#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qk1 n ALA 2 N 0.00 1.03 0.00 0.00 0.00 -1.26 -5.00 120.51 115.27 1qk1 n ALA 2 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.75 1qk1 n ALA 2 Cb 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1qk1 n ALA 2 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1qk1 n SER 3 N -3.40 0.00 0.00 0.00 2.88 -1.26 -4.98 113.62 106.86 1qk1 n SER 3 Ca -0.33 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.26 1qk1 n SER 3 Cb 1.04 0.00 0.30 0.00 -0.75 0.00 0.00 64.21 64.80 1qk1 n SER 3 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1qk1 n GLU 4 N 0.00 0.60 0.03 -1.46 4.71 -1.26 -1.82 120.64 121.43 1qk1 n GLU 4 Ca 0.00 0.00 0.11 0.00 -0.01 0.00 0.00 57.16 57.26 1qk1 n GLU 4 Cb 0.00 -1.26 -0.10 0.00 -1.01 0.00 0.00 31.44 29.07 1qk1 n GLU 4 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1qk1 n ARG 5 N -0.76 0.57 -3.27 3.49 1.74 -1.26 -4.91 116.66 112.25 1qk1 n ARG 5 Ca 0.08 -0.08 -0.38 0.00 -0.77 0.00 0.00 57.85 56.70 1qk1 n ARG 5 Cb 0.03 -1.61 -0.06 0.00 -1.02 0.00 0.00 32.46 29.80 1qk1 n ARG 5 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1qk1 s ARG 6 N -3.41 4.18 0.17 5.56 0.52 -0.76 -5.07 118.95 120.15 1qk1 s ARG 6 Ca -0.04 0.72 -0.23 0.00 -0.52 0.00 0.00 55.73 55.67 1qk1 s ARG 6 Cb 0.13 -3.17 -0.08 0.00 0.52 0.00 0.00 34.95 32.35 1qk1 s ARG 6 CO 0.86 0.60 0.73 1.03 0.02 0.00 0.00 175.30 178.54 1qk1 s ARG 7 N -1.29 4.41 0.51 3.54 1.81 -1.26 -4.95 118.95 121.71 1qk1 s ARG 7 Ca 0.31 1.00 -0.10 0.00 -1.72 0.00 0.00 55.73 55.22 1qk1 s ARG 7 Cb -0.19 -3.13 -0.05 0.00 -0.45 0.00 0.00 34.95 31.13 1qk1 s ARG 7 CO 0.19 0.52 0.90 -0.51 -0.68 0.00 0.00 175.30 175.72 1qk1 s LEU 8 N -1.42 3.55 0.10 2.53 1.43 -1.26 -5.00 118.68 118.61 1qk1 s LEU 8 Ca 0.37 1.25 -0.31 0.00 -1.03 0.00 0.00 54.13 54.42 1qk1 s LEU 8 Cb -0.20 -4.22 -0.07 0.00 0.03 0.00 0.00 46.19 41.73 1qk1 s LEU 8 CO 0.23 -0.63 1.34 -0.31 0.23 0.00 0.00 176.35 177.22 1qk1 s TYR 9 N -2.76 3.27 0.72 0.29 2.02 -1.26 -4.97 117.35 114.66 1qk1 s TYR 9 Ca 0.53 1.03 -0.14 0.00 -0.37 0.00 0.00 57.07 58.12 1qk1 s TYR 9 Cb -0.10 -3.62 0.03 0.00 -0.40 0.00 0.00 41.96 37.87 1qk1 s TYR 9 CO 0.42 -2.12 1.14 -1.25 -1.57 0.00 0.00 175.55 172.17 1qk1 s PRO 10 N 1.16 2.39 0.25 -1.71 0.04 -1.26 -4.88 135.00 130.99 1qk1 s PRO 10 Ca 0.63 1.48 -0.11 0.00 0.04 0.00 0.00 61.00 63.04 1qk1 s PRO 10 Cb -0.35 -1.89 0.35 0.00 0.04 0.00 0.00 34.50 32.65 1qk1 s PRO 10 CO 0.30 -1.59 1.59 -1.35 0.04 0.00 0.00 177.00 175.99 1qk1 h PRO 11 N -0.38 -0.00 -0.19 0.56 0.11 -1.95 0.89 132.00 131.03 1qk1 h PRO 11 Ca -0.46 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.70 1qk1 h PRO 11 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1qk1 h PRO 11 CO 0.51 -0.00 0.21 0.77 -0.21 0.00 0.00 178.00 179.28 1qk1 h SER 12 N -0.00 0.00 0.69 -2.05 0.02 -1.93 -0.58 113.55 109.68 1qk1 h SER 12 Ca 0.40 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.33 1qk1 h SER 12 Cb 0.61 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 1qk1 h SER 12 CO -0.86 0.00 -0.10 0.00 -1.14 0.00 0.00 176.83 174.73 1qk1 h ALA 13 N 1.77 1.09 -0.02 3.77 0.00 -1.15 -2.62 119.26 122.10 1qk1 h ALA 13 Ca 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1qk1 h ALA 13 Cb 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1qk1 h ALA 13 CO -0.00 0.12 -0.37 0.39 0.00 0.00 0.00 179.25 179.39 1qk1 n GLU 14 N -3.34 1.45 -1.71 0.00 -0.58 -0.24 -4.99 120.64 111.24 1qk1 n GLU 14 Ca -0.01 -1.15 -0.43 0.00 -0.42 0.00 0.00 57.16 55.15 1qk1 n GLU 14 Cb 0.29 -1.45 -0.02 0.00 -0.57 0.00 0.00 31.44 29.69 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 0.22 2.54 -2.58 -0.32 9.36 -0.99 -4.95 117.16 120.43 1qk1 n TYR 15 Ca 0.10 0.31 -0.34 0.00 3.32 0.00 0.00 57.90 61.29 1qk1 n TYR 15 Cb 0.48 -2.54 -0.04 0.00 -0.63 0.00 0.00 39.34 36.60 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 -0.29 3.87 -0.67 2.98 0.04 -1.26 -4.98 135.00 134.69 1qk1 s PRO 16 Ca 0.67 1.31 -0.24 0.00 0.04 0.00 0.00 61.00 62.78 1qk1 s PRO 16 Cb -0.57 -2.11 0.05 0.00 0.04 0.00 0.00 34.50 31.92 1qk1 s PRO 16 CO 0.47 -0.37 1.07 0.34 0.04 0.00 0.00 177.00 178.56 1qk1 s ASP 17 N -2.04 6.19 -0.20 6.66 -1.08 -1.26 -4.86 116.67 120.07 1qk1 s ASP 17 Ca 0.66 -0.72 0.15 0.00 -0.52 0.00 0.00 52.55 52.12 1qk1 s ASP 17 Cb -0.15 -2.47 0.60 0.00 -1.46 0.00 0.00 42.92 39.44 1qk1 s ASP 17 CO 0.19 -1.56 1.51 0.18 0.52 0.00 0.00 175.17 176.02 1qk1 n LEU 18 N 8.27 4.40 0.18 -1.34 4.77 -1.26 -4.72 117.00 127.29 1qk1 n LEU 18 Ca -0.01 -3.05 0.12 0.00 -0.03 0.00 0.00 56.01 53.04 1qk1 n LEU 18 Cb 0.47 -0.59 0.67 0.00 -2.33 0.00 0.00 43.42 41.64 1qk1 n LEU 18 CO 0.67 0.70 1.11 0.03 -1.33 0.00 0.00 177.39 178.56 1qk1 h ARG 19 N 2.26 0.00 -0.47 3.23 3.08 -2.00 -2.05 114.38 118.43 1qk1 h ARG 19 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1qk1 h ARG 19 Cb 1.62 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.67 1qk1 h ARG 19 CO 0.31 0.00 0.00 1.63 -1.07 0.00 0.00 179.97 180.84 1qk1 n LYS 20 N -4.45 3.02 -2.67 0.04 5.02 -1.26 -5.02 118.16 112.83 1qk1 n LYS 20 Ca 0.01 -2.44 -0.30 0.00 -2.02 0.00 0.00 58.31 53.56 1qk1 n LYS 20 Cb 0.26 -1.52 -0.03 0.00 -0.02 0.00 0.00 35.03 33.72 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 -1.40 3.49 -0.45 2.13 3.76 -0.77 -4.87 115.29 117.17 1qk1 s HIS 21 Ca 0.36 1.13 0.05 0.00 -0.15 0.00 0.00 55.06 56.45 1qk1 s HIS 21 Cb 0.22 -2.52 0.18 0.00 1.11 0.00 0.00 32.58 31.56 1qk1 s HIS 21 CO 0.20 -0.22 0.48 -1.71 -0.85 0.00 0.00 174.74 172.64 1qk1 n ASN 22 N -1.54 -1.45 -3.67 1.40 5.15 0.46 -4.99 115.26 110.62 1qk1 n ASN 22 Ca 0.03 -2.57 -0.10 0.00 -0.60 0.00 0.00 54.58 51.34 1qk1 n ASN 22 Cb 0.54 0.21 -0.05 0.00 -0.53 0.00 0.00 39.78 39.96 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 0.23 -0.23 0.28 1.20 2.20 -1.26 -4.07 114.94 113.29 1qk1 s ASN 23 Ca 0.32 -0.38 0.01 0.00 -0.94 0.00 0.00 52.86 51.87 1qk1 s ASN 23 Cb 0.04 0.49 0.53 0.00 -2.00 0.00 0.00 41.25 40.31 1qk1 s ASN 23 CO -0.15 -0.89 1.84 0.00 -2.94 0.00 0.00 177.10 174.95 1qk1 h MET 25 N 1.00 0.08 0.00 0.00 1.85 -1.45 -2.24 114.93 114.18 1qk1 h MET 25 Ca 0.49 -0.00 -0.05 0.00 -0.61 0.00 0.00 59.70 59.53 1qk1 h MET 25 Cb 0.46 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.46 1qk1 h MET 25 CO -0.26 0.05 -0.23 0.00 -0.40 0.00 0.00 176.91 176.08 1qk1 h ALA 26 N 1.14 1.61 0.00 0.39 0.00 -1.73 -1.72 119.26 118.95 1qk1 h ALA 26 Ca 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1qk1 h ALA 26 Cb 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1qk1 h ALA 26 CO -0.13 0.28 0.00 0.43 0.00 0.00 0.00 179.25 179.84 1qk1 n SER 27 N -4.24 0.68 0.00 0.00 7.64 -0.87 -3.86 113.62 112.98 1qk1 n SER 27 Ca -0.02 0.62 0.00 0.00 1.01 0.00 0.00 58.87 60.48 1qk1 n SER 27 Cb 0.28 -0.78 0.00 0.00 -1.01 0.00 0.00 64.21 62.70 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 -2.20 0.00 -2.55 1.43 8.25 -0.84 -5.01 115.22 114.30 1qk1 n HIS 28 Ca 0.04 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.09 1qk1 n HIS 28 Cb 0.30 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.37 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 -1.93 4.49 0.15 2.41 2.96 -0.71 -4.98 118.68 121.07 1qk1 s LEU 29 Ca 0.00 2.04 0.01 0.00 -0.22 0.00 0.00 54.13 55.96 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 -0.19 -0.01 0.42 -1.32 0.00 0.00 176.35 175.25 1qk1 s THR 30 N -0.19 0.59 0.29 3.68 -4.23 -1.26 -4.98 115.64 109.54 1qk1 s THR 30 Ca 0.49 -1.96 -0.01 0.00 -1.18 0.00 0.00 61.69 59.04 1qk1 s THR 30 Cb -0.28 -1.99 0.28 0.00 1.34 0.00 0.00 72.50 71.84 1qk1 s THR 30 CO 0.34 -0.58 1.91 -0.65 -0.54 0.00 0.00 174.62 175.10 1qk1 h PRO 31 N 2.79 1.06 -0.30 3.99 0.11 -1.99 -0.76 132.00 136.90 1qk1 h PRO 31 Ca -0.36 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1qk1 h PRO 31 Cb 1.19 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 1qk1 h PRO 31 CO 0.63 0.70 0.18 0.00 -0.21 0.00 0.00 178.00 179.30 1qk1 h ALA 32 N 1.48 0.39 -0.44 -0.75 0.00 -1.99 -0.63 119.26 117.32 1qk1 h ALA 32 Ca 0.39 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.15 1qk1 h ALA 32 Cb 0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1qk1 h ALA 32 CO -0.14 -0.11 -0.12 0.28 0.00 0.00 0.00 179.25 179.16 1qk1 h VAL 33 N 0.39 1.27 -0.32 0.00 2.07 -1.85 -1.87 116.25 115.95 1qk1 h VAL 33 Ca 0.11 -1.24 -0.01 0.00 0.82 0.00 0.00 66.70 66.39 1qk1 h VAL 33 Cb 0.02 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1qk1 h VAL 33 CO -0.02 0.42 0.18 0.22 0.02 0.00 0.00 177.57 178.39 1qk1 h TYR 34 N 0.69 0.44 -0.47 1.57 3.20 -0.99 -1.60 116.97 119.80 1qk1 h TYR 34 Ca 0.11 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.92 1qk1 h TYR 34 Cb 0.66 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.77 1qk1 h TYR 34 CO 0.05 0.35 0.07 0.00 -1.64 0.00 0.00 178.16 176.98 1qk1 h ALA 35 N 1.05 1.23 -0.19 1.82 0.00 -1.04 0.36 119.26 122.49 1qk1 h ALA 35 Ca 0.11 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 1qk1 h ALA 35 Cb 0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1qk1 h ALA 35 CO -0.02 0.52 -0.43 -0.09 0.00 0.00 0.00 179.25 179.24 1qk1 h ARG 36 N 0.71 0.46 0.00 0.00 2.43 -1.04 -3.34 114.38 113.60 1qk1 h ARG 36 Ca 0.15 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1qk1 h ARG 36 Cb 0.34 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1qk1 h ARG 36 CO 0.01 0.80 -1.28 1.28 -1.51 0.00 0.00 179.97 179.27 1qk1 n LEU 37 N -4.01 0.49 0.18 3.80 4.77 -0.63 -4.55 117.00 117.04 1qk1 n LEU 37 Ca -0.02 -0.29 0.12 0.00 -0.03 0.00 0.00 56.01 55.80 1qk1 n LEU 37 Cb 0.52 0.00 0.65 0.00 -2.33 0.00 0.00 43.42 42.25 1qk1 n LEU 37 CO 0.44 0.12 0.86 0.00 -1.33 0.00 0.00 177.39 177.49 1qk1 n ASP 39 N -2.33 0.26 -4.79 0.00 8.00 -1.26 -4.83 116.55 111.59 1qk1 n ASP 39 Ca -0.02 0.09 -0.32 0.00 0.71 0.00 0.00 54.79 55.26 1qk1 n ASP 39 Cb 0.04 1.53 0.05 0.00 -0.02 0.00 0.00 41.12 42.72 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 -3.47 2.80 0.02 -1.24 1.02 -0.67 -5.07 119.74 113.12 1qk1 s LYS 40 Ca -0.06 1.16 -0.14 0.00 0.02 0.00 0.00 55.97 56.95 1qk1 s LYS 40 Cb 0.13 -1.96 0.02 0.00 -0.52 0.00 0.00 37.83 35.49 1qk1 s LYS 40 CO 0.87 -1.22 0.31 -0.08 -0.92 0.00 0.00 175.35 174.32 1qk1 s THR 41 N -2.73 0.07 0.56 2.17 -1.32 -1.26 -4.53 115.64 108.59 1qk1 s THR 41 Ca 0.62 -0.57 -0.03 0.00 -1.21 0.00 0.00 61.69 60.50 1qk1 s THR 41 Cb -0.17 -0.79 0.02 0.00 -1.51 0.00 0.00 72.50 70.05 1qk1 s THR 41 CO 0.48 -0.32 0.83 0.42 -2.21 0.00 0.00 174.62 173.82 1qk1 s THR 42 N -1.96 3.37 0.55 5.08 -4.23 -0.90 -4.92 115.64 112.62 1qk1 s THR 42 Ca -0.09 -0.31 0.28 0.00 -1.18 0.00 0.00 61.69 60.39 1qk1 s THR 42 Cb -0.03 -3.31 0.43 0.00 1.34 0.00 0.00 72.50 70.93 1qk1 s THR 42 CO 0.00 -0.27 1.94 -0.65 -0.54 0.00 0.00 174.62 175.10 1qk1 h PRO 43 N -0.02 0.00 -0.65 3.99 0.11 -1.97 0.12 132.00 133.58 1qk1 h PRO 43 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1qk1 h PRO 43 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1qk1 h PRO 43 CO 0.58 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.62 1qk1 n THR 44 N -4.20 1.53 -0.61 -1.15 -2.24 -1.26 -4.95 114.28 101.40 1qk1 n THR 44 Ca 0.13 -1.04 0.00 0.00 -2.27 0.00 0.00 64.05 60.87 1qk1 n THR 44 Cb 0.75 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 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 1.17 0.72 3.75 3.38 0.00 0.43 -5.05 105.19 109.59 1qk1 n GLY 45 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.31 3.35 0.42 1.61 -0.11 -1.26 -4.71 118.94 115.93 1qk1 s TRP 46 Ca 0.00 1.49 0.07 0.00 1.22 0.00 0.00 56.10 58.88 1qk1 s TRP 46 Cb 0.00 -3.47 -0.07 0.00 -1.50 0.00 0.00 33.47 28.43 1qk1 s TRP 46 CO 0.00 -1.25 0.06 0.95 -4.62 0.00 0.00 176.95 172.09 1qk1 s THR 47 N -0.71 2.04 0.13 5.86 -4.23 -1.26 -2.12 115.64 115.35 1qk1 s THR 47 Ca 0.49 -1.91 -0.17 0.00 -1.18 0.00 0.00 61.69 58.92 1qk1 s THR 47 Cb -0.35 -2.95 -0.02 0.00 1.34 0.00 0.00 72.50 70.52 1qk1 s THR 47 CO 0.43 0.00 1.72 0.25 -0.54 0.00 0.00 174.62 176.48 1qk1 h LEU 48 N 1.65 0.44 -1.20 4.79 5.85 -1.82 -1.84 115.31 123.18 1qk1 h LEU 48 Ca -0.44 -0.11 0.05 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 0.77 0.42 0.56 0.44 -0.34 0.00 0.00 178.44 180.29 1qk1 h ASP 49 N 0.42 0.88 0.45 1.25 3.32 -1.94 -1.25 116.42 119.56 1qk1 h ASP 49 Ca 0.12 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.05 1qk1 h ASP 49 Cb 0.09 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 1qk1 h ASP 49 CO -0.02 0.59 -0.52 1.56 -1.72 0.00 