0.00 -0.03 -3.05 0.00 0.00 177.26 174.18 1qk1 h MET 241 N 5.53 0.79 -0.57 1.20 1.85 -1.62 -1.42 114.93 120.69 1qk1 h MET 241 Ca 0.54 -0.05 0.03 0.00 -0.61 0.00 0.00 59.70 59.62 1qk1 h MET 241 Cb 0.54 -0.18 -0.04 0.00 0.43 0.00 0.00 31.60 32.35 1qk1 h MET 241 CO 1.69 0.52 0.33 -0.22 -0.40 0.00 0.00 176.91 178.83 1qk1 h LYS 242 N 0.81 0.63 -0.25 0.39 3.64 -1.54 0.56 116.57 120.80 1qk1 h LYS 242 Ca 0.52 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.72 1qk1 h LYS 242 Cb 0.75 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 1qk1 h LYS 242 CO -0.30 0.41 -0.43 -0.09 -2.27 0.00 0.00 179.45 176.77 1qk1 h ARG 243 N 0.64 0.62 -0.68 1.90 2.43 -1.56 -1.55 114.38 116.18 1qk1 h ARG 243 Ca 0.24 -0.33 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1qk1 h ARG 243 Cb 0.07 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1qk1 h ARG 243 CO -0.12 0.93 0.41 0.28 -1.51 0.00 0.00 179.97 179.97 1qk1 h VAL 244 N 0.50 1.19 -0.08 0.20 2.07 -0.73 -1.87 116.25 117.53 1qk1 h VAL 244 Ca 0.04 -0.42 -0.14 0.00 0.82 0.00 0.00 66.70 67.00 1qk1 h VAL 244 Cb 0.96 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1qk1 h VAL 244 CO 0.09 0.20 -0.56 0.15 0.02 0.00 0.00 177.57 177.47 1qk1 h PHE 245 N 0.92 0.32 -0.51 1.57 3.57 -0.73 -1.73 116.94 120.34 1qk1 h PHE 245 Ca 0.24 -0.11 -0.10 0.00 3.53 0.00 0.00 57.97 61.53 1qk1 h PHE 245 Cb -0.04 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 1qk1 h PHE 245 CO -0.02 0.75 -0.08 0.93 -2.23 0.00 0.00 178.31 177.67 1qk1 h GLU 246 N 0.19 0.96 -0.62 1.11 5.08 -0.92 -1.04 114.58 119.34 1qk1 h GLU 246 Ca 0.00 -0.35 -0.09 0.00 -1.00 0.00 0.00 59.36 57.93 1qk1 h GLU 246 Cb 1.04 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 1qk1 h GLU 246 CO 0.09 1.01 0.05 -0.09 -1.00 0.00 0.00 179.01 179.07 1qk1 h ARG 247 N 0.83 1.05 0.17 2.33 2.43 -1.26 -0.41 114.38 119.52 1qk1 h ARG 247 Ca 0.14 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 1qk1 h ARG 247 Cb 0.63 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1qk1 h ARG 247 CO 0.04 1.00 -0.17 0.35 -1.51 0.00 0.00 179.97 179.68 1qk1 h PHE 248 N 0.97 -0.44 -0.61 2.20 3.57 -1.05 0.05 116.94 121.63 1qk1 h PHE 248 Ca 0.18 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.61 1qk1 h PHE 248 Cb 0.49 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 1qk1 h PHE 248 CO 0.03 -0.26 0.07 0.00 -2.23 0.00 0.00 178.31 175.93 1qk1 h ARG 250 N 0.95 0.23 -0.70 0.00 2.43 -0.91 -2.20 114.38 114.19 1qk1 h ARG 250 Ca 0.19 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 1qk1 h ARG 250 Cb 0.45 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 1qk1 h ARG 250 CO 0.02 0.48 0.39 0.78 -1.51 0.00 0.00 179.97 180.13 1qk1 h GLY 251 N -0.04 1.03 1.02 2.80 0.00 -0.93 -1.89 103.07 105.06 1qk1 h GLY 251 Ca 0.04 -0.45 -0.04 0.00 0.00 0.00 0.00 47.33 46.88 1qk1 h GLY 251 CO 0.01 0.44 0.31 1.41 0.00 0.00 0.00 176.54 178.70 1qk1 h LEU 252 N 0.95 0.98 -0.89 3.11 3.38 -1.30 -0.68 115.31 120.86 1qk1 h LEU 252 Ca 0.25 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 1qk1 h LEU 252 Cb 0.01 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1qk1 h LEU 252 CO -0.04 0.86 -0.27 0.11 0.09 0.00 0.00 178.44 179.19 1qk1 h LYS 253 N 1.02 0.50 -0.26 1.13 1.57 -1.20 -1.10 116.57 118.24 1qk1 h LYS 253 Ca 0.24 -0.20 -0.12 0.00 -1.87 0.00 0.00 60.65 58.71 1qk1 h LYS 253 Cb 0.18 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 1qk1 h LYS 253 CO -0.02 0.73 -0.29 1.49 -0.57 0.00 0.00 179.45 180.78 1qk1 h GLU 254 N 0.44 0.66 -0.59 3.15 4.57 -1.09 -1.47 114.58 120.24 1qk1 h GLU 254 Ca 0.06 -0.36 -0.08 0.00 -1.18 0.00 0.00 59.36 57.80 1qk1 h GLU 254 Cb 0.71 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.29 1qk1 h GLU 254 CO 0.05 0.97 0.04 0.28 -1.18 0.00 0.00 179.01 179.18 1qk1 h VAL 255 N 0.38 1.26 -0.61 0.32 2.07 -0.98 -1.73 116.25 116.96 1qk1 h VAL 255 Ca 0.04 -1.07 -0.08 0.00 0.82 0.00 0.00 66.70 66.40 1qk1 h VAL 255 Cb 0.87 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1qk1 h VAL 255 CO 0.07 0.39 0.07 -0.08 0.02 0.00 0.00 177.57 178.04 1qk1 h GLU 256 N 0.90 1.03 -0.28 1.57 4.81 -1.16 -2.12 114.58 119.35 1qk1 h GLU 256 Ca 0.17 -0.29 0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1qk1 h GLU 256 Cb 0.49 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.73 1qk1 h GLU 256 CO 0.02 0.98 0.05 -0.09 -0.73 0.00 0.00 179.01 179.25 1qk1 h ARG 257 N 0.94 0.15 -0.38 1.92 2.43 -1.00 -1.83 114.38 116.62 1qk1 h ARG 257 Ca 0.18 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 1qk1 h ARG 257 Cb 0.47 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.96 1qk1 h ARG 257 CO 0.02 0.10 0.07 -0.07 -1.51 0.00 0.00 179.97 178.58 1qk1 h LEU 258 N 0.16 0.52 0.00 3.80 3.38 -1.09 -2.35 115.31 119.73 1qk1 h LEU 258 Ca 0.13 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1qk1 h LEU 258 Cb 0.13 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1qk1 h LEU 258 CO -0.17 0.54 -0.67 0.16 0.09 0.00 0.00 178.44 178.39 1qk1 h ILE 259 N 0.55 0.89 0.00 1.22 3.07 -1.11 -3.17 117.51 118.97 1qk1 h ILE 259 Ca 0.13 -2.29 -0.06 0.00 1.55 0.00 0.00 64.86 64.19 1qk1 h ILE 259 Cb 0.24 2.41 -0.01 0.00 -0.27 0.00 0.00 36.82 39.19 1qk1 h ILE 259 CO -0.00 0.51 -0.27 1.56 -1.05 0.00 0.00 178.15 178.90 1qk1 h GLN 260 N 0.00 0.00 0.00 0.16 4.20 -1.00 -1.17 115.11 117.30 1qk1 h GLN 260 Ca -0.03 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 1qk1 h GLN 260 Cb 1.44 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.22 1qk1 h GLN 260 CO 0.07 0.27 -0.25 1.49 -0.67 0.00 0.00 178.83 179.74 1qk1 h GLU 261 N 0.00 0.00 -0.74 1.46 4.81 -1.40 -1.93 114.58 116.78 1qk1 h GLU 261 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1qk1 h GLU 261 Cb 0.78 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.16 1qk1 h GLU 261 CO 0.04 0.25 0.00 0.54 -0.73 0.00 0.00 179.01 179.10 1qk1 n ARG 262 N -4.14 2.77 -0.32 1.92 5.12 -0.92 -4.96 116.66 116.14 1qk1 n ARG 262 Ca -0.02 -2.69 0.00 0.00 -1.93 0.00 0.00 57.85 53.21 1qk1 n ARG 262 Cb 0.31 -1.59 0.00 0.00 -1.16 0.00 0.00 32.46 30.02 1qk1 n ARG 262 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1qk1 n GLY 263 N 1.65 0.76 3.87 -0.13 0.00 -0.73 -5.09 105.19 105.53 1qk1 n GLY 263 Ca 0.25 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.04 1qk1 n GLY 263 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1qk1 s TRP 264 N -2.29 3.24 0.19 1.61 0.52 -0.49 -4.97 118.94 116.76 1qk1 s TRP 264 Ca 0.00 -0.05 0.02 0.00 0.02 0.00 0.00 56.10 56.09 1qk1 s TRP 264 Cb 0.00 -1.49 -0.05 0.00 -1.15 0.00 0.00 33.47 30.78 1qk1 s TRP 264 CO 0.00 0.50 0.02 -1.21 0.02 0.00 0.00 176.95 176.28 1qk1 s GLU 265 N -3.70 1.19 0.30 4.98 2.02 -1.26 -3.23 118.70 118.99 1qk1 s GLU 265 Ca 0.33 -1.59 -0.12 0.00 0.02 0.00 0.00 54.97 53.61 1qk1 s GLU 265 Cb -0.09 -0.30 -0.08 0.00 0.10 0.00 0.00 34.13 33.76 1qk1 s GLU 265 CO 0.26 -0.16 0.67 -0.06 0.02 0.00 0.00 175.26 175.99 1qk1 s PHE 266 N -3.65 3.40 -0.12 1.61 0.08 -1.26 -0.81 117.98 117.24 1qk1 s PHE 266 Ca 0.27 1.07 -0.30 0.00 0.12 0.00 0.00 56.93 58.09 1qk1 s PHE 266 Cb 0.06 -2.42 -0.02 0.00 -0.57 0.00 0.00 43.02 40.07 1qk1 s PHE 266 CO 0.06 0.14 1.20 -1.64 -0.10 0.00 0.00 175.22 174.88 1qk1 s MET 267 N -3.02 4.30 -0.10 0.44 -1.94 0.41 -4.60 119.30 114.79 1qk1 s MET 267 Ca 0.51 1.62 -0.29 0.00 -1.71 0.00 0.00 55.69 55.82 1qk1 s MET 267 Cb -0.11 -3.65 0.07 0.00 2.01 0.00 0.00 34.83 33.16 1qk1 s MET 267 CO 0.20 -0.56 0.67 -0.46 -0.01 0.00 0.00 175.02 174.87 1qk1 s TRP 268 N 2.79 -0.67 0.11 -0.03 -0.00 -1.26 -2.22 118.94 117.66 1qk1 s TRP 268 Ca 0.54 1.27 -0.15 0.00 -0.00 0.00 0.00 56.10 57.76 1qk1 s TRP 268 Cb -0.22 0.37 0.03 0.00 -0.00 0.00 0.00 33.47 33.64 1qk1 s TRP 268 CO 0.17 -0.55 0.36 0.54 -0.00 0.00 0.00 176.95 177.47 1qk1 s ASN 269 N -0.85 -0.16 0.47 5.86 2.20 -0.87 -5.00 114.94 116.59 1qk1 s ASN 269 Ca -0.09 -0.36 0.31 0.00 -0.94 0.00 0.00 52.86 51.78 1qk1 s ASN 269 Cb -0.01 0.44 1.33 0.00 -2.00 0.00 0.00 41.25 41.01 1qk1 s ASN 269 CO 0.08 -0.81 1.93 1.05 -2.94 0.00 0.00 177.10 176.41 1qk1 h GLU 270 N 2.51 0.00 0.00 3.55 4.11 -1.89 0.74 114.58 123.60 1qk1 h GLU 270 Ca -0.34 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 58.95 1qk1 h GLU 270 Cb 1.24 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 1qk1 h GLU 270 CO 0.49 0.00 -1.61 2.89 0.07 0.00 0.00 179.01 180.84 1qk1 n ARG 271 N -2.83 0.64 0.00 1.06 1.85 -1.26 -0.74 116.66 115.38 1qk1 n ARG 271 Ca 0.01 0.09 0.01 0.00 -1.00 0.00 0.00 57.85 56.96 1qk1 n ARG 271 Cb 0.26 -1.71 0.01 0.00 -1.05 0.00 0.00 32.46 29.97 1qk1 n ARG 271 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1qk1 n LEU 272 N -2.71 0.97 0.00 2.89 4.77 -1.20 -4.31 117.00 117.42 1qk1 n LEU 272 Ca -0.11 -0.88 0.00 0.00 -0.03 0.00 0.00 56.01 55.00 1qk1 n LEU 272 Cb 0.79 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.88 1qk1 n LEU 272 CO 0.43 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 1qk1 n GLY 273 N 0.39 1.71 3.74 -0.72 0.00 0.25 -0.28 105.19 110.27 1qk1 n GLY 273 Ca 0.01 -0.62 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 1qk1 n GLY 273 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qk1 s TYR 274 N 0.00 3.57 -0.19 1.61 2.02 -0.41 -2.05 117.35 121.89 1qk1 s TYR 274 Ca 0.00 1.57 -0.15 0.00 -0.37 0.00 0.00 57.07 58.13 1qk1 s TYR 274 Cb 0.00 -3.30 -0.04 0.00 -0.40 0.00 0.00 41.96 38.22 1qk1 s TYR 274 CO 0.00 -0.69 0.35 0.42 -1.57 0.00 0.00 175.55 174.06 1qk1 s ILE 275 N -0.22 5.24 0.33 2.71 1.01 -0.94 -3.24 121.20 126.08 1qk1 s ILE 275 Ca 0.50 0.62 0.03 0.00 0.00 0.00 0.00 60.65 61.80 1qk1 s ILE 275 Cb -0.30 -3.69 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 1qk1 s ILE 275 CO 0.35 0.29 0.09 -0.76 0.00 0.00 0.00 174.94 174.92 1qk1 s LEU 276 N 1.07 1.96 0.30 2.97 1.43 -1.26 -4.12 118.68 121.03 1qk1 s LEU 276 Ca 0.17 -1.46 0.11 0.00 -1.03 0.00 0.00 54.13 51.92 1qk1 s LEU 276 Cb -0.14 -0.18 0.44 0.00 0.03 0.00 0.00 46.19 46.34 1qk1 s LEU 276 CO 0.07 -0.73 1.66 0.00 0.23 0.00 0.00 176.35 177.58 1qk1 h THR 277 N 2.11 1.40 -3.41 5.49 1.03 -1.88 -3.42 112.91 114.23 1qk1 h THR 277 Ca -0.38 -1.90 -0.63 0.00 -0.01 0.00 0.00 66.41 63.49 1qk1 h THR 277 Cb 1.25 2.02 -0.18 0.00 -1.07 0.00 0.00 68.15 70.18 1qk1 h THR 277 CO 0.63 0.54 -0.58 0.00 -0.01 0.00 0.00 175.52 176.11 1qk1 h PRO 279 N 7.14 0.00 0.00 0.00 0.11 -1.82 0.12 132.00 137.55 1qk1 h PRO 279 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1qk1 h PRO 279 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1qk1 h PRO 279 CO 0.66 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.11 1qk1 h SER 280 N 0.00 0.00 -0.61 -2.05 4.64 -1.94 -3.12 113.55 110.47 1qk1 h SER 280 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1qk1 h SER 280 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1qk1 h SER 280 CO -0.00 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.55 1qk1 n ASN 281 N -2.83 4.76 -4.26 4.97 3.02 0.03 -4.92 115.26 116.03 1qk1 n ASN 281 Ca 0.02 -2.51 -0.29 0.00 -0.03 0.00 0.00 54.58 51.76 1qk1 n ASN 281 Cb 0.33 -0.57 0.23 0.00 -0.61 0.00 0.00 39.78 39.16 1qk1 n ASN 281 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1qk1 s LEU 282 N -1.97 0.74 0.00 3.41 1.02 -1.18 -2.60 118.68 118.10 1qk1 s LEU 282 Ca 0.50 1.09 0.00 0.00 0.02 0.00 0.00 54.13 55.74 1qk1 s LEU 282 Cb 0.33 -2.97 0.00 0.00 0.02 0.00 0.00 46.19 43.57 1qk1 s LEU 282 CO 0.23 -4.01 0.00 0.61 0.02 0.00 0.00 176.35 173.19 1qk1 n GLY 283 N -0.18 2.11 0.01 -3.19 0.00 0.61 -2.86 105.19 101.70 1qk1 n GLY 283 Ca 0.07 -0.04 0.05 0.00 0.00 0.00 0.00 46.02 46.11 1qk1 n GLY 283 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qk1 n THR 284 N 0.00 0.08 -1.88 2.61 -2.24 -0.90 -1.29 114.28 110.66 1qk1 n THR 284 Ca 0.00 -0.31 -0.15 0.00 -2.27 0.00 0.00 64.05 61.32 1qk1 n THR 284 Cb 0.00 0.12 -0.04 0.00 -2.10 0.00 0.00 70.33 68.31 1qk1 n THR 284 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qk1 n GLY 285 N 1.83 0.57 3.78 3.38 0.00 -1.07 -4.62 105.19 109.06 1qk1 n GLY 285 Ca -0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 1qk1 n GLY 285 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qk1 s LEU 286 N -4.79 4.36 -0.32 0.99 0.20 -1.26 -4.05 118.68 113.81 1qk1 s LEU 286 Ca 0.00 0.83 0.01 0.00 0.69 0.00 0.00 54.13 55.66 1qk1 s LEU 286 Cb 0.00 -2.58 0.10 0.00 -0.43 0.00 0.00 46.19 43.27 1qk1 s LEU 286 CO 0.00 0.17 0.07 -0.13 -0.29 0.00 0.00 176.35 176.17 1qk1 s ARG 287 N -0.21 1.06 -0.21 1.98 1.81 -0.30 -4.85 118.95 118.23 1qk1 s ARG 287 Ca 0.23 -1.38 -0.08 0.00 -1.72 0.00 0.00 55.73 52.78 1qk1 s ARG 287 Cb -0.15 -2.50 -0.04 0.00 -0.45 0.00 0.00 34.95 31.81 1qk1 s ARG 287 CO 0.11 -0.95 0.10 0.00 -0.68 0.00 0.00 175.30 173.88 1qk1 s ALA 288 N 1.33 3.42 0.33 2.13 0.00 -1.26 -1.39 121.76 126.32 1qk1 s ALA 288 Ca 0.09 -0.87 -0.14 0.00 0.00 0.00 0.00 51.96 51.04 1qk1 s ALA 288 Cb -0.18 -2.09 0.03 0.00 0.00 0.00 0.00 23.12 20.88 1qk1 s ALA 288 CO -0.17 -0.08 0.66 0.20 0.00 0.00 0.00 175.76 176.37 1qk1 s GLY 289 N 0.85 0.53 0.10 0.00 0.00 -0.13 -2.48 107.32 106.19 1qk1 s GLY 289 Ca 0.05 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 43.94 1qk1 s GLY 289 CO 0.03 -0.45 -0.02 -1.34 0.00 0.00 0.00 173.10 171.31 1qk1 s VAL 290 N -3.05 0.45 -0.31 1.40 -7.23 -0.35 -1.24 120.40 110.07 1qk1 s VAL 290 Ca 0.19 -1.90 -0.09 0.00 -1.81 0.00 0.00 61.98 58.37 1qk1 s VAL 290 Cb -0.04 -1.76 -0.00 0.00 0.56 0.00 0.00 36.38 35.14 1qk1 s VAL 290 CO 0.12 -0.78 0.13 -1.00 -0.31 0.00 0.00 175.10 173.26 1qk1 s HIS 291 N -3.79 3.17 0.08 2.82 3.76 -0.61 -1.64 115.29 119.08 1qk1 s HIS 291 Ca 0.14 -0.69 0.06 0.00 -0.15 0.00 0.00 55.06 54.42 1qk1 s HIS 291 Cb 0.07 -2.32 -0.03 0.00 1.11 0.00 0.00 32.58 31.40 1qk1 s HIS 291 CO -0.04 -0.49 -0.16 -1.50 -0.85 0.00 0.00 174.74 171.70 1qk1 s ILE 292 N 1.58 1.31 -0.44 0.60 2.07 0.01 0.09 121.20 126.42 1qk1 s ILE 292 Ca 0.04 -1.40 -0.18 0.00 -1.41 0.00 0.00 60.65 57.69 1qk1 s ILE 292 Cb -0.17 -1.25 0.03 0.00 0.13 0.00 0.00 42.46 41.20 1qk1 s ILE 292 CO 0.05 -0.18 0.52 -0.54 -1.91 0.00 0.00 174.94 172.87 1qk1 s LYS 293 N -1.84 3.15 -0.49 3.50 1.02 0.50 -0.87 119.74 124.71 1qk1 s LYS 293 Ca 0.01 -0.68 0.07 0.00 0.02 0.00 0.00 55.97 55.39 1qk1 s LYS 293 Cb -0.10 -3.98 0.24 0.00 -0.52 0.00 0.00 37.83 33.47 1qk1 s LYS 293 CO 0.03 -0.94 0.59 1.28 -0.92 0.00 0.00 175.35 175.38 1qk1 n LEU 294 N 5.84 1.46 0.11 3.17 4.77 0.32 -4.90 117.00 127.77 1qk1 n LEU 294 Ca -0.06 -4.95 -0.13 0.00 -0.03 0.00 0.00 56.01 50.85 1qk1 n LEU 294 Cb 0.47 0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.64 1qk1 n LEU 294 CO 0.49 2.04 0.78 -0.65 -1.33 0.00 0.00 177.39 178.73 1qk1 h PRO 295 N 4.21 -0.27 0.12 3.23 0.11 -1.94 -2.59 132.00 134.88 1qk1 h PRO 295 Ca 0.13 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 1qk1 h PRO 295 Cb 0.80 0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1qk1 h PRO 295 CO 0.59 -0.18 -0.06 -0.07 -0.21 0.00 0.00 178.00 178.08 1qk1 h LEU 296 N -0.28 -0.14 -1.60 2.35 3.38 -1.95 -3.29 115.31 113.78 1qk1 h LEU 296 Ca 0.00 -0.31 0.28 0.00 0.09 0.00 0.00 57.88 57.94 1qk1 h LEU 296 Cb 0.26 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 1qk1 h LEU 296 CO -0.03 0.46 0.70 0.25 0.09 0.00 0.00 178.44 179.92 1qk1 h LEU 297 N -0.97 0.29 -1.09 1.67 5.85 -1.90 0.12 115.31 119.28 1qk1 h LEU 297 Ca -0.02 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.66 1qk1 h LEU 297 Cb 0.44 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1qk1 h LEU 297 CO 0.03 0.06 -0.43 0.77 -0.34 0.00 0.00 178.44 178.53 1qk1 h SER 298 N 0.26 0.00 0.98 1.25 4.64 -1.56 -2.89 113.55 116.23 1qk1 h SER 298 Ca 0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 1qk1 h SER 298 Cb 1.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 1qk1 h SER 298 CO -0.18 0.43 -0.39 0.29 -0.87 0.00 0.00 176.83 176.11 1qk1 n LYS 299 N -3.89 0.21 -2.54 4.77 5.02 0.40 -4.88 118.16 117.27 1qk1 n LYS 299 Ca -0.01 0.10 -0.37 0.00 -2.02 0.00 0.00 58.31 56.00 1qk1 n LYS 299 Cb 0.48 -1.67 -0.04 0.00 -0.02 0.00 0.00 35.03 33.78 1qk1 n LYS 299 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1qk1 s ASP 300 N -4.00 6.89 0.19 4.39 -1.08 -1.07 -4.95 116.67 117.04 1qk1 s ASP 300 Ca 0.09 2.08 0.24 0.00 -0.52 0.00 0.00 52.55 54.44 1qk1 s ASP 300 Cb 0.14 -2.59 0.91 0.00 -1.46 0.00 0.00 42.92 39.91 1qk1 s ASP 300 CO 0.67 -0.40 1.73 -1.54 0.52 0.00 0.00 175.17 176.15 1qk1 n SER 301 N 0.24 0.60 -0.63 -0.34 3.41 -1.26 -2.98 113.62 112.66 1qk1 n SER 301 Ca 0.03 0.60 0.11 0.00 -0.26 0.00 0.00 58.87 59.36 1qk1 n SER 301 Cb 0.48 -0.75 0.37 0.00 -0.26 0.00 0.00 64.21 64.05 1qk1 n SER 301 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1qk1 n ARG 302 N -2.11 1.83 0.26 4.33 1.74 -1.26 -4.40 116.66 117.05 1qk1 n ARG 302 Ca 0.04 -1.24 -0.15 0.00 -0.77 0.00 0.00 57.85 55.73 1qk1 n ARG 302 Cb 0.31 -1.42 -0.08 0.00 -1.02 0.00 0.00 32.46 30.25 1qk1 n ARG 302 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1qk1 h PHE 303 N 2.56 -0.61 -0.85 -1.55 3.57 -1.76 0.99 116.94 119.30 1qk1 h PHE 303 Ca 0.00 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 61.66 1qk1 h PHE 303 Cb 0.56 0.20 -0.06 0.00 2.79 0.00 0.00 35.95 39.44 1qk1 h PHE 303 CO 0.10 -0.31 0.56 -1.00 -2.23 0.00 0.00 178.31 175.44 1qk1 h PRO 304 N -0.81 0.44 0.14 6.41 0.13 -1.84 0.41 132.00 136.88 1qk1 h PRO 304 Ca -0.07 -0.03 -0.29 0.00 -0.87 0.00 0.00 66.00 64.74 1qk1 h PRO 304 Cb 0.57 -0.10 0.02 0.00 0.13 0.00 0.00 31.00 31.62 1qk1 h PRO 304 CO 0.11 0.29 -1.27 -0.22 -0.23 0.00 0.00 178.00 176.68 1qk1 h LYS 305 N 0.45 0.48 -0.30 0.86 1.63 -1.81 -1.41 116.57 116.47 1qk1 h LYS 305 Ca 0.43 -0.71 -0.01 0.00 -0.85 0.00 0.00 60.65 59.52 1qk1 h LYS 305 Cb 0.99 0.25 -0.01 0.00 -0.60 0.00 0.00 32.23 32.86 1qk1 h LYS 305 CO -0.16 1.32 0.16 0.82 -3.45 0.00 0.00 179.45 178.13 1qk1 h ILE 306 N 0.18 1.14 -0.08 2.00 2.04 0.69 0.10 117.51 123.58 1qk1 h ILE 306 Ca -0.18 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.29 1qk1 h ILE 306 Cb 1.95 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.88 1qk1 h ILE 306 CO 0.23 0.14 0.04 -0.07 0.00 0.00 0.00 178.15 178.50 1qk1 h LEU 307 N 0.36 0.07 -0.36 1.44 4.07 -1.05 -2.08 115.31 117.75 1qk1 h LEU 307 Ca 0.11 0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.12 1qk1 h LEU 307 Cb 0.09 -0.01 -0.05 0.00 1.08 0.00 0.00 40.66 41.77 1qk1 h LEU 307 CO -0.02 0.05 0.09 -0.08 -1.08 0.00 0.00 178.44 177.41 1qk1 h GLU 308 N 0.09 0.21 0.00 1.13 4.81 -0.95 -1.27 114.58 118.60 1qk1 h GLU 308 Ca 0.03 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 1qk1 h GLU 308 Cb -0.00 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1qk1 h GLU 308 CO -0.02 0.14 -0.26 -0.91 -0.73 0.00 0.00 179.01 177.23 1qk1 h ASN 309 N 0.22 0.00 0.13 1.04 4.21 -0.78 -1.89 115.58 118.51 1qk1 h ASN 309 Ca 0.17 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.68 1qk1 h ASN 309 Cb 0.18 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.38 1qk1 h ASN 309 CO -0.21 0.26 -0.09 0.18 -1.29 