#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n15 h ALA 7 N 0.00 1.03 0.00 0.00 0.00 -2.03 -1.37 119.26 116.90 1n15 h ALA 7 Ca 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1n15 h ALA 7 Cb 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1n15 h ALA 7 CO 0.00 0.51 -0.20 0.93 0.00 0.00 0.00 179.25 180.49 1n15 h GLU 8 N 0.00 0.00 0.00 0.00 5.08 -2.04 -2.60 114.58 115.02 1n15 h GLU 8 Ca -0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 1n15 h GLU 8 Cb 0.89 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 1n15 h GLU 8 CO 0.05 0.20 -1.69 1.04 -1.00 0.00 0.00 179.01 177.61 1n15 n GLN 9 N -3.29 0.64 -0.02 2.33 1.13 -0.99 -3.26 117.38 113.92 1n15 n GLN 9 Ca 0.01 0.10 -0.12 0.00 -1.94 0.00 0.00 57.00 55.04 1n15 n GLN 9 Cb 0.46 -1.70 -0.08 0.00 0.11 0.00 0.00 30.24 29.03 1n15 n GLN 9 CO 0.00 0.00 0.00 -0.92 -1.44 0.00 0.00 177.06 174.70 1n15 h TYR 10 N 0.00 0.14 -0.91 1.08 3.20 -1.19 -3.05 116.97 116.25 1n15 h TYR 10 Ca -0.20 -0.03 -0.46 0.00 3.14 0.00 0.00 58.73 61.18 1n15 h TYR 10 Cb 1.58 -0.04 -0.28 0.00 1.54 0.00 0.00 36.73 39.54 1n15 h TYR 10 CO 0.00 0.43 0.59 1.04 -1.64 0.00 0.00 178.16 178.57 1n15 n GLN 11 N -4.83 2.22 0.00 1.82 6.02 -0.99 -4.55 117.38 117.07 1n15 n GLN 11 Ca -0.07 -2.77 0.12 0.00 -0.01 0.00 0.00 57.00 54.28 1n15 n GLN 11 Cb 0.21 -2.09 0.15 0.00 1.02 0.00 0.00 30.24 29.53 1n15 n GLN 11 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1n15 n GLY 12 N -0.96 0.37 3.80 1.08 0.00 -1.15 -4.99 105.19 103.34 1n15 n GLY 12 Ca 0.54 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 1n15 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n15 s ALA 13 N -2.22 2.00 0.43 4.61 0.00 -1.26 -5.02 121.76 120.30 1n15 s ALA 13 Ca 0.26 -0.45 -0.23 0.00 0.00 0.00 0.00 51.96 51.53 1n15 s ALA 13 Cb 0.19 -3.04 -0.08 0.00 0.00 0.00 0.00 23.12 20.19 1n15 s ALA 13 CO 0.42 -2.06 1.10 0.00 0.00 0.00 0.00 175.76 175.22 1n15 s ALA 14 N -3.28 3.03 0.49 0.00 0.00 -1.26 -5.00 121.76 115.74 1n15 s ALA 14 Ca 0.63 0.80 -0.22 0.00 0.00 0.00 0.00 51.96 53.17 1n15 s ALA 14 Cb -0.14 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 1n15 s ALA 14 CO 0.53 -0.41 1.16 0.45 0.00 0.00 0.00 175.76 177.49 1n15 s SER 15 N -1.50 5.97 0.11 0.00 0.15 -1.26 -4.90 113.70 112.28 1n15 s SER 15 Ca 0.61 2.27 0.21 0.00 0.70 0.00 0.00 55.95 59.74 1n15 s SER 15 Cb -0.24 -2.60 0.84 0.00 -1.71 0.00 0.00 66.02 62.31 1n15 s SER 15 CO 0.30 -1.06 1.64 0.00 1.20 0.00 0.00 173.24 175.33 1n15 n ALA 16 N -0.82 1.80 -2.34 5.45 0.00 -1.26 -4.72 120.51 118.62 1n15 n ALA 16 Ca 0.09 -0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.10 1n15 n ALA 16 Cb 0.49 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 1n15 n ALA 16 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1n15 s VAL 17 N -3.12 3.87 -0.31 0.00 1.01 -1.26 -5.00 120.40 115.59 1n15 s VAL 17 Ca 0.07 1.31 -0.28 0.00 0.00 0.00 0.00 61.98 63.09 1n15 s VAL 17 Cb 0.11 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.66 1n15 s VAL 17 CO 0.38 0.07 1.00 -0.62 0.00 0.00 0.00 175.10 175.92 1n15 s ASP 18 N 1.28 6.88 0.50 3.32 2.15 -1.26 -4.94 116.67 124.60 1n15 s ASP 18 Ca 0.60 0.99 0.23 0.00 0.43 0.00 0.00 52.55 54.81 1n15 s ASP 18 Cb -0.30 -2.51 1.31 0.00 -0.30 0.00 0.00 42.92 41.12 1n15 s ASP 18 CO 0.28 -0.79 1.96 -0.65 -0.17 0.00 0.00 175.17 175.79 1n15 h PRO 19 N 8.03 0.12 0.00 4.34 0.11 -1.94 -0.51 132.00 142.14 1n15 h PRO 19 Ca -0.21 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1n15 h PRO 19 Cb 1.07 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1n15 h PRO 19 CO 0.99 0.08 0.00 0.00 -0.21 0.00 0.00 178.00 178.86 1n15 h ALA 20 N 1.68 1.00 -0.06 -0.75 0.00 -2.04 -2.51 119.26 116.59 1n15 h ALA 20 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1n15 h ALA 20 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1n15 h ALA 20 CO -0.04 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.93 1n15 n HIS 21 N -2.77 0.05 -3.29 0.00 8.25 -0.20 -4.86 115.22 112.40 1n15 n HIS 21 Ca 0.00 -0.03 -0.41 0.00 -0.26 0.00 0.00 57.72 57.01 1n15 n HIS 21 Cb 0.21 -0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.24 1n15 n HIS 21 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1n15 s VAL 22 N -1.45 5.06 -0.13 1.59 1.01 -0.95 -5.05 120.40 120.49 1n15 s VAL 22 Ca 0.22 0.20 -0.06 0.00 0.00 0.00 0.00 61.98 62.34 1n15 s VAL 22 Cb 0.15 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 1n15 s VAL 22 CO 0.22 -0.20 0.07 0.68 0.00 0.00 0.00 175.10 175.88 1n15 s VAL 23 N 2.28 4.93 0.13 2.92 -7.23 -1.26 -5.00 120.40 117.16 1n15 s VAL 23 Ca 0.16 -0.00 -0.25 0.00 -1.81 0.00 0.00 61.98 60.08 1n15 s VAL 23 Cb -0.16 -3.15 -0.07 0.00 0.56 0.00 0.00 36.38 33.56 1n15 s VAL 23 CO 0.13 0.56 0.78 -0.60 -0.31 0.00 0.00 175.10 175.66 1n15 s ARG 24 N -0.51 4.56 -0.22 4.82 3.52 -1.26 -5.06 118.95 124.79 1n15 s ARG 24 Ca 0.11 1.15 -0.05 0.00 -0.13 0.00 0.00 55.73 56.80 1n15 s ARG 24 Cb -0.12 -3.30 -0.02 0.00 -1.56 0.00 0.00 34.95 29.95 1n15 s ARG 24 CO 0.02 0.47 0.01 0.99 -0.81 0.00 0.00 175.30 175.98 1n15 s THR 25 N -0.76 3.91 -2.42 4.11 2.01 -1.26 -5.04 115.64 116.19 1n15 s THR 25 Ca 0.37 -0.32 0.00 0.00 0.31 0.00 0.00 61.69 62.06 1n15 s THR 25 Cb -0.22 -2.79 0.00 0.00 0.01 0.00 0.00 72.50 69.49 1n15 s THR 25 CO 0.26 0.40 0.00 -3.20 -0.69 0.00 0.00 174.62 171.38 1n15 n ASN 26 N 4.64 0.00 0.00 3.53 2.85 -1.26 -4.91 115.26 120.11 1n15 n ASN 26 Ca -0.17 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.30 1n15 n ASN 26 Cb 0.51 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.53 1n15 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1n15 n GLY 27 N -0.01 1.67 3.87 8.20 0.00 -1.26 -5.12 105.19 112.54 1n15 n GLY 27 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1n15 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n15 s ALA 28 N -2.00 3.39 -0.01 4.61 0.00 -1.26 -5.02 121.76 121.47 1n15 s ALA 28 Ca 0.00 -0.22 -0.30 0.00 0.00 0.00 0.00 51.96 51.44 1n15 s ALA 28 Cb 0.00 -2.65 -0.08 0.00 0.00 0.00 0.00 23.12 20.39 1n15 s ALA 28 CO 0.00 0.09 1.87 -2.14 0.00 0.00 0.00 175.76 175.58 1n15 s PRO 29 N -3.65 4.11 0.23 0.00 0.02 -1.26 -4.92 135.00 129.54 1n15 s PRO 29 Ca 0.51 2.43 -0.32 0.00 0.02 0.00 0.00 61.00 63.64 1n15 s PRO 29 Cb -0.10 -4.11 -0.13 0.00 0.02 0.00 0.00 34.50 30.18 1n15 s PRO 29 CO 0.29 -0.97 1.58 -0.25 -0.33 0.00 0.00 177.00 177.32 1n15 n ASP 30 N 7.57 3.46 -3.79 2.53 8.00 -1.26 -4.91 116.55 128.15 1n15 n ASP 30 Ca 0.19 1.11 -0.13 0.00 0.71 0.00 0.00 54.79 56.68 1n15 n ASP 30 Cb 0.42 -1.51 -0.14 0.00 -0.02 0.00 0.00 41.12 39.87 1n15 n ASP 30 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1n15 s MET 31 N 0.22 0.12 1.31 -1.24 0.23 -1.26 -5.14 119.30 113.54 1n15 s MET 31 Ca 0.71 0.28 -0.19 0.00 -1.03 0.00 0.00 55.69 55.45 1n15 s MET 31 Cb -0.57 -0.06 0.33 0.00 -1.53 0.00 0.00 34.83 33.00 1n15 s MET 31 CO 0.43 -0.09 0.98 -1.54 -2.03 0.00 0.00 175.02 172.77 1n15 s SER 32 N 0.64 -0.17 0.19 -1.18 1.04 -1.26 -4.66 113.70 108.30 1n15 s SER 32 Ca -0.05 1.01 -0.09 0.00 0.48 0.00 0.00 55.95 57.31 1n15 s SER 32 Cb -0.06 -1.50 0.10 0.00 0.10 0.00 0.00 66.02 64.66 1n15 s SER 32 CO -0.03 -4.84 1.69 -0.08 0.98 0.00 0.00 173.24 170.96 1n15 h GLU 33 N -3.06 1.12 -0.08 4.02 4.81 -2.02 -0.98 114.58 118.39 1n15 h GLU 33 Ca -0.49 -0.30 -0.12 0.00 -0.13 0.00 0.00 59.36 58.32 1n15 h GLU 33 Cb 1.33 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 1n15 h GLU 33 CO 0.37 1.02 -0.47 0.66 -0.73 0.00 0.00 179.01 179.85 1n15 h SER 34 N 1.05 0.22 0.21 1.04 4.64 -1.98 -0.85 113.55 117.87 1n15 h SER 34 Ca 0.21 -0.10 -0.21 0.00 -0.47 0.00 0.00 61.79 61.21 1n15 h SER 34 Cb 0.43 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1n15 h SER 34 CO 0.01 0.66 -0.86 -0.33 -0.87 0.00 0.00 176.83 175.45 1n15 h GLU 35 N 0.16 0.49 -0.09 4.77 5.08 -1.86 -1.78 114.58 121.35 1n15 h GLU 35 Ca 0.01 -0.46 -0.20 0.00 -1.00 0.00 0.00 59.36 57.71 1n15 h GLU 35 Cb 0.90 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 1n15 h GLU 35 CO 0.07 1.10 -0.76 0.35 -1.00 0.00 0.00 179.01 178.78 1n15 h PHE 36 N 0.30 0.69 -0.00 4.33 3.57 -1.04 -2.57 116.94 122.22 1n15 h PHE 36 Ca -0.06 -0.31 -0.16 0.00 3.53 0.00 0.00 57.97 60.97 1n15 h PHE 36 Cb 1.47 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 40.08 1n15 h PHE 36 CO 0.06 1.09 -0.76 -0.91 -2.23 0.00 0.00 178.31 175.56 1n15 h ASN 37 N 0.34 0.02 -0.41 0.41 2.35 -1.19 -0.46 115.58 116.65 1n15 h ASN 37 Ca -0.04 -0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.54 1n15 h ASN 37 Cb 1.35 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.70 1n15 h ASN 37 CO 0.14 0.77 -0.34 -0.08 -1.65 0.00 0.00 177.43 176.26 1n15 h GLU 38 N 0.01 0.96 -0.21 0.81 4.81 -1.29 -1.34 114.58 118.33 1n15 h GLU 38 Ca -0.01 -0.48 -0.20 0.00 -0.13 0.00 0.00 59.36 58.54 1n15 h GLU 38 Cb 1.34 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.73 1n15 h GLU 38 CO 0.10 1.14 -0.65 0.00 -0.73 0.00 0.00 179.01 178.87 1n15 h ALA 39 N 0.80 0.45 -0.37 2.92 0.00 -1.41 -2.83 119.26 118.83 1n15 h ALA 39 Ca 0.07 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 1n15 h ALA 39 Cb 0.93 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1n15 h ALA 39 CO 0.09 0.69 -0.04 -0.22 0.00 0.00 0.00 179.25 179.77 1n15 h LYS 40 N 0.56 0.61 -0.36 0.00 3.64 -0.99 -0.21 116.57 119.82 1n15 h LYS 40 Ca -0.02 -0.15 -0.14 0.00 -1.27 0.00 0.00 60.65 59.07 1n15 h LYS 40 Cb 1.26 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 1n15 h LYS 40 CO 0.13 0.66 -0.34 0.37 -2.27 0.00 0.00 179.45 178.01 1n15 h GLN 41 N 0.57 0.81 -0.08 1.90 4.15 -1.19 -2.61 115.11 118.66 1n15 h GLN 41 Ca 0.11 -0.39 -0.12 0.00 0.77 0.00 0.00 58.65 59.03 1n15 h GLN 41 Cb 0.42 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.09 1n15 h GLN 41 CO 0.02 1.02 -0.48 0.82 -1.93 0.00 0.00 178.83 178.28 1n15 h ILE 42 N 0.68 1.34 -0.45 2.39 2.04 -1.18 -2.41 117.51 119.92 1n15 h ILE 42 Ca 0.07 -1.69 -0.11 0.00 1.00 0.00 0.00 64.86 64.13 1n15 h ILE 42 Cb 0.89 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.77 1n15 h ILE 42 CO 0.08 0.50 -0.16 0.22 0.00 0.00 0.00 178.15 178.79 1n15 h TYR 43 N 0.16 1.02 0.00 1.37 3.20 -0.67 0.14 116.97 122.19 1n15 h TYR 43 Ca 0.01 -0.23 -0.11 0.00 3.14 0.00 0.00 58.73 61.53 1n15 h TYR 43 Cb 0.91 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.92 1n15 h TYR 43 CO 0.01 1.01 -0.68 0.74 -1.64 0.00 0.00 178.16 177.61 1n15 h PHE 44 N 0.73 0.00 0.07 -3.82 0.04 -1.50 0.55 116.94 113.00 1n15 h PHE 44 Ca 0.11 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.63 1n15 h PHE 44 Cb 0.71 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.86 1n15 h PHE 44 CO 0.05 0.50 -1.08 1.96 -0.60 0.00 0.00 178.31 179.14 1n15 h GLN 45 N 0.00 0.29 0.00 1.51 4.20 -1.25 -3.40 115.11 116.46 1n15 h GLN 45 Ca -0.03 -0.40 -0.06 0.00 0.06 0.00 0.00 58.65 58.22 1n15 h GLN 45 Cb 1.41 0.13 -0.01 0.00 0.30 0.00 0.00 27.48 29.32 1n15 h GLN 45 CO 0.06 1.13 -1.24 0.54 -0.67 0.00 0.00 178.83 178.66 1n15 n ARG 46 N -3.61 3.03 -0.12 1.46 5.12 0.49 -4.94 116.66 118.10 1n15 n ARG 46 Ca -0.07 0.00 -0.22 0.00 -1.93 0.00 0.00 57.85 55.64 1n15 n ARG 46 Cb 0.93 -1.09 -0.09 0.00 -1.16 0.00 0.00 32.46 31.05 1n15 n ARG 46 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1n15 h ALA 48 N -0.53 1.60 -0.88 0.00 0.00 -0.25 -2.27 119.26 116.92 1n15 h ALA 48 Ca -0.56 0.22 0.24 0.00 0.00 0.00 0.00 54.91 54.81 1n15 h ALA 48 Cb 1.61 0.27 -0.14 0.00 0.00 0.00 0.00 17.79 19.53 1n15 h ALA 48 CO -0.26 -0.54 0.25 0.78 0.00 0.00 0.00 179.25 179.47 1n15 h GLY 49 N 0.23 1.38 0.00 0.00 0.00 -1.83 1.37 103.07 104.22 1n15 h GLY 49 Ca 0.65 -0.04 -0.18 0.00 0.00 0.00 0.00 47.33 47.76 1n15 h GLY 49 CO -0.66 -0.37 -1.16 0.00 0.00 0.00 0.00 176.54 174.35 1n15 h HIS 51 N -1.00 0.00 0.00 0.00 3.86 -1.32 -2.89 115.15 113.80 1n15 h HIS 51 Ca -0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 1n15 h HIS 51 Cb 1.