0.00 179.24 179.14 1qk1 h GLN 50 N 1.01 0.07 -0.11 3.56 4.20 -1.85 -1.65 115.11 120.35 1qk1 h GLN 50 Ca 0.35 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 59.01 1qk1 h GLN 50 Cb 0.10 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 1qk1 h GLN 50 CO -0.11 0.57 0.04 0.00 -0.67 0.00 0.00 178.83 178.66 1qk1 n ILE 52 N -4.89 0.00 -0.21 0.00 -5.35 -0.85 -1.71 119.36 106.35 1qk1 n ILE 52 Ca -0.05 -0.13 0.01 0.00 -0.27 0.00 0.00 62.75 62.31 1qk1 n ILE 52 Cb 0.13 0.24 0.10 0.00 -1.74 0.00 0.00 39.64 38.37 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 1.19 0.09 -0.50 6.28 5.75 -1.36 0.69 115.11 127.26 1qk1 h GLN 53 Ca 0.00 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1qk1 h GLN 53 Cb 0.44 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.95 1qk1 h GLN 53 CO 0.00 0.06 0.32 0.00 -2.65 0.00 0.00 178.83 176.56 1qk1 h THR 54 N 0.09 1.13 0.00 2.39 1.03 -1.78 -0.66 112.91 115.11 1qk1 h THR 54 Ca 0.33 -0.25 -0.09 0.00 -0.01 0.00 0.00 66.41 66.38 1qk1 h THR 54 Cb 0.53 0.41 -0.01 0.00 -1.07 0.00 0.00 68.15 68.01 1qk1 h THR 54 CO -0.56 0.13 -0.43 1.23 -0.01 0.00 0.00 175.52 175.88 1qk1 h GLY 55 N 0.69 0.00 0.92 2.99 0.00 -0.18 -1.73 103.07 105.75 1qk1 h GLY 55 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.29 1qk1 h GLY 55 CO -0.04 0.00 -0.90 -2.08 0.00 0.00 0.00 176.54 173.53 1qk1 h VAL 56 N 0.00 1.40 0.00 4.60 2.07 -0.41 -3.32 116.25 120.59 1qk1 h VAL 56 Ca -0.00 -2.34 -0.06 0.00 0.82 0.00 0.00 66.70 65.12 1qk1 h VAL 56 Cb 0.89 2.80 -0.01 0.00 -1.52 0.00 0.00 31.29 33.45 1qk1 h VAL 56 CO 0.06 0.69 -0.28 0.44 0.02 0.00 0.00 177.57 178.50 1qk1 h ASP 57 N -0.04 0.00 -4.20 0.57 5.19 -1.09 -3.38 116.42 113.47 1qk1 h ASP 57 Ca -0.14 0.00 -0.64 0.00 -0.62 0.00 0.00 57.03 55.64 1qk1 h ASP 57 Cb 1.62 0.00 -0.41 0.00 0.18 0.00 0.00 39.33 40.73 1qk1 h ASP 57 CO 0.17 0.28 -0.65 0.20 -3.12 0.00 0.00 179.24 176.12 1qk1 s ASN 58 N -6.41 4.27 0.36 6.45 0.01 -0.66 -4.97 114.94 113.99 1qk1 s ASN 58 Ca -0.01 -2.88 0.11 0.00 -0.71 0.00 0.00 52.86 49.37 1qk1 s ASN 58 Cb 0.12 -1.56 0.88 0.00 0.41 0.00 0.00 41.25 41.10 1qk1 s ASN 58 CO 0.66 -0.25 1.85 -0.65 -1.51 0.00 0.00 177.10 177.19 1qk1 h PRO 59 N 6.64 0.60 0.00 -0.60 0.11 -1.76 -3.44 132.00 133.55 1qk1 h PRO 59 Ca -0.07 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1qk1 h PRO 59 Cb 0.91 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1qk1 h PRO 59 CO 0.65 0.40 0.00 0.41 -0.21 0.00 0.00 178.00 179.25 1qk1 n GLY 60 N -1.44 -3.25 3.75 -0.55 0.00 -1.26 -0.40 105.19 102.04 1qk1 n GLY 60 Ca 0.19 -1.82 -0.32 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.93 3.21 -0.43 1.61 2.46 -1.23 -4.77 115.29 115.20 1qk1 s HIS 61 Ca 0.00 0.15 0.23 0.00 0.47 0.00 0.00 55.06 55.90 1qk1 s HIS 61 Cb 0.00 -1.70 1.01 0.00 -0.13 0.00 0.00 32.58 31.76 1qk1 s HIS 61 CO 0.00 0.52 1.68 -0.35 -2.47 0.00 0.00 174.74 174.13 1qk1 n PRO 62 N 1.10 0.18 -0.11 2.88 -0.04 -1.26 -3.36 135.00 134.38 1qk1 n PRO 62 Ca -0.13 0.47 -0.18 0.00 -0.04 0.00 0.00 63.50 63.62 1qk1 n PRO 62 Cb 0.52 -1.88 -0.07 0.00 -0.04 0.00 0.00 33.50 32.03 1qk1 n PRO 62 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1qk1 n PHE 63 N -2.22 0.43 -3.40 0.54 3.72 -1.26 -4.88 117.46 110.39 1qk1 n PHE 63 Ca 0.01 0.19 -0.40 0.00 -0.05 0.00 0.00 57.45 57.21 1qk1 n PHE 63 Cb 0.18 -0.86 -0.09 0.00 -0.94 0.00 0.00 39.48 37.76 1qk1 n PHE 63 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 1qk1 s ILE 64 N -2.52 5.18 -0.30 4.37 1.10 -1.21 -5.06 121.20 122.75 1qk1 s ILE 64 Ca -0.29 0.38 -0.13 0.00 -0.51 0.00 0.00 60.65 60.09 1qk1 s ILE 64 Cb 0.08 -3.73 -0.03 0.00 0.15 0.00 0.00 42.46 38.93 1qk1 s ILE 64 CO 0.45 0.08 0.29 -0.75 -2.11 0.00 0.00 174.94 172.90 1qk1 s LYS 65 N 2.05 3.80 0.74 3.50 2.20 -1.26 -3.56 119.74 127.21 1qk1 s LYS 65 Ca 0.14 -0.30 -0.06 0.00 -0.36 0.00 0.00 55.97 55.38 1qk1 s LYS 65 Cb -0.16 -3.72 0.10 0.00 -1.51 0.00 0.00 37.83 32.54 1qk1 s LYS 65 CO 0.11 -0.34 1.05 0.95 -0.36 0.00 0.00 175.35 176.76 1qk1 s THR 66 N 1.90 2.22 -0.09 3.43 -4.23 -1.26 -4.87 115.64 112.74 1qk1 s THR 66 Ca 0.10 -0.32 -0.28 0.00 -1.18 0.00 0.00 61.69 60.01 1qk1 s THR 66 Cb -0.16 -2.90 -0.24 0.00 1.34 0.00 0.00 72.50 70.54 1qk1 s THR 66 CO 0.11 0.00 0.96 0.58 -0.54 0.00 0.00 174.62 175.73 1qk1 h VAL 67 N -0.73 1.64 0.00 2.29 2.07 -1.94 -1.38 116.25 118.20 1qk1 h VAL 67 Ca -0.42 -1.91 0.00 0.00 0.82 0.00 0.00 66.70 65.19 1qk1 h VAL 67 Cb 1.29 2.94 0.00 0.00 -1.52 0.00 0.00 31.29 33.99 1qk1 h VAL 67 CO 0.51 0.50 0.00 0.61 0.02 0.00 0.00 177.57 179.21 1qk1 n GLY 68 N 1.10 0.68 3.52 2.17 0.00 -1.26 -1.25 105.19 110.15 1qk1 n GLY 68 Ca -0.09 -0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 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 0.95 0.24 1.61 0.23 -1.26 -1.90 119.30 118.70 1qk1 s MET 69 Ca 0.00 0.14 0.06 0.00 -1.03 0.00 0.00 55.69 54.85 1qk1 s MET 69 Cb 0.00 0.45 -0.05 0.00 -1.53 0.00 0.00 34.83 33.70 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 -1.50 1.41 -0.04 5.16 -7.23 -0.70 -4.49 120.40 113.01 1qk1 s VAL 70 Ca -0.07 -2.10 -0.06 0.00 -1.81 0.00 0.00 61.98 57.94 1qk1 s VAL 70 Cb -0.00 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 1qk1 s VAL 70 CO 0.05 -0.41 0.21 0.00 -0.31 0.00 0.00 175.10 174.64 1qk1 s ALA 71 N -3.17 3.89 -0.12 1.32 0.00 -0.52 -4.53 121.76 118.62 1qk1 s ALA 71 Ca 0.26 -0.64 0.20 0.00 0.00 0.00 0.00 51.96 51.79 1qk1 s ALA 71 Cb 0.03 -1.99 -0.20 0.00 0.00 0.00 0.00 23.12 20.96 1qk1 s ALA 71 CO 0.09 0.66 0.60 0.41 0.00 0.00 0.00 175.76 177.52 1qk1 n GLY 72 N 1.36 -1.14 3.85 0.00 0.00 -1.26 -4.59 105.19 103.40 1qk1 n GLY 72 Ca -0.14 -0.32 -0.04 0.00 0.00 0.00 0.00 46.02 45.51 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 -5.20 -0.03 0.23 1.61 1.47 -1.26 -0.78 116.67 112.71 1qk1 s ASP 73 Ca -0.06 -0.73 -0.07 0.00 1.18 0.00 0.00 52.55 52.88 1qk1 s ASP 73 Cb 0.10 0.57 0.22 0.00 -0.34 0.00 0.00 42.92 43.47 1qk1 s ASP 73 CO 0.85 -1.12 1.88 -0.08 0.68 0.00 0.00 175.17 177.38 1qk1 h GLU 74 N 2.00 1.25 0.00 2.11 4.81 -1.96 -2.56 114.58 120.23 1qk1 h GLU 74 Ca -0.28 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 58.81 1qk1 h GLU 74 Cb 1.23 -0.26 -0.00 0.00 0.63 0.00 0.00 28.75 30.34 1qk1 h GLU 74 CO 0.35 0.87 -0.14 0.93 -0.73 0.00 0.00 179.01 180.30 1qk1 h GLU 75 N 1.27 0.00 -0.79 1.92 3.07 -2.01 -3.17 114.58 114.87 1qk1 h GLU 75 Ca 0.33 0.00 0.18 0.00 -0.50 0.00 0.00 59.36 59.38 1qk1 h GLU 75 Cb -0.05 0.00 -0.12 0.00 -0.84 0.00 0.00 28.75 27.74 1qk1 h GLU 75 CO -0.06 0.14 0.20 1.15 -1.40 0.00 0.00 179.01 179.04 1qk1 h THR 76 N 0.00 0.45 0.00 1.13 2.02 -1.86 0.23 112.91 114.87 1qk1 h THR 76 Ca -0.00 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 1qk1 h THR 76 Cb 0.35 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1qk1 h THR 76 CO 0.02 0.05 -0.03 1.88 0.37 0.00 0.00 175.52 177.80 1qk1 h TYR 77 N 0.26 0.00 0.00 3.16 0.05 -1.73 -1.35 116.97 117.36 1qk1 h TYR 77 Ca 0.46 0.00 -0.31 0.00 0.05 0.00 0.00 58.73 58.94 1qk1 h TYR 77 Cb 0.84 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.54 1qk1 h TYR 77 CO -0.26 0.03 -1.72 -1.91 -1.05 0.00 0.00 178.16 173.25 1qk1 n GLU 78 N -3.39 0.57 -0.30 4.88 2.13 -0.06 -3.31 120.64 121.16 1qk1 n GLU 78 Ca -0.02 0.45 0.00 0.00 0.66 0.00 0.00 57.16 58.25 1qk1 n GLU 78 Cb 0.15 -1.64 0.13 0.00 0.27 0.00 0.00 31.44 30.35 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 1.05 -0.69 6.31 2.07 -1.19 -2.62 116.25 120.19 1qk1 h VAL 79 Ca -0.47 -0.33 -0.35 0.00 0.82 0.00 0.00 66.70 66.38 1qk1 h VAL 79 Cb 1.39 0.01 -0.21 0.00 -1.52 0.00 0.00 31.29 30.97 1qk1 h VAL 79 CO -0.28 0.17 0.30 0.49 0.02 0.00 0.00 177.57 178.27 1qk1 n PHE 80 N -4.63 2.12 -0.07 1.57 3.72 -0.51 -4.70 117.46 114.97 1qk1 n PHE 80 Ca 0.12 -1.70 0.16 0.00 -0.05 0.00 0.00 57.45 55.98 1qk1 n PHE 80 Cb 0.16 -0.72 0.58 0.00 -0.94 0.00 0.00 39.48 38.56 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 1.10 2.24 0.00 4.37 0.00 -1.46 -1.67 119.26 123.84 1qk1 h ALA 81 Ca 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1qk1 h ALA 81 Cb 2.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 20.05 1qk1 h ALA 81 CO 0.76 -0.40 0.00 -0.44 0.00 0.00 0.00 179.25 179.17 1qk1 h ASP 82 N 0.24 0.00 0.00 0.00 3.32 -1.85 -0.52 116.42 117.61 1qk1 h ASP 82 Ca 0.29 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 57.04 1qk1 h ASP 82 Cb 0.81 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.31 1qk1 h ASP 82 CO -0.06 0.00 -2.06 -0.11 -1.72 0.00 0.00 179.24 175.29 1qk1 n LEU 83 N -2.86 2.09 -0.21 1.55 0.00 -0.70 -4.59 117.00 112.28 1qk1 n LEU 83 Ca -0.02 0.09 -0.07 0.00 0.00 0.00 0.00 56.01 56.01 1qk1 n LEU 83 Cb 0.09 -0.60 0.03 0.00 0.00 0.00 0.00 43.42 42.95 1qk1 n LEU 83 CO 0.18 0.58 1.04 -0.26 0.00 0.00 0.00 177.39 178.93 1qk1 h PHE 84 N -0.38 0.85 0.01 1.96 0.04 -1.22 -2.95 116.94 115.26 1qk1 h PHE 84 Ca -0.45 -0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.30 1qk1 h PHE 84 Cb 1.52 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 39.38 1qk1 h PHE 84 CO -0.02 0.64 -0.13 -0.44 -0.60 0.00 0.00 178.31 177.76 1qk1 h ASP 85 N 0.82 -0.36 -0.96 2.17 3.32 -1.35 0.27 116.42 120.32 1qk1 h ASP 85 Ca 0.21 0.05 0.06 0.00 0.02 0.00 0.00 57.03 57.37 1qk1 h ASP 85 Cb 0.09 0.15 -0.06 0.00 0.22 0.00 0.00 39.33 39.73 1qk1 h ASP 85 CO -0.03 -0.18 0.63 -0.65 -1.72 0.00 0.00 179.24 177.29 1qk1 h PRO 86 N -0.22 1.11 -0.22 3.56 0.11 -1.78 0.78 132.00 135.34 1qk1 h PRO 86 Ca 0.04 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 66.04 1qk1 h PRO 86 Cb 0.27 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 1qk1 h PRO 86 CO -0.12 0.73 -0.04 0.28 -0.21 0.00 0.00 178.00 178.64 1qk1 h VAL 87 N 1.14 1.28 -0.72 3.15 2.07 -1.26 -2.07 116.25 119.84 1qk1 h VAL 87 Ca 0.41 -1.02 0.01 0.00 0.82 0.00 0.00 66.70 66.91 1qk1 h VAL 87 Cb 0.13 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1qk1 h VAL 87 CO -0.15 0.31 0.47 0.40 0.02 0.00 0.00 177.57 178.63 1qk1 h ILE 88 N 0.16 1.18 -0.81 4.57 2.04 0.08 -1.21 117.51 123.52 1qk1 h ILE 88 Ca 0.06 -0.33 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 1qk1 h ILE 88 Cb 0.49 0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 36.66 1qk1 h ILE 88 CO 0.02 0.18 0.35 -0.61 0.00 0.00 0.00 178.15 178.09 1qk1 h GLN 89 N 0.97 1.19 -0.26 2.37 4.15 -0.76 -1.36 115.11 121.41 1qk1 h GLN 89 Ca 0.26 -0.20 -0.11 0.00 0.77 0.00 0.00 58.65 59.37 1qk1 h GLN 89 Cb -0.11 -0.20 -0.00 0.00 0.21 0.00 0.00 27.48 27.37 1qk1 h GLN 89 CO -0.06 0.94 -0.27 1.49 -1.93 0.00 0.00 178.83 179.00 1qk1 h GLU 90 N 1.16 0.65 -0.26 1.69 4.81 -0.93 -1.54 114.58 120.16 1qk1 h GLU 90 Ca 0.27 -0.34 -0.08 0.00 -0.13 0.00 0.00 59.36 59.08 1qk1 h GLU 90 Cb 0.18 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1qk1 h GLU 90 CO -0.03 0.95 -0.18 -0.09 -0.73 0.00 0.00 179.01 178.93 1qk1 h ARG 91 N 0.37 0.45 -0.87 1.92 9.65 -1.08 -2.82 114.38 122.00 1qk1 h ARG 91 Ca 0.04 -0.15 -0.60 0.00 -1.10 0.00 0.00 59.98 58.17 1qk1 h ARG 91 Cb 0.84 -0.04 -0.34 0.00 -1.39 0.00 0.00 29.97 29.03 1qk1 h ARG 91 CO 0.07 0.62 0.10 0.72 2.80 0.00 0.00 179.97 184.29 1qk1 n HIS 92 N -4.17 2.95 -0.43 2.20 8.25 -0.53 -5.00 115.22 118.50 1qk1 n HIS 92 Ca 0.00 -2.62 0.00 0.00 -0.26 0.00 0.00 57.72 54.84 1qk1 n HIS 92 Cb 0.35 -0.93 0.00 0.00 1.12 0.00 0.00 29.99 30.53 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 -0.84 0.00 0.00 0.41 6.94 -1.07 -2.43 115.26 118.28 1qk1 n ASN 93 Ca 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 55.10 1qk1 n ASN 93 Cb 0.82 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.24 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 0.29 3.03 3.69 4.83 0.00 -0.59 -5.04 105.19 111.39 1qk1 n GLY 94 Ca 0.00 -0.88 -0.52 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 2.21 -3.68 1.61 9.36 -1.02 -4.92 117.16 120.72 1qk1 n TYR 95 Ca 0.00 0.21 -0.39 0.00 3.32 0.00 0.00 57.90 61.05 1qk1 n TYR 95 Cb 0.00 -2.58 -0.11 0.00 -0.63 0.00 0.00 39.34 36.02 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 3.67 5.46 0.00 2.98 2.15 -1.26 -3.77 116.67 125.90 1qk1 s ASP 96 Ca 0.94 -1.60 0.05 0.00 0.43 0.00 0.00 52.55 52.38 1qk1 s ASP 96 Cb -0.83 -1.92 0.23 0.00 -0.30 0.00 0.00 42.92 40.10 1qk1 s ASP 96 CO 0.56 -0.51 1.11 -0.81 -0.17 0.00 0.00 175.17 175.35 1qk1 n PRO 97 N 4.81 0.03 0.10 4.34 -0.04 -1.26 -0.74 135.00 142.23 1qk1 n PRO 97 Ca -0.09 0.35 0.06 0.00 -0.04 0.00 0.00 63.50 63.78 1qk1 n PRO 97 Cb 0.43 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.38 