#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qrk h ARG 11 N 0.00 0.41 -3.09 1.61 9.65 -2.08 -3.47 114.38 117.41 1qrk h ARG 11 Ca 0.00 -0.69 -0.13 0.00 -1.10 0.00 0.00 59.98 58.06 1qrk h ARG 11 Cb 0.00 0.25 -0.22 0.00 -1.39 0.00 0.00 29.97 28.62 1qrk h ARG 11 CO 0.00 1.33 -0.33 -0.98 2.80 0.00 0.00 179.97 182.78 1qrk s ARG 12 N -2.53 0.54 0.40 0.20 1.70 -1.26 -5.06 118.95 112.94 1qrk s ARG 12 Ca -0.12 -0.01 0.14 0.00 -0.47 0.00 0.00 55.73 55.27 1qrk s ARG 12 Cb 0.02 0.24 0.84 0.00 -0.57 0.00 0.00 34.95 35.49 1qrk s ARG 12 CO 0.88 -0.13 1.89 0.00 -1.08 0.00 0.00 175.30 176.86 1qrk h ALA 13 N 4.53 1.46 -3.92 7.88 0.00 -2.09 -3.42 119.26 123.71 1qrk h ALA 13 Ca -0.29 -0.27 -0.36 0.00 0.00 0.00 0.00 54.91 53.99 1qrk h ALA 13 Cb 1.18 -0.05 -0.29 0.00 0.00 0.00 0.00 17.79 18.63 1qrk h ALA 13 CO 0.37 0.38 -0.77 0.54 0.00 0.00 0.00 179.25 179.77 1qrk s VAL 14 N -4.31 0.56 1.20 0.00 0.11 -1.26 -5.08 120.40 111.62 1qrk s VAL 14 Ca -0.03 -0.29 -0.16 0.00 -2.93 0.00 0.00 61.98 58.57 1qrk s VAL 14 Cb 0.15 -0.48 0.24 0.00 -1.53 0.00 0.00 36.38 34.76 1qrk s VAL 14 CO 0.71 0.17 0.61 -2.65 -3.33 0.00 0.00 175.10 170.61 1qrk n PRO 15 N 3.02 -2.56 -2.74 1.54 -0.02 -1.26 -4.90 135.00 128.08 1qrk n PRO 15 Ca -0.14 -0.73 -0.41 0.00 -2.02 0.00 0.00 63.50 60.19 1qrk n PRO 15 Cb 0.57 -1.94 -0.04 0.00 -0.02 0.00 0.00 33.50 32.07 1qrk n PRO 15 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1qrk s PRO 16 N -4.08 4.65 -0.98 0.52 0.04 -1.26 -4.95 135.00 128.94 1qrk s PRO 16 Ca 0.63 1.42 -0.22 0.00 0.04 0.00 0.00 61.00 62.87 1qrk s PRO 16 Cb -0.19 -3.40 0.07 0.00 0.04 0.00 0.00 34.50 31.03 1qrk s PRO 16 CO 0.63 0.15 1.35 1.21 0.04 0.00 0.00 177.00 180.39 1qrk s ASN 17 N 0.26 6.51 -0.09 6.66 2.47 -1.26 -4.75 114.94 124.74 1qrk s ASN 17 Ca 0.48 -1.55 0.19 0.00 0.42 0.00 0.00 52.86 52.40 1qrk s ASN 17 Cb -0.23 -2.52 0.43 0.00 -1.45 0.00 0.00 41.25 37.48 1qrk s ASN 17 CO 0.29 -1.41 1.19 -0.46 -3.72 0.00 0.00 177.10 172.99 1qrk n ASN 18 N 8.30 1.34 -3.76 -4.21 0.23 -1.26 -1.83 115.26 114.07 1qrk n ASN 18 Ca 0.29 -2.83 -0.15 0.00 -0.53 0.00 0.00 54.58 51.35 1qrk n ASN 18 Cb 0.50 -0.40 -0.16 0.00 -2.08 0.00 0.00 39.78 37.64 1qrk n ASN 18 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1qrk s SER 19 N -2.56 0.15 0.14 0.53 0.15 -1.26 -4.00 113.70 106.85 1qrk s SER 19 Ca 0.36 0.06 0.16 0.00 0.70 0.00 0.00 55.95 57.22 1qrk s SER 19 Cb 0.38 -0.06 -0.07 0.00 -1.71 0.00 0.00 66.02 64.56 1qrk s SER 19 CO -0.12 -0.14 1.06 -1.13 1.20 0.00 0.00 173.24 174.11 1qrk h ASN 20 N 7.39 0.00 1.18 5.45 -0.00 -1.92 -3.32 115.58 124.36 1qrk h ASN 20 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.87 1qrk h ASN 20 Cb 1.12 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.44 1qrk h ASN 20 CO 0.45 0.55 -0.38 0.00 -0.00 0.00 0.00 177.43 178.05 1qrk h ALA 21 N 1.45 0.76 -2.69 1.57 0.00 -1.95 -3.41 119.26 114.99 1qrk h ALA 21 Ca -0.10 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.28 1qrk h ALA 21 Cb 1.51 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.27 1qrk h ALA 21 CO 0.05 0.00 0.18 0.00 0.00 0.00 0.00 179.25 179.48 1qrk s ALA 22 N -3.16 3.40 0.10 0.00 0.00 -1.25 -5.03 121.76 115.82 1qrk s ALA 22 Ca 0.07 0.33 0.04 0.00 0.00 0.00 0.00 51.96 52.40 1qrk s ALA 22 Cb 0.12 -2.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.21 1qrk s ALA 22 CO 0.68 0.16 -0.10 -1.83 0.00 0.00 0.00 175.76 174.67 1qrk s GLU 23 N -0.52 0.86 0.03 0.00 -1.05 -1.26 -2.09 118.70 114.66 1qrk s GLU 23 Ca 0.38 -1.20 -0.00 0.00 -0.15 0.00 0.00 54.97 54.00 1qrk s GLU 23 Cb -0.22 -0.50 -0.04 0.00 -0.44 0.00 0.00 34.13 32.93 1qrk s GLU 23 CO 0.25 0.07 0.14 0.34 0.95 0.00 0.00 175.26 177.01 1qrk s ASP 24 N -2.57 6.01 -0.28 0.83 2.15 -1.24 -4.68 116.67 116.89 1qrk s ASP 24 Ca 0.07 0.20 -0.07 0.00 0.43 0.00 0.00 52.55 53.18 1qrk s ASP 24 Cb -0.02 -1.79 -0.00 0.00 -0.30 0.00 0.00 42.92 40.82 1qrk s ASP 24 CO -0.00 0.22 0.07 -0.62 -0.17 0.00 0.00 175.17 174.67 1qrk s ASP 25 N -2.11 5.08 0.22 -0.34 2.15 -1.26 -5.03 116.67 115.38 1qrk s ASP 25 Ca 0.28 -0.55 -0.24 0.00 0.43 0.00 0.00 52.55 52.48 1qrk s ASP 25 Cb -0.12 -1.89 -0.09 0.00 -0.30 0.00 0.00 42.92 40.52 1qrk s ASP 25 CO 0.20 -0.14 0.81 -0.76 -0.17 0.00 0.00 175.17 175.11 1qrk s LEU 26 N 1.53 4.46 0.50 -1.34 1.43 -1.26 -5.05 118.68 118.96 1qrk s LEU 26 Ca 0.04 1.64 -0.21 0.00 -1.03 0.00 0.00 54.13 54.57 1qrk s LEU 26 Cb -0.16 -3.57 -0.07 0.00 0.03 0.00 0.00 46.19 42.42 1qrk s LEU 26 CO 0.02 0.09 1.11 -2.16 0.23 0.00 0.00 176.35 175.65 1qrk s PRO 27 N -1.61 3.60 -0.05 1.29 0.04 -1.26 -4.93 135.00 132.07 1qrk s PRO 27 Ca 0.42 1.59 -0.19 0.00 0.04 0.00 0.00 61.00 62.86 1qrk s PRO 27 Cb -0.20 -2.15 -0.13 0.00 0.04 0.00 0.00 34.50 32.05 1qrk s PRO 27 CO 0.24 -0.64 0.78 1.79 0.04 0.00 0.00 177.00 179.21 1qrk h THR 28 N 1.50 0.59 -2.74 1.26 1.35 -1.83 -3.43 112.91 109.62 1qrk h THR 28 Ca -0.50 -0.98 -0.67 0.00 -0.55 0.00 0.00 66.41 63.72 1qrk h THR 28 Cb 1.25 1.00 -0.07 0.00 -1.73 0.00 0.00 68.15 68.59 1qrk h THR 28 CO 0.58 0.15 -0.50 -0.69 -0.25 0.00 0.00 175.52 174.82 1qrk s VAL 29 N -3.34 5.38 -0.31 6.82 1.01 -1.26 0.40 120.40 129.09 1qrk s VAL 29 Ca -0.11 0.10 0.01 0.00 0.00 0.00 0.00 61.98 61.98 1qrk s VAL 29 Cb 0.01 -3.37 0.15 0.00 0.00 0.00 0.00 36.38 33.17 1qrk s VAL 29 CO 0.40 0.57 0.36 -0.70 0.00 0.00 0.00 175.10 175.72 1qrk s GLU 30 N -1.18 0.42 0.39 2.72 2.56 -0.15 -5.01 118.70 118.45 1qrk s GLU 30 Ca 0.17 -0.16 0.07 0.00 0.00 0.00 0.00 54.97 55.05 1qrk s GLU 30 Cb -0.12 -0.51 -0.08 0.00 2.00 0.00 0.00 34.13 35.42 1qrk s GLU 30 CO 0.06 -1.06 0.01 -0.51 -0.56 0.00 0.00 175.26 173.20 1qrk s LEU 31 N 2.27 2.75 -0.24 2.70 1.43 -1.26 0.36 118.68 126.68 1qrk s LEU 31 Ca 0.11 -1.36 -0.26 0.00 -1.03 0.00 0.00 54.13 51.59 1qrk s LEU 31 Cb -0.13 -0.81 0.08 0.00 0.03 0.00 0.00 46.19 45.36 1qrk s LEU 31 CO -0.27 -0.47 0.77 -1.58 0.23 0.00 0.00 176.35 175.04 1qrk s GLN 32 N -3.74 0.80 0.00 1.70 0.74 0.13 -4.92 119.66 114.38 1qrk s GLN 32 Ca 0.35 0.83 0.00 0.00 0.05 0.00 0.00 55.36 56.59 1qrk s GLN 32 Cb 0.09 0.39 0.00 0.00 1.10 0.00 0.00 33.01 34.59 1qrk s GLN 32 CO 0.17 -0.12 0.00 0.41 -0.55 0.00 0.00 175.29 175.20 1qrk n GLY 33 N 2.36 0.93 3.46 2.59 0.00 -1.26 -4.81 105.19 108.45 1qrk n GLY 33 Ca -0.14 -1.02 -0.09 0.00 0.00 0.00 0.00 46.02 44.77 1qrk n GLY 33 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qrk s VAL 34 N 0.00 0.03 0.00 1.61 -7.23 -1.26 -5.25 120.40 108.30 1qrk s VAL 34 Ca 0.00 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.85 1qrk s VAL 34 Cb 0.00 -1.97 0.00 0.00 0.56 0.00 0.00 36.38 34.97 1qrk s VAL 34 CO 0.00 -0.13 0.00 1.33 -0.31 0.00 0.00 175.10 175.99 1qrk n VAL 35 N -0.31 0.00 -0.59 1.32 0.24 -1.26 -4.97 118.33 112.76 1qrk n VAL 35 Ca -0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.25 1qrk n VAL 35 Cb 0.63 -0.74 0.00 0.00 -1.47 0.00 0.00 33.84 32.25 1qrk n VAL 35 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1qrk n LEU 41 N 0.00 0.00 -4.11 1.34 -0.00 -1.26 -5.64 117.00 107.33 1qrk n LEU 41 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 56.01 55.58 1qrk n LEU 41 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1qrk n LEU 41 CO 0.00 0.00 1.83 0.00 -0.00 0.00 0.00 177.39 179.22 1qrk n GLN 42 N 0.00 3.44 -2.64 1.96 1.13 -1.26 -4.76 117.38 115.26 1qrk n GLN 42 Ca 0.00 -3.54 -0.41 0.00 -1.94 0.00 0.00 57.00 51.11 1qrk n GLN 42 Cb 0.00 -3.04 0.01 0.00 0.11 0.00 0.00 30.24 27.33 1qrk n GLN 42 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1qrk n GLU 43 N 4.97 5.09 -0.06 -1.09 1.02 -1.26 -4.72 120.64 124.59 1qrk n GLU 43 Ca 0.40 -4.47 -0.04 0.00 -0.02 0.00 0.00 57.16 53.04 1qrk n GLU 43 Cb 0.39 -2.51 -0.14 0.00 -0.02 0.00 0.00 31.44 29.16 1qrk n GLU 43 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1qrk n PHE 44 N 0.58 0.00 0.00 -0.32 3.72 -1.26 -5.09 117.46 115.08 1qrk n PHE 44 Ca 0.44 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.84 1qrk n PHE 44 Cb 0.28 -0.73 0.00 0.00 -0.94 0.00 0.00 39.48 38.09 1qrk n PHE 44 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 1qrk n LEU 45 N -2.50 0.00 -3.89 4.37 7.94 -1.26 -4.86 117.00 116.79 1qrk n LEU 45 Ca -0.21 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.51 1qrk n LEU 45 Cb 0.90 0.00 -0.16 0.00 0.53 0.00 0.00 43.42 44.69 1qrk n LEU 45 CO 0.37 0.00 -0.40 0.20 -1.11 0.00 0.00 177.39 176.45 1qrk s ASN 46 N 0.00 0.73 0.01 1.96 0.02 -1.26 -4.95 114.94 111.45 1qrk s ASN 46 Ca 0.00 -0.10 -0.30 0.00 -1.02 0.00 0.00 52.86 51.44 1qrk s ASN 46 Cb 0.00 -0.31 -0.03 0.00 0.02 0.00 0.00 41.25 40.93 1qrk s ASN 46 CO 0.00 -0.04 0.99 0.68 0.02 0.00 0.00 177.10 178.75 1qrk s VAL 47 N 0.70 4.80 -0.26 1.60 -7.23 -1.26 -0.48 120.40 118.28 1qrk s VAL 47 Ca -0.08 2.04 0.23 0.00 -1.81 0.00 0.00 61.98 62.35 1qrk s VAL 47 Cb -0.12 -4.30 0.00 0.00 0.56 0.00 0.00 36.38 32.52 1qrk s VAL 47 CO -0.00 0.17 1.06 0.71 -0.31 0.00 0.00 175.10 176.73 1qrk h THR 48 N 4.72 0.00 0.00 5.32 1.35 0.21 -3.47 112.91 121.04 1qrk h THR 48 Ca -0.41 -0.97 0.00 0.00 -0.55 0.00 0.00 66.41 64.47 1qrk h THR 48 Cb 1.22 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 1qrk h THR 48 CO 0.75 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 174.48 1qrk n SER 49 N -2.65 0.00 -4.34 5.36 3.41 -1.21 -5.00 113.62 109.18 1qrk n SER 49 Ca 0.00 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.34 1qrk n SER 49 Cb 0.54 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.36 1qrk n SER 49 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1qrk s VAL 50 N -2.00 2.02 -0.09 -3.33 1.01 -1.26 -1.06 120.40 115.69 1qrk s VAL 50 Ca 0.00 -1.58 0.01 0.00 0.00 0.00 0.00 61.98 60.41 1qrk s VAL 50 Cb 0.00 -1.79 0.02 0.00 0.00 0.00 0.00 36.38 34.61 1qrk s VAL 50 CO 0.00 0.11 -0.08 -1.00 0.00 0.00 0.00 175.10 174.12 1qrk s HIS 51 N -1.02 1.33 -0.62 5.22 3.76 0.29 -4.96 115.29 119.29 1qrk s HIS 51 Ca 0.11 -0.57 0.05 0.00 -0.15 0.00 0.00 55.06 54.50 1qrk s HIS 51 Cb -0.10 -1.08 0.31 0.00 1.11 0.00 0.00 32.58 32.82 1qrk s HIS 51 CO 0.04 -0.38 0.91 1.28 -0.85 0.00 0.00 174.74 175.74 1qrk n LEU 52 N 4.47 4.35 -0.32 0.89 4.77 -1.26 0.61 117.00 130.51 1qrk n LEU 52 Ca -0.17 -5.60 0.00 0.00 -0.03 0.00 0.00 56.01 50.21 1qrk n LEU 52 Cb 0.51 -0.62 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 1qrk n LEU 52 CO 0.20 2.24 0.04 0.49 -1.33 0.00 0.00 177.39 179.03 1qrk n PHE 53 N 0.14 0.00 0.00 -1.77 3.72 -1.25 -4.65 117.46 113.65 1qrk n PHE 53 Ca 0.31 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.71 1qrk n PHE 53 Cb 0.39 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 1qrk n PHE 53 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1qrk n LYS 54 N 0.28 0.00 0.00 -1.08 2.85 -1.26 -3.86 118.16 115.09 1qrk n LYS 54 Ca 0.00 0.10 0.00 0.00 -1.05 0.00 0.00 58.31 57.36 1qrk n LYS 54 Cb 0.02 -0.51 0.00 0.00 -0.65 0.00 0.00 35.03 33.89 1qrk n LYS 54 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1qrk n GLU 55 N -1.07 0.00 -0.37 -1.58 -0.58 -1.26 -3.83 120.64 111.95 1qrk n GLU 55 Ca 0.00 0.00 0.29 0.00 -0.42 0.00 0.00 57.16 57.03 1qrk n GLU 55 Cb 0.00 0.00 0.46 0.00 -0.57 0.00 0.00 31.44 31.33 1qrk n GLU 55 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1qrk n ARG 56 N 0.12 -0.01 -0.01 3.49 5.12 -1.26 0.82 116.66 124.94 1qrk n ARG 56 Ca 0.00 0.71 -0.17 0.00 -1.93 0.00 0.00 57.85 56.47 1qrk n ARG 56 Cb 0.00 -1.52 -0.12 0.00 -1.16 0.00 0.00 32.46 29.66 1qrk n ARG 56 CO 0.00 0.00 0.00 0.11 -1.93 0.00 0.00 177.63 175.81 1qrk h TRP 57 N 0.00 0.36 -3.04 -1.55 0.09 -1.96 -3.41 115.95 106.45 1qrk h TRP 57 Ca 0.56 -0.22 -0.57 0.00 0.09 0.00 0.00 58.89 58.75 1qrk h TRP 57 Cb 2.04 -0.03 0.19 0.00 0.08 0.00 0.00 29.16 31.43 1qrk h TRP 57 CO -0.00 1.07 -0.50 -0.25 0.09 0.00 0.00 178.44 178.85 1qrk n ASP 58 N -4.38 -1.51 -0.27 0.11 8.00 0.24 -4.73 116.55 114.01 1qrk n ASP 58 Ca -0.11 0.61 -0.05 0.00 0.71 0.00 0.00 54.79 55.95 1qrk n ASP 58 Cb 0.60 -1.17 -0.00 0.00 -0.02 0.00 0.00 41.12 40.53 1qrk n ASP 58 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1qrk h THR 59 N -0.25 0.08 0.00 -3.53 1.35 -1.85 -2.88 112.91 105.83 1qrk h THR 59 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1qrk h THR 59 Cb 1.36 0.08 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1qrk h THR 59 CO 0.43 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 176.29 1qrk n ASN 60 N -5.42 0.00 -0.25 5.36 3.02 -1.25 0.99 115.26 117.70 1qrk n ASN 60 Ca 0.05 0.81 0.32 0.00 -0.03 0.00 0.00 54.58 55.73 1qrk n ASN 60 Cb 0.36 -0.31 0.74 0.00 -0.61 0.00 0.00 39.78 39.96 1qrk n ASN 60 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1qrk h LYS 61 N 0.00 0.00 0.07 3.52 1.57 -1.65 -0.58 116.57 119.49 1qrk h LYS 61 Ca 0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 1qrk h LYS 61 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1qrk h LYS 61 CO 0.00 0.00 -0.65 0.28 -0.57 0.00 0.00 179.45 178.51 1qrk h VAL 62 N 0.00 1.48 0.00 0.50 2.07 -1.15 -0.26 116.25 118.89 1qrk h VAL 62 Ca 0.49 -2.41 0.00 0.00 0.82 0.00 0.00 66.70 65.60 1qrk h VAL 62 Cb 1.99 3.10 0.00 0.00 -1.52 0.00 0.00 31.29 34.86 1qrk h VAL 62 CO -0.01 0.63 0.00 0.44 0.02 0.00 0.00 177.57 178.66 1qrk h ASP 63 N -0.66 0.00 0.09 0.57 5.19 0.14 -2.87 116.42 118.89 1qrk h ASP 63 Ca -0.14 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.27 1qrk h ASP 63 Cb 1.39 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.90 1qrk h ASP 63 CO 0.04 0.00 -0.68 1.41 -3.12 0.00 0.00 179.24 176.90 1qrk n HIS 64 N -2.70 0.00 -1.69 4.55 8.25 -0.30 -4.98 115.22 118.36 1qrk n HIS 64 Ca 0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.42 1qrk n HIS 64 Cb 0.29 -0.05 -0.01 0.00 1.12 0.00 0.00 29.99 31.34 1qrk n HIS 64 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1qrk n HIS 65 N -0.93 -0.14 -0.05 4.41 8.25 -1.08 -4.54 115.22 121.13 1qrk n HIS 65 Ca 0.07 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.55 1qrk n HIS 65 Cb 0.38 -1.54 0.06 0.00 1.12 0.00 0.00 29.99 30.00 1qrk n HIS 65 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1qrk n THR 66 N -3.50 0.92 0.33 1.59 -2.24 -0.52 -4.54 114.28 106.31 1qrk n THR 66 Ca -0.06 -0.96 0.06 0.00 -2.27 0.00 0.00 64.05 60.83 1qrk n THR 66 Cb 0.39 0.55 0.28 0.00 -2.10 0.00 0.00 70.33 69.45 1qrk n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1qrk n ASP 67 N -0.08 0.16 0.11 3.42 5.68 -0.22 -1.81 116.55 123.81 1qrk n ASP 67 Ca 0.04 0.55 0.08 0.00 -0.50 0.00 0.00 54.79 54.96 1qrk n ASP 67 Cb 0.30 -0.58 0.01 0.00 -1.14 0.00 0.00 41.12 39.71 1qrk n ASP 67 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1qrk h LYS 68 N 0.00 0.00 -6.41 0.11 2.10 -1.86 -3.46 116.57 107.05 1qrk h LYS 68 Ca 0.00 0.00 -0.54 0.00 -2.00 0.00 0.00 60.65 58.11 1qrk h LYS 68 Cb 0.19 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.52 1qrk h LYS 68 CO 0.00 0.12 0.84 0.71 -2.00 0.00 0.00 179.45 179.12 1qrk s TYR 69 N -3.19 2.84 -0.07 0.07 1.51 -0.75 -4.85 117.35 112.91 1qrk s TYR 69 Ca 0.01 0.76 -0.04 0.00 -1.01 0.00 0.00 57.07 56.78 1qrk s TYR 69 Cb 0.08 -3.72 -0.17 0.00 -0.11 0.00 0.00 41.96 38.05 1qrk s TYR 69 CO 0.77 -2.67 2.52 -1.91 -1.11 0.00 0.00 175.55 173.14 1qrk n GLU 70 N 5.19 1.37 -4.54 -0.62 4.07 -1.02 -4.82 120.64 120.27 1qrk n GLU 70 Ca 0.13 -0.71 -0.30 0.00 -0.06 0.00 0.00 57.16 56.23 1qrk n GLU 70 Cb 0.43 -1.87 -0.13 0.00 -0.06 0.00 0.00 31.44 29.81 1qrk n GLU 70 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 1qrk s ASN 71 N 2.40 3.50 0.29 4.31 3.84 -1.26 -4.64 114.94 123.38 1qrk s ASN 71 Ca 0.44 -0.61 0.23 0.00 0.21 0.00 0.00 52.86 53.12 1qrk s ASN 71 Cb 0.20 -0.38 0.16 0.00 -0.55 0.00 0.00 41.25 40.69 1qrk s ASN 71 CO -0.00 0.21 1.29 -1.13 -2.79 0.00 0.00 177.10 174.68 1qrk h ASN 72 N 4.17 0.00 -2.33 -4.21 -0.73 -2.02 -3.47 115.58 106.98 1qrk h ASN 72 Ca -0.49 -0.01 -0.45 0.00 1.87 0.00 0.00 56.30 57.22 1qrk h ASN 72 Cb 1.16 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.77 1qrk h ASN 72 CO 0.43 0.00 -0.19 -0.54 -0.37 0.00 0.00 177.43 176.77 1qrk s LYS 73 N -3.29 3.04 0.09 6.67 -0.14 -1.26 -4.95 119.74 119.90 1qrk s LYS 73 Ca 0.03 -0.73 -0.31 0.00 -1.36 0.00 0.00 55.97 53.60 1qrk s LYS 73 Cb 0.08 -2.66 -0.08 0.00 -1.68 0.00 0.00 37.83 33.50 1qrk s LYS 73 CO 0.74 -0.18 1.40 -1.17 -0.76 0.00 0.00 175.35 175.38 1qrk s LEU 74 N -4.42 4.36 -0.09 3.17 2.96 -1.25 -4.95 118.68 118.47 1qrk s LEU 74 Ca 0.48 2.29 0.05 0.00 -0.22 0.00 0.00 54.13 56.73 1qrk s LEU 74 Cb -0.10 -3.58 -0.00 0.00 0.50 0.00 0.00 46.19 43.01 1qrk s LEU 74 CO 0.35 -0.67 -0.24 -0.63 -1.32 0.00 0.00 176.35 173.84 1qrk s ILE 75 N 1.39 2.04 -0.01 6.68 1.01 -1.26 -1.74 121.20 129.31 1qrk s ILE 75 Ca 0.65 -1.02 -0.03 0.00 0.00 0.00 0.00 60.65 60.24 1qrk s ILE 75 Cb -0.36 -1.76 -0.00 0.00 0.01 0.00 0.00 42.46 40.35 1qrk s ILE 75 CO 0.30 0.56 0.07 -0.69 0.00 0.00 0.00 174.94 175.17 1qrk s VAL 76 N 0.21 0.05 -0.14 2.92 1.01 -0.16 -4.61 120.40 119.69 1qrk s VAL 76 Ca -0.15 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.31 1qrk s VAL 76 Cb -0.17 -0.24 -0.05 0.00 0.00 0.00 0.00 36.38 35.93 1qrk s VAL 76 CO 0.08 -0.24 0.19 -0.13 0.00 0.00 0.00 175.10 175.00 1qrk s ARG 77 N -0.74 3.84 0.62 2.72 0.52 -1.26 -0.77 118.95 123.88 1qrk s ARG 77 Ca -0.08 -0.06 -0.18 0.00 -0.52 0.00 0.00 55.73 54.88 1qrk s ARG 77 Cb -0.05 -3.30 -0.03 0.00 0.52 0.00 0.00 34.95 32.09 1qrk s ARG 77 CO 0.00 0.55 1.12 2.89 0.02 0.00 0.00 175.30 179.88 1qrk n ARG 78 N 2.66 1.01 -0.06 3.54 1.85 0.11 -3.65 116.66 122.12 1qrk n ARG 78 Ca -0.17 0.39 0.00 0.00 -1.00 0.00 0.00 57.85 57.07 1qrk n ARG 78 Cb 0.53 -2.34 0.00 0.00 -1.05 0.00 0.00 32.46 29.60 1qrk n ARG 78 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1qrk n GLY 79 N 1.12 2.51 3.43 2.89 0.00 -1.24 -4.54 105.19 109.36 1qrk n GLY 79 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1qrk n GLY 79 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1qrk s GLN 80 N -0.13 2.04 0.72 1.61 0.74 -1.24 -4.65 119.66 118.76 1qrk s GLN 80 Ca 0.00 -0.99 -0.11 0.00 0.05 0.00 0.00 55.36 54.31 1qrk s GLN 80 Cb 0.00 -2.16 0.02 0.00 1.10 0.00 0.00 33.01 31.98 1qrk s GLN 80 CO 0.00 0.54 1.07 -1.54 -0.55 0.00 0.00 175.29 174.81 1qrk s SER 81 N -1.36 5.15 0.20 6.67 1.04 -1.26 -4.11 113.70 120.03 1qrk s SER 81 Ca 0.14 1.49 -0.12 0.00 0.48 0.00 0.00 55.95 57.94 1qrk s SER 81 Cb -0.10 -2.33 0.00 0.00 0.10 0.00 0.00 66.02 63.69 1qrk s SER 81 CO 0.04 -1.57 0.40 0.72 0.98 0.00 0.00 173.24 173.81 1qrk s PHE 82 N -3.10 0.26 0.05 5.02 -0.71 -0.21 -4.95 117.98 114.34 1qrk s PHE 82 Ca 0.59 -0.61 0.05 0.00 -1.04 0.00 0.00 56.93 55.92 1qrk s PHE 82 Cb -0.14 0.13 -0.04 0.00 -1.21 0.00 0.00 43.02 41.76 1qrk s PHE 82 CO 0.55 -0.85 -0.10 0.71 -1.34 0.00 0.00 175.22 174.19 1qrk s TYR 83 N -3.96 2.77 0.18 3.49 2.02 -1.26 -0.75 117.35 119.84 1qrk s TYR 83 Ca 0.17 -0.13 -0.02 0.00 -0.37 0.00 0.00 57.07 56.73 1qrk s TYR 83 Cb 0.01 -1.51 -0.04 0.00 -0.40 0.00 0.00 41.96 40.02 1qrk s TYR 83 CO 0.02 0.37 0.13 0.14 -1.57 0.00 0.00 175.55 174.64 1qrk s VAL 84 N -1.07 0.03 -0.10 0.71 -7.23 -1.10 -3.82 120.40 107.81 1qrk s VAL 84 Ca 0.18 -1.93 -0.04 0.00 -1.81 0.00 0.00 61.98 58.38 1qrk s VAL 84 Cb -0.11 -2.34 0.05 0.00 0.56 0.00 0.00 36.38 34.54 1qrk s VAL 84 CO 0.10 -0.14 0.22 -1.58 -0.31 0.00 0.00 175.10 173.39 1qrk s GLN 85 N -4.12 0.14 -0.18 4.82 0.74 0.20 -1.98 119.66 119.29 1qrk s GLN 85 Ca 0.33 0.57 -0.04 0.00 0.05 0.00 0.00 55.36 56.28 1qrk s GLN 85 Cb 0.07 -0.13 -0.02 0.00 1.10 0.00 0.00 33.01 34.02 1qrk s GLN 85 CO 0.09 -0.22 -0.04 0.42 -0.55 0.00 0.00 175.29 174.99 1qrk s ILE 86 N 1.72 3.72 -0.21 -2.34 1.01 0.01 0.11 121.20 125.21 1qrk s ILE 86 Ca -0.05 -0.41 -0.14 0.00 0.00 0.00 0.00 60.65 60.05 1qrk s ILE 86 Cb -0.11 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 1qrk s ILE 86 CO -0.08 0.47 0.33 -1.81 0.00 0.00 0.00 174.94 173.85 1qrk s ASP 87 N 0.74 6.35 0.35 3.58 1.01 -0.23 -1.85 116.67 126.62 1qrk s ASP 87 Ca -0.02 0.40 0.07 0.00 0.71 0.00 0.00 52.55 53.72 1qrk s ASP 87 Cb -0.15 -2.20 -0.02 0.00 1.01 0.00 0.00 42.92 41.57 1qrk s ASP 87 CO 0.02 -0.04 0.39 -0.36 0.21 0.00 0.00 175.17 175.39 1qrk s PHE 88 N 1.24 2.97 -0.44 4.23 0.08 -0.13 0.88 117.98 126.81 1qrk s PHE 88 Ca 0.16 -0.29 0.26 0.00 0.12 0.00 0.00 56.93 57.18 1qrk s PHE 88 Cb -0.14 -1.94 0.98 0.00 -0.57 0.00 0.00 43.02 41.35 1qrk s PHE 88 CO 0.07 0.05 1.76 0.66 -0.10 0.00 0.00 175.22 177.66 1qrk h SER 89 N 1.05 0.00 -3.46 1.36 4.64 -1.08 -3.44 113.55 112.63 1qrk h SER 89 Ca -0.45 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.89 1qrk h SER 89 Cb 1.26 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.11 1qrk h SER 89 CO 0.55 0.00 0.26 0.00 -0.87 0.00 0.00 176.83 176.77 1qrk s ARG 90 N -3.33 0.66 0.08 4.77 1.70 -1.26 -5.00 118.95 116.57 1qrk s ARG 90 Ca 0.05 0.85 -0.19 0.00 -0.47 0.00 0.00 55.73 55.97 1qrk s ARG 90 Cb 0.10 0.29 -0.11 0.00 -0.57 0.00 0.00 34.95 34.66 1qrk s ARG 90 CO 0.47 -0.09 0.41 -0.35 -1.08 0.00 0.00 175.30 174.66 1qrk n PRO 91 N 2.79 0.00 -2.35 3.89 -0.04 -1.26 -4.83 135.00 133.20 1qrk n PRO 91 Ca -0.14 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.90 1qrk n PRO 91 Cb 0.56 -0.68 -0.03 0.00 -0.04 0.00 0.00 33.50 33.30 1qrk n PRO 91 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1qrk s TYR 92 N -0.40 3.40 -0.26 0.54 5.04 -1.26 -4.94 117.35 119.46 1qrk s TYR 92 Ca 0.43 1.34 0.03 0.00 -2.44 0.00 0.00 57.07 56.42 1qrk s TYR 92 Cb -0.61 -3.47 0.06 0.00 0.35 0.00 0.00 41.96 38.29 1qrk s TYR 92 CO 0.33 -1.39 -0.11 0.34 -1.34 0.00 0.00 175.55 173.38 1qrk s ASP 93 N 0.42 4.45 0.00 4.32 -1.08 -1.26 -5.01 116.67 118.50 1qrk s ASP 93 Ca 0.55 -1.38 0.02 0.00 -0.52 0.00 0.00 52.55 51.22 1qrk s ASP 93 Cb -0.33 -1.56 0.09 0.00 -1.46 0.00 0.00 42.92 39.67 1qrk s ASP 93 CO 0.35 -0.19 0.37 -0.81 0.52 0.00 0.00 175.17 175.41 1qrk n PRO 94 N 4.44 0.22 -0.01 4.34 -0.04 -1.26 -2.06 135.00 140.64 1qrk n PRO 94 Ca -0.14 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.36 1qrk n PRO 94 Cb 0.42 -1.11 -0.09 0.00 -0.04 0.00 0.00 33.50 32.68 1qrk n PRO 94 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1qrk n ARG 95 N -0.61 0.59 -0.03 0.54 3.00 -1.26 -4.81 116.66 114.08 1qrk n ARG 95 Ca 0.01 -0.09 -0.06 0.00 -0.01 0.00 0.00 57.85 57.70 1qrk n ARG 95 Cb 0.01 -1.28 -0.02 0.00 0.00 0.00 0.00 32.46 31.17 1qrk n ARG 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1qrk n ARG 96 N -1.97 0.11 -2.24 5.56 5.12 -1.03 -5.05 116.66 117.16 1qrk n ARG 96 Ca -0.04 0.05 -0.41 0.00 -1.93 0.00 0.00 57.85 55.51 1qrk n ARG 96 Cb 0.37 -0.69 -0.03 0.00 -1.16 0.00 0.00 32.46 30.95 1qrk n ARG 96 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1qrk s ASP 97 N -5.46 6.92 -0.03 0.55 1.01 -0.87 -5.03 116.67 113.75 1qrk s ASP 97 Ca -0.07 2.37 -0.01 0.00 0.71 0.00 0.00 52.55 55.55 1qrk s ASP 97 Cb 0.03 -2.61 0.03 0.00 1.01 0.00 0.00 42.92 41.38 1qrk s ASP 97 CO 0.09 -0.51 0.06 -0.76 0.21 0.00 0.00 175.17 174.26 1qrk s LEU 98 N -0.08 0.81 0.00 1.23 1.02 -1.26 -4.74 118.68 115.65 1qrk s LEU 98 Ca 0.56 0.10 -0.06 0.00 0.02 0.00 0.00 54.13 54.76 1qrk s LEU 98 Cb -0.36 0.01 0.02 0.00 0.02 0.00 0.00 46.19 45.88 1qrk s LEU 98 CO 0.38 -0.16 0.45 2.22 0.02 0.00 0.00 176.35 179.26 1qrk n PHE 99 N 4.42 -1.54 -3.63 0.29 -1.74 -1.26 -2.03 117.46 111.97 1qrk n PHE 99 Ca -0.23 -1.50 -0.04 0.00 -0.56 0.00 0.00 57.45 55.12 1qrk n PHE 99 Cb 0.50 0.52 -0.05 0.00 1.52 0.00 0.00 39.48 41.97 1qrk n PHE 99 CO 0.00 0.00 0.00 -0.98 -0.56 0.00 0.00 176.76 175.22 1qrk s ARG 100 N -2.33 0.20 0.41 3.97 1.70 -0.43 -4.43 118.95 118.04 1qrk s ARG 100 Ca 0.16 0.07 -0.20 0.00 -0.47 0.00 0.00 55.73 55.29 1qrk s ARG 100 Cb -0.02 0.09 -0.11 0.00 -0.57 0.00 0.00 34.95 34.35 1qrk s ARG 100 CO 0.12 -0.06 0.91 0.08 -1.08 0.00 0.00 175.30 175.27 1qrk s VAL 101 N -0.87 4.44 -0.02 4.99 1.01 -1.24 -0.53 120.40 128.19 1qrk s VAL 101 Ca 0.06 1.39 0.03 0.00 0.00 0.00 0.00 61.98 63.46 1qrk s VAL 101 Cb -0.01 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.76 1qrk s VAL 101 CO -0.07 -0.30 -0.10 -1.61 0.00 0.00 0.00 175.10 173.02 1qrk s GLU 102 N -3.16 0.95 -0.13 2.72 2.02 0.56 -4.00 118.70 117.66 1qrk s GLU 102 Ca 0.61 -0.36 0.02 0.00 0.02 0.00 0.00 54.97 55.26 1qrk s GLU 102 Cb -0.09 -0.90 0.01 0.00 0.10 0.00 0.00 34.13 33.25 1qrk s GLU 102 CO 0.14 0.18 -0.19 0.71 0.02 0.00 0.00 175.26 176.11 1qrk s TYR 103 N -0.03 2.39 0.08 1.61 2.02 -0.46 -1.51 117.35 121.45 1qrk s TYR 103 Ca 0.00 -1.18 0.05 0.00 -0.37 0.00 0.00 57.07 55.57 1qrk s TYR 103 Cb -0.07 -1.66 -0.03 0.00 -0.40 0.00 0.00 41.96 39.81 1qrk s TYR 103 CO 0.00 -0.56 -0.13 0.14 -1.57 0.00 0.00 175.55 173.43 1qrk s VAL 104 N 0.89 1.06 -0.02 0.71 -7.23 -1.05 -0.01 120.40 114.76 1qrk s VAL 104 Ca -0.07 -1.41 0.00 0.00 -1.81 0.00 0.00 61.98 58.70 1qrk s VAL 104 Cb -0.15 -1.15 0.02 0.00 0.56 0.00 0.00 36.38 35.66 1qrk s VAL 104 CO -0.02 -0.33 0.01 -0.51 -0.31 0.00 0.00 175.10 173.94 1qrk s ILE 105 N -1.63 0.04 0.00 -0.62 2.07 0.61 -2.22 121.20 119.46 1qrk s ILE 105 Ca 0.00 0.13 0.00 0.00 -1.41 0.00 0.00 60.65 59.37 1qrk s ILE 105 Cb -0.08 -0.14 0.00 0.00 0.13 0.00 0.00 42.46 42.37 1qrk s ILE 105 CO 0.02 0.09 0.00 0.61 -1.91 0.00 0.00 174.94 173.75 1qrk n GLY 106 N 3.96 -1.03 0.25 1.50 0.00 -1.25 -4.17 105.19 104.45 1qrk n GLY 106 Ca -0.25 -1.64 -0.07 0.00 0.00 0.00 0.00 46.02 44.06 1qrk n GLY 106 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1qrk h ARG 107 N 0.00 0.65 -2.29 1.61 2.43 -1.60 -3.29 114.38 111.90 1qrk h ARG 107 Ca 0.00 -0.29 -0.63 0.00 -0.81 0.00 0.00 59.98 58.26 1qrk h ARG 107 Cb 0.00 -0.02 -0.40 0.00 -0.42 0.00 0.00 29.97 29.13 1qrk h ARG 107 CO 0.00 0.88 -0.41 0.66 -1.51 0.00 0.00 179.97 179.59 1qrk n TYR 108 N -4.08 3.63 -1.66 2.20 4.01 -1.26 -4.20 117.16 115.81 1qrk n TYR 108 Ca -0.01 -3.89 -0.43 0.00 -0.16 0.00 0.00 57.90 53.41 1qrk n TYR 108 Cb 0.47 -0.63 -0.01 0.00 -0.31 0.00 0.00 39.34 38.86 1qrk n TYR 108 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1qrk n PRO 109 N 0.47 1.83 -3.67 -0.72 -0.02 -1.26 -4.78 135.00 126.85 1qrk n PRO 109 Ca 0.31 0.64 -0.09 0.00 -2.02 0.00 0.00 63.50 62.34 1qrk n PRO 109 Cb 0.39 -2.15 -0.10 0.00 -0.02 0.00 0.00 33.50 31.62 1qrk n PRO 109 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1qrk s GLN 110 N -1.78 0.34 0.22 -0.52 0.74 -1.26 -4.85 119.66 112.55 1qrk s GLN 110 Ca 0.57 0.97 -0.09 0.00 0.05 0.00 0.00 55.36 56.85 1qrk s GLN 110 Cb -0.61 0.23 0.18 0.00 1.10 0.00 0.00 33.01 33.91 1qrk s GLN 110 CO 0.61 -0.23 1.88 1.49 -0.55 0.00 0.00 175.29 178.49 1qrk h GLU 111 N 7.91 1.09 -1.29 1.67 4.81 -1.91 -1.17 114.58 125.68 1qrk h GLU 111 Ca -0.21 -0.08 0.38 0.00 -0.13 0.00 0.00 59.36 59.32 1qrk h GLU 111 Cb 1.13 -0.24 -0.08 0.00 0.63 0.00 0.00 28.75 30.19 1qrk h GLU 111 CO 0.16 0.74 0.88 -0.91 -0.73 0.00 0.00 179.01 179.16 1qrk h ASN 112 N 1.11 0.18 -0.01 1.04 2.35 -1.96 -1.37 115.58 116.91 1qrk h ASN 112 Ca 0.30 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 56.10 1qrk h ASN 112 Cb -0.09 0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.31 1qrk h ASN 112 CO -0.06 -0.02 0.00 0.29 -1.65 0.00 0.00 177.43 175.99 1qrk n LYS 113 N -4.39 1.43 -1.45 0.81 5.02 -0.51 -5.01 118.16 114.07 1qrk n LYS 113 Ca 0.31 -2.55 -0.15 0.00 -2.02 0.00 0.00 58.31 53.90 1qrk n LYS 113 Cb 1.30 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 34.75 1qrk n LYS 113 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1qrk n GLY 114 N -1.35 1.48 0.58 0.72 0.00 -0.52 -4.71 105.19 101.40 1qrk n GLY 114 Ca 0.16 -0.33 0.10 0.00 0.00 0.00 0.00 46.02 45.95 1qrk n GLY 114 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qrk n THR 115 N -2.60 0.00 -3.69 2.61 -2.24 -0.81 -4.75 114.28 102.80 1qrk n THR 115 Ca -0.15 -0.36 -0.18 0.00 -2.27 0.00 0.00 64.05 61.10 1qrk n THR 115 Cb 0.49 1.30 -0.17 0.00 -2.10 0.00 0.00 70.33 69.85 1qrk n THR 115 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1qrk s TYR 116 N -2.12 -0.03 -0.23 4.78 5.04 -1.23 -0.28 117.35 123.29 1qrk s TYR 116 Ca 0.19 0.36 -0.01 0.00 -2.44 0.00 0.00 57.07 55.17 1qrk s TYR 116 Cb 0.17 -0.36 0.07 0.00 0.35 0.00 0.00 41.96 42.18 1qrk s TYR 116 CO 0.43 -0.20 0.00 0.42 -1.34 0.00 0.00 175.55 174.87 1qrk s ILE 117 N 1.99 1.04 0.10 3.14 1.01 0.99 -4.09 121.20 125.38 1qrk s ILE 117 Ca 0.02 -0.98 -0.19 0.00 0.00 0.00 0.00 60.65 59.49 1qrk s ILE 117 Cb -0.12 -1.47 -0.07 0.00 0.01 0.00 0.00 42.46 40.80 1qrk s ILE 117 CO -0.04 -0.22 1.67 -0.65 0.00 0.00 0.00 174.94 175.70 1qrk h PRO 118 N 8.09 0.32 -5.44 2.79 0.11 -1.84 -1.21 132.00 134.81 1qrk h PRO 118 Ca -0.16 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.88 1qrk h PRO 118 Cb 1.09 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1qrk h PRO 118 CO 0.39 0.33 -0.92 0.28 -0.21 0.00 0.00 178.00 177.87 1qrk n VAL 119 N -4.85 -9.84 -2.22 3.15 0.31 -1.26 -4.05 118.33 99.58 1qrk n VAL 119 Ca -0.03 1.37 -0.27 0.00 -0.01 0.00 0.00 64.34 65.40 1qrk n VAL 119 Cb 0.10 -6.19 0.05 0.00 -0.91 0.00 0.00 33.84 26.89 1qrk n VAL 119 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1qrk s PRO 120 N -1.76 2.50 0.35 5.55 0.04 -1.26 -3.64 135.00 136.77 1qrk s PRO 120 Ca 0.07 -0.08 -0.26 0.00 0.04 0.00 0.00 61.00 60.76 1qrk s PRO 120 Cb -0.02 -2.18 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 1qrk s PRO 120 CO 0.66 -1.05 1.09 0.42 0.04 0.00 0.00 177.00 178.16 1qrk s ILE 121 N -3.19 3.52 0.01 0.56 1.09 -1.26 -1.30 121.20 120.63 1qrk s ILE 121 Ca 0.58 1.32 -0.01 0.00 -1.10 0.00 0.00 60.65 61.44 1qrk s ILE 121 Cb -0.11 -3.76 -0.01 0.00 -1.06 0.00 0.00 42.46 37.52 1qrk s ILE 121 CO 0.46 0.16 0.01 0.54 -0.10 0.00 0.00 174.94 176.01 1qrk s VAL 122 N -1.41 0.06 0.15 2.92 0.11 0.62 -4.78 120.40 118.07 1qrk s VAL 122 Ca 0.52 -0.49 -0.16 0.00 -2.93 0.00 0.00 61.98 58.93 1qrk s VAL 122 Cb -0.28 -0.18 0.02 0.00 -1.53 0.00 0.00 36.38 34.42 1qrk s VAL 122 CO 0.35 -0.27 1.79 -1.28 -3.33 0.00 0.00 175.10 172.36 1qrk h SER 123 N 5.27 0.52 -2.99 3.54 0.87 -1.96 -3.37 113.55 115.43 1qrk h SER 123 Ca -0.28 -0.05 -0.07 0.00 -1.23 0.00 0.00 61.79 60.16 1qrk h SER 123 Cb 1.21 -0.13 -0.25 0.00 -0.44 0.00 0.00 62.40 62.79 1qrk h SER 123 CO 0.45 0.42 -0.22 -0.70 -0.53 0.00 0.00 176.83 176.25 1qrk s GLU 124 N -6.01 0.47 0.10 2.24 2.56 -1.26 -4.89 118.70 111.91 1qrk s GLU 124 Ca -0.13 0.97 -0.33 0.00 0.00 0.00 0.00 54.97 55.48 1qrk s GLU 124 Cb 0.11 0.12 -0.12 0.00 2.00 0.00 0.00 34.13 36.24 1qrk s GLU 124 CO 0.74 -0.17 1.75 1.28 -0.56 0.00 0.00 175.26 178.29 1qrk n LEU 125 N 4.51 3.56 0.00 2.70 4.77 -1.26 -5.01 117.00 126.27 1qrk n LEU 125 Ca -0.20 1.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.81 1qrk n LEU 125 Cb 0.55 -1.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 1qrk n LEU 125 CO 0.04 -0.04 0.00 1.67 -1.33 0.00 0.00 177.39 177.72 1qrk n GLN 126 N 4.94 1.58 -3.80 3.23 0.00 -1.26 -5.06 117.38 117.01 1qrk n GLN 126 Ca 0.19 0.00 -0.35 0.00 -0.00 0.00 0.00 57.00 56.83 1qrk n GLN 126 Cb 0.32 0.00 -0.09 0.00 0.00 0.00 0.00 30.24 30.47 1qrk n GLN 126 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1qrk s SER 127 N -1.00 5.91 -1.48 1.69 1.04 -1.26 -4.49 113.70 114.10 1qrk s SER 127 Ca 0.00 0.11 -0.12 0.00 0.48 0.00 0.00 55.95 56.42 1qrk s SER 127 Cb 0.00 -2.04 0.06 0.00 0.10 0.00 0.00 66.02 64.14 1qrk s SER 127 CO 0.00 0.12 1.02 0.61 0.98 0.00 0.00 173.24 175.97 1qrk n GLY 128 N 3.90 -0.51 2.95 7.32 0.00 -1.26 -4.97 105.19 112.61 1qrk n GLY 128 Ca -0.16 0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 1qrk n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qrk s LYS 129 N -6.50 0.11 0.31 1.61 1.02 -1.26 -4.66 119.74 110.37 1qrk s LYS 129 Ca 0.63 0.43 -0.29 0.00 0.02 0.00 0.00 55.97 56.75 1qrk s LYS 129 Cb -0.31 -0.17 -0.12 0.00 -0.52 0.00 0.00 37.83 36.71 1qrk s LYS 129 CO 0.78 -0.18 1.45 0.91 -0.92 0.00 0.00 175.35 177.39 1qrk n TRP 130 N 4.32 2.59 -3.62 3.18 7.02 -1.26 -4.59 117.44 125.07 1qrk n TRP 130 Ca -0.24 0.42 -0.06 0.00 -1.02 0.00 0.00 57.50 56.60 1qrk n TRP 130 Cb 0.52 -2.50 -0.05 0.00 -2.42 0.00 0.00 31.31 26.85 1qrk n TRP 130 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1qrk s GLY 131 N 0.09 -0.00 -0.05 6.99 0.00 -1.12 -4.62 107.32 108.60 1qrk s GLY 131 Ca 0.60 2.68 0.05 0.00 0.00 0.00 0.00 44.72 48.04 1qrk s GLY 131 CO 0.56 1.30 -0.19 0.00 0.00 0.00 0.00 173.10 174.77 1qrk s ALA 132 N -0.74 1.69 -0.09 3.20 0.00 -0.42 -1.45 121.76 123.96 1qrk s ALA 132 Ca 0.05 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.25 1qrk s ALA 132 Cb -0.02 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.51 1qrk s ALA 132 CO -0.06 0.30 -0.12 0.21 0.00 0.00 0.00 175.76 176.09 1qrk s LYS 133 N 0.06 2.97 -0.22 0.00 2.20 -0.88 0.23 119.74 124.10 1qrk s LYS 133 Ca -0.06 -0.65 -0.29 0.00 -0.36 0.00 0.00 55.97 54.61 1qrk s LYS 133 Cb -0.13 -2.55 0.00 0.00 -1.51 0.00 0.00 37.83 33.64 1qrk s LYS 133 CO 0.03 0.45 1.14 0.42 -0.36 0.00 0.00 175.35 177.03 1qrk s ILE 134 N -0.25 4.49 -0.91 5.43 1.01 -1.26 -1.09 121.20 128.61 1qrk s ILE 134 Ca 0.02 1.79 0.10 0.00 0.00 0.00 0.00 60.65 62.56 1qrk s ILE 134 Cb -0.13 -4.20 -0.01 0.00 0.01 0.00 0.00 42.46 38.13 1qrk s ILE 134 CO 0.03 -0.21 0.63 0.55 0.00 0.00 0.00 174.94 175.93 1qrk n VAL 135 N 5.45 0.00 -3.64 2.92 3.14 -0.28 -4.98 118.33 120.94 1qrk n VAL 135 Ca 0.13 -0.38 -0.04 0.00 -2.96 0.00 0.00 64.34 61.08 1qrk n VAL 135 Cb 0.46 1.11 -0.07 0.00 -1.06 0.00 0.00 33.84 34.28 1qrk n VAL 135 CO 0.00 0.00 0.00 -0.32 -6.46 0.00 0.00 176.83 170.05 1qrk s MET 136 N -1.43 0.31 -0.33 1.45 -2.45 -1.18 -5.00 119.30 110.67 1qrk s MET 136 Ca 0.08 0.43 0.01 0.00 -1.25 0.00 0.00 55.69 54.96 1qrk s MET 136 Cb 0.08 0.12 0.10 0.00 1.25 0.00 0.00 34.83 36.38 1qrk s MET 136 CO 0.27 -0.05 0.09 1.03 1.05 0.00 0.00 175.02 177.42 1qrk s ARG 137 N 0.62 0.96 0.55 4.11 0.52 -1.26 -2.10 118.95 122.35 1qrk s ARG 137 Ca -0.01 -1.35 0.00 0.00 -0.52 0.00 0.00 55.73 53.85 1qrk s ARG 137 Cb -0.04 -2.35 0.03 0.00 0.52 0.00 0.00 34.95 33.11 1qrk s ARG 137 CO -0.11 -0.98 0.78 -1.21 0.02 0.00 0.00 175.30 173.80 1qrk s GLU 138 N 1.35 2.58 -0.25 3.54 0.41 -0.71 -4.95 118.70 120.68 1qrk s GLU 138 Ca 0.11 -0.69 -0.31 0.00 -0.41 0.00 0.00 54.97 53.67 1qrk s GLU 138 Cb -0.18 -2.47 -0.08 0.00 -1.78 0.00 0.00 34.13 29.62 1qrk s GLU 138 CO -0.19 -0.70 2.17 -0.40 -0.49 0.00 0.00 175.26 175.65 1qrk n ASP 139 N -2.36 2.90 -0.04 -0.19 5.68 -1.26 -1.56 116.55 119.72 1qrk n ASP 139 Ca 0.07 0.37 -0.01 0.00 -0.50 0.00 0.00 54.79 54.72 1qrk n ASP 139 Cb 0.59 -1.43 -0.00 0.00 -1.14 0.00 0.00 41.12 39.14 1qrk n ASP 139 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1qrk n ARG 140 N 8.33 -0.16 -3.72 0.11 1.74 -1.26 -4.95 116.66 116.75 1qrk n ARG 140 Ca 0.33 0.20 -0.14 0.00 -0.77 0.00 0.00 57.85 57.48 1qrk n ARG 140 Cb 0.35 -3.47 -0.14 0.00 -1.02 0.00 0.00 32.46 28.19 1qrk n ARG 140 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1qrk s SER 141 N -2.30 -0.01 -0.11 0.55 0.01 -0.60 -0.96 113.70 110.28 1qrk s SER 141 Ca 0.00 0.40 -0.03 0.00 1.31 0.00 0.00 55.95 57.63 1qrk s SER 141 Cb 0.00 0.32 -0.03 0.00 0.21 0.00 0.00 66.02 66.51 1qrk s SER 141 CO 0.00 -0.18 -0.00 -0.69 0.41 0.00 0.00 173.24 172.78 1qrk s VAL 142 N 1.46 4.27 -0.25 3.43 1.01 -0.77 -1.73 120.40 127.82 1qrk s VAL 142 Ca -0.07 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.69 1qrk s VAL 142 Cb -0.11 -2.83 0.06 0.00 0.00 0.00 0.00 36.38 33.50 1qrk s VAL 142 CO -0.07 0.56 -0.08 -0.60 0.00 0.00 0.00 175.10 174.91 1qrk s ARG 143 N -0.42 1.92 0.41 2.72 3.00 -0.89 -0.81 118.95 124.87 1qrk s ARG 143 Ca 0.08 -1.22 0.00 0.00 -1.00 0.00 0.00 55.73 53.59 1qrk s ARG 143 Cb -0.12 -2.77 -0.02 0.00 0.00 0.00 0.00 34.95 32.05 1qrk s ARG 143 CO 0.02 -0.60 0.62 -0.51 0.00 0.00 0.00 175.30 174.83 1qrk s LEU 144 N 1.22 3.80 -0.37 -0.88 1.43 -0.84 -1.13 118.68 121.91 1qrk s LEU 144 Ca -0.06 0.38 0.03 0.00 -1.03 0.00 0.00 54.13 53.44 1qrk s LEU 144 Cb -0.19 -3.25 0.11 0.00 0.03 0.00 0.00 46.19 42.88 1qrk s LEU 144 CO -0.06 -0.53 0.11 -0.55 0.23 0.00 0.00 176.35 175.55 1qrk s SER 145 N -4.14 4.48 -0.04 2.29 0.15 -0.25 -2.71 113.70 113.47 1qrk s SER 145 Ca 0.45 -2.24 -0.19 0.00 0.70 0.00 0.00 55.95 54.68 1qrk s SER 145 Cb -0.10 -1.45 -0.05 0.00 -1.71 0.00 0.00 66.02 62.71 1qrk s SER 145 CO 0.37 -0.35 0.52 -0.63 1.20 0.00 0.00 173.24 174.35 1qrk s ILE 146 N 0.80 5.01 -0.05 6.45 1.01 0.07 -2.07 121.20 132.42 1qrk s ILE 146 Ca 0.12 1.07 0.06 0.00 0.00 0.00 0.00 60.65 61.90 1qrk s ILE 146 Cb -0.20 -3.85 -0.02 0.00 0.01 0.00 0.00 42.46 38.40 1qrk s ILE 146 CO -0.09 0.43 -0.22 -1.58 0.00 0.00 0.00 174.94 173.47 1qrk s GLN 147 N -0.14 2.43 0.42 2.79 0.74 -0.53 -1.04 119.66 124.33 1qrk s GLN 147 Ca 0.28 -0.85 0.08 0.00 0.05 0.00 0.00 55.36 54.92 1qrk s GLN 147 Cb -0.17 -2.20 0.01 0.00 1.10 0.00 0.00 33.01 31.75 1qrk s GLN 147 CO 0.14 0.49 0.57 -1.54 -0.55 0.00 0.00 175.29 174.41 1qrk s SER 148 N -0.43 5.65 0.07 6.67 1.04 -1.26 -2.81 113.70 122.64 1qrk s SER 148 Ca 0.04 -0.42 -0.22 0.00 0.48 0.00 0.00 55.95 55.83 1qrk s SER 148 Cb -0.12 -0.66 -0.06 0.00 0.10 0.00 0.00 66.02 65.28 1qrk s SER 148 CO 0.01 -0.76 0.67 -0.55 0.98 0.00 0.00 173.24 173.59 1qrk s SER 149 N -4.35 7.16 0.07 7.02 0.15 -1.26 -3.85 113.70 118.64 1qrk s SER 149 Ca 0.55 1.38 0.11 0.00 0.70 0.00 0.00 55.95 58.68 1qrk s SER 149 Cb -0.10 -2.42 0.49 0.00 -1.71 0.00 0.00 66.02 62.28 1qrk s SER 149 CO 0.33 0.17 1.33 -2.65 1.20 0.00 0.00 173.24 173.62 1qrk n PRO 150 N 2.13 0.04 -0.46 5.44 -0.02 -1.26 -1.27 135.00 139.60 1qrk n PRO 150 Ca -0.07 0.43 0.08 0.00 -2.02 0.00 0.00 63.50 61.92 1qrk n PRO 150 Cb 0.50 -1.61 0.28 0.00 -0.02 0.00 0.00 33.50 32.65 1qrk n PRO 150 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1qrk n LYS 151 N -1.69 3.33 -1.74 -0.52 5.02 -1.26 -4.69 118.16 116.62 1qrk n LYS 151 Ca 0.01 -2.67 -0.38 0.00 -2.02 0.00 0.00 58.31 53.25 1qrk n LYS 151 Cb 0.09 -1.73 0.05 0.00 -0.02 0.00 0.00 35.03 33.42 1qrk n LYS 151 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qrk s ILE 153 N -1.31 2.73 -0.26 0.00 1.01 -1.26 -4.55 121.20 117.56 1qrk s ILE 153 Ca 0.74 0.47 -0.11 0.00 0.00 0.00 0.00 60.65 61.75 1qrk s ILE 153 Cb -0.41 -3.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.82 1qrk s ILE 153 CO 0.47 -0.09 0.19 -0.69 0.00 0.00 0.00 174.94 174.82 1qrk s VAL 154 N -1.60 5.32 -2.43 2.92 1.01 -0.33 -4.83 120.40 120.46 1qrk s VAL 154 Ca 0.75 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.93 1qrk s VAL 154 Cb -0.30 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1qrk s VAL 154 CO 0.33 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.33 1qrk n GLY 155 N 4.70 -1.75 3.42 4.51 0.00 -1.06 -4.86 105.19 110.14 1qrk n GLY 155 Ca -0.14 -1.11 -0.44 0.00 0.00 0.00 0.00 46.02 44.33 1qrk n GLY 155 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1qrk s LYS 156 N -1.63 3.09 0.34 1.61 2.20 -1.26 -1.80 119.74 122.29 1qrk s LYS 156 Ca 0.00 -1.07 -0.06 0.00 -0.36 0.00 0.00 55.97 54.48 1qrk s LYS 156 Cb 0.00 -4.17 -0.05 0.00 -1.51 0.00 0.00 37.83 32.10 1qrk s LYS 156 CO 0.00 -1.34 0.63 -0.06 -0.36 0.00 0.00 175.35 174.21 1qrk s PHE 157 N 2.63 3.48 -0.10 4.03 0.40 0.16 -4.88 117.98 123.69 1qrk s PHE 157 Ca 0.13 0.75 -0.10 0.00 -0.60 0.00 0.00 56.93 57.11 1qrk s PHE 157 Cb -0.21 -2.20 -0.05 0.00 0.51 0.00 0.00 43.02 41.07 1qrk s PHE 157 CO 0.09 0.07 0.24 1.03 0.70 0.00 0.00 175.22 177.35 1qrk s ARG 158 N -3.74 3.78 0.07 0.44 0.52 -0.94 -0.63 118.95 118.45 1qrk s ARG 158 Ca 0.46 0.04 0.02 0.00 -0.52 0.00 0.00 55.73 55.73 1qrk s ARG 158 Cb -0.10 -3.26 -0.04 0.00 0.52 0.00 0.00 34.95 32.06 1qrk s ARG 158 CO 0.31 0.62 0.15 1.41 0.02 0.00 0.00 175.30 177.81 1qrk s MET 159 N -0.65 3.16 -0.07 3.54 1.75 -1.26 -2.53 119.30 123.24 1qrk s MET 159 Ca 0.17 -0.57 -0.20 0.00 -1.25 0.00 0.00 55.69 53.83 1qrk s MET 159 Cb -0.13 -2.88 0.04 0.00 2.84 0.00 0.00 34.83 34.70 1qrk s MET 159 CO 0.06 0.58 0.48 0.71 -0.65 0.00 0.00 175.02 176.20 1qrk s TYR 160 N -1.46 -0.43 -0.08 4.11 2.02 -0.57 -4.74 117.35 116.20 1qrk s TYR 160 Ca 0.32 0.83 0.02 0.00 -0.37 0.00 0.00 57.07 57.88 1qrk s TYR 160 Cb -0.12 0.22 -0.02 0.00 -0.40 0.00 0.00 41.96 41.63 1qrk s TYR 160 CO 0.25 -0.42 -0.14 0.08 -1.57 0.00 0.00 175.55 173.75 1qrk s VAL 161 N -0.83 3.01 -0.07 0.71 1.01 -1.26 -0.33 120.40 122.64 1qrk s VAL 161 Ca -0.09 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1qrk s VAL 161 Cb -0.03 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 34.15 1qrk s VAL 161 CO 0.05 0.56 -0.13 0.00 0.00 0.00 0.00 175.10 175.59 1qrk s ALA 162 N -0.26 1.30 -0.22 5.51 0.00 0.31 -1.08 121.76 127.32 1qrk s ALA 162 Ca 0.02 -0.44 -0.06 0.00 0.00 0.00 0.00 51.96 51.48 1qrk s ALA 162 Cb -0.13 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.40 1qrk s ALA 162 CO 0.03 0.13 0.01 0.08 0.00 0.00 0.00 175.76 176.01 1qrk s VAL 163 N 0.63 3.97 -0.22 0.00 1.01 0.16 -1.31 120.40 124.63 1qrk s VAL 163 Ca -0.14 -0.30 -0.24 0.00 0.00 0.00 0.00 61.98 61.29 1qrk s VAL 163 Cb -0.16 -2.81 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 1qrk s VAL 163 CO 0.04 0.40 0.80 0.26 0.00 0.00 0.00 175.10 176.60 1qrk s TRP 164 N 1.26 3.34 0.30 5.22 0.52 -0.86 -0.68 118.94 128.04 1qrk s TRP 164 Ca 0.04 1.13 0.08 0.00 0.02 0.00 0.00 56.10 57.36 1qrk s TRP 164 Cb -0.15 -3.01 -0.03 0.00 -1.15 0.00 0.00 33.47 29.13 1qrk s TRP 164 CO 0.01 -0.33 0.20 0.95 0.02 0.00 0.00 176.95 177.80 1qrk s THR 165 N 2.56 3.78 -1.82 2.01 -4.23 0.16 -4.63 115.64 113.46 1qrk s THR 165 Ca 0.35 -1.50 0.19 0.00 -1.18 0.00 0.00 61.69 59.55 1qrk s THR 165 Cb -0.16 -3.19 0.49 0.00 1.34 0.00 0.00 72.50 70.98 1qrk s THR 165 CO 0.09 -0.27 1.57 -0.81 -0.54 0.00 0.00 174.62 174.67 1qrk n PRO 166 N -1.21 0.51 -0.00 3.99 -0.04 -1.26 -2.39 135.00 134.61 1qrk n PRO 166 Ca -0.05 0.03 0.07 0.00 -0.04 0.00 0.00 63.50 63.52 1qrk n PRO 166 Cb 0.59 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 1qrk n PRO 166 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1qrk n TYR 167 N -1.09 0.00 -3.65 0.54 4.01 -1.26 -5.00 117.16 110.71 1qrk n TYR 167 Ca 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.87 1qrk n TYR 167 Cb 0.09 -0.24 0.00 0.00 -0.31 0.00 0.00 39.34 38.89 1qrk n TYR 167 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1qrk n GLY 168 N 1.57 -0.74 3.69 2.72 0.00 -1.00 0.21 105.19 111.62 1qrk n GLY 168 Ca -0.01 -1.23 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 1qrk n GLY 168 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qrk s VAL 169 N -2.96 4.01 -0.07 1.61 -7.23 0.16 0.38 120.40 116.30 1qrk s VAL 169 Ca 0.00 -0.99 0.05 0.00 -1.81 0.00 0.00 61.98 59.24 1qrk s VAL 169 Cb 0.00 -2.91 -0.01 0.00 0.56 0.00 0.00 36.38 34.02 1qrk s VAL 169 CO 0.00 0.12 -0.24 -0.76 -0.31 0.00 0.00 175.10 173.92 1qrk s LEU 170 N -2.29 2.13 0.07 1.32 1.43 0.14 -0.98 118.68 120.50 1qrk s LEU 170 Ca 0.26 -0.50 -0.05 0.00 -1.03 0.00 0.00 54.13 52.81 1qrk s LEU 170 Cb -0.12 -1.40 -0.02 0.00 0.03 0.00 0.00 46.19 44.69 1qrk s LEU 170 CO 0.18 0.23 0.08 0.00 0.23 0.00 0.00 176.35 177.08 1qrk s ARG 171 N -0.10 0.71 1.28 1.70 1.70 0.16 0.36 118.95 124.77 1qrk s ARG 171 Ca -0.05 -1.05 -0.17 0.00 -0.47 0.00 0.00 55.73 53.99 1qrk s ARG 171 Cb -0.14 0.27 0.32 0.00 -0.57 0.00 0.00 34.95 34.83 1qrk s ARG 171 CO 0.04 -0.18 0.91 0.25 -1.08 0.00 0.00 175.30 175.24 1qrk n THR 172 N 0.10 0.00 -4.19 4.99 -2.24 -0.24 -4.52 114.28 108.19 1qrk n THR 172 Ca -0.15 -0.34 -0.22 0.00 -2.27 0.00 0.00 64.05 61.06 1qrk n THR 172 Cb 0.61 -0.97 -0.06 0.00 -2.10 0.00 0.00 70.33 67.82 1qrk n THR 172 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1qrk s SER 173 N -2.55 5.10 -0.45 3.42 1.04 -1.26 -4.67 113.70 114.33 1qrk s SER 173 Ca 0.67 -0.42 -0.45 0.00 0.48 0.00 0.00 55.95 56.23 1qrk s SER 173 Cb -0.21 -1.16 -0.19 0.00 0.10 0.00 0.00 66.02 64.56 1qrk s SER 173 CO 0.63 -0.02 1.68 -1.14 0.98 0.00 0.00 173.24 175.36 1qrk n ARG 174 N -1.06 0.28 -3.62 4.02 3.00 -1.26 -4.92 116.66 113.10 1qrk n ARG 174 Ca -0.07 0.10 -0.29 0.00 -0.00 0.00 0.00 57.85 57.59 1qrk n ARG 174 Cb 0.58 -1.65 -0.14 0.00 0.00 0.00 0.00 32.46 31.25 1qrk n ARG 174 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1qrk s ASN 175 N 3.39 3.65 0.57 6.15 2.47 -1.26 -5.01 114.94 124.90 1qrk s ASN 175 Ca 1.05 -1.67 0.25 0.00 0.42 0.00 0.00 52.86 52.90 1qrk s ASN 175 Cb -1.39 -0.61 1.63 0.00 -1.45 0.00 0.00 41.25 39.43 1qrk s ASN 175 CO 0.77 -0.40 2.22 -0.65 -3.72 0.00 0.00 177.10 175.32 1qrk h PRO 176 N 7.93 0.00 0.00 0.43 0.11 -1.96 -2.60 132.00 135.91 1qrk h PRO 176 Ca -0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1qrk h PRO 176 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1qrk h PRO 176 CO 0.43 0.00 0.00 -1.91 -0.21 0.00 0.00 178.00 176.31 1qrk n GLU 177 N -4.08 0.18 -0.66 1.05 4.07 -1.26 -2.91 120.64 117.02 1qrk n GLU 177 Ca -0.03 0.28 0.08 0.00 -0.06 0.00 0.00 57.16 57.44 1qrk n GLU 177 Cb 0.09 -1.77 0.34 0.00 -0.06 0.00 0.00 31.44 30.04 1qrk n GLU 177 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1qrk n THR 178 N -2.09 2.25 -2.28 6.31 -2.24 -0.98 -4.75 114.28 110.51 1qrk n THR 178 Ca 0.04 -1.43 -0.40 0.00 -2.27 0.00 0.00 64.05 59.99 1qrk n THR 178 Cb 0.31 -0.09 -0.03 0.00 -2.10 0.00 0.00 70.33 68.42 1qrk n THR 178 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1qrk s ASP 179 N -1.11 6.86 -0.05 3.42 1.01 -1.15 -4.05 116.67 121.61 1qrk s ASP 179 Ca 0.49 2.47 0.04 0.00 0.71 0.00 0.00 52.55 56.26 1qrk s ASP 179 Cb 0.35 -2.63 -0.00 0.00 1.01 0.00 0.00 42.92 41.65 1qrk s ASP 179 CO 0.17 -0.45 -0.18 -0.89 0.21 0.00 0.00 175.17 174.03 1qrk s THR 180 N -1.22 1.53 -0.01 -1.27 2.01 0.19 -3.75 115.64 113.12 1qrk s THR 180 Ca 0.50 -0.76 -0.12 0.00 0.31 0.00 0.00 61.69 61.62 1qrk s THR 180 Cb -0.35 -1.32 -0.05 0.00 0.01 0.00 0.00 72.50 70.79 1qrk s THR 180 CO 0.45 0.44 0.34 -0.31 -0.69 0.00 0.00 174.62 174.86 1qrk s TYR 181 N 0.09 3.67 -0.23 4.92 1.51 -0.71 0.36 117.35 126.95 1qrk s TYR 181 Ca -0.06 0.84 -0.00 0.00 -1.01 0.00 0.00 57.07 56.83 1qrk s TYR 181 Cb -0.13 -2.18 0.07 0.00 -0.11 0.00 0.00 41.96 39.61 1qrk s TYR 181 CO 0.03 0.64 -0.01 0.42 -1.11 0.00 0.00 175.55 175.52 1qrk s ILE 182 N -1.14 1.19 0.47 2.71 1.01 -0.74 -0.98 121.20 123.71 1qrk s ILE 182 Ca 0.24 -1.08 0.02 0.00 0.00 0.00 0.00 60.65 59.83 1qrk s ILE 182 Cb -0.15 -1.58 0.01 0.00 0.01 0.00 0.00 42.46 40.75 1qrk s ILE 182 CO 0.12 -0.21 0.67 -0.76 0.00 0.00 0.00 174.94 174.77 1qrk s LEU 183 N 1.54 3.55 0.96 2.97 1.43 0.05 -2.56 118.68 126.62 1qrk s LEU 183 Ca -0.02 0.02 -0.11 0.00 -1.03 0.00 0.00 54.13 52.99 1qrk s LEU 183 Cb -0.18 -2.93 0.17 0.00 0.03 0.00 0.00 46.19 43.27 1qrk s LEU 183 CO -0.09 -0.84 1.10 -0.36 0.23 0.00 0.00 176.35 176.39 1qrk s PHE 184 N -2.56 1.83 -0.32 0.29 0.08 -0.43 -0.71 117.98 116.15 1qrk s PHE 184 Ca 0.52 1.49 -0.02 0.00 0.12 0.00 0.00 56.93 59.04 1qrk s PHE 184 Cb -0.10 -3.20 0.12 0.00 -0.57 0.00 0.00 43.02 39.26 1qrk s PHE 184 CO 0.37 -2.86 0.16 1.21 -0.10 0.00 0.00 175.22 174.00 1qrk s ASN 185 N -2.90 3.35 0.00 1.36 2.47 -1.26 -4.52 114.94 113.44 1qrk s ASN 185 Ca 0.66 -1.71 0.10 0.00 0.42 0.00 0.00 52.86 52.32 1qrk s ASN 185 Cb -0.21 -0.42 0.46 0.00 -1.45 0.00 0.00 41.25 39.62 1qrk s ASN 185 CO 0.59 -0.38 1.29 -2.65 -3.72 0.00 0.00 177.10 172.23 1qrk n PRO 186 N 4.69 0.05 0.00 0.43 -0.02 -1.26 -2.28 135.00 136.60 1qrk n PRO 186 Ca 0.02 0.28 0.12 0.00 -2.02 0.00 0.00 63.50 61.90 1qrk n PRO 186 Cb 0.40 -1.50 0.27 0.00 -0.02 0.00 0.00 33.50 32.65 1qrk n PRO 186 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1qrk n TRP 187 N -1.42 0.00 -3.54 6.00 8.01 -1.26 -1.47 117.44 123.75 1qrk n TRP 187 Ca 0.03 0.00 -0.38 0.00 -1.31 0.00 0.00 57.50 55.84 1qrk n TRP 187 Cb 0.10 -0.17 -0.10 0.00 -2.01 0.00 0.00 31.31 29.13 1qrk n TRP 187 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1qrk h GLU 189 N 8.11 0.12 -0.31 0.00 9.09 -1.90 -1.49 114.58 128.20 1qrk h GLU 189 Ca -0.35 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.05 1qrk h GLU 189 Cb 1.18 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 28.25 1qrk h GLU 189 CO 0.60 0.08 0.00 -0.25 0.05 0.00 0.00 179.01 179.49 1qrk n ASP 190 N -4.36 1.83 -4.71 3.06 8.00 -1.26 -4.86 116.55 114.24 1qrk n ASP 190 Ca 0.17 -1.94 -0.35 0.00 0.71 0.00 0.00 54.79 53.38 1qrk n ASP 190 Cb 0.82 -0.21 -0.08 0.00 -0.02 0.00 0.00 41.12 41.63 1qrk n ASP 190 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1qrk s ASP 191 N -1.12 6.18 0.44 -2.24 -1.08 -0.56 -4.80 116.67 113.49 1qrk s ASP 191 Ca 0.25 0.20 0.29 0.00 -0.52 0.00 0.00 52.55 52.77 1qrk s ASP 191 Cb 0.13 -2.09 1.37 0.00 -1.46 0.00 0.00 42.92 40.88 1qrk s ASP 191 CO 0.18 0.16 1.66 