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.58 1n15 h HIS 51 CO -0.02 0.25 0.00 0.41 0.86 0.00 0.00 177.93 179.43 1n15 n GLY 52 N 0.32 -0.88 0.19 2.45 0.00 0.47 0.05 105.19 107.78 1n15 n GLY 52 Ca 0.01 -1.67 -0.10 0.00 0.00 0.00 0.00 46.02 44.26 1n15 n GLY 52 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1n15 h VAL 53 N 0.00 1.21 -0.60 1.61 2.07 -1.97 -2.96 116.25 115.61 1n15 h VAL 53 Ca 0.00 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1n15 h VAL 53 Cb 0.00 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1n15 h VAL 53 CO 0.00 0.24 0.00 0.18 0.02 0.00 0.00 177.57 178.01 1n15 n LEU 54 N -4.63 3.40 -3.19 2.57 4.77 -1.26 -4.82 117.00 113.85 1n15 n LEU 54 Ca -0.01 -1.70 -0.22 0.00 -0.03 0.00 0.00 56.01 54.04 1n15 n LEU 54 Cb 0.18 -0.43 0.05 0.00 -2.33 0.00 0.00 43.42 40.89 1n15 n LEU 54 CO 0.37 0.80 0.11 0.54 -1.33 0.00 0.00 177.39 177.88 1n15 n ARG 55 N 1.24 -6.12 -0.57 3.23 1.74 -1.12 -4.80 116.66 110.26 1n15 n ARG 55 Ca 0.21 0.85 0.05 0.00 -0.77 0.00 0.00 57.85 58.19 1n15 n ARG 55 Cb 0.55 -5.74 0.09 0.00 -1.02 0.00 0.00 32.46 26.34 1n15 n ARG 55 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1n15 n LYS 56 N -4.36 0.71 0.07 5.56 5.02 -0.68 -1.62 118.16 122.85 1n15 n LYS 56 Ca -0.06 -2.12 0.11 0.00 -2.02 0.00 0.00 58.31 54.22 1n15 n LYS 56 Cb 0.59 -0.94 -0.03 0.00 -0.02 0.00 0.00 35.03 34.63 1n15 n LYS 56 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n15 n GLY 57 N -0.58 -1.33 3.97 0.72 0.00 0.11 -4.94 105.19 103.13 1n15 n GLY 57 Ca 0.10 -0.31 -0.21 0.00 0.00 0.00 0.00 46.02 45.59 1n15 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n15 s ALA 58 N -3.38 3.95 1.00 4.61 0.00 -1.09 -4.78 121.76 122.07 1n15 s ALA 58 Ca -0.02 -1.24 -0.13 0.00 0.00 0.00 0.00 51.96 50.57 1n15 s ALA 58 Cb 0.11 -1.97 0.19 0.00 0.00 0.00 0.00 23.12 21.45 1n15 s ALA 58 CO 0.82 -0.31 1.12 0.95 0.00 0.00 0.00 175.76 178.33 1n15 s THR 59 N -2.45 1.96 0.00 0.00 -4.23 -1.26 -4.85 115.64 104.81 1n15 s THR 59 Ca 0.49 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.00 1n15 s THR 59 Cb -0.10 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.15 1n15 s THR 59 CO 0.36 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.05 1n15 n GLY 60 N -1.50 -1.60 3.76 3.99 0.00 -1.26 -4.85 105.19 103.73 1n15 n GLY 60 Ca 0.07 -1.31 -0.39 0.00 0.00 0.00 0.00 46.02 44.38 1n15 n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n15 s LYS 61 N 0.00 4.53 0.67 1.61 1.02 -1.26 -5.03 119.74 121.28 1n15 s LYS 61 Ca 0.00 1.73 -0.15 0.00 0.02 0.00 0.00 55.97 57.58 1n15 s LYS 61 Cb 0.00 -3.05 0.01 0.00 -0.52 0.00 0.00 37.83 34.27 1n15 s LYS 61 CO 0.00 0.14 1.12 -1.25 -0.92 0.00 0.00 175.35 174.43 1n15 s PRO 62 N -1.67 2.73 -0.48 -1.68 0.04 -1.26 -4.95 135.00 127.72 1n15 s PRO 62 Ca 0.47 1.41 -0.01 0.00 0.04 0.00 0.00 61.00 62.91 1n15 s PRO 62 Cb -0.30 -1.94 0.35 0.00 0.04 0.00 0.00 34.50 32.65 1n15 s PRO 62 CO 0.38 -1.31 2.00 1.28 0.04 0.00 0.00 177.00 179.39 1n15 n LEU 63 N -2.49 6.97 -4.86 -3.56 4.77 -0.64 -4.64 117.00 112.55 1n15 n LEU 63 Ca 0.10 -3.73 -0.33 0.00 -0.03 0.00 0.00 56.01 52.03 1n15 n LEU 63 Cb 0.52 -0.99 -0.06 0.00 -2.33 0.00 0.00 43.42 40.56 1n15 n LEU 63 CO 0.48 1.31 0.32 0.42 -1.33 0.00 0.00 177.39 178.59 1n15 s THR 64 N -3.47 4.79 0.54 -5.08 -4.23 -1.26 -4.81 115.64 102.12 1n15 s THR 64 Ca 0.48 0.75 0.38 0.00 -1.18 0.00 0.00 61.69 62.12 1n15 s THR 64 Cb 0.38 -3.63 0.58 0.00 1.34 0.00 0.00 72.50 71.16 1n15 s THR 64 CO 0.00 -0.09 1.76 1.55 -0.54 0.00 0.00 174.62 177.30 1n15 h PRO 65 N 2.52 0.02 -0.44 3.99 0.13 -1.80 -1.17 132.00 135.25 1n15 h PRO 65 Ca -0.47 -0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 1n15 h PRO 65 Cb 1.17 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 1n15 h PRO 65 CO 0.67 0.01 0.20 0.38 -0.23 0.00 0.00 178.00 179.04 1n15 h ASP 66 N 0.02 0.59 0.02 1.44 2.03 -1.93 -1.50 116.42 117.09 1n15 h ASP 66 Ca 0.64 -0.14 -0.06 0.00 -0.73 0.00 0.00 57.03 56.74 1n15 h ASP 66 Cb 2.50 -0.15 0.01 0.00 -0.83 0.00 0.00 39.33 40.86 1n15 h ASP 66 CO -0.03 0.56 -0.25 0.40 -1.03 0.00 0.00 179.24 178.88 1n15 h ILE 67 N 0.57 1.60 -0.63 4.15 5.03 -1.57 -3.23 117.51 123.44 1n15 h ILE 67 Ca 0.15 -2.10 -0.03 0.00 -0.12 0.00 0.00 64.86 62.76 1n15 h ILE 67 Cb 0.14 2.97 -0.03 0.00 -3.03 0.00 0.00 36.82 36.86 1n15 h ILE 67 CO -0.02 0.57 0.27 0.71 -0.68 0.00 0.00 178.15 179.01 1n15 h THR 68 N -0.61 1.21 0.00 -0.27 1.35 -1.25 -1.29 112.91 112.06 1n15 h THR 68 Ca -0.04 -0.64 -0.10 0.00 -0.55 0.00 0.00 66.41 65.09 1n15 h THR 68 Cb 1.07 0.44 -0.01 0.00 -1.73 0.00 0.00 68.15 67.92 1n15 h THR 68 CO 0.05 0.26 -0.46 1.56 -0.25 0.00 0.00 175.52 176.68 1n15 h GLN 69 N 0.89 0.00 -0.31 4.72 4.20 -1.43 -1.54 115.11 121.64 1n15 h GLN 69 Ca 0.22 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.79 1n15 h GLN 69 Cb 0.14 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.91 1n15 h GLN 69 CO -0.02 0.46 -0.35 0.37 -0.67 0.00 0.00 178.83 178.62 1n15 h GLN 70 N 0.00 0.79 -0.26 1.46 4.15 -1.39 -3.16 115.11 116.71 1n15 h GLN 70 Ca -0.00 -0.43 -0.07 0.00 0.77 0.00 0.00 58.65 58.92 1n15 h GLN 70 Cb 0.99 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.70 1n15 h GLN 70 CO 0.06 1.06 -0.10 0.00 -1.93 0.00 0.00 178.83 177.92 1n15 h ARG 71 N 0.56 0.52 0.00 1.69 2.47 -1.07 -3.50 114.38 115.05 1n15 h ARG 71 Ca 0.05 -0.21 0.00 0.00 -1.26 0.00 0.00 59.98 58.55 1n15 h ARG 71 Cb 0.93 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.23 1n15 h ARG 71 CO 0.08 0.76 0.00 0.41 0.56 0.00 0.00 179.97 181.78 1n15 n GLY 72 N -0.08 1.73 0.10 0.04 0.00 -0.60 -4.32 105.19 102.06 1n15 n GLY 72 Ca -0.04 -1.91 -0.09 0.00 0.00 0.00 0.00 46.02 43.99 1n15 n GLY 72 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1n15 h GLN 73 N 0.00 0.02 -0.41 1.61 5.75 -1.89 -2.63 115.11 117.56 1n15 h GLN 73 Ca 0.00 -0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.38 1n15 h GLN 73 Cb 0.00 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 1n15 h GLN 73 CO 0.00 0.01 -0.21 1.96 -2.65 0.00 0.00 178.83 177.94 1n15 h GLN 74 N 0.02 0.81 -0.29 1.69 1.08 -1.99 -1.40 115.11 115.03 1n15 h GLN 74 Ca 0.09 -0.32 -0.01 0.00 -1.45 0.00 0.00 58.65 56.95 1n15 h GLN 74 Cb 0.13 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.51 1n15 h GLN 74 CO -0.18 0.95 0.13 -0.92 -0.95 0.00 0.00 178.83 177.86 1n15 h TYR 75 N 0.71 0.42 -0.30 2.96 5.03 -1.73 -1.83 116.97 122.22 1n15 h TYR 75 Ca 0.10 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.37 1n15 h TYR 75 Cb 0.73 -0.13 -0.01 0.00 1.55 0.00 0.00 36.73 38.86 1n15 h TYR 75 CO 0.04 0.39 0.14 -0.07 -1.32 0.00 0.00 178.16 177.35 1n15 h LEU 76 N 0.32 0.40 -1.07 2.82 3.38 -1.39 -0.39 115.31 119.39 1n15 h LEU 76 Ca 0.10 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.97 1n15 h LEU 76 Cb 0.14 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1n15 h LEU 76 CO -0.01 0.42 0.63 -0.33 0.09 0.00 0.00 178.44 179.24 1n15 h GLU 77 N 0.36 1.19 -0.19 1.13 5.08 -1.16 0.14 114.58 121.12 1n15 h GLU 77 Ca 0.10 -0.07 -0.20 0.00 -1.00 0.00 0.00 59.36 58.19 1n15 h GLU 77 Cb 0.13 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.11 1n15 h GLU 77 CO -0.01 0.78 -0.67 0.00 -1.00 0.00 0.00 179.01 178.11 1n15 h ALA 78 N 1.44 0.45 -0.31 3.43 0.00 -1.10 -0.73 119.26 122.44 1n15 h ALA 78 Ca 0.37 -0.56 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1n15 h ALA 78 Cb -0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1n15 h ALA 78 CO -0.11 0.70 -0.04 1.25 0.00 0.00 0.00 179.25 181.05 1n15 h LEU 79 N 0.53 0.57 -0.66 0.00 6.46 -0.54 -0.44 115.31 121.24 1n15 h LEU 79 Ca -0.02 -0.34 -0.07 0.00 -0.12 0.00 0.00 57.88 57.33 1n15 h LEU 79 Cb 1.27 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 41.02 1n15 h LEU 79 CO 0.14 0.77 0.14 0.40 -0.62 0.00 0.00 178.44 179.27 1n15 h ILE 80 N 0.35 1.26 -0.42 4.05 2.04 -0.75 0.48 117.51 124.52 1n15 h ILE 80 Ca 0.08 -0.97 -0.01 0.00 1.00 0.00 0.00 64.86 64.96 1n15 h ILE 80 Cb 0.51 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1n15 h ILE 80 CO 0.02 0.37 0.23 0.74 0.00 0.00 0.00 178.15 179.51 1n15 h THR 81 N 0.98 1.16 0.00 -0.27 2.02 -0.92 -1.26 112.91 114.62 1n15 h THR 81 Ca 0.20 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1n15 h THR 81 Cb 0.39 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1n15 h THR 81 CO 0.01 0.16 -1.01 -1.22 0.37 0.00 0.00 175.52 173.83 1n15 n TYR 82 N -4.72 0.00 -4.50 3.16 4.01 -0.19 -1.23 117.16 113.70 1n15 n TYR 82 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1n15 n TYR 82 Cb 0.08 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 1n15 n TYR 82 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1n15 n GLY 83 N 1.50 -0.23 3.30 2.72 0.00 0.17 -4.21 105.19 108.44 1n15 n GLY 83 Ca 0.00 -1.05 -0.09 0.00 0.00 0.00 0.00 46.02 44.88 1n15 n GLY 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1n15 s THR 84 N 0.00 0.09 -2.08 2.61 -4.23 -0.01 -4.89 115.64 107.13 1n15 s THR 84 Ca 0.00 -1.31 0.27 0.00 -1.18 0.00 0.00 61.69 59.46 1n15 s THR 84 Cb 0.00 -1.68 0.71 0.00 1.34 0.00 0.00 72.50 72.87 1n15 s THR 84 CO 0.00 -0.40 1.96 -0.81 -0.54 0.00 0.00 174.62 174.83 1n15 n PRO 85 N -0.17 1.13 -0.80 3.99 -0.04 -1.26 -3.71 135.00 134.14 1n15 n PRO 85 Ca -0.10 -0.20 0.06 0.00 -0.04 0.00 0.00 63.50 63.22 1n15 n PRO 85 Cb 0.63 -1.42 0.36 0.00 -0.04 0.00 0.00 33.50 33.02 1n15 n PRO 85 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1n15 n LEU 86 N -0.69 5.22 0.00 1.53 4.77 -1.26 -4.88 117.00 121.68 1n15 n LEU 86 Ca 0.20 -2.65 0.00 0.00 -0.03 0.00 0.00 56.01 53.53 1n15 n LEU 86 Cb 0.14 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 1n15 n LEU 86 CO 0.15 0.59 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 1n15 n GLY 87 N 0.53 0.85 3.41 -0.72 0.00 -1.25 -5.04 105.19 102.97 1n15 n GLY 87 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 1n15 n GLY 87 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1n15 s MET 88 N -0.41 2.89 0.72 1.61 0.00 -1.24 -5.01 119.30 117.86 1n15 s MET 88 Ca 0.00 -1.09 -0.15 0.00 0.00 0.00 0.00 55.69 54.45 1n15 s MET 88 Cb 0.00 -3.88 0.03 0.00 0.00 0.00 0.00 34.83 30.98 1n15 s MET 88 CO 0.00 -0.76 1.21 -1.25 0.00 0.00 0.00 175.02 174.22 1n15 s PRO 89 N 1.62 2.22 -0.32 4.11 0.04 -1.26 -0.83 135.00 140.58 1n15 s PRO 89 Ca 0.04 1.78 -0.19 0.00 0.04 0.00 0.00 61.00 62.67 1n15 s PRO 89 Cb -0.20 -1.84 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 1n15 s PRO 89 CO 0.08 -1.78 0.56 0.54 0.04 0.00 0.00 177.00 176.45 1n15 s ASN 90 N -1.97 6.41 0.09 6.66 2.20 -1.26 -3.99 114.94 123.08 1n15 s ASN 90 Ca 0.75 0.25 0.23 0.00 -0.94 0.00 0.00 52.86 53.14 1n15 s ASN 90 Cb -0.30 -2.30 -0.06 0.00 -2.00 0.00 0.00 41.25 36.60 1n15 s ASN 90 CO 0.44 -0.45 0.91 0.79 -2.94 0.00 0.00 177.10 175.85 1n15 n TRP 91 N 5.78 0.49 -0.12 1.54 7.02 -0.47 -3.77 117.44 127.91 1n15 n TRP 91 Ca -0.03 0.14 -0.26 0.00 -1.02 0.00 0.00 57.50 56.34 1n15 n TRP 91 Cb 0.49 -0.67 -0.11 0.00 -2.42 0.00 0.00 31.31 28.60 1n15 n TRP 91 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1n15 n GLY 92 N 1.27 -0.57 0.19 6.99 0.00 -0.36 -0.99 105.19 111.71 1n15 n GLY 92 Ca -0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 46.02 45.88 1n15 n GLY 92 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1n15 h SER 93 N -0.82 0.44 0.05 1.61 0.02 -1.65 -1.35 113.55 111.84 1n15 h SER 93 Ca -0.57 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.34 1n15 h SER 93 Cb 1.58 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 64.02 1n15 h SER 93 CO -0.29 0.31 -0.12 0.77 -1.14 0.00 0.00 176.83 176.36 1n15 h SER 94 N 0.54 0.15 0.00 3.07 4.64 -1.79 -3.46 113.55 116.69 1n15 h SER 94 Ca 0.17 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1n15 h SER 94 Cb -0.00 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1n15 h SER 94 CO -0.07 0.29 0.00 0.61 -0.87 0.00 0.00 176.83 176.79 1n15 n GLY 95 N -0.98 0.75 0.16 -0.77 0.00 -0.51 -4.99 105.19 98.84 1n15 n GLY 95 Ca -0.01 -0.32 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 1n15 n GLY 95 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1n15 h GLU 96 N 0.88 0.45 -6.76 1.61 4.57 -1.70 -3.45 114.58 110.18 1n15 h GLU 96 Ca 0.00 -0.22 -0.68 0.00 -1.18 0.00 0.00 59.36 57.27 1n15 h GLU 96 Cb 0.00 0.00 -0.20 0.00 -0.16 0.00 0.00 28.75 28.39 1n15 h GLU 96 CO 0.00 0.78 -0.82 -0.51 -1.18 0.00 0.00 179.01 177.28 1n15 s LEU 97 N -9.12 2.59 0.67 1.64 1.43 -0.16 -5.06 118.68 110.67 1n15 s LEU 97 Ca -0.14 -0.60 -0.09 0.00 -1.03 0.00 0.00 54.13 52.28 1n15 s LEU 97 Cb 0.06 -1.46 0.03 0.00 0.03 0.00 0.00 46.19 44.85 1n15 s LEU 97 CO 0.77 0.18 1.02 -0.94 0.23 0.00 0.00 176.35 177.61 1n15 s SER 98 N -2.08 5.32 0.55 2.29 1.04 -1.26 -4.49 113.70 115.07 1n15 s SER 98 Ca 0.17 0.84 0.33 0.00 0.48 0.00 0.00 55.95 57.77 1n15 s SER 98 Cb -0.10 -1.66 1.52 0.00 0.10 0.00 0.00 66.02 65.88 1n15 s SER 98 CO 0.09 -1.33 2.05 0.11 0.98 0.00 0.00 173.24 175.14 1n15 h LYS 99 N -0.50 0.00 0.05 4.02 1.79 -1.97 -0.31 116.57 119.66 1n15 h LYS 99 Ca -0.45 0.00 -0.24 0.00 -2.18 0.00 0.00 60.65 57.78 1n15 h LYS 99 Cb 1.27 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.92 1n15 h LYS 99 CO 0.62 0.06 -1.05 0.93 -1.08 0.00 0.00 179.45 178.93 1n15 h GLU 100 N 0.00 0.28 -0.01 3.15 3.07 -1.99 -2.37 114.58 116.70 1n15 h GLU 100 Ca -0.00 -0.37 -0.20 0.00 -0.50 0.00 0.00 59.36 58.29 1n15 h GLU 100 Cb 0.42 0.12 0.02 0.00 -0.84 0.00 0.00 28.75 28.46 1n15 h GLU 100 CO 0.01 1.10 -0.78 1.96 -1.40 0.00 0.00 179.01 179.90 1n15 h GLN 101 N 0.12 0.55 -0.32 2.33 4.20 -1.74 -2.58 115.11 117.67 1n15 h GLN 101 Ca -0.09 -0.58 -0.02 0.00 0.06 0.00 0.00 58.65 58.03 1n15 h GLN 101 Cb 1.72 0.16 -0.02 0.00 0.30 0.00 0.00 27.48 29.65 1n15 h GLN 101 CO 0.17 1.20 0.13 0.82 -0.67 0.00 0.00 178.83 180.48 1n15 h ILE 102 N 0.13 1.13 -0.36 2.54 2.04 -1.13 0.15 117.51 122.00 1n15 h ILE 102 Ca -0.09 -0.39 -0.10 0.00 1.00 0.00 0.00 64.86 65.28 1n15 h ILE 102 Cb 1.46 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1n15 h ILE 102 CO 0.15 0.15 -0.15 0.74 0.00 0.00 0.00 178.15 179.05 1n15 h THR 103 N 0.44 1.28 -0.56 -0.27 2.02 -1.39 -1.84 112.91 112.60 1n15 h THR 103 Ca 0.11 -1.26 -0.08 0.00 0.77 0.00 0.00 66.41 65.96 1n15 h THR 103 Cb 0.09 1.