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 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1qk1 h ARG 98 CO 0.00 0.18 0.00 0.25 -1.07 0.00 0.00 179.97 179.33 1qk1 n THR 99 N -2.88 0.00 -4.05 2.04 -2.24 -0.88 -5.09 114.28 101.17 1qk1 n THR 99 Ca -0.03 -0.26 -0.23 0.00 -2.27 0.00 0.00 64.05 61.27 1qk1 n THR 99 Cb 0.68 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.87 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 -0.48 2.36 0.06 -0.78 -1.94 0.08 -5.07 119.30 113.53 1qk1 s MET 100 Ca 0.00 -1.60 0.05 0.00 -1.71 0.00 0.00 55.69 52.43 1qk1 s MET 100 Cb 0.00 -2.16 -0.03 0.00 2.01 0.00 0.00 34.83 34.65 1qk1 s MET 100 CO 0.00 0.03 -0.15 0.15 -0.01 0.00 0.00 175.02 175.04 1qk1 s LYS 101 N -3.89 0.91 -0.14 2.03 1.02 -1.26 -4.66 119.74 113.75 1qk1 s LYS 101 Ca 0.39 -0.92 -0.06 0.00 0.02 0.00 0.00 55.97 55.41 1qk1 s LYS 101 Cb -0.01 -0.95 -0.04 0.00 -0.52 0.00 0.00 37.83 36.31 1qk1 s LYS 101 CO 0.23 0.22 0.08 -1.58 -0.92 0.00 0.00 175.35 173.38 1qk1 s HIS 102 N -1.11 3.35 -0.11 3.18 5.65 -0.10 -4.87 115.29 121.28 1qk1 s HIS 102 Ca 0.00 0.27 0.01 0.00 0.25 0.00 0.00 55.06 55.60 1qk1 s HIS 102 Cb -0.09 -1.96 -0.01 0.00 -1.18 0.00 0.00 32.58 29.33 1qk1 s HIS 102 CO 0.02 0.44 -0.16 -0.08 -0.65 0.00 0.00 174.74 174.31 1qk1 s THR 103 N -0.42 2.84 -0.04 0.89 -1.32 -1.26 -4.79 115.64 111.53 1qk1 s THR 103 Ca 0.10 -0.75 -0.15 0.00 -1.21 0.00 0.00 61.69 59.68 1qk1 s THR 103 Cb -0.12 -2.16 -0.05 0.00 -1.51 0.00 0.00 72.50 68.66 1qk1 s THR 103 CO 0.02 0.54 0.39 -0.89 -2.21 0.00 0.00 174.62 172.47 1qk1 s THR 104 N 0.17 5.11 -0.27 5.08 2.01 -1.26 -3.82 115.64 122.67 1qk1 s THR 104 Ca -0.09 0.78 -0.01 0.00 0.31 0.00 0.00 61.69 62.68 1qk1 s THR 104 Cb -0.15 -3.70 0.13 0.00 0.01 0.00 0.00 72.50 68.79 1qk1 s THR 104 CO 0.05 0.52 0.30 -0.62 -0.69 0.00 0.00 174.62 174.19 1qk1 s ASP 105 N -0.64 1.31 -0.43 3.53 -1.08 -1.26 -4.97 116.67 113.12 1qk1 s ASP 105 Ca 0.23 -0.50 0.04 0.00 -0.52 0.00 0.00 52.55 51.80 1qk1 s ASP 105 Cb -0.16 0.62 0.49 0.00 -1.46 0.00 0.00 42.92 42.42 1qk1 s ASP 105 CO 0.11 -0.36 1.63 0.18 0.52 0.00 0.00 175.17 177.25 1qk1 n LEU 106 N 5.32 5.83 -4.39 -1.34 4.77 -1.26 -2.97 117.00 122.96 1qk1 n LEU 106 Ca -0.03 -4.20 -0.45 0.00 -0.03 0.00 0.00 56.01 51.30 1qk1 n LEU 106 Cb 0.48 -0.69 -0.02 0.00 -2.33 0.00 0.00 43.42 40.85 1qk1 n LEU 106 CO 0.02 1.55 0.71 -0.62 -1.33 0.00 0.00 177.39 177.72 1qk1 s ASP 107 N -2.47 6.71 0.63 -1.43 2.15 -1.26 -4.85 116.67 116.15 1qk1 s ASP 107 Ca 0.55 -2.39 0.35 0.00 0.43 0.00 0.00 52.55 51.48 1qk1 s ASP 107 Cb 0.45 -2.30 1.99 0.00 -0.30 0.00 0.00 42.92 42.75 1qk1 s ASP 107 CO 0.02 -0.81 2.23 0.00 -0.17 0.00 0.00 175.17 176.44 1qk1 h ALA 108 N 8.27 1.38 0.00 3.66 0.00 -1.90 -2.16 119.26 128.51 1qk1 h ALA 108 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1qk1 h ALA 108 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1qk1 h ALA 108 CO 0.93 -0.11 0.00 0.66 0.00 0.00 0.00 179.25 180.73 1qk1 h SER 109 N 0.00 0.00 0.43 0.00 4.64 -1.98 -2.02 113.55 114.62 1qk1 h SER 109 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1qk1 h SER 109 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1qk1 h SER 109 CO -0.00 0.00 -0.06 0.29 -0.87 0.00 0.00 176.83 176.19 1qk1 n LYS 110 N -2.30 0.59 -2.60 4.77 5.02 -0.81 -4.84 118.16 117.99 1qk1 n LYS 110 Ca 0.00 -0.11 -0.43 0.00 -2.02 0.00 0.00 58.31 55.75 1qk1 n LYS 110 Cb 0.13 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.62 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 -2.49 4.54 -0.11 -0.18 -1.09 -0.76 -5.02 121.20 116.09 1qk1 s ILE 111 Ca 0.30 1.84 -0.13 0.00 -2.23 0.00 0.00 60.65 60.43 1qk1 s ILE 111 Cb 0.20 -4.27 -0.05 0.00 -1.58 0.00 0.00 42.46 36.76 1qk1 s ILE 111 CO 0.46 -0.25 0.30 -0.13 -1.23 0.00 0.00 174.94 174.09 1qk1 s ARG 112 N 3.40 4.01 3.05 2.79 0.52 -1.26 -4.90 118.95 126.57 1qk1 s ARG 112 Ca 0.47 0.15 0.00 0.00 -0.52 0.00 0.00 55.73 55.82 1qk1 s ARG 112 Cb -0.16 -3.32 0.00 0.00 0.52 0.00 0.00 34.95 31.99 1qk1 s ARG 112 CO 0.10 0.46 0.00 0.45 0.02 0.00 0.00 175.30 176.34 1qk1 n SER 113 N 2.79 -0.14 0.00 0.23 2.88 -1.26 -4.98 113.62 113.14 1qk1 n SER 113 Ca -0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 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 1.41 2.91 0.46 0.00 -1.26 -4.76 105.19 103.95 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 2.86 0.57 1.61 6.14 -1.26 -1.52 117.35 123.76 1qk1 s TYR 115 Ca 0.00 -2.40 -0.15 0.00 0.64 0.00 0.00 57.07 55.16 1qk1 s TYR 115 Cb 0.00 -2.32 -0.05 0.00 0.42 0.00 0.00 41.96 40.01 1qk1 s TYR 115 CO 0.00 -0.90 1.02 -0.06 0.64 0.00 0.00 175.55 176.25 1qk1 s PHE 116 N 1.22 3.30 -0.34 4.97 0.08 0.48 -4.97 117.98 122.72 1qk1 s PHE 116 Ca 0.08 1.45 -0.28 0.00 0.12 0.00 0.00 56.93 58.30 1qk1 s PHE 116 Cb -0.18 -2.86 -0.02 0.00 -0.57 0.00 0.00 43.02 39.39 1qk1 s PHE 116 CO -0.14 -0.73 1.80 0.34 -0.10 0.00 0.00 175.22 176.40 1qk1 s ASP 117 N -3.22 5.86 0.00 1.36 -1.08 -1.26 -4.56 116.67 113.77 1qk1 s ASP 117 Ca 0.60 1.26 0.00 0.00 -0.52 0.00 0.00 52.55 53.89 1qk1 s ASP 117 Cb -0.12 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.81 1qk1 s ASP 117 CO 0.39 -1.74 0.32 -0.62 0.52 0.00 0.00 175.17 174.04 1qk1 n GLU 118 N 8.46 0.35 0.00 4.34 1.02 -1.26 -1.74 120.64 131.81 1qk1 n GLU 118 Ca 0.23 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.48 1qk1 n GLU 118 Cb 0.47 -1.03 0.07 0.00 -0.02 0.00 0.00 31.44 30.93 1qk1 n GLU 118 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1qk1 n ARG 119 N -0.37 1.89 0.00 3.49 1.85 -1.26 -4.35 116.66 117.92 1qk1 n ARG 119 Ca 0.00 -1.62 0.00 0.00 -1.00 0.00 0.00 57.85 55.23 1qk1 n ARG 119 Cb 0.01 -1.42 0.00 0.00 -1.05 0.00 0.00 32.46 30.01 1qk1 n ARG 119 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1qk1 n TYR 120 N 0.96 0.00 -3.33 2.89 4.01 -0.71 -4.89 117.16 116.09 1qk1 n TYR 120 Ca 0.12 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.44 1qk1 n TYR 120 Cb 0.52 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.46 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 -1.73 5.10 0.06 -0.72 1.01 -1.00 -0.58 120.40 122.54 1qk1 s VAL 121 Ca 0.00 -0.09 -0.12 0.00 0.00 0.00 0.00 61.98 61.78 1qk1 s VAL 121 Cb 0.00 -3.95 -0.31 0.00 0.00 0.00 0.00 36.38 32.12 1qk1 s VAL 121 CO 0.00 -0.27 1.09 -0.07 0.00 0.00 0.00 175.10 175.85 1qk1 h LEU 122 N 8.96 0.74 -7.30 3.92 3.38 -0.76 -3.39 115.31 120.86 1qk1 h LEU 122 Ca -0.28 -0.74 -0.05 0.00 0.09 0.00 0.00 57.88 56.90 1qk1 h LEU 122 Cb 1.12 -0.24 -0.14 0.00 0.09 0.00 0.00 40.66 41.50 1qk1 h LEU 122 CO 0.76 1.56 -0.02 -0.94 0.09 0.00 0.00 178.44 179.89 1qk1 s SER 123 N -7.40 -0.32 -0.02 -0.43 1.04 -1.18 -0.04 113.70 105.35 1qk1 s SER 123 Ca -0.08 -0.16 0.03 0.00 0.48 0.00 0.00 55.95 56.23 1qk1 s SER 123 Cb 0.06 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.66 1qk1 s SER 123 CO 0.92 -0.83 -0.12 -0.44 0.98 0.00 0.00 173.24 173.76 1qk1 s SER 124 N -2.58 1.46 -0.02 7.02 0.01 -0.53 -1.67 113.70 117.39 1qk1 s SER 124 Ca 0.00 -0.23 -0.19 0.00 1.31 0.00 0.00 55.95 56.84 1qk1 s SER 124 Cb 0.01 -0.25 0.04 0.00 0.21 0.00 0.00 66.02 66.02 1qk1 s SER 124 CO -0.09 0.13 0.42 0.00 0.41 0.00 0.00 173.24 174.10 1qk1 s ARG 125 N -0.12 0.80 -0.07 12.44 1.70 -0.46 -1.93 118.95 131.31 1qk1 s ARG 125 Ca 0.02 -0.10 0.02 0.00 -0.47 0.00 0.00 55.73 55.19 1qk1 s ARG 125 Cb -0.07 0.36 0.02 0.00 -0.57 0.00 0.00 34.95 34.70 1qk1 s ARG 125 CO 0.00 -0.24 -0.10 0.08 -1.08 0.00 0.00 175.30 173.97 1qk1 s VAL 126 N -1.45 0.97 0.10 4.99 1.01 -0.11 -0.68 120.40 125.24 1qk1 s VAL 126 Ca -0.12 -0.36 0.06 0.00 0.00 0.00 0.00 61.98 61.57 1qk1 s VAL 126 Cb -0.03 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 1qk1 s VAL 126 CO 0.05 0.32 -0.16 -0.60 0.00 0.00 0.00 175.10 174.71 1qk1 s ARG 127 N 0.87 1.00 0.38 2.72 3.52 -0.39 -1.30 118.95 125.75 1qk1 s ARG 127 Ca -0.11 -1.13 -0.13 0.00 -0.13 0.00 0.00 55.73 54.23 1qk1 s ARG 127 Cb -0.15 -1.05 0.05 0.00 -1.56 0.00 0.00 34.95 32.24 1qk1 s ARG 127 CO 0.01 0.23 0.73 -2.37 -0.81 0.00 0.00 175.30 173.09 1qk1 n THR 128 N 0.92 0.00 -4.12 4.11 5.66 -0.49 -1.36 114.28 119.02 1qk1 n THR 128 Ca -0.18 -1.05 -0.09 0.00 -3.05 0.00 0.00 64.05 59.67 1qk1 n THR 128 Cb 0.55 0.97 -0.10 0.00 -1.55 0.00 0.00 70.33 70.20 1qk1 n THR 128 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1qk1 s GLY 129 N -3.02 0.59 -0.02 1.09 0.00 -1.26 -0.16 107.32 104.55 1qk1 s GLY 129 Ca 0.17 -1.20 -0.04 0.00 0.00 0.00 0.00 44.72 43.65 1qk1 s GLY 129 CO 0.13 -1.30 0.09 0.50 0.00 0.00 0.00 173.10 172.51 1qk1 s ARG 130 N -3.56 0.25 0.00 2.90 1.81 -0.82 -4.94 118.95 114.59 1qk1 s ARG 130 Ca 0.06 -0.13 0.06 0.00 -1.72 0.00 0.00 55.73 54.01 1qk1 s ARG 130 Cb 0.04 0.10 -0.03 0.00 -0.45 0.00 0.00 34.95 34.62 1qk1 s ARG 130 CO -0.06 -0.05 -0.19 -1.12 -0.68 0.00 0.00 175.30 173.20 1qk1 s SER 131 N -0.58 3.70 -0.30 0.23 0.01 -1.26 -2.39 113.70 113.10 1qk1 s SER 131 Ca -0.07 -0.37 -0.21 0.00 1.31 0.00 0.00 55.95 56.62 1qk1 s SER 131 Cb -0.04 -0.62 -0.01 0.00 0.21 0.00 0.00 66.02 65.56 1qk1 s SER 131 CO 0.00 0.30 0.66 -0.63 0.41 0.00 0.00 173.24 173.98 1qk1 s ILE 132 N -0.80 4.91 0.34 1.44 -1.09 -1.26 -0.65 121.20 124.09 1qk1 s ILE 132 Ca 0.13 0.93 -0.29 0.00 -2.23 0.00 0.00 60.65 59.19 1qk1 s ILE 132 Cb -0.10 -4.03 -0.12 0.00 -1.58 0.00 0.00 42.46 36.63 1qk1 s ILE 132 CO 0.02 -0.16 1.44 -1.14 -1.23 0.00 0.00 174.94 173.87 1qk1 n ARG 133 N 5.94 2.46 -0.08 2.79 0.63 0.00 -2.85 116.66 125.56 1qk1 n ARG 133 Ca -0.00 0.87 0.00 0.00 -0.92 0.00 0.00 57.85 57.80 1qk1 n ARG 133 Cb 0.49 -2.55 0.00 0.00 0.45 0.00 0.00 32.46 30.84 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 0.93 0.68 3.26 5.14 0.00 -1.26 -4.73 105.19 109.21 1qk1 n GLY 134 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 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 2.05 0.70 0.99 1.43 -1.13 -5.13 118.68 117.60 1qk1 s LEU 135 Ca 0.00 -0.43 -0.15 0.00 -1.03 0.00 0.00 54.13 52.52 1qk1 s LEU 135 Cb 0.00 -1.19 0.02 0.00 0.03 0.00 0.00 46.19 45.06 1qk1 s LEU 135 CO 0.00 0.28 1.18 -0.44 0.23 0.00 0.00 176.35 177.60 1qk1 s SER 136 N -0.58 4.51 0.81 2.29 0.01 -1.26 -4.81 113.70 114.66 1qk1 s SER 136 Ca 0.09 2.25 -0.12 0.00 1.31 0.00 0.00 55.95 59.48 1qk1 s SER 136 Cb -0.09 -2.58 0.08 0.00 0.21 0.00 0.00 66.02 63.64 1qk1 s SER 136 CO -0.01 -2.04 1.12 -0.76 0.41 0.00 0.00 173.24 171.96 1qk1 s LEU 137 N -5.01 2.50 0.39 2.44 1.43 0.04 -4.44 118.68 116.03 1qk1 s LEU 137 Ca 0.72 1.09 0.22 0.00 -1.03 0.00 0.00 54.13 55.13 1qk1 s LEU 137 Cb -0.27 -3.65 1.23 0.00 0.03 0.00 0.00 46.19 43.53 1qk1 s LEU 137 CO 0.43 -1.97 1.67 -0.65 0.23 0.00 0.00 176.35 176.07 1qk1 h PRO 138 N -1.09 0.23 0.00 1.29 0.11 -1.88 -0.82 132.00 129.84 1qk1 h PRO 138 Ca -0.47 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 1qk1 h PRO 138 Cb 1.29 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1qk1 h PRO 138 CO 0.62 0.15 -0.28 -1.35 -0.21 0.00 0.00 178.00 176.94 1qk1 h PRO 139 N 0.24 0.00 0.00 1.05 0.11 -1.81 -3.37 132.00 128.22 1qk1 h PRO 139 Ca 0.74 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.85 1qk1 h PRO 139 Cb 2.