0.00 0.52 0.00 0.00 175.17 177.69 1qrk h ALA 192 N 6.85 2.69 -0.31 3.66 0.00 -1.88 0.44 119.26 130.71 1qrk h ALA 192 Ca -0.40 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1qrk h ALA 192 Cb 1.15 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1qrk h ALA 192 CO 0.74 -1.26 0.04 1.55 0.00 0.00 0.00 179.25 180.33 1qrk n VAL 193 N -4.62 1.44 -2.24 0.00 3.14 -1.26 -2.17 118.33 112.62 1qrk n VAL 193 Ca 0.34 -0.71 -0.42 0.00 -2.96 0.00 0.00 64.34 60.59 1qrk n VAL 193 Cb 1.33 -0.44 -0.03 0.00 -1.06 0.00 0.00 33.84 33.63 1qrk n VAL 193 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 1qrk s TYR 194 N -1.82 2.98 -0.21 1.45 5.04 0.14 -4.28 117.35 120.65 1qrk s TYR 194 Ca 0.27 0.90 -0.06 0.00 -2.44 0.00 0.00 57.07 55.74 1qrk s TYR 194 Cb 0.21 -3.63 -0.03 0.00 0.35 0.00 0.00 41.96 38.86 1qrk s TYR 194 CO 0.07 -2.29 0.02 -0.51 -1.34 0.00 0.00 175.55 171.50 1qrk s LEU 195 N 2.06 3.32 0.00 6.97 1.43 -0.55 -5.01 118.68 126.91 1qrk s LEU 195 Ca 0.63 -0.18 0.21 0.00 -1.03 0.00 0.00 54.13 53.76 1qrk s LEU 195 Cb -0.32 -1.85 1.23 0.00 0.03 0.00 0.00 46.19 45.28 1qrk s LEU 195 CO 0.27 0.06 1.62 -0.90 0.23 0.00 0.00 176.35 177.63 1qrk n ASP 196 N 4.30 0.00 -3.77 2.29 5.75 -1.26 -4.73 116.55 119.12 1qrk n ASP 196 Ca -0.17 -0.69 -0.13 0.00 -0.01 0.00 0.00 54.79 53.79 1qrk n ASP 196 Cb 0.52 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.50 1qrk n ASP 196 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1qrk s ASN 197 N -1.98 -0.29 0.39 -1.12 2.20 -1.26 -5.05 114.94 107.82 1qrk s ASN 197 Ca 0.31 0.55 0.15 0.00 -0.94 0.00 0.00 52.86 52.93 1qrk s ASN 197 Cb 0.14 0.58 1.01 0.00 -2.00 0.00 0.00 41.25 40.98 1qrk s ASN 197 CO 0.24 -0.12 1.81 -0.08 -2.94 0.00 0.00 177.10 176.01 1qrk h GLU 198 N 5.57 0.47 -0.11 3.55 4.57 -1.99 -2.48 114.58 124.15 1qrk h GLU 198 Ca -0.26 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 57.91 1qrk h GLU 198 Cb 1.19 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.65 1qrk h GLU 198 CO 0.33 0.31 -0.02 0.87 -1.18 0.00 0.00 179.01 179.32 1qrk h LYS 199 N 0.48 0.02 0.12 1.92 1.79 -1.99 0.15 116.57 119.06 1qrk h LYS 199 Ca 0.53 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 59.00 1qrk h LYS 199 Cb 1.22 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 1qrk h LYS 199 CO -0.26 0.01 -0.06 0.93 -1.08 0.00 0.00 179.45 179.00 1qrk h GLU 200 N 0.02 -0.15 -0.71 3.15 5.08 -1.89 -1.51 114.58 118.57 1qrk h GLU 200 Ca 0.05 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.56 1qrk h GLU 200 Cb 0.07 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.27 1qrk h GLU 200 CO -0.11 0.13 0.25 0.00 -1.00 0.00 0.00 179.01 178.29 1qrk h ARG 201 N -0.42 0.38 -0.09 2.33 3.08 -1.29 0.16 114.38 118.53 1qrk h ARG 201 Ca -0.02 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1qrk h ARG 201 Cb 0.35 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1qrk h ARG 201 CO 0.03 0.25 0.06 1.49 -1.07 0.00 0.00 179.97 180.73 1qrk h GLU 202 N 0.40 0.13 0.51 0.04 4.81 -0.61 -1.32 114.58 118.53 1qrk h GLU 202 Ca 0.39 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.58 1qrk h GLU 202 Cb 0.58 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1qrk h GLU 202 CO -0.40 0.10 -0.24 1.49 -0.73 0.00 0.00 179.01 179.22 1qrk h GLU 203 N 0.11 -0.65 0.00 1.92 4.57 -0.07 -1.09 114.58 119.37 1qrk h GLU 203 Ca 0.03 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1qrk h GLU 203 Cb 0.00 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 1qrk h GLU 203 CO -0.01 -0.44 0.00 0.66 -1.18 0.00 0.00 179.01 178.05 1qrk n TYR 204 N -4.40 0.00 0.03 0.92 4.01 0.41 -3.07 117.16 115.05 1qrk n TYR 204 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 1qrk n TYR 204 Cb 0.27 -0.39 0.00 0.00 -0.31 0.00 0.00 39.34 38.91 1qrk n TYR 204 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1qrk n VAL 205 N -1.39 0.31 0.64 -0.72 0.31 -0.54 -2.76 118.33 114.17 1qrk n VAL 205 Ca 0.07 0.10 0.13 0.00 -0.01 0.00 0.00 64.34 64.63 1qrk n VAL 205 Cb 0.20 -1.18 0.45 0.00 -0.91 0.00 0.00 33.84 32.39 1qrk n VAL 205 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1qrk n LEU 206 N -3.08 0.65 -4.65 7.52 7.99 -0.76 -4.79 117.00 119.88 1qrk n LEU 206 Ca 0.00 0.58 -0.41 0.00 -0.01 0.00 0.00 56.01 56.17 1qrk n LEU 206 Cb 0.21 -0.39 -0.05 0.00 -0.11 0.00 0.00 43.42 43.07 1qrk n LEU 206 CO 0.00 -0.22 0.49 0.21 -1.51 0.00 0.00 177.39 176.35 1qrk s ASN 207 N -4.22 6.76 -0.36 -1.43 3.84 -0.49 -4.94 114.94 114.11 1qrk s ASN 207 Ca 0.10 0.94 0.08 0.00 0.21 0.00 0.00 52.86 54.19 1qrk s ASN 207 Cb 0.13 -2.39 0.71 0.00 -0.55 0.00 0.00 41.25 39.15 1qrk s ASN 207 CO 0.54 -0.36 1.82 -0.90 -2.79 0.00 0.00 177.10 175.41 1qrk n ASP 208 N 5.37 4.38 -3.87 -4.21 5.75 -1.26 -4.90 116.55 117.81 1qrk n ASP 208 Ca 0.01 -3.37 -0.12 0.00 -0.01 0.00 0.00 54.79 51.31 1qrk n ASP 208 Cb 0.49 -0.77 -0.13 0.00 -1.03 0.00 0.00 41.12 39.68 1qrk n ASP 208 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1qrk s ILE 209 N -3.10 0.02 0.27 2.12 1.01 -1.26 -1.04 121.20 119.22 1qrk s ILE 209 Ca 0.55 -0.12 -0.03 0.00 0.00 0.00 0.00 60.65 61.04 1qrk s ILE 209 Cb 0.45 -0.11 -0.02 0.00 0.01 0.00 0.00 42.46 42.79 1qrk s ILE 209 CO 0.12 -0.07 0.35 -0.83 0.00 0.00 0.00 174.94 174.51 1qrk s GLY 210 N -0.19 1.34 0.03 6.18 0.00 0.08 -4.91 107.32 109.85 1qrk s GLY 210 Ca -0.02 -1.48 0.09 0.00 0.00 0.00 0.00 44.72 43.30 1qrk s GLY 210 CO 0.00 -1.08 -0.25 -1.34 0.00 0.00 0.00 173.10 170.42 1qrk s VAL 211 N -3.69 2.22 -0.13 1.40 -7.23 -1.26 0.04 120.40 111.75 1qrk s VAL 211 Ca 0.32 -1.31 -0.01 0.00 -1.81 0.00 0.00 61.98 59.18 1qrk s VAL 211 Cb 0.02 -1.85 -0.02 0.00 0.56 0.00 0.00 36.38 35.09 1qrk s VAL 211 CO 0.16 0.41 -0.10 -0.63 -0.31 0.00 0.00 175.10 174.62 1qrk s ILE 212 N -0.78 3.33 -0.25 -0.62 1.01 0.56 -4.70 121.20 119.75 1qrk s ILE 212 Ca 0.12 -0.57 -0.12 0.00 0.00 0.00 0.00 60.65 60.07 1qrk s ILE 212 Cb -0.10 -2.41 -0.05 0.00 0.01 0.00 0.00 42.46 39.92 1qrk s ILE 212 CO 0.02 0.53 0.24 -0.36 0.00 0.00 0.00 174.94 175.37 1qrk s PHE 213 N 0.19 3.29 0.00 3.97 0.40 -1.26 -1.78 117.98 122.79 1qrk s PHE 213 Ca -0.06 0.30 0.00 0.00 -0.60 0.00 0.00 56.93 56.57 1qrk s PHE 213 Cb -0.15 -2.39 0.00 0.00 0.51 0.00 0.00 43.02 41.00 1qrk s PHE 213 CO 0.04 -0.05 0.00 2.48 0.70 0.00 0.00 175.22 178.40 1qrk n TYR 214 N 4.66 0.00 0.00 0.36 4.11 0.14 -4.84 117.16 121.58 1qrk n TYR 214 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.77 1qrk n TYR 214 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.86 1qrk n TYR 214 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1qrk n GLY 215 N 1.45 1.09 3.42 -7.48 0.00 -1.26 -1.67 105.19 100.74 1qrk n GLY 215 Ca 0.00 -0.85 -0.16 0.00 0.00 0.00 0.00 46.02 45.01 1qrk n GLY 215 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1qrk s GLU 216 N 0.00 0.98 0.24 1.61 4.04 -1.14 -4.64 118.70 119.79 1qrk s GLU 216 Ca 0.00 -0.02 0.07 0.00 0.04 0.00 0.00 54.97 55.07 1qrk s GLU 216 Cb 0.00 0.45 0.72 0.00 0.02 0.00 0.00 34.13 35.33 1qrk s GLU 216 CO 0.00 -0.32 1.11 1.33 -1.84 0.00 0.00 175.26 175.54 1qrk n VAL 217 N 0.78 -0.30 -0.00 1.83 0.24 -1.26 -0.16 118.33 119.46 1qrk n VAL 217 Ca -0.19 1.50 -0.01 0.00 -2.04 0.00 0.00 64.34 63.60 1qrk n VAL 217 Cb 0.58 -2.30 0.17 0.00 -1.47 0.00 0.00 33.84 30.82 1qrk n VAL 217 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1qrk n ASN 218 N -4.80 3.39 0.00 -1.34 3.02 -1.26 -4.29 115.26 109.98 1qrk n ASN 218 Ca 0.21 -2.57 0.00 0.00 -0.03 0.00 0.00 54.58 52.19 1qrk n ASN 218 Cb 0.71 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 1qrk n ASN 218 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1qrk n ASP 219 N 0.13 0.00 -4.68 6.41 2.03 0.77 -5.02 116.55 116.19 1qrk n ASP 219 Ca 0.19 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 55.07 1qrk n ASP 219 Cb 0.83 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 41.21 1qrk n ASP 219 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1qrk s ILE 220 N 0.00 3.78 -0.07 5.18 1.01 -1.08 -2.89 121.20 127.13 1qrk s ILE 220 Ca 0.00 1.09 0.01 0.00 0.00 0.00 0.00 60.65 61.74 1qrk s ILE 220 Cb 0.00 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.74 1qrk s ILE 220 CO 0.00 -0.04 -0.07 -0.54 0.00 0.00 0.00 174.94 174.29 1qrk s LYS 221 N 2.96 2.77 0.28 2.79 1.02 -0.67 -4.97 119.74 123.93 1qrk s LYS 221 Ca 0.64 -0.55 0.11 0.00 0.02 0.00 0.00 55.97 56.19 1qrk s LYS 221 Cb -0.30 -2.60 -0.05 0.00 -0.52 0.00 0.00 37.83 34.36 1qrk s LYS 221 CO 0.25 0.65 -0.12 0.95 -0.92 0.00 0.00 175.35 176.16 1qrk s THR 222 N -0.77 2.77 -0.27 2.17 -4.23 -1.26 0.23 115.64 114.28 1qrk s THR 222 Ca 0.12 -2.22 -0.24 0.00 -1.18 0.00 0.00 61.69 58.17 1qrk s THR 222 Cb -0.11 -2.52 0.08 0.00 1.34 0.00 0.00 72.50 71.29 1qrk s THR 222 CO 0.01 -0.37 0.76 0.00 -0.54 0.00 0.00 174.62 174.49 1qrk s ARG 223 N -3.58 0.78 0.19 3.99 1.04 -0.73 -4.94 118.95 115.70 1qrk s ARG 223 Ca 0.31 0.96 -0.30 0.00 -1.04 0.00 0.00 55.73 55.66 1qrk s ARG 223 Cb -0.05 0.36 -0.08 0.00 -2.04 0.00 0.00 34.95 33.15 1qrk s ARG 223 CO 0.17 -0.10 1.08 -1.12 -0.04 0.00 0.00 175.30 175.29 1qrk s SER 224 N 0.48 7.30 -0.02 -2.89 0.01 -1.26 -0.32 113.70 116.99 1qrk s SER 224 Ca -0.01 2.09 0.03 0.00 1.31 0.00 0.00 55.95 59.37 1qrk s SER 224 Cb -0.05 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.58 1qrk s SER 224 CO -0.02 -0.19 -0.09 0.86 0.41 0.00 0.00 173.24 174.21 1qrk s TRP 225 N -0.37 0.95 -0.36 2.43 -0.11 0.11 -4.91 118.94 116.67 1qrk s TRP 225 Ca 0.48 -0.23 -0.20 0.00 1.22 0.00 0.00 56.10 57.37 1qrk s TRP 225 Cb -0.29 -0.66 0.00 0.00 -1.50 0.00 0.00 33.47 31.02 1qrk s TRP 225 CO 0.35 -0.08 0.64 0.45 -4.62 0.00 0.00 176.95 173.68 1qrk s SER 226 N 0.10 6.42 0.14 5.86 0.15 -1.12 -0.74 113.70 124.51 1qrk s SER 226 Ca -0.02 0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.75 1qrk s SER 226 Cb -0.08 -2.33 -0.07 0.00 -1.71 0.00 0.00 66.02 61.83 1qrk s SER 226 CO 0.00 -0.61 1.32 1.88 1.20 0.00 0.00 173.24 177.04 1qrk h TYR 227 N 8.49 0.38 -6.90 3.44 0.05 -1.44 -0.65 116.97 120.35 1qrk h TYR 227 Ca -0.26 -0.22 -0.58 0.00 0.05 0.00 0.00 58.73 57.72 1qrk h TYR 227 Cb 1.11 -0.04 -0.26 0.00 1.01 0.00 0.00 36.73 38.55 1qrk h TYR 227 CO 0.75 1.06 -0.86 0.41 -1.05 0.00 0.00 178.16 178.47 1qrk n GLY 228 N 1.00 -0.42 0.27 3.88 0.00 -0.88 -4.51 105.19 104.53 1qrk n GLY 228 Ca -0.05 0.12 0.02 0.00 0.00 0.00 0.00 46.02 46.11 1qrk n GLY 228 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1qrk h GLN 229 N -1.31 0.39 -0.00 1.61 -0.00 -1.88 -1.72 115.11 112.19 1qrk h GLN 229 Ca -0.60 -0.07 0.00 0.00 -0.00 0.00 0.00 58.65 57.99 1qrk h GLN 229 Cb 1.39 -0.07 0.00 0.00 -0.00 0.00 0.00 27.48 28.80 1qrk h GLN 229 CO 0.81 0.41 -0.07 1.19 -0.00 0.00 0.00 178.83 181.17 1qrk n PHE 230 N -4.34 0.00 -1.06 0.06 3.72 -1.26 -4.20 117.46 110.39 1qrk n PHE 230 Ca 0.01 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.10 1qrk n PHE 230 Cb 0.20 -0.15 0.12 0.00 -0.94 0.00 0.00 39.48 38.71 1qrk n PHE 230 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1qrk s GLU 231 N -2.37 1.76 0.13 -1.08 0.41 -0.65 -2.44 118.70 114.45 1qrk s GLU 231 Ca 0.33 1.28 -0.31 0.00 -0.41 0.00 0.00 54.97 55.86 1qrk s GLU 231 Cb 0.20 -1.83 -0.09 0.00 -1.78 0.00 0.00 34.13 30.64 1qrk s GLU 231 CO 0.45 -2.03 1.45 0.34 -0.49 0.00 0.00 175.26 174.98 1qrk s ASP 232 N -3.14 6.74 0.00 -0.19 2.15 -1.26 -2.93 116.67 118.04 1qrk s ASP 232 Ca 0.63 2.42 0.00 0.00 0.43 0.00 0.00 52.55 56.04 1qrk s ASP 232 Cb -0.19 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.84 1qrk s ASP 232 CO 0.57 -0.72 0.00 0.61 -0.17 0.00 0.00 175.17 175.46 1qrk n GLY 233 N 3.59 3.29 0.05 2.66 0.00 -1.26 -4.93 105.19 108.59 1qrk n GLY 233 Ca 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 1qrk n GLY 233 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1qrk h ILE 234 N 0.00 1.18 -0.61 -0.61 1.08 -1.81 -0.95 117.51 115.79 1qrk h ILE 234 Ca 0.00 -0.53 0.11 0.00 -0.39 0.00 0.00 64.86 64.06 1qrk h ILE 234 Cb 0.00 1.52 -0.09 0.00 -3.07 0.00 0.00 36.82 35.19 1qrk h ILE 234 CO 0.00 0.14 0.15 0.25 -0.69 0.00 0.00 178.15 177.99 1qrk h LEU 235 N -0.21 0.04 -0.41 1.44 6.46 -1.77 -1.26 115.31 119.59 1qrk h LEU 235 Ca 0.00 0.11 -0.12 0.00 -0.12 0.00 0.00 57.88 57.75 1qrk h LEU 235 Cb 0.22 0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.28 1qrk h LEU 235 CO -0.00 0.02 -0.20 0.44 -0.62 0.00 0.00 178.44 178.09 1qrk h ASP 236 N 0.28 0.89 -0.87 1.25 3.32 -1.93 -2.80 116.42 116.56 1qrk h ASP 236 Ca 0.32 -0.40 0.09 0.00 0.02 0.00 0.00 57.03 57.05 1qrk h ASP 236 Cb 0.47 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 39.71 1qrk h ASP 236 CO -0.40 1.09 0.53 0.74 -1.72 0.00 0.00 179.24 179.49 1qrk h THR 237 N 0.68 0.96 -0.70 0.35 2.02 -0.29 0.15 112.91 116.08 1qrk h THR 237 Ca 0.09 -0.31 0.06 0.00 0.77 0.00 0.00 66.41 67.02 1qrk h THR 237 Cb 0.76 -0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 1qrk h THR 237 CO 0.06 0.17 0.46 0.00 0.37 0.00 0.00 175.52 176.58 1qrk h LEU 239 N 0.74 0.15 -0.68 0.00 3.38 -0.56 -3.03 115.31 115.31 1qrk h LEU 239 Ca 0.30 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.08 1qrk h LEU 239 Cb 0.23 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1qrk h LEU 239 CO -0.10 0.88 0.12 0.22 0.09 0.00 0.00 178.44 179.66 1qrk h TYR 240 N 0.07 1.18 0.47 1.13 3.20 0.91 -2.13 116.97 121.80 1qrk h TYR 240 Ca -0.02 -0.16 -0.01 0.00 3.14 0.00 0.00 58.73 61.68 1qrk h TYR 240 Cb 1.39 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 39.31 1qrk h TYR 240 CO 0.02 0.98 -0.49 0.28 -1.64 0.00 0.00 178.16 177.31 1qrk h VAL 241 N 1.04 0.00 -0.54 1.81 2.07 -0.90 0.58 116.25 120.31 1qrk h VAL 241 Ca 0.21 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.88 1qrk h VAL 241 Cb 0.43 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 1qrk h VAL 241 CO 0.01 0.00 0.45 0.24 0.02 0.00 0.00 177.57 178.29 1qrk h MET 242 N -0.96 0.00 -0.16 1.57 2.86 -1.49 0.12 114.93 116.87 1qrk h MET 242 Ca -0.06 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 1qrk h MET 242 Cb 0.84 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.50 1qrk h MET 242 CO -0.07 0.00 -0.43 -0.44 1.06 0.00 0.00 176.91 177.03 1qrk h ASP 243 N 0.00 0.65 0.40 1.22 3.32 -0.12 -1.31 116.42 120.58 1qrk h ASP 243 Ca 0.26 -0.58 -0.02 0.00 0.02 0.00 0.00 57.03 56.70 1qrk h ASP 243 Cb 1.16 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.52 1qrk h ASP 243 CO -0.00 1.12 -0.11 0.03 -1.72 0.00 0.00 179.24 178.56 1qrk h ARG 244 N 0.21 0.00 -0.34 3.56 2.47 0.27 -1.48 114.38 119.07 1qrk h ARG 244 Ca -0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1qrk h ARG 244 Cb 1.04 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.36 1qrk h ARG 244 CO 0.09 0.11 0.00 0.00 0.56 0.00 0.00 179.97 180.73 1qrk n ALA 245 N -2.26 2.46 -3.97 0.04 0.00 -0.72 -4.92 120.51 111.13 1qrk n ALA 245 Ca -0.02 -0.69 -0.28 0.00 0.00 0.00 0.00 53.44 52.45 1qrk n ALA 245 Cb 0.24 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.68 1qrk n ALA 245 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1qrk n GLN 246 N 0.67 -3.90 -2.53 0.00 6.02 -0.56 -4.88 117.38 112.21 1qrk n GLN 246 Ca 0.15 0.46 -0.43 0.00 -0.01 0.00 0.00 57.00 57.18 1qrk n GLN 246 Cb 0.37 -4.93 -0.02 0.00 1.02 0.00 0.00 30.24 26.68 1qrk n GLN 246 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1qrk s MET 247 N -6.57 4.31 0.13 -1.09 1.75 -0.51 -4.94 119.30 112.38 1qrk s MET 247 Ca 0.29 1.56 -0.34 0.00 -1.25 0.00 0.00 55.69 55.95 1qrk s MET 247 Cb -0.15 -3.64 -0.14 0.00 2.84 0.00 0.00 34.83 33.74 1qrk s MET 247 CO 0.88 -0.54 1.55 -3.47 -0.65 0.00 0.00 175.02 172.78 1qrk n ASP 248 N 5.83 2.82 -0.31 1.11 2.03 -1.26 -4.49 116.55 122.28 1qrk n ASP 248 Ca 0.12 1.09 0.06 0.00 0.52 0.00 0.00 54.79 56.57 1qrk n ASP 248 Cb 0.46 -1.38 0.22 0.00 -0.72 0.00 0.00 41.12 39.70 1qrk n ASP 248 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1qrk h LEU 249 N 5.80 0.69 -0.22 -2.67 3.38 -1.65 0.51 115.31 121.16 1qrk h LEU 249 Ca -0.46 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1qrk h LEU 249 Cb 1.27 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1qrk h LEU 249 CO 0.87 0.35 0.00 -1.20 0.09 0.00 0.00 178.44 178.55 1qrk n SER 250 N -4.76 0.11 0.08 -0.43 7.64 -1.26 -1.42 113.62 113.58 1qrk n SER 250 Ca 0.17 0.54 0.09 0.00 1.01 0.00 0.00 58.87 60.68 1qrk n SER 250 Cb 0.37 -0.56 -0.04 0.00 -1.01 0.00 0.00 64.21 62.98 1qrk n SER 250 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qrk n GLY 251 N -1.00 -1.36 0.19 0.23 0.00 0.17 -4.35 105.19 99.06 1qrk n GLY 251 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1qrk n GLY 251 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qrk n ARG 252 N -2.66 0.30 -0.00 1.61 1.74 -0.51 -1.52 116.66 115.61 1qrk n ARG 252 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1qrk n ARG 252 Cb 0.61 -1.06 0.01 0.00 -1.02 0.00 0.00 32.46 31.00 1qrk n ARG 252 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qrk n GLY 253 N 0.01 2.92 3.14 -0.13 0.00 -1.26 -1.18 105.19 108.68 1qrk n GLY 253 Ca 0.00 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 1qrk n GLY 253 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1qrk s ASN 254 N -1.06 4.40 0.24 1.61 3.84 -0.57 -4.87 114.94 118.52 1qrk s ASN 254 Ca 0.01 -1.12 -0.05 0.00 0.21 0.00 0.00 52.86 51.91 1qrk s ASN 254 Cb 0.01 -1.62 0.41 0.00 -0.55 0.00 0.00 41.25 39.50 1qrk s ASN 254 CO 0.00 -0.17 1.76 -0.65 -2.79 0.00 0.00 177.10 175.25 1qrk h PRO 255 N 7.93 0.52 -0.01 0.43 0.11 -1.93 0.31 132.00 139.35 1qrk h PRO 255 Ca -0.27 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.82 1qrk h PRO 255 Cb 1.08 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1qrk h PRO 255 CO 0.53 0.34 -0.05 0.82 -0.21 0.00 0.00 178.00 179.44 1qrk h ILE 256 N 0.54 0.88 -0.34 4.15 2.04 -1.94 0.04 117.51 122.87 1qrk h ILE 256 Ca 0.39 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 66.10 1qrk h ILE 256 Cb 0.51 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 1qrk h ILE 256 CO -0.34 0.00 -0.38 0.50 0.00 0.00 0.00 178.15 177.94 1qrk h LYS 257 N -0.08 0.81 -0.97 2.37 3.64 -1.64 0.16 116.57 120.86 1qrk h LYS 257 Ca 0.02 -0.41 0.04 0.00 -1.27 0.00 0.00 60.65 59.03 1qrk h LYS 257 Cb 0.11 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.88 1qrk h LYS 257 CO -0.05 1.04 0.63 0.28 -2.27 0.00 0.00 179.45 179.08 1qrk h VAL 258 N 0.66 1.15 0.00 2.00 2.07 -0.43 0.18 116.25 121.88 1qrk h VAL 258 Ca 0.06 -0.41 -0.22 0.00 0.82 0.00 0.00 66.70 66.95 1qrk h VAL 258 Cb 0.94 -0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1qrk h VAL 258 CO 0.09 0.22 -1.21 0.77 0.02 0.00 0.00 177.57 177.45 1qrk h SER 259 N 1.20 0.00 -0.05 0.57 4.64 -0.77 0.14 113.55 119.28 1qrk h SER 259 Ca 0.39 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.69 1qrk h SER 259 Cb 0.04 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1qrk h SER 259 CO -0.13 0.89 -0.04 -0.09 -0.87 0.00 0.00 176.83 176.58 1qrk h ARG 260 N 0.00 0.12 -0.03 4.77 9.65 -0.29 -2.87 114.38 125.72 1qrk h ARG 260 Ca -0.12 -0.06 -0.04 0.00 -1.10 0.00 0.00 59.98 58.66 1qrk h ARG 260 Cb 1.78 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.36 1qrk h ARG 260 CO 0.10 0.55 -0.15 0.28 2.80 0.00 0.00 179.97 183.54 1qrk h VAL 261 N -0.30 1.48 -0.50 0.20 2.07 -0.76 -3.27 116.25 115.16 1qrk h VAL 261 Ca 0.01 -1.64 -0.01 0.00 0.82 0.00 0.00 66.70 65.88 1qrk h VAL 261 Cb 0.52 2.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.73 1qrk h VAL 261 CO 0.01 0.45 0.27 1.23 0.02 0.00 0.00 177.57 179.55 1qrk h GLY 262 N -0.42 0.73 1.28 2.17 0.00 -0.84 -2.47 103.07 103.53 1qrk h GLY 262 Ca -0.01 -0.31 -0.09 0.00 0.00 0.00 0.00 47.33 46.92 1qrk h GLY 262 CO 0.03 0.30 -0.08 1.48 0.00 0.00 0.00 176.54 178.27 1qrk h SER 263 N 0.69 0.84 0.33 0.19 4.64 -1.62 -2.35 113.55 116.28 1qrk h SER 263 Ca 0.18 -0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 1qrk h SER 263 Cb 0.02 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 61.88 1qrk h SER 263 CO -0.03 0.95 -0.05 0.00 -0.87 0.00 0.00 176.83 176.83 1qrk h ALA 264 N 1.13 1.17 0.00 5.18 0.00 -1.50 -1.75 119.26 123.49 1qrk h ALA 264 Ca 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1qrk h ALA 264 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1qrk h ALA 264 CO 0.04 0.06 -0.28 0.52 0.00 0.00 0.00 179.25 179.59 1qrk h MET 265 N 0.00 0.00 -0.45 0.00 2.86 -1.22 -3.37 114.93 112.75 1qrk h MET 265 Ca -0.00 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 1qrk h MET 265 Cb 0.22 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1qrk h MET 265 CO 0.01 0.00 0.03 0.28 1.06 0.00 0.00 176.91 178.28 1qrk h VAL 266 N 0.00 1.26 -3.48 -2.22 2.07 -1.27 0.28 116.25 112.89 1qrk h VAL 266 Ca 0.00 -0.99 -0.68 0.00 0.82 0.00 0.00 66.70 65.85 1qrk h VAL 266 Cb 0.86 1.02 -0.18 0.00 -1.52 0.00 0.00 31.29 31.46 1qrk h VAL 266 CO 0.00 0.34 -0.07 0.21 0.02 0.00 0.00 177.57 178.07 1qrk s ASN 267 N -6.23 6.23 -0.70 0.57 3.04 -1.26 -0.74 114.94 115.85 1qrk s ASN 267 Ca -0.13 -0.67 -0.26 0.00 0.04 0.00 0.00 52.86 51.84 1qrk s ASN 267 Cb 0.11 -2.26 -0.11 0.00 -1.54 0.00 0.00 41.25 37.45 1qrk s ASN 267 CO 0.80 -0.70 2.37 0.00 -3.04 0.00 0.00 177.10 176.53 1qrk s ALA 268 N 2.40 1.07 -0.22 1.71 0.00 0.33 -4.43 121.76 122.61 1qrk s ALA 268 Ca 0.15 -0.59 -0.25 0.00 0.00 0.00 0.00 51.96 51.27 1qrk s ALA 268 Cb -0.17 -4.50 -0.01 0.00 0.00 0.00 0.00 23.12 18.44 1qrk s ALA 268 CO 0.14 -5.37 0.84 0.21 0.00 0.00 0.00 175.76 171.59 1qrk s LYS 269 N 8.55 4.22 6.27 0.00 2.36 -1.26 -4.69 119.74 135.18 1qrk s LYS 269 Ca 0.92 0.99 0.00 0.00 -2.55 0.00 0.00 55.97 55.33 1qrk s LYS 269 Cb -0.14 -3.63 0.00 0.00 -1.05 0.00 0.00 37.83 33.02 1qrk s LYS 269 CO 0.13 -0.48 0.00 -3.47 1.55 0.00 0.00 175.35 173.08 1qrk n ASP 270 N 5.84 0.00 -2.73 1.43 2.03 -1.26 -2.72 116.55 119.15 1qrk n ASP 270 Ca 0.06 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.31 1qrk n ASP 270 Cb 0.48 0.00 0.05 0.00 -0.72 0.00 0.00 41.12 40.92 1qrk n ASP 270 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1qrk n ASP 271 N 10.70 1.21 -0.02 1.67 5.68 -1.26 -4.94 116.55 129.58 1qrk n ASP 271 Ca 0.00 -2.43 -0.03 0.00 -0.50 0.00 0.00 54.79 51.83 1qrk n ASP 271 Cb 0.00 -0.39 -0.01 0.00 -1.14 0.00 0.00 41.12 39.58 1qrk n ASP 271 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1qrk n GLU 272 N -0.34 0.16 -0.19 0.11 0.00 -1.10 -4.70 120.64 114.59 1qrk n GLU 272 Ca 0.07 0.06 -0.19 0.00 0.00 0.00 0.00 57.16 57.10 1qrk n GLU 272 Cb 0.82 -0.74 0.19 0.00 0.00 0.00 0.00 31.44 31.71 1qrk n GLU 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1qrk n GLY 273 N 1.80 -3.53 0.15 8.31 0.00 -1.26 -4.66 105.19 106.01 1qrk n GLY 273 Ca -0.04 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.70 1qrk n GLY 273 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1qrk h VAL 274 N -3.02 1.35 -4.05 1.61 2.07 -0.46 -3.29 116.25 110.46 1qrk h VAL 274 Ca -0.25 -1.39 -0.48 0.00 0.82 0.00 0.00 66.70 65.40 1qrk h VAL 274 Cb 0.84 1.89 -0.24 0.00 -1.52 0.00 0.00 31.29 32.26 1qrk h VAL 274 CO 0.15 0.41 -0.81 -0.76 0.02 0.00 0.00 177.57 176.58 1qrk s LEU 275 N -9.02 2.19 -0.26 2.57 1.43 0.08 0.04 118.68 115.72 1qrk s LEU 275 Ca -0.14 -0.51 -0.15 0.00 -1.03 0.00 0.00 54.13 52.31 1qrk s LEU 275 Cb 0.06 -0.71 -0.04 0.00 0.03 0.00 0.00 46.19 45.53 1qrk s LEU 275 CO 0.77 0.06 0.36 -0.69 0.23 0.00 0.00 176.35 177.08 1qrk s VAL 276 N -0.90 5.19 0.18 -1.59 1.01 0.23 0.12 120.40 124.64 1qrk s VAL 276 Ca 0.03 0.57 -0.20 0.00 0.00 0.00 0.00 61.98 62.38 1qrk s VAL 276 Cb -0.08 -3.69 -0.08 0.00 0.00 0.00 0.00 36.38 32.53 1qrk s VAL 276 CO 0.02 0.18 0.70 -0.83 0.00 0.00 0.00 175.10 175.17 1qrk s GLY 277 N 1.51 2.68 -0.24 4.51 0.00 -1.26 -1.94 107.32 112.57 1qrk s GLY 277 Ca 0.15 0.16 -0.15 0.00 0.00 0.00 0.00 44.72 44.88 1qrk s GLY 277 CO 0.09 0.55 0.61 -0.45 0.00 0.00 0.00 173.10 173.90 1qrk s SER 278 N -1.46 -0.79 -0.20 1.64 0.15 -1.02 -4.88 113.70 107.14 1qrk s SER 278 Ca 0.39 1.31 0.12 0.00 0.70 0.00 0.00 55.95 58.47 1qrk s SER 278 Cb -0.18 1.21 0.41 0.00 -1.71 0.00 0.00 66.02 65.75 1qrk s SER 278 CO 0.22 -0.22 1.22 0.79 1.20 0.00 0.00 173.24 176.44 1qrk n TRP 279 N 4.03 0.03 1.44 3.44 8.01 -1.26 -4.69 117.44 128.44 1qrk n TRP 279 Ca -0.20 -1.45 0.15 0.00 -1.31 0.00 0.00 57.50 54.69 1qrk