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 1n15 h THR 103 CO -0.01 0.41 0.04 -0.07 0.37 0.00 0.00 175.52 176.26 1n15 h LEU 104 N 0.53 0.89 -0.76 2.58 3.38 -0.80 -2.61 115.31 118.51 1n15 h LEU 104 Ca 0.08 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1n15 h LEU 104 Cb 0.68 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1n15 h LEU 104 CO 0.05 0.93 0.27 0.24 0.09 0.00 0.00 178.44 180.02 1n15 h MET 105 N 0.86 1.16 -0.66 1.13 2.86 -0.55 0.09 114.93 119.82 1n15 h MET 105 Ca 0.17 -0.23 -0.07 0.00 -2.06 0.00 0.00 59.70 57.51 1n15 h MET 105 Cb 0.46 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 1n15 h MET 105 CO 0.02 0.97 0.14 0.00 1.06 0.00 0.00 176.91 179.09 1n15 h ALA 106 N 1.14 0.99 -0.24 6.32 0.00 -1.09 -2.20 119.26 124.18 1n15 h ALA 106 Ca 0.25 -0.25 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 1n15 h ALA 106 Cb 0.26 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1n15 h ALA 106 CO -0.01 0.65 -0.59 0.87 0.00 0.00 0.00 179.25 180.16 1n15 h LYS 107 N 1.00 0.79 -0.06 0.00 1.57 -1.21 -3.29 116.57 115.38 1n15 h LYS 107 Ca 0.21 -0.53 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1n15 h LYS 107 Cb 0.39 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 1n15 h LYS 107 CO 0.01 1.16 0.03 -0.92 -0.57 0.00 0.00 179.45 179.15 1n15 h TYR 108 N 0.60 0.06 0.00 -1.35 3.20 -0.74 -2.16 116.97 116.58 1n15 h TYR 108 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1n15 h TYR 108 Cb 1.19 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.45 1n15 h TYR 108 CO 0.07 0.04 0.00 0.44 -1.64 0.00 0.00 178.16 177.07 1n15 n ILE 109 N -5.06 0.49 1.21 1.81 -5.35 -0.85 -1.52 119.36 110.10 1n15 n ILE 109 Ca -0.06 0.12 0.13 0.00 -0.27 0.00 0.00 62.75 62.67 1n15 n ILE 109 Cb 0.03 -0.88 0.36 0.00 -1.74 0.00 0.00 39.64 37.41 1n15 n ILE 109 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1n15 n GLN 110 N -1.24 0.70 -3.82 6.28 6.02 -0.81 -4.04 117.38 120.47 1n15 n GLN 110 Ca 0.08 -0.41 -0.21 0.00 -0.01 0.00 0.00 57.00 56.45 1n15 n GLN 110 Cb 0.11 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 29.86 1n15 n GLN 110 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1n15 s HIS 111 N -2.58 3.38 0.34 1.08 3.76 -0.57 -4.54 115.29 116.15 1n15 s HIS 111 Ca 0.22 -0.04 -0.29 0.00 -0.15 0.00 0.00 55.06 54.81 1n15 s HIS 111 Cb 0.19 -1.69 -0.11 0.00 1.11 0.00 0.00 32.58 32.09 1n15 s HIS 111 CO 0.55 0.32 1.44 0.99 -0.85 0.00 0.00 174.74 177.19 1n15 s THR 112 N -2.05 2.31 0.13 1.30 2.01 -1.26 -4.55 115.64 113.53 1n15 s THR 112 Ca 0.37 0.30 -0.31 0.00 0.31 0.00 0.00 61.69 62.36 1n15 s THR 112 Cb -0.09 -3.19 -0.10 0.00 0.01 0.00 0.00 72.50 69.13 1n15 s THR 112 CO 0.30 0.07 1.71 -2.84 -0.69 0.00 0.00 174.62 173.16 1n15 s PRO 113 N -1.61 4.17 0.75 4.92 0.02 -1.26 -4.97 135.00 137.02 1n15 s PRO 113 Ca 0.54 2.47 -0.15 0.00 0.02 0.00 0.00 61.00 63.87 1n15 s PRO 113 Cb -0.44 -3.43 0.05 0.00 0.02 0.00 0.00 34.50 30.69 1n15 s PRO 113 CO 0.56 -0.75 1.19 -2.30 -0.33 0.00 0.00 177.00 175.37 1n15 n PRO 114 N 5.07 0.48 -3.81 5.54 -0.02 -1.26 -4.98 135.00 136.01 1n15 n PRO 114 Ca 0.16 0.23 -0.36 0.00 -2.02 0.00 0.00 63.50 61.51 1n15 n PRO 114 Cb 0.39 -2.43 -0.11 0.00 -0.02 0.00 0.00 33.50 31.32 1n15 n PRO 114 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1n15 s GLN 115 N -3.79 3.83 0.50 -0.52 -1.52 -1.26 -4.93 119.66 111.97 1n15 s GLN 115 Ca 0.76 -0.40 -0.15 0.00 -1.95 0.00 0.00 55.36 53.62 1n15 s GLN 115 Cb -0.32 -3.36 -0.08 0.00 -0.22 0.00 0.00 33.01 29.04 1n15 s GLN 115 CO 0.48 -0.02 0.96 -2.14 -0.25 0.00 0.00 175.29 174.31 1n15 s PRO 116 N 1.20 3.91 0.82 2.91 0.02 -1.26 -5.01 135.00 137.58 1n15 s PRO 116 Ca 0.05 0.88 -0.12 0.00 0.02 0.00 0.00 61.00 61.83 1n15 s PRO 116 Cb -0.14 -2.17 0.09 0.00 0.02 0.00 0.00 34.50 32.29 1n15 s PRO 116 CO 0.04 -0.25 1.15 -1.25 -0.33 0.00 0.00 177.00 176.36 1n15 s PRO 117 N -4.08 1.72 0.96 5.54 0.04 -1.26 -5.04 135.00 132.87 1n15 s PRO 117 Ca 0.58 1.52 -0.15 0.00 0.04 0.00 0.00 61.00 62.99 1n15 s PRO 117 Cb -0.10 -1.81 0.21 0.00 0.04 0.00 0.00 34.50 32.84 1n15 s PRO 117 CO 0.32 -2.11 1.31 -1.21 0.04 0.00 0.00 177.00 175.35 1n15 s GLU 118 N -4.46 0.56 -0.40 4.56 0.41 -1.26 -4.80 118.70 113.30 1n15 s GLU 118 Ca 0.68 -0.59 0.06 0.00 -0.41 0.00 0.00 54.97 54.71 1n15 s GLU 118 Cb -0.23 -1.89 0.17 0.00 -1.78 0.00 0.00 34.13 30.40 1n15 s GLU 118 CO 0.53 -2.43 0.54 -0.46 -0.49 0.00 0.00 175.26 172.95 1n15 s TRP 119 N -3.85 -1.18 0.00 1.61 -0.11 -1.26 -5.01 118.94 109.15 1n15 s TRP 119 Ca 0.75 -0.21 0.00 0.00 1.22 0.00 0.00 56.10 57.86 1n15 s TRP 119 Cb -0.03 0.04 0.00 0.00 -1.50 0.00 0.00 33.47 31.99 1n15 s TRP 119 CO 0.53 -1.11 0.00 0.41 -4.62 0.00 0.00 176.95 172.16 1n15 n GLY 120 N 4.25 3.58 0.36 5.86 0.00 -1.26 -4.83 105.19 113.15 1n15 n GLY 120 Ca 0.12 -2.03 0.09 0.00 0.00 0.00 0.00 46.02 44.20 1n15 n GLY 120 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1n15 h MET 121 N 0.00 0.87 -0.42 1.61 4.05 -2.01 0.10 114.93 119.13 1n15 h MET 121 Ca 0.00 -0.05 -0.03 0.00 -0.28 0.00 0.00 59.70 59.34 1n15 h MET 121 Cb 0.00 -0.20 -0.02 0.00 -0.80 0.00 0.00 31.60 30.59 1n15 h MET 121 CO 0.00 0.57 0.15 -1.35 0.23 0.00 0.00 176.91 176.51 1n15 h PRO 122 N 0.89 0.64 -0.36 0.39 0.11 -1.99 -0.59 132.00 131.09 1n15 h PRO 122 Ca 0.52 -0.13 -0.11 0.00 0.11 0.00 0.00 66.00 66.40 1n15 h PRO 122 Cb 0.64 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 1n15 h PRO 122 CO -0.31 0.62 -0.22 0.93 -0.21 0.00 0.00 178.00 178.80 1n15 h GLU 123 N 0.54 0.70 -0.26 1.05 3.07 -1.75 -1.77 114.58 116.15 1n15 h GLU 123 Ca 0.14 -0.27 -0.05 0.00 -0.50 0.00 0.00 59.36 58.67 1n15 h GLU 123 Cb 0.23 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 1n15 h GLU 123 CO -0.01 0.86 -0.03 0.52 -1.40 0.00 0.00 179.01 178.96 1n15 h MET 124 N 0.61 0.48 -0.53 2.33 2.86 -0.62 -2.87 114.93 117.20 1n15 h MET 124 Ca 0.09 -0.17 -0.12 0.00 -2.06 0.00 0.00 59.70 57.45 1n15 h MET 124 Cb 0.71 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.32 1n15 h MET 124 CO 0.05 0.67 -0.12 0.00 1.06 0.00 0.00 176.91 178.57 1n15 h ARG 125 N 0.25 1.01 -0.56 1.72 3.08 -1.04 -1.38 114.38 117.45 1n15 h ARG 125 Ca 0.07 -0.38 0.08 0.00 0.07 0.00 0.00 59.98 59.82 1n15 h ARG 125 Cb 0.47 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 1n15 h ARG 125 CO 0.02 1.06 0.38 1.49 -1.07 0.00 0.00 179.97 181.84 1n15 h GLU 126 N 0.89 0.43 0.00 0.04 4.57 -1.30 -1.65 114.58 117.55 1n15 h GLU 126 Ca 0.14 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 1n15 h GLU 126 Cb 0.69 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 1n15 h GLU 126 CO 0.05 0.28 -0.89 -1.13 -1.18 0.00 0.00 179.01 176.14 1n15 n SER 127 N -4.47 0.67 -4.72 1.04 3.41 -1.00 -4.89 113.62 103.65 1n15 n SER 127 Ca 0.09 0.02 -0.42 0.00 -0.26 0.00 0.00 58.87 58.30 1n15 n SER 127 Cb 0.31 0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 64.75 1n15 n SER 127 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 1n15 s TRP 128 N -3.22 3.19 -0.04 7.33 -0.00 -0.55 -4.25 118.94 121.39 1n15 s TRP 128 Ca 0.04 0.87 -0.00 0.00 -0.00 0.00 0.00 56.10 57.00 1n15 s TRP 128 Cb 0.13 -3.75 0.03 0.00 -0.00 0.00 0.00 33.47 29.87 1n15 s TRP 128 CO 0.77 -2.67 0.02 0.15 -0.00 0.00 0.00 176.95 175.21 1n15 s LYS 129 N 1.02 0.26 -0.42 5.86 1.02 -0.21 -4.99 119.74 122.27 1n15 s LYS 129 Ca 0.66 0.16 -0.18 0.00 0.02 0.00 0.00 55.97 56.63 1n15 s LYS 129 Cb -0.39 -0.57 0.02 0.00 -0.52 0.00 0.00 37.83 36.37 1n15 s LYS 129 CO 0.31 -0.21 0.46 0.08 -0.92 0.00 0.00 175.35 175.07 1n15 s VAL 130 N 1.47 5.06 0.05 3.17 1.01 -1.26 -1.61 120.40 128.30 1n15 s VAL 130 Ca -0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.65 1n15 s VAL 130 Cb -0.13 -4.05 -0.28 0.00 0.00 0.00 0.00 36.38 31.93 1n15 s VAL 130 CO -0.03 -0.42 1.06 -0.07 0.00 0.00 0.00 175.10 175.64 1n15 h LEU 131 N 9.11 0.40 -7.14 3.92 3.38 -0.24 -3.44 115.31 121.30 1n15 h LEU 131 Ca -0.26 -0.46 -0.41 0.00 0.09 0.00 0.00 57.88 56.84 1n15 h LEU 131 Cb 1.11 -0.13 -0.40 0.00 0.09 0.00 0.00 40.66 41.34 1n15 h LEU 131 CO 0.80 1.37 -0.73 -0.69 0.09 0.00 0.00 178.44 179.28 1n15 s VAL 132 N -2.65 -0.12 0.54 1.22 1.01 -0.61 -4.99 120.40 114.80 1n15 s VAL 132 Ca -0.05 0.09 -0.22 0.00 0.00 0.00 0.00 61.98 61.80 1n15 s VAL 132 Cb 0.07 -0.41 -0.05 0.00 0.00 0.00 0.00 36.38 35.99 1n15 s VAL 132 CO 0.87 -0.08 1.36 -0.54 0.00 0.00 0.00 175.10 176.72 1n15 s LYS 133 N 2.17 3.17 0.28 2.72 1.02 -1.26 -4.83 119.74 123.01 1n15 s LYS 133 Ca 0.03 2.25 0.02 0.00 0.02 0.00 0.00 55.97 58.29 1n15 s LYS 133 Cb -0.14 -2.28 0.68 0.00 -0.52 0.00 0.00 37.83 35.57 1n15 s LYS 133 CO -0.07 -1.17 1.67 -1.35 -0.92 0.00 0.00 175.35 173.51 1n15 h PRO 134 N 1.50 0.29 -0.17 -1.68 0.11 -1.96 0.36 132.00 130.46 1n15 h PRO 134 Ca -0.51 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 1n15 h PRO 134 Cb 1.30 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1n15 h PRO 134 CO 0.57 0.19 -0.19 1.05 -0.21 0.00 0.00 178.00 179.42 1n15 h GLU 135 N 0.30 0.29 -0.16 1.05 9.09 -2.00 -2.54 114.58 120.61 1n15 h GLU 135 Ca 0.54 -0.08 0.00 0.00 0.05 0.00 0.00 59.36 59.86 1n15 h GLU 135 Cb 1.03 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 28.10 1n15 h GLU 135 CO -0.58 0.48 0.00 -0.25 0.05 0.00 0.00 179.01 178.71 1n15 n ASP 136 N -4.20 1.06 -4.90 3.06 9.92 0.09 -4.87 116.55 116.71 1n15 n ASP 136 Ca -0.01 -1.83 -0.32 0.00 -0.53 0.00 0.00 54.79 52.10 1n15 n ASP 136 Cb 0.33 -0.11 -0.05 0.00 -0.64 0.00 0.00 41.12 40.65 1n15 n ASP 136 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1n15 s ARG 137 N -1.78 3.59 0.67 -1.24 0.52 -0.96 -4.88 118.95 114.87 1n15 s ARG 137 Ca 0.21 -0.14 -0.17 0.00 -0.52 0.00 0.00 55.73 55.11 1n15 s ARG 137 Cb 0.11 -2.92 -0.05 0.00 0.52 0.00 0.00 34.95 32.61 1n15 s ARG 137 CO 0.16 0.52 0.66 -2.30 0.02 0.00 0.00 175.30 174.36 1n15 n PRO 138 N 0.29 0.48 0.00 3.54 -0.02 -1.26 -4.92 135.00 133.10 1n15 n PRO 138 Ca -0.04 0.20 0.10 0.00 -2.02 0.00 0.00 63.50 61.74 1n15 n PRO 138 Cb 0.52 -1.91 -0.07 0.00 -0.02 0.00 0.00 33.50 32.02 1n15 n PRO 138 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1n15 n LYS 139 N -0.78 0.14 -4.15 -0.52 5.02 -1.26 -4.97 118.16 111.64 1n15 n LYS 139 Ca 0.12 -0.11 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 1n15 n LYS 139 Cb 0.49 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.91 1n15 n LYS 139 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1n15 s LYS 140 N -2.94 1.30 -0.38 1.97 1.02 -1.26 -5.11 119.74 114.35 1n15 s LYS 140 Ca 0.10 -1.54 -0.29 0.00 0.02 0.00 0.00 55.97 54.26 1n15 s LYS 140 Cb 0.16 0.32 0.00 0.00 -0.52 0.00 0.00 37.83 37.80 1n15 s LYS 140 CO 0.82 -0.46 1.51 -1.14 -0.92 0.00 0.00 175.35 175.16 1n15 s GLN 141 N -4.11 3.55 -0.11 1.68 0.74 -1.26 -4.78 119.66 115.37 1n15 s GLN 141 Ca 0.35 1.11 0.04 0.00 0.05 0.00 0.00 55.36 56.91 1n15 s GLN 141 Cb 0.05 -4.06 0.28 0.00 1.10 0.00 0.00 33.01 30.39 1n15 s GLN 141 CO 0.11 -1.59 1.07 1.28 -0.55 0.00 0.00 175.29 175.62 1n15 n LEU 142 N 9.06 3.25 -4.19 3.68 4.77 0.15 -4.89 117.00 128.84 1n15 n LEU 142 Ca 0.18 -1.66 -0.13 0.00 -0.03 0.00 0.00 56.01 54.37 1n15 n LEU 142 Cb 0.47 -0.59 -0.09 0.00 -2.33 0.00 0.00 43.42 40.89 1n15 n LEU 142 CO 0.69 0.49 -0.16 0.54 -1.33 0.00 0.00 177.39 177.62 1n15 s ASN 143 N -0.14 0.38 0.00 -1.43 2.20 -1.26 -4.25 114.94 110.44 1n15 s ASN 143 Ca 0.20 -1.40 0.24 0.00 -0.94 0.00 0.00 52.86 50.96 1n15 s ASN 143 Cb 0.16 0.44 0.45 0.00 -2.00 0.00 0.00 41.25 40.30 1n15 s ASN 143 CO 0.05 -0.92 1.41 0.47 -2.94 0.00 0.00 177.10 175.16 1n15 n ASP 144 N -0.52 2.86 -4.74 3.54 8.00 -1.26 -5.00 116.55 119.43 1n15 n ASP 144 Ca 0.02 -1.91 -0.39 0.00 0.71 0.00 0.00 54.79 53.23 1n15 n ASP 144 Cb 0.65 -0.11 0.04 0.00 -0.02 0.00 0.00 41.12 41.67 1n15 n ASP 144 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1n15 n LEU 145 N 1.16 5.43 -4.42 0.64 4.77 -1.26 -4.93 117.00 118.39 1n15 n LEU 145 Ca 0.17 1.00 -0.44 0.00 -0.03 0.00 0.00 56.01 56.70 1n15 n LEU 145 Cb 0.54 -1.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 1n15 n LEU 145 CO 0.15 -0.54 1.23 -0.67 -1.33 0.00 0.00 177.39 176.23 1n15 n ASP 146 N -0.87 5.32 -0.28 -1.43 2.03 -1.26 -4.89 116.55 115.17 1n15 n ASP 146 Ca 0.10 -3.00 0.08 0.00 0.52 0.00 0.00 54.79 52.48 1n15 n ASP 146 Cb 0.44 -1.51 0.23 0.00 -0.72 0.00 0.00 41.12 39.56 1n15 n ASP 146 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1n15 h LEU 147 N 8.75 0.35 -1.44 -2.67 3.38 -1.96 -2.47 115.31 119.25 1n15 h LEU 147 Ca 0.28 0.12 0.08 0.00 0.09 0.00 0.00 57.88 58.45 1n15 h LEU 147 Cb 0.86 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 1n15 h LEU 147 CO 1.19 0.11 0.47 -0.65 0.09 0.00 0.00 178.44 179.64 1n15 h PRO 148 N 0.48 0.62 -0.65 1.13 0.11 -1.93 -2.23 132.00 129.52 1n15 h PRO 148 Ca 0.47 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.48 1n15 h PRO 148 Cb 0.75 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.68 1n15 h PRO 148 CO -0.43 0.41 0.07 -1.71 -0.21 0.00 0.00 178.00 176.13 1n15 n ASN 149 N -4.49 5.25 -4.83 -2.05 5.15 -0.94 -0.88 115.26 112.48 1n15 n ASN 149 Ca 0.11 -2.94 -0.34 0.00 -0.60 0.00 0.00 54.58 50.81 1n15 n ASN 149 Cb 0.30 -0.69 -0.06 0.00 -0.53 0.00 0.00 39.78 38.80 1n15 n ASN 149 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1n15 s LEU 150 N -2.63 4.20 -0.16 1.20 2.96 -0.84 -1.97 118.68 121.44 1n15 s LEU 150 Ca 0.51 1.39 -0.00 0.00 -0.22 0.00 0.00 54.13 55.81 1n15 s LEU 150 Cb 0.40 -3.88 -0.01 0.00 0.50 0.00 0.00 46.19 43.20 1n15 s LEU 150 CO 0.14 -0.10 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.58 1n15 s PHE 151 N -1.77 2.82 -0.49 5.38 0.40 -0.05 -0.71 117.98 123.55 1n15 s PHE 151 Ca 0.49 -0.90 -0.18 0.00 -0.60 0.00 0.00 56.93 55.74 1n15 s PHE 151 Cb -0.13 -1.91 0.06 0.00 0.51 0.00 0.00 43.02 41.55 1n15 s PHE 151 CO 0.19 -0.40 0.56 0.45 0.70 0.00 0.00 175.22 176.72 1n15 s SER 152 N 0.76 6.20 -0.13 1.36 0.15 -0.40 -1.23 113.70 120.42 1n15 s SER 152 Ca -0.05 -0.99 -0.05 0.00 0.70 0.00 0.00 55.95 55.55 1n15 s SER 152 Cb -0.15 -2.26 -0.04 0.00 -1.71 0.00 0.00 66.02 61.86 1n15 s SER 152 CO 0.01 -0.81 0.07 -0.69 1.20 0.00 0.00 173.24 173.02 1n15 s VAL 153 N 2.36 4.88 -0.25 4.45 1.01 -0.37 -1.37 120.40 131.11 1n15 s VAL 153 Ca 0.12 -0.02 -0.22 0.00 0.00 0.00 0.00 61.98 61.86 1n15 s VAL 153 Cb -0.20 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.04 1n15 s VAL 153 CO 0.11 0.57 0.72 -0.89 0.00 0.00 0.00 175.10 175.61 1n15 s THR 154 N -0.58 4.91 -1.13 3.92 2.01 -0.43 -0.88 115.64 123.46 1n15 s THR 154 Ca 0.11 1.34 -0.08 0.00 0.31 0.00 0.00 61.69 63.37 1n15 s THR 154 Cb -0.12 -4.02 0.27 0.00 0.01 0.00 0.00 72.50 68.64 1n15 s THR 154 CO 0.02 -0.02 1.30 0.18 -0.69 0.00 0.00 174.62 175.41 1n15 n LEU 155 N 5.85 5.81 0.00 4.42 4.77 -0.74 -1.51 117.00 135.60 1n15 n LEU 155 Ca 0.02 -5.00 0.00 0.00 -0.03 0.00 0.00 56.01 51.00 1n15 n LEU 155 Cb 0.48 -1.