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 33.11 1qk1 h PRO 139 CO -0.46 0.28 -0.66 0.00 -0.21 0.00 0.00 178.00 176.95 1qk1 n ALA 140 N -2.41 2.17 -1.76 -0.75 0.00 -0.54 -4.73 120.51 112.48 1qk1 n ALA 140 Ca -0.02 -0.05 -0.39 0.00 0.00 0.00 0.00 53.44 52.97 1qk1 n ALA 140 Cb 0.35 -0.07 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 -1.23 2.13 0.24 0.00 -4.23 -1.26 -4.84 115.64 106.45 1qk1 s THR 142 Ca 0.63 -0.23 -0.07 0.00 -1.18 0.00 0.00 61.69 60.84 1qk1 s THR 142 Cb -0.43 -2.91 0.24 0.00 1.34 0.00 0.00 72.50 70.75 1qk1 s THR 142 CO 0.54 0.00 1.92 0.03 -0.54 0.00 0.00 174.62 176.57 1qk1 h ARG 143 N -0.96 1.27 -0.70 3.99 3.08 -1.99 -0.87 114.38 118.20 1qk1 h ARG 143 Ca -0.43 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 59.49 1qk1 h ARG 143 Cb 1.28 -0.28 -0.03 0.00 0.08 0.00 0.00 29.97 31.02 1qk1 h ARG 143 CO 0.50 0.84 0.24 0.00 -1.07 0.00 0.00 179.97 180.47 1qk1 h ALA 144 N 1.35 0.91 -0.47 0.04 0.00 -1.99 -0.55 119.26 118.56 1qk1 h ALA 144 Ca 0.35 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1qk1 h ALA 144 Cb -0.15 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 1qk1 h ALA 144 CO -0.08 0.57 0.08 0.93 0.00 0.00 0.00 179.25 180.76 1qk1 h GLU 145 N 1.01 0.77 -0.76 0.00 5.08 -1.81 -1.14 114.58 117.74 1qk1 h GLU 145 Ca 0.23 -0.20 -0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1qk1 h GLU 145 Cb 0.28 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1qk1 h GLU 145 CO -0.01 0.78 0.29 -0.09 -1.00 0.00 0.00 179.01 178.99 1qk1 h ARG 146 N 0.64 1.13 -0.14 2.33 2.43 -0.95 -1.76 114.38 118.07 1qk1 h ARG 146 Ca 0.14 -0.21 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 1qk1 h ARG 146 Cb 0.38 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1qk1 h ARG 146 CO 0.01 0.93 -0.19 0.00 -1.51 0.00 0.00 179.97 179.21 1qk1 h ARG 147 N 1.09 0.24 -0.41 0.20 3.08 -0.85 -2.52 114.38 115.20 1qk1 h ARG 147 Ca 0.25 -0.07 -0.15 0.00 0.07 0.00 0.00 59.98 60.08 1qk1 h ARG 147 Cb 0.22 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1qk1 h ARG 147 CO -0.02 0.43 -0.33 1.49 -1.07 0.00 0.00 179.97 180.46 1qk1 h GLU 148 N 0.22 0.94 -0.55 0.04 4.57 -0.50 -1.01 114.58 118.29 1qk1 h GLU 148 Ca 0.04 -0.47 0.04 0.00 -1.18 0.00 0.00 59.36 57.79 1qk1 h GLU 148 Cb 0.47 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.02 1qk1 h GLU 148 CO 0.03 1.13 0.31 0.28 -1.18 0.00 0.00 179.01 179.58 1qk1 h VAL 149 N 0.79 1.01 0.03 0.32 2.07 -0.93 -0.72 116.25 118.82 1qk1 h VAL 149 Ca 0.08 -0.21 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 1qk1 h VAL 149 Cb 0.92 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1qk1 h VAL 149 CO 0.09 0.11 -0.02 -0.08 0.02 0.00 0.00 177.57 177.69 1qk1 h GLU 150 N 0.60 -0.04 -0.58 1.57 4.81 -1.20 -0.33 114.58 119.40 1qk1 h GLU 150 Ca 0.23 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.53 1qk1 h GLU 150 Cb 0.09 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.42 1qk1 h GLU 150 CO -0.13 0.10 0.27 0.00 -0.73 0.00 0.00 179.01 178.52 1qk1 h ARG 151 N -0.18 0.48 0.11 1.92 3.08 -0.96 -0.14 114.38 118.70 1qk1 h ARG 151 Ca -0.00 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1qk1 h ARG 151 Cb 0.16 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1qk1 h ARG 151 CO 0.01 0.32 -0.05 0.28 -1.07 0.00 0.00 179.97 179.45 1qk1 h VAL 152 N 0.49 1.00 0.31 2.04 2.07 -0.88 -2.17 116.25 119.11 1qk1 h VAL 152 Ca 0.27 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1qk1 h VAL 152 Cb 0.25 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1qk1 h VAL 152 CO -0.23 0.11 -0.15 0.58 0.02 0.00 0.00 177.57 177.90 1qk1 h VAL 153 N -0.35 0.72 -0.96 2.57 2.07 -0.89 -2.71 116.25 116.70 1qk1 h VAL 153 Ca -0.02 -0.45 0.20 0.00 0.82 0.00 0.00 66.70 67.25 1qk1 h VAL 153 Cb 0.29 0.96 -0.09 0.00 -1.52 0.00 0.00 31.29 30.93 1qk1 h VAL 153 CO 0.03 0.09 0.61 0.58 0.02 0.00 0.00 177.57 178.90 1qk1 h VAL 154 N -0.66 0.68 -0.25 2.57 2.07 -1.09 0.23 116.25 119.79 1qk1 h VAL 154 Ca -0.04 -0.20 -0.08 0.00 0.82 0.00 0.00 66.70 67.20 1qk1 h VAL 154 Cb 0.47 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1qk1 h VAL 154 CO 0.07 0.10 -0.20 0.44 0.02 0.00 0.00 177.57 178.00 1qk1 h ASP 155 N 0.57 0.44 0.07 0.57 3.32 -1.25 -2.45 116.42 117.68 1qk1 h ASP 155 Ca 0.53 -0.13 -0.23 0.00 0.02 0.00 0.00 57.03 57.21 1qk1 h ASP 155 Cb 1.08 -0.12 0.01 0.00 0.22 0.00 0.00 39.33 40.52 1qk1 h ASP 155 CO -0.27 0.66 -0.90 0.00 -1.72 0.00 0.00 179.24 177.01 1qk1 h ALA 156 N 1.38 0.30 -0.25 3.45 0.00 -0.31 -3.27 119.26 120.56 1qk1 h ALA 156 Ca 0.07 -0.66 -0.08 0.00 0.00 0.00 0.00 54.91 54.23 1qk1 h ALA 156 Cb 0.59 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1qk1 h ALA 156 CO 0.04 0.73 -0.21 -0.07 0.00 0.00 0.00 179.25 179.74 1qk1 h LEU 157 N 0.39 0.45 0.00 0.00 3.38 -0.90 -2.14 115.31 116.48 1qk1 h LEU 157 Ca -0.08 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1qk1 h LEU 157 Cb 1.53 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.16 1qk1 h LEU 157 CO 0.17 0.66 0.00 -1.54 0.09 0.00 0.00 178.44 177.83 1qk1 n SER 158 N -4.15 0.00 -0.50 -0.43 3.41 -0.94 -1.72 113.62 109.28 1qk1 n SER 158 Ca -0.00 0.20 0.12 0.00 -0.26 0.00 0.00 58.87 58.93 1qk1 n SER 158 Cb 0.37 -0.35 0.21 0.00 -0.26 0.00 0.00 64.21 64.18 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 0.04 0.00 3.77 5.00 0.00 -0.81 -4.93 105.19 108.26 1qk1 n GLY 159 Ca 0.06 -0.55 -0.38 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.33 4.33 0.38 0.99 1.43 -0.70 -5.05 118.68 117.72 1qk1 s LEU 160 Ca 0.25 2.17 0.04 0.00 -1.03 0.00 0.00 54.13 55.56 1qk1 s LEU 160 Cb 0.19 -3.92 -0.03 0.00 0.03 0.00 0.00 46.19 42.46 1qk1 s LEU 160 CO 0.48 -0.36 0.12 -0.54 0.23 0.00 0.00 176.35 176.28 1qk1 s LYS 161 N -2.01 1.83 7.26 1.70 1.02 -1.26 -4.22 119.74 124.06 1qk1 s LYS 161 Ca 0.52 -2.09 0.00 0.00 0.02 0.00 0.00 55.97 54.42 1qk1 s LYS 161 Cb -0.27 -0.59 0.00 0.00 -0.52 0.00 0.00 37.83 36.44 1qk1 s LYS 161 CO 0.35 -0.42 0.00 0.41 -0.92 0.00 0.00 175.35 174.77 1qk1 n GLY 162 N -0.82 2.46 0.00 -3.33 0.00 -1.26 -2.03 105.19 100.21 1qk1 n GLY 162 Ca -0.04 -0.31 0.15 0.00 0.00 0.00 0.00 46.02 45.82 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 5.60 0.00 -0.67 1.61 5.75 -1.26 -2.79 116.55 124.79 1qk1 n ASP 163 Ca 0.00 -0.53 0.11 0.00 -0.01 0.00 0.00 54.79 54.37 1qk1 n ASP 163 Cb 0.00 -0.16 0.04 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 -1.16 2.40 -4.77 -2.12 4.77 -0.86 -4.67 117.00 110.60 1qk1 n LEU 164 Ca 0.19 -0.85 -0.39 0.00 -0.03 0.00 0.00 56.01 54.92 1qk1 n LEU 164 Cb 0.18 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.26 1qk1 n LEU 164 CO 0.21 0.43 0.93 0.00 -1.33 0.00 0.00 177.39 177.63 1qk1 s ALA 165 N -2.28 3.26 0.00 -1.18 0.00 -1.12 -4.59 121.76 115.84 1qk1 s ALA 165 Ca 0.22 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.35 1qk1 s ALA 165 Cb 0.19 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.85 1qk1 s ALA 165 CO 0.46 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1qk1 n GLY 166 N 0.69 3.57 3.01 0.00 0.00 -1.26 -1.15 105.19 110.05 1qk1 n GLY 166 Ca 0.03 -0.91 -0.13 0.00 0.00 0.00 0.00 46.02 45.02 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 1.06 0.43 -0.02 1.61 3.52 -0.75 -4.91 118.95 119.89 1qk1 s ARG 167 Ca 0.00 -0.55 0.03 0.00 -0.13 0.00 0.00 55.73 55.08 1qk1 s ARG 167 Cb 0.00 -0.23 -0.03 0.00 -1.56 0.00 0.00 34.95 33.12 1qk1 s ARG 167 CO 0.00 0.04 -0.09 -0.47 -0.81 0.00 0.00 175.30 173.98 1qk1 s TYR 168 N -1.00 2.85 -0.08 5.12 5.04 -1.26 -2.48 117.35 125.53 1qk1 s TYR 168 Ca -0.07 -0.06 0.01 0.00 -2.44 0.00 0.00 57.07 54.51 1qk1 s TYR 168 Cb -0.07 -1.63 0.02 0.00 0.35 0.00 0.00 41.96 40.63 1qk1 s TYR 168 CO 0.00 0.32 -0.11 0.71 -1.34 0.00 0.00 175.55 175.14 1qk1 s TYR 169 N -0.90 1.44 -0.12 4.97 1.51 0.11 -4.99 117.35 119.37 1qk1 s TYR 169 Ca 0.15 -0.59 -0.22 0.00 -1.01 0.00 0.00 57.07 55.40 1qk1 s TYR 169 Cb -0.11 -1.10 -0.03 0.00 -0.11 0.00 0.00 41.96 40.61 1qk1 s TYR 169 CO 0.05 -0.34 0.65 1.03 -1.11 0.00 0.00 175.55 175.83 1qk1 s ARG 170 N 0.97 4.34 0.45 -0.62 0.52 -1.26 -0.63 118.95 122.72 1qk1 s ARG 170 Ca -0.09 0.74 0.15 0.00 -0.52 0.00 0.00 55.73 56.01 1qk1 s ARG 170 Cb -0.15 -3.50 1.08 0.00 0.52 0.00 0.00 34.95 32.91 1qk1 s ARG 170 CO 0.00 -0.05 2.01 -0.07 0.02 0.00 0.00 175.30 177.21 1qk1 h LEU 171 N 7.32 0.29 -1.24 2.53 3.38 -1.78 -2.18 115.31 123.64 1qk1 h LEU 171 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1qk1 h LEU 171 Cb 1.17 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1qk1 h LEU 171 CO 0.77 0.18 0.00 0.77 0.09 0.00 0.00 178.44 180.25 1qk1 h SER 172 N 0.33 0.00 0.00 -0.43 4.64 -1.81 -3.22 113.55 113.06 1qk1 h SER 172 Ca 0.23 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.54 1qk1 h SER 172 Cb 0.48 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.54 1qk1 h SER 172 CO -0.05 0.00 -0.31 -1.84 -0.87 0.00 0.00 176.83 173.76 1qk1 n GLU 173 N -2.95 0.79 -2.46 4.77 0.28 -0.88 -5.05 120.64 115.15 1qk1 n GLU 173 Ca 0.01 -2.09 -0.41 0.00 -0.16 0.00 0.00 57.16 54.51 1qk1 n GLU 173 Cb 0.31 -1.06 -0.04 0.00 1.43 0.00 0.00 31.44 32.08 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 -1.73 4.55 0.62 3.44 1.75 -0.88 -4.93 119.30 122.12 1qk1 s MET 174 Ca 0.22 1.78 -0.07 0.00 -1.25 0.00 0.00 55.69 56.36 1qk1 s MET 174 Cb 0.21 -3.27 0.01 0.00 2.84 0.00 0.00 34.83 34.62 1qk1 s MET 174 CO -0.01 -0.00 0.96 0.95 -0.65 0.00 0.00 175.02 176.26 1qk1 s THR 175 N -0.09 3.59 0.42 10.11 -4.23 -1.26 -4.88 115.64 119.30 1qk1 s THR 175 Ca 0.51 0.13 0.11 0.00 -1.18 0.00 0.00 61.69 61.26 1qk1 s THR 175 Cb -0.30 -3.45 0.19 0.00 1.34 0.00 0.00 72.50 70.27 1qk1 s THR 175 CO 0.35 -0.50 1.98 -0.33 -0.54 0.00 0.00 174.62 175.58 1qk1 h GLU 176 N -0.31 0.19 0.22 3.99 5.08 -1.98 0.12 114.58 121.89 1qk1 h GLU 176 Ca -0.45 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 1qk1 h GLU 176 Cb 1.26 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1qk1 h GLU 176 CO 0.62 0.28 -0.11 0.00 -1.00 0.00 0.00 179.01 178.80 1qk1 h ALA 177 N 1.74 -0.30 -0.74 3.43 0.00 -1.99 -1.32 119.26 120.08 1qk1 h ALA 177 Ca 0.04 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1qk1 h ALA 177 Cb 0.27 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1qk1 h ALA 177 CO 0.01 -0.52 0.49 0.93 0.00 0.00 0.00 179.25 180.16 1qk1 h GLU 178 N -0.59 0.96 -0.79 0.00 5.08 -1.87 -1.41 114.58 115.95 1qk1 h GLU 178 Ca -0.03 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1qk1 h GLU 178 Cb 0.43 -0.22 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 1qk1 h GLU 178 CO 0.05 0.63 0.51 0.37 -1.00 0.00 0.00 179.01 179.58 1qk1 h GLN 179 N 0.99 0.98 -0.39 2.33 4.15 -0.69 -1.46 115.11 121.02 1qk1 h GLN 179 Ca 0.28 -0.06 -0.13 0.00 0.77 0.00 0.00 58.65 59.51 1qk1 h GLN 179 Cb -0.09 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.36 1qk1 h GLN 179 CO -0.07 0.65 -0.28 0.37 -1.93 0.00 0.00 178.83 177.57 1qk1 h GLN 180 N 1.01 0.82 -0.32 1.69 5.75 -0.66 -2.46 115.11 120.94 1qk1 h GLN 180 Ca 0.31 -0.37 -0.01 0.00 -0.15 0.00 0.00 58.65 58.43 1qk1 h GLN 180 Cb -0.03 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.49 1qk1 h GLN 180 CO -0.10 1.00 0.15 0.37 -2.65 0.00 0.00 178.83 177.60 1qk1 h GLN 181 N 0.70 0.47 -0.21 1.69 5.75 -0.81 -2.26 115.11 120.44 1qk1 h GLN 181 Ca 0.08 -0.08 -0.03 0.00 -0.15 0.00 0.00 58.65 58.47 1qk1 h GLN 181 Cb 0.82 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.28 1qk1 h GLN 181 CO 0.07 0.45 -0.02 -0.07 -2.65 0.00 0.00 178.83 176.61 1qk1 h LEU 182 N 0.38 0.28 -0.43 -2.39 3.38 -1.19 -1.57 115.31 113.77 1qk1 h LEU 182 Ca 0.11 -0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.87 1qk1 h LEU 182 Cb 0.14 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1qk1 h LEU 182 CO -0.01 0.35 -0.49 0.40 0.09 0.00 0.00 178.44 178.79 1qk1 h ILE 183 N 0.30 1.29 -0.37 1.22 2.04 -1.20 -0.11 117.51 120.68 1qk1 h ILE 183 Ca 0.07 -1.68 -0.09 0.00 1.00 0.00 0.00 64.86 64.15 1qk1 h ILE 183 Cb 0.24 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 1qk1 h ILE 183 CO 0.01 0.54 -0.16 0.44 0.00 0.00 0.00 178.15 178.98 1qk1 h ASP 184 N 0.61 0.67 1.02 1.72 3.32 -0.79 -2.19 116.42 120.77 1qk1 h ASP 184 Ca 0.03 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.87 1qk1 h ASP 184 Cb 1.06 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.43 1qk1 h ASP 184 CO 0.10 0.84 0.00 0.47 -1.72 0.00 0.00 179.24 178.94 1qk1 n ASP 185 N -4.15 0.11 -2.35 6.45 8.00 -0.65 -4.92 116.55 119.03 1qk1 n ASP 185 Ca 0.01 0.51 -0.14 0.00 0.71 0.00 0.00 54.79 55.88 1qk1 n ASP 185 Cb 0.38 -0.54 0.05 0.00 -0.02 0.00 0.00 41.12 40.99 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 -1.60 -1.67 0.19 1.24 8.25 -0.78 -4.94 115.22 115.91 1qk1 n HIS 186 Ca 0.07 0.60 0.05 0.00 -0.26 0.00 0.00 57.72 58.18 1qk1 n HIS 186 Cb 0.34 -3.46 -0.07 0.00 1.12 0.00 0.00 29.99 27.91 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 -3.85 0.00 -2.29 4.41 3.72 -0.12 -5.02 117.46 114.30 1qk1 n PHE 187 Ca -0.02 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.06 1qk1 n PHE 187 Cb 0.54 -0.14 -0.02 0.00 -0.94 0.00 0.00 39.48 38.92 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 -3.23 3.56 0.04 4.37 2.96 -1.15 -5.02 118.68 120.21 1qk1 s LEU 188 Ca -0.01 1.59 -0.01 0.00 -0.22 0.00 0.00 54.13 55.48 1qk1 s LEU 188 Cb 0.07 -4.51 -0.03 0.00 0.50 0.00 0.00 46.19 42.22 1qk1 s LEU 188 CO 0.43 -0.70 -0.03 0.72 -1.32 0.00 0.00 176.35 175.45 1qk1 s PHE 189 N -2.66 0.39 0.31 5.38 -0.12 -1.26 -5.01 117.98 115.01 1qk1 s PHE 189 Ca 0.59 -0.80 0.02 0.00 -0.05 0.00 0.00 56.93 56.69 1qk1 s PHE 189 Cb -0.11 -0.29 -0.01 0.00 -0.63 0.00 0.00 43.02 41.98 1qk1 s PHE 189 CO 0.35 -0.29 0.07 -0.40 -0.05 0.00 0.00 175.22 174.90 1qk1 n ASP 190 N 0.85 1.71 -4.61 1.98 5.68 -1.26 -5.09 116.55 115.80 1qk1 n ASP 190 Ca -0.19 -2.56 -0.52 0.00 -0.50 0.00 0.00 