0.00 0.00 177.43 176.28 1qk1 n LEU 310 N -3.92 1.03 -3.30 1.61 4.77 -0.80 -1.89 117.00 114.51 1qk1 n LEU 310 Ca -0.02 -0.29 -0.18 0.00 -0.03 0.00 0.00 56.01 55.49 1qk1 n LEU 310 Cb 0.34 -0.07 0.08 0.00 -2.33 0.00 0.00 43.42 41.44 1qk1 n LEU 310 CO 0.35 0.18 0.15 0.54 -1.33 0.00 0.00 177.39 177.28 1qk1 n ARG 311 N -0.38 -6.61 -4.40 3.23 1.74 -0.57 -4.89 116.66 104.77 1qk1 n ARG 311 Ca 0.17 0.78 -0.24 0.00 -0.77 0.00 0.00 57.85 57.78 1qk1 n ARG 311 Cb 0.32 -5.63 -0.11 0.00 -1.02 0.00 0.00 32.46 26.01 1qk1 n ARG 311 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1qk1 s LEU 312 N -6.34 2.46 0.10 0.55 1.43 -0.66 -2.04 118.68 114.19 1qk1 s LEU 312 Ca 0.20 -0.89 0.06 0.00 -1.03 0.00 0.00 54.13 52.46 1qk1 s LEU 312 Cb -0.09 -1.03 -0.03 0.00 0.03 0.00 0.00 46.19 45.07 1qk1 s LEU 312 CO 0.68 0.05 -0.14 0.00 0.23 0.00 0.00 176.35 177.17 1qk1 s GLN 313 N -2.87 0.95 0.21 1.70 -2.07 -0.24 -4.33 119.66 113.02 1qk1 s GLN 313 Ca 0.21 -1.15 0.10 0.00 -1.82 0.00 0.00 55.36 52.70 1qk1 s GLN 313 Cb -0.07 -0.86 -0.04 0.00 -1.09 0.00 0.00 33.01 30.95 1qk1 s GLN 313 CO 0.09 0.17 -0.21 -1.59 -1.32 0.00 0.00 175.29 172.44 1qk1 s LYS 314 N -2.39 1.47 0.23 9.60 -2.85 -1.26 -2.00 119.74 122.53 1qk1 s LYS 314 Ca 0.05 -1.55 -0.17 0.00 -1.00 0.00 0.00 55.97 53.31 1qk1 s LYS 314 Cb -0.06 -1.64 0.02 0.00 -2.06 0.00 0.00 37.83 34.09 1qk1 s LYS 314 CO 0.03 0.33 0.54 -0.98 0.10 0.00 0.00 175.35 175.37 1qk1 s ARG 315 N -2.95 1.50 0.83 1.78 1.70 -0.73 -4.98 118.95 116.09 1qk1 s ARG 315 Ca 0.21 -1.01 -0.11 0.00 -0.47 0.00 0.00 55.73 54.35 1qk1 s ARG 315 Cb -0.06 0.52 0.09 0.00 -0.57 0.00 0.00 34.95 34.93 1qk1 s ARG 315 CO 0.10 -0.64 1.14 0.20 -1.08 0.00 0.00 175.30 175.02 1qk1 s GLY 316 N -2.93 1.84 0.05 3.88 0.00 -1.26 -1.85 107.32 107.05 1qk1 s GLY 316 Ca 0.14 0.57 0.21 0.00 0.00 0.00 0.00 44.72 45.63 1qk1 s GLY 316 CO 0.03 0.96 1.65 2.41 0.00 0.00 0.00 173.10 178.14 1qk1 n THR 317 N -3.65 0.67 0.00 0.90 -1.04 -1.26 -4.56 114.28 105.34 1qk1 n THR 317 Ca 0.11 0.14 0.00 0.00 -2.04 0.00 0.00 64.05 62.26 1qk1 n THR 317 Cb 0.52 -0.85 0.00 0.00 -1.82 0.00 0.00 70.33 68.18 1qk1 n THR 317 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1qk1 n GLY 318 N 0.52 1.09 3.07 3.41 0.00 -1.26 -5.05 105.19 106.96 1qk1 n GLY 318 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 1qk1 n GLY 318 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qk1 s GLY 319 N -2.00 1.84 0.00 -0.02 0.00 -1.26 -5.02 107.32 100.86 1qk1 s GLY 319 Ca 0.00 -2.22 0.00 0.00 0.00 0.00 0.00 44.72 42.50 1qk1 s GLY 319 CO 0.00 0.82 0.00 -0.62 0.00 0.00 0.00 173.10 173.30 1qk1 n VAL 320 N 4.39 0.00 0.00 1.40 0.31 -1.26 -4.17 118.33 119.00 1qk1 n VAL 320 Ca -0.04 0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1qk1 n VAL 320 Cb 0.42 -0.28 0.00 0.00 -0.91 0.00 0.00 33.84 33.08 1qk1 n VAL 320 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1qk1 n ASP 321 N -0.78 0.00 -0.08 4.52 8.00 -1.26 -1.43 116.55 125.52 1qk1 n ASP 321 Ca 0.00 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.37 1qk1 n ASP 321 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.04 1qk1 n ASP 321 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1qk1 n THR 322 N 0.00 0.87 -1.34 -3.53 -1.04 -1.26 -4.81 114.28 103.17 1qk1 n THR 322 Ca 0.00 -0.29 0.08 0.00 -2.04 0.00 0.00 64.05 61.80 1qk1 n THR 322 Cb 0.00 -1.31 0.12 0.00 -1.82 0.00 0.00 70.33 67.32 1qk1 n THR 322 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1qk1 n ALA 323 N -3.26 2.39 -0.69 2.41 0.00 -1.26 -5.13 120.51 114.98 1qk1 n ALA 323 Ca -0.29 -2.43 0.00 0.00 0.00 0.00 0.00 53.44 50.73 1qk1 n ALA 323 Cb 0.76 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.80 1qk1 n ALA 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qk1 n ALA 324 N -1.09 0.00 -3.30 0.00 0.00 -0.52 -4.85 120.51 110.74 1qk1 n ALA 324 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.45 1qk1 n ALA 324 Cb 0.67 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.01 1qk1 n ALA 324 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1qk1 s THR 325 N 0.00 -0.01 -0.15 0.00 2.01 -1.26 -4.88 115.64 111.35 1qk1 s THR 325 Ca 0.00 0.02 -0.07 0.00 0.31 0.00 0.00 61.69 61.95 1qk1 s THR 325 Cb 0.00 -0.47 -0.04 0.00 0.01 0.00 0.00 72.50 72.00 1qk1 s THR 325 CO 0.00 0.01 0.09 -0.83 -0.69 0.00 0.00 174.62 173.20 1qk1 s GLY 326 N 0.37 2.01 0.00 4.40 0.00 -1.26 -4.57 107.32 108.28 1qk1 s GLY 326 Ca -0.02 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.00 1qk1 s GLY 326 CO -0.01 -0.18 0.00 0.61 0.00 0.00 0.00 173.10 173.52 1qk1 n GLY 327 N 2.77 2.73 3.56 0.20 0.00 -1.26 -4.97 105.19 108.22 1qk1 n GLY 327 Ca -0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 1qk1 n GLY 327 