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.13 1n15 n LEU 155 CO 0.45 1.38 0.16 -1.14 -1.33 0.00 0.00 177.39 176.91 1n15 n ARG 156 N 2.69 0.00 0.27 3.23 0.63 -1.07 -2.33 116.66 120.08 1n15 n ARG 156 Ca 0.27 0.32 0.18 0.00 -0.92 0.00 0.00 57.85 57.71 1n15 n ARG 156 Cb 0.38 -0.72 0.97 0.00 0.45 0.00 0.00 32.46 33.53 1n15 n ARG 156 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1n15 h ASP 157 N 0.00 0.00 1.28 6.15 5.19 -1.81 -2.00 116.42 125.22 1n15 h ASP 157 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1n15 h ASP 157 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1n15 h ASP 157 CO 0.00 0.00 -0.28 0.00 -3.12 0.00 0.00 179.24 175.84 1n15 h ALA 158 N 2.00 0.82 -4.96 3.45 0.00 -1.71 -3.47 119.26 115.39 1n15 h ALA 158 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 1n15 h ALA 158 Cb 0.02 0.00 0.15 0.00 0.00 0.00 0.00 17.79 17.96 1n15 h ALA 158 CO 0.00 0.00 -0.66 0.41 0.00 0.00 0.00 179.25 179.00 1n15 n GLY 159 N 1.29 -0.51 3.73 0.00 0.00 -0.79 -4.94 105.19 103.97 1n15 n GLY 159 Ca 0.04 0.23 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 1n15 n GLY 159 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n15 s GLN 160 N -4.56 1.91 0.03 1.61 -0.21 -1.19 -2.35 119.66 114.90 1n15 s GLN 160 Ca 0.20 -1.32 0.01 0.00 0.02 0.00 0.00 55.36 54.27 1n15 s GLN 160 Cb -0.03 0.56 -0.02 0.00 1.00 0.00 0.00 33.01 34.52 1n15 s GLN 160 CO 0.59 -0.86 -0.05 0.96 -2.12 0.00 0.00 175.29 173.82 1n15 s ILE 161 N -3.26 0.29 -0.07 1.08 -4.36 -0.63 -1.80 121.20 112.46 1n15 s ILE 161 Ca 0.18 -1.01 0.05 0.00 -0.26 0.00 0.00 60.65 59.61 1n15 s ILE 161 Cb -0.04 -0.44 -0.01 0.00 1.25 0.00 0.00 42.46 43.22 1n15 s ILE 161 CO 0.11 -0.47 -0.22 0.00 0.24 0.00 0.00 174.94 174.60 1n15 s ALA 162 N -1.50 2.27 -0.23 2.27 0.00 -0.06 -0.53 121.76 123.98 1n15 s ALA 162 Ca -0.13 -1.01 -0.15 0.00 0.00 0.00 0.00 51.96 50.67 1n15 s ALA 162 Cb -0.09 -0.79 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 1n15 s ALA 162 CO -0.01 0.39 0.35 -0.51 0.00 0.00 0.00 175.76 175.98 1n15 s LEU 163 N -0.09 4.10 -0.14 0.00 1.43 0.59 -1.24 118.68 123.34 1n15 s LEU 163 Ca -0.05 0.35 -0.00 0.00 -1.03 0.00 0.00 54.13 53.40 1n15 s LEU 163 Cb -0.14 -2.41 -0.01 0.00 0.03 0.00 0.00 46.19 43.66 1n15 s LEU 163 CO 0.04 -0.09 -0.13 -0.69 0.23 0.00 0.00 176.35 175.72 1n15 s VAL 164 N 1.55 3.05 -0.10 -1.59 1.01 -0.37 -0.53 120.40 123.42 1n15 s VAL 164 Ca 0.15 -0.66 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 1n15 s VAL 164 Cb -0.15 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 1n15 s VAL 164 CO 0.08 0.52 1.34 -0.62 0.00 0.00 0.00 175.10 176.41 1n15 s ASP 165 N 0.46 6.90 0.16 3.32 2.15 -0.81 -0.87 116.67 127.98 1n15 s ASP 165 Ca -0.09 1.86 -0.17 0.00 0.43 0.00 0.00 52.55 54.58 1n15 s ASP 165 Cb -0.16 -2.54 0.08 0.00 -0.30 0.00 0.00 42.92 40.00 1n15 s ASP 165 CO 0.04 -0.75 1.68 1.23 -0.17 0.00 0.00 175.17 177.20 1n15 h GLY 166 N 9.35 0.30 1.24 2.66 0.00 -1.74 -0.41 103.07 114.46 1n15 h GLY 166 Ca -0.31 0.10 -0.28 0.00 0.00 0.00 0.00 47.33 46.84 1n15 h GLY 166 CO 0.94 -0.13 -1.11 -0.55 0.00 0.00 0.00 176.54 175.69 1n15 h ASP 167 N 0.03 0.89 1.37 0.19 3.32 -1.92 -3.33 116.42 116.96 1n15 h ASP 167 Ca 0.18 -0.75 -0.12 0.00 0.02 0.00 0.00 57.03 56.36 1n15 h ASP 167 Cb 0.27 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1n15 h ASP 167 CO -0.36 1.55 -0.64 0.77 -1.72 0.00 0.00 179.24 178.85 1n15 h SER 168 N 0.35 0.00 -1.11 6.45 4.64 -1.98 -3.47 113.55 118.43 1n15 h SER 168 Ca -0.15 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.94 1n15 h SER 168 Cb 1.77 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.81 1n15 h SER 168 CO 0.22 0.57 -0.25 0.29 -0.87 0.00 0.00 176.83 176.78 1n15 n LYS 169 N -3.22 -0.86 -4.40 4.77 4.01 -0.17 -5.02 118.16 113.27 1n15 n LYS 169 Ca 0.01 0.72 -0.30 0.00 -0.51 0.00 0.00 58.31 58.23 1n15 n LYS 169 Cb 0.77 -4.79 -0.11 0.00 -0.51 0.00 0.00 35.03 30.39 1n15 n LYS 169 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1n15 s LYS 170 N -3.80 2.09 -0.36 1.97 1.02 -1.25 -4.87 119.74 114.53 1n15 s LYS 170 Ca 0.00 -1.01 -0.29 0.00 0.02 0.00 0.00 55.97 54.69 1n15 s LYS 170 Cb 0.00 -2.25 0.00 0.00 -0.52 0.00 0.00 37.83 35.06 1n15 s LYS 170 CO 0.00 0.52 1.47 0.42 -0.92 0.00 0.00 175.35 176.84 1n15 s ILE 171 N -1.08 3.86 0.13 2.17 1.01 -1.26 -1.93 121.20 124.10 1n15 s ILE 171 Ca 0.18 0.91 -0.04 0.00 0.00 0.00 0.00 60.65 61.70 1n15 s ILE 171 Cb -0.11 -4.06 -0.18 0.00 0.01 0.00 0.00 42.46 38.12 1n15 s ILE 171 CO 0.10 -0.61 1.31 0.58 0.00 0.00 0.00 174.94 176.32 1n15 h VAL 172 N 6.38 1.40 -1.61 2.92 2.07 -1.17 -3.47 116.25 122.77 1n15 h VAL 172 Ca -0.29 -2.45 0.07 0.00 0.82 0.00 0.00 66.70 64.86 1n15 h VAL 172 Cb 1.12 2.41 -0.26 0.00 -1.52 0.00 0.00 31.29 33.04 1n15 h VAL 172 CO 1.06 0.73 0.40 -0.75 0.02 0.00 0.00 177.57 179.03 1n15 s LYS 173 N -3.27 0.48 -0.13 1.57 2.47 -1.18 -4.99 119.74 114.69 1n15 s LYS 173 Ca -0.06 0.66 -0.02 0.00 -1.56 0.00 0.00 55.97 54.99 1n15 s LYS 173 Cb 0.09 0.18 -0.03 0.00 -1.46 0.00 0.00 37.83 36.61 1n15 s LYS 173 CO 0.87 -0.07 -0.04 0.08 0.16 0.00 0.00 175.35 176.34 1n15 s VAL 174 N 0.68 3.91 -0.03 4.02 1.01 -1.26 -0.30 120.40 128.43 1n15 s VAL 174 Ca -0.02 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.65 1n15 s VAL 174 Cb -0.05 -2.67 -0.01 0.00 0.00 0.00 0.00 36.38 33.65 1n15 s VAL 174 CO -0.10 0.53 -0.19 -0.63 0.00 0.00 0.00 175.10 174.72 1n15 s ILE 175 N -0.08 1.51 0.06 2.22 1.01 0.31 -4.97 121.20 121.25 1n15 s ILE 175 Ca 0.02 -0.79 -0.30 0.00 0.00 0.00 0.00 60.65 59.57 1n15 s ILE 175 Cb -0.13 -1.27 -0.05 0.00 0.01 0.00 0.00 42.46 41.02 1n15 s ILE 175 CO 0.03 0.43 1.11 -1.81 0.00 0.00 0.00 174.94 174.70 1n15 s ASP 176 N -0.28 7.20 0.00 3.58 1.01 -1.26 -1.60 116.67 125.32 1n15 s ASP 176 Ca 0.03 1.91 0.00 0.00 0.71 0.00 0.00 52.55 55.20 1n15 s ASP 176 Cb -0.09 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.26 1n15 s ASP 176 CO 0.00 -0.36 0.00 0.35 0.21 0.00 0.00 175.17 175.37 1n15 n THR 177 N 3.71 0.00 -1.81 -1.27 -2.24 -0.99 -4.94 114.28 106.73 1n15 n THR 177 Ca 0.07 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.56 1n15 n THR 177 Cb 0.48 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.80 1n15 n THR 177 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1n15 s GLY 178 N -0.33 1.59 0.26 3.38 0.00 -1.26 -4.70 107.32 106.26 1n15 s GLY 178 Ca 0.00 -0.59 -0.30 0.00 0.00 0.00 0.00 44.72 43.84 1n15 s GLY 178 CO 0.00 -0.09 1.34 -0.47 0.00 0.00 0.00 173.10 173.88 1n15 s TYR 179 N -3.49 3.13 -1.05 1.90 5.04 -1.26 -3.93 117.35 117.69 1n15 s TYR 179 Ca 0.62 1.23 -0.19 0.00 -2.44 0.00 0.00 57.07 56.29 1n15 s TYR 179 Cb -0.12 -3.68 0.02 0.00 0.35 0.00 0.00 41.96 38.53 1n15 s TYR 179 CO 0.50 -2.07 0.68 0.00 -1.34 0.00 0.00 175.55 173.33 1n15 n ALA 180 N 1.95 -2.66 -1.59 3.97 0.00 -1.01 -1.68 120.51 119.50 1n15 n ALA 180 Ca 0.04 -0.39 -0.48 0.00 0.00 0.00 0.00 53.44 52.61 1n15 n ALA 180 Cb 0.42 -2.30 -0.04 0.00 0.00 0.00 0.00 19.45 17.53 1n15 n ALA 180 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1n15 n VAL 181 N -3.95 0.89 -0.10 0.00 0.31 -1.25 -3.07 118.33 111.15 1n15 n VAL 181 Ca -0.16 -0.22 -0.23 0.00 -0.01 0.00 0.00 64.34 63.72 1n15 n VAL 181 Cb 0.60 -0.90 -0.12 0.00 -0.91 0.00 0.00 33.84 32.52 1n15 n VAL 181 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1n15 n HIS 182 N 1.54 0.89 -4.11 3.52 -0.00 0.12 -4.88 115.22 112.31 1n15 n HIS 182 Ca 0.15 0.36 -0.08 0.00 0.46 0.00 0.00 57.72 58.61 1n15 n HIS 182 Cb 0.25 -1.09 -0.10 0.00 -0.12 0.00 0.00 29.99 28.93 1n15 n HIS 182 CO 0.00 0.00 0.00 0.96 0.46 0.00 0.00 176.34 177.76 1n15 s ILE 183 N -2.40 0.36 -0.05 3.57 -4.36 -1.26 -4.76 121.20 112.30 1n15 s ILE 183 Ca -0.30 -1.78 0.05 0.00 -0.26 0.00 0.00 60.65 58.36 1n15 s ILE 183 Cb 0.07 -1.48 -0.02 0.00 1.25 0.00 0.00 42.46 42.28 1n15 s ILE 183 CO 0.59 -0.92 -0.18 -0.44 0.24 0.00 0.00 174.94 174.24 1n15 s SER 184 N -2.84 3.70 0.02 4.36 0.01 -1.26 -3.29 113.70 114.41 1n15 s SER 184 Ca 0.07 -0.30 0.01 0.00 1.31 0.00 0.00 55.95 57.04 1n15 s SER 184 Cb 0.06 -0.78 -0.02 0.00 0.21 0.00 0.00 66.02 65.50 1n15 s SER 184 CO -0.08 0.32 -0.06 -0.13 0.41 0.00 0.00 173.24 173.71 1n15 s ARG 185 N -0.58 0.41 0.05 12.44 1.81 0.18 -4.97 118.95 128.29 1n15 s ARG 185 Ca 0.08 -0.53 0.00 0.00 -1.72 0.00 0.00 55.73 53.56 1n15 s ARG 185 Cb -0.11 -0.21 -0.04 0.00 -0.45 0.00 0.00 34.95 34.14 1n15 s ARG 185 CO 0.01 0.04 0.16 -1.64 -0.68 0.00 0.00 175.30 173.18 1n15 s MET 186 N -1.09 3.26 0.64 3.54 -1.94 -1.26 0.13 119.30 122.57 1n15 s MET 186 Ca -0.08 -0.49 -0.12 0.00 -1.71 0.00 0.00 55.69 53.29 1n15 s MET 186 Cb -0.07 -2.95 -0.02 0.00 2.01 0.00 0.00 34.83 33.79 1n15 s MET 186 CO -0.00 0.61 1.04 -1.54 -0.01 0.00 0.00 175.02 175.12 1n15 s SER 187 N -2.30 5.85 0.60 3.03 1.04 -0.56 -4.69 113.70 116.67 1n15 s SER 187 Ca 0.31 1.56 0.32 0.00 0.48 0.00 0.00 55.95 58.62 1n15 s SER 187 Cb -0.13 -2.49 1.92 0.00 0.10 0.00 0.00 66.02 65.42 1n15 s SER 187 CO 0.23 -1.12 2.28 0.00 0.98 0.00 0.00 173.24 175.61 1n15 h ALA 188 N -0.29 1.45 0.00 5.32 0.00 -1.91 -1.20 119.26 122.63 1n15 h ALA 188 Ca -0.44 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.41 1n15 h ALA 188 Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1n15 h ALA 188 CO 0.59 -0.00 -0.28 0.66 0.00 0.00 0.00 179.25 180.22 1n15 h SER 189 N 0.00 0.00 0.00 0.00 4.64 -1.93 -3.48 113.55 112.78 1n15 h SER 189 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1n15 h SER 189 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1n15 h SER 189 CO -0.00 0.28 0.00 0.61 -0.87 0.00 0.00 176.83 176.85 1n15 n GLY 190 N 0.98 0.77 0.11 -0.77 0.00 -0.45 -4.95 105.19 100.87 1n15 n GLY 190 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 1n15 n GLY 190 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1n15 h ARG 191 N 3.67 0.12 -5.85 1.61 2.43 -1.92 -3.48 114.38 110.96 1n15 h ARG 191 Ca 0.00 -0.20 -0.64 0.00 -0.81 0.00 0.00 59.98 58.33 1n15 h ARG 191 Cb 0.00 0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 29.57 1n15 h ARG 191 CO 0.00 1.10 -0.36 0.71 -1.51 0.00 0.00 179.97 179.90 1n15 s TYR 192 N -2.42 3.63 -0.16 2.20 2.02 -1.26 -1.69 117.35 119.67 1n15 s TYR 192 Ca -0.24 0.68 -0.03 0.00 -0.37 0.00 0.00 57.07 57.11 1n15 s TYR 192 Cb 0.05 -2.06 -0.02 0.00 -0.40 0.00 0.00 41.96 39.53 1n15 s TYR 192 CO 0.68 0.66 -0.07 -1.17 -1.57 0.00 0.00 175.55 174.09 1n15 s LEU 193 N -1.32 3.00 -0.13 -1.29 0.20 0.13 -1.50 118.68 117.78 1n15 s LEU 193 Ca 0.22 -0.24 0.01 0.00 0.69 0.00 0.00 54.13 54.81 1n15 s LEU 193 Cb -0.14 -1.72 -0.01 0.00 -0.43 0.00 0.00 46.19 43.90 1n15 s LEU 193 CO 0.11 0.13 -0.17 -0.76 -0.29 0.00 0.00 176.35 175.37 1n15 s LEU 194 N 0.57 2.45 0.07 -0.68 1.43 0.12 -0.25 118.68 122.38 1n15 s LEU 194 Ca -0.05 -0.44 0.06 0.00 -1.03 0.00 0.00 54.13 52.67 1n15 s LEU 194 Cb -0.15 -1.54 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 1n15 s LEU 194 CO 0.03 0.14 -0.16 0.68 0.23 0.00 0.00 176.35 177.27 1n15 s VAL 195 N 0.49 1.24 -0.02 -1.59 -7.23 -0.96 0.48 120.40 112.82 1n15 s VAL 195 Ca -0.12 -1.25 0.01 0.00 -1.81 0.00 0.00 61.98 58.81 1n15 s VAL 195 Cb -0.16 -1.15 0.01 0.00 0.56 0.00 0.00 36.38 35.64 1n15 s VAL 195 CO 0.05 -0.11 -0.01 -0.51 -0.31 0.00 0.00 175.10 174.20 1n15 s ILE 196 N -1.11 0.21 0.49 -0.62 2.07 -1.21 -1.04 121.20 119.99 1n15 s ILE 196 Ca 0.01 -0.02 -0.01 0.00 -1.41 0.00 0.00 60.65 59.22 1n15 s ILE 196 Cb -0.09 -0.24 0.00 0.00 0.13 0.00 0.00 42.46 42.26 1n15 s ILE 196 CO 0.02 0.11 0.74 -0.83 -1.91 0.00 0.00 174.94 173.07 1n15 s GLY 197 N 0.49 1.59 0.20 1.50 0.00 -0.81 -0.70 107.32 109.60 1n15 s GLY 197 Ca -0.05 -0.98 0.18 0.00 0.00 0.00 0.00 44.72 43.87 1n15 s GLY 197 CO -0.01 -0.77 1.55 -0.96 0.00 0.00 0.00 173.10 172.91 1n15 n ARG 198 N -2.23 0.12 -0.24 2.90 1.85 -0.67 -1.03 116.66 117.36 1n15 n ARG 198 Ca 0.03 0.48 0.04 0.00 -1.00 0.00 0.00 57.85 57.39 1n15 n ARG 198 Cb 0.58 -1.79 0.14 0.00 -1.05 0.00 0.00 32.46 30.34 1n15 n ARG 198 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1n15 n ASP 199 N -2.02 2.12 -0.02 2.89 5.68 -1.26 -1.57 116.55 122.36 1n15 n ASP 199 Ca 0.01 -2.17 -0.00 0.00 -0.50 0.00 0.00 54.79 52.13 1n15 n ASP 199 Cb 0.12 -0.37 -0.00 0.00 -1.14 0.00 0.00 41.12 39.73 1n15 n ASP 199 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1n15 n ALA 200 N 0.28 -0.00 -2.61 2.12 0.00 -0.20 -4.58 120.51 115.52 1n15 n ALA 200 Ca 0.10 0.01 -0.41 0.00 0.00 0.00 0.00 53.44 53.14 1n15 n ALA 200 Cb 0.41 -1.02 -0.06 0.00 0.00 0.00 0.00 19.45 18.78 1n15 n ALA 200 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1n15 s ARG 201 N -1.39 4.01 0.05 0.00 3.52 -1.26 -1.30 118.95 122.59 1n15 s ARG 201 Ca 0.00 0.46 -0.07 0.00 -0.13 0.00 0.00 55.73 55.99 1n15 s ARG 201 Cb 0.00 -3.69 -0.05 0.00 -1.56 0.00 0.00 34.95 29.65 1n15 s ARG 201 CO 0.00 -0.50 0.33 0.42 -0.81 0.00 0.00 175.30 174.73 1n15 s ILE 202 N 2.59 5.22 -0.09 4.11 1.01 0.70 -1.91 121.20 132.83 1n15 s ILE 202 Ca 0.26 0.22 -0.00 0.00 0.00 0.00 0.00 60.65 61.13 1n15 s ILE 202 Cb -0.15 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 38.74 1n15 s ILE 202 CO 0.10 0.28 -0.06 -1.81 0.00 0.00 0.00 174.94 173.46 1n15 s ASP 203 N -1.87 1.82 -0.20 3.58 1.01 -0.20 -2.45 116.67 118.36 1n15 s ASP 203 Ca 0.32 -0.22 -0.13 0.00 0.71 0.00 0.00 52.55 53.23 1n15 s ASP 203 Cb -0.13 -0.68 -0.05 0.00 1.01 0.00 0.00 42.92 43.07 1n15 s ASP 203 CO 0.19 -0.11 0.26 -0.32 0.21 0.00 0.00 175.17 175.39 1n15 s MET 204 N 1.56 4.18 -0.10 8.23 -2.45 -0.69 -2.26 119.30 127.78 1n15 s MET 204 Ca 0.01 -0.01 0.04 0.00 -1.25 0.00 0.00 55.69 54.47 1n15 s MET 204 Cb -0.13 -3.48 0.00 0.00 1.25 0.00 0.00 34.83 32.47 1n15 s MET 204 CO -0.05 0.14 -0.24 0.42 1.05 0.00 0.00 175.02 176.34 1n15 s ILE 205 N 0.80 2.06 -0.35 10.11 1.01 0.66 -1.35 121.20 134.13 1n15 s ILE 205 Ca 0.14 -1.02 -0.21 0.00 0.00 0.00 0.00 60.65 59.56 1n15 s ILE 205 Cb -0.13 -1.78 0.00 0.00 0.01 0.00 0.00 42.46 40.56 1n15 s ILE 205 CO 0.04 0.56 0.67 -0.62 0.00 0.00 0.00 174.94 175.59 1n15 s ASP 206 N 0.38 6.47 0.00 