54.79 51.02 1qk1 n ASP 190 Cb 0.58 0.59 -0.06 0.00 -1.14 0.00 0.00 41.12 41.09 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 -0.73 1.24 -1.78 0.11 4.81 -1.26 -4.86 118.16 115.69 1qk1 n LYS 191 Ca -0.07 0.45 -0.40 0.00 -0.87 0.00 0.00 58.31 57.41 1qk1 n LYS 191 Cb 0.44 -2.11 0.01 0.00 0.02 0.00 0.00 35.03 33.39 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 0.92 3.90 -0.02 1.64 0.02 -1.26 -4.91 135.00 135.29 1qk1 s PRO 192 Ca 0.86 2.53 0.04 0.00 0.02 0.00 0.00 61.00 64.45 1qk1 s PRO 192 Cb -0.94 -2.82 -0.06 0.00 0.02 0.00 0.00 34.50 30.69 1qk1 s PRO 192 CO 0.48 -0.68 0.07 1.33 -0.33 0.00 0.00 177.00 177.87 1qk1 n VAL 193 N 0.15 0.11 -1.67 3.83 0.24 -1.26 -4.85 118.33 114.87 1qk1 n VAL 193 Ca 0.03 -0.13 -0.48 0.00 -2.04 0.00 0.00 64.34 61.72 1qk1 n VAL 193 Cb 0.40 -0.07 -0.05 0.00 -1.47 0.00 0.00 33.84 32.65 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 -1.84 3.13 0.19 -1.34 2.88 -1.26 -4.84 113.62 110.54 1qk1 n SER 194 Ca -0.03 1.04 0.14 0.00 -1.33 0.00 0.00 58.87 58.69 1qk1 n SER 194 Cb 0.31 -1.38 0.62 0.00 -0.75 0.00 0.00 64.21 63.02 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 7.32 0.00 0.00 -1.46 0.13 -1.99 -0.95 132.00 135.05 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 0.91 0.00 -0.35 -0.07 -0.23 0.00 0.00 178.00 178.26 1qk1 h LEU 196 N 0.00 0.00 0.10 1.56 3.38 -1.93 -2.15 115.31 116.26 1qk1 h LEU 196 Ca 0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 1qk1 h LEU 196 Cb 0.29 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1qk1 h LEU 196 CO 0.00 0.35 -1.98 0.18 0.09 0.00 0.00 178.44 177.08 1qk1 n LEU 197 N -3.92 2.58 0.04 1.67 4.32 -0.45 -3.92 117.00 117.32 1qk1 n LEU 197 Ca -0.02 0.20 -0.05 0.00 -0.02 0.00 0.00 56.01 56.12 1qk1 n LEU 197 Cb 0.41 -1.08 0.15 0.00 -1.62 0.00 0.00 43.42 41.28 1qk1 n LEU 197 CO 0.37 0.79 0.59 0.71 -1.22 0.00 0.00 177.39 178.64 1qk1 h THR 198 N -0.08 1.31 0.00 -5.08 1.35 -1.37 -2.42 112.91 106.62 1qk1 h THR 198 Ca -0.44 -1.61 0.00 0.00 -0.55 0.00 0.00 66.41 63.81 1qk1 h THR 198 Cb 1.93 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 70.01 1qk1 h THR 198 CO 0.02 0.49 0.00 0.00 -0.25 0.00 0.00 175.52 175.79 1qk1 h ALA 199 N 1.20 1.00 -0.37 6.62 0.00 -1.58 -1.02 119.26 125.11 1qk1 h ALA 199 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1qk1 h ALA 199 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1qk1 h ALA 199 CO 0.08 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.33 1qk1 n ALA 200 N -2.08 2.45 -1.55 0.00 0.00 -0.95 -4.26 120.51 114.13 1qk1 n ALA 200 Ca -0.00 -0.73 -0.11 0.00 0.00 0.00 0.00 53.44 52.60 1qk1 n ALA 200 Cb 0.26 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 18.68 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 1.20 0.92 0.36 0.00 0.00 -0.39 -4.40 105.19 102.89 1qk1 n GLY 201 Ca 0.15 -0.48 0.07 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.53 1.47 -0.03 1.61 2.00 -0.99 -3.60 117.12 115.04 1qk1 n MET 202 Ca -0.12 -0.72 0.01 0.00 0.00 0.00 0.00 57.70 56.88 1qk1 n MET 202 Cb 0.43 -1.27 0.03 0.00 0.00 0.00 0.00 33.22 32.41 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 0.00 2.06 -1.75 3.04 0.00 -1.26 -4.91 120.51 117.69 1qk1 n ALA 203 Ca 0.11 -1.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.17 1qk1 n ALA 203 Cb 0.20 -0.08 0.05 0.00 0.00 0.00 0.00 19.45 19.62 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 -0.28 1.67 -1.27 0.00 1.74 -1.24 -3.08 116.66 114.20 1qk1 n ARG 204 Ca 0.02 0.62 -0.11 0.00 -0.77 0.00 0.00 57.85 57.61 1qk1 n ARG 204 Cb 0.27 -2.59 -0.05 0.00 -1.02 0.00 0.00 32.46 29.08 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 -1.10 -5.28 -4.68 0.55 8.00 -1.26 -4.88 116.55 107.90 1qk1 n ASP 205 Ca 0.11 0.26 -0.44 0.00 0.71 0.00 0.00 54.79 55.43 1qk1 n ASP 205 Cb 0.45 -3.95 -0.02 0.00 -0.02 0.00 0.00 41.12 37.58 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 -2.08 2.22 -0.86 1.24 -0.00 -1.18 -0.63 117.44 116.16 1qk1 n TRP 206 Ca -0.11 0.47 0.04 0.00 -0.00 0.00 0.00 57.50 57.90 1qk1 n TRP 206 Cb 0.55 -2.45 0.37 0.00 -0.00 0.00 0.00 31.31 29.79 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 1.47 4.50 -1.66 5.87 -0.04 -1.26 -5.12 135.00 138.77 1qk1 n PRO 207 Ca 0.09 -3.02 -0.55 0.00 -0.04 0.00 0.00 63.50 59.98 1qk1 n PRO 207 Cb 0.33 -2.23 -0.07 0.00 -0.04 0.00 0.00 33.50 31.49 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 0.43 2.07 -0.45 3.54 -0.08 0.20 -1.76 116.55 120.50 1qk1 n ASP 208 Ca 0.30 1.09 -0.06 0.00 -1.51 0.00 0.00 54.79 54.61 1qk1 n ASP 208 Cb 1.22 -1.16 -0.03 0.00 2.34 0.00 0.00 41.12 43.49 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 4.19 -0.09 -2.83 -1.67 0.00 -1.26 -4.97 120.51 113.88 1qk1 n ALA 209 Ca 0.23 0.10 -0.33 0.00 0.00 0.00 0.00 53.44 53.44 1qk1 n ALA 209 Cb 0.15 -1.29 -0.05 0.00 0.00 0.00 0.00 19.45 18.27 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 -2.15 3.51 0.30 0.00 1.81 -0.72 -4.65 118.95 117.04 1qk1 s ARG 210 Ca 0.00 -0.25 -0.19 0.00 -1.72 0.00 0.00 55.73 53.57 1qk1 s ARG 210 Cb 0.00 -3.03 0.03 0.00 -0.45 0.00 0.00 34.95 31.50 1qk1 s ARG 210 CO 0.00 0.61 0.71 0.20 -0.68 0.00 0.00 175.30 176.14 1qk1 s GLY 211 N -2.16 0.10 -0.03 -3.53 0.00 -0.99 -2.44 107.32 98.28 1qk1 s GLY 211 Ca 0.33 -0.49 0.04 0.00 0.00 0.00 0.00 44.72 44.60 1qk1 s GLY 211 CO 0.22 -0.21 -0.14 -0.42 0.00 0.00 0.00 173.10 172.56 1qk1 s ILE 212 N -3.54 1.12 -0.01 0.90 1.01 0.20 -1.18 121.20 119.69 1qk1 s ILE 212 Ca 0.13 -0.56 0.02 0.00 0.00 0.00 0.00 60.65 60.24 1qk1 s ILE 212 Cb -0.05 -0.96 0.00 0.00 0.01 0.00 0.00 42.46 41.46 1qk1 s ILE 212 CO 0.08 0.33 -0.07 0.86 0.00 0.00 0.00 174.94 176.14 1qk1 s TRP 213 N -0.04 0.70 0.03 3.97 -0.00 -0.31 0.08 118.94 123.37 1qk1 s TRP 213 Ca -0.00 -0.15 -0.09 0.00 -0.00 0.00 0.00 56.10 55.86 1qk1 s TRP 213 Cb -0.08 -0.49 0.00 0.00 -0.00 0.00 0.00 33.47 32.90 1qk1 s TRP 213 CO 0.01 -0.05 0.18 -3.38 -0.00 0.00 0.00 176.95 173.70 1qk1 s HIS 214 N 0.07 0.06 0.79 5.86 -3.43 -1.04 -0.19 115.29 117.42 1qk1 s HIS 214 Ca -0.01 -0.25 -0.12 0.00 -0.80 0.00 0.00 55.06 53.89 1qk1 s HIS 214 Cb -0.06 -0.04 0.07 0.00 -1.43 0.00 0.00 32.58 31.12 1qk1 s HIS 214 CO -0.00 -0.39 1.10 0.54 -2.00 0.00 0.00 174.74 173.99 1qk1 s ASN 215 N -1.92 4.55 0.28 7.38 4.22 -0.81 -1.81 114.94 126.84 1qk1 s ASN 215 Ca -0.07 1.24 -0.02 0.00 -2.14 0.00 0.00 52.86 51.86 1qk1 s ASN 215 Cb -0.03 -1.96 0.41 0.00 1.28 0.00 0.00 41.25 40.96 1qk1 s ASN 215 CO -0.02 -1.93 1.93 0.78 -2.04 0.00 0.00 177.10 175.82 1qk1 h ASN 216 N -1.06 1.01 -0.02 3.54 2.35 -1.41 -1.88 115.58 118.11 1qk1 h ASN 216 Ca -0.47 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 1qk1 h ASN 216 Cb 1.27 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.41 1qk1 h ASN 216 CO 0.60 0.69 0.00 -1.84 -1.65 0.00 0.00 177.43 175.24 1qk1 n GLU 217 N -4.44 1.06 -3.70 0.81 0.28 -1.26 -4.92 120.64 108.48 1qk1 n GLU 217 Ca 0.12 -0.10 -0.24 0.00 -0.16 0.00 0.00 57.16 56.79 1qk1 n GLU 217 Cb 0.09 -1.21 0.05 0.00 1.43 0.00 0.00 31.44 31.80 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 -0.60 -5.81 0.00 3.44 5.02 -0.71 -4.91 118.16 114.59 1qk1 n LYS 218 Ca 0.10 0.68 0.00 0.00 -2.02 0.00 0.00 58.31 57.07 1qk1 n LYS 218 Cb 0.07 -5.48 0.00 0.00 -0.02 0.00 0.00 35.03 29.60 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 -3.00 0.78 -3.72 4.39 3.41 -1.26 -4.93 113.62 109.29 1qk1 n SER 219 Ca -0.16 -0.97 -0.23 0.00 -0.26 0.00 0.00 58.87 57.25 1qk1 n SER 219 Cb 0.62 0.04 -0.18 0.00 -0.26 0.00 0.00 64.21 64.43 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 -0.04 0.45 -0.03 7.33 5.36 -1.26 -2.12 117.98 127.68 1qk1 s PHE 220 Ca 0.00 -0.11 0.07 0.00 -0.96 0.00 0.00 56.93 55.93 1qk1 s PHE 220 Cb 0.00 -0.71 -0.02 0.00 -0.34 0.00 0.00 43.02 41.96 1qk1 s PHE 220 CO 0.00 -0.33 -0.26 -1.17 -1.46 0.00 0.00 175.22 172.00 1qk1 s LEU 221 N 2.04 2.06 -0.06 6.12 0.20 0.70 -1.92 118.68 127.83 1qk1 s LEU 221 Ca 0.04 -0.48 0.00 0.00 0.69 0.00 0.00 54.13 54.38 1qk1 s LEU 221 Cb -0.13 -1.35 0.02 0.00 -0.43 0.00 0.00 46.19 44.30 1qk1 s LEU 221 CO -0.05 0.30 -0.04 -0.63 -0.29 0.00 0.00 176.35 175.64 1qk1 s ILE 222 N -0.49 0.58 -0.20 6.68 1.01 0.74 -0.09 121.20 129.43 1qk1 s ILE 222 Ca 0.06 -0.08 -0.08 0.00 0.00 0.00 0.00 60.65 60.55 1qk1 s ILE 222 Cb -0.11 -0.64 -0.04 0.00 0.01 0.00 0.00 42.46 41.68 1qk1 s ILE 222 CO 0.00 0.26 0.08 0.26 0.00 0.00 0.00 174.94 175.54 1qk1 s TRP 223 N 1.35 3.23 -0.23 3.97 0.51 -0.18 -1.16 118.94 126.44 1qk1 s TRP 223 Ca -0.04 0.02 -0.07 0.00 -2.12 0.00 0.00 56.10 53.89 1qk1 s TRP 223 Cb -0.13 -2.13 -0.03 0.00 -0.81 0.00 0.00 33.47 30.37 1qk1 s TRP 223 CO -0.03 0.07 0.06 0.08 -0.51 0.00 0.00 176.95 176.62 1qk1 s VAL 224 N 0.64 4.38 -1.44 4.03 1.01 -0.32 -1.45 120.40 127.26 1qk1 s VAL 224 Ca 0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 61.98 61.82 1qk1 s VAL 224 Cb -0.13 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.23 1qk1 s VAL 224 CO 0.01 0.38 0.52 0.59 0.00 0.00 0.00 175.10 176.60 1qk1 n ASN 225 N 4.48 -5.73 0.00 3.32 3.02 0.84 -2.34 115.26 118.86 1qk1 n ASN 225 Ca -0.16 -0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.14 1qk1 n ASN 225 Cb 0.52 -4.57 0.00 0.00 -0.61 0.00 0.00 39.78 35.12 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 -3.67 0.00 -0.60 3.52 2.13 -1.26 -4.79 120.64 115.97 1qk1 n GLU 226 Ca -0.11 0.00 0.09 0.00 0.66 0.00 0.00 57.16 57.79 1qk1 n GLU 226 Cb 0.62 0.00 0.34 0.00 0.27 0.00 0.00 31.44 32.67 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 3.63 -3.77 5.31 0.28 -1.26 -4.91 120.64 119.91 1qk1 n GLU 227 Ca 0.00 -2.72 -0.04 0.00 -0.16 0.00 0.00 57.16 54.25 1qk1 n GLU 227 Cb 0.00 -1.88 -0.01 0.00 1.43 0.00 0.00 31.44 30.98 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 -0.86 -0.16 0.13 -1.84 1.01 -1.26 -4.70 116.67 108.98 1qk1 s ASP 228 Ca 0.49 -0.46 -0.20 0.00 0.71 0.00 0.00 52.55 53.09 1qk1 s ASP 228 Cb 0.31 0.51 -0.03 0.00 1.01 0.00 0.00 42.92 44.72 1qk1 s ASP 228 CO 0.23 -0.95 1.70 0.45 0.21 0.00 0.00 175.17 176.81 1qk1 h HIS 229 N 2.00 -0.11 -3.79 4.23 3.86 -1.92 -3.13 115.15 116.29 1qk1 h HIS 229 Ca -0.24 0.02 -0.20 0.00 -1.16 0.00 0.00 60.37 58.78 1qk1 h HIS 229 Cb 1.23 0.08 -0.25 0.00 1.06 0.00 0.00 27.41 29.53 1qk1 h HIS 229 CO 0.48 -0.09 -0.69 0.95 0.86 0.00 0.00 177.93 179.44 1qk1 s THR 230 N -6.20 0.04 -0.17 2.45 -4.23 -1.01 -0.11 115.64 106.42 1qk1 s THR 230 Ca -0.13 -0.36 0.01 0.00 -1.18 0.00 0.00 61.69 60.02 1qk1 s THR 230 Cb 0.10 -0.13 0.02 0.00 1.34 0.00 0.00 72.50 73.83 1qk1 s THR 230 CO 0.68 -0.20 -0.20 -0.13 -0.54 0.00 0.00 174.62 174.23 1qk1 s ARG 231 N -0.59 2.93 -0.20 3.99 1.81 -0.53 -1.94 118.95 124.43 1qk1 s ARG 231 Ca -0.06 -0.81 -0.06 0.00 -1.72 0.00 0.00 55.73 53.07 1qk1 s ARG 231 Cb -0.04 -2.50 -0.03 0.00 -0.45 0.00 0.00 34.95 31.93 1qk1 s ARG 231 CO -0.00 -0.17 0.04 0.08 -0.68 0.00 0.00 175.30 174.56 1qk1 s VAL 232 N 1.21 4.39 -0.04 3.52 1.01 0.78 -1.01 120.40 130.26 1qk1 s VAL 232 Ca 0.03 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 61.87 1qk1 s VAL 232 Cb -0.13 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.26 1qk1 s VAL 232 CO -0.11 0.43 -0.11 -0.63 0.00 0.00 0.00 175.10 174.69 1qk1 s ILE 233 N 0.76 0.94 -0.14 2.22 1.01 0.87 -1.39 121.20 125.48 1qk1 s ILE 233 Ca 0.02 -0.43 0.02 0.00 0.00 0.00 0.00 60.65 60.26 1qk1 s ILE 233 Cb -0.14 -0.84 0.00 0.00 0.01 0.00 0.00 42.46 41.49 1qk1 s ILE 233 CO 0.02 0.29 -0.19 -0.55 0.00 0.00 0.00 174.94 174.51 1qk1 s SER 234 N 0.29 3.37 0.07 3.58 0.15 -0.42 -0.21 113.70 120.53 1qk1 s SER 234 Ca -0.06 -0.53 -0.05 0.00 0.70 0.00 0.00 55.95 56.01 1qk1 s SER 234 Cb -0.11 -1.49 -0.02 0.00 -1.71 0.00 0.00 66.02 62.69 1qk1 s SER 234 CO 0.01 0.10 0.10 0.00 1.20 0.00 0.00 173.24 174.65 1qk1 s MET 235 N 0.72 0.74 -0.04 5.44 0.23 -0.90 -0.93 119.30 124.55 1qk1 s MET 235 Ca -0.08 -1.05 -0.30 0.00 -1.03 0.00 0.00 55.69 53.23 1qk1 s MET 235 Cb -0.16 0.28 0.08 0.00 -1.53 0.00 0.00 34.83 33.51 1qk1 s MET 235 CO 0.01 -0.20 0.74 -1.21 -2.03 0.00 0.00 175.02 172.33 1qk1 s GLU 236 N -3.83 1.00 0.38 3.16 2.02 -0.81 -4.58 118.70 116.03 1qk1 s GLU 236 Ca 0.05 0.11 -0.21 0.00 0.02 0.00 0.00 54.97 54.94 1qk1 s GLU 236 Cb 0.06 0.47 -0.10 0.00 0.10 0.00 0.00 34.13 34.65 1qk1 s GLU 236 CO -0.10 -0.34 0.90 0.15 0.02 0.00 0.00 175.26 175.89 1qk1 s LYS 237 N -1.64 4.28 0.00 1.61 1.02 -1.26 -1.45 119.74 122.30 1qk1 s LYS 237 Ca -0.07 1.09 0.00 0.00 0.02 0.00 0.00 55.97 57.01 1qk1 s LYS 237 Cb -0.00 -2.41 0.00 0.00 -0.52 0.00 