n TRP 279 Cb 0.57 -0.25 0.70 0.00 -2.01 0.00 0.00 31.31 30.32 1qrk n TRP 279 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.69 176.28 1qrk n ASP 280 N -1.15 0.21 0.00 -0.99 5.75 -1.26 -4.92 116.55 114.20 1qrk n ASP 280 Ca 0.19 -0.37 0.00 0.00 -0.01 0.00 0.00 54.79 54.60 1qrk n ASP 280 Cb 0.70 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.61 1qrk n ASP 280 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1qrk n ASN 281 N -1.13 0.00 -0.07 -1.12 5.15 -1.26 -4.68 115.26 112.15 1qrk n ASN 281 Ca 0.15 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 54.05 1qrk n ASN 281 Cb 0.25 -1.17 -0.03 0.00 -0.53 0.00 0.00 39.78 38.31 1qrk n ASN 281 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1qrk n ILE 282 N -2.00 1.46 -2.66 -1.44 2.08 -1.26 -5.01 119.36 110.53 1qrk n ILE 282 Ca 0.00 0.18 -0.06 0.00 0.56 0.00 0.00 62.75 63.43 1qrk n ILE 282 Cb 0.00 -2.23 0.03 0.00 -0.75 0.00 0.00 39.64 36.69 1qrk n ILE 282 CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 1qrk n TYR 283 N -4.31 -1.85 0.00 1.39 4.01 -1.26 -4.96 117.16 110.19 1qrk n TYR 283 Ca -0.12 0.67 0.00 0.00 -0.16 0.00 0.00 57.90 58.29 1qrk n TYR 283 Cb 0.44 -3.50 0.00 0.00 -0.31 0.00 0.00 39.34 35.97 1qrk n TYR 283 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1qrk n ALA 284 N -2.24 0.00 -3.16 -0.72 0.00 -1.26 -3.68 120.51 109.45 1qrk n ALA 284 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.17 1qrk n ALA 284 Cb 0.55 0.38 -0.05 0.00 0.00 0.00 0.00 19.45 20.32 1qrk n ALA 284 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1qrk n TYR 285 N -2.56 2.09 -3.68 0.00 4.01 -1.26 -5.06 117.16 110.70 1qrk n TYR 285 Ca 0.00 -3.90 -0.02 0.00 -0.16 0.00 0.00 57.90 53.82 1qrk n TYR 285 Cb 0.00 -0.46 0.01 0.00 -0.31 0.00 0.00 39.34 38.58 1qrk n TYR 285 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1qrk n GLY 286 N 0.43 0.93 3.82 2.72 0.00 -1.24 -4.89 105.19 106.96 1qrk n GLY 286 Ca 0.27 -1.05 -0.38 0.00 0.00 0.00 0.00 46.02 44.86 1qrk n GLY 286 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qrk s VAL 287 N -2.30 5.00 0.21 1.61 1.01 -0.43 -4.85 120.40 120.65 1qrk s VAL 287 Ca 0.12 0.91 -0.30 0.00 0.00 0.00 0.00 61.98 62.71 1qrk s VAL 287 Cb -0.02 -3.75 -0.09 0.00 0.00 0.00 0.00 36.38 32.52 1qrk s VAL 287 CO 0.03 0.55 1.34 -2.84 0.00 0.00 0.00 175.10 174.18 1qrk s PRO 288 N -0.90 4.36 0.60 2.72 0.02 -1.26 -0.79 135.00 139.75 1qrk s PRO 288 Ca 0.25 2.11 0.28 0.00 0.02 0.00 0.00 61.00 63.66 1qrk s PRO 288 Cb -0.17 -3.17 1.34 0.00 0.02 0.00 0.00 34.50 32.52 1qrk s PRO 288 CO 0.14 -0.29 1.76 -1.35 -0.33 0.00 0.00 177.00 176.92 1qrk h PRO 289 N 5.26 0.00 0.00 5.54 0.11 -1.91 0.81 132.00 141.81 1qrk h PRO 289 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1qrk h PRO 289 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1qrk h PRO 289 CO 0.77 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.99 1qrk n SER 290 N -3.48 0.09 -0.01 -2.05 7.64 -1.26 -3.66 113.62 110.89 1qrk n SER 290 Ca 0.10 0.51 -0.15 0.00 1.01 0.00 0.00 58.87 60.34 1qrk n SER 290 Cb 0.82 -0.53 -0.14 0.00 -1.01 0.00 0.00 64.21 63.34 1qrk n SER 290 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1qrk n ALA 291 N -1.53 1.18 -1.58 -0.43 0.00 0.28 -4.54 120.51 113.89 1qrk n ALA 291 Ca 0.06 -0.68 -0.51 0.00 0.00 0.00 0.00 53.44 52.31 1qrk n ALA 291 Cb 0.30 -0.75 -0.05 0.00 0.00 0.00 0.00 19.45 18.95 1qrk n ALA 291 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1qrk n TRP 292 N -3.27 1.33 -0.09 0.00 7.02 -1.24 -4.85 117.44 116.34 1qrk n TRP 292 Ca -0.25 0.68 -0.11 0.00 -1.02 0.00 0.00 57.50 56.81 1qrk n TRP 292 Cb 1.05 -2.29 -0.15 0.00 -2.42 0.00 0.00 31.31 27.50 1qrk n TRP 292 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1qrk n THR 293 N 1.91 1.43 -3.81 -0.99 -2.24 -1.26 -5.03 114.28 104.30 1qrk n THR 293 Ca 0.17 -0.81 -0.09 0.00 -2.27 0.00 0.00 64.05 61.05 1qrk n THR 293 Cb 0.21 -0.67 0.03 0.00 -2.10 0.00 0.00 70.33 67.81 1qrk n THR 293 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1qrk s GLY 294 N -5.58 0.40 0.24 3.38 0.00 -1.26 -2.80 107.32 101.70 1qrk s GLY 294 Ca -0.13 -0.77 0.12 0.00 0.00 0.00 0.00 44.72 43.94 1qrk s GLY 294 CO 0.80 -0.17 1.49 1.76 0.00 0.00 0.00 173.10 176.98 1qrk h SER 295 N 2.00 0.00 -0.40 1.64 0.02 -1.36 -3.38 113.55 112.08 1qrk h SER 295 Ca -0.33 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 60.70 1qrk h SER 295 Cb 1.25 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 63.70 1qrk h SER 295 CO 0.42 0.67 -0.26 0.58 -1.14 0.00 0.00 176.83 177.10 1qrk h VAL 296 N 0.00 0.31 0.02 2.27 2.07 -1.79 -1.43 116.25 117.70 1qrk h VAL 296 Ca -0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1qrk h VAL 296 Cb 1.34 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 1qrk h VAL 296 CO 0.09 0.00 -0.42 0.44 0.02 0.00 0.00 177.57 177.70 1qrk h ASP 297 N -0.19 -1.29 0.23 0.57 5.19 -1.97 -0.53 116.42 118.42 1qrk h ASP 297 Ca 0.19 0.14 0.00 0.00 -0.62 0.00 0.00 57.03 56.74 1qrk h ASP 297 Cb 0.49 0.49 -0.03 0.00 0.18 0.00 0.00 39.33 40.46 1qrk h ASP 297 CO -0.51 -0.42 -0.45 0.40 -3.12 0.00 0.00 179.24 175.14 1qrk h ILE 298 N -0.54 0.00 -0.86 0.35 2.04 -1.75 0.19 117.51 116.94 1qrk h ILE 298 Ca 0.01 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.03 1qrk h ILE 298 Cb 0.57 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.55 1qrk h ILE 298 CO -0.27 0.00 0.42 -0.07 0.00 0.00 0.00 178.15 178.23 1qrk h LEU 299 N -0.74 0.47 0.12 1.44 3.38 -1.16 0.17 115.31 118.98 1qrk h LEU 299 Ca -0.02 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1qrk h LEU 299 Cb 0.69 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1qrk h LEU 299 CO -0.18 0.15 -0.06 -0.07 0.09 0.00 0.00 178.44 178.38 1qrk h LEU 300 N 0.55 -0.14 -0.92 1.67 3.38 -0.90 -2.80 115.31 116.16 1qrk h LEU 300 Ca 0.49 -0.42 0.27 0.00 0.09 0.00 0.00 57.88 58.31 1qrk h LEU 300 Cb 0.78 0.04 -0.15 0.00 0.09 0.00 0.00 40.66 41.41 1qrk h LEU 300 CO -0.41 0.42 0.32 -0.08 0.09 0.00 0.00 178.44 178.77 1qrk h GLU 301 N -0.76 0.21 -0.64 1.13 4.22 -0.19 0.75 114.58 119.30 1qrk h GLU 301 Ca -0.02 -0.01 -0.07 0.00 0.08 0.00 0.00 59.36 59.34 1qrk h GLU 301 Cb 0.55 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 1qrk h GLU 301 CO 0.03 0.14 0.13 -0.92 -2.18 0.00 0.00 179.01 176.21 1qrk h TYR 302 N 0.22 1.08 0.00 0.92 3.20 -0.70 0.98 116.97 122.66 1qrk h TYR 302 Ca 0.62 -0.13 -0.05 0.00 3.14 0.00 0.00 58.73 62.31 1qrk h TYR 302 Cb 1.31 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 1qrk h TYR 302 CO -0.20 0.90 -0.23 -0.09 -1.64 0.00 0.00 178.16 176.89 1qrk h ARG 303 N 0.97 0.00 0.10 1.82 2.43 0.77 0.91 114.38 121.38 1qrk h ARG 303 Ca 0.20 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 59.02 1qrk h ARG 303 Cb 0.38 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1qrk h ARG 303 CO 0.01 0.23 -1.93 0.43 -1.51 0.00 0.00 179.97 177.19 1qrk n SER 304 N -3.56 1.86 0.01 -3.80 7.64 -0.83 -4.28 113.62 110.66 1qrk n SER 304 Ca -0.01 0.26 -0.18 0.00 1.01 0.00 0.00 58.87 59.95 1qrk n SER 304 Cb 0.37 -0.69 -0.12 0.00 -1.01 0.00 0.00 64.21 62.76 1qrk n SER 304 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1qrk h SER 305 N 0.06 0.55 -0.07 6.43 4.64 -0.67 -3.47 113.55 121.02 1qrk h SER 305 Ca -0.39 -0.79 -0.03 0.00 -0.47 0.00 0.00 61.79 60.11 1qrk h SER 305 Cb 2.03 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 63.94 1qrk h SER 305 CO 0.09 1.27 -0.03 -0.62 -0.87 0.00 0.00 176.83 176.68 1qrk n GLU 306 N -4.17 -0.59 -4.19 4.77 1.02 0.31 -4.99 120.64 112.80 1qrk n GLU 306 Ca -0.11 0.28 -0.15 0.00 -0.02 0.00 0.00 57.16 57.16 1qrk n GLU 306 Cb 0.71 -3.81 -0.11 0.00 -0.02 0.00 0.00 31.44 28.21 1qrk n GLU 306 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1qrk s ASN 307 N -2.20 1.53 0.51 1.62 0.02 -1.25 -5.06 114.94 110.12 1qrk s ASN 307 Ca 0.00 -0.84 -0.20 0.00 -1.02 0.00 0.00 52.86 50.80 1qrk s ASN 307 Cb 0.00 0.00 -0.10 0.00 0.02 0.00 0.00 41.25 41.17 1qrk s ASN 307 CO 0.00 -0.26 0.58 -2.65 0.02 0.00 0.00 177.10 174.78 1qrk n PRO 308 N 0.46 0.61 -3.96 -0.60 -0.02 -1.24 -4.71 135.00 125.54 1qrk n PRO 308 Ca -0.15 0.23 -0.37 0.00 -2.02 0.00 0.00 63.50 61.19 1qrk n PRO 308 Cb 0.58 -1.68 -0.07 0.00 -0.02 0.00 0.00 33.50 32.32 1qrk n PRO 308 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1qrk s VAL 309 N -1.61 5.33 -0.09 -1.45 1.01 0.11 -4.85 120.40 118.85 1qrk s VAL 309 Ca 0.67 0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.80 1qrk s VAL 309 Cb -0.50 -3.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 1qrk s VAL 309 CO 0.56 0.62 -0.11 -0.13 0.00 0.00 0.00 175.10 176.03 1qrk s ARG 310 N -1.01 2.93 0.26 2.72 0.52 -1.26 -0.60 118.95 122.52 1qrk s ARG 310 Ca 0.15 -0.64 0.02 0.00 -0.52 0.00 0.00 55.73 54.74 1qrk s ARG 310 Cb -0.12 -2.55 -0.05 0.00 0.52 0.00 0.00 34.95 32.74 1qrk s ARG 310 CO 0.04 0.48 0.07 0.71 0.02 0.00 0.00 175.30 176.61 1qrk s TYR 311 N -0.32 1.61 0.15 -0.53 2.02 0.03 -1.31 117.35 118.99 1qrk s TYR 311 Ca 0.03 -1.10 -0.08 0.00 -0.37 0.00 0.00 57.07 55.56 1qrk s TYR 311 Cb -0.13 -0.96 -0.01 0.00 -0.40 0.00 0.00 41.96 40.46 1qrk s TYR 311 CO 0.02 -0.22 0.24 0.20 -1.57 0.00 0.00 175.55 174.22 1qrk s GLY 312 N -3.34 0.47 0.28 0.71 0.00 -0.82 -3.79 107.32 100.83 1qrk s GLY 312 Ca 0.36 -0.91 -0.01 0.00 0.00 0.00 0.00 44.72 44.16 1qrk s GLY 312 CO 0.13 -0.89 0.30 1.20 0.00 0.00 0.00 173.10 173.84 1qrk s GLN 313 N -3.96 1.58 0.43 2.90 -0.21 -1.26 -2.44 119.66 116.70 1qrk s GLN 313 Ca 0.16 -1.72 0.34 0.00 0.02 0.00 0.00 55.36 54.16 1qrk s GLN 313 Cb 0.04 0.36 1.42 0.00 1.00 0.00 0.00 33.01 35.83 1qrk s GLN 313 CO -0.02 -0.60 1.43 0.00 -2.12 0.00 0.00 175.29 173.98 1qrk h TRP 315 N 0.00 0.00 -0.25 0.00 0.09 -1.97 -2.72 115.95 111.10 1qrk h TRP 315 Ca 0.82 0.00 -0.12 0.00 0.09 0.00 0.00 58.89 59.68 1qrk h TRP 315 Cb 2.83 0.00 -0.00 0.00 0.08 0.00 0.00 29.16 32.07 1qrk h TRP 315 CO -0.00 0.69 -0.32 0.28 0.09 0.00 0.00 178.44 179.17 1qrk h VAL 316 N 0.00 1.31 -0.63 0.12 2.07 -1.18 0.75 116.25 118.70 1qrk h VAL 316 Ca -0.07 -1.51 -0.07 0.00 0.82 0.00 0.00 66.70 65.86 1qrk h VAL 316 Cb 1.59 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 33.04 1qrk h VAL 316 CO 0.08 0.48 0.10 -0.26 0.02 0.00 0.00 177.57 177.99 1qrk h PHE 317 N 0.36 1.11 -0.22 1.57 0.04 -1.60 0.30 116.94 118.49 1qrk h PHE 317 Ca 0.03 -0.15 -0.10 0.00 2.80 0.00 0.00 57.97 60.55 1qrk h PHE 317 Cb 0.90 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.73 1qrk h PHE 317 CO 0.08 0.94 -0.27 0.00 -0.60 0.00 0.00 178.31 178.45 1qrk h ALA 318 N 1.03 1.11 0.02 2.45 0.00 -1.38 -0.41 119.26 122.08 1qrk h ALA 318 Ca 0.19 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1qrk h ALA 318 Cb 0.43 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1qrk h ALA 318 CO 0.01 0.56 -0.01 0.78 0.00 0.00 0.00 179.25 180.59 1qrk h GLY 319 N 1.03 -0.03 0.72 0.00 0.00 0.19 -2.29 103.07 102.69 1qrk h GLY 319 Ca 0.05 0.01 0.16 0.00 0.00 0.00 0.00 47.33 47.55 1qrk h GLY 319 CO 0.05 -0.01 0.49 -2.08 0.00 0.00 0.00 176.54 174.99 1qrk h VAL 320 N -0.04 0.45 0.03 4.60 2.07 -0.46 0.01 116.25 122.90 1qrk h VAL 320 Ca -0.00 0.00 -0.22 0.00 0.82 0.00 0.00 66.70 67.30 1qrk h VAL 320 Cb 0.02 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1qrk h VAL 320 CO 0.01 0.00 -0.97 0.15 0.02 0.00 0.00 177.57 176.77 1qrk h PHE 321 N 0.00 0.42 -0.43 1.57 3.57 -1.08 -2.96 116.94 118.03 1qrk h PHE 321 Ca 0.26 -0.25 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 1qrk h PHE 321 Cb 1.24 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 1qrk h PHE 321 CO 0.00 1.09 -0.05 -0.97 -2.23 0.00 0.00 178.31 176.15 1qrk h ASN 322 N 0.13 0.79 -0.06 0.41 -0.00 -0.38 -0.14 115.58 116.33 1qrk h ASN 322 Ca -0.07 -0.34 0.02 0.00 -0.00 0.00 0.00 56.30 55.92 1qrk h ASN 322 Cb 1.63 -0.21 -0.03 0.00 -0.00 0.00 0.00 38.32 39.71 1qrk h ASN 322 CO 0.16 0.94 -0.09 0.74 -0.00 0.00 0.00 177.43 179.17 1qrk h THR 323 N 0.62 0.75 0.15 -3.57 2.02 -1.58 -0.89 112.91 110.40 1qrk h THR 323 Ca 0.11 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.31 1qrk h THR 323 Cb 0.57 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.68 1qrk h THR 323 CO 0.03 0.00 -0.45 0.15 0.37 0.00 0.00 175.52 175.62 1qrk h PHE 324 N -0.13 -1.27 -0.02 3.16 3.04 -1.30 0.19 116.94 120.62 1qrk h PHE 324 Ca 0.06 0.03 0.03 0.00 3.98 0.00 0.00 57.97 62.07 1qrk h PHE 324 Cb 0.21 0.54 -0.04 0.00 2.56 0.00 0.00 35.95 39.22 1qrk h PHE 324 CO -0.19 -0.55 -0.21 -0.07 -2.02 0.00 0.00 178.31 175.28 1qrk h LEU 325 N -0.70 -0.62 -0.89 0.59 3.38 -0.77 -2.81 115.31 113.49 1qrk h LEU 325 Ca 0.01 0.09 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1qrk h LEU 325 Cb 0.71 0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.70 1qrk h LEU 325 CO -0.24 -0.27 0.16 0.03 0.09 0.00 0.00 178.44 178.20 1qrk h ARG 326 N -0.33 0.98 -0.89 1.13 3.08 -0.92 -0.41 114.38 117.02 1qrk h ARG 326 Ca 0.06 -0.21 0.02 0.00 0.07 0.00 0.00 59.98 59.92 1qrk h ARG 326 Cb 0.41 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.27 1qrk h ARG 326 CO -0.20 0.87 0.59 0.00 -1.07 0.00 0.00 179.97 180.15 1qrk h LEU 328 N 1.16 0.00 0.00 0.00 3.38 -1.40 -3.48 115.31 114.97 1qrk h LEU 328 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1qrk h LEU 328 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1qrk h LEU 328 CO -0.09 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.05 1qrk n GLY 329 N 1.24 1.37 3.63 0.83 0.00 -0.16 -1.32 105.19 110.78 1qrk n GLY 329 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1qrk n GLY 329 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qrk s ILE 330 N -2.00 5.33 0.23 -0.61 1.01 -0.19 -4.33 121.20 120.63 1qrk s ILE 330 Ca 0.00 0.20 -0.31 0.00 0.00 0.00 0.00 60.65 60.53 1qrk s ILE 330 Cb 0.00 -3.52 -0.11 0.00 0.01 0.00 0.00 42.46 38.84 1qrk s ILE 330 CO 0.00 0.31 1.66 -2.84 0.00 0.00 0.00 174.94 174.06 1qrk s PRO 331 N 1.33 4.14 0.01 2.79 0.02 -1.26 -3.31 135.00 138.73 1qrk s PRO 331 Ca 0.08 2.55 -0.16 0.00 0.02 0.00 0.00 61.00 63.49 1qrk s PRO 331 Cb -0.14 -3.07 0.03 0.00 0.02 0.00 0.00 34.50 31.33 1qrk s PRO 331 CO 0.07 -0.69 0.35 0.00 -0.33 0.00 0.00 177.00 176.40 1qrk s ALA 332 N 0.81 -0.85 0.01 -1.55 0.00 -1.11 -0.79 121.76 118.28 1qrk s ALA 332 Ca 0.70 0.27 -0.05 0.00 0.00 0.00 0.00 51.96 52.88 1qrk s ALA 332 Cb -0.48 0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1qrk s ALA 332 CO 0.37 -0.35 0.09 -0.98 0.00 0.00 0.00 175.76 174.88 1qrk s ARG 333 N -1.94 0.45 0.29 0.00 1.70 -0.05 -4.80 118.95 114.60 1qrk s ARG 333 Ca -0.09 -0.48 -0.17 0.00 -0.47 0.00 0.00 55.73 54.52 1qrk s ARG 333 Cb -0.03 0.18 -0.09 0.00 -0.57 0.00 0.00 34.95 34.44 1qrk s ARG 333 CO 0.01 -0.10 0.74 0.42 -1.08 0.00 0.00 175.30 175.29 1qrk s ILE 334 N -1.50 4.63 0.04 4.99 1.01 -1.26 -0.05 121.20 129.05 1qrk s ILE 334 Ca -0.14 1.09 0.05 0.00 0.00 0.00 0.00 60.65 61.64 1qrk s ILE 334 Cb -0.08 -3.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.67 1qrk s ILE 334 CO 0.00 -0.05 -0.14 -0.69 0.00 0.00 0.00 174.94 174.06 1qrk s VAL 335 N -1.83 1.13 -0.25 2.92 1.01 0.46 -4.61 120.40 119.24 1qrk s VAL 335 Ca 0.51 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1qrk s VAL 335 Cb -0.12 -1.03 0.07 0.00 0.00 0.00 0.00 36.38 35.30 1qrk s VAL 335 CO 0.19 0.02 -0.02 -0.89 0.00 0.00 0.00 175.10 174.39 1qrk s THR 336 N -0.84 1.46 -0.05 3.92 2.01 -0.52 -1.12 115.64 120.50 1qrk s THR 336 Ca 0.02 -1.28 -0.18 0.00 0.31 0.00 0.00 61.69 60.55 1qrk s THR 336 Cb -0.08 -1.80 -0.05 0.00 0.01 0.00 0.00 72.50 70.58 1qrk s THR 336 CO 0.01 -0.20 0.50 0.21 -0.69 0.00 0.00 174.62 174.45 1qrk s ASN 337 N 1.41 6.82 -0.17 3.53 3.04 0.21 -2.12 114.94 127.66 1qrk s ASN 337 Ca -0.03 0.98 -0.12 0.00 0.04 0.00 0.00 52.86 53.73 1qrk s ASN 337 Cb -0.19 -2.31 -0.05 0.00 -1.54 0.00 0.00 41.25 37.17 1qrk s ASN 337 CO -0.08 0.12 0.24 -0.31 -3.04 0.00 0.00 177.10 174.02 1qrk s TYR 338 N -0.10 3.46 -0.25 0.43 2.02 0.15 -1.52 117.35 121.54 1qrk s TYR 338 Ca 0.27 0.52 -0.07 0.00 -0.37 0.00 0.00 57.07 57.42 1qrk s TYR 338 Cb -0.17 -2.26 0.01 0.00 -0.40 0.00 0.00 41.96 39.14 1qrk s TYR 338 CO 0.14 0.29 0.32 1.19 -1.57 0.00 0.00 175.55 175.92 1qrk n PHE 339 N 3.41 -1.77 -3.95 2.71 3.72 -0.31 -2.63 117.46 118.64 1qrk n PHE 339 Ca -0.14 0.71 -0.36 0.00 -0.05 0.00 0.00 57.45 57.62 1qrk n PHE 339 Cb 0.52 -2.86 -0.08 0.00 -0.94 0.00 0.00 39.48 36.13 1qrk n PHE 339 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1qrk s SER 340 N -1.96 5.97 -1.10 4.37 0.01 -0.15 -1.00 113.70 119.85 1qrk s SER 340 Ca 0.11 0.26 -0.05 0.00 1.31 0.00 0.00 55.95 57.57 1qrk s SER 340 Cb -0.03 -1.96 0.29 0.00 0.21 0.00 0.00 66.02 64.53 1qrk s SER 340 CO 0.40 0.28 1.44 0.00 0.41 0.00 0.00 173.24 175.77 1qrk n ALA 341 N 2.81 5.00 -1.85 1.44 0.00 -0.67 -0.77 120.51 126.48 1qrk n ALA 341 Ca -0.18 -4.75 -0.31 0.00 0.00 0.00 0.00 53.44 48.20 1qrk n ALA 341 Cb 0.53 -2.41 0.01 0.00 0.00 0.00 0.00 19.45 17.58 1qrk n ALA 341 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1qrk s HIS 342 N -2.29 3.58 -1.28 0.00 5.04 -1.26 -3.75 115.29 115.33 1qrk s HIS 342 Ca 0.32 1.32 0.00 0.00 -1.54 0.00 0.00 55.06 55.15 1qrk s HIS 342 Cb 0.02 -2.74 0.00 0.00 0.04 0.00 0.00 32.58 29.90 1qrk s HIS 342 CO 0.07 -0.69 0.00 -0.25 -2.34 0.00 0.00 174.74 171.52 1qrk n ASP 343 N -2.65 -4.42 0.18 9.88 8.00 -1.26 -4.92 116.55 121.35 1qrk n ASP 343 Ca 0.06 0.08 0.14 0.00 0.71 0.00 0.00 54.79 55.78 1qrk n ASP 343 Cb 0.54 -3.47 0.53 0.00 -0.02 0.00 0.00 41.12 38.69 1qrk n ASP 343 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1qrk h ASN 344 N 0.00 0.00 -6.88 -2.24 7.08 -1.91 -3.48 115.58 108.15 1qrk h ASN 344 Ca -0.32 0.00 -0.58 0.00 -3.08 0.00 0.00 56.30 52.32 1qrk h ASN 344 Cb 1.16 0.00 -0.21 0.00 -2.08 0.00 0.00 38.32 37.19 1qrk h ASN 344 CO 0.40 0.00 -0.90 -0.67 -2.08 0.00 0.00 177.43 174.18 1qrk n ASP 345 N -2.58 -0.93 0.00 6.14 2.03 -1.26 -0.12 116.55 119.83 1qrk n ASP 345 Ca 0.02 -1.14 0.00 0.00 0.52 0.00 0.00 54.79 54.19 1qrk n ASP 345 Cb 0.30 -2.24 0.00 0.00 -0.72 0.00 0.00 41.12 38.46 1qrk n ASP 345 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1qrk n ALA 346 N -4.39 0.00 -1.76 -1.67 0.00 -1.26 -4.88 120.51 106.55 1qrk n ALA 346 Ca -0.14 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.93 1qrk n ALA 346 Cb 0.60 -0.37 0.02 0.00 0.00 0.00 0.00 19.45 19.71 1qrk n ALA 346 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1qrk s ASN 347 N -2.71 5.46 -0.22 0.00 0.01 0.82 -1.32 114.94 116.98 1qrk s ASN 347 Ca 0.00 2.44 0.13 0.00 -0.71 0.00 0.00 52.86 54.73 1qrk s ASN 347 Cb 0.00 -2.61 0.48 0.00 0.41 0.00 0.00 41.25 39.53 1qrk s ASN 347 CO 0.00 -1.41 1.39 0.18 -1.51 0.00 0.00 177.10 175.74 1qrk n LEU 348 N -1.19 3.68 -3.89 0.60 4.77 0.13 -4.80 117.00 116.31 1qrk n LEU 348 Ca 0.11 -3.41 -0.11 0.00 -0.03 0.00 0.00 56.01 52.57 1qrk n LEU 348 Cb 0.48 -0.57 -0.12 0.00 -2.33 0.00 0.00 43.42 40.89 1qrk n LEU 348 CO 0.47 0.98 -0.27 -1.10 -1.33 0.00 0.00 177.39 176.13 1qrk s GLN 349 N -3.04 0.25 -0.10 3.23 -0.21 -1.26 -1.33 119.66 117.19 1qrk s GLN 349 Ca 0.41 -0.21 0.03 0.00 0.02 0.00 0.00 55.36 55.61 1qrk s GLN 349 Cb 0.36 0.10 0.00 0.00 1.00 0.00 0.00 33.01 34.48 1qrk s GLN 349 CO 0.03 -0.05 -0.21 -1.64 -2.12 0.00 0.00 175.29 171.30 1qrk s MET 350 N -0.73 2.82 -0.24 2.91 -1.94 0.25 -4.88 119.30 117.49 1qrk s MET 350 Ca -0.08 -0.79 -0.12 0.00 -1.71 0.00 0.00 55.69 52.99 1qrk s MET 350 Cb -0.05 -2.19 -0.05 0.00 2.01 0.00 0.00 34.83 34.56 1qrk s MET 350 CO 0.00 0.10 0.21 -0.51 -0.01 0.00 0.00 175.02 174.82 1qrk s ASP 351 N 0.53 6.15 -0.14 3.03 1.01 -1.26 -0.08 116.67 125.91 1qrk s ASP 351 Ca -0.15 0.16 0.01 0.00 0.71 0.00 0.00 52.55 53.28 1qrk s ASP 351 Cb -0.17 -2.13 -0.00 0.00 1.01 0.00 0.00 42.92 41.62 1qrk s ASP 351 CO 0.05 0.01 -0.17 -0.63 0.21 0.00 0.00 175.17 174.64 1qrk s ILE 352 N 1.29 2.58 -0.08 0.77 -1.09 -0.86 -4.59 121.20 119.23 1qrk s ILE 352 Ca 0.10 -0.81 -0.02 0.00 -2.23 0.00 0.00 60.65 57.68 1qrk s ILE 352 Cb -0.14 -2.07 -0.03 0.00 -1.58 0.00 0.00 42.46 38.63 1qrk s ILE 352 CO 0.07 0.53 0.02 -0.36 -1.23 0.00 0.00 174.94 173.97 1qrk s PHE 353 N 0.65 3.22 0.20 3.97 0.08 -1.26 -1.49 117.98 123.34 1qrk s PHE 353 Ca -0.09 0.23 0.11 0.00 0.12 0.00 0.00 56.93 57.31 1qrk s PHE 353 Cb -0.16 -1.80 -0.04 0.00 -0.57 0.00 0.00 43.02 40.45 1qrk s PHE 353 CO 0.02 0.51 -0.23 -0.51 -0.10 0.00 0.00 175.22 174.92 1qrk s LEU 354 N -1.00 2.48 0.67 -0.37 1.02 0.67 0.15 118.68 122.30 1qrk s LEU 354 Ca 0.15 -0.86 -0.08 0.00 0.02 0.00 0.00 54.13 53.36 1qrk s LEU 354 Cb -0.11 -1.20 0.04 0.00 0.02 0.00 0.00 46.19 44.93 1qrk s LEU 354 CO 0.04 0.11 1.00 -1.61 0.02 0.00 0.00 176.35 175.91 1qrk s GLU 355 N -2.74 2.55 0.42 1.70 0.41 0.19 -1.50 118.70 119.73 1qrk s GLU 355 Ca 0.22 -0.01 0.16 0.00 -0.41 0.00 0.00 54.97 54.92 1qrk s GLU 355 Cb -0.08 -2.16 0.94 0.00 -1.78 0.00 0.00 34.13 31.05 1qrk s GLU 355 CO 0.11 -1.04 1.92 0.93 -0.49 0.00 0.00 175.26 176.69 1qrk h GLU 356 N -0.49 0.00 -0.05 1.61 5.08 -1.88 -2.21 114.58 116.64 1qrk h GLU 356 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1qrk h GLU 356 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1qrk h GLU 356 CO 0.62 0.26 0.00 -0.40 -1.00 0.00 0.00 179.01 178.49 1qrk n ASP 357 N -4.10 0.28 0.00 1.42 5.75 -1.26 -4.88 116.55 113.76 1qrk n ASP 357 Ca -0.02 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.76 1qrk n ASP 357 Cb 0.32 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 1qrk n ASP 357 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qrk n GLY 358 N 0.58 0.71 3.83 6.12 0.00 -0.83 -4.88 105.19 110.72 1qrk n GLY 358 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1qrk n GLY 358 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qrk s ASN 359 N -2.54 6.18 0.10 1.61 0.01 -1.26 -4.66 114.94 114.38 1qrk s ASN 359 Ca 0.00 1.65 -0.30 0.00 -0.71 0.00 0.00 52.86 53.50 1qrk s ASN 359 Cb 0.00 -2.51 -0.06 0.00 0.41 0.00 0.00 41.25 39.08 1qrk s ASN 359 CO 0.00 -0.90 1.18 -0.69 -1.51 0.00 0.00 177.10 175.19 1qrk s VAL 360 N -2.65 3.93 -1.23 1.60 1.01 -1.26 0.53 120.40 122.33 1qrk s VAL 360 Ca 0.60 1.46 -0.18 0.00 0.00 0.00 0.00 61.98 63.86 1qrk s VAL 360 Cb -0.13 -3.93 0.09 0.00 0.00 0.00 0.00 36.38 32.41 1qrk s VAL 360 CO 0.37 0.16 1.62 0.21 0.00 0.00 0.00 175.10 177.46 1qrk s ASN 361 N 0.71 6.84 0.64 3.32 3.84 0.39 -4.73 114.94 125.95 1qrk s ASN 361 Ca 0.56 -2.42 0.10 0.00 0.21 0.00 0.00 52.86 51.31 1qrk s ASN 361 Cb -0.30 -2.54 0.55 0.00 -0.55 0.00 0.00 41.25 38.41 1qrk s ASN 361 CO 0.31 -1.12 1.30 0.28 -2.79 0.00 0.00 177.10 175.08 1qrk h SER 362 N 7.81 0.00 0.08 -4.21 0.02 -1.91 -1.00 113.55 114.34 1qrk h SER 362 Ca 0.38 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.99 1qrk h SER 362 Cb 0.89 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.41 1qrk h SER 362 CO 1.40 0.00 -1.87 0.29 -1.14 0.00 0.00 176.83 175.51 1qrk n LYS 363 N -2.59 0.70 0.18 3.45 4.01 -1.26 -4.41 118.16 118.24 1qrk n LYS 363 Ca -0.01 0.33 0.06 0.00 -0.51 0.00 0.00 58.31 58.19 1qrk n LYS 363 Cb 0.77 -1.70 0.15 0.00 -0.51 0.00 0.00 35.03 33.74 1qrk n LYS 363 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1qrk h LEU 364 N -0.25 0.00 -8.18 -0.35 3.38 -1.58 -3.40 115.31 104.94 1qrk h LEU 364 Ca -0.43 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 56.94 1qrk h LEU 364 Cb 1.82 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.46 1qrk h LEU 364 CO -0.02 0.33 1.13 -0.89 0.09 0.00 0.00 178.44 179.08 1qrk s THR 365 N -3.15 4.06 -0.80 0.22 2.01 -0.89 -4.74 115.64 112.35 1qrk s THR 365 Ca 0.04 -0.53 0.14 0.00 0.31 0.00 0.00 61.69 61.65 1qrk s THR 365 Cb 0.07 -4.92 -0.11 0.00 0.01 0.00 0.00 72.50 67.55 1qrk s THR 365 CO 0.71 -1.78 0.63 0.29 -0.69 0.00 0.00 174.62 173.77 1qrk n LYS 366 N 8.45 2.37 -3.31 4.92 4.76 -1.26 -4.91 118.16 129.18 1qrk n LYS 366 Ca 0.18 -0.18 -0.33 0.00 -2.87 0.00 0.00 58.31 55.11 1qrk n LYS 366 Cb 0.49 -1.16 -0.06 0.00 -1.84 0.00 0.00 35.03 32.47 1qrk n LYS 366 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1qrk s ASP 367 N -2.14 6.74 0.02 4.39 1.01 -1.26 -5.09 116.67 120.33 1qrk s ASP 367 Ca 0.07 1.09 -0.01 0.00 0.71 0.00 0.00 52.55 54.41 1qrk s ASP 367 Cb 0.10 -2.29 -0.02 0.00 1.01 0.00 0.00 42.92 41.73 1qrk s ASP 367 CO 0.51 -0.06 -0.01 -0.94 0.21 