3.58 -1.08 -0.35 -0.69 116.67 124.98 1n15 s ASP 206 Ca -0.18 0.23 0.29 0.00 -0.52 0.00 0.00 52.55 52.37 1n15 s ASP 206 Cb -0.18 -2.34 1.29 0.00 -1.46 0.00 0.00 42.92 40.23 1n15 s ASP 206 CO 0.08 -0.62 1.94 0.18 0.52 0.00 0.00 175.17 177.27 1n15 n LEU 207 N 6.12 0.06 0.08 -1.34 4.77 -0.68 -2.59 117.00 123.42 1n15 n LEU 207 Ca -0.00 0.37 0.12 0.00 -0.03 0.00 0.00 56.01 56.47 1n15 n LEU 207 Cb 0.48 -0.40 0.13 0.00 -2.33 0.00 0.00 43.42 41.31 1n15 n LEU 207 CO 0.50 0.01 0.28 -0.50 -1.33 0.00 0.00 177.39 176.36 1n15 h TRP 208 N 0.04 0.00 -4.21 -1.77 4.06 -1.90 -3.43 115.95 108.74 1n15 h TRP 208 Ca 0.00 0.00 -0.53 0.00 2.06 0.00 0.00 58.89 60.42 1n15 h TRP 208 Cb 0.42 0.00 0.16 0.00 -1.00 0.00 0.00 29.16 28.74 1n15 h TRP 208 CO 0.00 0.00 0.36 0.00 -3.56 0.00 0.00 178.44 175.24 1n15 s ALA 209 N -3.22 2.05 0.30 1.49 0.00 -1.22 0.34 121.76 121.51 1n15 s ALA 209 Ca 0.05 0.76 0.01 0.00 0.00 0.00 0.00 51.96 52.77 1n15 s ALA 209 Cb 0.12 -3.44 0.73 0.00 0.00 0.00 0.00 23.12 20.53 1n15 s ALA 209 CO 0.74 -1.97 1.58 0.87 0.00 0.00 0.00 175.76 176.97 1n15 h LYS 210 N -0.60 0.02 -4.25 0.00 1.79 -1.92 -3.27 116.57 108.34 1n15 h LYS 210 Ca -0.46 -0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.45 1n15 h LYS 210 Cb 1.28 -0.01 -0.37 0.00 -1.58 0.00 0.00 32.23 31.55 1n15 h LYS 210 CO 0.49 0.01 -0.80 -1.21 -1.08 0.00 0.00 179.45 176.86 1n15 s GLU 211 N -6.01 1.58 -0.31 3.15 2.02 -1.26 -4.64 118.70 113.23 1n15 s GLU 211 Ca -0.13 -0.50 -0.42 0.00 0.02 0.00 0.00 54.97 53.94 1n15 s GLU 211 Cb 0.28 -1.97 -0.17 0.00 0.10 0.00 0.00 34.13 32.37 1n15 s GLU 211 CO 0.78 -0.38 1.66 -0.35 0.02 0.00 0.00 175.26 176.98 1n15 n PRO 212 N 4.86 0.79 -4.09 0.39 -0.04 -1.23 -4.92 135.00 130.75 1n15 n PRO 212 Ca -0.13 0.29 -0.08 0.00 -0.04 0.00 0.00 63.50 63.54 1n15 n PRO 212 Cb 0.48 -1.91 -0.10 0.00 -0.04 0.00 0.00 33.50 31.93 1n15 n PRO 212 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1n15 s THR 213 N 3.12 0.19 0.18 0.52 -4.23 -1.07 -4.93 115.64 109.42 1n15 s THR 213 Ca 0.99 -1.80 -0.31 0.00 -1.18 0.00 0.00 61.69 59.40 1n15 s THR 213 Cb -1.19 -1.64 -0.09 0.00 1.34 0.00 0.00 72.50 70.92 1n15 s THR 213 CO 0.69 -0.84 1.40 -0.54 -0.54 0.00 0.00 174.62 174.79 1n15 s LYS 214 N -3.95 4.31 -0.01 3.99 1.02 -1.26 -1.21 119.74 122.64 1n15 s LYS 214 Ca 0.11 2.16 0.08 0.00 0.02 0.00 0.00 55.97 58.34 1n15 s LYS 214 Cb 0.08 -3.19 -0.11 0.00 -0.52 0.00 0.00 37.83 34.09 1n15 s LYS 214 CO -0.07 -0.40 0.24 1.33 -0.92 0.00 0.00 175.35 175.53 1n15 n VAL 215 N 3.16 0.00 -3.47 3.17 0.24 -0.46 -4.60 118.33 116.37 1n15 n VAL 215 Ca 0.09 -0.23 -0.10 0.00 -2.04 0.00 0.00 64.34 62.05 1n15 n VAL 215 Cb 0.41 0.57 -0.02 0.00 -1.47 0.00 0.00 33.84 33.34 1n15 n VAL 215 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1n15 s ALA 216 N -2.25 -1.70 0.11 2.33 0.00 -1.24 0.52 121.76 119.53 1n15 s ALA 216 Ca -0.01 0.73 -0.21 0.00 0.00 0.00 0.00 51.96 52.47 1n15 s ALA 216 Cb 0.05 0.66 0.06 0.00 0.00 0.00 0.00 23.12 23.89 1n15 s ALA 216 CO 0.33 -0.74 0.53 -1.83 0.00 0.00 0.00 175.76 174.05 1n15 s GLU 217 N -3.45 1.15 -0.07 0.00 -1.05 -0.63 -1.70 118.70 112.95 1n15 s GLU 217 Ca 0.03 -0.45 -0.29 0.00 -0.15 0.00 0.00 54.97 54.11 1n15 s GLU 217 Cb -0.01 0.52 0.11 0.00 -0.44 0.00 0.00 34.13 34.31 1n15 s GLU 217 CO -0.11 -0.46 0.91 -1.50 0.95 0.00 0.00 175.26 175.05 1n15 s ILE 218 N -3.34 0.00 -0.16 1.83 2.07 -1.03 -1.05 121.20 119.53 1n15 s ILE 218 Ca -0.00 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.22 1n15 s ILE 218 Cb -0.00 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.58 1n15 s ILE 218 CO -0.09 0.00 -0.10 -0.75 -1.91 0.00 0.00 174.94 172.09 1n15 s LYS 219 N -2.15 3.40 -0.05 3.50 2.20 -1.26 -0.21 119.74 125.16 1n15 s LYS 219 Ca 0.01 -0.66 0.14 0.00 -0.36 0.00 0.00 55.97 55.10 1n15 s LYS 219 Cb -0.01 -2.75 0.45 0.00 -1.51 0.00 0.00 37.83 34.02 1n15 s LYS 219 CO -0.03 0.10 1.38 0.44 -0.36 0.00 0.00 175.35 176.87 1n15 n ILE 220 N 3.88 1.38 -3.50 5.43 -6.64 -0.42 -4.57 119.36 114.91 1n15 n ILE 220 Ca -0.18 -1.20 0.00 0.00 -1.77 0.00 0.00 62.75 59.59 1n15 n ILE 220 Cb 0.52 0.30 0.00 0.00 -1.44 0.00 0.00 39.64 39.02 1n15 n ILE 220 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1n15 n GLY 221 N 0.53 -0.88 0.08 3.28 0.00 -1.26 -4.84 105.19 102.11 1n15 n GLY 221 Ca 0.17 -0.93 -0.07 0.00 0.00 0.00 0.00 46.02 45.20 1n15 n GLY 221 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1n15 n ILE 222 N 4.49 1.15 -3.76 -0.61 -0.00 0.17 -4.64 119.36 116.17 1n15 n ILE 222 Ca 0.00 -0.79 -0.13 0.00 -0.00 0.00 0.00 62.75 61.83 1n15 n ILE 222 Cb 0.00 -0.39 -0.13 0.00 -0.00 0.00 0.00 39.64 39.11 1n15 n ILE 222 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 1n15 s GLU 223 N -2.64 0.17 0.29 0.38 2.12 -0.82 -4.32 118.70 113.89 1n15 s GLU 223 Ca -0.10 0.40 -0.07 0.00 0.36 0.00 0.00 54.97 55.56 1n15 s GLU 223 Cb 0.07 -0.07 -0.00 0.00 0.26 0.00 0.00 34.13 34.39 1n15 s GLU 223 CO 0.83 -0.12 0.45 0.00 -0.54 0.00 0.00 175.26 175.88 1n15 s ALA 224 N 0.88 0.32 0.00 6.30 0.00 -0.61 0.64 121.76 129.30 1n15 s ALA 224 Ca -0.06 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.66 1n15 s ALA 224 Cb -0.08 1.12 0.00 0.00 0.00 0.00 0.00 23.12 24.16 1n15 s ALA 224 CO -0.05 -0.81 0.00 0.54 0.00 0.00 0.00 175.76 175.44 1n15 n ARG 225 N -0.46 0.00 -4.14 0.00 5.12 -1.20 -4.17 116.66 111.82 1n15 n ARG 225 Ca -0.00 0.00 -0.27 0.00 -1.93 0.00 0.00 57.85 55.65 1n15 n ARG 225 Cb 0.62 -0.32 -0.07 0.00 -1.16 0.00 0.00 32.46 31.53 1n15 n ARG 225 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1n15 s SER 226 N -3.41 5.16 0.09 0.55 0.15 -1.25 -4.32 113.70 110.67 1n15 s SER 226 Ca 0.00 -0.25 -0.10 0.00 0.70 0.00 0.00 55.95 56.30 1n15 s SER 226 Cb 0.00 -1.24 0.01 0.00 -1.71 0.00 0.00 66.02 63.08 1n15 s SER 226 CO 0.00 0.08 0.23 0.54 1.20 0.00 0.00 173.24 175.29 1n15 s VAL 227 N -1.72 0.13 -0.06 4.45 0.11 -1.26 -1.80 120.40 120.26 1n15 s VAL 227 Ca 0.29 -1.04 -0.30 0.00 -2.93 0.00 0.00 61.98 58.00 1n15 s VAL 227 Cb -0.10 -1.26 0.11 0.00 -1.53 0.00 0.00 36.38 33.60 1n15 s VAL 227 CO 0.21 -0.57 0.94 -0.70 -3.33 0.00 0.00 175.10 171.64 1n15 s GLU 228 N -3.68 0.73 0.14 1.54 2.56 -0.28 -4.86 118.70 114.84 1n15 s GLU 228 Ca 0.03 -0.18 0.11 0.00 0.00 0.00 0.00 54.97 54.93 1n15 s GLU 228 Cb 0.04 0.34 -0.04 0.00 2.00 0.00 0.00 34.13 36.46 1n15 s GLU 228 CO -0.10 -0.30 -0.24 0.45 -0.56 0.00 0.00 175.26 174.51 1n15 s SER 229 N -2.14 3.48 0.08 -1.70 0.15 -1.26 -1.01 113.70 111.29 1n15 s SER 229 Ca 0.04 -0.73 -0.31 0.00 0.70 0.00 0.00 55.95 55.65 1n15 s SER 229 Cb -0.01 -0.30 -0.09 0.00 -1.71 0.00 0.00 66.02 63.91 1n15 s SER 229 CO -0.06 0.17 1.70 -0.94 1.20 0.00 0.00 173.24 175.30 1n15 s SER 230 N -2.22 6.56 -0.05 5.45 1.04 -0.63 -4.65 113.70 119.20 1n15 s SER 230 Ca 0.16 2.54 0.08 0.00 0.48 0.00 0.00 55.95 59.22 1n15 s SER 230 Cb -0.10 -2.56 0.18 0.00 0.10 0.00 0.00 66.02 63.64 1n15 s SER 230 CO 0.08 -0.92 1.12 0.29 0.98 0.00 0.00 173.24 174.80 1n15 n LYS 231 N 5.69 2.55 -2.82 4.02 5.02 -1.26 -4.29 118.16 127.08 1n15 n LYS 231 Ca 0.16 -2.00 -0.36 0.00 -2.02 0.00 0.00 58.31 54.10 1n15 n LYS 231 Cb 0.40 -1.25 -0.07 0.00 -0.02 0.00 0.00 35.03 34.09 1n15 n LYS 231 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1n15 s PHE 232 N -1.63 3.61 0.02 2.13 5.36 -1.23 -4.75 117.98 121.49 1n15 s PHE 232 Ca 0.16 1.72 -0.33 0.00 -0.96 0.00 0.00 56.93 57.52 1n15 s PHE 232 Cb 0.12 -2.88 -0.11 0.00 -0.34 0.00 0.00 43.02 39.81 1n15 s PHE 232 CO 0.04 0.16 1.84 1.17 -1.46 0.00 0.00 175.22 176.97 1n15 n LYS 233 N 0.33 2.43 -0.21 10.12 4.81 -1.26 -1.36 118.16 133.02 1n15 n LYS 233 Ca 0.03 0.89 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 1n15 n LYS 233 Cb 0.51 -2.75 0.00 0.00 0.02 0.00 0.00 35.03 32.81 1n15 n LYS 233 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1n15 n GLY 234 N 4.23 0.89 0.71 3.14 0.00 -1.26 -4.97 105.19 107.94 1n15 n GLY 234 Ca 0.20 -0.03 0.05 0.00 0.00 0.00 0.00 46.02 46.25 1n15 n GLY 234 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1n15 n TYR 235 N -2.21 0.00 -1.68 1.61 4.02 -0.46 -5.03 117.16 113.41 1n15 n TYR 235 Ca 0.00 -0.78 -0.46 0.00 -0.01 0.00 0.00 57.90 56.65 1n15 n TYR 235 Cb 0.00 -0.16 -0.04 0.00 -0.02 0.00 0.00 39.34 39.12 1n15 n TYR 235 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1n15 n GLU 236 N -0.49 2.25 -1.80 -0.72 1.02 -1.26 -1.54 120.64 118.11 1n15 n GLU 236 Ca 0.10 0.82 -0.17 0.00 -0.02 0.00 0.00 57.16 57.89 1n15 n GLU 236 Cb 0.81 -2.62 -0.05 0.00 -0.02 0.00 0.00 31.44 29.56 1n15 n GLU 236 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1n15 n ASP 237 N 4.44 -4.63 -0.04 1.62 9.92 -1.26 -4.87 116.55 121.72 1n15 n ASP 237 Ca 0.18 0.31 -0.13 0.00 -0.53 0.00 0.00 54.79 54.62 1n15 n ASP 237 Cb 0.30 -4.08 -0.11 0.00 -0.64 0.00 0.00 41.12 36.59 1n15 n ASP 237 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 1n15 h ARG 238 N 0.00 -0.00 -4.50 -1.24 2.47 -1.56 -3.29 114.38 106.26 1n15 h ARG 238 Ca -0.36 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.13 1n15 h ARG 238 Cb 1.17 0.00 -0.18 0.00 -1.65 0.00 0.00 29.97 29.31 1n15 h ARG 238 CO 0.50 0.76 -0.71 0.71 0.56 0.00 0.00 179.97 181.78 1n15 s TYR 239 N -3.11 0.69 -0.04 3.04 2.02 -1.26 -1.00 117.35 117.67 1n15 s TYR 239 Ca -0.17 -0.71 0.03 0.00 -0.37 0.00 0.00 57.07 55.84 1n15 s TYR 239 Cb -0.01 -0.42 0.01 0.00 -0.40 0.00 0.00 41.96 41.14 1n15 s TYR 239 CO 0.67 -0.15 -0.11 0.99 -1.57 0.00 0.00 175.55 175.38 1n15 s THR 240 N -2.44 1.00 0.20 -0.71 2.01 -0.85 -1.60 115.64 113.26 1n15 s THR 240 Ca -0.01 -0.45 0.11 0.00 0.31 0.00 0.00 61.69 61.65 1n15 s THR 240 Cb -0.03 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.53 1n15 s THR 240 CO -0.03 0.31 -0.21 -0.51 -0.69 0.00 0.00 174.62 173.50 1n15 s ILE 241 N 0.40 2.51 -0.09 1.82 2.07 -0.18 -0.55 121.20 127.17 1n15 s ILE 241 Ca -0.08 -2.03 -0.10 0.00 -1.41 0.00 0.00 60.65 57.03 1n15 s ILE 241 Cb -0.12 -2.23 0.03 0.00 0.13 0.00 0.00 42.46 40.26 1n15 s ILE 241 CO 0.02 -0.16 0.27 0.00 -1.91 0.00 0.00 174.94 173.17 1n15 s ALA 242 N -1.80 -0.68 -0.08 1.50 0.00 -0.90 -1.13 121.76 118.68 1n15 s ALA 242 Ca 0.23 0.69 0.02 0.00 0.00 0.00 0.00 51.96 52.89 1n15 s ALA 242 Cb -0.08 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 1n15 s ALA 242 CO 0.11 -0.15 -0.12 0.20 0.00 0.00 0.00 175.76 175.81 1n15 s GLY 243 N -0.09 1.58 0.19 0.00 0.00 -0.74 -1.59 107.32 106.66 1n15 s GLY 243 Ca -0.02 -0.93 0.08 0.00 0.00 0.00 0.00 44.72 43.84 1n15 s GLY 243 CO 0.01 -0.59 0.00 0.00 0.00 0.00 0.00 173.10 172.52 1n15 s ALA 244 N -0.47 3.20 -0.14 3.20 0.00 0.84 -3.23 121.76 125.16 1n15 s ALA 244 Ca 0.06 -1.41 -0.18 0.00 0.00 0.00 0.00 51.96 50.43 1n15 s ALA 244 Cb -0.12 -0.97 -0.25 0.00 0.00 0.00 0.00 23.12 21.79 1n15 s ALA 244 CO 0.02 0.44 0.46 1.88 0.00 0.00 0.00 175.76 178.56 1n15 h TYR 245 N 2.54 0.26 -3.35 0.00 -1.99 -0.04 -2.03 116.97 112.37 1n15 h TYR 245 Ca -0.47 -0.19 -0.32 0.00 2.00 0.00 0.00 58.73 59.75 1n15 h TYR 245 Cb 1.21 -0.01 -0.36 0.00 2.00 0.00 0.00 36.73 39.57 1n15 h TYR 245 CO 0.63 1.50 -0.70 -0.46 -0.00 0.00 0.00 178.16 179.12 1n15 s TRP 246 N -2.42 -0.01 0.93 4.88 -0.11 -0.92 -3.73 118.94 117.56 1n15 s TRP 246 Ca -0.23 0.29 -0.12 0.00 1.22 0.00 0.00 56.10 57.26 1n15 s TRP 246 Cb 0.04 -0.31 0.15 0.00 -1.50 0.00 0.00 33.47 31.85 1n15 s TRP 246 CO 0.70 -0.16 1.10 -2.14 -4.62 0.00 0.00 176.95 171.83 1n15 s PRO 247 N 1.66 0.99 -0.88 5.86 0.02 -1.26 0.46 135.00 141.84 1n15 s PRO 247 Ca -0.02 0.64 -0.25 0.00 0.02 0.00 0.00 61.00 61.39 1n15 s PRO 247 Cb -0.12 -1.79 -0.03 0.00 0.02 0.00 0.00 34.50 32.58 1n15 s PRO 247 CO -0.04 -2.38 1.83 -2.14 -0.33 0.00 0.00 177.00 173.94 1n15 s PRO 248 N -5.00 2.76 0.10 5.54 0.02 -1.24 -4.60 135.00 132.58 1n15 s PRO 248 Ca 0.64 -0.32 -0.26 0.00 0.02 0.00 0.00 61.00 61.08 1n15 s PRO 248 Cb -0.18 -5.00 0.08 0.00 0.02 0.00 0.00 34.50 29.42 1n15 s PRO 248 CO 0.57 -3.06 0.90 1.14 -0.33 0.00 0.00 177.00 176.21 1n15 s GLN 249 N 6.63 1.09 0.11 5.54 -2.07 -1.25 -1.07 119.66 128.65 1n15 s GLN 249 Ca 0.65 -0.53 0.05 0.00 -1.82 0.00 0.00 55.36 53.70 1n15 s GLN 249 Cb -0.06 0.42 -0.04 0.00 -1.09 0.00 0.00 33.01 32.24 1n15 s GLN 249 CO 0.01 -0.49 -0.13 -0.59 -1.32 0.00 0.00 175.29 172.76 1n15 s PHE 250 N -3.28 1.31 0.04 9.60 -0.12 -0.46 -0.11 117.98 124.96 1n15 s PHE 250 Ca 0.09 -0.58 0.05 0.00 -0.05 0.00 0.00 56.93 56.44 1n15 s PHE 250 Cb -0.01 -0.69 -0.02 0.00 -0.63 0.00 0.00 43.02 41.66 1n15 s PHE 250 CO -0.03 0.11 -0.14 0.00 -0.05 0.00 0.00 175.22 175.11 1n15 s ALA 251 N -2.20 1.15 -0.08 1.99 0.00 -0.62 -0.85 121.76 121.15 1n15 s ALA 251 Ca 0.08 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.22 1n15 s ALA 251 Cb -0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 1n15 s ALA 251 CO 0.02 0.21 -0.13 0.42 0.00 0.00 0.00 175.76 176.28 1n15 s ILE 252 N -0.91 3.10 0.27 0.00 1.01 0.56 -2.11 121.20 123.12 1n15 s ILE 252 Ca 0.01 -0.69 0.02 0.00 0.00 0.00 0.00 60.65 59.99 1n15 s ILE 252 Cb -0.08 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.09 1n15 s ILE 252 CO 0.01 0.57 0.07 -0.04 0.00 0.00 0.00 174.94 175.55 1n15 s MET 253 N -0.40 1.46 0.07 2.79 -1.94 0.28 -1.09 119.30 120.48 1n15 s MET 253 Ca 0.05 -1.79 -0.31 0.00 -1.71 0.00 0.00 55.69 51.93 1n15 s MET 253 Cb -0.12 -0.48 -0.07 0.00 2.01 0.00 0.00 34.83 36.16 1n15 s MET 253 CO 0.02 -0.23 1.44 0.34 -0.01 0.00 0.00 175.02 176.58 1n15 s ASP 254 N -3.36 6.79 0.00 3.03 -1.08 -0.09 -2.00 116.67 119.97 1n15 s ASP 254 Ca 0.36 2.29 0.21 0.00 -0.52 0.00 0.00 52.55 54.88 1n15 s ASP 254 Cb 0.08 -2.57 1.10 0.00 -1.46 0.00 0.00 42.92 40.06 1n15 s ASP 254 CO 0.13 -0.72 1.64 0.61 0.52 0.00 0.00 175.17 177.35 1n15 n GLY 255 N 3.64 -0.87 0.07 2.66 0.00 -0.17 -0.56 105.19 109.96 1n15 n GLY 255 Ca 0.13 