0.00 37.83 34.90 1qk1 s LYS 237 CO 0.04 0.10 0.00 0.41 -0.92 0.00 0.00 175.35 174.98 1qk1 n GLY 238 N -0.23 -1.42 0.86 -3.33 0.00 0.95 -4.75 105.19 97.27 1qk1 n GLY 238 Ca 0.05 -2.07 0.05 0.00 0.00 0.00 0.00 46.02 44.04 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 2.78 2.68 -0.02 0.00 -1.26 -2.98 105.19 106.39 1qk1 n GLY 239 Ca 0.00 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.36 5.72 -0.33 1.61 4.05 -1.26 -0.39 115.26 124.30 1qk1 n ASN 240 Ca 0.11 -2.96 0.11 0.00 0.45 0.00 0.00 54.58 52.29 1qk1 n ASN 240 Cb 0.86 -1.53 0.32 0.00 1.23 0.00 0.00 39.78 40.66 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 -0.51 1.20 1.85 -1.62 -1.64 114.93 120.53 1qk1 h MET 241 Ca 0.57 -0.05 0.03 0.00 -0.61 0.00 0.00 59.70 59.64 1qk1 h MET 241 Cb 0.53 -0.18 -0.04 0.00 0.43 0.00 0.00 31.60 32.34 1qk1 h MET 241 CO 1.71 0.52 0.28 -0.22 -0.40 0.00 0.00 176.91 178.80 1qk1 h LYS 242 N 0.82 0.54 -0.37 0.39 3.64 -1.58 0.56 116.57 120.56 1qk1 h LYS 242 Ca 0.51 -0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.74 1qk1 h LYS 242 Cb 0.72 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 1qk1 h LYS 242 CO -0.28 0.35 -0.27 -0.09 -2.27 0.00 0.00 179.45 176.89 1qk1 h ARG 243 N 0.55 0.78 -0.69 1.90 2.43 -1.60 -1.26 114.38 116.49 1qk1 h ARG 243 Ca 0.22 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1qk1 h ARG 243 Cb 0.08 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 1qk1 h ARG 243 CO -0.13 0.96 0.43 0.28 -1.51 0.00 0.00 179.97 180.00 1qk1 h VAL 244 N 0.67 1.19 -0.05 0.20 2.07 -0.80 -1.88 116.25 117.64 1qk1 h VAL 244 Ca 0.08 -0.39 -0.13 0.00 0.82 0.00 0.00 66.70 67.08 1qk1 h VAL 244 Cb 0.79 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1qk1 h VAL 244 CO 0.07 0.19 -0.58 0.15 0.02 0.00 0.00 177.57 177.41 1qk1 h PHE 245 N 0.93 0.18 -0.41 1.57 3.57 -0.69 -1.67 116.94 120.42 1qk1 h PHE 245 Ca 0.25 -0.07 -0.12 0.00 3.53 0.00 0.00 57.97 61.56 1qk1 h PHE 245 Cb -0.06 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 1qk1 h PHE 245 CO -0.02 0.69 -0.21 0.93 -2.23 0.00 0.00 178.31 177.47 1qk1 h GLU 246 N 0.11 0.88 -0.66 1.11 5.08 -0.86 -1.02 114.58 119.22 1qk1 h GLU 246 Ca -0.00 -0.39 -0.09 0.00 -1.00 0.00 0.00 59.36 57.88 1qk1 h GLU 246 Cb 1.06 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 1qk1 h GLU 246 CO 0.08 1.04 0.08 -0.09 -1.00 0.00 0.00 179.01 179.12 1qk1 h ARG 247 N 0.70 1.12 0.23 2.33 2.43 -1.29 -0.41 114.38 119.49 1qk1 h ARG 247 Ca 0.09 -0.31 0.01 0.00 -0.81 0.00 0.00 59.98 58.95 1qk1 h ARG 247 Cb 0.78 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.18 1qk1 h ARG 247 CO 0.06 1.03 -0.27 0.35 -1.51 0.00 0.00 179.97 179.64 1qk1 h PHE 248 N 1.04 -0.71 -0.81 2.20 3.57 -1.06 0.25 116.94 121.42 1qk1 h PHE 248 Ca 0.20 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.67 1qk1 h PHE 248 Cb 0.48 0.28 -0.04 0.00 2.79 0.00 0.00 35.95 39.46 1qk1 h PHE 248 CO 0.04 -0.38 0.36 0.00 -2.23 0.00 0.00 178.31 176.09 1qk1 h ARG 250 N 1.16 0.22 -0.69 0.00 2.43 -0.88 -2.35 114.38 114.28 1qk1 h ARG 250 Ca 0.27 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.38 1qk1 h ARG 250 Cb 0.16 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 1qk1 h ARG 250 CO -0.03 0.45 0.45 0.78 -1.51 0.00 0.00 179.97 180.11 1qk1 h GLY 251 N -0.04 0.98 1.03 2.80 0.00 -0.84 -1.76 103.07 105.23 1qk1 h GLY 251 Ca 0.04 -0.37 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 1qk1 h GLY 251 CO 0.01 0.36 0.23 1.41 0.00 0.00 0.00 176.54 178.55 1qk1 h LEU 252 N 0.94 0.96 -0.84 3.11 3.38 -1.31 -0.89 115.31 120.65 1qk1 h LEU 252 Ca 0.25 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 1qk1 h LEU 252 Cb -0.10 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.39 1qk1 h LEU 252 CO -0.05 0.90 -0.24 0.11 0.09 0.00 0.00 178.44 179.25 1qk1 h LYS 253 N 0.97 0.59 -0.28 1.13 1.57 -1.19 -0.89 116.57 118.48 1qk1 h LYS 253 Ca 0.22 -0.23 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 1qk1 h LYS 253 Cb 0.27 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1qk1 h LYS 253 CO -0.01 0.78 -0.20 1.49 -0.57 0.00 0.00 179.45 180.95 1qk1 h GLU 254 N 0.52 0.62 -0.59 3.15 4.57 -1.09 -1.27 114.58 120.50 1qk1 h GLU 254 Ca 0.08 -0.30 -0.08 0.00 -1.18 0.00 0.00 59.36 57.88 1qk1 h GLU 254 Cb 0.69 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.26 1qk1 h GLU 254 CO 0.05 0.89 0.07 0.28 -1.18 0.00 0.00 179.01 179.12 1qk1 h VAL 255 N 0.36 1.26 -0.57 0.32 2.07 -1.03 -1.68 116.25 116.97 1qk1 h VAL 255 Ca 0.05 -1.04 -0.08 0.00 0.82 0.00 0.00 66.70 66.46 1qk1 h VAL 255 Cb 0.74 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1qk1 h VAL 255 CO 0.05 0.38 0.05 -0.08 0.02 0.00 0.00 177.57 178.00 1qk1 h GLU 256 N 0.90 0.95 -0.32 1.57 4.81 -1.08 -1.99 114.58 119.42 1qk1 h GLU 256 Ca 0.18 -0.25 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1qk1 h GLU 256 Cb 0.47 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1qk1 h GLU 256 CO 0.02 0.91 0.20 -0.09 -0.73 0.00 0.00 179.01 179.31 1qk1 h ARG 257 N 0.89 0.43 -0.32 1.92 2.43 -0.92 -2.18 114.38 116.63 1qk1 h ARG 257 Ca 0.17 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.25 1qk1 h ARG 257 Cb 0.45 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1qk1 h ARG 257 CO 0.02 0.32 -0.04 -0.07 -1.51 0.00 0.00 179.97 178.69 1qk1 h LEU 258 N 0.41 0.48 0.00 3.80 3.38 -1.01 -2.51 115.31 119.87 1qk1 h LEU 258 Ca 0.11 -0.10 -0.16 0.00 0.09 0.00 0.00 57.88 57.82 1qk1 h LEU 258 Cb -0.00 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1qk1 h LEU 258 CO -0.02 0.58 -0.79 0.16 0.09 0.00 0.00 178.44 178.46 1qk1 h ILE 259 N 0.49 1.34 0.00 1.22 3.07 -1.21 -3.19 117.51 119.22 1qk1 h ILE 259 Ca 0.10 -2.90 -0.05 0.00 1.55 0.00 0.00 64.86 63.57 1qk1 h ILE 259 Cb 0.37 2.66 -0.01 0.00 -0.27 0.00 0.00 36.82 39.58 1qk1 h ILE 259 CO 0.02 0.76 -0.22 1.56 -1.05 0.00 0.00 178.15 179.21 1qk1 h GLN 260 N 0.00 0.00 0.00 0.16 4.20 -1.13 -1.42 115.11 116.91 1qk1 h GLN 260 Ca -0.01 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.65 1qk1 h GLN 260 Cb 1.60 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.38 1qk1 h GLN 260 CO 0.10 0.22 -0.25 1.49 -0.67 0.00 0.00 178.83 179.72 1qk1 h GLU 261 N 0.00 0.00 -0.64 1.46 4.81 -1.44 -1.95 114.58 116.83 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 0.65 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1qk1 h GLU 261 CO 0.03 0.25 0.00 0.54 -0.73 0.00 0.00 179.01 179.10 1qk1 n ARG 262 N -4.03 3.30 -0.47 1.92 5.12 -0.80 -4.96 116.66 116.73 1qk1 n ARG 262 Ca -0.02 -2.74 0.00 0.00 -1.93 0.00 0.00 57.85 53.16 1qk1 n ARG 262 Cb 0.32 -1.73 0.00 0.00 -1.16 0.00 0.00 32.46 29.89 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 1.18 0.76 3.84 -0.13 0.00 -0.73 -5.08 105.19 105.02 1qk1 n GLY 263 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.27 3.17 0.21 1.61 0.52 -0.60 -4.98 118.94 116.59 1qk1 s TRP 264 Ca 0.00 -0.08 0.02 0.00 0.02 0.00 0.00 56.10 56.05 1qk1 s TRP 264 Cb 0.00 -1.44 -0.05 0.00 -1.15 0.00 0.00 33.47 30.83 1qk1 s TRP 264 CO 0.00 0.51 0.04 -1.21 0.02 0.00 0.00 176.95 176.31 1qk1 s GLU 265 N -3.74 1.23 0.30 4.98 2.02 -1.26 -3.26 118.70 118.96 1qk1 s GLU 265 Ca 0.33 -1.63 -0.09 0.00 0.02 0.00 0.00 54.97 53.60 1qk1 s GLU 265 Cb -0.08 -0.27 -0.07 0.00 0.10 0.00 0.00 34.13 33.81 1qk1 s GLU 265 CO 0.25 -0.19 0.62 -0.06 0.02 0.00 0.00 175.26 175.90 1qk1 s PHE 266 N -3.69 3.45 -0.13 1.61 0.08 -1.26 -0.82 117.98 117.22 1qk1 s PHE 266 Ca 0.30 0.87 -0.29 0.00 0.12 0.00 0.00 56.93 57.92 1qk1 s PHE 266 Cb 0.07 -2.28 -0.01 0.00 -0.57 0.00 0.00 43.02 40.23 1qk1 s PHE 266 CO 0.08 0.14 1.10 -1.64 -0.10 0.00 0.00 175.22 174.80 1qk1 s MET 267 N -3.30 4.34 -0.09 0.44 -1.94 0.17 -4.58 119.30 114.34 1qk1 s MET 267 Ca 0.48 1.50 -0.30 0.00 -1.71 0.00 0.00 55.69 55.66 1qk1 s MET 267 Cb -0.11 -3.60 0.07 0.00 2.01 0.00 0.00 34.83 33.21 1qk1 s MET 267 CO 0.26 -0.47 0.69 -0.46 -0.01 0.00 0.00 175.02 175.03 1qk1 s TRP 268 N 2.52 -0.68 0.12 -0.03 -0.00 -1.26 -2.04 118.94 117.58 1qk1 s TRP 268 Ca 0.50 1.26 -0.14 0.00 -0.00 0.00 0.00 56.10 57.73 1qk1 s TRP 268 Cb -0.20 0.39 0.02 0.00 -0.00 0.00 0.00 33.47 33.68 1qk1 s TRP 268 CO 0.16 -0.56 0.34 0.54 -0.00 0.00 0.00 176.95 177.43 1qk1 s ASN 269 N -0.91 -0.12 0.38 5.86 2.20 -0.95 -4.99 114.94 116.41 1qk1 s ASN 269 Ca -0.09 -0.46 0.28 0.00 -0.94 0.00 0.00 52.86 51.65 1qk1 s ASN 269 Cb -0.01 0.44 1.15 0.00 -2.00 0.00 0.00 41.25 40.83 1qk1 s ASN 269 CO 0.08 -0.84 1.83 1.05 -2.94 0.00 0.00 177.10 176.28 1qk1 h GLU 270 N 2.47 0.00 0.00 3.55 4.11 -1.89 0.96 114.58 123.78 1qk1 h GLU 270 Ca -0.33 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 58.96 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 -1.72 2.89 0.07 0.00 0.00 179.01 180.74 1qk1 n ARG 271 N -2.59 0.64 0.00 1.06 1.85 -1.26 -0.92 116.66 115.45 1qk1 n ARG 271 Ca 0.01 0.04 0.02 0.00 -1.00 0.00 0.00 57.85 56.92 1qk1 n ARG 271 Cb 0.26 -1.67 0.00 0.00 -1.05 0.00 0.00 32.46 30.00 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 -2.65 0.83 0.00 2.89 4.77 -1.19 -4.29 117.00 117.35 1qk1 n LEU 272 Ca -0.11 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.08 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 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 1qk1 n GLY 273 N 0.57 1.21 3.74 -0.72 0.00 0.32 -0.24 105.19 110.08 1qk1 n GLY 273 Ca 0.02 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 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 3.38 -0.18 1.61 2.02 -0.40 -2.23 117.35 121.55 1qk1 s TYR 274 Ca 0.00 1.44 -0.15 0.00 -0.37 0.00 0.00 57.07 57.99 1qk1 s TYR 274 Cb 0.00 -3.46 -0.04 0.00 -0.40 0.00 0.00 41.96 38.06 1qk1 s TYR 274 CO 0.00 -1.27 0.35 0.42 -1.57 0.00 0.00 175.55 173.48 1qk1 s ILE 275 N -0.35 5.25 0.30 2.71 1.01 -0.86 -3.33 121.20 125.93 1qk1 s ILE 275 Ca 0.51 0.63 0.02 0.00 0.00 0.00 0.00 60.65 61.82 1qk1 s ILE 275 Cb -0.34 -3.68 -0.05 0.00 0.01 0.00 0.00 42.46 38.40 1qk1 s ILE 275 CO 0.39 0.31 0.11 -0.76 0.00 0.00 0.00 174.94 175.00 1qk1 s LEU 276 N 0.93 1.79 0.27 2.97 1.43 -1.26 -4.15 118.68 120.66 1qk1 s LEU 276 Ca 0.18 -1.46 0.06 0.00 -1.03 0.00 0.00 54.13 51.88 1qk1 s LEU 276 Cb -0.14 -0.03 0.36 0.00 0.03 0.00 0.00 46.19 46.41 1qk1 s LEU 276 CO 0.06 -0.77 1.63 0.00 0.23 0.00 0.00 176.35 177.51 1qk1 h THR 277 N 2.22 1.36 -3.41 5.49 1.03 -1.87 -3.42 112.91 114.30 1qk1 h THR 277 Ca -0.37 -1.79 -0.61 0.00 -0.01 0.00 0.00 66.41 63.62 1qk1 h THR 277 Cb 1.25 1.89 -0.15 0.00 -1.07 0.00 0.00 68.15 70.07 1qk1 h THR 277 CO 0.60 0.53 -0.53 0.00 -0.01 0.00 0.00 175.52 176.11 1qk1 h PRO 279 N 7.06 0.00 0.00 0.00 0.11 -1.82 -0.41 132.00 136.95 1qk1 h PRO 279 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1qk1 h PRO 279 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1qk1 h PRO 279 CO 0.69 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.14 1qk1 h SER 280 N 0.00 0.00 -0.58 -2.05 4.64 -1.94 -3.03 113.55 110.59 1qk1 h SER 280 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1qk1 h SER 280 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 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 4.85 -4.08 4.97 3.02 -0.16 -4.91 115.26 116.12 1qk1 n ASN 281 Ca 0.01 -2.60 -0.29 0.00 -0.03 0.00 0.00 54.58 51.66 1qk1 n ASN 281 Cb 0.26 -0.59 0.24 0.00 -0.61 0.00 0.00 39.78 39.08 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 -2.13 0.55 0.00 3.41 1.02 -1.15 -2.69 118.68 117.70 1qk1 s LEU 282 Ca 0.50 0.96 0.00 0.00 0.02 0.00 0.00 54.13 55.61 1qk1 s LEU 282 Cb 0.34 -2.77 0.00 0.00 0.02 0.00 0.00 46.19 43.79 1qk1 s LEU 282 CO 0.21 -4.17 0.00 0.61 0.02 0.00 0.00 176.35 173.02 1qk1 n GLY 283 N -0.21 1.90 0.01 -3.19 0.00 0.67 -2.67 105.19 101.69 1qk1 n GLY 283 Ca 0.09 0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 -1.99 2.61 -2.24 -0.84 -1.27 114.28 110.55 1qk1 n THR 284 Ca 0.00 -0.29 -0.14 0.00 -2.27 0.00 0.00 64.05 61.35 1qk1 n THR 284 Cb 0.00 0.20 -0.03 0.00 -2.10 0.00 0.00 70.33 68.40 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 1.78 0.31 3.78 3.38 0.00 -1.09 -4.61 105.19 108.74 1qk1 n GLY 285 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 -4.91 4.34 -0.30 0.99 0.20 -1.26 -4.05 118.68 113.70 1qk1 s LEU 286 Ca 0.00 0.69 0.01 0.00 0.69 0.00 0.00 54.13 55.53 1qk1 s LEU 286 Cb 0.00 -2.45 0.09 0.00 -0.43 0.00 0.00 46.19 43.39 1qk1 s LEU 286 CO 0.00 0.19 0.04 -0.13 -0.29 0.00 0.00 176.35 176.16 1qk1 s ARG 287 N -0.18 1.24 -0.21 1.98 1.81 -0.46 -4.85 118.95 118.29 1qk1 s ARG 287 Ca 0.20 -1.32 -0.07 0.00 -1.72 0.00 0.00 55.73 52.81 1qk1 s ARG 287 Cb -0.14 -2.59 -0.04 0.00 -0.45 0.00 0.00 34.95 31.73 1qk1 s ARG 287 CO 0.08 -0.85 0.07 0.00 -0.68 0.00 0.00 175.30 173.91 1qk1 s ALA 288 N 1.31 3.33 0.35 2.13 0.00 -1.26 -1.27 121.76 126.35 1qk1 s ALA 288 Ca 0.05 -0.88 -0.12 0.00 0.00 0.00 0.00 51.96 51.02 1qk1 s ALA 288 Cb -0.18 -1.98 0.03 0.00 0.00 0.00 0.00 23.12 20.98 1qk1 s ALA 288 CO -0.13 -0.05 0.66 0.20 0.00 0.00 0.00 175.76 176.44 1qk1 s GLY 289 N 0.80 0.67 0.11 0.00 0.00 0.15 -2.57 107.32 106.48 1qk1 s GLY 289 Ca 0.04 -0.95 -0.00 0.00 0.00 0.00 0.00 44.72 43.81 1qk1 s GLY 289 CO 0.02 -0.52 0.01 -1.34 0.00 0.00 0.00 173.10 171.27 1qk1 s VAL 290 N -2.85 0.33 -0.29 1.40 -7.23 -0.39 -1.36 120.40 110.01 1qk1 s VAL 290 Ca 0.20 -1.90 -0.08 0.00 -1.81 0.00 0.00 61.98 58.39 1qk1 s VAL 290 Cb -0.03 -1.88 0.00 0.00 0.56 0.00 0.00 36.38 35.02 1qk1 s VAL 290 CO 0.13 -0.65 0.10 -1.00 -0.31 0.00 0.00 175.10 173.37 1qk1 s HIS 291 N -3.88 3.15 0.06 2.82 3.76 -0.67 -1.64 115.29 118.88 1qk1 s HIS 291 Ca 0.18 -0.80 0.06 0.00 -0.15 0.00 0.00 55.06 54.35 1qk1 s HIS 291 Cb 0.07 -2.28 -0.03 0.00 1.11 0.00 0.00 32.58 31.45 1qk1 s HIS 291 CO -0.02 -0.52 -0.17 -1.50 -0.85 0.00 0.00 174.74 171.69 1qk1 s ILE 292 N 1.54 1.33 -0.43 0.60 2.07 -0.10 -0.13 121.20 126.08 1qk1 s ILE 292 Ca 0.04 -1.20 -0.17 0.00 -1.41 0.00 0.00 60.65 57.91 1qk1 s ILE 292 Cb -0.17 -1.20 0.03 0.00 0.13 0.00 0.00 42.46 41.25 1qk1 s ILE 292 CO 0.04 -0.02 0.42 -0.54 -1.91 0.00 0.00 174.94 172.93 1qk1 s LYS 293 N -1.41 3.05 -0.60 3.50 1.02 0.25 -0.83 119.74 124.72 1qk1 s LYS 293 Ca 0.03 -0.91 0.06 0.00 0.02 0.00 0.00 55.97 55.17 1qk1 s LYS 293 Cb -0.09 -4.01 0.29 0.00 -0.52 0.00 0.00 37.83 33.51 1qk1 s LYS 293 CO 0.02 -0.89 0.83 1.28 -0.92 0.00 0.00 175.35 175.67 1qk1 n LEU 294 N 5.51 3.90 -0.01 3.17 4.77 0.76 -4.90 117.00 130.19 1qk1 n LEU 294 Ca -0.09 -5.52 -0.02 0.00 -0.03 0.00 0.00 56.01 50.35 1qk1 n LEU 294 Cb 0.47 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 41.01 1qk1 n LEU 294 CO 0.46 2.20 0.50 -0.65 -1.33 0.00 0.00 177.39 178.57 1qk1 h PRO 295 N 3.58 -0.07 -0.04 3.23 0.11 -1.91 0.67 132.00 137.58 1qk1 h PRO 295 Ca 0.16 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.27 1qk1 h PRO 295 Cb 0.60 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.73 1qk1 h PRO 295 CO 0.81 -0.04 0.02 -0.07 -0.21 0.00 0.00 178.00 178.50 1qk1 h LEU 296 N -0.07 0.05 -1.20 2.35 4.07 -1.94 -3.18 115.31 115.40 1qk1 h LEU 296 Ca 0.01 -0.15 -0.00 0.00 0.08 0.00 0.00 57.88 57.82 1qk1 h LEU 296 Cb 0.09 -0.01 -0.04 0.00 1.08 0.00 0.00 40.66 41.78 1qk1 h LEU 296 CO -0.08 0.18 0.46 0.25 -1.08 0.00 0.00 178.44 178.18 1qk1 h LEU 297 N -0.09 0.89 -0.98 1.67 5.85 -1.91 -2.64 115.31 118.11 1qk1 h LEU 297 Ca 0.01 -0.04 0.18 0.00 0.84 0.00 0.00 57.88 58.87 1qk1 h LEU 297 Cb 0.15 -0.22 -0.11 0.00 0.37 0.00 0.00 40.66 40.85 1qk1 h LEU 297 CO -0.00 0.67 0.58 -1.28 -0.34 0.00 0.00 178.44 178.07 1qk1 h SER 298 N 1.03 0.74 -0.03 1.25 0.87 -0.83 -1.81 113.55 114.77 1qk1 h SER 298 Ca 0.27 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.93 1qk1 h SER 298 Cb -0.06 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1qk1 h SER 298 CO -0.05 0.27 0.00 0.29 -0.53 0.00 0.00 176.83 176.80 1qk1 n LYS 299 N -4.79 1.42 -2.74 2.24 4.76 -1.00 -4.88 118.16 113.19 1qk1 n LYS 299 Ca 0.22 -0.62 -0.32 0.00 -2.87 0.00 0.00 58.31 54.72 1qk1 n LYS 299 Cb 0.55 -1.46 -0.05 0.00 -1.84 0.00 0.00 35.03 32.23 1qk1 n LYS 299 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1qk1 s ASP 300 N -1.91 6.73 0.00 4.39 -1.08 -0.68 -4.97 116.67 119.15 1qk1 s ASP 300 Ca 0.39 1.49 0.28 0.00 -0.52 0.00 0.00 52.55 54.19 1qk1 s ASP 300 Cb 0.20 -2.46 0.98 0.00 -1.46 0.00 0.00 42.92 40.17 1qk1 s ASP 300 CO 0.33 -0.42 1.74 -1.54 0.52 0.00 0.00 175.17 175.80 1qk1 n SER 301 N -1.02 0.23 0.01 -0.34 3.41 -1.26 -3.48 113.62 111.17 1qk1 n SER 301 Ca 0.05 0.10 0.12 0.00 -0.26 0.00 0.00 58.87 58.88 1qk1 n SER 301 Cb 0.54 -0.18 0.15 0.00 -0.26 0.00 0.00 64.21 64.47 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 -1.43 0.08 -0.21 4.33 1.74 -1.26 -4.42 116.66 115.48 1qk1 n ARG 302 Ca 0.07 0.01 -0.08 0.00 -0.77 0.00 0.00 57.85 57.08 1qk1 n ARG 302 Cb 0.33 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.21 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 0.00 -1.26 -0.83 -1.55 3.57 -1.81 0.35 116.94 115.40 1qk1 h PHE 303 Ca 0.00 0.08 0.24 0.00 3.53 0.00 0.00 57.97 61.82 1qk1 h PHE 303 Cb 0.56 0.63 -0.03 0.00 2.79 0.00 0.00 35.95 39.90 1qk1 h PHE 303 CO 0.00 -0.42 0.62 -1.35 -2.23 0.00 0.00 178.31 174.93 1qk1 h PRO 304 N -0.21 0.00 0.04 6.41 0.11 -1.85 -2.32 132.00 134.18 1qk1 h PRO 304 Ca 0.19 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.19 1qk1 h PRO 304 Cb 0.56 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.67 1qk1 h PRO 304 CO -0.70 0.00 -0.51 -0.22 -0.21 0.00 0.00 178.00 176.36 1qk1 h LYS 305 N 0.00 0.08 -0.88 1.05 1.63 -0.64 -2.90 116.57 114.92 1qk1 h LYS 305 Ca 0.40 -0.14 0.15 0.00 -0.85 0.00 0.00 60.65 60.20 1qk1 h LYS 305 Cb 1.63 0.05 -0.09 0.00 -0.60 0.00 0.00 32.23 33.22 1qk1 h LYS 305 CO -0.00 1.07 0.47 0.82 -3.45 0.00 0.00 179.45 178.36 1qk1 h ILE 306 N -0.81 0.74 0.10 2.00 2.04 -0.84 -0.45 117.51 120.29 1qk1 h ILE 306 Ca -0.12 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 1qk1 h ILE 306 Cb 1.25 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1qk1 h ILE 306 CO 0.00 0.12 -0.05 -0.07 0.00 0.00 0.00 178.15 178.16 1qk1 h LEU 307 N 0.67 -0.11 -0.40 1.44 4.07 -1.56 -2.05 115.31 117.38 1qk1 h LEU 307 Ca 0.48 -0.01 0.07 0.00 0.08 0.00 0.00 57.88 58.50 1qk1 h LEU 307 Cb 0.66 0.03 -0.06 0.00 1.08 0.00 0.00 40.66 42.37 1qk1 h LEU 307 CO -0.35 -0.07 0.03 -0.08 -1.08 0.00 0.00 178.44 176.89 1qk1 h GLU 308 N -0.14 0.14 0.00 1.13 4.81 -0.93 -1.15 114.58 118.45 1qk1 h GLU 308 Ca -0.01 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.16 1qk1 h GLU 308 Cb 0.11 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1qk1 h GLU 308 CO 0.02 0.09 -0.22 -0.91 -0.73 0.00 0.00 179.01 177.26 1qk1 h ASN 309 N 0.15 0.00 0.07 1.04 4.21 -1.05 -1.88 115.58 118.11 1qk1 h ASN 309 Ca 0.20 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.71 1qk1 h ASN 309 Cb 0.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.46 1qk1 h ASN 309 CO -0.30 0.22 -0.05 0.18 -1.29 0.00 0.00 177.43 176.19 1qk1 n LEU 310 N -4.02 1.08 -3.49 1.61 4.77 -0.69 -2.23 117.00 114.03 1qk1 n LEU 310 Ca -0.02 -0.33 -0.19 0.00 -0.03 0.00 0.00 56.01 55.44 1qk1 n LEU 310 Cb 0.30 -0.04 0.09 0.00 -2.33 0.00 0.00 43.42 41.43 1qk1 n LEU 310 CO 0.35 0.18 0.15 0.54 -1.33 0.00 0.00 177.39 177.29 1qk1 n ARG 311 N -0.26 -7.06 -4.38 3.23 1.74 -0.53 -4.90 116.66 104.50 1qk1 n ARG 311 Ca 0.18 0.84 -0.24 0.00 -0.77 0.00 0.00 57.85 57.87 1qk1 n ARG 311 Cb 0.31 -5.87 -0.11 0.00 -1.02 0.00 0.00 32.46 25.77 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 -6.68 2.46 0.10 0.55 1.43 -0.62 -2.15 118.68 113.77 1qk1 s LEU 312 Ca 0.19 -0.89 0.05 0.00 -1.03 0.00 0.00 54.13 52.46 1qk1 s LEU 312 Cb -0.09 -0.96 -0.03 0.00 0.03 0.00 0.00 46.19 45.14 1qk1 s LEU 312 CO 0.73 0.02 -0.14 0.00 0.23 0.00 0.00 176.35 177.19 1qk1 s GLN 313 N -2.88 0.92 0.20 1.70 -2.07 -0.14 -4.28 119.66 113.10 1qk1 s GLN 313 Ca 0.19 -1.12 0.10 0.00 -1.82 0.00 0.00 55.36 52.72 1qk1 s GLN 313 Cb -0.06 -0.83 -0.04 0.00 -1.09 0.00 0.00 33.01 30.98 1qk1 s GLN 313 CO 0.09 0.17 -0.21 -1.59 -1.32 0.00 0.00 175.29 172.42 1qk1 s LYS 314 N -2.32 1.45 0.30 9.60 -2.85 -1.26 -1.91 119.74 122.74 1qk1 s LYS 314 Ca 0.04 -1.52 -0.16 0.00 -1.00 0.00 0.00 55.97 53.34 1qk1 s LYS 314 Cb -0.07 -1.62 0.02 0.00 -2.06 0.00 0.00 37.83 34.10 1qk1 s LYS 314 CO 0.02 0.34 0.63 -0.98 0.10 0.00 0.00 175.35 175.46 1qk1 s ARG 315 N -2.86 1.81 0.88 1.78 1.70 -0.77 -4.98 118.95 116.50 1qk1 s ARG 315 Ca 0.20 -1.23 -0.12 0.00 -0.47 0.00 0.00 55.73 54.11 1qk1 s ARG 315 Cb -0.06 0.55 0.12 0.00 -0.57 0.00 0.00 34.95 34.99 1qk1 s ARG 315 CO 0.09 -0.81 1.15 0.20 -1.08 0.00 0.00 175.30 174.86 1qk1 s GLY 316 N -3.01 1.58 0.00 3.88 0.00 -1.25 -1.95 107.32 106.57 1qk1 s GLY 316 Ca 0.17 -0.55 0.00 0.00 0.00 0.00 0.00 44.72 44.34 1qk1 s GLY 316 CO 0.10 -0.02 0.00 -0.37 0.00 0.00 0.00 173.10 172.81 1qk1 n THR 317 N -3.62 0.00 0.00 0.90 5.66 -1.26 -4.67 114.28 111.28 1qk1 n THR 317 Ca 0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 1qk1 n THR 317 Cb 0.60 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.38 1qk1 n THR 317 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1qk1 n GLY 318 N 0.68 -0.35 0.00 1.09 0.00 -1.26 -4.94 105.19 100.40 1qk1 n GLY 318 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1qk1 n GLY 318 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qk1 n GLY 319 N -0.29 1.66 0.37 -0.02 0.00 -1.26 -5.02 105.19 100.63 1qk1 n GLY 319 Ca 0.00 0.30 -0.12 0.00 0.00 0.00 0.00 46.02 46.19 1qk1 n GLY 319 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1qk1 h VAL 320 N 0.00 0.00 -2.36 1.61 -1.51 -2.05 -3.28 116.25 108.66 1qk1 h VAL 320 Ca 0.00 0.00 -0.63 0.00 -1.23 0.00 0.00 66.70 64.84 1qk1 h VAL 320 Cb 0.00 0.00 -0.40 0.00 -2.13 0.00 0.00 31.29 28.76 1qk1 h VAL 320 CO 0.00 0.00 -0.44 -0.90 -1.23 0.00 0.00 177.57 175.00 1qk1 n ASP 321 N -4.80 4.01 -4.24 4.19 5.75 -1.26 -5.07 116.55 115.12 1qk1 n ASP 321 Ca -0.06 -3.42 -0.60 0.00 -0.01 0.00 0.00 54.79 50.70 1qk1 n ASP 321 Cb 0.31 -0.75 -0.11 0.00 -1.03 0.00 0.00 41.12 39.55 1qk1 n ASP 321 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1qk1 n THR 322 N 1.01 0.00 0.06 2.12 -2.24 -1.24 -4.81 114.28 109.18 1qk1 n THR 322 Ca 0.29 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 1qk1 n THR 322 Cb 0.40 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 1qk1 n THR 322 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qk1 n ALA 323 N 5.75 3.00 0.00 6.98 0.00 -1.26 -4.32 120.51 130.66 1qk1 n ALA 323 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1qk1 n ALA 323 Cb -0.05 0.10 0.00 0.00 0.00 0.00 0.00 19.45 19.51 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 -3.15 0.00 -2.13 0.00 0.00 -1.26 -3.94 120.51 110.03 1qk1 n ALA 324 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1qk1 n ALA 324 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1qk1 n ALA 324 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1qk1 n THR 325 N 0.00 2.18 -2.38 0.00 -1.04 -1.26 -4.39 114.28 107.39 1qk1 n THR 325 Ca 0.00 -2.27 -0.05 0.00 -2.04 0.00 0.00 64.05 59.69 1qk1 n THR 325 Cb 0.00 -2.19 0.01 0.00 -1.82 0.00 0.00 70.33 66.32 1qk1 n THR 325 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1qk1 n GLY 326 N 5.73 -1.09 4.07 3.41 0.00 -1.26 -4.16 105.19 111.89 1qk1 n GLY 326 Ca 0.45 0.76 0.00 0.00 0.00 0.00 0.00 46.02 47.23 1qk1 n GLY 326 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qk1 n GLY 327 N -0.43 0.12 3.55 -0.02 0.00 -1.26 -4.90 105.19 102.26 1qk1 n GLY 327 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.26 4.93 0.29 1.61 1.01 -1.26 0.27 120.40 125.99 1qk1 s VAL 328 Ca 0.00 0.04 0.05 0.00 0.00 0.00 0.00 61.98 62.07 1qk1 s VAL 328 Cb 0.00 -3.32 -0.06 0.00 0.00 0.00 0.00 36.38 33.00 1qk1 s VAL 328 CO 0.00 0.31 -0.01 -0.36 0.00 0.00 0.00 175.10 175.04 1qk1 s PHE 329 N 1.54 1.90 -0.39 5.22 0.40 -0.01 -4.33 117.98 122.30 1qk1 s PHE 329 Ca 0.07 -0.82 -0.07 0.00 -0.60 0.00 0.00 56.93 55.50 1qk1 s PHE 329 Cb -0.15 -1.15 0.07 0.00 0.51 0.00 0.00 43.02 42.30 1qk1 s PHE 329 CO 0.07 0.14 0.20 0.34 0.70 0.00 0.00 175.22 176.68 1qk1 s ASP 330 N -3.44 5.48 -0.15 1.36 -1.08 -0.82 -0.93 116.67 117.10 1qk1 s ASP 330 Ca 0.32 -1.49 -0.04 0.00 -0.52 0.00 0.00 52.55 50.82 1qk1 s ASP 330 Cb 0.06 -1.93 -0.03 0.00 -1.46 0.00 0.00 42.92 39.56 1qk1 s ASP 330 CO 0.13 -0.48 -0.01 -0.63 0.52 0.00 0.00 175.17 174.70 1qk1 s ILE 331 N 1.37 4.19 0.22 4.11 -1.09 -0.65 -1.85 121.20 127.51 1qk1 s ILE 331 Ca 0.02 -0.26 -0.13 0.00 -2.23 0.00 0.00 60.65 58.05 1qk1 s ILE 331 Cb -0.22 -2.