0.00 0.00 175.17 174.87 1qrk s SER 368 N -2.15 0.19 -0.21 0.27 1.04 -1.26 -5.00 113.70 106.59 1qrk s SER 368 Ca 0.47 -0.42 -0.11 0.00 0.48 0.00 0.00 55.95 56.37 1qrk s SER 368 Cb -0.12 0.10 -0.05 0.00 0.10 0.00 0.00 66.02 66.05 1qrk s SER 368 CO 0.20 -0.28 0.16 -0.69 0.98 0.00 0.00 173.24 173.61 1qrk s VAL 369 N -1.30 5.38 0.21 5.02 1.01 -1.26 -4.77 120.40 124.69 1qrk s VAL 369 Ca -0.14 0.23 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 1qrk s VAL 369 Cb -0.09 -3.50 -0.09 0.00 0.00 0.00 0.00 36.38 32.71 1qrk s VAL 369 CO -0.01 0.41 1.26 0.26 0.00 0.00 0.00 175.10 177.02 1qrk s TRP 370 N 0.57 3.32 0.21 5.22 0.52 0.05 -3.82 118.94 125.02 1qrk s TRP 370 Ca 0.09 1.33 -0.09 0.00 0.02 0.00 0.00 56.10 57.45 1qrk s TRP 370 Cb -0.12 -3.53 0.29 0.00 -1.15 0.00 0.00 33.47 28.95 1qrk s TRP 370 CO 0.00 -1.58 1.77 -0.91 0.02 0.00 0.00 176.95 176.25 1qrk h ASN 371 N 5.13 0.36 -4.73 2.95 2.35 0.40 -0.34 115.58 121.70 1qrk h ASN 371 Ca -0.45 0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.29 1qrk h ASN 371 Cb 1.21 0.01 -0.20 0.00 0.05 0.00 0.00 38.32 39.39 1qrk h ASN 371 CO 0.75 0.22 0.05 -0.72 -1.65 0.00 0.00 177.43 176.08 1qrk s TYR 372 N -6.08 -0.57 -0.04 1.19 1.13 -1.25 -1.16 117.35 110.56 1qrk s TYR 372 Ca -0.13 1.10 -0.01 0.00 -1.41 0.00 0.00 57.07 56.62 1qrk s TYR 372 Cb 0.17 0.30 0.03 0.00 -1.10 0.00 0.00 41.96 41.37 1qrk s TYR 372 CO 0.75 -0.49 0.07 -1.58 -2.51 0.00 0.00 175.55 171.79 1qrk s HIS 373 N -0.82 -0.03 -0.00 -3.49 2.46 -0.57 -4.87 115.29 107.96 1qrk s HIS 373 Ca -0.09 0.27 -0.04 0.00 0.47 0.00 0.00 55.06 55.67 1qrk s HIS 373 Cb -0.02 -0.23 -0.04 0.00 -0.13 0.00 0.00 32.58 32.15 1qrk s HIS 373 CO 0.06 -0.13 0.20 0.00 -2.47 0.00 0.00 174.74 172.41 1qrk n TRP 375 N 0.96 -0.50 -4.35 0.00 2.14 -0.27 -4.74 117.44 110.68 1qrk n TRP 375 Ca -0.11 -1.64 -0.25 0.00 2.07 0.00 0.00 57.50 57.57 1qrk n TRP 375 Cb 0.53 0.18 -0.09 0.00 -0.81 0.00 0.00 31.31 31.12 1qrk n TRP 375 CO 0.00 0.00 0.00 -0.80 2.07 0.00 0.00 177.69 178.96 1qrk s ASN 376 N -2.37 4.09 -0.07 -0.67 -0.87 -0.91 -0.40 114.94 113.74 1qrk s ASN 376 Ca 0.23 -0.73 0.04 0.00 -1.57 0.00 0.00 52.86 50.83 1qrk s ASN 376 Cb 0.01 -0.61 0.00 0.00 -0.02 0.00 0.00 41.25 40.64 1qrk s ASN 376 CO 0.16 0.06 -0.18 -1.61 -2.57 0.00 0.00 177.10 172.97 1qrk s GLU 377 N -3.18 2.24 -0.04 -0.60 2.02 0.92 -1.85 118.70 118.21 1qrk s GLU 377 Ca 0.27 -0.66 0.05 0.00 0.02 0.00 0.00 54.97 54.65 1qrk s GLU 377 Cb -0.07 -1.80 -0.01 0.00 0.10 0.00 0.00 34.13 32.35 1qrk s GLU 377 CO 0.16 0.16 -0.18 0.00 0.02 0.00 0.00 175.26 175.41 1qrk s ALA 378 N 0.34 1.62 -0.13 5.21 0.00 -0.27 -0.87 121.76 127.67 1qrk s ALA 378 Ca -0.13 -0.75 -0.15 0.00 0.00 0.00 0.00 51.96 50.93 1qrk s ALA 378 Cb -0.15 -0.52 -0.05 0.00 0.00 0.00 0.00 23.12 22.40 1qrk s ALA 378 CO 0.05 0.31 0.34 -0.46 0.00 0.00 0.00 175.76 176.00 1qrk s TRP 379 N -0.03 3.50 -0.13 0.00 -0.11 0.03 -0.69 118.94 121.51 1qrk s TRP 379 Ca -0.03 0.70 -0.34 0.00 1.22 0.00 0.00 56.10 57.66 1qrk s TRP 379 Cb -0.11 -2.37 0.14 0.00 -1.50 0.00 0.00 33.47 29.62 1qrk s TRP 379 CO 0.02 0.28 1.30 0.00 -4.62 0.00 0.00 176.95 173.93 1qrk s MET 380 N 0.30 0.26 0.88 5.86 0.23 -1.03 -4.40 119.30 121.40 1qrk s MET 380 Ca 0.19 -0.12 -0.12 0.00 -1.03 0.00 0.00 55.69 54.61 1qrk s MET 380 Cb -0.14 0.10 0.17 0.00 -1.53 0.00 0.00 34.83 33.43 1qrk s MET 380 CO 0.06 -0.12 1.22 0.95 -2.03 0.00 0.00 175.02 175.11 1qrk s THR 381 N -2.31 2.05 -0.37 3.16 -4.23 -0.92 -1.08 115.64 111.93 1qrk s THR 381 Ca 0.12 -0.15 0.02 0.00 -1.18 0.00 0.00 61.69 60.50 1qrk s THR 381 Cb 0.02 -2.89 0.15 0.00 1.34 0.00 0.00 72.50 71.12 1qrk s THR 381 CO -0.04 0.00 0.29 -0.13 -0.54 0.00 0.00 174.62 174.19 1qrk s ARG 382 N -5.66 0.66 0.19 3.99 1.81 -1.26 -4.81 118.95 113.86 1qrk s ARG 382 Ca 0.71 -1.40 0.26 0.00 -1.72 0.00 0.00 55.73 53.58 1qrk s ARG 382 Cb -0.05 -1.17 0.88 0.00 -0.45 0.00 0.00 34.95 34.16 1qrk s ARG 382 CO 0.50 -1.25 1.79 -2.30 -0.68 0.00 0.00 175.30 173.36 1qrk n PRO 383 N 3.78 0.22 0.00 3.54 -0.02 -1.26 -2.93 135.00 138.33 1qrk n PRO 383 Ca 0.16 0.21 0.13 0.00 -2.02 0.00 0.00 63.50 61.98 1qrk n PRO 383 Cb 0.42 -1.77 0.33 0.00 -0.02 0.00 0.00 33.50 32.45 1qrk n PRO 383 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1qrk n ASP 384 N -2.15 1.27 -4.68 2.55 5.75 -1.26 -4.92 116.55 113.11 1qrk n ASP 384 Ca 0.05 -1.07 -0.28 0.00 -0.01 0.00 0.00 54.79 53.49 1qrk n ASP 384 Cb 0.40 0.17 -0.09 0.00 -1.03 0.00 0.00 41.12 40.57 1qrk n ASP 384 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1qrk s LEU 385 N -2.44 2.87 0.95 -2.12 1.43 -1.15 -5.04 118.68 113.19 1qrk s LEU 385 Ca 0.25 -1.32 -0.12 0.00 -1.03 0.00 0.00 54.13 51.91 1qrk s LEU 385 Cb 0.19 -1.04 0.16 0.00 0.03 0.00 0.00 46.19 45.53 1qrk s LEU 385 CO 0.51 -0.54 1.11 -2.84 0.23 0.00 0.00 176.35 174.81 1qrk s PRO 386 N -3.80 0.78 0.45 1.29 0.02 -1.26 -4.95 135.00 127.53 1qrk s PRO 386 Ca 0.33 0.46 -0.25 0.00 0.02 0.00 0.00 61.00 61.56 1qrk s PRO 386 Cb 0.07 -1.78 -0.08 0.00 0.02 0.00 0.00 34.50 32.73 1qrk s PRO 386 CO 0.18 -2.48 1.36 0.54 -0.33 0.00 0.00 177.00 176.27 1qrk s VAL 387 N -3.08 2.31 0.00 3.83 0.11 -1.26 -3.31 120.40 119.00 1qrk s VAL 387 Ca 0.64 0.27 0.00 0.00 -2.93 0.00 0.00 61.98 59.96 1qrk s VAL 387 Cb -0.17 -3.15 0.00 0.00 -1.53 0.00 0.00 36.38 31.53 1qrk s VAL 387 CO 0.56 0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.97 1qrk n GLY 388 N 0.62 2.61 1.84 6.54 0.00 -1.26 -4.94 105.19 110.60 1qrk n GLY 388 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.07 1qrk n GLY 388 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1qrk n PHE 389 N -0.78 2.10 -2.58 1.61 3.72 -1.21 -4.90 117.46 115.42 1qrk n PHE 389 Ca 0.00 -0.92 -0.22 0.00 -0.05 0.00 0.00 57.45 56.26 1qrk n PHE 389 Cb 0.00 -0.58 0.05 0.00 -0.94 0.00 0.00 39.48 38.02 1qrk n PHE 389 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1qrk s GLY 390 N -0.79 1.80 0.00 1.37 0.00 -1.26 -4.56 107.32 103.88 1qrk s GLY 390 Ca 0.49 -1.36 0.00 0.00 0.00 0.00 0.00 44.72 43.85 1qrk s GLY 390 CO 0.13 -1.01 0.00 0.61 0.00 0.00 0.00 173.10 172.83 1qrk n GLY 391 N -2.49 0.36 3.76 0.20 0.00 -0.24 -4.91 105.19 101.87 1qrk n GLY 391 Ca 0.09 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.91 1qrk n GLY 391 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1qrk s TRP 392 N 0.00 3.15 -0.08 1.61 0.52 -1.26 -2.46 118.94 120.42 1qrk s TRP 392 Ca 0.00 1.43 0.02 0.00 0.02 0.00 0.00 56.10 57.56 1qrk s TRP 392 Cb 0.00 -3.61 0.02 0.00 -1.15 0.00 0.00 33.47 28.72 1qrk s TRP 392 CO 0.00 -1.68 -0.12 -0.65 0.02 0.00 0.00 176.95 174.52 1qrk s GLN 393 N -1.51 1.77 0.02 4.98 -1.52 0.13 -2.64 119.66 120.89 1qrk s GLN 393 Ca 0.49 -0.41 -0.28 0.00 -1.95 0.00 0.00 55.36 53.21 1qrk s GLN 393 Cb -0.38 -1.53 -0.04 0.00 -0.22 0.00 0.00 33.01 30.84 1qrk s GLN 393 CO 0.49 -0.04 0.91 0.00 -0.25 0.00 0.00 175.29 176.40 1qrk s ALA 394 N 0.91 3.23 -0.07 6.09 0.00 -0.15 -1.11 121.76 130.65 1qrk s ALA 394 Ca -0.10 0.46 -0.00 0.00 0.00 0.00 0.00 51.96 52.32 1qrk s ALA 394 Cb -0.15 -3.23 0.03 0.00 0.00 0.00 0.00 23.12 19.77 1qrk s ALA 394 CO 0.01 -0.13 -0.03 0.08 0.00 0.00 0.00 175.76 175.69 1qrk s VAL 395 N 0.63 0.57 -0.33 0.00 1.01 -0.77 -0.71 120.40 120.80 1qrk s VAL 395 Ca 0.47 -0.04 -0.06 0.00 0.00 0.00 0.00 61.98 62.36 1qrk s VAL 395 Cb -0.21 -0.66 0.04 0.00 0.00 0.00 0.00 36.38 35.55 1qrk s VAL 395 CO 0.26 0.28 0.08 -0.62 0.00 0.00 0.00 175.10 175.10 1qrk s ASP 396 N 1.63 5.21 0.13 3.32 -1.08 0.35 -2.13 116.67 124.09 1qrk s ASP 396 Ca 0.01 -1.13 0.24 0.00 -0.52 0.00 0.00 52.55 51.15 1qrk s ASP 396 Cb -0.13 -1.84 0.93 0.00 -1.46 0.00 0.00 42.92 40.42 1qrk s ASP 396 CO -0.04 -0.30 1.75 -1.20 0.52 0.00 0.00 175.17 175.90 1qrk n SER 397 N 4.78 0.43 -4.56 -0.34 7.64 -1.26 -1.74 113.62 118.57 1qrk n SER 397 Ca -0.13 0.56 -0.43 0.00 1.01 0.00 0.00 58.87 59.89 1qrk n SER 397 Cb 0.45 -0.67 -0.04 0.00 -1.01 0.00 0.00 64.21 62.93 1qrk n SER 397 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1qrk s THR 398 N -3.11 4.51 0.77 0.44 2.01 -1.26 -4.55 115.64 114.45 1qrk s THR 398 Ca 0.10 0.68 -0.14 0.00 0.31 0.00 0.00 61.69 62.63 1qrk s THR 398 Cb 0.13 -4.41 0.06 0.00 0.01 0.00 0.00 72.50 68.29 1qrk s THR 398 CO 0.48 -0.81 1.22 -2.16 -0.69 0.00 0.00 174.62 172.66 1qrk s PRO 399 N 3.65 1.87 0.14 4.92 0.04 -1.26 -4.69 135.00 139.66 1qrk s PRO 399 Ca 0.35 1.79 -0.24 0.00 0.04 0.00 0.00 61.00 62.94 1qrk s PRO 399 Cb -0.11 -1.80 0.07 0.00 0.04 0.00 0.00 34.50 32.70 1qrk s PRO 399 CO 0.25 -2.05 0.76 1.14 0.04 0.00 0.00 177.00 177.15 1qrk s GLN 400 N -4.00 1.24 0.07 4.56 -2.07 -0.68 -4.82 119.66 113.96 1qrk s GLN 400 Ca 0.74 -0.56 -0.31 0.00 -1.82 0.00 0.00 55.36 53.42 1qrk s GLN 400 Cb -0.30 0.51 -0.08 0.00 -1.09 0.00 0.00 33.01 32.05 1qrk s GLN 400 CO 0.48 -0.56 1.52 -1.21 -1.32 0.00 0.00 175.29 174.21 1qrk s GLU 401 N -3.54 4.25 0.00 9.60 0.41 -1.26 -1.99 118.70 126.16 1qrk s GLU 401 Ca 0.06 2.19 0.00 0.00 -0.41 0.00 0.00 54.97 56.81 1qrk s GLU 401 Cb -0.02 -3.47 0.00 0.00 -1.78 0.00 0.00 34.13 28.86 1qrk s GLU 401 CO -0.06 -0.62 0.00 0.27 -0.49 0.00 0.00 175.26 174.37 1qrk n ASN 402 N 5.01 0.62 -0.34 -0.19 0.23 -1.26 -4.56 115.26 114.77 1qrk n ASN 402 Ca 0.14 -0.40 0.07 0.00 -0.53 0.00 0.00 54.58 53.86 1qrk n ASN 402 Cb 0.41 0.00 0.25 0.00 -2.08 0.00 0.00 39.78 38.37 1qrk n ASN 402 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1qrk h SER 403 N 0.00 0.90 1.57 0.53 0.02 -1.98 -0.05 113.55 114.53 1qrk h SER 403 Ca 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1qrk h SER 403 Cb 0.00 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1qrk h SER 403 CO 0.00 0.50 -0.36 0.44 -1.14 0.00 0.00 176.83 176.28 1qrk h ASP 404 N 0.98 0.00 -3.94 3.07 3.32 -1.96 -3.50 116.42 114.39 1qrk h ASP 404 Ca 0.47 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.51 1qrk h ASP 404 Cb 0.44 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.95 1qrk h ASP 404 CO -0.23 0.01 -0.70 0.61 -1.72 0.00 0.00 179.24 177.20 1qrk n GLY 405 N 1.16 -4.19 1.62 2.75 0.00 -0.03 -4.90 105.19 101.58 1qrk n GLY 405 Ca 0.03 0.41 -0.01 0.00 0.00 0.00 0.00 46.02 46.45 1qrk n GLY 405 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1qrk n MET 406 N 0.87 -0.16 -4.04 1.61 0.00 -0.84 -4.80 117.12 109.75 1qrk n MET 406 Ca -0.15 0.06 -0.11 0.00 -0.00 0.00 0.00 57.70 57.51 1qrk n MET 406 Cb 0.23 -1.82 -0.06 0.00 0.00 0.00 0.00 33.22 31.57 1qrk n MET 406 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 175.97 176.68 1qrk s TYR 407 N -3.03 0.61 1.15 1.12 2.02 -1.01 -4.71 117.35 113.50 1qrk s TYR 407 Ca 0.03 -0.93 -0.13 0.00 -0.37 0.00 0.00 57.07 55.67 1qrk s TYR 407 Cb -0.00 0.03 0.28 0.00 -0.40 0.00 0.00 41.96 41.86 1qrk s TYR 407 CO 0.05 -0.97 1.04 -0.98 -1.57 0.00 0.00 175.55 173.11 1qrk s ARG 408 N -3.83 -0.80 0.10 -0.62 1.04 -1.26 -1.69 118.95 111.88 1qrk s ARG 408 Ca 0.26 0.86 0.07 0.00 -1.04 0.00 0.00 55.73 55.89 1qrk s ARG 408 Cb 0.01 -1.57 -0.03 0.00 -2.04 0.00 0.00 34.95 31.32 1qrk s ARG 408 CO 0.12 -3.65 -0.18 0.00 -0.04 0.00 0.00 175.30 171.54 1qrk n GLY 410 N 0.99 1.88 3.66 0.00 0.00 -1.12 -0.50 105.19 110.11 1qrk n GLY 410 Ca -0.19 -2.02 -0.43 0.00 0.00 0.00 0.00 46.02 43.39 1qrk n GLY 410 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1qrk s PRO 411 N -2.23 4.19 -0.21 1.61 0.04 -1.26 -4.67 135.00 132.46 1qrk s PRO 411 Ca 0.00 1.88 -0.11 0.00 0.04 0.00 0.00 61.00 62.81 1qrk s PRO 411 Cb 0.00 -3.87 -0.05 0.00 0.04 0.00 0.00 34.50 30.62 1qrk s PRO 411 CO 0.00 -0.80 0.17 0.00 0.04 0.00 0.00 177.00 176.41 1qrk s ALA 412 N 3.82 3.65 -0.23 8.56 0.00 0.11 -1.51 121.76 136.17 1qrk s ALA 412 Ca 0.63 -0.72 -0.29 0.00 0.00 0.00 0.00 51.96 51.58 1qrk s ALA 412 Cb -0.27 -2.26 -0.04 0.00 0.00 0.00 0.00 23.12 20.55 1qrk s ALA 412 CO 0.22 0.02 1.93 0.45 0.00 0.00 0.00 175.76 178.38 1qrk s SER 413 N 0.63 5.89 0.54 0.00 0.15 -1.26 -0.98 113.70 118.67 1qrk s SER 413 Ca 0.09 1.73 0.35 0.00 0.70 0.00 0.00 55.95 58.81 1qrk s SER 413 Cb -0.12 -2.52 1.52 0.00 -1.71 0.00 0.00 66.02 63.19 1qrk s SER 413 CO 0.01 -1.64 1.83 0.58 1.20 0.00 0.00 173.24 175.22 1qrk h VAL 414 N 6.68 0.45 -0.04 4.45 2.07 -1.83 0.28 116.25 128.30 1qrk h VAL 414 Ca -0.38 0.00 -0.22 0.00 0.82 0.00 0.00 66.70 66.92 1qrk h VAL 414 Cb 1.20 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1qrk h VAL 414 CO 0.99 0.00 -0.87 1.56 0.02 0.00 0.00 177.57 179.27 1qrk h GLN 415 N 0.00 0.48 -0.56 1.57 1.08 -1.83 -2.69 115.11 113.16 1qrk h GLN 415 Ca 0.50 -0.46 -0.07 0.00 -1.45 0.00 0.00 58.65 57.17 1qrk h GLN 415 Cb 2.04 0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 29.57 1qrk h GLN 415 CO -0.01 1.10 0.05 0.00 -0.95 0.00 0.00 178.83 179.03 1qrk h ALA 416 N 0.75 1.04 0.18 3.87 0.00 -0.80 -2.57 119.26 121.71 1qrk h ALA 416 Ca -0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1qrk h ALA 416 Cb 1.48 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1qrk h ALA 416 CO 0.15 0.61 -0.08 0.82 0.00 0.00 0.00 179.25 180.75 1qrk h ILE 417 N 0.87 0.87 -0.24 0.00 1.08 -1.26 -0.48 117.51 118.36 1qrk h ILE 417 Ca 0.17 -0.21 0.07 0.00 -0.39 0.00 0.00 64.86 64.50 1qrk h ILE 417 Cb 0.44 1.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.18 1qrk h ILE 417 CO 0.02 0.05 0.33 0.50 -0.69 0.00 0.00 178.15 178.35 1qrk h LYS 418 N -0.34 0.00 -0.43 2.37 3.64 -1.35 0.18 116.57 120.64 1qrk h LYS 418 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1qrk h LYS 418 Cb 0.26 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1qrk h LYS 418 CO 0.04 0.00 0.00 0.72 -2.27 0.00 0.00 179.45 177.94 1qrk n HIS 419 N -3.55 0.93 -1.20 1.91 8.25 -0.76 -4.69 115.22 116.10 1qrk n HIS 419 Ca 0.03 -0.64 -0.07 0.00 -0.26 0.00 0.00 57.72 56.79 1qrk n HIS 419 Cb 0.45 -0.17 -0.03 0.00 1.12 0.00 0.00 29.99 31.36 1qrk n HIS 419 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qrk n GLY 420 N 0.47 0.73 2.98 -1.41 0.00 0.63 -4.65 105.19 103.95 1qrk n GLY 420 Ca 0.19 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1qrk n GLY 420 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1qrk n HIS 421 N -2.28 3.71 1.88 1.61 8.25 -0.26 -2.61 115.22 125.52 1qrk n HIS 421 Ca -0.07 -2.94 0.16 0.00 -0.26 0.00 0.00 57.72 54.61 1qrk n HIS 421 Cb 0.49 -2.37 0.86 0.00 1.12 0.00 0.00 29.99 30.09 1qrk n HIS 421 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1qrk n VAL 422 N 4.80 0.00 0.39 1.59 0.24 -1.26 -3.79 118.33 120.30 1qrk n VAL 422 Ca 0.47 -0.04 0.10 0.00 -2.04 0.00 0.00 64.34 62.82 1qrk n VAL 422 Cb 0.40 -0.33 0.42 0.00 -1.47 0.00 0.00 33.84 32.86 1qrk n VAL 422 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1qrk s PHE 424 N -3.22 3.53 0.54 0.00 0.08 -1.25 -5.10 117.98 112.57 1qrk s PHE 424 Ca 0.04 0.75 -0.13 0.00 0.12 0.00 0.00 56.93 57.71 1qrk s PHE 424 Cb 0.09 -2.14 -0.06 0.00 -0.57 0.00 0.00 43.02 40.34 1qrk s PHE 424 CO 0.32 0.46 0.96 1.14 -0.10 0.00 0.00 175.22 178.00 1qrk s GLN 425 N -2.22 3.77 -0.10 0.44 -2.07 -1.26 -4.13 119.66 114.09 1qrk s GLN 425 Ca 0.37 0.77 0.00 0.00 -1.82 0.00 0.00 55.36 54.68 1qrk s GLN 425 Cb -0.13 -2.16 -0.02 0.00 -1.09 0.00 0.00 33.01 29.60 1qrk s GLN 425 CO 0.20 -0.35 -0.10 -0.06 -1.32 0.00 0.00 175.29 173.66 1qrk s PHE 426 N -2.81 2.86 -1.38 9.60 0.40 -0.57 -4.56 117.98 121.53 1qrk s PHE 426 Ca 0.56 -0.28 -0.07 0.00 -0.60 0.00 0.00 56.93 56.54 1qrk s PHE 426 Cb -0.10 -1.78 0.04 0.00 0.51 0.00 0.00 43.02 41.69 1qrk s PHE 426 CO 0.41 0.07 0.52 -0.25 0.70 0.00 0.00 175.22 176.66 1qrk n ASP 427 N 2.89 -4.62 -0.33 1.36 8.00 -1.26 -2.77 116.55 119.81 1qrk n ASP 427 Ca -0.18 -0.33 0.03 0.00 0.71 0.00 0.00 54.79 55.03 1qrk n ASP 427 Cb 0.53 -3.79 0.18 0.00 -0.02 0.00 0.00 41.12 38.02 1qrk n ASP 427 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qrk h ALA 428 N 0.98 1.30 -0.48 2.24 0.00 -1.82 -2.60 119.26 118.88 1qrk h ALA 428 Ca -0.46 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.52 1qrk h ALA 428 Cb 1.31 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1qrk h ALA 428 CO 0.54 0.24 0.33 -1.35 0.00 0.00 0.00 179.25 179.00 1qrk h PRO 429 N 0.96 0.36 -0.05 0.00 0.11 -1.90 -1.58 132.00 129.89 1qrk h PRO 429 Ca 0.42 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.48 1qrk h PRO 429 Cb 0.31 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.34 1qrk h PRO 429 CO -0.22 0.24 -0.08 0.74 -0.21 0.00 0.00 178.00 178.47 1qrk h PHE 430 N 0.37 0.18 0.00 0.65 0.04 -1.84 -2.43 116.94 113.92 1qrk h PHE 430 Ca 0.21 -0.06 -0.05 0.00 2.80 0.00 0.00 57.97 60.87 1qrk h PHE 430 Cb 0.37 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.47 1qrk h PHE 430 CO -0.00 0.65 -0.26 -0.39 -0.60 0.00 0.00 178.31 177.70 1qrk h VAL 431 N -0.33 0.77 -0.46 -0.55 -1.51 -1.56 -2.34 116.25 110.27 1qrk h VAL 431 Ca 0.01 -1.08 -0.11 0.00 -1.23 0.00 0.00 66.70 64.28 1qrk h VAL 431 Cb 0.63 1.67 -0.02 0.00 -2.13 0.00 0.00 31.29 31.44 1qrk h VAL 431 CO 0.02 0.26 -0.15 0.15 -1.23 0.00 0.00 177.57 176.62 1qrk h PHE 432 N 0.00 0.97 -0.01 5.19 3.04 -1.22 -2.43 116.94 122.47 1qrk h PHE 432 Ca -0.00 -0.20 0.00 0.00 3.98 0.00 0.00 57.97 61.75 1qrk h PHE 432 Cb 0.65 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 38.92 1qrk h PHE 432 CO 0.00 0.95 -0.08 0.00 -2.02 0.00 0.00 178.31 177.16 1qrk n ALA 433 N -2.50 2.72 0.12 2.41 0.00 -0.92 -1.34 120.51 121.00 1qrk n ALA 433 Ca 0.01 -0.45 -0.01 0.00 0.00 0.00 0.00 53.44 52.99 1qrk n ALA 433 Cb 0.40 -1.14 0.08 0.00 0.00 0.00 0.00 19.45 18.79 1qrk n ALA 433 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1qrk h GLU 434 N 2.14 0.00 0.00 0.00 4.39 -0.91 -3.38 114.58 116.82 1qrk h GLU 434 Ca 0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 1qrk h GLU 434 Cb 0.53 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 1qrk h GLU 434 CO 0.00 0.68 -1.30 1.55 -1.16 0.00 0.00 179.01 178.78 1qrk n VAL 435 N -3.50 0.25 -2.30 3.13 3.14 -1.16 -1.66 118.33 116.22 1qrk n VAL 435 Ca -0.00 -0.18 -0.29 0.00 -2.96 0.00 0.00 64.34 60.91 1qrk n VAL 435 Cb 0.73 -0.59 0.01 0.00 -1.06 0.00 0.00 33.84 32.93 1qrk n VAL 435 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1qrk n ASN 436 N -2.06 5.23 -4.58 6.55 2.85 -0.45 -3.43 115.26 119.35 1qrk n ASN 436 Ca -0.06 -3.74 -0.29 0.00 -0.11 0.00 0.00 54.58 50.38 1qrk n ASN 436 Cb 0.53 -0.54 -0.09 0.00 1.24 0.00 0.00 39.78 40.92 1qrk n ASN 436 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1qrk s SER 437 N -3.16 4.40 0.31 1.20 0.15 -1.26 -4.87 113.70 110.48 1qrk s SER 437 Ca 0.50 -0.43 0.06 0.00 0.70 0.00 0.00 55.95 56.77 1qrk s SER 437 Cb 0.41 -0.83 -0.02 0.00 -1.71 0.00 0.00 66.02 63.88 1qrk s SER 437 CO -0.18 0.15 0.45 -1.81 1.20 0.00 0.00 173.24 173.05 1qrk s ASP 438 N -2.44 6.08 -0.22 5.45 1.01 -0.44 -4.38 116.67 121.72 1qrk s ASP 438 Ca 0.23 -0.08 -0.05 0.00 0.71 0.00 0.00 52.55 53.35 1qrk s ASP 438 Cb -0.10 -1.44 -0.02 0.00 1.01 0.00 0.00 42.92 42.37 1qrk s ASP 438 CO 0.15 -0.33 0.01 -0.76 0.21 0.00 0.00 175.17 174.44 1qrk s LEU 439 N -4.13 3.20 -0.19 1.23 1.43 0.47 0.87 118.68 121.55 1qrk s LEU 439 Ca 0.42 -0.27 -0.05 0.00 -1.03 0.00 0.00 54.13 53.20 1qrk s LEU 439 Cb -0.09 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 1qrk s LEU 439 CO 0.31 0.00 0.01 -0.63 0.23 0.00 0.00 176.35 176.27 1qrk s ILE 440 N 1.36 4.14 -0.38 -0.59 -1.09 0.88 0.35 121.20 125.87 1qrk s ILE 440 Ca 0.05 -0.25 -0.14 0.00 -2.23 0.00 0.00 60.65 58.07 1qrk s ILE 440 Cb -0.15 -2.87 0.01 0.00 -1.58 0.00 0.00 42.46 37.87 1qrk s ILE 440 CO 0.01 0.44 0.27 -0.31 -1.23 0.00 0.00 174.94 174.11 1qrk s TYR 441 N 0.83 3.23 -0.03 3.97 2.02 0.12 -2.03 117.35 125.48 1qrk s TYR 441 Ca 0.01 -0.47 0.05 0.00 -0.37 0.00 0.00 57.07 56.29 1qrk s TYR 441 Cb -0.14 -2.54 -0.03 0.00 -0.40 0.00 0.00 41.96 38.85 1qrk s TYR 441 CO 0.02 -0.50 -0.15 0.42 -1.57 0.00 0.00 175.55 173.76 1qrk s ILE 442 N 1.69 2.97 -0.20 2.71 1.01 -0.56 0.13 121.20 128.95 1qrk s ILE 442 Ca 0.05 -0.85 -0.07 0.00 0.00 0.00 0.00 60.65 59.78 1qrk s ILE 442 Cb -0.18 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 1qrk s ILE 442 CO 0.10 0.53 0.07 -0.89 0.00 0.00 0.00 174.94 174.74 1qrk s THR 443 N -0.78 4.63 -0.57 2.92 2.01 0.19 -0.24 115.64 123.82 1qrk s THR 443 Ca 0.12 -0.08 -0.15 0.00 0.31 0.00 0.00 61.69 61.90 1qrk s THR 443 Cb -0.11 -3.11 0.14 0.00 0.01 0.00 0.00 72.50 69.43 1qrk s THR 443 CO 0.02 0.42 0.51 0.00 -0.69 0.00 0.00 174.62 174.87 1qrk s ALA 444 N 0.78 3.66 0.50 7.40 0.00 -0.56 0.27 121.76 133.81 1qrk s ALA 444 Ca 0.03 -2.64 -0.24 0.00 0.00 0.00 0.00 51.96 49.12 1qrk s ALA 444 Cb -0.13 -3.23 -0.07 0.00 0.00 0.00 0.00 23.12 19.69 1qrk s ALA 444 CO 0.02 -2.04 1.40 0.15 0.00 0.00 0.00 175.76 175.30 1qrk s LYS 445 N 1.37 3.40 0.53 0.00 1.02 0.94 -4.50 119.74 122.50 1qrk s LYS 445 Ca 0.05 2.35 0.40 0.00 0.02 0.00 0.00 55.97 58.79 1qrk s LYS 445 Cb -0.27 -2.46 1.58 0.00 -0.52 0.00 0.00 37.83 36.16 1qrk s LYS 445 CO 0.01 -1.02 1.71 0.87 -0.92 0.00 0.00 175.35 176.00 1qrk h LYS 446 N 1.89 0.03 0.00 1.68 6.56 -1.97 -0.08 116.57 124.68 1qrk h LYS 446 Ca -0.51 -0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.03 1qrk h LYS 446 Cb 1.28 -0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.93 1qrk h LYS 446 CO 0.59 0.02 -0.24 0.38 -2.06 0.00 0.00 179.45 178.14 1qrk h ASP 447 N 0.03 0.00 0.00 0.86 2.03 -2.04 -3.47 116.42 113.84 1qrk h ASP 447 Ca 0.72 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 57.02 1qrk h ASP 447 Cb 2.75 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 41.25 1qrk h ASP 447 CO -0.07 0.24 0.00 0.61 -1.03 0.00 0.00 179.24 179.00 1qrk n GLY 448 N 0.95 1.13 3.93 7.15 0.00 -0.04 -5.14 105.19 113.16 1qrk n GLY 448 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 1qrk n GLY 448 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qrk s THR 449 N -0.87 2.10 0.03 2.61 -4.23 -1.24 -4.84 115.64 109.19 1qrk s THR 449 Ca 0.00 -0.14 0.03 0.00 -1.18 0.00 0.00 61.69 60.41 1qrk s THR 449 Cb 0.00 -2.96 -0.02 0.00 1.34 0.00 0.00 72.50 70.86 1qrk s THR 449 CO 0.00 0.00 -0.10 -1.00 -0.54 0.00 0.00 174.62 172.98 1qrk s HIS 450 N -3.52 0.91 -0.04 3.99 3.76 -1.26 -0.04 115.29 119.09 1qrk s HIS 450 Ca 0.65 -0.32 -0.01 0.00 -0.15 0.00 0.00 55.06 55.23 1qrk s HIS 450 Cb -0.09 -0.55 0.03 0.00 1.11 0.00 0.00 32.58 33.08 1qrk s HIS 450 CO 0.48 -0.01 0.01 0.54 -0.85 0.00 0.00 174.74 174.92 1qrk s VAL 451 N -0.78 0.17 -0.62 -0.90 0.11 0.14 -4.93 120.40 113.59 1qrk s VAL 451 Ca -0.01 0.18 -0.27 0.00 -2.93 0.00 0.00 61.98 58.94 1qrk s VAL 451 Cb -0.07 -0.32 0.02 0.00 -1.53 0.00 0.00 36.38 34.48 1qrk s VAL 451 CO 0.01 0.19 1.41 0.68 -3.33 0.00 0.00 175.10 174.05 1qrk s VAL 452 N 1.56 3.74 -0.01 2.04 -7.23 -1.26 0.55 120.40 119.78 1qrk s VAL 452 Ca -0.02 0.56 -0.23 0.00 -1.81 0.00 0.00 61.98 60.48 1qrk s VAL 452 Cb -0.13 -4.55 -0.15 0.00 0.56 0.00 0.00 36.38 32.12 1qrk s VAL 452 CO -0.03 -1.36 1.04 -0.33 -0.31 0.00 0.00 175.10 174.12 1qrk h GLU 453 N 11.07 -0.46 -2.20 4.82 4.39 0.74 -3.48 114.58 129.45 1qrk h GLU 453 Ca -0.27 0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.49 1qrk h GLU 453 Cb 1.08 0.11 -0.17 0.00 -0.10 0.00 0.00 28.75 29.67 1qrk h GLU 453 CO 1.21 -0.14 0.36 0.54 -1.16 0.00 0.00 179.01 179.82 1qrk s ASN 454 N -5.04 -0.49 -0.12 1.42 2.20 -1.15 -4.85 114.94 106.91 1qrk s ASN 454 Ca -0.13 0.28 -0.02 0.00 -0.94 0.00 0.00 52.86 52.05 1qrk s ASN 454 Cb 0.01 0.46 -0.03 0.00 -2.00 0.00 0.00 41.25 39.69 1qrk s ASN 454 CO 0.46 -0.63 -0.04 0.68 -2.94 0.00 0.00 177.10 174.63 1qrk s VAL 455 N -2.29 3.94 -0.31 3.54 -7.23 -1.26 0.16 120.40 116.96 1qrk s VAL 455 Ca -0.02 -0.36 -0.07 0.00 -1.81 0.00 0.00 61.98 59.72 1qrk s VAL 455 Cb -0.01 -2.68 0.01 0.00 0.56 0.00 0.00 36.38 34.26 1qrk s VAL 455 CO -0.02 0.54 0.10 -0.62 -0.31 0.00 0.00 175.10 174.79 1qrk s ASP 456 N -0.20 5.26 -0.09 4.85 -1.08 0.15 -4.96 116.67 120.60 1qrk s ASP 456 Ca 0.04 -0.77 0.14 0.00 -0.52 0.00 0.00 52.55 51.43 1qrk s ASP 456 Cb -0.13 -1.91 0.42 0.00 -1.46 0.00 0.00 42.92 39.84 1qrk s ASP 456 CO 0.02 -0.23 1.34 0.00 0.52 0.00 0.00 175.17 176.82 1qrk n ALA 457 N 4.88 2.60 -0.19 3.66 0.00 -1.26 -0.40 120.51 129.81 1qrk n ALA 457 Ca -0.14 -1.76 0.00 0.00 0.00 0.00 0.00 53.44 51.54 1qrk n ALA 457 Cb 0.47 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.35 1qrk n ALA 457 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1qrk