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qk1 s VAL 328 N -2.14 4.92 0.27 1.61 1.01 -1.26 0.12 120.40 124.93 1qk1 s VAL 328 Ca 0.00 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.06 1qk1 s VAL 328 Cb 0.00 -3.30 -0.06 0.00 0.00 0.00 0.00 36.38 33.02 1qk1 s VAL 328 CO 0.00 0.32 -0.03 -0.36 0.00 0.00 0.00 175.10 175.04 1qk1 s PHE 329 N 1.40 1.83 -0.38 5.22 0.40 -0.04 -4.36 117.98 122.04 1qk1 s PHE 329 Ca 0.06 -0.80 -0.07 0.00 -0.60 0.00 0.00 56.93 55.52 1qk1 s PHE 329 Cb -0.15 -1.07 0.07 0.00 0.51 0.00 0.00 43.02 42.38 1qk1 s PHE 329 CO 0.06 0.15 0.19 0.34 0.70 0.00 0.00 175.22 176.65 1qk1 s ASP 330 N -3.40 5.45 -0.15 1.36 -1.08 -0.77 -0.81 116.67 117.26 1qk1 s ASP 330 Ca 0.30 -1.43 -0.04 0.00 -0.52 0.00 0.00 52.55 50.86 1qk1 s ASP 330 Cb 0.05 -1.92 -0.03 0.00 -1.46 0.00 0.00 42.92 39.57 1qk1 s ASP 330 CO 0.11 -0.45 -0.03 -0.63 0.52 0.00 0.00 175.17 174.69 1qk1 s ILE 331 N 1.37 4.01 0.23 4.11 -1.09 -0.65 -1.78 121.20 127.41 1qk1 s ILE 331 Ca 0.02 -0.32 -0.12 0.00 -2.23 0.00 0.00 60.65 58.00 1qk1 s ILE 331 Cb -0.22 -2.75 -0.01 0.00 -1.58 0.00 0.00 42.46 37.91 1qk1 s ILE 331 CO 0.01 0.50 0.44 -0.94 -1.23 0.00 0.00 174.94 173.73 1qk1 s SER 332 N 0.21 -0.07 0.49 3.58 1.04 -0.85 -1.22 113.70 116.89 1qk1 s SER 332 Ca -0.01 -0.93 -0.22 0.00 0.48 0.00 0.00 55.95 55.26 1qk1 s SER 332 Cb -0.14 0.56 -0.06 0.00 0.10 0.00 0.00 66.02 66.48 1qk1 s SER 332 CO 0.03 -1.10 1.24 0.54 0.98 0.00 0.00 173.24 174.93 1qk1 s ASN 333 N -3.02 5.82 -0.13 7.02 4.22 -1.03 -1.07 114.94 126.74 1qk1 s ASN 333 Ca 0.22 2.49 -0.16 0.00 -2.14 0.00 0.00 52.86 53.28 1qk1 s ASN 333 Cb 0.00 -2.62 -0.25 0.00 1.28 0.00 0.00 41.25 39.67 1qk1 s ASN 333 CO 0.08 -1.17 0.44 0.25 -2.04 0.00 0.00 177.10 174.66 1qk1 h LEU 334 N 1.82 0.29-10.20 3.54 7.12 -1.73 -3.44 115.31 112.71 1qk1 h LEU 334 Ca -0.50 -0.80 -0.49 0.00 0.13 0.00 0.00 57.88 56.22 1qk1 h LEU 334 Cb 1.27 -0.09 0.05 0.00 -0.53 0.00 0.00 40.66 41.35 1qk1 h LEU 334 CO 0.59 1.63 0.38 -1.81 -0.13 0.00 0.00 178.44 179.09 1qk1 s ASP 335 N -6.97 6.01 0.00 1.25 1.01 -1.26 -4.99 116.67 111.71 1qk1 s ASP 335 Ca -0.22 1.74 0.00 0.00 0.71 0.00 0.00 52.55 54.78 1qk1 s ASP 335 Cb 0.05 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.46 1qk1 s ASP 335 CO 0.72 -1.01 0.00 -1.14 0.21 0.00 0.00 175.17 173.95 1qk1 n ARG 336 N -1.95 0.00 -5.22 8.23 0.63 -1.26 -4.90 116.66 112.18 1qk1 n ARG 336 Ca 0.08 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.70 1qk1 n ARG 336 Cb 0.53 -0.49 -0.16 0.00 0.45 0.00 0.00 32.46 32.80 1qk1 n ARG 336 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1qk1 s LEU 337 N -2.20 2.17 0.00 6.15 0.20 -1.26 -2.12 118.68 121.63 1qk1 s LEU 337 Ca 0.00 -0.43 0.00 0.00 0.69 0.00 0.00 54.13 54.39 1qk1 s LEU 337 Cb 0.00 -1.39 0.00 0.00 -0.43 0.00 0.00 46.19 44.37 1qk1 s LEU 337 CO 0.00 0.30 0.00 0.61 -0.29 0.00 0.00 176.35 176.97 1qk1 n GLY 338 N 2.56 0.58 2.90 7.98 0.00 -1.26 -4.97 105.19 112.97 1qk1 n GLY 338 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 1qk1 n GLY 338 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qk1 s LYS 339 N -0.84 0.06 0.86 1.61 1.02 -1.26 -4.90 119.74 116.30 1qk1 s LYS 339 Ca 0.00 -0.06 -0.12 0.00 0.02 0.00 0.00 55.97 55.81 1qk1 s LYS 339 Cb 0.00 0.03 0.11 0.00 -0.52 0.00 0.00 37.83 37.44 1qk1 s LYS 339 CO 0.00 -0.01 1.10 -1.54 -0.92 0.00 0.00 175.35 173.98 1qk1 s SER 340 N -0.19 3.85 0.37 2.83 1.04 -1.25 -4.79 113.70 115.56 1qk1 s SER 340 Ca -0.02 1.38 0.11 0.00 0.48 0.00 0.00 55.95 57.90 1qk1 s SER 340 Cb -0.01 -2.07 0.74 0.00 0.10 0.00 0.00 66.02 64.77 1qk1 s SER 340 CO -0.00 -2.38 1.85 1.05 0.98 0.00 0.00 173.24 174.73 1qk1 h GLU 341 N -1.37 0.08 -0.43 4.02 9.09 -1.82 -1.26 114.58 122.87 1qk1 h GLU 341 Ca -0.49 -0.03 -0.08 0.00 0.05 0.00 0.00 59.36 58.82 1qk1 h GLU 341 Cb 1.28 -0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 28.36 1qk1 h GLU 341 CO 0.57 0.38 -0.05 0.28 0.05 0.00 0.00 179.01 180.24 1qk1 h VAL 342 N 0.07 1.27 -0.53 -1.06 2.07 -1.90 -1.34 116.25 114.82 1qk1 h VAL 342 Ca 0.01 -1.12 -0.06 0.00 0.82 0.00 0.00 66.70 66.34 1qk1 h VAL 342 Cb 0.58 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1qk1 h VAL 342 CO 0.04 0.38 0.08 -0.33 0.02 0.00 0.00 177.57 177.76 1qk1 h GLU 343 N 0.63 0.85 -0.30 1.57 5.08 -1.80 -1.72 114.58 118.90 1qk1 h GLU 343 Ca 0.12 -0.20 -0.14 0.00 -1.00 0.00 0.00 59.36 58.14 1qk1 h GLU 343 Cb 0.56 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1qk1 h GLU 343 CO 0.03 0.80 -0.35 -0.07 -1.00 0.00 0.00 179.01 178.42 1qk1 h LEU 344 N 0.81 0.82 -0.35 1.33 3.38 -0.99 -1.36 115.31 118.94 1qk1 h LEU 344 Ca 0.17 -0.49 -0.07 0.00 0.09 0.00 0.00 57.88 57.58 1qk1 h LEU 344 Cb 0.38 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1qk1 