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.83 1qk1 s ILE 331 CO 0.01 0.51 0.47 -0.94 -1.23 0.00 0.00 174.94 173.76 1qk1 s SER 332 N 0.07 -0.11 0.50 3.58 1.04 -0.80 -1.26 113.70 116.72 1qk1 s SER 332 Ca 0.02 -0.82 -0.23 0.00 0.48 0.00 0.00 55.95 55.40 1qk1 s SER 332 Cb -0.13 0.57 -0.06 0.00 0.10 0.00 0.00 66.02 66.49 1qk1 s SER 332 CO 0.02 -1.09 1.28 0.54 0.98 0.00 0.00 173.24 174.97 1qk1 s ASN 333 N -2.98 5.73 -0.15 7.02 4.22 -1.06 -0.97 114.94 126.76 1qk1 s ASN 333 Ca 0.19 2.58 -0.17 0.00 -2.14 0.00 0.00 52.86 53.31 1qk1 s ASN 333 Cb -0.00 -2.62 -0.24 0.00 1.28 0.00 0.00 41.25 39.67 1qk1 s ASN 333 CO 0.05 -1.24 0.40 0.25 -2.04 0.00 0.00 177.10 174.52 1qk1 h LEU 334 N 1.82 0.22-10.27 3.54 7.12 -1.75 -3.44 115.31 112.56 1qk1 h LEU 334 Ca -0.50 -0.75 -0.50 0.00 0.13 0.00 0.00 57.88 56.26 1qk1 h LEU 334 Cb 1.27 -0.07 0.07 0.00 -0.53 0.00 0.00 40.66 41.40 1qk1 h LEU 334 CO 0.59 1.59 0.38 -1.81 -0.13 0.00 0.00 178.44 179.05 1qk1 s ASP 335 N -6.92 5.74 0.00 1.25 1.01 -1.26 -4.99 116.67 111.50 1qk1 s ASP 335 Ca -0.24 1.68 0.00 0.00 0.71 0.00 0.00 52.55 54.70 1qk1 s ASP 335 Cb 0.05 -2.51 0.00 0.00 1.01 0.00 0.00 42.92 41.47 1qk1 s ASP 335 CO 0.70 -1.20 0.00 -1.14 0.21 0.00 0.00 175.17 173.74 1qk1 n ARG 336 N -2.49 0.00 -5.26 8.23 0.63 -1.26 -4.90 116.66 111.60 1qk1 n ARG 336 Ca 0.08 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.69 1qk1 n ARG 336 Cb 0.53 -0.43 -0.16 0.00 0.45 0.00 0.00 32.46 32.85 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 -1.98 2.10 0.00 6.15 0.20 -1.26 -1.99 118.68 121.90 1qk1 s LEU 337 Ca 0.00 -0.47 0.00 0.00 0.69 0.00 0.00 54.13 54.35 1qk1 s LEU 337 Cb 0.00 -1.37 0.00 0.00 -0.43 0.00 0.00 46.19 44.39 1qk1 s LEU 337 CO 0.00 0.29 0.00 0.61 -0.29 0.00 0.00 176.35 176.96 1qk1 n GLY 338 N 2.62 0.57 2.95 7.98 0.00 -1.26 -4.97 105.19 113.08 1qk1 n GLY 338 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.88 0.10 0.89 1.61 1.02 -1.26 -4.90 119.74 116.31 1qk1 s LYS 339 Ca 0.00 0.10 -0.12 0.00 0.02 0.00 0.00 55.97 55.97 1qk1 s LYS 339 Cb 0.00 0.05 0.12 0.00 -0.52 0.00 0.00 37.83 37.48 1qk1 s LYS 339 CO 0.00 -0.01 1.09 -1.54 -0.92 0.00 0.00 175.35 173.97 1qk1 s SER 340 N 0.01 3.57 0.35 2.83 1.04 -1.25 -4.79 113.70 115.46 1qk1 s SER 340 Ca -0.00 1.43 0.09 0.00 0.48 0.00 0.00 55.95 57.95 1qk1 s SER 340 Cb -0.01 -2.12 0.64 0.00 0.10 0.00 0.00 66.02 64.63 1qk1 s SER 340 CO 0.00 -2.57 1.81 1.05 0.98 0.00 0.00 173.24 174.51 1qk1 h GLU 341 N -1.50 0.20 -0.45 4.02 9.09 -1.82 -1.23 114.58 122.90 1qk1 h GLU 341 Ca -0.49 -0.07 -0.05 0.00 0.05 0.00 0.00 59.36 58.79 1qk1 h GLU 341 Cb 1.29 -0.02 -0.02 0.00 -1.65 0.00 0.00 28.75 28.35 1qk1 h GLU 341 CO 0.56 0.48 0.07 0.28 0.05 0.00 0.00 179.01 180.44 1qk1 h VAL 342 N 0.18 1.25 -0.55 -1.06 2.07 -1.89 -1.04 116.25 115.21 1qk1 h VAL 342 Ca 0.03 -0.90 -0.06 0.00 0.82 0.00 0.00 66.70 66.60 1qk1 h VAL 342 Cb 0.60 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1qk1 h VAL 342 CO 0.04 0.31 0.12 -0.33 0.02 0.00 0.00 177.57 177.73 1qk1 h GLU 343 N 0.60 0.85 -0.24 1.57 5.08 -1.78 -1.72 114.58 118.95 1qk1 h GLU 343 Ca 0.14 -0.18 -0.13 0.00 -1.00 0.00 0.00 59.36 58.18 1qk1 h GLU 343 Cb 0.38 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 1qk1 h GLU 343 CO 0.01 0.78 -0.36 -0.07 -1.00 0.00 0.00 179.01 178.37 1qk1 h LEU 344 N 0.82 0.72 -0.48 1.33 3.38 -0.95 -1.37 115.31 118.77 1qk1 h LEU 344 Ca 0.18 -0.52 -0.06 0.00 0.09 0.00 0.00 57.88 57.57 1qk1 h LEU 344 Cb 0.32 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1qk1 h LEU 344 CO 0.00 1.10 0.06 0.58 0.09 0.00 0.00 178.44 180.27 1qk1 h VAL 345 N 0.37 1.25 -0.85 1.22 2.07 -1.13 -1.79 116.25 117.39 1qk1 h VAL 345 Ca 0.02 -0.96 0.04 0.00 0.82 0.00 0.00 66.70 66.62 1qk1 h VAL 345 Cb 0.94 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 31.60 1qk1 h VAL 345 CO 0.08 0.34 0.54 -0.61 0.02 0.00 0.00 177.57 177.94 1qk1 h GLN 346 N 0.67 1.01 -0.48 1.57 5.75 -1.29 0.75 115.11 123.09 1qk1 h GLN 346 Ca 0.14 -0.06 -0.05 0.00 -0.15 0.00 0.00 58.65 58.53 1qk1 h GLN 346 Cb 0.42 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 1qk1 h GLN 346 CO 0.01 0.67 0.09 1.25 -2.65 0.00 0.00 178.83 178.20 1qk1 h LEU 347 N 1.04 0.69 -0.21 -2.39 6.46 -0.95 0.09 115.31 120.04 1qk1 h LEU 347 Ca 0.34 -0.12 -0.15 0.00 -0.12 0.00 0.00 57.88 57.83 1qk1 h LEU 347 Cb 0.04 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 39.79 1qk1 h LEU 347 CO -0.13 0.70 -0.46 0.58 -0.62 0.00 0.00 178.44 178.51 1qk1 h VAL 348 N 0.71 1.32 -0.05 1.05 2.07 -0.42 -1.01 116.25 119.92 1qk1 h VAL 348 Ca 0.16 -1.68 0.01 0.00 0.82 0.00 0.00 66.70 66.00 1qk1 h VAL 348 Cb 0.30 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.91 1qk1 h VAL 348 CO 0.00 0.53 -0.02 0.40 0.02 0.00 0.00 177.57 178.50 1qk1 h ILE 349 N 0.37 0.94 -0.59 4.57 2.04 -0.49 0.86 117.51 125.21 1qk1 h ILE 349 Ca 0.00 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 1qk1 h ILE 349 Cb 1.07 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 38.06 1qk1 h ILE 349 CO 0.10 0.00 0.24 0.44 0.00 0.00 0.00 178.15 178.93 1qk1 h ASP 350 N -0.01 0.82 -0.43 1.72 3.32 -0.99 -1.73 116.42 119.12 1qk1 h ASP 350 Ca 0.03 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 56.86 1qk1 h ASP 350 Cb 0.04 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 1qk1 h ASP 350 CO -0.05 0.77 0.11 1.23 -1.72 0.00 0.00 179.24 179.57 1qk1 h GLY 351 N 0.82 0.73 1.32 2.75 0.00 -0.92 -2.23 103.07 105.55 1qk1 h GLY 351 Ca 0.20 -0.46 -0.12 0.00 0.00 0.00 0.00 47.33 46.95 1qk1 h GLY 351 CO -0.02 0.43 -0.28 -2.08 0.00 0.00 0.00 176.54 174.59 1qk1 h VAL 352 N 0.56 1.28 -0.84 4.60 2.07 -0.74 -0.88 116.25 122.29 1qk1 h VAL 352 Ca 0.13 -1.41 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 1qk1 h VAL 352 Cb 0.31 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 1qk1 h VAL 352 CO 0.00 0.47 0.50 0.78 0.02 0.00 0.00 177.57 179.34 1qk1 h ASN 353 N 0.66 1.01 -0.36 0.57 2.35 -1.22 -1.57 115.58 117.02 1qk1 h ASN 353 Ca 0.08 -0.06 -0.12 0.00 -0.55 0.00 0.00 56.30 55.65 1qk1 h ASN 353 Cb 0.80 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.91 1qk1 h ASN 353 CO 0.07 0.78 -0.26 0.22 -1.65 0.00 0.00 177.43 176.58 1qk1 h TYR 354 N 1.16 0.95 -0.92 1.19 5.03 -1.05 -2.51 116.97 120.81 1qk1 h TYR 354 Ca 0.30 -0.26 -0.00 0.00 2.58 0.00 0.00 58.73 61.35 1qk1 h TYR 354 Cb -0.04 -0.21 -0.04 0.00 1.55 0.00 0.00 36.73 37.98 1qk1 h TYR 354 CO 0.00 1.03 0.57 1.25 -1.32 0.00 0.00 178.16 179.70 1qk1 h LEU 355 N 0.60 1.09 -0.40 2.82 5.85 -0.75 -1.99 115.31 122.53 1qk1 h LEU 355 Ca 0.07 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1qk1 h LEU 355 Cb 0.83 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1qk1 h LEU 355 CO 0.07 0.82 0.22 0.40 -0.34 0.00 0.00 178.44 179.61 1qk1 h ILE 356 N 1.26 1.15 -0.56 4.05 2.04 -1.24 -2.03 117.51 122.17 1qk1 h ILE 356 Ca 0.33 -0.40 0.07 0.00 1.00 0.00 0.00 64.86 65.86 1qk1 h ILE 356 Cb -0.08 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 1qk1 h ILE 356 CO -0.07 0.16 0.38 -0.78 0.00 0.00 0.00 178.15 177.84 1qk1 h ASP 357 N 0.51 0.44 -0.39 1.72 3.58 -0.93 0.15 116.42 121.51 1qk1 h ASP 357 Ca 0.14 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.49 1qk1 h ASP 357 Cb 0.06 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.00 1qk1 h ASP 357 CO -0.02 0.29 -0.15 0.00 -2.88 0.00 0.00 179.24 176.48 1qk1 h GLU 359 N 0.76 0.12 -0.76 0.00 4.57 -0.63 -1.55 114.58 117.08 1qk1 h GLU 359 Ca 0.12 -0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.37 1qk1 h GLU 359 Cb 0.67 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.19 1qk1 h GLU 359 CO 0.05 0.29 0.50 0.00 -1.18 0.00 0.00 179.01 178.66 1qk1 h ARG 360 N -0.07 0.65 0.25 1.92 3.08 -1.05 -1.69 114.38 117.47 1qk1 h ARG 360 Ca 0.02 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1qk1 h ARG 360 Cb 0.22 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1qk1 h ARG 360 CO -0.00 0.43 -0.12 0.00 -1.07 0.00 0.00 179.97 179.21 1qk1 h ARG 361 N 0.67 -0.32 -0.87 0.04 3.08 -1.07 -2.74 114.38 113.17 1qk1 h ARG 361 Ca 0.35 0.02 0.18 0.00 0.07 0.00 0.00 59.98 60.61 1qk1 h ARG 361 Cb 0.46 0.07 -0.07 0.00 0.08 0.00 0.00 29.97 30.52 1qk1 h ARG 361 CO -0.13 0.03 0.58 -0.07 -1.07 0.00 0.00 179.97 179.30 1qk1 h LEU 362 N -0.74 0.45 -0.82 3.04 3.38 -0.92 0.42 115.31 120.11 1qk1 h LEU 362 Ca -0.03 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1qk1 h LEU 362 Cb 0.50 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 1qk1 h LEU 362 CO 0.06 0.20 0.30 -0.33 0.09 0.00 0.00 178.44 178.75 1qk1 h GLU 363 N 0.46 1.17 -0.01 1.13 5.08 -1.21 -2.53 114.58 118.67 1qk1 h GLU 363 Ca 0.45 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1qk1 h GLU 363 Cb 1.04 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1qk1 h GLU 363 CO -0.18 0.95 0.00 0.54 -1.00 0.00 0.00 179.01 179.33 1qk1 n ARG 364 N -4.27 1.40 -0.87 2.33 5.12 0.03 -4.93 116.66 115.47 1qk1 n ARG 364 Ca 0.07 -0.58 0.00 0.00 -1.93 0.00 0.00 57.85 55.41 1qk1 n ARG 364 Cb 0.19 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.01 1qk1 n ARG 364 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1qk1 n GLY 365 N 1.10 0.88 3.87 -0.13 0.00 -0.57 -5.04 105.19 105.31 1qk1 n GLY 365 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 1qk1 n GLY 365 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1qk1 s GLN 366 N -0.13 2.88 0.34 1.61 -0.21 -0.88 -4.97 119.66 118.30 1qk1 s GLN 366 Ca 0.00 0.52 -0.02 0.00 0.02 0.00 0.00 55.36 55.88 1qk1 s GLN 366 Cb 0.00 -2.02 -0.04 0.00 1.00 0.00 0.00 33.01 31.95 1qk1 s GLN 366 CO 0.00 -1.03 0.57 0.34 -2.12 0.00 0.00 175.29 173.05 1qk1 s ASP 367 N -4.29 6.34 0.24 5.90 2.15 -1.26 -4.04 116.67 121.71 1qk1 s ASP 367 Ca 0.58 0.60 0.07 0.00 0.43 0.00 0.00 52.55 54.23 1qk1 s ASP 367 Cb -0.11 -2.10 -0.04 0.00 -0.30 0.00 0.00 42.92 40.37 1qk1 s ASP 367 CO 0.52 -0.29 0.12 0.27 -0.17 0.00 0.00 175.17 175.63 1qk1 s ILE 368 N -2.28 4.13 -0.09 4.11 -4.36 -1.26 -4.94 121.20 116.52 1qk1 s ILE 368 Ca 0.42 -1.50 0.05 0.00 -0.26 0.00 0.00 60.65 59.36 1qk1 s ILE 368 Cb -0.10 -3.20 -0.00 0.00 1.25 0.00 0.00 42.46 40.41 1qk1 s ILE 368 CO 0.35 -0.31 -0.24 -0.60 0.24 0.00 0.00 174.94 174.38 1qk1 s ARG 369 N -3.63 2.89 -0.22 0.37 3.00 -1.26 -5.09 118.95 115.01 1qk1 s ARG 369 Ca 0.32 -0.88 -0.29 0.00 -1.00 0.00 0.00 55.73 53.87 1qk1 s ARG 369 Cb -0.08 -2.25 -0.01 0.00 0.00 0.00 0.00 34.95 32.61 1qk1 s ARG 369 CO 0.23 0.24 1.40 0.42 0.00 0.00 0.00 175.30 177.58 1qk1 s ILE 370 N 0.20 4.03 0.85 4.11 1.01 -1.26 -4.98 121.20 125.15 1qk1 s ILE 370 Ca -0.14 1.19 -0.11 0.00 0.00 0.00 0.00 60.65 61.59 1qk1 s ILE 370 Cb -0.17 -3.95 0.11 0.00 0.01 0.00 0.00 42.46 38.46 1qk1 s ILE 370 CO 0.07 -0.30 1.14 -2.16 0.00 0.00 0.00 174.94 173.70 1qk1 s PRO 371 N 4.10 1.49 0.15 2.79 0.04 -1.26 -4.97 135.00 137.34 1qk1 s PRO 371 Ca 0.61 1.50 -0.29 0.00 0.04 0.00 0.00 61.00 62.86 1qk1 s PRO 371 Cb -0.21 -1.78 -0.07 0.00 0.04 0.00 0.00 34.50 32.47 1qk1 s PRO 371 CO 0.23 -2.27 0.91 0.95 0.04 0.00 0.00 177.00 176.85 1qk1 s THR 372 N -2.59 4.36 0.25 1.26 -4.23 -1.26 -4.85 115.64 108.59 1qk1 s THR 372 Ca 0.67 1.98 -0.27 0.00 -1.18 0.00 0.00 61.69 62.89 1qk1 s THR 372 Cb -0.23 -4.28 -0.16 0.00 1.34 0.00 0.00 72.50 69.17 1qk1 s THR 372 CO 0.55 0.41 0.55 -2.65 -0.54 0.00 0.00 174.62 172.94 1qk1 n PRO 373 N 2.20 0.26 -2.81 3.99 -0.02 -1.26 -4.88 135.00 132.48 1qk1 n PRO 373 Ca -0.01 0.09 -0.42 0.00 -2.02 0.00 0.00 63.50 61.14 1qk1 n PRO 373 Cb 0.48 -1.18 -0.04 0.00 -0.02 0.00 0.00 33.50 32.75 1qk1 n PRO 373 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1qk1 s VAL 374 N -1.12 4.71 0.07 -1.45 -7.23 -0.95 -5.04 120.40 109.38 1qk1 s VAL 374 Ca 0.62 1.51 -0.01 0.00 -1.81 0.00 0.00 61.98 62.30 1qk1 s VAL 374 Cb -0.83 -4.24 -0.04 0.00 0.56 0.00 0.00 36.38 31.82 1qk1 s VAL 374 CO 0.58 -0.28 0.23 -0.63 -0.31 0.00 0.00 175.10 174.69 1qk1 s ILE 375 N 3.17 5.36 -0.21 -0.62 1.01 -1.26 -4.99 121.20 123.66 1qk1 s ILE 375 Ca 0.38 -0.31 -0.19 0.00 0.00 0.00 0.00 60.65 60.53 1qk1 s ILE 375 Cb -0.14 -3.62 -0.08 0.00 0.01 0.00 0.00 42.46 38.63 1qk1 s ILE 375 CO 0.12 0.14 0.77 1.41 0.00 0.00 0.00 174.94 177.37 1qk1 n HIS 376 N 0.31 0.63 0.00 3.97 8.25 -1.26 -4.93 115.22 122.19 1qk1 n HIS 376 Ca -0.05 0.41 0.00 0.00 -0.26 0.00 0.00 57.72 57.82 1qk1 n HIS 376 Cb 0.51 -0.95 0.00 0.00 1.12 0.00 0.00 29.99 30.68 1qk1 n HIS 376 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1qk1 n THR 377 N 2.13 0.00 -0.03 1.59 5.66 -1.26 -5.09 114.28 117.28 1qk1 n THR 377 Ca 0.17 0.55 0.00 0.00 -3.05 0.00 0.00 64.05 61.72 1qk1 n THR 377 Cb -0.02 -1.35 0.00 0.00 -1.55 0.00 0.00 70.33 67.40 1qk1 n THR 377 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 1qk1 n LYS 378 N -0.18 0.00 0.00 1.09 2.85 -1.26 -5.32 118.16 115.34 1qk1 n LYS 378 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1qk1 n LYS 378 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1qk1 n LYS 378 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07