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 1n15 n GLY 255 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1n15 n GLU 256 N -1.20 1.25 0.00 1.61 4.07 -1.24 -4.77 120.64 120.36 1n15 n GLU 256 Ca 0.12 0.04 0.00 0.00 -0.06 0.00 0.00 57.16 57.25 1n15 n GLU 256 Cb 0.13 -1.33 0.00 0.00 -0.06 0.00 0.00 31.44 30.19 1n15 n GLU 256 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1n15 n THR 257 N -2.70 0.00 -1.06 6.31 -2.24 -1.22 -4.88 114.28 108.50 1n15 n THR 257 Ca -0.24 -0.29 -0.02 0.00 -2.27 0.00 0.00 64.05 61.22 1n15 n THR 257 Cb 0.87 0.80 -0.01 0.00 -2.10 0.00 0.00 70.33 69.89 1n15 n THR 257 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1n15 n LEU 258 N -1.15 -0.05 -4.71 3.22 4.77 0.27 -4.78 117.00 114.57 1n15 n LEU 258 Ca 0.00 0.05 -0.42 0.00 -0.03 0.00 0.00 56.01 55.61 1n15 n LEU 258 Cb 0.00 -0.95 -0.03 0.00 -2.33 0.00 0.00 43.42 40.11 1n15 n LEU 258 CO 0.00 -0.21 1.24 -0.70 -1.33 0.00 0.00 177.39 176.39 1n15 s GLU 259 N -1.35 4.21 0.18 3.23 2.12 -1.26 -4.56 118.70 121.27 1n15 s GLU 259 Ca 0.00 2.35 -0.31 0.00 0.36 0.00 0.00 54.97 57.37 1n15 s GLU 259 Cb 0.00 -3.24 -0.10 0.00 0.26 0.00 0.00 34.13 31.05 1n15 s GLU 259 CO 0.00 -0.63 1.48 -1.25 -0.54 0.00 0.00 175.26 174.32 1n15 s PRO 260 N 1.43 4.26 -0.02 4.30 0.05 -1.26 -0.91 135.00 142.85 1n15 s PRO 260 Ca 0.71 2.28 -0.05 0.00 0.05 0.00 0.00 61.00 63.98 1n15 s PRO 260 Cb -0.43 -3.16 -0.02 0.00 0.05 0.00 0.00 34.50 30.94 1n15 s PRO 260 CO 0.31 -0.50 -0.10 1.63 0.05 0.00 0.00 177.00 178.39 1n15 n LYS 261 N 3.37 0.16 -4.22 4.56 4.76 -0.25 -4.92 118.16 121.62 1n15 n LYS 261 Ca 0.11 0.07 -0.19 0.00 -2.87 0.00 0.00 58.31 55.42 1n15 n LYS 261 Cb 0.40 -0.78 -0.12 0.00 -1.84 0.00 0.00 35.03 32.68 1n15 n LYS 261 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1n15 s GLN 262 N -2.22 0.87 -0.06 1.97 -1.52 -0.91 -4.99 119.66 112.78 1n15 s GLN 262 Ca -0.10 -0.93 -0.01 0.00 -1.95 0.00 0.00 55.36 52.38 1n15 s GLN 262 Cb 0.02 -0.89 0.03 0.00 -0.22 0.00 0.00 33.01 31.95 1n15 s GLN 262 CO 0.13 0.20 -0.00 0.42 -0.25 0.00 0.00 175.29 175.80 1n15 s ILE 263 N -1.17 0.37 -0.05 1.08 1.01 -1.26 -0.32 121.20 120.85 1n15 s ILE 263 Ca -0.01 0.10 0.06 0.00 0.00 0.00 0.00 60.65 60.80 1n15 s ILE 263 Cb -0.10 -0.51 -0.01 0.00 0.01 0.00 0.00 42.46 41.85 1n15 s ILE 263 CO 0.02 0.25 -0.25 -0.69 0.00 0.00 0.00 174.94 174.27 1n15 s VAL 264 N 1.78 2.03 0.05 2.92 1.01 -0.03 -4.99 120.40 123.17 1n15 s VAL 264 Ca 0.02 -1.06 -0.23 0.00 0.00 0.00 0.00 61.98 60.71 1n15 s VAL 264 Cb -0.13 -1.71 -0.06 0.00 0.00 0.00 0.00 36.38 34.48 1n15 s VAL 264 CO -0.04 0.57 0.68 -0.55 0.00 0.00 0.00 175.10 175.75 1n15 s SER 265 N -0.25 7.13 0.00 3.32 0.15 -1.26 -1.35 113.70 121.43 1n15 s SER 265 Ca -0.01 1.35 0.24 0.00 0.70 0.00 0.00 55.95 58.23 1n15 s SER 265 Cb -0.13 -2.42 0.34 0.00 -1.71 0.00 0.00 66.02 62.10 1n15 s SER 265 CO 0.03 0.11 1.35 0.35 1.20 0.00 0.00 173.24 176.28 1n15 n THR 266 N 2.45 0.28 -1.78 6.45 -2.24 -0.23 -4.94 114.28 114.27 1n15 n THR 266 Ca -0.06 -0.63 -0.42 0.00 -2.27 0.00 0.00 64.05 60.68 1n15 n THR 266 Cb 0.50 1.19 -0.03 0.00 -2.10 0.00 0.00 70.33 69.89 1n15 n THR 266 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1n15 s ARG 267 N -1.72 4.14 0.00 -0.78 0.52 -1.26 -4.49 118.95 115.37 1n15 s ARG 267 Ca 0.34 2.55 0.00 0.00 -0.52 0.00 0.00 55.73 58.10 1n15 s ARG 267 Cb 0.22 -3.09 0.00 0.00 0.52 0.00 0.00 34.95 32.60 1n15 s ARG 267 CO 0.31 -0.71 0.00 0.41 0.02 0.00 0.00 175.30 175.33 1n15 n GLY 268 N 3.74 0.82 3.79 -3.53 0.00 -1.19 -5.04 105.19 103.77 1n15 n GLY 268 Ca 0.15 -0.61 -0.39 0.00 0.00 0.00 0.00 46.02 45.17 1n15 n GLY 268 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1n15 s MET 269 N 0.88 4.26 0.80 1.61 -1.94 -1.26 -0.59 119.30 123.06 1n15 s MET 269 Ca 0.00 0.73 -0.11 0.00 -1.71 0.00 0.00 55.69 54.61 1n15 s MET 269 Cb 0.00 -3.29 0.07 0.00 2.01 0.00 0.00 34.83 33.62 1n15 s MET 269 CO 0.00 0.51 1.09 0.95 -0.01 0.00 0.00 175.02 177.56 1n15 s THR 270 N -0.66 3.20 0.02 2.05 -4.23 0.10 -4.87 115.64 111.25 1n15 s THR 270 Ca 0.30 0.39 -0.05 0.00 -1.18 0.00 0.00 61.69 61.15 1n15 s THR 270 Cb -0.19 -2.91 -0.29 0.00 1.34 0.00 0.00 72.50 70.45 1n15 s THR 270 CO 0.18 -0.51 0.93 1.62 -0.54 0.00 0.00 174.62 176.30 1n15 h VAL 271 N -1.20 1.24 0.00 2.29 3.04 -1.54 -2.99 116.25 117.09 1n15 h VAL 271 Ca -0.45 -2.84 0.00 0.00 -1.01 0.00 0.00 66.70 62.40 1n15 h VAL 271 Cb 1.24 2.83 0.00 0.00 -2.01 0.00 0.00 31.29 33.35 1n15 h VAL 271 CO 0.53 0.84 0.00 -0.90 -1.01 0.00 0.00 177.57 177.03 1n15 n ASP 272 N -3.50 0.00 0.13 3.17 5.75 -1.26 -4.42 116.55 116.42 1n15 n ASP 272 Ca -0.15 0.52 0.13 0.00 -0.01 0.00 0.00 54.79 55.28 1n15 n ASP 272 Cb 1.05 -0.47 0.34 0.00 -1.03 0.00 0.00 41.12 41.01 1n15 n ASP 272 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1n15 h THR 273 N 0.00 0.00 -5.89 2.12 1.35 -1.99 -3.47 112.91 105.02 1n15 h THR 273 Ca 0.00 -0.61 -0.40 0.00 -0.55 0.00 0.00 66.41 64.85 1n15 h THR 273 Cb 0.00 1.60 0.12 0.00 -1.73 0.00 0.00 68.15 68.14 1n15 h THR 273 CO 0.00 0.00 -0.72 0.00 -0.25 0.00 0.00 175.52 174.55 1n15 n GLN 274 N -2.47 -7.19 -4.32 4.72 6.02 -1.13 -4.98 117.38 108.03 1n15 n GLN 274 Ca 0.05 0.79 -0.25 0.00 -0.01 0.00 0.00 57.00 57.58 1n15 n GLN 274 Cb 0.46 -5.79 -0.09 0.00 1.02 0.00 0.00 30.24 25.84 1n15 n GLN 274 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1n15 s THR 275 N -3.35 2.33 -0.04 5.09 -4.23 -1.26 -4.74 115.64 109.45 1n15 s THR 275 Ca 0.45 -1.86 -0.30 0.00 -1.18 0.00 0.00 61.69 58.80 1n15 s THR 275 Cb -0.20 -2.93 -0.03 0.00 1.34 0.00 0.00 72.50 70.68 1n15 s THR 275 CO 0.75 -0.06 1.03 -0.47 -0.54 0.00 0.00 174.62 175.32 1n15 s TYR 276 N -2.60 3.55 -0.20 3.99 5.04 -1.26 -0.72 117.35 125.14 1n15 s TYR 276 Ca 0.38 1.59 -0.03 0.00 -2.44 0.00 0.00 57.07 56.57 1n15 s TYR 276 Cb 0.04 -3.19 -0.01 0.00 0.35 0.00 0.00 41.96 39.15 1n15 s TYR 276 CO 0.20 -0.30 -0.07 -1.58 -1.34 0.00 0.00 175.55 172.46 1n15 s HIS 277 N 1.48 2.92 -1.23 4.97 5.65 0.25 -4.95 115.29 124.38 1n15 s HIS 277 Ca 0.52 -0.96 0.17 0.00 0.25 0.00 0.00 55.06 55.03 1n15 s HIS 277 Cb -0.21 -2.05 0.79 0.00 -1.18 0.00 0.00 32.58 29.93 1n15 s HIS 277 CO 0.24 -0.52 1.52 -2.30 -0.65 0.00 0.00 174.74 173.03 1n15 n PRO 278 N 4.59 0.13 -2.90 2.88 -0.02 -1.26 -3.17 135.00 135.25 1n15 n PRO 278 Ca -0.18 0.17 -0.13 0.00 -2.02 0.00 0.00 63.50 61.33 1n15 n PRO 278 Cb 0.51 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.51 1n15 n PRO 278 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1n15 n GLU 279 N -1.38 0.84 -2.76 -0.52 2.13 -1.26 -4.92 120.64 112.76 1n15 n GLU 279 Ca 0.06 -2.33 -0.42 0.00 0.66 0.00 0.00 57.16 55.13 1n15 n GLU 279 Cb 0.16 -1.34 -0.04 0.00 0.27 0.00 0.00 31.44 30.49 1n15 n GLU 279 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 1n15 s PRO 280 N -0.22 3.19 0.47 5.31 0.02 -1.26 -4.81 135.00 137.70 1n15 s PRO 280 Ca 0.32 -0.53 -0.22 0.00 0.02 0.00 0.00 61.00 60.59 1n15 s PRO 280 Cb 0.24 -4.18 -0.07 0.00 0.02 0.00 0.00 34.50 30.52 1n15 s PRO 280 CO -0.15 -1.85 1.17 1.03 -0.33 0.00 0.00 177.00 176.87 1n15 s ARG 281 N 4.55 3.69 -0.18 5.54 0.52 -1.26 -4.65 118.95 127.16 1n15 s ARG 281 Ca 0.28 1.77 -0.21 0.00 -0.52 0.00 0.00 55.73 57.05 1n15 s ARG 281 Cb -0.13 -2.36 -0.03 0.00 0.52 0.00 0.00 34.95 32.96 1n15 s ARG 281 CO 0.14 -0.61 0.65 0.08 0.02 0.00 0.00 175.30 175.58 1n15 s VAL 282 N -1.56 5.01 0.00 3.52 1.01 -0.76 -1.47 120.40 126.14 1n15 s VAL 282 Ca 0.65 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.87 1n15 s VAL 282 Cb -0.28 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.13 1n15 s VAL 282 CO 0.34 0.12 0.00 0.00 0.00 0.00 0.00 175.10 175.56 1n15 n ALA 283 N 4.94 0.00 -1.62 5.51 0.00 -0.01 -4.52 120.51 124.80 1n15 n ALA 283 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.09 1n15 n ALA 283 Cb 0.50 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.98 1n15 n ALA 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n15 s ALA 284 N -3.20 2.57 -0.00 0.00 0.00 -1.11 -4.40 121.76 115.62 1n15 s ALA 284 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.61 1n15 s ALA 284 Cb 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1n15 s ALA 284 CO 0.00 -1.06 -0.01 0.42 0.00 0.00 0.00 175.76 175.11 1n15 s ILE 285 N -2.12 0.09 -0.08 0.00 1.01 -1.26 -1.12 121.20 117.72 1n15 s ILE 285 Ca 0.69 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 61.25 1n15 s ILE 285 Cb -0.22 -0.10 0.02 0.00 0.01 0.00 0.00 42.46 42.18 1n15 s ILE 285 CO 0.36 0.04 0.20 -0.51 0.00 0.00 0.00 174.94 175.02 1n15 s ILE 286 N 0.10 -0.01 0.00 2.92 2.07 -0.44 -4.88 121.20 120.97 1n15 s ILE 286 Ca -0.01 0.03 -0.23 0.00 -1.41 0.00 0.00 60.65 59.03 1n15 s ILE 286 Cb -0.02 -0.29 -0.05 0.00 0.13 0.00 0.00 42.46 42.23 1n15 s ILE 286 CO -0.00 0.01 0.71 0.00 -1.91 0.00 0.00 174.94 173.75 1n15 s ALA 287 N 0.34 3.39 0.44 1.50 0.00 -1.26 -0.68 121.76 125.48 1n15 s ALA 287 Ca -0.02 0.18 -0.23 0.00 0.00 0.00 0.00 51.96 51.90 1n15 s ALA 287 Cb -0.03 -2.92 -0.08 0.00 0.00 0.00 0.00 23.12 20.08 1n15 s ALA 287 CO -0.01 0.05 1.08 0.45 0.00 0.00 0.00 175.76 177.32 1n15 s SER 288 N 0.13 6.47 -0.01 0.00 0.15 -0.88 -4.83 113.70 114.74 1n15 s SER 288 Ca 0.36 2.08 0.13 0.00 0.70 0.00 0.00 55.95 59.22 1n15 s SER 288 Cb -0.19 -2.58 -0.16 0.00 -1.71 0.00 0.00 66.02 61.38 1n15 s SER 288 CO 0.20 -0.69 0.46 1.41 1.20 0.00 0.00 173.24 175.82 1n15 n HIS 289 N -0.44 0.00 0.01 3.44 8.25 -1.26 -3.55 115.22 121.66 1n15 n HIS 289 Ca 0.07 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.49 1n15 n HIS 289 Cb 0.50 -0.09 -0.11 0.00 1.12 0.00 0.00 29.99 31.41 1n15 n HIS 289 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1n15 n GLU 290 N -1.49 0.63 -3.88 -0.41 -0.58 -1.26 -4.72 120.64 108.91 1n15 n GLU 290 Ca 0.01 0.26 -0.09 0.00 -0.42 0.00 0.00 57.16 56.92 1n15 n GLU 290 Cb 0.24 -1.80 -0.07 0.00 -0.57 0.00 0.00 31.44 29.23 1n15 n GLU 290 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 1n15 s HIS 291 N -2.77 0.20 -1.35 -0.32 3.76 -1.26 -4.99 115.29 108.56 1n15 s HIS 291 Ca -0.04 -0.64 -0.14 0.00 -0.15 0.00 0.00 55.06 54.10 1n15 s HIS 291 Cb 0.08 -0.09 0.09 0.00 1.11 0.00 0.00 32.58 33.77 1n15 s HIS 291 CO 0.82 -0.53 1.95 -0.35 -0.85 0.00 0.00 174.74 175.77 1n15 n PRO 292 N -0.05 3.18 -4.04 8.40 -0.05 -1.26 -4.54 135.00 136.63 1n15 n PRO 292 Ca -0.15 -3.12 -0.08 0.00 -0.05 0.00 0.00 63.50 60.10 1n15 n PRO 292 Cb 0.62 -3.21 -0.09 0.00 -0.05 0.00 0.00 33.50 30.77 1n15 n PRO 292 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 175.50 174.24 1n15 s GLU 293 N 2.52 0.81 -0.04 0.54 2.02 -1.26 -1.20 118.70 122.10 1n15 s GLU 293 Ca 0.46 -1.22 -0.00 0.00 0.02 0.00 0.00 54.97 54.23 1n15 s GLU 293 Cb 0.09 0.27 -0.03 0.00 0.10 0.00 0.00 34.13 34.55 1n15 s GLU 293 CO -0.02 -0.22 0.01 -0.06 0.02 0.00 0.00 175.26 174.99 1n15 s PHE 294 N -3.95 3.12 -0.33 1.61 0.08 0.13 -2.07 117.98 116.58 1n15 s PHE 294 Ca 0.13 0.14 -0.08 0.00 0.12 0.00 0.00 56.93 57.23 1n15 s PHE 294 Cb 0.07 -1.72 0.02 0.00 -0.57 0.00 0.00 43.02 40.81 1n15 s PHE 294 CO -0.06 0.47 0.14 0.42 -0.10 0.00 0.00 175.22 176.09 1n15 s ILE 295 N -1.01 4.19 -0.11 0.64 1.01 0.14 -0.64 121.20 125.42 1n15 s ILE 295 Ca 0.17 -0.84 -0.01 0.00 0.00 0.00 0.00 60.65 59.97 1n15 s ILE 295 Cb -0.11 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 39.05 1n15 s ILE 295 CO 0.07 -0.10 -0.05 -0.69 0.00 0.00 0.00 174.94 174.18 1n15 s VAL 296 N 1.50 3.82 -0.23 2.92 1.01 0.28 -1.33 120.40 128.37 1n15 s VAL 296 Ca 0.01 -0.41 -0.13 0.00 0.00 0.00 0.00 61.98 61.46 1n15 s VAL 296 Cb -0.18 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 1n15 s VAL 296 CO 0.04 0.55 0.27 0.20 0.00 0.00 0.00 175.10 176.17 1n15 s ASN 297 N -0.28 6.23 -0.31 3.32 0.01 -0.27 -0.77 114.94 122.87 1n15 s ASN 297 Ca 0.04 0.26 -0.03 0.00 -0.71 0.00 0.00 52.86 52.43 1n15 s ASN 297 Cb -0.13 -2.16 0.05 0.00 0.41 0.00 0.00 41.25 39.42 1n15 s ASN 297 CO 0.02 -0.03 0.03 -0.69 -1.51 0.00 0.00 177.10 174.92 1n15 s VAL 298 N 1.35 3.19 0.00 1.60 1.01 0.56 -0.83 120.40 127.28 1n15 s VAL 298 Ca 0.12 -1.33 0.00 0.00 0.00 0.00 0.00 61.98 60.77 1n15 s VAL 298 Cb -0.14 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1n15 s VAL 298 CO 0.07 -0.14 0.00 1.17 0.00 0.00 0.00 175.10 176.20 1n15 n LYS 299 N 4.67 0.00 -0.15 2.72 4.81 -0.54 -2.03 118.16 127.64 1n15 n LYS 299 Ca -0.13 0.00 0.28 0.00 -0.87 0.00 0.00 58.31 57.59 1n15 n LYS 299 Cb 0.44 -0.43 0.65 0.00 0.02 0.00 0.00 35.03 35.71 1n15 n LYS 299 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1n15 h GLU 300 N 0.00 0.00 -0.02 1.64 3.07 -1.87 0.47 114.58 117.86 1n15 h GLU 300 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1n15 h GLU 300 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1n15 h GLU 300 CO 0.00 0.00 -0.25 0.25 -1.40 0.00 0.00 179.01 177.61 1n15 n THR 301 N -3.66 0.00 -3.73 1.13 -2.24 -1.25 -4.61 114.28 99.93 1n15 n THR 301 Ca 0.19 -0.37 -0.23 0.00 -2.27 0.00 0.00 64.05 61.37 1n15 n THR 301 Cb 1.15 1.36 0.03 0.00 -2.10 0.00 0.00 70.33 70.77 1n15 n THR 301 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n15 n GLY 302 N 1.39 -0.32 3.34 3.38 0.00 0.16 -1.45 105.19 111.68 1n15 n GLY 302 Ca 0.11 0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.98 1n15 n GLY 302 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n15 s LYS 303 N -6.07 1.72 -0.26 1.61 -0.14 -0.87 -1.31 119.74 114.42 1n15 s LYS 303 Ca 0.11 -1.11 0.00 0.00 -1.36 0.00 0.00 55.97 53.61 1n15 s LYS 303 Cb -0.05 -1.92 0.04 0.00 -1.68 0.00 0.00 37.83 34.22 1n15 s LYS 303 CO 0.81 0.49 -0.08 0.08 -0.76 0.00 0.00 175.35 175.89 1n15 s VAL 304 N -0.83 2.56 -0.17 3.17 1.01 0.61 -0.33 120.40 126.43 1n15 s VAL 304 Ca 0.11 -1.30 -0.10 0.00 0.00 0.00 0.00 61.98 60.69 1n15 s VAL 304 Cb -0.10 