h LEU 344 CO 0.01 1.15 -0.04 0.58 0.09 0.00 0.00 178.44 180.23 1qk1 h VAL 345 N 0.52 1.27 -0.86 1.22 2.07 -1.18 -1.67 116.25 117.62 1qk1 h VAL 345 Ca 0.04 -1.06 0.05 0.00 0.82 0.00 0.00 66.70 66.55 1qk1 h VAL 345 Cb 0.94 1.24 -0.06 0.00 -1.52 0.00 0.00 31.29 31.89 1qk1 h VAL 345 CO 0.08 0.35 0.54 -0.61 0.02 0.00 0.00 177.57 177.95 1qk1 h GLN 346 N 0.45 0.98 -0.38 1.57 5.75 -1.28 0.74 115.11 122.94 1qk1 h GLN 346 Ca 0.10 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 1qk1 h GLN 346 Cb 0.52 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 1qk1 h GLN 346 CO 0.03 0.65 0.06 1.25 -2.65 0.00 0.00 178.83 178.17 1qk1 h LEU 347 N 1.01 0.53 -0.13 -2.39 6.46 -0.94 0.28 115.31 120.14 1qk1 h LEU 347 Ca 0.36 -0.09 -0.19 0.00 -0.12 0.00 0.00 57.88 57.85 1qk1 h LEU 347 Cb 0.11 -0.14 0.01 0.00 -0.73 0.00 0.00 40.66 39.91 1qk1 h LEU 347 CO -0.15 0.56 -0.66 0.58 -0.62 0.00 0.00 178.44 178.15 1qk1 h VAL 348 N 0.56 1.32 -0.22 1.05 2.07 -0.26 -1.08 116.25 119.69 1qk1 h VAL 348 Ca 0.13 -1.92 0.01 0.00 0.82 0.00 0.00 66.70 65.74 1qk1 h VAL 348 Cb 0.26 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 1qk1 h VAL 348 CO 0.00 0.59 0.14 0.40 0.02 0.00 0.00 177.57 178.72 1qk1 h ILE 349 N 0.34 1.04 -0.39 4.57 2.04 -0.48 0.16 117.51 124.79 1qk1 h ILE 349 Ca -0.05 -0.10 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 1qk1 h ILE 349 Cb 1.30 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 1qk1 h ILE 349 CO 0.14 0.05 0.09 0.44 0.00 0.00 0.00 178.15 178.87 1qk1 h ASP 350 N 0.28 0.60 -0.46 1.72 3.32 -0.95 -1.91 116.42 119.02 1qk1 h ASP 350 Ca 0.08 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 56.87 1qk1 h ASP 350 Cb -0.02 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 1qk1 h ASP 350 CO -0.03 0.68 0.15 1.23 -1.72 0.00 0.00 179.24 179.55 1qk1 h GLY 351 N 0.49 0.76 1.22 2.75 0.00 -0.95 -2.06 103.07 105.28 1qk1 h GLY 351 Ca 0.12 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 46.91 1qk1 h GLY 351 CO 0.00 0.41 -0.07 -2.08 0.00 0.00 0.00 176.54 174.80 1qk1 h VAL 352 N 0.60 1.26 -0.75 4.60 2.07 -0.65 -1.07 116.25 122.31 1qk1 h VAL 352 Ca 0.15 -1.18 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 1qk1 h VAL 352 Cb 0.25 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 1qk1 h VAL 352 CO -0.01 0.42 0.42 0.78 0.02 0.00 0.00 177.57 179.20 1qk1 h ASN 353 N 0.83 0.92 -0.05 0.57 2.35 -1.20 -0.64 115.58 118.37 1qk1 h ASN 353 Ca 0.14 -0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.71 1qk1 h ASN 353 Cb 0.60 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 1qk1 h ASN 353 CO 0.04 0.74 -0.33 0.22 -1.65 0.00 0.00 177.43 176.44 1qk1 h TYR 354 N 1.04 0.60 -0.49 1.19 5.03 -0.95 -2.20 116.97 121.20 1qk1 h TYR 354 Ca 0.27 -0.15 -0.08 0.00 2.58 0.00 0.00 58.73 61.35 1qk1 h TYR 354 Cb 0.01 -0.14 -0.02 0.00 1.55 0.00 0.00 36.73 38.14 1qk1 h TYR 354 CO 0.01 0.79 0.01 -0.07 -1.32 0.00 0.00 178.16 177.57 1qk1 h LEU 355 N 0.45 0.84 -1.38 2.82 4.07 -0.20 -1.88 115.31 120.02 1qk1 h LEU 355 Ca 0.05 -0.30 -0.04 0.00 0.08 0.00 0.00 57.88 57.67 1qk1 h LEU 355 Cb 0.79 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 42.29 1qk1 h LEU 355 CO 0.06 0.94 0.03 0.40 -1.08 0.00 0.00 178.44 178.80 1qk1 h ILE 356 N 0.72 1.16 -0.44 1.22 2.04 -1.00 -2.52 117.51 118.70 1qk1 h ILE 356 Ca 0.14 -0.62 -0.13 0.00 1.00 0.00 0.00 64.86 65.25 1qk1 h ILE 356 Cb 0.51 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1qk1 h ILE 356 CO 0.02 0.21 -0.25 -0.78 0.00 0.00 0.00 178.15 177.36 1qk1 h ASP 357 N 0.43 0.94 0.54 1.72 1.82 -0.88 -2.11 116.42 118.87 1qk1 h ASP 357 Ca 0.10 -0.36 -0.08 0.00 -0.39 0.00 0.00 57.03 56.30 1qk1 h ASP 357 Cb 0.24 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 39.98 1qk1 h ASP 357 CO 0.00 1.13 -0.37 0.00 -1.61 0.00 0.00 179.24 178.40 1qk1 h GLU 359 N 0.00 -0.56 -0.48 0.00 4.39 -1.15 -1.71 114.58 115.06 1qk1 h GLU 359 Ca -0.00 0.04 0.14 0.00 0.34 0.00 0.00 59.36 59.87 1qk1 h GLU 359 Cb 0.74 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.49 1qk1 h GLU 359 CO 0.05 -0.29 0.55 0.00 -1.16 0.00 0.00 179.01 178.15 1qk1 h ARG 360 N -1.08 0.00 0.02 2.33 3.08 -1.42 0.43 114.38 117.74 1qk1 h ARG 360 Ca -0.06 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1qk1 h ARG 360 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 1qk1 h ARG 360 CO 0.10 0.00 -0.12 0.00 -1.07 0.00 0.00 179.97 178.87 1qk1 h ARG 361 N 0.00 0.05 -0.31 0.04 3.08 -1.46 -3.29 114.38 112.49 1qk1 h ARG 361 Ca 0.23 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 1qk1 h ARG 361 Cb 1.32 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.38 1qk1 h ARG 361 CO -0.00 1.02 0.17 -0.07 -1.07 0.00 0.00 179.97 180.02 1qk1 h LEU 362 N -0.88 0.37 -0.20 3.04 3.38 0.11 0.88 115.31 122.02 1qk1 h LEU 362 Ca -0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1qk1 h LEU 362 Cb 1.07 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1qk1 h LEU 362 CO 0.02 0.30 0.00 -0.62 0.09 0.00 0.00 178.44 178.24 1qk1 n GLU 363 N -4.45 0.02 -0.56 1.13 1.02 0.12 -1.08 120.64 116.85 1qk1 n GLU 363 Ca 0.02 0.50 0.06 0.00 -0.02 0.00 0.00 57.16 57.72 1qk1 n GLU 363 Cb 0.09 -1.57 0.13 0.00 -0.02 0.00 0.00 31.44 30.08 1qk1 n GLU 363 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1qk1 n ARG 364 N -1.61 1.02 0.00 3.49 1.74 0.27 -4.98 116.66 116.58 1qk1 n ARG 364 Ca 0.00 -2.54 0.00 0.00 -0.77 0.00 0.00 57.85 54.54 1qk1 n ARG 364 Cb 0.02 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 1qk1 n ARG 364 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qk1 n GLY 365 N -0.81 0.64 2.80 -0.13 0.00 -0.24 -4.95 105.19 102.50 1qk1 n GLY 365 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 1qk1 n GLY 365 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1qk1 n GLN 366 N -1.94 -3.04 -4.20 1.61 6.02 -1.01 -4.94 117.38 109.87 1qk1 n GLN 366 Ca 0.00 -1.01 -0.27 0.00 -0.01 0.00 0.00 57.00 55.72 1qk1 n GLN 366 Cb 0.00 -1.53 -0.08 0.00 1.02 0.00 0.00 30.24 29.65 1qk1 n GLN 366 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1qk1 s ASP 367 N -2.51 4.82 0.24 1.08 1.01 -1.26 -4.54 116.67 115.51 1qk1 s ASP 367 Ca 0.46 -0.38 0.06 0.00 0.71 0.00 0.00 52.55 53.40 1qk1 s ASP 367 Cb -0.08 -1.04 -0.05 0.00 1.01 0.00 0.00 42.92 42.75 1qk1 s ASP 367 CO 0.39 0.09 -0.06 0.27 0.21 0.00 0.00 175.17 176.06 1qk1 s ILE 368 N -1.73 1.45 0.05 0.77 -4.36 -1.26 -4.93 121.20 111.19 1qk1 s ILE 368 Ca 0.28 -2.11 0.03 0.00 -0.26 0.00 0.00 60.65 58.58 1qk1 s ILE 368 Cb -0.09 -2.28 -0.03 0.00 1.25 0.00 0.00 42.46 41.31 1qk1 s ILE 368 CO 0.19 -0.41 -0.09 0.00 0.24 0.00 0.00 174.94 174.87 1qk1 s ARG 369 N -3.75 0.62 0.09 0.37 1.70 -1.26 -5.11 118.95 111.62 1qk1 s ARG 369 Ca 0.27 -0.86 -0.31 0.00 -0.47 0.00 0.00 55.73 54.35 1qk1 s ARG 369 Cb 0.03 -0.38 -0.10 0.00 -0.57 0.00 0.00 34.95 33.93 1qk1 s ARG 369 CO 0.09 0.07 1.82 0.42 -1.08 0.00 0.00 175.30 176.61 1qk1 s ILE 370 N -1.63 2.73 0.62 4.99 -1.09 -1.26 -4.96 121.20 120.60 1qk1 s ILE 370 Ca -0.06 0.14 -0.16 0.00 -2.23 0.00 0.00 60.65 58.34 1qk1 s ILE 370 Cb -0.08 -3.09 -0.02 0.00 -1.58 0.00 0.00 42.46 37.69 1qk1 s ILE 370 CO 0.00 -0.00 1.09 -2.16 -1.23 0.00 0.00 174.94 172.64 1qk1 s PRO 371 N 3.04 3.06 0.30 2.79 0.04 -1.26 -4.97 135.00 138.00 1qk1 s PRO 371 Ca 0.81 1.32 -0.29 0.00 0.04 0.00 0.00 61.00 62.88 1qk1 s PRO 371 Cb -0.44 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.01 1qk1 s PRO 371 CO 0.36 -1.04 1.31 -0.08 0.04 0.00 0.00 177.00 177.59 1qk1 s THR 372 N -2.36 2.83 0.26 1.26 -1.32 -1.26 -4.91 115.64 110.13 1qk1 s THR 372 Ca 0.66 0.79 -0.31 0.00 -1.21 0.00 0.00 61.69 61.62 1qk1 s THR 372 Cb -0.19 -3.51 -0.12 0.00 -1.51 0.00 0.00 72.50 67.18 1qk1 s THR 372 CO 0.39 0.17 1.66 -2.16 -2.21 0.00 0.00 174.62 172.47 1qk1 s PRO 373 N -1.40 4.12 0.48 7.08 0.04 -1.26 -4.85 135.00 139.20 1qk1 s PRO 373 Ca 0.51 2.60 0.33 0.00 0.04 0.00 0.00 61.00 64.47 1qk1 s PRO 373 Cb -0.39 -3.04 1.56 0.00 0.04 0.00 0.00 34.50 32.67 1qk1 s PRO 373 CO 0.49 -0.69 1.98 0.28 0.04 0.00 0.00 177.00 179.10 1qk1 h VAL 374 N 3.57 0.00 0.00 -0.36 2.07 -1.73 -3.37 116.25 116.43 1qk1 h VAL 374 Ca -0.45 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1qk1 h VAL 374 Cb 1.21 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1qk1 h VAL 374 CO 0.87 0.00 0.49 2.30 0.02 0.00 0.00 177.57 181.25 1qk1 n ILE 375 N -2.75 0.00 -4.31 4.57 -5.35 -1.26 -4.78 119.36 105.47 1qk1 n ILE 375 Ca -0.01 0.00 -0.35 0.00 -0.27 0.00 0.00 62.75 62.13 1qk1 n ILE 375 Cb 0.17 -1.45 -0.10 0.00 -1.74 0.00 0.00 39.64 36.52 1qk1 n ILE 375 CO 0.00 0.00 0.00 -1.38 -1.76 0.00 0.00 176.55 173.41 1qk1 s HIS 376 N 2.93 3.18 -0.07 4.28 -3.43 -1.26 -5.11 115.29 115.81 1qk1 s HIS 376 Ca 0.00 0.15 0.00 0.00 -0.80 0.00 0.00 55.06 54.42 1qk1 s HIS 376 Cb 0.00 -1.84 0.02 0.00 -1.43 0.00 0.00 32.58 29.33 1qk1 s HIS 376 CO 0.00 0.40 -0.06 -0.08 -2.00 0.00 0.00 174.74 173.00 1qk1 s THR 377 N -0.64 0.80 -0.17 -5.38 -1.32 -1.26 -5.05 115.64 102.62 1qk1 s THR 377 Ca 0.11 -0.22 -0.21 0.00 -1.21 0.00 0.00 61.69 60.16 1qk1 s THR 377 Cb -0.12 -0.82 -0.22 0.00 -1.51 0.00 0.00 72.50 69.84 1qk1 s THR 377 CO 0.02 0.31 0.37 0.11 -2.21 0.00 0.00 174.62 173.22 1qk1 h LYS 378 N 7.62 0.06 0.00 7.08 1.57 -2.01 -3.57 116.57 127.32 1qk1 h LYS 378 Ca -0.31 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1qk1 h LYS 378 Cb 1.15 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.50 1qk1 h LYS 378 CO 0.42 1.05 0.00 1.58 -0.57 0.00 0.00 179.45 181.93