n THR 458 N -0.06 0.16 0.05 0.00 -2.24 -1.26 -4.84 114.28 106.09 1qrk n THR 458 Ca 0.16 -0.48 -0.03 0.00 -2.27 0.00 0.00 64.05 61.43 1qrk n THR 458 Cb 0.67 1.07 -0.01 0.00 -2.10 0.00 0.00 70.33 69.96 1qrk n THR 458 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1qrk h HIS 459 N 0.00 -0.16 -3.10 4.78 2.76 -1.89 -3.42 115.15 114.14 1qrk h HIS 459 Ca 0.00 -0.00 -0.53 0.00 -2.20 0.00 0.00 60.37 57.64 1qrk h HIS 459 Cb 0.19 0.05 0.05 0.00 1.55 0.00 0.00 27.41 29.25 1qrk h HIS 459 CO 0.00 -0.10 0.82 0.42 -1.30 0.00 0.00 177.93 177.77 1qrk s ILE 460 N -2.10 2.66 -0.03 6.26 1.01 -1.26 -2.99 121.20 124.74 1qrk s ILE 460 Ca -0.02 0.51 0.00 0.00 0.00 0.00 0.00 60.65 61.13 1qrk s ILE 460 Cb 0.00 -3.33 0.00 0.00 0.01 0.00 0.00 42.46 39.15 1qrk s ILE 460 CO 0.07 0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.68 1qrk n GLY 461 N 3.00 0.36 0.18 6.18 0.00 -0.17 -4.65 105.19 110.10 1qrk n GLY 461 Ca 0.10 -0.90 -0.04 0.00 0.00 0.00 0.00 46.02 45.18 1qrk n GLY 461 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qrk h LYS 462 N 0.00 0.03 -2.77 1.61 1.79 -1.40 -3.43 116.57 112.40 1qrk h LYS 462 Ca -0.01 -0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.33 1qrk h LYS 462 Cb 0.89 -0.01 -0.26 0.00 -1.58 0.00 0.00 32.23 31.27 1qrk h LYS 462 CO 0.01 0.02 -0.32 -1.17 -1.08 0.00 0.00 179.45 176.91 1qrk s LEU 463 N -10.61 0.22 -0.13 2.94 0.20 -1.26 -5.03 118.68 105.00 1qrk s LEU 463 Ca -0.14 0.79 0.02 0.00 0.69 0.00 0.00 54.13 55.49 1qrk s LEU 463 Cb 0.15 1.23 0.01 0.00 -0.43 0.00 0.00 46.19 47.15 1qrk s LEU 463 CO 0.71 -0.17 -0.21 -0.63 -0.29 0.00 0.00 176.35 175.77 1qrk s ILE 464 N 0.95 1.94 0.04 6.68 1.01 -1.26 -0.67 121.20 129.88 1qrk s ILE 464 Ca -0.06 -0.91 -0.00 0.00 0.00 0.00 0.00 60.65 59.68 1qrk s ILE 464 Cb -0.07 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 1qrk s ILE 464 CO -0.07 0.53 -0.03 0.54 0.00 0.00 0.00 174.94 175.90 1qrk s VAL 465 N 0.83 0.22 0.15 2.92 0.11 -0.90 -1.48 120.40 122.26 1qrk s VAL 465 Ca -0.07 -1.43 -0.07 0.00 -2.93 0.00 0.00 61.98 57.48 1qrk s VAL 465 Cb -0.15 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.68 1qrk s VAL 465 CO -0.02 -0.77 0.21 0.28 -3.33 0.00 0.00 175.10 171.48 1qrk s THR 466 N -2.82 0.08 0.54 5.04 -1.32 -0.24 -1.44 115.64 115.48 1qrk s THR 466 Ca -0.02 -1.52 -0.19 0.00 -1.21 0.00 0.00 61.69 58.75 1qrk s THR 466 Cb -0.00 -1.85 -0.06 0.00 -1.51 0.00 0.00 72.50 69.08 1qrk s THR 466 CO -0.06 -0.38 1.09 -0.75 -2.21 0.00 0.00 174.62 172.31 1qrk s LYS 467 N -3.98 3.43 0.65 7.08 2.20 -1.26 0.11 119.74 127.97 1qrk s LYS 467 Ca 0.18 1.47 -0.09 0.00 -0.36 0.00 0.00 55.97 57.17 1qrk s LYS 467 Cb 0.05 -2.03 0.01 0.00 -1.51 0.00 0.00 37.83 34.35 1qrk s LYS 467 CO -0.01 -0.76 1.00 1.14 -0.36 0.00 0.00 175.35 176.37 1qrk s GLN 468 N -3.43 2.92 0.01 4.03 -2.07 0.33 -4.64 119.66 116.82 1qrk s GLN 468 Ca 0.70 0.26 -0.25 0.00 -1.82 0.00 0.00 55.36 54.24 1qrk s GLN 468 Cb -0.20 -2.14 -0.19 0.00 -1.09 0.00 0.00 33.01 29.39 1qrk s GLN 468 CO 0.27 -0.86 1.41 0.82 -1.32 0.00 0.00 175.29 175.61 1qrk h ILE 469 N -0.42 1.24 0.00 3.63 2.04 -1.96 -3.36 117.51 118.68 1qrk h ILE 469 Ca -0.45 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 64.64 1qrk h ILE 469 Cb 1.25 1.75 0.00 0.00 -0.74 0.00 0.00 36.82 39.08 1qrk h ILE 469 CO 0.62 0.20 0.00 0.61 0.00 0.00 0.00 178.15 179.58 1qrk n GLY 470 N -0.20 -2.82 0.00 5.37 0.00 -1.26 -4.89 105.19 101.38 1qrk n GLY 470 Ca -0.08 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1qrk n GLY 470 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qrk n GLY 471 N -0.73 5.40 0.41 -0.02 0.00 -1.26 -5.04 105.19 103.96 1qrk n GLY 471 Ca 0.00 -1.31 0.02 0.00 0.00 0.00 0.00 46.02 44.73 1qrk n GLY 471 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qrk n ASP 472 N 0.00 1.13 -4.01 1.61 8.00 -1.26 -3.66 116.55 118.36 1qrk n ASP 472 Ca 0.00 -2.04 -0.30 0.00 0.71 0.00 0.00 54.79 53.16 1qrk n ASP 472 Cb 0.00 -0.20 0.20 0.00 -0.02 0.00 0.00 41.12 41.10 1qrk n ASP 472 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1qrk s GLY 473 N -0.82 1.81 0.23 0.44 0.00 -1.26 -4.80 107.32 102.93 1qrk s GLY 473 Ca 0.11 -1.29 0.07 0.00 0.00 0.00 0.00 44.72 43.61 1qrk s GLY 473 CO 0.07 -0.48 0.15 -3.16 0.00 0.00 0.00 173.10 169.68 1qrk s MET 474 N -5.94 2.81 -0.15 2.90 0.23 -1.26 -0.51 119.30 117.38 1qrk s MET 474 Ca 0.76 -1.07 -0.01 0.00 -1.03 0.00 0.00 55.69 54.34 1qrk s MET 474 Cb -0.03 -2.52 0.04 0.00 -1.53 0.00 0.00 34.83 30.80 1qrk s MET 474 CO 0.54 0.42 -0.02 1.41 -2.03 0.00 0.00 175.02 175.34 1qrk s MET 475 N -3.62 1.01 -0.34 3.16 0.00 0.31 -4.70 119.30 115.12 1qrk s MET 475 Ca 0.32 -0.31 -0.29 0.00 0.00 0.00 0.00 55.69 55.41 1qrk s MET 475 Cb -0.08 -1.74 -0.01 0.00 0.00 0.00 0.00 34.83 33.00 1qrk s MET 475 CO 0.24 -0.45 1.52 0.34 0.00 0.00 0.00 175.02 176.67 1qrk s ASP 476 N 1.79 6.30 -0.09 1.11 -1.08 -1.26 -1.08 116.67 122.35 1qrk s ASP 476 Ca 0.02 1.15 0.13 0.00 -0.52 0.00 0.00 52.55 53.33 1qrk s ASP 476 Cb -0.15 -2.54 0.36 0.00 -1.46 0.00 0.00 42.92 39.13 1qrk s ASP 476 CO -0.07 -1.40 1.28 2.30 0.52 0.00 0.00 175.17 177.79 1qrk n ILE 477 N 6.89 1.67 -0.12 4.11 -5.35 -0.55 -4.70 119.36 121.31 1qrk n ILE 477 Ca 0.18 -1.56 0.22 0.00 -0.27 0.00 0.00 62.75 61.33 1qrk n ILE 477 Cb 0.47 0.07 0.66 0.00 -1.74 0.00 0.00 39.64 39.10 1qrk n ILE 477 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1qrk h THR 478 N 1.37 0.67 0.00 7.28 2.02 -1.82 -0.31 112.91 122.11 1qrk h THR 478 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1qrk h THR 478 Cb 1.04 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1qrk h THR 478 CO 0.09 0.02 0.00 -0.90 0.37 0.00 0.00 175.52 175.10 1qrk n ASP 479 N -4.37 0.00 0.08 4.18 5.75 -1.26 -1.72 116.55 119.22 1qrk n ASP 479 Ca 0.15 -0.60 0.07 0.00 -0.01 0.00 0.00 54.79 54.39 1qrk n ASP 479 Cb 0.74 -0.11 -0.02 0.00 -1.03 0.00 0.00 41.12 40.69 1qrk n ASP 479 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1qrk h THR 480 N 0.00 0.22 0.02 2.12 1.35 -1.42 -3.37 112.91 111.83 1qrk h THR 480 Ca 0.00 -1.43 -0.35 0.00 -0.55 0.00 0.00 66.41 64.08 1qrk h THR 480 Cb 0.11 1.76 -0.06 0.00 -1.73 0.00 0.00 68.15 68.23 1qrk h THR 480 CO 0.00 0.13 -2.16 -1.22 -0.25 0.00 0.00 175.52 172.02 1qrk n TYR 481 N -2.80 0.44 -3.72 4.73 4.02 -1.05 -4.43 117.16 114.35 1qrk n TYR 481 Ca -0.03 0.14 -0.10 0.00 -0.01 0.00 0.00 57.90 57.89 1qrk n TYR 481 Cb 0.67 -1.07 -0.06 0.00 -0.02 0.00 0.00 39.34 38.86 1qrk n TYR 481 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 176.86 174.26 1qrk s LYS 482 N -2.53 0.96 0.71 -0.72 -2.85 -0.70 -3.57 119.74 111.04 1qrk s LYS 482 Ca -0.14 -0.77 -0.11 0.00 -1.00 0.00 0.00 55.97 53.95 1qrk s LYS 482 Cb 0.07 0.41 0.16 0.00 -2.06 0.00 0.00 37.83 36.42 1qrk s LYS 482 CO 0.78 -0.35 0.97 1.19 0.10 0.00 0.00 175.35 178.04 1qrk n PHE 483 N -0.08 -3.87 -2.63 1.78 3.72 -1.26 -4.17 117.46 110.95 1qrk n PHE 483 Ca -0.16 -0.95 -0.37 0.00 -0.05 0.00 0.00 57.45 55.92 1qrk n PHE 483 Cb 0.63 -0.74 -0.05 0.00 -0.94 0.00 0.00 39.48 38.38 1qrk n PHE 483 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1qrk s GLN 484 N -5.08 4.37 0.26 -1.08 1.11 -1.26 -4.91 119.66 113.06 1qrk s GLN 484 Ca 0.56 1.46 -0.30 0.00 0.01 0.00 0.00 55.36 57.08 1qrk s GLN 484 Cb -0.02 -2.68 -0.10 0.00 -1.01 0.00 0.00 33.01 29.20 1qrk s GLN 484 CO 0.39 0.05 1.47 -2.00 0.01 0.00 0.00 175.29 175.21 1qrk s GLU 485 N -2.26 4.24 0.00 2.91 2.56 -1.26 -3.07 118.70 121.82 1qrk s GLU 485 Ca 0.54 2.35 0.00 0.00 0.00 0.00 0.00 54.97 57.86 1qrk s GLU 485 Cb -0.21 -3.09 0.00 0.00 2.00 0.00 0.00 34.13 32.83 1qrk s GLU 485 CO 0.27 -0.46 0.00 0.41 -0.56 0.00 0.00 175.26 174.92 1qrk n GLY 486 N 2.17 2.18 2.08 -1.50 0.00 -1.26 -5.06 105.19 103.79 1qrk n GLY 486 Ca 0.07 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 45.15 1qrk n GLY 486 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1qrk n GLN 487 N 0.00 0.00 -0.29 1.61 1.13 -1.17 -4.53 117.38 114.12 1qrk n GLN 487 Ca 0.00 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.18 1qrk n GLN 487 Cb 0.00 -0.62 0.27 0.00 0.11 0.00 0.00 30.24 30.00 1qrk n GLN 487 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 1qrk h GLU 488 N 0.38 0.18 -0.48 -1.09 4.39 -1.97 -0.65 114.58 115.33 1qrk h GLU 488 Ca -0.21 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.47 1qrk h GLU 488 Cb 0.90 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.48 1qrk h GLU 488 CO 0.32 0.12 0.23 1.05 -1.16 0.00 0.00 179.01 179.57 1qrk h GLU 489 N 0.19 0.67 -0.34 2.33 9.09 -1.92 0.28 114.58 124.88 1qrk h GLU 489 Ca 0.53 -0.08 -0.15 0.00 0.05 0.00 0.00 59.36 59.72 1qrk h GLU 489 Cb 1.06 -0.13 -0.01 0.00 -1.65 0.00 0.00 28.75 28.02 1qrk h GLU 489 CO -0.67 0.52 -0.38 1.05 0.05 0.00 0.00 179.01 179.59 1qrk h GLU 490 N 0.67 0.80 0.03 1.06 -0.00 -1.37 -1.23 114.58 114.54 1qrk h GLU 490 Ca 0.17 -0.41 -0.00 0.00 -0.00 0.00 0.00 59.36 59.12 1qrk h GLU 490 Cb 0.07 0.01 0.00 0.00 -0.00 0.00 0.00 28.75 28.83 1qrk h GLU 490 CO -0.02 1.04 -0.01 -0.09 -0.00 0.00 0.00 179.01 179.92 1qrk h ARG 491 N 0.66 -0.04 -0.76 1.06 2.43 -0.84 -2.12 114.38 114.77 1qrk h ARG 491 Ca 0.06 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1qrk h ARG 491 Cb 0.93 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.46 1qrk h ARG 491 CO 0.09 0.24 0.48 1.25 -1.51 0.00 0.00 179.97 180.51 1qrk h LEU 492 N -0.31 0.90 -0.57 3.80 6.46 -0.47 -2.01 115.31 123.10 1qrk h LEU 492 Ca -0.00 -0.05 0.09 0.00 -0.12 0.00 0.00 57.88 57.80 1qrk h LEU 492 Cb 0.29 -0.23 -0.07 0.00 -0.73 0.00 0.00 40.66 39.92 1qrk h LEU 492 CO 0.01 0.68 0.17 0.00 -0.62 0.00 0.00 178.44 178.68 1qrk h ALA 493 N 1.26 0.70 -0.77 1.25 0.00 -1.12 0.14 119.26 120.72 1qrk h ALA 493 Ca 0.28 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.26 1qrk h ALA 493 Cb -0.07 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1qrk h ALA 493 CO -0.06 -0.25 0.38 1.25 0.00 0.00 0.00 179.25 180.58 1qrk h LEU 494 N 0.33 0.99 -0.27 0.00 5.85 -0.69 -1.75 115.31 119.79 1qrk h LEU 494 Ca 0.29 -0.11 -0.13 0.00 0.84 0.00 0.00 57.88 58.77 1qrk h LEU 494 Cb 0.38 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1qrk h LEU 494 CO -0.33 0.83 -0.33 -0.33 -0.34 0.00 0.00 178.44 177.95 1qrk h GLU 495 N 1.09 0.70 -0.41 1.25 4.39 -0.60 -1.85 114.58 119.15 1qrk h GLU 495 Ca 0.27 -0.39 0.05 0.00 0.34 0.00 0.00 59.36 59.63 1qrk h GLU 495 Cb 0.10 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 1qrk h GLU 495 CO -0.04 1.01 0.28 1.15 -1.16 0.00 0.00 179.01 180.25 1qrk h THR 496 N 0.43 0.98 0.04 1.13 2.02 -0.50 -2.57 112.91 114.44 1qrk h THR 496 Ca 0.03 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 67.09 1qrk h THR 496 Cb 0.91 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1qrk h THR 496 CO 0.08 0.06 -0.02 0.00 0.37 0.00 0.00 175.52 176.01 1qrk h ALA 497 N 1.77 -0.05 -0.93 6.16 0.00 -1.05 -3.29 119.26 121.86 1qrk h ALA 497 Ca 0.18 -0.33 0.27 0.00 0.00 0.00 0.00 54.91 55.03 1qrk h ALA 497 Cb 0.25 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1qrk h ALA 497 CO -0.04 -0.16 0.69 -0.07 0.00 0.00 0.00 179.25 179.67 1qrk h LEU 498 N -0.80 0.00 -0.08 0.00 4.07 -1.02 0.10 115.31 117.58 1qrk h LEU 498 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1qrk h LEU 498 Cb 0.67 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.41 1qrk h LEU 498 CO 0.01 0.00 -0.42 1.15 -1.08 0.00 0.00 178.44 178.10 1qrk n MET 499 N -4.20 0.15 -0.94 1.13 0.00 -1.00 -4.03 117.12 108.24 1qrk n MET 499 Ca 0.19 -0.08 0.02 0.00 0.00 0.00 0.00 57.70 57.83 1qrk n MET 499 Cb 1.01 -1.50 0.16 0.00 0.00 0.00 0.00 33.22 32.89 1qrk n MET 499 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1qrk n TYR 500 N -1.35 0.32 0.00 3.17 4.01 0.32 -5.00 117.16 118.63 1qrk n TYR 500 Ca 0.07 -1.44 0.00 0.00 -0.16 0.00 0.00 57.90 56.37 1qrk n TYR 500 Cb 0.34 -0.24 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 1qrk n TYR 500 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1qrk n GLY 501 N -0.82 3.33 3.62 2.72 0.00 -1.03 -4.39 105.19 108.62 1qrk n GLY 501 Ca 0.19 -0.62 -0.53 0.00 0.00 0.00 0.00 46.02 45.06 1qrk n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qrk n ALA 502 N 0.00 -0.79 -2.90 4.61 0.00 -1.00 -4.94 120.51 115.48 1qrk n ALA 502 Ca 0.00 0.49 -0.29 0.00 0.00 0.00 0.00 53.44 53.63 1qrk n ALA 502 Cb 0.00 -2.11 -0.04 0.00 0.00 0.00 0.00 19.45 17.30 1qrk n ALA 502 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1qrk s LYS 503 N 1.25 3.34 -0.47 0.00 1.02 -0.43 -4.30 119.74 120.15 1qrk s LYS 503 Ca 0.88 -0.53 0.06 0.00 0.02 0.00 0.00 55.97 56.40 1qrk s LYS 503 Cb -0.98 -2.96 0.24 0.00 -0.52 0.00 0.00 37.83 33.60 1qrk s LYS 503 CO 0.52 0.58 0.80 1.17 -0.92 0.00 0.00 175.35 177.49 1qrk n LYS 504 N 0.06 0.74 0.00 1.68 4.81 -1.26 -0.69 118.16 123.50 1qrk n LYS 504 Ca -0.06 -2.07 0.00 0.00 -0.87 0.00 0.00 58.31 55.31 1qrk n LYS 504 Cb 0.52 -1.42 0.00 0.00 0.02 0.00 0.00 35.03 34.15 1qrk n LYS 504 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1qrk n PRO 505 N 1.70 0.00 -0.70 1.64 -0.04 -1.26 -4.78 135.00 131.55 1qrk n PRO 505 Ca 0.12 0.22 -0.32 0.00 -0.04 0.00 0.00 63.50 63.48 1qrk n PRO 505 Cb 0.60 -0.82 0.16 0.00 -0.04 0.00 0.00 33.50 33.40 1qrk n PRO 505 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1qrk n LEU 506 N -0.54 -0.96 0.00 1.53 4.32 -1.26 -5.22 117.00 114.87 1qrk n LEU 506 Ca 0.00 0.10 0.00 0.00 -0.02 0.00 0.00 56.01 56.09 1qrk n LEU 506 Cb 0.00 -1.13 0.00 0.00 -1.62 0.00 0.00 43.42 40.67 1qrk n LEU 506 CO 0.00 -3.28 0.00 -3.20 -1.22 0.00 0.00 177.39 169.69 1qrk n ASN 507 N -2.03 0.00 -0.43 -1.43 5.15 -1.26 -5.13 115.26 110.13 1qrk n ASN 507 Ca 0.04 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 54.01 1qrk n ASN 507 Cb 0.57 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.81 1qrk n ASN 507 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1qrk n SER 516 N 0.00 -0.10 -3.98 1.20 7.64 -1.26 -5.64 113.62 111.48 1qrk n SER 516 Ca 0.00 -0.83 -0.39 0.00 1.01 0.00 0.00 58.87 58.66 1qrk n SER 516 Cb 0.00 0.03 0.01 0.00 -1.01 0.00 0.00 64.21 63.24 1qrk n SER 516 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1qrk n ASN 517 N 0.00 -3.63 -3.47 6.43 4.13 -1.26 -4.77 115.26 112.69 1qrk n ASN 517 Ca -0.03 -1.19 -0.28 0.00 1.68 0.00 0.00 54.58 54.76 1qrk n ASN 517 Cb 0.39 -2.29 -0.11 0.00 -1.54 0.00 0.00 39.78 36.23 1qrk n ASN 517 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1qrk s VAL 518 N -3.64 0.46 0.93 2.41 1.01 -1.26 -1.95 120.40 118.37 1qrk s VAL 518 Ca 0.40 -2.35 -0.12 0.00 0.00 0.00 0.00 61.98 59.90 1qrk s VAL 518 Cb -0.19 -1.33 0.15 0.00 0.00 0.00 0.00 36.38 35.00 1qrk s VAL 518 CO 0.94 -1.10 1.10 -1.81 0.00 0.00 0.00 175.10 174.22 1qrk s ASP 519 N 0.41 3.22 0.14 3.32 1.01 -1.08 -4.88 116.67 118.80 1qrk s ASP 519 Ca 0.26 1.30 -0.18 0.00 0.71 0.00 0.00 52.55 54.63 1qrk s ASP 519 Cb -0.09 -1.97 0.05 0.00 1.01 0.00 0.00 42.92 41.91 1qrk s ASP 519 CO -0.10 -2.77 0.47 0.00 0.21 0.00 0.00 175.17 172.98 1qrk s MET 520 N -5.00 1.15 0.00 8.23 0.23 -1.26 -2.76 119.30 119.89 1qrk s MET 520 Ca 0.64 -0.64 0.00 0.00 -1.03 0.00 0.00 55.69 54.66 1qrk s MET 520 Cb -0.18 0.51 0.00 0.00 -1.53 0.00 0.00 34.83 33.63 1qrk s MET 520 CO 0.57 -0.47 0.00 -3.47 -2.03 0.00 0.00 175.02 169.61 1qrk n ASP 521 N -0.28 0.00 -3.99 -1.18 2.03 -0.79 -5.01 116.55 107.33 1qrk n ASP 521 Ca -0.16 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.03 1qrk n ASP 521 Cb 0.64 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.92 1qrk n ASP 521 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1qrk s PHE 522 N -2.00 0.42 -0.01 -0.67 -0.71 -1.26 0.32 117.98 114.06 1qrk s PHE 522 Ca 0.00 -0.34 0.08 0.00 -1.04 0.00 0.00 56.93 55.63 1qrk s PHE 522 Cb 0.00 -0.27 -0.02 0.00 -1.21 0.00 0.00 43.02 41.52 1qrk s PHE 522 CO 0.00 -0.08 -0.26 -1.83 -1.34 0.00 0.00 175.22 171.71 1qrk s GLU 523 N -0.98 2.04 -0.12 1.99 -1.05 -0.96 -4.94 118.70 114.68 1qrk s GLU 523 Ca -0.07 -0.93 -0.06 0.00 -0.15 0.00 0.00 54.97 53.76 1qrk s GLU 523 Cb -0.07 -2.00 -0.04 0.00 -0.44 0.00 0.00 34.13 31.59 1qrk s GLU 523 CO -0.00 0.55 0.10 0.08 0.95 0.00 0.00 175.26 176.93 1qrk s VAL 524 N -0.62 5.16 -0.53 1.83 1.01 -1.26 -1.49 120.40 124.50 1qrk s VAL 524 Ca 0.10 0.08 -0.18 0.00 0.00 0.00 0.00 61.98 61.98 1qrk s VAL 524 Cb -0.10 -3.24 0.08 0.00 0.00 0.00 0.00 36.38 33.13 1qrk s VAL 524 CO -0.01 0.60 0.58 -1.83 0.00 0.00 0.00 175.10 174.44 1qrk s GLU 525 N -0.88 3.05 0.02 2.72 -1.05 -0.76 -5.01 118.70 116.78 1qrk s GLU 525 Ca 0.14 -1.24 -0.34 0.00 -0.15 0.00 0.00 54.97 53.38 1qrk s GLU 525 Cb -0.12 -4.18 -0.13 0.00 -0.44 0.00 0.00 34.13 29.26 1qrk s GLU 525 CO 0.03 -1.28 1.74 0.27 0.95 0.00 0.00 175.26 176.97 1qrk n ASN 526 N 5.86 3.26 -5.01 0.83 6.94 -1.26 -4.30 115.26 121.57 1qrk n ASN 526 Ca -0.10 1.02 -0.18 0.00 -0.02 0.00 0.00 54.58 55.30 1qrk n ASN 526 Cb 0.43 -1.39 0.03 0.00 -2.36 0.00 0.00 39.78 36.49 1qrk n ASN 526 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1qrk s ALA 527 N 2.70 4.56 0.16 -2.53 0.00 -1.26 -4.96 121.76 120.42 1qrk s ALA 527 Ca 0.87 -1.81 -0.05 0.00 0.00 0.00 0.00 51.96 50.97 1qrk s ALA 527 Cb -0.70 -1.60 -0.06 0.00 0.00 0.00 0.00 23.12 20.77 1qrk s ALA 527 CO 0.46 -0.49 0.39 0.08 0.00 0.00 0.00 175.76 176.20 1qrk s VAL 528 N -2.47 5.15 -0.12 0.00 1.01 -1.26 -1.69 120.40 121.01 1qrk s VAL 528 Ca 0.57 0.05 -0.35 0.00 0.00 0.00 0.00 61.98 62.25 1qrk s VAL 528 Cb -0.09 -3.63 -0.12 0.00 0.00 0.00 0.00 36.38 32.54 1qrk s VAL 528 CO 0.35 0.01 1.85 -0.11 0.00 0.00 0.00 175.10 177.21 1qrk n LEU 529 N 0.01 3.25 0.00 3.92 -0.00 0.15 -1.43 117.00 122.89 1qrk n LEU 529 Ca -0.02 0.99 0.00 0.00 -0.00 0.00 0.00 56.01 56.98 1qrk n LEU 529 Cb 0.52 -1.33 0.00 0.00 -0.00 0.00 0.00 43.42 42.61 1qrk n LEU 529 CO 0.48 -0.13 0.00 0.61 -0.00 0.00 0.00 177.39 178.36 1qrk n GLY 530 N 4.35 0.54 3.71 -3.96 0.00 -1.26 -5.00 105.19 103.57 1qrk n GLY 530 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 1qrk n GLY 530 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qrk s LYS 531 N -0.90 2.57 0.61 1.61 -0.14 -0.52 -4.82 119.74 118.16 1qrk s LYS 531 Ca 0.00 -1.10 -0.13 0.00 -1.36 0.00 0.00 55.97 53.38 1qrk s LYS 531 Cb 0.00 -2.42 -0.03 0.00 -1.68 0.00 0.00 37.83 33.70 1qrk s LYS 531 CO 0.00 0.44 1.04 -0.51 -0.76 0.00 0.00 175.35 175.56 1qrk s ASP 532 N -3.23 5.91 0.32 2.83 1.11 -1.26 -4.11 116.67 118.25 1qrk s ASP 532 Ca 0.30 1.63 -0.12 0.00 0.18 0.00 0.00 52.55 54.54 1qrk s ASP 532 Cb -0.09 -2.50 0.02 0.00 1.07 0.00 0.00 42.92 41.42 1qrk s ASP 532 CO 0.21 -1.08 0.60 0.72 1.18 0.00 0.00 175.17 176.80 1qrk s PHE 533 N -2.81 0.42 0.11 4.23 -0.71 0.34 -4.90 117.98 114.66 1qrk s PHE 533 Ca 0.59 -0.85 0.10 0.00 -1.04 0.00 0.00 56.93 55.73 1qrk s PHE 533 Cb -0.13 0.37 -0.04 0.00 -1.21 0.00 0.00 43.02 42.01 1qrk s PHE 533 CO 0.45 -1.24 -0.24 0.15 -1.34 0.00 0.00 175.22 172.99 1qrk s LYS 534 N -3.22 1.31 -0.15 1.99 1.02 -1.26 0.46 119.74 119.89 1qrk s LYS 534 Ca 0.21 -1.24 0.02 0.00 0.02 0.00 0.00 55.97 54.98 1qrk s LYS 534 Cb -0.03 -1.69 0.01 0.00 -0.52 0.00 0.00 37.83 35.61 1qrk s LYS 534 CO 0.13 0.40 -0.20 -1.17 -0.92 0.00 0.00 175.35 173.59 1qrk s LEU 535 N -1.91 2.21 -0.42 3.17 0.20 0.21 -1.83 118.68 120.31 1qrk s LEU 535 Ca 0.11 -0.57 0.03 0.00 0.69 0.00 0.00 54.13 54.39 1qrk s LEU 535 Cb -0.10 -1.48 0.11 0.00 -0.43 0.00 0.00 46.19 44.29 1qrk s LEU 535 CO 0.05 0.07 0.16 -0.44 -0.29 0.00 0.00 176.35 175.90 1qrk s SER 536 N 0.87 4.66 0.11 3.68 0.01 -0.56 -0.06 113.70 122.42 1qrk s SER 536 Ca -0.05 -2.50 -0.25 0.00 1.31 0.00 0.00 55.95 54.46 1qrk s SER 536 Cb -0.15 -1.66 -0.07 0.00 0.21 0.00 0.00 66.02 64.35 1qrk s SER 536 CO -0.03 -0.34 0.77 -0.63 0.41 0.00 0.00 173.24 173.42 1qrk s ILE 537 N 0.44 4.52 -0.06 1.44 1.01 0.15 -2.26 121.20 126.45 1qrk s ILE 537 Ca 0.13 1.66 0.01 0.00 0.00 0.00 0.00 60.65 62.45 1qrk s ILE 537 Cb -0.22 -4.12 0.02 0.00 0.01 0.00 0.00 42.46 38.15 1qrk s ILE 537 CO -0.05 0.46 -0.06 0.42 0.00 0.00 0.00 174.94 175.71 1qrk s THR 538 N -0.71 0.71 0.13 2.92 -4.23 0.15 0.23 115.64 114.84 1qrk s THR 538 Ca 0.37 -0.21 0.02 0.00 -1.18 0.00 0.00 61.69 60.69 1qrk s THR 538 Cb -0.22 -0.71 0.02 0.00 1.34 0.00 0.00 72.50 72.93 1qrk s THR 538 CO 0.25 0.27 0.18 0.49 -0.54 0.00 0.00 174.62 175.27 1qrk n PHE 539 N 4.11 -2.80 -3.65 3.99 3.01 0.23 -1.89 117.46 120.46 1qrk n PHE 539 Ca -0.22 -0.49 -0.01 0.00 1.01 0.00 0.00 57.45 57.73 1qrk n PHE 539 Cb 0.51 -0.13 -0.07 0.00 -0.01 0.00 0.00 39.48 39.79 1qrk n PHE 539 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1qrk s ARG 540 N -2.61 0.10 -0.28 -1.08 3.52 -1.11 -2.85 118.95 114.62 1qrk s ARG 540 Ca 0.14 0.14 -0.00 0.00 -0.13 0.00 0.00 55.73 55.88 1qrk s ARG 540 Cb -0.01 0.04 0.05 0.00 -1.56 0.00 0.00 34.95 33.47 1qrk s ARG 540 CO 0.09 -0.02 -0.04 1.21 -0.81 0.00 0.00 175.30 175.73 1qrk s ASN 541 N 0.52 4.72 -0.08 -2.12 3.84 -1.25 -2.64 114.94 117.93 1qrk s ASN 541 Ca -0.00 -1.29 -0.23 0.00 0.21 0.00 0.00 52.86 51.54 1qrk s ASN 541 Cb -0.04 -1.66 -0.19 0.00 -0.55 0.00 0.00 41.25 38.81 1qrk s ASN 541 CO -0.13 -0.23 0.86 -1.13 -2.79 0.00 0.00 177.10 173.68 1qrk h ASN 542 N 7.93 -0.06 -2.79 -4.21 -0.00 -1.72 -0.76 115.58 113.96 1qrk h ASN 542 Ca -0.21 -0.59 -0.44 0.00 -0.00 0.00 0.00 56.30 55.06 1qrk h ASN 542 Cb 1.06 0.02 0.23 0.00 -0.00 0.00 0.00 38.32 39.62 1qrk h ASN 542 CO 0.51 0.63 -0.45 -1.54 -0.00 0.00 0.00 177.43 176.58 1qrk n SER 543 N -4.78 -2.11 -2.88 1.15 3.41 -1.25 -3.45 113.62 103.70 1qrk n SER 543 Ca -0.08 -0.19 -0.39 0.00 -0.26 0.00 0.00 58.87 57.96 1qrk n SER 543 Cb 0.32 -1.13 0.03 0.00 -0.26 0.00 0.00 64.21 63.17 1qrk n SER 543 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1qrk n HIS 544 N -4.83 2.82 -4.63 7.33 8.25 -1.26 -1.22 115.22 121.67 1qrk n HIS 544 Ca 0.01 -2.28 -0.24 0.00 -0.26 0.00 0.00 57.72 54.96 1qrk n HIS 544 Cb 0.57 -1.21 -0.14 0.00 1.12 0.00 0.00 29.99 30.33 1qrk n HIS 544 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1qrk s ASN 545 N -0.92 2.07 -0.58 0.41 0.01 -1.26 -4.83 114.94 109.84 1qrk s ASN 545 Ca 0.53 -0.42 -0.23 0.00 -0.71 0.00 0.00 52.86 52.03 1qrk s ASN 545 Cb 0.43 -0.19 0.05 0.00 0.41 0.00 0.00 41.25 41.96 1qrk s ASN 545 CO -0.39 0.15 0.89 -0.60 -1.51 0.00 0.00 177.10 175.63 1qrk s ARG 546 N -0.85 3.22 0.64 -0.60 3.52 -1.26 -3.65 118.95 119.97 1qrk s ARG 546 Ca 0.06 -0.57 0.01 0.00 -0.13 0.00 0.00 55.73 55.09 1qrk s ARG 546 Cb -0.08 -4.12 0.09 0.00 -1.56 0.00 0.00 34.95 29.28 1qrk s ARG 546 CO 0.01 -1.54 0.89 0.71 -0.81 0.00 0.00 175.30 174.55 1qrk s TYR 547 N 3.72 2.07 -0.06 5.12 2.02 -1.04 -4.93 117.35 124.26 1qrk s TYR 547 Ca 0.25 -0.21 -0.02 0.00 -0.37 0.00 0.00 57.07 56.71 1qrk s TYR 547 Cb -0.15 -2.83 0.04 0.00 -0.40 0.00 0.00 41.96 38.62 1qrk s TYR 547 CO 0.15 -1.34 0.12 0.99 -1.57 0.00 0.00 175.55 173.90 1qrk s THR 548 N -2.95 -0.16 0.16 -0.71 2.01 -1.26 -2.01 115.64 110.72 1qrk s THR 548 Ca 0.62 0.33 0.08 0.00 0.31 0.00 0.00 61.69 63.04 1qrk s THR 548 Cb -0.07 -0.22 -0.04 0.00 0.01 0.00 0.00 72.50 72.17 1qrk s THR 548 CO 0.42 0.14 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.77 1qrk s ILE 549 N 1.92 3.29 -0.34 1.82 1.01 0.74 -2.82 121.20 126.80 1qrk s ILE 549 Ca -0.00 -1.55 -0.01 0.00 0.00 0.00 0.00 60.65 59.09 1qrk s ILE 549 Cb -0.12 -2.61 0.12 0.00 0.01 0.00 0.00 42.46 39.86 1qrk s ILE 549 CO -0.05 -0.07 0.18 -0.89 0.00 0.00 0.00 174.94 174.11 1qrk s THR 550 N -1.61 0.40 0.37 2.92 2.01 0.45 -0.80 115.64 119.38 1qrk s THR 550 Ca 0.24 -1.55 -0.09 0.00 0.31 0.00 0.00 61.69 60.60 1qrk s THR 550 Cb -0.09 -1.31 -0.06 0.00 0.01 0.00 0.00 72.50 71.05 1qrk s THR 550 CO 0.15 -0.86 0.70 0.00 -0.69 0.00 0.00 174.62 173.93 1qrk s ALA 551 N 1.31 3.43 0.06 7.40 0.00 0.12 -0.57 121.76 133.52 1qrk s ALA 551 Ca 0.14 -0.31 0.06 0.00 0.00 0.00 0.00 51.96 51.85 1qrk s ALA 551 Cb -0.21 -2.58 -0.03 0.00 0.00 0.00 0.00 23.12 20.31 1qrk s ALA 551 CO -0.13 0.07 -0.15 0.71 0.00 0.00 0.00 175.76 176.26 1qrk s TYR 552 N -2.28 1.33 -0.08 0.00 2.02 0.58 -1.06 117.35 117.87 1qrk s TYR 552 Ca 0.49 -0.42 -0.03 0.00 -0.37 0.00 0.00 57.07 56.75 1qrk s TYR 552 Cb -0.10 -0.76 0.04 0.00 -0.40 0.00 0.00 41.96 40.74 1qrk s TYR 552 CO 0.31 0.07 0.06 -1.17 -1.57 0.00 0.00 175.55 173.25 1qrk s LEU 553 N -1.55 0.24 -0.13 -1.29 1.98 -0.00 -1.82 118.68 116.11 1qrk s LEU 553 Ca 0.01 -0.12 0.02 0.00 -2.89 0.00 0.00 54.13 51.15 1qrk s LEU 553 Cb -0.09 -0.19 0.01 0.00 0.66 0.00 0.00 46.19 46.58 1qrk s LEU 553 CO 0.02 -0.27 -0.19 -0.55 -1.89 0.00 0.00 176.35 173.47 1qrk s SER 554 N 2.14 2.84 -0.12 3.68 0.15 -0.21 -0.97 113.70 121.22 1qrk s SER 554 Ca 0.04 -0.53 0.02 0.00 0.70 0.00 0.00 55.95 56.18 1qrk s SER 554 Cb -0.13 -1.30 -0.00 0.00 -1.71 0.00 0.00 66.02 62.88 1qrk s SER 554 CO -0.05 0.05 -0.20 0.00 1.20 0.00 0.00 173.24 174.24 1qrk s ALA 555 N 0.92 2.32 0.01 5.45 0.00 -0.70 -0.01 121.76 129.75 1qrk s ALA 555 Ca -0.06 -1.00 0.05 0.00 0.00 0.00 0.00 51.96 50.96 1qrk s ALA 555 Cb -0.15 -0.99 -0.02 0.00 0.00 0.00 0.00 23.12 21.97 1qrk s ALA 555 CO -0.02 0.16 -0.16 -0.80 0.00 0.00 0.00 175.76 174.93 1qrk s ASN 556 N 0.52 1.95 -0.09 0.00 0.01 0.12 -1.64 114.94 115.81 1qrk s ASN 556 Ca -0.13 -0.38 -0.28 0.00 -0.71 0.00 0.00 52.86 51.36 1qrk s ASN 556 Cb -0.17 -0.18 -0.02 0.00 0.41 0.00 0.00 41.25 41.29 1qrk s ASN 556 CO 0.05 0.15 0.92 -0.63 -1.51 0.00 0.00 177.10 176.07 1qrk s ILE 557 N -0.59 4.86 0.29 0.60 1.09 0.90 -0.16 121.20 128.19 1qrk s ILE 557 Ca 0.05 1.87 0.02 0.00 -1.10 0.00 0.00 60.65 61.49 1qrk s ILE 557 Cb -0.07 -4.24 -0.06 0.00 -1.06 0.00 0.00 42.46 37.04 1qrk s ILE 557 CO 0.00 0.08 0.08 0.42 -0.10 0.00 0.00 174.94 175.43 1qrk s THR 558 N 1.62 0.86 0.58 2.92 -4.23 -1.11 -0.80 115.64 115.47 1qrk s THR 558 Ca 0.45 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.95 1qrk s THR 558 Cb -0.18 -2.71 0.03 0.00 1.34 0.00 0.00 72.50 70.98 1qrk s THR 558 CO 0.19 -0.00 0.84 -0.36 -0.54 0.00 0.00 174.62 174.75 1qrk s PHE 559 N -3.54 2.97 -0.36 3.99 0.08 0.05 -4.32 117.98 116.85 1qrk s PHE 559 Ca 0.37 0.22 0.24 0.00 0.12 0.00 0.00 56.93 57.88 1qrk s PHE 559 Cb 0.08 -2.80 1.08 0.00 -0.57 0.00 0.00 43.02 40.81 1qrk s PHE 559 CO 0.15 -0.93 1.73 0.10 -0.10 0.00 0.00 175.22 176.16 1qrk h TYR 560 N -0.09 0.00 0.00 0.36 -0.00 -1.89 -1.79 116.97 113.57 1qrk h TYR 560 Ca -0.44 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 58.26 1qrk h TYR 560 Cb 1.29 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 38.02 1qrk h TYR 560 CO 0.38 0.00 -0.14 1.79 -0.00 0.00 0.00 178.16 180.19 1qrk h THR 561 N 0.00 0.25 0.00 -0.90 1.35 -1.89 0.78 112.91 112.50 1qrk h THR 561 Ca 0.00 -1.33 0.00 0.00 -0.55 0.00 0.00 66.41 64.53 1qrk h THR 561 Cb 0.29 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.81 1qrk h THR 561 CO 0.00 0.14 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 1qrk n GLY 562 N 1.09 2.32 3.70 5.82 0.00 -0.67 -2.08 105.19 115.37 1qrk n GLY 562 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1qrk n GLY 562 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qrk s VAL 563 N -2.15 2.92 0.45 1.61 1.01 -1.26 -4.73 120.40 118.26 1qrk s VAL 563 Ca 0.00 0.51 -0.08 0.00 0.00 0.00 0.00 61.98 62.40 1qrk s VAL 563 Cb 0.00 -3.33 -0.05 0.00 0.00 0.00 0.00 36.38 33.00 1qrk s VAL 563 CO 0.00 0.01 0.80 -2.16 0.00 0.00 0.00 175.10 173.76 1qrk s PRO 564 N 2.04 3.67 -0.04 2.72 0.04 -1.26 -0.77 135.00 141.40 1qrk s PRO 564 Ca 0.72 0.39 0.00 0.00 0.04 0.00 0.00 61.00 62.15 1qrk s PRO 564 Cb -0.41 -2.36 -0.02 0.00 0.04 0.00 0.00 34.50 31.75 1qrk s PRO 564 CO 0.32 -0.15 -0.04 1.17 0.04 0.00 0.00 177.00 178.34 1qrk n LYS 565 N -1.81 0.10 -3.55 4.56 0.00 0.02 -4.92 118.16 112.56 1qrk n LYS 565 Ca 0.02 0.02 -0.08 0.00 0.00 0.00 0.00 58.31 58.27 1qrk n LYS 565 Cb 0.54 -1.04 -0.02 0.00 0.00 0.00 0.00 35.03 34.52 1qrk n LYS 565 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1qrk s ALA 566 N -2.08 -1.68 -0.39 3.14 0.00 -1.20 -4.99 121.76 114.56 1qrk s ALA 566 Ca -0.05 0.61 -0.06 0.00 0.00 0.00 0.00 51.96 52.46 1qrk s ALA 566 Cb 0.01 0.62 0.08 0.00 0.00 0.00 0.00 23.12 23.84 1qrk s ALA 566 CO 0.09 -0.80 0.18 -2.00 0.00 0.00 0.00 175.76 173.24 1qrk s GLU 567 N -3.39 2.38 0.26 0.00 2.12 -1.26 -0.07 118.70 118.74 1qrk s GLU 567 Ca 0.06 -1.52 0.20 0.00 0.36 0.00 0.00 54.97 54.07 1qrk s GLU 567 Cb -0.01 -3.59 0.09 0.00 0.26 0.00 0.00 34.13 30.88 1qrk s GLU 567 CO -0.07 -0.91 1.25 0.27 -0.54 0.00 0.00 175.26 175.26 1qrk h PHE 568 N 8.21 0.00 -2.95 5.30 -0.00 -1.63 -3.46 116.94 122.42 1qrk h PHE 568 Ca -0.19 0.00 -0.32 0.00 -0.00 0.00 0.00 57.97 57.46 1qrk h PHE 568 Cb 1.07 0.00 -0.36 0.00 -0.00 0.00 0.00 35.95 36.65 1qrk h PHE 568 CO 0.59 0.21 -0.65 0.21 -0.00 0.00 0.00 178.31 178.68 1qrk s LYS 569 N -3.16 0.07 -0.13 6.09 2.20 -1.22 -4.98 119.74 118.62 1qrk s LYS 569 Ca 0.02 0.41 0.00 0.00 -0.36 0.00 0.00 55.97 56.04 1qrk s LYS 569 Cb 0.08 -0.67 -0.01 0.00 -1.51 0.00 0.00 37.83 35.71 1qrk s LYS 569 CO 0.75 -0.43 -0.15 0.21 -0.36 0.00 0.00 175.35 175.37 1qrk s LYS 570 N 2.29 3.31 0.03 4.03 2.47 -1.26 -1.72 119.74 128.88 1qrk s LYS 570 Ca 0.04 -0.72 0.01 0.00 -1.56 0.00 0.00 55.97 53.74 1qrk s LYS 570 Cb -0.13 -2.59 -0.02 0.00 -1.46 0.00 0.00 37.83 33.62 1qrk s LYS 570 CO -0.08 0.16 -0.05 -2.00 0.16 0.00 0.00 175.35 173.55 1qrk s GLU 571 N 0.46 0.42 -0.14 4.03 2.56 -0.14 -5.01 118.70 120.88 1qrk s GLU 571 Ca -0.11 -0.69 -0.10 0.00 0.00 0.00 0.00 54.97 54.07 1qrk s GLU 571 Cb -0.16 -0.08 0.04 0.00 2.00 0.00 0.00 34.13 35.94 1qrk s GLU 571 CO 0.05 -0.00 0.35 -0.08 -0.56 0.00 0.00 175.26 175.01 1qrk s THR 572 N -1.48 -0.02 -0.15 -1.70 -1.32 -1.26 -0.82 115.64 108.89 1qrk s THR 572 Ca -0.13 0.06 -0.20 0.00 -1.21 0.00 0.00 61.69 60.22 1qrk s THR 572 Cb -0.10 -0.51 0.05 0.00 -1.51 0.00 0.00 72.50 70.44 1qrk s THR 572 CO -0.01 0.03 0.52 0.72 -2.21 0.00 0.00 174.62 173.67 1qrk s PHE 573 N 0.82 -0.53 -0.13 9.09 -0.12 -0.22 -5.01 117.98 121.88 1qrk s PHE 573 Ca -0.05 1.19 -0.07 0.00 -0.05 0.00 0.00 56.93 57.95 1qrk s PHE 573 Cb -0.06 0.21 -0.04 0.00 -0.63 0.00 0.00 43.02 42.50 1qrk s PHE 573 CO -0.06 -0.35 0.12 0.16 -0.05 0.00 0.00 175.22 175.05 1qrk s ASP 574 N -0.21 6.25 0.03 1.98 1.47 -1.26 0.15 116.67 125.08 1qrk s ASP 574 Ca -0.04 0.41 0.03 0.00 1.18 0.00 0.00 52.55 54.13 1qrk s ASP 574 Cb -0.03 -2.01 -0.02 0.00 -0.34 0.00 0.00 42.92 40.51 1qrk s ASP 574 CO 0.03 0.38 -0.08 -0.69 0.68 0.00 0.00 175.17 175.48 1qrk s VAL 575 N -0.86 0.63 -0.05 2.11 1.01 0.02 -4.97 120.40 118.30 1qrk s VAL 575 Ca 0.14 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1qrk s VAL 575 Cb -0.12 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 1qrk s VAL 575 CO 0.03 -0.14 -0.03 0.42 0.00 0.00 0.00 175.10 175.39 1qrk s THR 576 N -0.87 4.01 -0.11 3.92 -4.23 -1.26 -0.19 115.64 116.91 1qrk s THR 576 Ca -0.04 -0.47 0.03 0.00 -1.18 0.00 0.00 61.69 60.03 1qrk s THR 576 Cb -0.07 -2.70 -0.01 0.00 1.34 0.00 0.00 72.50 71.06 1qrk s THR 576 CO 0.00 0.52 -0.20 -0.76 -0.54 0.00 0.00 174.62 173.64 1qrk s LEU 577 N -1.09 2.30 0.58 4.79 1.02 -0.85 -4.99 118.68 120.43 1qrk s LEU 577 Ca 0.15 -0.48 -0.16 0.00 0.02 0.00 0.00 54.13 53.65 1qrk s LEU 577 Cb -0.11 -1.48 -0.04 0.00 0.02 0.00 0.00 46.19 44.58 1qrk s LEU 577 CO 0.05 0.16 1.06 -1.61 0.02 0.00 0.00 176.35 176.03 1qrk s GLU 578 N 0.33 3.35 0.15 1.70 8.01 -1.26 -2.48 118.70 128.50 1qrk s GLU 578 Ca -0.16 1.25 -0.31 0.00 0.01 0.00 0.00 54.97 55.75 1qrk s GLU 578 Cb -0.17 -2.04 -0.09 0.00 -4.31 0.00 0.00 34.13 27.52 1qrk s GLU 578 CO 0.08 -0.79 1.53 -2.14 0.01 0.00 0.00 175.26 173.96 1qrk s PRO 579 N -3.95 4.24 -0.99 0.39 0.02 -1.24 -2.97 135.00 130.50 1qrk s PRO 579 Ca 0.64 2.30 -0.06 0.00 0.02 0.00 0.00 61.00 63.91 1qrk s PRO 579 Cb -0.16 -3.20 -0.05 0.00 0.02 0.00 0.00 34.50 31.10 1qrk s PRO 579 CO 0.35 -0.58 0.86 1.28 -0.33 0.00 0.00 177.00 178.58 1qrk n LEU 580 N 4.07 -5.68 0.00 -5.54 4.77 -0.36 -4.91 117.00 109.35 1qrk n LEU 580 Ca 0.13 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 1qrk n LEU 580 Cb 0.39 -3.17 0.00 0.00 -2.33 0.00 0.00 43.42 38.32 1qrk n LEU 580 CO 0.61 -0.14 0.00 -1.54 -1.33 0.00 0.00 177.39 174.99 1qrk n SER 581 N -2.86 0.46 -3.64 -1.43 3.41 -0.45 -4.96 113.62 104.15 1qrk n SER 581 Ca -0.06 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.49 1qrk n SER 581 Cb 0.59 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.48 1qrk n SER 581 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1qrk s PHE 582 N 1.29 -0.22 -0.19 7.33 2.19 -1.26 -3.76 117.98 123.35 1qrk s PHE 582 Ca 0.00 0.50 -0.11 0.00 0.33 0.00 0.00 56.93 57.65 1qrk s PHE 582 Cb 0.00 0.44 0.06 0.00 -1.31 0.00 0.00 43.02 42.22 1qrk s PHE 582 CO 0.00 -0.13 0.47 0.21 1.83 0.00 0.00 175.22 177.60 1qrk s LYS 583 N -0.21 0.46 -0.29 10.12 2.47 -1.13 -4.94 119.74 126.21 1qrk s LYS 583 Ca 0.05 0.89 -0.01 0.00 -1.56 0.00 0.00 55.97 55.34 1qrk s LYS 583 Cb -0.04 0.01 0.05 0.00 -1.46 0.00 0.00 37.83 36.40 1qrk s LYS 583 CO -0.09 -0.16 -0.02 0.21 0.16 0.00 0.00 175.35 175.45 1qrk s LYS 584 N 1.46 2.40 -0.24 4.03 2.20 -1.26 0.75 119.74 129.08 1qrk s LYS 584 Ca -0.10 -1.28 -0.15 0.00 -0.36 0.00 0.00 55.97 54.09 1qrk s LYS 584 Cb -0.08 -3.13 -0.04 0.00 -1.51 0.00 0.00 37.83 33.08 1qrk s LYS 584 CO -0.14 -0.61 0.36 -1.21 -0.36 0.00 0.00 175.35 173.38 1qrk s GLU 585 N 1.23 4.09 0.00 4.03 0.41 0.61 -4.94 118.70 124.12 1qrk s GLU 585 Ca -0.06 0.07 0.01 0.00 -0.41 0.00 0.00 54.97 54.57 1qrk s GLU 585 Cb -0.20 -3.59 -0.04 0.00 -1.78 0.00 0.00 34.13 28.52 1qrk s GLU 585 CO -0.02 -0.14 0.05 0.00 -0.49 0.00 0.00 175.26 174.66 1qrk s ALA 586 N 1.64 3.46 -0.04 5.21 0.00 -1.26 0.32 121.76 131.09 1qrk s ALA 586 Ca 0.16 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.22 1qrk s ALA 586 Cb -0.15 -1.47 0.01 0.00 0.00 0.00 0.00 23.12 21.51 1qrk s ALA 586 CO 0.08 0.68 -0.08 0.08 0.00 0.00 0.00 175.76 176.52 1qrk s VAL 587 N -1.17 0.75 -0.34 0.00 1.01 0.91 -4.98 120.40 116.57 1qrk s VAL 587 Ca 0.22 -0.29 -0.11 0.00 0.00 0.00 0.00 61.98 61.80 1qrk s VAL 587 Cb -0.12 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.57 1qrk s VAL 587 CO 0.13 0.25 0.19 -0.22 0.00 0.00 0.00 175.10 175.45 1qrk s LEU 588 N 0.53 4.39 -0.29 3.92 1.98 -1.26 -0.62 118.68 127.34 1qrk s LEU 588 Ca -0.08 -0.68 -0.15 0.00 -2.89 0.00 0.00 54.13 50.33 1qrk s LEU 588 Cb -0.12 -2.03 -0.03 0.00 0.66 0.00 0.00 46.19 44.67 1qrk s LEU 588 CO 0.01 -0.27 0.38 -0.63 -1.89 0.00 0.00 176.35 173.95 1qrk s ILE 589 N 1.61 5.16 0.24 6.68 -1.09 0.17 -4.96 121.20 129.01 1qrk s ILE 589 Ca 0.04 0.49 -0.19 0.00 -2.23 0.00 0.00 60.65 58.75 1qrk s ILE 589 Cb -0.18 -3.74 -0.08 0.00 -1.58 0.00 0.00 42.46 36.88 1qrk s ILE 589 CO 0.07 0.09 0.73 -1.10 -1.23 0.00 0.00 174.94 173.51 1qrk s GLN 590 N 2.09 4.23 0.29 2.79 -0.21 -1.26 -0.50 119.66 127.09 1qrk s GLN 590 Ca 0.15 0.85 0.05 0.00 0.02 0.00 0.00 55.36 56.43 1qrk s GLN 590 Cb -0.16 -2.82 0.74 0.00 1.00 0.00 0.00 33.01 31.77 1qrk s GLN 590 CO 0.10 0.36 1.73 0.00 -2.12 0.00 0.00 175.29 175.36 1qrk h ALA 591 N 3.26 1.53 0.00 6.09 0.00 -1.88 0.77 119.26 129.03 1qrk h ALA 591 Ca -0.48 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 1qrk h ALA 591 Cb 1.19 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1qrk h ALA 591 CO 0.65 -0.24 -0.08 0.78 0.00 0.00 0.00 179.25 180.37 1qrk h GLY 592 N 0.54 0.00 1.99 0.00 0.00 -1.93 0.19 103.07 103.86 1qrk h GLY 592 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.90 1qrk h GLY 592 CO -0.47 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.25 1qrk n GLU 593 N -3.97 0.01 0.00 4.80 1.02 0.26 -4.03 120.64 118.73 1qrk n GLU 593 Ca -0.03 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 1qrk n GLU 593 Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1qrk n GLU 593 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 1qrk n TYR 594 N -1.49 0.00 -0.35 -0.32 0.18 -0.68 -4.81 117.16 109.69 1qrk n TYR 594 Ca 0.03 0.00 0.23 0.00 1.88 0.00 0.00 57.90 60.04 1qrk n TYR 594 Cb 0.15 0.00 0.48 0.00 -0.38 0.00 0.00 39.34 39.59 1qrk n TYR 594 CO 0.00 0.00 0.00 0.52 -2.08 0.00 0.00 176.86 175.30 1qrk h MET 595 N 0.00 0.39 0.00 -3.48 2.86 -0.79 -1.72 114.93 112.18 1qrk h MET 595 Ca 0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1qrk h MET 595 Cb 0.02 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.60 1qrk h MET 595 CO 0.00 0.26 0.00 0.41 1.06 0.00 0.00 176.91 178.64 1qrk n GLY 596 N -1.40 -1.03 2.74 8.32 0.00 -1.26 -3.97 105.19 108.59 1qrk n GLY 596 Ca 0.28 0.10 -0.04 0.00 0.00 0.00 0.00 46.02 46.36 1qrk n GLY 596 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qrk n GLN 597 N -2.09 1.42 -1.82 1.61 10.64 -0.65 -5.12 117.38 121.38 1qrk n GLN 597 Ca 0.01 -2.75 -0.30 0.00 -1.83 0.00 0.00 57.00 52.12 1qrk n GLN 597 Cb 0.13 -0.89 0.04 0.00 -0.86 0.00 0.00 30.24 28.67 1qrk n GLN 597 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1qrk s LEU 598 N -3.59 2.97 0.39 2.61 1.43 -1.24 -4.92 118.68 116.32 1qrk s LEU 598 Ca 0.23 1.26 0.07 0.00 -1.03 0.00 0.00 54.13 54.66 1qrk s LEU 598 Cb 0.40 -4.11 -0.08 0.00 0.03 0.00 0.00 46.19 42.43 1qrk s LEU 598 CO -0.04 -1.30 -0.00 -0.76 0.23 0.00 0.00 176.35 174.47 1qrk s LEU 599 N -5.38 2.79 0.55 1.79 1.43 -1.26 -5.04 118.68 113.56 1qrk s LEU 599 Ca 0.58 -1.34 -0.19 0.00 -1.03 0.00 0.00 54.13 52.15 1qrk s LEU 599 Cb -0.12 -0.87 -0.09 0.00 0.03 0.00 0.00 46.19 45.15 1qrk s LEU 599 CO 0.53 -0.42 0.59 -0.62 0.23 0.00 0.00 176.35 176.66 1qrk n GLU 600 N -0.91 0.59 -0.32 1.70 1.02 -1.26 -1.59 120.64 119.87 1qrk n GLU 600 Ca -0.05 0.23 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 1qrk n GLU 600 Cb 0.66 -1.74 0.00 0.00 -0.02 0.00 0.00 31.44 30.34 1qrk n GLU 600 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1qrk n GLN 601 N -0.07 0.00 -3.99 3.49 6.02 -1.26 -4.48 117.38 117.09 1qrk n GLN 601 Ca 0.12 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.69 1qrk n GLN 601 Cb 0.46 -2.69 0.02 0.00 1.02 0.00 0.00 30.24 29.05 1qrk n GLN 601 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1qrk n ALA 602 N 0.60 -2.64 -2.64 -1.58 0.00 -0.62 -4.37 120.51 109.26 1qrk n ALA 602 Ca 0.00 -0.50 -0.30 0.00 0.00 0.00 0.00 53.44 52.63 1qrk n ALA 602 Cb 0.00 -2.53 -0.09 0.00 0.00 0.00 0.00 19.45 16.83 1qrk n ALA 602 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1qrk s SER 603 N -3.44 4.80 0.05 0.00 1.04 -1.26 0.00 113.70 114.90 1qrk s SER 603 Ca 0.42 -0.22 0.06 0.00 0.48 0.00 0.00 55.95 56.70 1qrk s SER 603 Cb -0.22 -1.09 -0.02 0.00 0.10 0.00 0.00 66.02 64.78 1qrk s SER 603 CO 0.95 0.20 -0.18 -0.76 0.98 0.00 0.00 173.24 174.43 1qrk s LEU 604 N -2.10 2.18 -0.05 2.42 2.01 0.77 -2.76 118.68 121.16 1qrk s LEU 604 Ca 0.23 -0.51 0.06 0.00 0.01 0.00 0.00 54.13 53.92 1qrk s LEU 604 Cb -0.11 -0.79 -0.02 0.00 0.01 0.00 0.00 46.19 45.28 1qrk s LEU 604 CO 0.15 0.09 -0.23 -2.28 1.01 0.00 0.00 176.35 175.09 1qrk s HIS 605 N -0.86 2.45 -0.02 0.29 2.46 0.77 -1.48 115.29 118.90 1qrk s HIS 605 Ca 0.05 -0.54 0.06 0.00 0.47 0.00 0.00 55.06 55.10 1qrk s HIS 605 Cb -0.08 -1.58 -0.01 0.00 -0.13 0.00 0.00 32.58 30.77 1qrk s HIS 605 CO 0.02 -0.09 -0.22 -0.06 -2.47 0.00 0.00 174.74 171.92 1qrk s PHE 606 N -0.39 1.97 -0.15 3.88 0.08 -1.00 0.13 117.98 122.51 1qrk s PHE 606 Ca 0.03 -0.43 0.01 0.00 0.12 0.00 0.00 56.93 56.67 1qrk s PHE 606 Cb -0.12 -1.28 0.02 0.00 -0.57 0.00 0.00 43.02 41.07 1qrk s PHE 606 CO 0.02 -0.07 -0.17 -0.06 -0.10 0.00 0.00 175.22 174.83 1qrk s PHE 607 N -0.40 2.38 -0.21 0.36 0.08 0.99 -2.75 117.98 118.44 1qrk s PHE 607 Ca 0.05 -1.31 0.01 0.00 0.12 0.00 0.00 56.93 55.80 1qrk s PHE 607 Cb -0.09 -1.69 0.04 0.00 -0.57 0.00 0.00 43.02 40.71 1qrk s PHE 607 CO 0.00 -0.67 -0.14 0.08 -0.10 0.00 0.00 175.22 174.39 1qrk s VAL 608 N 1.27 1.92 0.03 -0.44 1.01 0.23 -1.04 120.40 123.39 1qrk s VAL 608 Ca 0.02 -1.15 0.06 0.00 0.00 0.00 0.00 61.98 60.90 1qrk s VAL 608 Cb -0.13 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 1qrk s VAL 608 CO -0.09 0.24 -0.17 0.42 0.00 0.00 0.00 175.10 175.50 1qrk s THR 609 N 1.28 1.33 0.03 3.92 -4.23 -0.76 0.31 115.64 117.53 1qrk s THR 609 Ca -0.01 -0.99 -0.05 0.00 -1.18 0.00 0.00 61.69 59.45 1qrk s THR 609 Cb -0.16 -1.17 -0.01 0.00 1.34 0.00 0.00 72.50 72.50 1qrk s THR 609 CO -0.09 0.15 0.08 0.00 -0.54 0.00 0.00 174.62 174.22 1qrk s ALA 610 N -0.72 -0.07 -0.13 3.99 0.00 -0.36 0.22 121.76 124.68 1qrk s ALA 610 Ca 0.05 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 51.54 1qrk s ALA 610 Cb -0.08 0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.25 1qrk s ALA 610 CO 0.01 -0.27 -0.21 0.50 0.00 0.00 0.00 175.76 175.78 1qrk s ARG 611 N -2.22 3.06 -0.98 0.00 3.52 0.27 -1.88 118.95 120.72 1qrk s ARG 611 Ca -0.08 -0.84 -0.01 0.00 -0.13 0.00 0.00 55.73 54.66 1qrk s ARG 611 Cb -0.04 -2.43 0.31 0.00 -1.56 0.00 0.00 34.95 31.23 1qrk s ARG 611 CO -0.03 0.04 1.45 -0.89 -0.81 0.00 0.00 175.30 175.07 1qrk n ILE 612 N 3.92 5.04 -0.15 4.11 5.41 -1.05 -0.41 119.36 136.23 1qrk n ILE 612 Ca -0.20 -5.85 0.13 0.00 1.00 0.00 0.00 62.75 57.83 1qrk n ILE 612 Cb 0.52 -1.90 0.20 0.00 -0.71 0.00 0.00 39.64 37.75 1qrk n ILE 612 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1qrk n ASN 613 N 0.80 0.04 0.35 4.38 6.94 -1.13 -0.88 115.26 125.77 1qrk n ASN 613 Ca 0.32 0.37 -0.19 0.00 -0.02 0.00 0.00 54.58 55.06 1qrk n ASN 613 Cb 0.33 -0.18 -0.10 0.00 -2.36 0.00 0.00 39.78 37.47 1qrk n ASN 613 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 1qrk h GLU 614 N 0.00 -1.05 0.00 -3.83 3.07 -1.93 -3.07 114.58 107.77 1qrk h GLU 614 Ca 0.26 0.07 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1qrk h GLU 614 Cb 0.88 0.24 0.00 0.00 -0.84 0.00 0.00 28.75 29.03 1qrk h GLU 614 CO -0.10 -0.70 -0.31 0.25 -1.40 0.00 0.00 179.01 176.75 1qrk n THR 615 N -5.54 0.23 -2.46 1.13 -2.24 -0.06 -4.92 114.28 100.42 1qrk n THR 615 Ca -0.13 -0.14 -0.19 0.00 -2.27 0.00 0.00 64.05 61.32 1qrk n THR 615 Cb 0.48 -0.22 -0.01 0.00 -2.10 0.00 0.00 70.33 68.48 1qrk n THR 615 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1qrk n ARG 616 N -1.84 -2.01 -3.26 -0.78 0.00 -0.89 -4.96 116.66 102.91 1qrk n ARG 616 Ca 0.05 0.91 -0.39 0.00 -0.00 0.00 0.00 57.85 58.43 1qrk n ARG 616 Cb 0.39 -5.58 -0.06 0.00 0.00 0.00 0.00 32.46 27.21 1qrk n ARG 616 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1qrk s ASP 617 N -2.09 7.04 -0.15 6.15 1.11 -1.26 -4.93 116.67 122.55 1qrk s ASP 617 Ca 0.02 1.24 -0.03 0.00 0.18 0.00 0.00 52.55 53.97 1qrk s ASP 617 Cb -0.01 -2.36 -0.02 0.00 1.07 0.00 0.00 42.92 41.60 1qrk s ASP 617 CO 0.03 0.24 -0.07 -0.69 1.18 0.00 0.00 175.17 175.87 1qrk s VAL 618 N -0.94 3.63 0.02 -1.27 1.01 -1.26 -2.52 120.40 119.07 1qrk s VAL 618 Ca 0.29 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.86 1qrk s VAL 618 Cb -0.19 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1qrk s VAL 618 CO 0.19 0.50 -0.06 -0.76 0.00 0.00 0.00 175.10 174.97 1qrk s LEU 619 N 0.38 3.22 -0.11 3.92 1.43 -0.79 -4.73 118.68 122.01 1qrk s LEU 619 Ca -0.06 -0.16 -0.20 0.00 -1.03 0.00 0.00 54.13 52.68 1qrk s LEU 619 Cb -0.15 -1.87 0.05 0.00 0.03 0.00 0.00 46.19 44.25 1qrk s LEU 619 CO 0.04 0.26 0.50 0.00 0.23 0.00 0.00 176.35 177.38 1qrk s ALA 620 N -1.06 -1.26 0.08 4.21 0.00 -1.26 -1.22 121.76 121.26 1qrk s ALA 620 Ca 0.19 1.10 -0.14 0.00 0.00 0.00 0.00 51.96 53.10 1qrk s ALA 620 Cb -0.11 -0.37 0.02 0.00 0.00 0.00 0.00 23.12 22.66 1qrk s ALA 620 CO 0.09 -0.28 0.33 0.15 0.00 0.00 0.00 175.76 176.06 1qrk s LYS 621 N -0.55 0.92 -0.06 0.00 -0.14 0.15 -4.98 119.74 115.08 1qrk s LYS 621 Ca -0.07 -0.63 -0.10 0.00 -1.36 0.00 0.00 55.97 53.81 1qrk s LYS 621 Cb -0.03 0.40 0.02 0.00 -1.68 0.00 0.00 37.83 36.54 1qrk s LYS 621 CO 0.04 -0.32 0.25 1.14 -0.76 0.00 0.00 175.35 175.69 1qrk s GLN 622 N -3.20 0.42 0.29 1.68 -2.07 -1.26 -0.60 119.66 114.92 1qrk s GLN 622 Ca -0.01 0.09 -0.01 0.00 -1.82 0.00 0.00 55.36 53.61 1qrk s GLN 622 Cb 0.01 0.19 -0.02 0.00 -1.09 0.00 0.00 33.01 32.10 1qrk s GLN 622 CO -0.07 -0.08 0.33 0.15 -1.32 0.00 0.00 175.29 174.29 1qrk s LYS 623 N -0.49 1.62 0.07 9.60 1.02 -1.11 -5.01 119.74 125.43 1qrk s LYS 623 Ca -0.06 -1.71 -0.07 0.00 0.02 0.00 0.00 55.97 54.16 1qrk s LYS 623 Cb -0.04 0.37 -0.01 0.00 -0.52 0.00 0.00 37.83 37.64 1qrk s LYS 623 CO 0.01 -0.62 0.13 -1.12 -0.92 0.00 0.00 175.35 172.83 1qrk s SER 624 N -3.21 0.18 -0.02 2.83 0.01 -1.26 -2.37 113.70 109.85 1qrk s SER 624 Ca 0.34 -0.65 -0.02 0.00 1.31 0.00 0.00 55.95 56.93 1qrk s SER 624 Cb 0.02 0.29 0.00 0.00 0.21 0.00 0.00 66.02 66.54 1qrk s SER 624 CO 0.18 -0.64 0.06 0.42 0.41 0.00 0.00 173.24 173.67 1qrk s THR 625 N -3.46 0.01 -0.11 1.44 -4.23 -0.55 -4.95 115.64 103.79 1qrk s THR 625 Ca 0.02 -0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.48 1qrk s THR 625 Cb 0.03 -0.11 -0.02 0.00 1.34 0.00 0.00 72.50 73.74 1qrk s THR 625 CO -0.09 -0.03 -0.12 0.68 -0.54 0.00 0.00 174.62 174.53 1qrk s VAL 626 N -0.06 3.21 -0.19 2.29 -7.23 -1.26 -0.16 120.40 117.00 1qrk s VAL 626 Ca -0.01 -0.62 -0.29 0.00 -1.81 0.00 0.00 61.98 59.25 1qrk s VAL 626 Cb -0.01 -2.34 0.00 0.00 0.56 0.00 0.00 36.38 34.60 1qrk s VAL 626 CO 0.00 0.54 1.07 -0.76 -0.31 0.00 0.00 175.10 175.64 1qrk s LEU 627 N 0.06 4.15 0.16 1.32 1.43 0.10 -4.71 118.68 121.19 1qrk s LEU 627 Ca -0.04 1.47 -0.31 0.00 -1.03 0.00 0.00 54.13 54.21 1qrk s LEU 627 Cb -0.14 -3.54 -0.11 0.00 0.03 0.00 0.00 46.19 42.42 1qrk s LEU 627 CO 0.04 -0.63 1.74 -0.89 0.23 0.00 0.00 176.35 176.84 1qrk s THR 628 N 2.95 2.37 -0.06 5.49 2.01 -0.68 -4.50 115.64 123.21 1qrk s THR 628 Ca 0.47 0.11 0.06 0.00 0.31 0.00 0.00 61.69 62.63 1qrk s THR 628 Cb -0.17 -3.07 -0.01 0.00 0.01 0.00 0.00 72.50 69.26 1qrk s THR 628 CO 0.10 0.00 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.17 1qrk s ILE 629 N 1.91 2.15 0.49 1.82 1.01 -1.26 -0.68 121.20 126.64 1qrk s ILE 629 Ca 0.77 -1.03 -0.24 0.00 0.00 0.00 0.00 60.65 60.15 1qrk s ILE 629 Cb -0.47 -1.78 -0.07 0.00 0.01 0.00 0.00 42.46 40.15 1qrk s ILE 629 CO 0.34 0.57 1.40 -2.16 0.00 0.00 0.00 174.94 175.08 1qrk s PRO 630 N -0.14 3.48 0.76 2.79 0.04 -1.26 -5.01 135.00 135.66 1qrk s PRO 630 Ca -0.04 2.34 -0.07 0.00 0.04 0.00 0.00 61.00 63.27 1qrk s PRO 630 Cb -0.14 -2.50 0.11 0.00 0.04 0.00 0.00 34.50 32.01 1qrk s PRO 630 CO 0.04 -0.96 1.06 -1.83 0.04 0.00 0.00 177.00 175.36 1qrk s GLU 631 N -2.63 1.71 0.20 4.56 -1.05 -1.26 -4.85 118.70 115.38 1qrk s GLU 631 Ca 0.65 -0.58 -0.16 0.00 -0.15 0.00 0.00 54.97 54.73 1qrk s GLU 631 Cb -0.42 -2.16 -0.08 0.00 -0.44 0.00 0.00 34.13 31.03 1qrk s GLU 631 CO 0.53 -1.54 0.64 0.42 0.95 0.00 0.00 175.26 176.26 1qrk s ILE 632 N -3.33 4.73 -0.18 1.83 1.01 -1.20 -4.84 121.20 119.21 1qrk s ILE 632 Ca 0.65 0.99 -0.07 0.00 0.00 0.00 0.00 60.65 62.22 1qrk s ILE 632 Cb -0.08 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 1qrk s ILE 632 CO 0.46 0.15 0.06 -0.63 0.00 0.00 0.00 174.94 174.98 1qrk s ILE 633 N -1.58 4.71 -0.11 2.92 -1.09 -0.14 -4.49 121.20 121.42 1qrk s ILE 633 Ca 0.42 -0.06 0.01 0.00 -2.23 0.00 0.00 60.65 58.79 1qrk s ILE 633 Cb -0.15 -3.12 0.02 0.00 -1.58 0.00 0.00 42.46 37.63 1qrk s ILE 633 CO 0.20 0.46 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.60 1qrk s ILE 634 N 0.43 1.38 -0.04 2.92 1.01 -1.26 0.30 121.20 125.94 1qrk s ILE 634 Ca 0.03 -0.55 0.04 0.00 0.00 0.00 0.00 60.65 60.16 1qrk s ILE 634 Cb -0.13 -1.29 -0.00 0.00 0.01 0.00 0.00 42.46 41.05 1qrk s ILE 634 CO 0.01 0.42 -0.15 -0.54 0.00 0.00 0.00 174.94 174.68 1qrk s LYS 635 N 1.20 1.58 -0.19 2.79 1.02 -0.73 -4.85 119.74 120.55 1qrk s LYS 635 Ca -0.03 -0.52 -0.13 0.00 0.02 0.00 0.00 55.97 55.31 1qrk s LYS 635 Cb -0.14 -1.38 -0.05 0.00 -0.52 0.00 0.00 37.83 35.74 1qrk s LYS 635 CO -0.04 0.19 0.25 0.14 -0.92 0.00 0.00 175.35 174.97 1qrk s VAL 636 N 0.13 5.32 -0.20 3.17 -7.23 -1.26 -1.29 120.40 119.04 1qrk s VAL 636 Ca -0.05 0.43 -0.00 0.00 -1.81 0.00 0.00 61.98 60.55 1qrk s VAL 636 Cb -0.11 -3.59 0.05 0.00 0.56 0.00 0.00 36.38 33.29 1qrk s VAL 636 CO 0.02 0.36 -0.05 -0.60 -0.31 0.00 0.00 175.10 174.53 1qrk s ARG 637 N 0.74 1.45 0.00 4.82 3.52 0.13 -5.00 118.95 124.62 1qrk s ARG 637 Ca 0.13 -0.70 0.00 0.00 -0.13 0.00 0.00 55.73 55.04 1qrk s ARG 637 Cb -0.13 -2.26 0.00 0.00 -1.56 0.00 0.00 34.95 31.00 1qrk s ARG 637 CO 0.04 -0.52 0.00 0.41 -0.81 0.00 0.00 175.30 174.42 1qrk n GLY 638 N 4.81 0.77 3.52 8.12 0.00 -1.26 0.51 105.19 121.66 1qrk n GLY 638 Ca -0.12 -1.66 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1qrk n GLY 638 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qrk s THR 639 N -3.66 4.61 -0.76 2.61 -4.23 -1.19 -4.94 115.64 108.08 1qrk s THR 639 Ca 0.00 