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.85 1n15 s VAL 304 CO 0.02 0.10 0.18 -0.76 0.00 0.00 0.00 175.10 174.64 1n15 s LEU 305 N 1.23 4.26 -0.58 3.92 1.43 0.05 -0.78 118.68 128.21 1n15 s LEU 305 Ca -0.04 0.36 -0.13 0.00 -1.03 0.00 0.00 54.13 53.30 1n15 s LEU 305 Cb -0.18 -2.17 0.14 0.00 0.03 0.00 0.00 46.19 44.02 1n15 s LEU 305 CO -0.05 0.21 0.50 -0.76 0.23 0.00 0.00 176.35 176.49 1n15 s LEU 306 N 0.07 6.12 -0.51 1.79 1.43 0.05 -0.56 118.68 127.07 1n15 s LEU 306 Ca 0.12 -2.03 -0.22 0.00 -1.03 0.00 0.00 54.13 50.97 1n15 s LEU 306 Cb -0.12 -2.14 0.04 0.00 0.03 0.00 0.00 46.19 44.00 1n15 s LEU 306 CO 0.01 -0.74 0.78 -0.69 0.23 0.00 0.00 176.35 175.93 1n15 s VAL 307 N 1.21 4.64 -0.14 -1.59 1.01 0.19 -1.38 120.40 124.34 1n15 s VAL 307 Ca 0.07 0.03 -0.28 0.00 0.00 0.00 0.00 61.98 61.80 1n15 s VAL 307 Cb -0.25 -4.39 -0.01 0.00 0.00 0.00 0.00 36.38 31.73 1n15 s VAL 307 CO -0.00 -0.89 0.95 0.21 0.00 0.00 0.00 175.10 175.36 1n15 s ASN 308 N 2.58 7.13 -0.14 3.32 3.84 -0.23 -0.69 114.94 130.75 1n15 s ASN 308 Ca 0.24 1.39 0.16 0.00 0.21 0.00 0.00 52.86 54.86 1n15 s ASN 308 Cb -0.15 -2.52 0.65 0.00 -0.55 0.00 0.00 41.25 38.68 1n15 s ASN 308 CO 0.17 -0.46 1.57 0.00 -2.79 0.00 0.00 177.10 175.59 1n15 n TYR 309 N 5.23 1.37 0.17 0.43 0.18 -0.34 -4.09 117.16 120.11 1n15 n TYR 309 Ca 0.08 -0.68 0.08 0.00 1.88 0.00 0.00 57.90 59.25 1n15 n TYR 309 Cb 0.48 -0.29 0.59 0.00 -0.38 0.00 0.00 39.34 39.74 1n15 n TYR 309 CO 0.00 0.00 0.00 -0.22 -2.08 0.00 0.00 176.86 174.56 1n15 h LYS 310 N 3.30 0.14 -2.62 -3.48 3.64 -1.93 -3.31 116.57 112.31 1n15 h LYS 310 Ca 0.00 -0.01 -0.48 0.00 -1.27 0.00 0.00 60.65 58.89 1n15 h LYS 310 Cb 1.48 -0.03 -0.38 0.00 -0.41 0.00 0.00 32.23 32.88 1n15 h LYS 310 CO 0.26 0.10 -0.75 0.34 -2.27 0.00 0.00 179.45 177.12 1n15 s ASP 311 N -6.89 3.06 0.45 4.20 -1.08 -1.26 -5.02 116.67 110.13 1n15 s ASP 311 Ca -0.06 -1.22 0.30 0.00 -0.52 0.00 0.00 52.55 51.05 1n15 s ASP 311 Cb 0.17 -0.15 1.14 0.00 -1.46 0.00 0.00 42.92 42.63 1n15 s ASP 311 CO 0.69 -0.42 1.87 -0.29 0.52 0.00 0.00 175.17 177.54 1n15 h ILE 312 N 6.29 0.00 0.03 4.11 2.10 -1.86 -3.16 117.51 125.02 1n15 h ILE 312 Ca -0.17 -0.49 -0.24 0.00 1.08 0.00 0.00 64.86 65.04 1n15 h ILE 312 Cb 1.02 1.42 0.01 0.00 -1.09 0.00 0.00 36.82 38.18 1n15 h ILE 312 CO 0.40 0.00 -1.03 0.44 -1.08 0.00 0.00 178.15 176.89 1n15 h ASP 313 N 0.00 0.57 -3.91 2.19 3.32 -1.95 -3.39 116.42 113.26 1n15 h ASP 313 Ca 0.00 -0.49 -0.64 0.00 0.02 0.00 0.00 57.03 55.92 1n15 h ASP 313 Cb 0.53 -0.18 -0.40 0.00 0.22 0.00 0.00 39.33 39.50 1n15 h ASP 313 CO 0.00 1.30 -0.69 0.20 -1.72 0.00 0.00 179.24 178.33 1n15 s ASN 314 N -7.14 4.43 -0.00 6.45 0.01 -1.19 -5.10 114.94 112.40 1n15 s ASN 314 Ca -0.06 -2.50 -0.30 0.00 -0.71 0.00 0.00 52.86 49.29 1n15 s ASN 314 Cb 0.08 -1.52 -0.03 0.00 0.41 0.00 0.00 41.25 40.18 1n15 s ASN 314 CO 0.88 -0.31 1.06 -0.22 -1.51 0.00 0.00 177.10 176.99 1n15 s LEU 315 N 0.43 4.35 -0.17 0.60 2.96 -1.25 -4.71 118.68 120.88 1n15 s LEU 315 Ca 0.14 1.74 -0.04 0.00 -0.22 0.00 0.00 54.13 55.76 1n15 s LEU 315 Cb -0.22 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 42.88 1n15 s LEU 315 CO -0.05 -0.36 -0.04 -0.89 -1.32 0.00 0.00 176.35 173.69 1n15 s THR 316 N 1.25 3.75 -0.07 3.68 2.01 -1.26 -5.03 115.64 119.97 1n15 s THR 316 Ca 0.53 -0.40 0.02 0.00 0.31 0.00 0.00 61.69 62.15 1n15 s THR 316 Cb -0.23 -2.66 0.02 0.00 0.01 0.00 0.00 72.50 69.64 1n15 s THR 316 CO 0.26 0.47 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.87 1n15 s VAL 317 N 0.67 1.07 -0.34 3.82 1.01 -1.26 -1.07 120.40 124.29 1n15 s VAL 317 Ca -0.02 -0.42 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 1n15 s VAL 317 Cb -0.14 -1.00 -0.00 0.00 0.00 0.00 0.00 36.38 35.23 1n15 s VAL 317 CO 0.02 0.35 0.20 -0.89 0.00 0.00 0.00 175.10 174.78 1n15 s THR 318 N 0.86 4.86 -0.41 3.92 2.01 -0.48 -4.92 115.64 121.48 1n15 s THR 318 Ca -0.11 -0.47 -0.20 0.00 0.31 0.00 0.00 61.69 61.22 1n15 s THR 318 Cb -0.15 -3.55 0.02 0.00 0.01 0.00 0.00 72.50 68.83 1n15 s THR 318 CO 0.01 -0.05 0.61 -0.55 -0.69 0.00 0.00 174.62 173.95 1n15 s SER 319 N 1.64 6.33 -0.23 3.53 0.15 -1.26 -0.77 113.70 123.08 1n15 s SER 319 Ca 0.05 -0.25 -0.07 0.00 0.70 0.00 0.00 55.95 56.37 1n15 s SER 319 Cb -0.18 -2.31 -0.03 0.00 -1.71 0.00 0.00 66.02 61.79 1n15 s SER 319 CO 0.08 -0.70 0.07 -0.63 1.20 0.00 0.00 173.24 173.26 1n15 s ILE 320 N 2.70 4.48 0.23 6.45 1.01 0.04 -4.95 121.20 131.16 1n15 s ILE 320 Ca 0.22 -0.12 -0.30 0.00 0.00 0.00 0.00 60.65 60.45 1n15 s ILE 320 Cb -0.15 -3.07 -0.09 0.00 0.01 0.00 0.00 42.46 39.17 1n15 s ILE 320 CO 0.17 0.37 1.05 -0.83 0.00 0.00 0.00 174.94 175.70 1n15 s GLY 321 N 1.22 3.01 0.00 6.18 0.00 -1.26 -0.29 107.32 116.18 1n15 s GLY 321 Ca 0.05 0.78 0.00 0.00 0.00 0.00 0.00 44.72 45.54 1n15 s GLY 321 CO 0.03 1.46 0.00 0.00 0.00 0.00 0.00 173.10 174.59 1n15 n ALA 322 N 1.73 0.15 -3.34 3.20 0.00 -0.43 -4.85 120.51 116.97 1n15 n ALA 322 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1n15 n ALA 322 Cb 0.46 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.84 1n15 n ALA 322 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n15 s ALA 323 N -2.00 -1.19 0.52 0.00 0.00 -1.23 -5.01 121.76 112.85 1n15 s ALA 323 Ca 0.00 0.71 -0.21 0.00 0.00 0.00 0.00 51.96 52.45 1n15 s ALA 323 Cb 0.00 0.08 -0.07 0.00 0.00 0.00 0.00 23.12 23.13 1n15 s ALA 323 CO 0.00 -0.32 1.03 -2.30 0.00 0.00 0.00 175.76 174.17 1n15 n PRO 324 N 1.05 1.22 -2.98 0.00 -0.02 -1.26 -4.02 135.00 128.99 1n15 n PRO 324 Ca -0.20 0.45 -0.12 0.00 -2.02 0.00 0.00 63.50 61.61 1n15 n PRO 324 Cb 0.57 -2.17 0.06 0.00 -0.02 0.00 0.00 33.50 31.94 1n15 n PRO 324 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1n15 n PHE 325 N -1.10 -1.68 -2.25 6.00 3.72 -0.97 -4.29 117.46 116.89 1n15 n PHE 325 Ca 0.11 0.68 -0.41 0.00 -0.05 0.00 0.00 57.45 57.78 1n15 n PHE 325 Cb 0.44 -4.11 -0.03 0.00 -0.94 0.00 0.00 39.48 34.83 1n15 n PHE 325 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1n15 s LEU 326 N -5.09 4.44 0.00 4.37 1.43 -1.22 -2.19 118.68 120.42 1n15 s LEU 326 Ca 0.10 2.44 0.00 0.00 -1.03 0.00 0.00 54.13 55.64 1n15 s LEU 326 Cb -0.01 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.58 1n15 s LEU 326 CO 0.54 -0.45 0.00 1.57 0.23 0.00 0.00 176.35 178.24 1n15 n HIS 327 N 1.94 0.00 -2.44 0.29 -0.00 0.52 -4.12 115.22 111.41 1n15 n HIS 327 Ca 0.03 0.00 -0.23 0.00 0.46 0.00 0.00 57.72 57.98 1n15 n HIS 327 Cb 0.43 0.00 0.06 0.00 -0.12 0.00 0.00 29.99 30.36 1n15 n HIS 327 CO 0.00 0.00 0.00 0.16 0.46 0.00 0.00 176.34 176.96 1n15 s ASP 328 N 1.00 4.90 0.00 0.26 -4.77 -1.26 -2.75 116.67 114.05 1n15 s ASP 328 Ca 0.00 0.13 0.00 0.00 -3.30 0.00 0.00 52.55 49.38 1n15 s ASP 328 Cb 0.00 -0.82 0.00 0.00 -1.09 0.00 0.00 42.92 41.01 1n15 s ASP 328 CO 0.00 -1.47 0.00 0.61 0.70 0.00 0.00 175.17 175.01 1n15 n GLY 329 N -2.68 -0.96 3.82 2.12 0.00 -0.32 -1.08 105.19 106.09 1n15 n GLY 329 Ca 0.09 -1.13 -0.03 0.00 0.00 0.00 0.00 46.02 44.96 1n15 n GLY 329 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n15 s GLY 330 N 0.00 -0.06 0.69 -0.02 0.00 0.06 -4.08 107.32 103.92 1n15 s GLY 330 Ca 0.00 -0.08 -0.13 0.00 0.00 0.00 0.00 44.72 44.51 1n15 s GLY 330 CO 0.00 1.46 1.10 -0.98 0.00 0.00 0.00 173.10 174.68 1n15 s TRP 331 N -2.57 2.65 0.78 1.90 0.23 -1.26 -0.25 118.94 120.42 1n15 s TRP 331 Ca 0.18 1.54 -0.08 0.00 -2.03 0.00 0.00 56.10 55.72 1n15 s TRP 331 Cb -0.01 -3.11 0.12 0.00 0.03 0.00 0.00 33.47 30.50 1n15 s TRP 331 CO 0.03 -1.66 1.10 0.16 0.96 0.00 0.00 176.95 177.54 1n15 s ASP 332 N -2.91 4.22 0.49 2.95 -4.77 -0.84 -4.83 116.67 110.99 1n15 s ASP 332 Ca 0.64 0.20 0.28 0.00 -3.30 0.00 0.00 52.55 50.38 1n15 s ASP 332 Cb -0.19 -0.61 1.37 0.00 -1.09 0.00 0.00 42.92 42.40 1n15 s ASP 332 CO 0.46 -1.99 1.84 0.77 0.70 0.00 0.00 175.17 176.96 1n15 h SER 333 N -0.88 0.14 0.57 2.11 4.64 -1.88 -1.34 113.55 116.91 1n15 h SER 333 Ca -0.42 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1n15 h SER 333 Cb 1.28 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1n15 h SER 333 CO 0.49 0.04 -0.34 -1.54 -0.87 0.00 0.00 176.83 174.61 1n15 n SER 334 N -4.35 0.44 -1.80 4.97 3.41 -1.26 -4.96 113.62 110.07 1n15 n SER 334 Ca 0.21 -0.18 -0.13 0.00 -0.26 0.00 0.00 58.87 58.52 1n15 n SER 334 Cb 0.97 0.05 0.02 0.00 -0.26 0.00 0.00 64.21 64.99 1n15 n SER 334 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1n15 n HIS 335 N -1.38 -1.06 -0.01 7.33 8.25 -0.51 -4.92 115.22 122.94 1n15 n HIS 335 Ca 0.07 0.25 -0.01 0.00 -0.26 0.00 0.00 57.72 57.78 1n15 n HIS 335 Cb 0.33 -3.03 -0.01 0.00 1.12 0.00 0.00 29.99 28.40 1n15 n HIS 335 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1n15 n ARG 336 N -2.60 3.46 -4.29 -0.41 0.00 -1.26 -4.64 116.66 106.91 1n15 n ARG 336 Ca -0.08 0.00 -0.34 0.00 -0.00 0.00 0.00 57.85 57.43 1n15 n ARG 336 Cb 0.58 -1.03 -0.14 0.00 0.00 0.00 0.00 32.46 31.87 1n15 n ARG 336 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1n15 s TYR 337 N -2.03 2.92 -0.33 -0.14 2.02 -1.26 -0.57 117.35 117.95 1n15 s TYR 337 Ca -0.01 -0.75 -0.23 0.00 -0.37 0.00 0.00 57.07 55.72 1n15 s TYR 337 Cb 0.00 -1.99 0.00 0.00 -0.40 0.00 0.00 41.96 39.58 1n15 s TYR 337 CO 0.05 -0.35 0.76 0.12 -1.57 0.00 0.00 175.55 174.56 1n15 s PHE 338 N 0.90 3.16 -0.63 2.71 5.36 0.50 -1.98 117.98 128.00 1n15 s PHE 338 Ca -0.02 0.65 -0.17 0.00 -0.96 0.00 0.00 56.93 56.44 1n15 s PHE 338 Cb -0.15 -3.27 0.14 0.00 -0.34 0.00 0.00 43.02 39.39 1n15 s PHE 338 CO 0.01 -0.63 0.65 -1.64 -1.46 0.00 0.00 175.22 172.14 1n15 s MET 339 N 2.97 3.14 0.04 10.12 -1.94 0.65 -1.35 119.30 132.94 1n15 s MET 339 Ca 0.31 -1.70 0.08 0.00 -1.71 0.00 0.00 55.69 52.67 1n15 s MET 339 Cb -0.14 -4.34 -0.03 0.00 2.01 0.00 0.00 34.83 32.33 1n15 s MET 339 CO 0.14 -1.42 -0.23 -0.08 -0.01 0.00 0.00 175.02 173.42 1n15 s THR 340 N 1.81 2.43 -0.12 2.05 -1.32 -0.69 -0.76 115.64 119.04 1n15 s THR 340 Ca 0.10 -1.28 -0.11 0.00 -1.21 0.00 0.00 61.69 59.19 1n15 s THR 340 Cb -0.23 -1.98 -0.05 0.00 -1.51 0.00 0.00 72.50 68.73 1n15 s THR 340 CO 0.01 0.37 0.24 0.00 -2.21 0.00 0.00 174.62 173.03 1n15 s ALA 341 N -0.85 3.72 -1.02 11.08 0.00 -0.24 0.26 121.76 134.71 1n15 s ALA 341 Ca 0.13 -0.51 -0.03 0.00 0.00 0.00 0.00 51.96 51.56 1n15 s ALA 341 Cb -0.10 -2.22 0.31 0.00 0.00 0.00 0.00 23.12 21.11 1n15 s ALA 341 CO 0.03 0.36 1.44 0.00 0.00 0.00 0.00 175.76 177.59 1n15 n ALA 342 N 2.68 5.16 -0.11 0.00 0.00 -0.11 -0.35 120.51 127.78 1n15 n ALA 342 Ca -0.16 -4.79 -0.03 0.00 0.00 0.00 0.00 53.44 48.47 1n15 n ALA 342 Cb 0.53 -2.17 -0.03 0.00 0.00 0.00 0.00 19.45 17.79 1n15 n ALA 342 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1n15 n ASN 343 N 1.11 -0.28 0.03 0.00 0.23 -0.93 -0.89 115.26 114.53 1n15 n ASN 343 Ca 0.28 0.92 0.03 0.00 -0.53 0.00 0.00 54.58 55.29 1n15 n ASN 343 Cb 0.33 -0.28 0.16 0.00 -2.08 0.00 0.00 39.78 37.91 1n15 n ASN 343 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1n15 n ASN 344 N -3.53 0.11 -0.43 0.53 5.03 -1.26 -0.26 115.26 115.44 1n15 n ASN 344 Ca 0.01 0.54 0.11 0.00 0.87 0.00 0.00 54.58 56.11 1n15 n ASN 344 Cb 0.07 -0.56 0.06 0.00 -1.02 0.00 0.00 39.78 38.33 1n15 n ASN 344 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1n15 n SER 345 N -1.64 1.82 -3.72 6.41 7.64 -0.07 -4.98 113.62 119.09 1n15 n SER 345 Ca 0.01 -1.39 -0.25 0.00 1.01 0.00 0.00 58.87 58.25 1n15 n SER 345 Cb 0.05 0.44 0.05 0.00 -1.01 0.00 0.00 64.21 63.74 1n15 n SER 345 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1n15 n ASN 346 N -0.19 -4.01 -4.07 6.43 3.02 0.63 -4.98 115.26 112.10 1n15 n ASN 346 Ca 0.09 -0.70 -0.07 0.00 -0.03 0.00 0.00 54.58 53.87 1n15 n ASN 346 Cb 0.44 -4.40 -0.10 0.00 -0.61 0.00 0.00 39.78 35.12 1n15 n ASN 346 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1n15 s LYS 347 N -6.22 0.60 -0.20 3.52 1.02 -1.19 -2.15 119.74 115.12 1n15 s LYS 347 Ca 0.40 -1.15 -0.00 0.00 0.02 0.00 0.00 55.97 55.24 1n15 s LYS 347 Cb -0.19 0.21 0.02 0.00 -0.52 0.00 0.00 37.83 37.35 1n15 s LYS 347 CO 0.79 -0.12 -0.15 0.08 -0.92 0.00 0.00 175.35 175.03 1n15 s VAL 348 N -3.71 2.38 0.02 3.17 1.01 -0.29 -0.93 120.40 122.06 1n15 s VAL 348 Ca 0.05 -0.91 -0.21 0.00 0.00 0.00 0.00 61.98 60.91 1n15 s VAL 348 Cb 0.06 -2.06 -0.06 0.00 0.00 0.00 0.00 36.38 34.32 1n15 s VAL 348 CO -0.09 0.45 0.62 0.00 0.00 0.00 0.00 175.10 176.08 1n15 s ALA 349 N 1.32 3.49 -0.31 5.51 0.00 0.14 -1.19 121.76 130.71 1n15 s ALA 349 Ca 0.04 0.08 -0.06 0.00 0.00 0.00 0.00 51.96 52.01 1n15 s ALA 349 Cb -0.14 -2.77 0.02 0.00 0.00 0.00 0.00 23.12 20.23 1n15 s ALA 349 CO -0.10 0.20 0.08 0.08 0.00 0.00 0.00 175.76 176.02 1n15 s VAL 350 N -0.37 3.85 -0.26 0.00 1.01 -0.68 -1.71 120.40 122.23 1n15 s VAL 350 Ca 0.32 -0.87 -0.08 0.00 0.00 0.00 0.00 61.98 61.35 1n15 s VAL 350 Cb -0.19 -3.06 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 1n15 s VAL 350 CO 0.19 -0.01 0.10 -0.63 0.00 0.00 0.00 175.10 174.74 1n15 s ILE 351 N 1.46 4.44 -0.40 2.22 1.09 -0.46 -0.20 121.20 129.36 1n15 s ILE 351 Ca 0.01 -0.20 -0.29 0.00 -1.10 0.00 0.00 60.65 59.07 1n15 s ILE 351 Cb -0.18 -3.12 0.02 0.00 -1.06 0.00 0.00 42.46 38.12 1n15 s ILE 351 CO 0.02 0.27 1.14 -0.62 -0.10 0.00 0.00 174.94 175.65 1n15 s ASP 352 N 1.62 6.75 0.22 3.58 -1.08 0.08 -0.37 116.67 127.47 1n15 s ASP 352 Ca 0.06 0.78 0.26 0.00 -0.52 0.00 0.00 52.55 53.13 1n15 s ASP 352 Cb -0.16 -2.55 0.82 0.00 -1.46 0.00 0.00 42.92 39.58 1n15 s ASP 352 CO 0.05 -1.09 1.77 -1.54 0.52 0.00 0.00 175.17 174.87 1n15 n SER 353 N 7.47 0.82 -0.06 -0.34 3.41 0.26 -1.07 113.62 124.12 1n15 n SER 353 Ca 0.12 0.59 -0.03 0.00 -0.26 0.00 0.00 58.87 59.29 1n15 n SER 353 Cb 0.48 -0.80 -0.01 0.00 -0.26 0.00 0.00 64.21 63.62 1n15 n SER 353 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1n15 h LYS 354 N 0.00 0.00 0.00 4.33 3.64 -1.91 -3.38 116.57 119.25 1n15 h LYS 354 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1n15 h LYS 354 Cb 0.71 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1n15 h LYS 354 CO 0.00 0.00 0.00 -0.25 -2.27 0.00 0.00 179.45 176.93 1n15 n ASP 355 N -4.52 0.63 -3.10 4.20 8.00 -1.26 -4.97 116.55 115.54 1n15 n ASP 355 Ca -0.04 0.57 -0.08 0.00 0.71 0.00 0.00 54.79 55.95 1n15 n ASP 355 Cb 0.16 -0.74 0.04 0.00 -0.02 0.00 0.00 41.12 40.55 1n15 n ASP 355 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1n15 n ARG 356 N -2.10 -1.76 -3.74 -1.24 1.74 -0.23 -5.05 116.66 104.28 1n15 n ARG 356 Ca 0.05 1.13 -0.09 0.00 -0.77 0.00 0.00 57.85 58.17 1n15 n ARG 356 Cb 0.38 -5.65 -0.02 0.00 -1.02 0.00 0.00 32.46 26.15 1n15 n ARG 356 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1n15 s ARG 357 N -3.72 1.61 -0.40 5.56 1.70 -1.09 -4.99 118.95 117.63 1n15 s ARG 357 Ca 0.24 -0.85 -0.26 0.00 -0.47 0.00 0.00 55.73 54.39 1n15 s ARG 357 Cb -0.03 0.59 0.02 0.00 -0.57 0.00 0.00 34.95 34.96 1n15 s ARG 357 CO 0.72 -0.73 0.93 -1.17 -1.08 0.00 0.00 175.30 173.98 1n15 s LEU 358 N -2.88 3.98 0.26 -1.89 2.96 -1.26 -0.74 118.68 119.12 1n15 s LEU 358 Ca 0.09 0.45 0.12 0.00 -0.22 0.00 0.00 54.13 54.57 1n15 s LEU 358 Cb -0.04 -3.26 0.30 0.00 0.50 0.00 0.00 46.19 43.69 1n15 s LEU 358 CO 0.01 -0.93 1.57 0.28 -1.32 0.00 0.00 176.35 175.96 1n15 h SER 359 N 8.67 0.00 0.00 3.68 0.02 -0.94 -3.48 113.55 121.50 1n15 h SER 359 Ca -0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1n15 h SER 359 Cb 1.