0.27 -0.07 0.00 -1.18 0.00 0.00 61.69 60.71 1qrk s THR 639 Cb 0.00 -4.37 -0.14 0.00 1.34 0.00 0.00 72.50 69.32 1qrk s THR 639 CO 0.00 -0.83 3.21 0.00 -0.54 0.00 0.00 174.62 176.46 1qrk n GLN 640 N 6.84 2.89 -4.64 3.99 3.00 -1.26 -4.34 117.38 123.85 1qrk n GLN 640 Ca 0.01 -1.77 -0.25 0.00 -0.01 0.00 0.00 57.00 54.99 1qrk n GLN 640 Cb 0.48 -2.37 -0.16 0.00 0.00 0.00 0.00 30.24 28.19 1qrk n GLN 640 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1qrk s VAL 641 N 0.99 1.20 -0.04 5.09 1.01 -1.26 0.73 120.40 128.12 1qrk s VAL 641 Ca 0.66 -0.53 -0.39 0.00 0.00 0.00 0.00 61.98 61.72 1qrk s VAL 641 Cb 0.26 -1.08 -0.18 0.00 0.00 0.00 0.00 36.38 35.38 1qrk s VAL 641 CO -0.05 0.37 1.28 0.52 0.00 0.00 0.00 175.10 177.22 1qrk n VAL 642 N 3.68 0.03 0.00 2.92 0.31 0.18 -0.50 118.33 124.95 1qrk n VAL 642 Ca -0.22 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 1qrk n VAL 642 Cb 0.52 -0.47 0.00 0.00 -0.91 0.00 0.00 33.84 32.99 1qrk n VAL 642 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1qrk n GLY 643 N 2.36 3.06 3.86 2.92 0.00 0.62 -4.96 105.19 113.05 1qrk n GLY 643 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 1qrk n GLY 643 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qrk s SER 644 N -1.22 6.33 0.74 1.61 0.01 0.34 -4.94 113.70 116.58 1qrk s SER 644 Ca 0.00 0.44 -0.15 0.00 1.31 0.00 0.00 55.95 57.55 1qrk s SER 644 Cb 0.00 -2.05 0.05 0.00 0.21 0.00 0.00 66.02 64.22 1qrk s SER 644 CO 0.00 0.39 1.21 -1.81 0.41 0.00 0.00 173.24 173.43 1qrk s ASP 645 N -0.89 4.11 -0.20 2.44 1.01 -1.26 -4.16 116.67 117.71 1qrk s ASP 645 Ca 0.14 2.36 -0.15 0.00 0.71 0.00 0.00 52.55 55.61 1qrk s ASP 645 Cb -0.12 -2.59 0.06 0.00 1.01 0.00 0.00 42.92 41.28 1qrk s ASP 645 CO 0.03 -2.32 0.50 0.00 0.21 0.00 0.00 175.17 173.60 1qrk s MET 646 N -3.95 0.55 -0.22 8.23 0.23 0.04 -3.16 119.30 121.02 1qrk s MET 646 Ca 0.74 0.81 -0.17 0.00 -1.03 0.00 0.00 55.69 56.03 1qrk s MET 646 Cb -0.29 0.17 -0.03 0.00 -1.53 0.00 0.00 34.83 33.15 1qrk s MET 646 CO 0.46 -0.11 0.48 0.99 -2.03 0.00 0.00 175.02 174.81 1qrk s THR 647 N 0.82 5.13 -0.14 3.16 2.01 0.18 0.48 115.64 127.27 1qrk s THR 647 Ca -0.04 0.85 -0.05 0.00 0.31 0.00 0.00 61.69 62.75 1qrk s THR 647 Cb -0.05 -3.80 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 1qrk s THR 647 CO -0.06 0.18 0.04 -0.69 -0.69 0.00 0.00 174.62 173.39 1qrk s VAL 648 N 1.69 4.58 -0.26 3.82 1.01 0.12 0.21 120.40 131.57 1qrk s VAL 648 Ca 0.22 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.10 1qrk s VAL 648 Cb -0.15 -3.01 0.06 0.00 0.00 0.00 0.00 36.38 33.28 1qrk s VAL 648 CO 0.09 0.53 -0.10 -0.89 0.00 0.00 0.00 175.10 174.72 1qrk s THR 649 N -0.15 2.16 -0.02 3.92 2.01 -0.41 -1.04 115.64 122.10 1qrk s THR 649 Ca 0.06 -1.66 -0.16 0.00 0.31 0.00 0.00 61.69 60.25 1qrk s THR 649 Cb -0.12 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 70.05 1qrk s THR 649 CO 0.02 -0.05 0.42 -0.69 -0.69 0.00 0.00 174.62 173.63 1qrk s VAL 650 N 1.10 5.05 -0.02 3.82 1.01 0.56 -1.78 120.40 130.15 1qrk s VAL 650 Ca -0.08 0.87 0.00 0.00 0.00 0.00 0.00 61.98 62.77 1qrk s VAL 650 Cb -0.20 -3.74 0.03 0.00 0.00 0.00 0.00 36.38 32.47 1qrk s VAL 650 CO -0.05 0.52 0.02 -0.70 0.00 0.00 0.00 175.10 174.89 1qrk s GLU 651 N -0.69 0.09 -0.02 2.72 2.12 0.15 -0.63 118.70 122.43 1qrk s GLU 651 Ca 0.24 0.15 0.02 0.00 0.36 0.00 0.00 54.97 55.74 1qrk s GLU 651 Cb -0.16 -0.34 0.00 0.00 0.26 0.00 0.00 34.13 33.88 1qrk s GLU 651 CO 0.13 -0.16 -0.08 0.12 -0.54 0.00 0.00 175.26 174.72 1qrk s PHE 652 N 1.08 0.85 -0.14 5.30 5.36 -0.74 -0.97 117.98 128.71 1qrk s PHE 652 Ca -0.09 -0.20 0.01 0.00 -0.96 0.00 0.00 56.93 55.69 1qrk s PHE 652 Cb -0.13 -0.60 -0.00 0.00 -0.34 0.00 0.00 43.02 41.94 1qrk s PHE 652 CO -0.03 -0.08 -0.17 0.99 -1.46 0.00 0.00 175.22 174.48 1qrk s THR 653 N 0.13 2.59 -0.22 0.12 2.01 -1.26 -1.24 115.64 117.77 1qrk s THR 653 Ca -0.02 -0.81 -0.29 0.00 0.31 0.00 0.00 61.69 60.89 1qrk s THR 653 Cb -0.07 -2.07 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 1qrk s THR 653 CO 0.00 0.53 1.96 0.21 -0.69 0.00 0.00 174.62 176.63 1qrk s ASN 654 N 0.65 5.85 0.36 3.53 3.84 -0.29 -4.84 114.94 124.03 1qrk s ASN 654 Ca -0.09 1.75 0.19 0.00 0.21 0.00 0.00 52.86 54.93 1qrk s ASN 654 Cb -0.16 -2.52 0.35 0.00 -0.55 0.00 0.00 41.25 38.37 1qrk s ASN 654 CO 0.02 -1.67 1.58 1.55 -2.79 0.00 0.00 177.10 175.80 1qrk h PRO 655 N 13.18 0.00 -7.54 0.43 0.13 -1.95 -1.31 132.00 134.94 1qrk h PRO 655 Ca -0.38 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.32 1qrk h PRO 655 Cb 1.20 0.00 0.19 0.00 0.13 0.00 0.00 31.00 32.52 1qrk h PRO 655 CO 0.99 0.33 0.22 -0.51 -0.23 0.00 0.00 178.00 178.79 1qrk s LEU 656 N -6.49 1.29 -0.15 1.56 1.43 -1.26 -4.84 118.68 110.22 1qrk s LEU 656 Ca 0.04 0.48 0.16 0.00 -1.03 0.00 0.00 54.13 53.77 1qrk s LEU 656 Cb 0.08 -2.27 0.54 0.00 0.03 0.00 0.00 46.19 44.57 1qrk s LEU 656 CO 0.70 -3.76 1.45 0.29 0.23 0.00 0.00 176.35 175.26 1qrk n LYS 657 N -4.49 3.19 -4.26 1.70 4.01 -1.26 -3.65 118.16 113.40 1qrk n LYS 657 Ca 0.14 -2.76 -0.17 0.00 -0.51 0.00 0.00 58.31 55.02 1qrk n LYS 657 Cb 0.60 -1.81 -0.09 0.00 -0.51 0.00 0.00 35.03 33.22 1qrk n LYS 657 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 1qrk s GLU 658 N -2.48 1.56 0.12 1.97 -1.05 -1.26 -4.87 118.70 112.68 1qrk s GLU 658 Ca 0.41 -1.88 -0.19 0.00 -0.15 0.00 0.00 54.97 53.16 1qrk s GLU 658 Cb 0.31 0.28 -0.07 0.00 -0.44 0.00 0.00 34.13 34.21 1qrk s GLU 658 CO 0.12 -0.55 0.60 0.95 0.95 0.00 0.00 175.26 177.33 1qrk s THR 659 N -3.70 4.71 -0.08 1.83 -4.23 -1.26 -3.54 115.64 109.37 1qrk s THR 659 Ca 0.40 1.19 -0.04 0.00 -1.18 0.00 0.00 61.69 62.06 1qrk s THR 659 Cb 0.04 -3.88 -0.04 0.00 1.34 0.00 0.00 72.50 69.96 1qrk s THR 659 CO 0.22 0.44 0.10 -0.76 -0.54 0.00 0.00 174.62 174.07 1qrk s LEU 660 N -1.41 4.09 0.13 4.79 1.43 -1.01 -4.94 118.68 121.76 1qrk s LEU 660 Ca 0.33 0.31 0.07 0.00 -1.03 0.00 0.00 54.13 53.82 1qrk s LEU 660 Cb -0.18 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 1qrk s LEU 660 CO 0.20 0.36 -0.17 -0.13 0.23 0.00 0.00 176.35 176.84 1qrk s ARG 661 N -1.22 1.12 -1.27 1.70 0.52 -1.26 -0.66 118.95 117.88 1qrk s ARG 661 Ca 0.17 -1.28 -0.02 0.00 -0.52 0.00 0.00 55.73 54.08 1qrk s ARG 661 Cb -0.12 -1.13 -0.00 0.00 0.52 0.00 0.00 34.95 34.22 1qrk s ARG 661 CO 0.07 0.23 0.73 0.09 0.02 0.00 0.00 175.30 176.44 1qrk n ASN 662 N 0.54 -1.81 -4.63 0.23 4.13 0.10 -2.55 115.26 111.28 1qrk n ASN 662 Ca -0.15 -0.82 -0.43 0.00 1.68 0.00 0.00 54.58 54.86 1qrk n ASN 662 Cb 0.56 -4.11 -0.02 0.00 -1.54 0.00 0.00 39.78 34.67 1qrk n ASN 662 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1qrk s VAL 663 N -3.63 4.33 -0.29 2.41 1.01 -0.05 -4.41 120.40 119.77 1qrk s VAL 663 Ca 0.06 1.50 -0.11 0.00 0.00 0.00 0.00 61.98 63.44 1qrk s VAL 663 Cb -0.02 -4.35 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 1qrk s VAL 663 CO 0.81 -0.56 0.18 0.26 0.00 0.00 0.00 175.10 175.79 1qrk s TRP 664 N 4.03 3.20 -0.07 5.22 0.52 0.26 -0.29 118.94 131.81 1qrk s TRP 664 Ca 0.50 -0.07 -0.03 0.00 0.02 0.00 0.00 56.10 56.52 1qrk s TRP 664 Cb -0.13 -2.38 -0.04 0.00 -1.15 0.00 0.00 33.47 29.77 1qrk s TRP 664 CO 0.20 -0.25 0.06 0.08 0.02 0.00 0.00 176.95 177.07 1qrk s VAL 665 N 1.72 4.76 0.07 4.03 1.01 0.44 -2.19 120.40 130.23 1qrk s VAL 665 Ca 0.07 -0.18 0.10 0.00 0.00 0.00 0.00 61.98 61.97 1qrk s VAL 665 Cb -0.16 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 1qrk s VAL 665 CO 0.10 0.53 -0.26 -1.00 0.00 0.00 0.00 175.10 174.47 1qrk s HIS 666 N -1.02 2.28 -0.00 5.22 3.76 -0.13 -1.07 115.29 124.33 1qrk s HIS 666 Ca 0.17 -0.40 0.01 0.00 -0.15 0.00 0.00 55.06 54.68 1qrk s HIS 666 Cb -0.12 -1.33 -0.00 0.00 1.11 0.00 0.00 32.58 32.24 1qrk s HIS 666 CO 0.06 0.18 -0.03 -1.17 -0.85 0.00 0.00 174.74 172.93 1qrk s LEU 667 N -1.46 2.02 0.04 0.89 2.96 -0.44 -1.68 118.68 121.01 1qrk s LEU 667 Ca 0.12 -0.07 -0.21 0.00 -0.22 0.00 0.00 54.13 53.74 1qrk s LEU 667 Cb -0.10 -0.14 0.05 0.00 0.50 0.00 0.00 46.19 46.50 1qrk s LEU 667 CO 0.03 0.02 0.49 -0.62 -1.32 0.00 0.00 176.35 174.95 1qrk s ASP 668 N -0.14 -0.40 -0.32 3.68 -1.08 -0.16 -1.84 116.67 116.42 1qrk s ASP 668 Ca 0.00 0.15 -0.07 0.00 -0.52 0.00 0.00 52.55 52.12 1qrk s ASP 668 Cb -0.01 0.47 0.19 0.00 -1.46 0.00 0.00 42.92 42.10 1qrk s ASP 668 CO -0.00 -0.69 0.96 -0.83 0.52 0.00 0.00 175.17 175.13 1qrk s GLY 669 N -1.91 -1.23 -0.26 2.66 0.00 -1.21 -0.47 107.32 104.90 1qrk s GLY 669 Ca -0.06 1.50 -0.31 0.00 0.00 0.00 0.00 44.72 45.85 1qrk s GLY 669 CO -0.01 4.10 2.20 -1.55 0.00 0.00 0.00 173.10 177.84 1qrk n PRO 670 N 4.53 1.65 -0.24 2.90 -0.04 -1.26 -0.74 135.00 141.80 1qrk n PRO 670 Ca 0.08 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.99 1qrk n PRO 670 Cb 0.59 -2.95 0.00 0.00 -0.04 0.00 0.00 33.50 31.11 1qrk n PRO 670 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qrk n GLY 671 N 6.02 0.87 0.00 0.55 0.00 -1.26 -4.86 105.19 106.51 1qrk n GLY 671 Ca 0.34 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1qrk n GLY 671 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1qrk n VAL 672 N -2.24 0.00 -3.58 1.61 0.31 0.08 -2.13 118.33 112.38 1qrk n VAL 672 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.22 1qrk n VAL 672 Cb 0.00 -0.26 -0.05 0.00 -0.91 0.00 0.00 33.84 32.62 1qrk n VAL 672 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1qrk s THR 673 N -1.36 0.00 0.45 2.52 -1.32 -0.28 -3.87 115.64 111.78 1qrk s THR 673 Ca 0.00 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.45 1qrk s THR 673 Cb 0.00 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.96 1qrk s THR 673 CO 0.00 0.00 0.71 -0.13 -2.21 0.00 0.00 174.62 172.99 1qrk s ARG 674 N -0.99 3.45 -0.33 7.08 0.52 -1.26 -3.32 118.95 124.11 1qrk s ARG 674 Ca -0.02 -0.02 -0.38 0.00 -0.52 0.00 0.00 55.73 54.79 1qrk s ARG 674 Cb -0.01 -2.47 -0.14 0.00 0.52 0.00 0.00 34.95 32.86 1qrk s ARG 674 CO 0.01 -0.14 2.02 -0.35 0.02 0.00 0.00 175.30 176.86 1qrk n PRO 675 N -2.13 1.03 -4.62 3.54 -0.04 -1.26 -4.77 135.00 126.74 1qrk n PRO 675 Ca -0.01 0.33 -0.28 0.00 -0.04 0.00 0.00 63.50 63.50 1qrk n PRO 675 Cb 0.56 -2.23 -0.14 0.00 -0.04 0.00 0.00 33.50 31.65 1qrk n PRO 675 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1qrk s MET 676 N 5.17 1.49 0.01 0.54 -1.94 -0.76 -5.02 119.30 118.78 1qrk s MET 676 Ca 1.06 -1.12 0.02 0.00 -1.71 0.00 0.00 55.69 53.94 1qrk s MET 676 Cb -1.00 -1.74 -0.01 0.00 2.01 0.00 0.00 34.83 34.09 1qrk s MET 676 CO 0.57 0.43 -0.07 -1.59 -0.01 0.00 0.00 175.02 174.36 1qrk s LYS 677 N -1.50 0.50 0.11 2.03 -2.85 -1.26 -1.32 119.74 115.45 1qrk s LYS 677 Ca 0.10 -0.40 0.09 0.00 -1.00 0.00 0.00 55.97 54.76 1qrk s LYS 677 Cb -0.10 -0.42 -0.04 0.00 -2.06 0.00 0.00 37.83 35.22 1qrk s LYS 677 CO 0.03 0.11 -0.22 0.21 0.10 0.00 0.00 175.35 175.58 1qrk s LYS 678 N -0.63 1.18 -0.03 1.78 2.36 -0.23 -4.98 119.74 119.20 1qrk s LYS 678 Ca -0.02 -1.20 0.07 0.00 -2.55 0.00 0.00 55.97 52.28 1qrk s LYS 678 Cb -0.05 -1.50 -0.02 0.00 -1.05 0.00 0.00 37.83 35.22 1qrk s LYS 678 CO 0.00 0.35 -0.24 1.41 1.55 0.00 0.00 175.35 178.42 1qrk s MET 679 N -1.93 2.11 -0.17 4.03 -2.45 -1.26 -0.42 119.30 119.21 1qrk s MET 679 Ca 0.08 -0.86 0.01 0.00 -1.25 0.00 0.00 55.69 53.66 1qrk s MET 679 Cb -0.10 -1.95 0.01 0.00 1.25 0.00 0.00 34.83 34.04 1qrk s MET 679 CO 0.05 0.47 -0.17 -0.06 1.05 0.00 0.00 175.02 176.36 1qrk s PHE 680 N -0.43 2.78 0.29 4.11 0.40 0.60 -4.99 117.98 120.73 1qrk s PHE 680 Ca 0.05 -1.29 0.03 0.00 -0.60 0.00 0.00 56.93 55.12 1qrk s PHE 680 Cb -0.11 -1.91 0.68 0.00 0.51 0.00 0.00 43.02 42.20 1qrk s PHE 680 CO 0.00 -0.62 1.72 0.00 0.70 0.00 0.00 175.22 177.03 1qrk h ARG 681 N 7.60 0.48 -2.29 0.44 2.47 -1.95 -0.09 114.38 121.04 1qrk h ARG 681 Ca -0.38 -0.03 0.19 0.00 -1.26 0.00 0.00 59.98 58.50 1qrk h ARG 681 Cb 1.17 -0.11 -0.07 0.00 -1.65 0.00 0.00 29.97 29.31 1qrk h ARG 681 CO 0.59 0.32 0.56 -1.83 0.56 0.00 0.00 179.97 180.17 1qrk s GLU 682 N -5.90 1.14 -0.22 0.04 -1.05 -1.26 -0.72 118.70 110.73 1qrk s GLU 682 Ca -0.12 -0.67 -0.06 0.00 -0.15 0.00 0.00 54.97 53.97 1qrk s GLU 682 Cb 0.24 0.36 0.10 0.00 -0.44 0.00 0.00 34.13 34.40 1qrk s GLU 682 CO 0.78 -0.53 0.44 -1.50 0.95 0.00 0.00 175.26 175.41 1qrk s ILE 683 N -2.85 -0.69 0.75 1.83 2.07 0.16 -4.93 121.20 117.54 1qrk s ILE 683 Ca 0.15 0.11 -0.15 0.00 -1.41 0.00 0.00 60.65 59.36 1qrk s ILE 683 Cb -0.01 -0.73 0.05 0.00 0.13 0.00 0.00 42.46 41.90 1qrk s ILE 683 CO 0.03 0.04 1.23 -0.13 -1.91 0.00 0.00 174.94 174.19 1qrk s ARG 684 N 2.64 1.99 0.02 3.50 1.81 -1.26 -2.40 118.95 125.25 1qrk s ARG 684 Ca 0.01 1.83 -0.30 0.00 -1.72 0.00 0.00 55.73 55.55 1qrk s ARG 684 Cb -0.13 -1.81 -0.09 0.00 -0.45 0.00 0.00 34.95 32.48 1qrk s ARG 684 CO -0.14 -1.97 1.98 -1.25 -0.68 0.00 0.00 175.30 173.24 1qrk s PRO 685 N -3.90 4.08 -0.11 3.54 0.04 -1.23 -2.13 135.00 135.29 1qrk s PRO 685 Ca 0.76 2.57 0.00 0.00 0.04 0.00 0.00 61.00 64.37 1qrk s PRO 685 Cb -0.31 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.06 1qrk s PRO 685 CO 0.47 -1.02 0.00 0.09 0.04 0.00 0.00 177.00 176.57 1qrk n ASN 686 N 7.78 -3.19 -4.95 6.66 3.02 -0.49 -4.91 115.26 119.16 1qrk n ASN 686 Ca 0.20 0.03 -0.23 0.00 -0.03 0.00 0.00 54.58 54.55 1qrk n ASN 686 Cb 0.41 -0.79 0.02 0.00 -0.61 0.00 0.00 39.78 38.82 1qrk n ASN 686 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1qrk s SER 687 N -2.69 5.60 -0.01 6.41 0.01 -0.90 -4.77 113.70 117.35 1qrk s SER 687 Ca 0.00 0.23 0.03 0.00 1.31 0.00 0.00 55.95 57.52 1qrk s SER 687 Cb 0.00 -1.32 -0.01 0.00 0.21 0.00 0.00 66.02 64.90 1qrk s SER 687 CO 0.00 -0.91 -0.09 -0.89 0.41 0.00 0.00 173.24 171.76 1qrk s THR 688 N -2.68 0.75 0.02 1.44 2.01 -1.26 -1.14 115.64 114.77 1qrk s THR 688 Ca 0.52 -0.39 0.07 0.00 0.31 0.00 0.00 61.69 62.20 1qrk s THR 688 Cb -0.10 -0.64 -0.02 0.00 0.01 0.00 0.00 72.50 71.75 1qrk s THR 688 CO 0.39 0.22 -0.22 0.68 -0.69 0.00 0.00 174.62 174.99 1qrk s VAL 689 N -0.14 1.78 0.21 3.82 -7.23 -0.37 -5.00 120.40 113.47 1qrk s VAL 689 Ca 0.02 -1.11 0.10 0.00 -1.81 0.00 0.00 61.98 59.18 1qrk s VAL 689 Cb -0.05 -1.51 -0.04 0.00 0.56 0.00 0.00 36.38 35.34 1qrk s VAL 689 CO -0.00 0.36 -0.12 -1.10 -0.31 0.00 0.00 175.10 173.93 1qrk s GLN 690 N -0.89 1.95 -0.07 4.82 -0.21 -1.26 -1.80 119.66 122.21 1qrk s GLN 690 Ca 0.09 -1.42 -0.03 0.00 0.02 0.00 0.00 55.36 54.02 1qrk s GLN 690 Cb -0.09 -2.04 0.04 0.00 1.00 0.00 0.00 33.01 31.92 1qrk s GLN 690 CO 0.01 0.40 0.12 -0.46 -2.12 0.00 0.00 175.29 173.24 1qrk s TRP 691 N -1.94 -0.10 -0.18 0.91 -0.00 0.19 -4.96 118.94 112.87 1qrk s TRP 691 Ca 0.26 0.47 -0.02 0.00 -0.00 0.00 0.00 56.10 56.81 1qrk s TRP 691 Cb -0.08 -0.30 -0.01 0.00 -0.00 0.00 0.00 33.47 33.09 1qrk s TRP 691 CO 0.15 -0.22 -0.10 -1.21 -0.00 0.00 0.00 176.95 175.57 1qrk s GLU 692 N 2.02 3.34 0.04 5.86 2.02 -1.26 -0.32 118.70 130.40 1qrk s GLU 692 Ca 0.01 -0.67 0.04 0.00 0.02 0.00 0.00 54.97 54.37 1qrk s GLU 692 Cb -0.12 -2.80 -0.02 0.00 0.10 0.00 0.00 34.13 31.29 1qrk s GLU 692 CO -0.05 -0.02 -0.12 -1.21 0.02 0.00 0.00 175.26 173.88 1qrk s GLU 693 N 0.97 0.78 -0.32 1.61 0.41 -0.21 -4.98 118.70 116.96 1qrk s GLU 693 Ca -0.01 -0.74 -0.08 0.00 -0.41 0.00 0.00 54.97 53.73 1qrk s GLU 693 Cb -0.15 -0.74 0.02 0.00 -1.78 0.00 0.00 34.13 31.48 1qrk s GLU 693 CO -0.01 0.18 0.12 0.08 -0.49 0.00 0.00 175.26 175.14 1qrk s VAL 694 N -0.97 4.14 0.12 2.63 1.01 -1.26 0.16 120.40 126.24 1qrk s VAL 694 Ca -0.01 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.12 1qrk s VAL 694 Cb -0.08 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 1qrk s VAL 694 CO 0.01 -0.05 0.35 0.00 0.00 0.00 0.00 175.10 175.41 1qrk s ARG 696 N -2.54 2.20 0.17 0.00 3.00 -1.25 -0.78 118.95 119.75 1qrk s ARG 696 Ca 0.39 -2.95 -0.33 0.00 -1.00 0.00 0.00 55.73 51.84 1qrk s ARG 696 Cb -0.12 -3.37 -0.13 0.00 0.00 0.00 0.00 34.95 31.33 1qrk s ARG 696 CO 0.24 -1.19 1.65 -0.35 0.00 0.00 0.00 175.30 175.65 1qrk n PRO 697 N 2.60 2.41 0.00 5.12 -0.04 -1.26 -4.74 135.00 139.09 1qrk n PRO 697 Ca 0.12 0.87 0.09 0.00 -0.04 0.00 0.00 63.50 64.53 1qrk n PRO 697 Cb 0.33 -2.68 0.03 0.00 -0.04 0.00 0.00 33.50 31.14 1qrk n PRO 697 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1qrk n TRP 698 N 3.79 0.00 -4.97 0.54 2.14 -0.98 -0.28 117.44 117.68 1qrk n TRP 698 Ca 0.17 0.00 -0.28 0.00 2.07 0.00 0.00 57.50 59.45 1qrk n TRP 698 Cb 0.31 0.00 -0.15 0.00 -0.81 0.00 0.00 31.31 30.66 1qrk n TRP 698 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1qrk s VAL 699 N -1.86 1.85 0.43 -1.67 1.01 -0.91 -4.89 120.40 114.37 1qrk s VAL 699 Ca 0.17 -1.13 0.08 0.00 0.00 0.00 0.00 61.98 61.10 1qrk s VAL 699 Cb 0.15 -1.57 0.01 0.00 0.00 0.00 0.00 36.38 34.97 1qrk s VAL 699 CO 0.37 0.41 0.54 -0.94 0.00 0.00 0.00 175.10 175.47 1qrk s SER 700 N -0.86 5.48 0.00 3.32 1.04 -1.26 -4.78 113.70 116.64 1qrk s SER 700 Ca 0.09 -0.53 0.00 0.00 0.48 0.00 0.00 55.95 55.99 1qrk s SER 700 Cb -0.09 -0.57 0.00 0.00 0.10 0.00 0.00 66.02 65.46 1qrk s SER 700 CO 0.00 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.06 1qrk n GLY 701 N -1.80 -1.83 3.58 7.32 0.00 0.50 -4.81 105.19 108.15 1qrk n GLY 701 Ca 0.07 -1.72 -0.41 0.00 0.00 0.00 0.00 46.02 43.96 1qrk n GLY 701 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1qrk s HIS 702 N 0.00 1.59 0.00 1.61 5.65 -1.26 -1.43 115.29 121.45 1qrk s HIS 702 Ca 0.00 0.78 0.00 0.00 0.25 0.00 0.00 55.06 56.09 1qrk s HIS 702 Cb 0.00 -4.02 0.00 0.00 -1.18 0.00 0.00 32.58 27.38 1qrk s HIS 702 CO 0.00 -2.89 0.00 0.54 -0.65 0.00 0.00 174.74 171.74 1qrk n ARG 703 N 8.73 2.26 -3.65 2.88 5.12 0.40 -5.00 116.66 127.41 1qrk n ARG 703 Ca 0.25 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 56.08 1qrk n ARG 703 Cb 0.49 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.77 1qrk n ARG 703 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1qrk s LYS 704 N -0.74 1.50 -0.08 5.56 2.20 -1.26 -3.14 119.74 123.77 1qrk s LYS 704 Ca 0.00 -0.72 -0.00 0.00 -0.36 0.00 0.00 55.97 54.89 1qrk s LYS 704 Cb 0.00 0.58 0.02 0.00 -1.51 0.00 0.00 37.83 36.93 1qrk s LYS 704 CO 0.00 -0.68 -0.04 -0.51 -0.36 0.00 0.00 175.35 173.76 1qrk s LEU 705 N -2.83 0.98 -0.11 5.43 1.43 0.58 -4.49 118.68 119.68 1qrk s LEU 705 Ca 0.06 -0.18 -0.03 0.00 -1.03 0.00 0.00 54.13 52.96 1qrk s LEU 705 Cb -0.03 -0.60 -0.03 0.00 0.03 0.00 0.00 46.19 45.56 1qrk s LEU 705 CO -0.03 -0.13 -0.00 -0.63 0.23 0.00 0.00 176.35 175.79 1qrk s ILE 706 N 1.61 4.24 0.11 -0.59 1.09 0.38 -1.26 121.20 126.78 1qrk s ILE 706 Ca 0.01 -0.26 0.07 0.00 -1.10 0.00 0.00 60.65 59.37 1qrk s ILE 706 Cb -0.13 -2.81 -0.04 0.00 -1.06 0.00 0.00 42.46 38.43 1qrk s ILE 706 CO -0.05 0.57 -0.17 0.00 -0.10 0.00 0.00 174.94 175.19 1qrk s ALA 707 N -0.50 1.60 0.11 9.38 0.00 0.20 -0.99 121.76 131.57 1qrk s ALA 707 Ca 0.09 -1.23 -0.08 0.00 0.00 0.00 0.00 51.96 50.73 1qrk s ALA 707 Cb -0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1qrk s ALA 707 CO 0.02 0.23 0.21 -1.54 0.00 0.00 0.00 175.76 174.68 1qrk s SER 708 N -2.12 0.11 0.02 0.00 1.04 -0.68 -1.73 113.70 110.34 1qrk s SER 708 Ca 0.06 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.75 1qrk s SER 708 Cb -0.08 0.37 -0.02 0.00 0.10 0.00 0.00 66.02 66.39 1qrk s SER 708 CO 0.04 -0.78 -0.04 -0.32 0.98 0.00 0.00 173.24 173.12 1qrk s MET 709 N -3.90 0.34 -0.23 4.02 1.75 0.17 -0.95 119.30 120.49 1qrk s MET 709 Ca 0.10 -0.64 -0.18 0.00 -1.25 0.00 0.00 55.69 53.72 1qrk s MET 709 Cb 0.04 0.06 0.06 0.00 2.84 0.00 0.00 34.83 37.84 1qrk s MET 709 CO -0.07 -0.04 0.60 0.45 -0.65 0.00 0.00 175.02 175.32 1qrk s SER 710 N -1.49 -0.70 0.11 1.11 0.15 -0.93 -3.49 113.70 108.45 1qrk s SER 710 Ca -0.15 1.26 0.02 0.00 0.70 0.00 0.00 55.95 57.78 1qrk s SER 710 Cb -0.10 1.22 -0.01 0.00 -1.71 0.00 0.00 66.02 65.42 1qrk s SER 710 CO -0.01 -0.22 0.11 -1.54 1.20 0.00 0.00 173.24 172.78 1qrk n SER 711 N 3.36 -0.29 0.09 5.45 3.41 0.81 -0.57 113.62 125.89 1qrk n SER 711 Ca -0.17 -1.71 -0.06 0.00 -0.26 0.00 0.00 58.87 56.67 1qrk n SER 711 Cb 0.57 0.63 0.03 0.00 -0.26 0.00 0.00 64.21 65.17 1qrk n SER 711 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1qrk h ASP 712 N 0.68 0.14 0.00 4.04 3.32 -1.70 -3.41 116.42 119.48 1qrk h ASP 712 Ca -0.08 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1qrk h ASP 712 Cb 0.40 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1qrk h ASP 712 CO 0.12 0.88 0.00 -1.54 -1.72 0.00 0.00 179.24 176.98 1qrk n SER 713 N -3.66 0.00 -4.76 6.45 3.41 -1.26 -5.00 113.62 108.81 1qrk n SER 713 Ca -0.02 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.21 1qrk n SER 713 Cb 0.77 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.73 1qrk n SER 713 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1qrk s LEU 714 N 0.00 3.94 0.22 1.04 2.96 -1.26 -5.03 118.68 120.55 1qrk s LEU 714 Ca 0.00 2.58 -0.22 0.00 -0.22 0.00 0.00 54.13 56.26 1qrk s LEU 714 Cb 0.00 -4.23 0.04 0.00 0.50 0.00 0.00 46.19 42.50 1qrk s LEU 714 CO 0.00 -1.26 0.73 -0.60 -1.32 0.00 0.00 176.35 173.90 1qrk s ARG 715 N -2.77 1.52 -0.68 1.98 3.52 -1.26 -0.14 118.95 121.12 1qrk s ARG 715 Ca 0.67 -0.77 -0.04 0.00 -0.13 0.00 0.00 55.73 55.46 1qrk s ARG 715 Cb -0.36 0.56 0.00 0.00 -1.56 0.00 0.00 34.95 33.60 1qrk s ARG 715 CO 0.43 -0.69 0.59 1.58 -0.81 0.00 0.00 175.30 176.40 1qrk n HIS 716 N -0.43 -1.42 -3.95 5.12 -0.00 -1.23 -4.53 115.22 108.79 1qrk n HIS 716 Ca -0.08 0.51 -0.35 0.00 0.46 0.00 0.00 57.72 58.27 1qrk n HIS 716 Cb 0.61 -3.16 -0.14 0.00 -0.12 0.00 0.00 29.99 27.18 1qrk n HIS 716 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1qrk s VAL 717 N -3.17 2.95 0.32 3.57 1.01 -1.23 -4.91 120.40 118.95 1qrk s VAL 717 Ca 0.25 -1.01 0.08 0.00 0.00 0.00 0.00 61.98 61.30 1qrk s VAL 717 Cb -0.11 -2.50 -0.06 0.00 0.00 0.00 0.00 36.38 33.70 1qrk s VAL 717 CO 0.37 0.19 -0.05 -0.31 0.00 0.00 0.00 175.10 175.29 1qrk s TYR 718 N 1.33 2.19 -0.09 5.22 2.02 -1.26 0.43 117.35 127.20 1qrk s TYR 718 Ca 0.00 -0.64 -0.30 0.00 -0.37 0.00 0.00 57.07 55.76 1qrk s TYR 718 Cb -0.17 -1.31 0.09 0.00 -0.40 0.00 0.00 41.96 40.18 1qrk s TYR 718 CO -0.04 0.39 0.81 0.20 -1.57 0.00 0.00 175.55 175.35 1qrk s GLY 719 N -3.54 -0.45 0.19 0.71 0.00 -0.71 -3.23 107.32 100.30 1qrk s GLY 719 Ca 0.32 1.58 -0.03 0.00 0.00 0.00 0.00 44.72 46.58 1qrk s GLY 719 CO 0.15 0.95 0.18 -1.83 0.00 0.00 0.00 173.10 172.54 1qrk s GLU 720 N -1.29 1.20 -0.18 2.90 -1.05 -1.26 0.58 118.70 119.61 1qrk s GLU 720 Ca -0.06 -1.51 -0.14 0.00 -0.15 0.00 0.00 54.97 53.10 1qrk s GLU 720 Cb -0.00 0.30 0.05 0.00 -0.44 0.00 0.00 34.13 34.04 1qrk s GLU 720 CO 0.05 -0.41 0.46 -1.17 0.95 0.00 0.00 175.26 175.15 1qrk s LEU 721 N -3.11 0.09 -0.23 1.83 0.20 -0.39 -4.73 118.68 112.34 1qrk s LEU 721 Ca 0.33 0.95 -0.12 0.00 0.69 0.00 0.00 54.13 55.97 1qrk s LEU 721 Cb 0.06 1.56 -0.05 0.00 -0.43 0.00 0.00 46.19 47.33 1qrk s LEU 721 CO 0.09 -0.17 0.25 -1.81 -0.29 0.00 0.00 176.35 174.41 1qrk s ASP 722 N 0.62 6.21 0.16 3.68 1.01 -1.26 -0.31 116.67 126.78 1qrk s ASP 722 Ca -0.03 0.23 0.09 0.00 0.71 0.00 0.00 52.55 53.55 1qrk s ASP 722 Cb -0.05 -2.15 -0.04 0.00 1.01 0.00 0.00 42.92 41.69 1qrk s ASP 722 CO -0.04 -0.00 -0.20 0.68 0.21 0.00 0.00 175.17 175.82 1qrk s VAL 723 N 1.27 1.89 -0.17 -1.27 -7.23 -1.19 -5.00 120.40 108.70 1qrk s VAL 723 Ca 0.11 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 1qrk s VAL 723 Cb -0.14 -1.84 0.03 0.00 0.56 0.00 0.00 36.38 34.99 1qrk s VAL 723 CO 0.06 -0.23 -0.13 -1.10 -0.31 0.00 0.00 175.10 173.40 1qrk s GLN 724 N -2.60 2.18 -0.23 4.82 1.11 -1.26 -0.45 119.66 123.23 1qrk s GLN 724 Ca 0.15 -0.65 -0.09 0.00 0.01 0.00 0.00 55.36 54.78 1qrk s GLN 724 Cb -0.07 -2.20 -0.04 0.00 -1.01 0.00 0.00 33.01 29.68 1qrk s GLN 724 CO 0.07 -0.31 0.12 0.42 0.01 0.00 0.00 175.29 175.60 1qrk s ILE 725 N 1.46 4.98 0.56 1.08 1.01 -0.51 -4.84 121.20 124.93 1qrk s ILE 725 Ca 0.03 0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.67 1qrk s ILE 725 Cb -0.14 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 39.02 1qrk s ILE 725 CO -0.10 0.37 0.86 -1.10 0.00 0.00 0.00 174.94 174.97 1qrk s GLN 726 N 1.03 3.03 0.00 2.79 -1.52 0.22 -0.37 119.66 124.84 1qrk s GLN 726 Ca 0.06 -0.03 0.24 0.00 -1.95 0.00 0.00 55.36 53.67 1qrk s GLN 726 Cb -0.14 -2.32 1.43 0.00 -0.22 0.00 0.00 33.01 31.77 1qrk s GLN 726 CO 0.04 -0.58 1.80 0.54 -0.25 0.00 0.00 175.29 176.84