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.62 1n15 h SER 359 CO 1.00 0.64 0.00 0.00 -1.14 0.00 0.00 176.83 177.33 1n15 n ALA 360 N -2.38 0.00 -3.80 3.77 0.00 -1.23 -4.99 120.51 111.88 1n15 n ALA 360 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.14 1n15 n ALA 360 Cb 0.66 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.95 1n15 n ALA 360 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1n15 s LEU 361 N 0.00 2.11 -0.15 0.00 1.43 -1.26 -1.69 118.68 119.12 1n15 s LEU 361 Ca 0.00 -1.28 -0.17 0.00 -1.03 0.00 0.00 54.13 51.66 1n15 s LEU 361 Cb 0.00 -0.90 -0.04 0.00 0.03 0.00 0.00 46.19 45.28 1n15 s LEU 361 CO 0.00 -0.33 0.42 -0.69 0.23 0.00 0.00 176.35 175.98 1n15 s VAL 362 N 1.60 5.22 -0.23 -1.59 1.01 -0.33 -4.91 120.40 121.17 1n15 s VAL 362 Ca 0.02 0.80 -0.29 0.00 0.00 0.00 0.00 61.98 62.51 1n15 s VAL 362 Cb -0.18 -3.75 0.01 0.00 0.00 0.00 0.00 36.38 32.46 1n15 s VAL 362 CO -0.14 0.32 1.07 -1.81 0.00 0.00 0.00 175.10 174.54 1n15 s ASP 363 N 0.69 7.07 0.00 3.32 1.01 -1.26 -1.13 116.67 126.37 1n15 s ASP 363 Ca 0.22 1.41 0.00 0.00 0.71 0.00 0.00 52.55 54.89 1n15 s ASP 363 Cb -0.14 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1n15 s ASP 363 CO 0.08 -0.69 0.00 1.33 0.21 0.00 0.00 175.17 176.10 1n15 n VAL 364 N 5.35 0.00 -1.38 -1.27 0.24 -0.91 -4.83 118.33 115.53 1n15 n VAL 364 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 1n15 n VAL 364 Cb 0.46 -0.02 0.00 0.00 -1.47 0.00 0.00 33.84 32.81 1n15 n VAL 364 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n15 n GLY 365 N 5.00 -0.33 3.62 7.63 0.00 -1.26 -4.87 105.19 114.98 1n15 n GLY 365 Ca 0.00 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1n15 n GLY 365 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n15 s LYS 366 N -2.33 3.69 -0.49 1.61 1.02 -1.26 -4.18 119.74 117.79 1n15 s LYS 366 Ca 0.00 1.52 -0.19 0.00 0.02 0.00 0.00 55.97 57.32 1n15 s LYS 366 Cb 0.00 -4.06 0.03 0.00 -0.52 0.00 0.00 37.83 33.28 1n15 s LYS 366 CO 0.00 -1.42 0.63 2.41 -0.92 0.00 0.00 175.35 176.04 1n15 n THR 367 N 6.67 -9.03 -2.07 2.17 -1.04 -1.26 -0.30 114.28 109.42 1n15 n THR 367 Ca 0.19 0.53 -0.41 0.00 -2.04 0.00 0.00 64.05 62.32 1n15 n THR 367 Cb 0.46 -6.22 -0.02 0.00 -1.82 0.00 0.00 70.33 62.73 1n15 n THR 367 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1n15 s PRO 368 N -2.73 4.31 -0.38 -2.82 0.02 -1.26 -0.63 135.00 131.51 1n15 s PRO 368 Ca 0.24 2.25 0.03 0.00 0.02 0.00 0.00 61.00 63.53 1n15 s PRO 368 Cb -0.05 -3.11 0.15 0.00 0.02 0.00 0.00 34.50 31.51 1n15 s PRO 368 CO 0.80 -0.33 0.34 -1.58 -0.33 0.00 0.00 177.00 175.90 1n15 s HIS 369 N -0.32 0.04 -0.85 6.54 2.46 -0.73 -4.44 115.29 118.00 1n15 s HIS 369 Ca 0.56 -1.17 0.24 0.00 0.47 0.00 0.00 55.06 55.16 1n15 s HIS 369 Cb -0.41 -0.55 0.29 0.00 -0.13 0.00 0.00 32.58 31.78 1n15 s HIS 369 CO 0.46 -0.93 1.25 -0.35 -2.47 0.00 0.00 174.74 172.69 1n15 n PRO 370 N 4.00 0.12 0.00 2.88 -0.04 -1.26 -4.11 135.00 136.58 1n15 n PRO 370 Ca 0.14 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 1n15 n PRO 370 Cb 0.44 -1.55 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 1n15 n PRO 370 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1n15 n GLY 371 N 1.44 3.57 0.53 0.55 0.00 -1.26 -0.37 105.19 109.65 1n15 n GLY 371 Ca 0.04 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.11 1n15 n GLY 371 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n15 n ARG 372 N 13.41 1.40 0.00 1.61 1.74 -1.26 -1.18 116.66 132.39 1n15 n ARG 372 Ca 0.00 -1.07 0.00 0.00 -0.77 0.00 0.00 57.85 56.01 1n15 n ARG 372 Cb 0.00 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 1n15 n ARG 372 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n15 n GLY 373 N 1.37 -0.81 2.84 -0.13 0.00 0.50 -3.53 105.19 105.42 1n15 n GLY 373 Ca 0.12 -1.70 -0.26 0.00 0.00 0.00 0.00 46.02 44.18 1n15 n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n15 s ALA 374 N -1.27 1.13 -0.17 4.61 0.00 -0.94 -4.80 121.76 120.33 1n15 s ALA 374 Ca 0.00 -0.48 -0.09 0.00 0.00 0.00 0.00 51.96 51.39 1n15 s ALA 374 Cb 0.00 -0.92 -0.05 0.00 0.00 0.00 0.00 23.12 22.15 1n15 s ALA 374 CO 0.00 -0.57 0.14 -0.80 0.00 0.00 0.00 175.76 174.54 1n15 s ASN 375 N 1.79 6.29 -0.08 0.00 0.01 -1.25 -0.01 114.94 121.70 1n15 s ASN 375 Ca 0.04 0.34 -0.30 0.00 -0.71 0.00 0.00 52.86 52.23 1n15 s ASN 375 Cb -0.13 -2.09 0.10 0.00 0.41 0.00 0.00 41.25 39.54 1n15 s ASN 375 CO -0.07 0.27 0.82 0.72 -1.51 0.00 0.00 177.10 177.33 1n15 s PHE 376 N -0.20 -0.51 -0.23 2.20 -0.12 -1.06 -4.76 117.98 113.30 1n15 s PHE 376 Ca 0.11 0.82 -0.25 0.00 -0.05 0.00 0.00 56.93 57.56 1n15 s PHE 376 Cb -0.12 0.44 -0.01 0.00 -0.63 0.00 0.00 43.02 42.71 1n15 s PHE 376 CO 0.01 -0.51 0.85 0.08 -0.05 0.00 0.00 175.22 175.59 1n15 s VAL 377 N -1.42 4.83 0.10 -2.49 1.01 -1.26 -1.24 120.40 119.92 1n15 s VAL 377 Ca -0.06 1.62 -0.25 0.00 0.00 0.00 0.00 61.98 63.29 1n15 s VAL 377 Cb -0.00 -4.14 -0.07 0.00 0.00 0.00 0.00 36.38 32.18 1n15 s VAL 377 CO 0.04 -0.06 0.77 -2.28 0.00 0.00 0.00 175.10 173.57 1n15 s HIS 378 N 2.73 3.81 0.58 5.22 2.46 -0.42 -4.91 115.29 124.76 1n15 s HIS 378 Ca 0.36 1.55 0.28 0.00 0.47 0.00 0.00 55.06 57.72 1n15 s HIS 378 Cb -0.15 -2.80 1.52 0.00 -0.13 0.00 0.00 32.58 31.01 1n15 s HIS 378 CO 0.08 0.38 1.98 -1.35 -2.47 0.00 0.00 174.74 173.36 1n15 h PRO 379 N 5.09 0.00 0.00 2.88 0.11 -1.90 -2.52 132.00 135.66 1n15 h PRO 379 Ca -0.45 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.45 1n15 h PRO 379 Cb 1.21 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 1n15 h PRO 379 CO 0.69 0.00 -1.65 1.17 -0.21 0.00 0.00 178.00 177.99 1n15 n LYS 380 N -3.89 0.28 -0.09 1.05 4.81 -1.26 -4.79 118.16 114.27 1n15 n LYS 380 Ca 0.07 0.12 0.08 0.00 -0.87 0.00 0.00 58.31 57.70 1n15 n LYS 380 Cb 0.55 -0.97 0.29 0.00 0.02 0.00 0.00 35.03 34.92 1n15 n LYS 380 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1n15 n TYR 381 N -3.62 0.24 -4.38 5.64 4.01 -1.24 -5.06 117.16 112.76 1n15 n TYR 381 Ca -0.25 -0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.37 1n15 n TYR 381 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.69 1n15 n TYR 381 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1n15 n GLY 382 N 0.98 -1.38 3.68 2.72 0.00 -0.95 -4.80 105.19 105.44 1n15 n GLY 382 Ca 0.13 -1.23 -0.43 0.00 0.00 0.00 0.00 46.02 44.49 1n15 n GLY 382 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1n15 n PRO 383 N -0.56 2.71 -4.66 1.61 -0.04 -1.26 -1.30 135.00 131.50 1n15 n PRO 383 Ca 0.00 0.99 -0.30 0.00 -0.04 0.00 0.00 63.50 64.15 1n15 n PRO 383 Cb 0.00 -2.89 -0.09 0.00 -0.04 0.00 0.00 33.50 30.48 1n15 n PRO 383 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1n15 s VAL 384 N 3.17 1.42 -0.04 0.52 -7.23 -0.37 -2.03 120.40 115.84 1n15 s VAL 384 Ca 0.85 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 59.02 1n15 s VAL 384 Cb -0.50 -2.54 0.03 0.00 0.56 0.00 0.00 36.38 33.92 1n15 s VAL 384 CO 0.40 0.00 -0.01 0.86 -0.31 0.00 0.00 175.10 176.04 1n15 s TRP 385 N -2.88 0.47 0.30 2.82 -0.00 0.24 -2.57 118.94 117.32 1n15 s TRP 385 Ca 0.21 -0.07 0.09 0.00 -0.00 0.00 0.00 56.10 56.33 1n15 s TRP 385 Cb 0.05 -0.53 -0.05 0.00 -0.00 0.00 0.00 33.47 32.95 1n15 s TRP 385 CO 0.11 -0.17 0.02 -1.54 -0.00 0.00 0.00 176.95 175.36 1n15 s SER 386 N 1.14 4.42 -0.12 5.86 1.04 0.99 -1.06 113.70 125.97 1n15 s SER 386 Ca -0.08 -0.79 -0.19 0.00 0.48 0.00 0.00 55.95 55.37 1n15 s SER 386 Cb -0.14 -0.70 0.05 0.00 0.10 0.00 0.00 66.02 65.33 1n15 s SER 386 CO -0.02 -0.13 0.49 0.28 0.98 0.00 0.00 173.24 174.84 1n15 s THR 387 N -2.41 0.01 0.52 2.02 -1.32 -0.74 -2.22 115.64 111.50 1n15 s THR 387 Ca 0.34 -0.12 0.07 0.00 -1.21 0.00 0.00 61.69 60.77 1n15 s THR 387 Cb -0.04 -0.73 0.07 0.00 -1.51 0.00 0.00 72.50 70.29 1n15 s THR 387 CO 0.20 -0.07 0.59 -1.54 -2.21 0.00 0.00 174.62 171.60 1n15 n SER 388 N 2.08 2.23 -4.28 8.08 3.41 -1.26 -0.76 113.62 123.12 1n15 n SER 388 Ca -0.16 -2.55 -0.15 0.00 -0.26 0.00 0.00 58.87 55.74 1n15 n SER 388 Cb 0.56 -0.25 -0.10 0.00 -0.26 0.00 0.00 64.21 64.17 1n15 n SER 388 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1n15 s HIS 389 N -2.40 1.38 -0.18 7.33 0.09 -1.22 -1.77 115.29 118.52 1n15 s HIS 389 Ca 0.45 -0.85 0.09 0.00 -0.00 0.00 0.00 55.06 54.75 1n15 s HIS 389 Cb -0.04 -0.75 -0.22 0.00 -0.00 0.00 0.00 32.58 31.57 1n15 s HIS 389 CO 0.28 -0.00 0.12 1.28 -0.00 0.00 0.00 174.74 176.43 1n15 n LEU 390 N -0.29 1.34 0.10 0.89 4.77 0.20 -1.63 117.00 122.38 1n15 n LEU 390 Ca -0.08 0.06 -0.05 0.00 -0.03 0.00 0.00 56.01 55.91 1n15 n LEU 390 Cb 0.62 -0.17 0.06 0.00 -2.33 0.00 0.00 43.42 41.60 1n15 n LEU 390 CO 0.34 0.65 0.35 1.23 -1.33 0.00 0.00 177.39 178.64 1n15 h GLY 391 N 2.98 0.08 -1.32 -0.72 0.00 -0.72 -0.79 103.07 102.59 1n15 h GLY 391 Ca -0.50 -0.13 -0.30 0.00 0.00 0.00 0.00 47.33 46.41 1n15 h GLY 391 CO 0.01 0.11 -0.24 2.09 0.00 0.00 0.00 176.54 178.52 1n15 n ASP 392 N -3.67 -0.84 -1.29 0.19 5.68 -1.21 -4.82 116.55 110.59 1n15 n ASP 392 Ca -0.02 -2.61 0.07 0.00 -0.50 0.00 0.00 54.79 51.73 1n15 n ASP 392 Cb 0.74 1.69 0.28 0.00 -1.14 0.00 0.00 41.12 42.68 1n15 n ASP 392 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1n15 n GLY 393 N -0.48 2.12 3.92 6.12 0.00 -1.26 -3.66 105.19 111.96 1n15 n GLY 393 Ca 0.03 -0.65 -0.26 0.00 0.00 0.00 0.00 46.02 45.14 1n15 n GLY 393 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n15 s SER 394 N -0.78 5.03 -0.06 1.61 1.04 -1.26 -0.33 113.70 118.94 1n15 s SER 394 Ca 0.39 0.58 -0.02 0.00 0.48 0.00 0.00 55.95 57.37 1n15 s SER 394 Cb 0.25 -1.31 0.03 0.00 0.10 0.00 0.00 66.02 65.10 1n15 s SER 394 CO 0.18 -1.47 0.06 -0.63 0.98 0.00 0.00 173.24 172.36 1n15 s ILE 395 N -3.21 -0.07 -0.12 -1.02 1.01 -0.10 -3.44 121.20 114.25 1n15 s ILE 395 Ca 0.59 0.33 -0.14 0.00 0.00 0.00 0.00 60.65 61.42 1n15 s ILE 395 Cb -0.11 -0.23 -0.05 0.00 0.01 0.00 0.00 42.46 42.09 1n15 s ILE 395 CO 0.45 0.12 0.33 -0.44 0.00 0.00 0.00 174.94 175.41 1n15 s SER 396 N 2.15 6.54 -0.19 3.58 0.01 0.06 -1.21 113.70 124.64 1n15 s SER 396 Ca 0.05 0.64 -0.05 0.00 1.31 0.00 0.00 55.95 57.90 1n15 s SER 396 Cb -0.13 -2.20 -0.02 0.00 0.21 0.00 0.00 66.02 63.88 1n15 s SER 396 CO -0.04 0.14 -0.01 -0.76 0.41 0.00 0.00 173.24 172.98 1n15 s LEU 397 N 0.12 3.20 -0.07 2.44 1.43 -0.92 -1.79 118.68 123.09 1n15 s LEU 397 Ca 0.19 -0.21 0.05 0.00 -1.03 0.00 0.00 54.13 53.13 1n15 s LEU 397 Cb -0.14 -1.80 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 1n15 s LEU 397 CO 0.07 0.08 -0.23 -0.63 0.23 0.00 0.00 176.35 175.86 1n15 s ILE 398 N 0.92 1.94 0.29 -0.59 1.01 -0.23 -1.44 121.20 123.10 1n15 s ILE 398 Ca 0.01 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 59.38 1n15 s ILE 398 Cb -0.14 -1.65 -0.10 0.00 0.01 0.00 0.00 42.46 40.57 1n15 s ILE 398 CO 0.02 0.54 1.20 -0.83 0.00 0.00 0.00 174.94 175.87 1n15 s GLY 399 N 0.04 2.97 -0.08 6.18 0.00 -0.87 -0.59 107.32 114.96 1n15 s GLY 399 Ca -0.08 1.06 0.14 0.00 0.00 0.00 0.00 44.72 45.83 1n15 s GLY 399 CO 0.05 1.73 1.13 -1.30 0.00 0.00 0.00 173.10 174.71 1n15 n THR 400 N 1.25 1.00 -3.87 0.90 -2.24 -0.86 -0.99 114.28 109.48 1n15 n THR 400 Ca 0.00 -1.57 -0.28 0.00 -2.27 0.00 0.00 64.05 59.93 1n15 n THR 400 Cb 0.43 0.25 -0.12 0.00 -2.10 0.00 0.00 70.33 68.80 1n15 n THR 400 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1n15 s ASP 401 N -2.24 4.49 0.33 3.42 2.15 -1.26 -4.93 116.67 118.63 1n15 s ASP 401 Ca 0.25 -3.65 0.01 0.00 0.43 0.00 0.00 52.55 49.58 1n15 s ASP 401 Cb 0.25 -1.54 0.56 0.00 -0.30 0.00 0.00 42.92 41.89 1n15 s ASP 401 CO -0.05 -0.12 1.99 -0.65 -0.17 0.00 0.00 175.17 176.18 1n15 h PRO 402 N 5.60 0.94 0.00 4.34 0.11 -1.93 0.99 132.00 142.05 1n15 h PRO 402 Ca 0.12 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1n15 h PRO 402 Cb 0.79 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.69 1n15 h PRO 402 CO 0.68 0.62 0.00 1.63 -0.21 0.00 0.00 178.00 180.72 1n15 n LYS 403 N -4.43 0.00 0.14 1.05 5.02 -1.26 -3.48 118.16 115.21 1n15 n LYS 403 Ca 0.08 0.38 0.12 0.00 -2.02 0.00 0.00 58.31 56.87 1n15 n LYS 403 Cb 0.04 -1.30 0.19 0.00 -0.02 0.00 0.00 35.03 33.94 1n15 n LYS 403 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1n15 h ASN 404 N 0.00 0.00 -2.02 4.39 2.35 -1.99 -3.39 115.58 114.92 1n15 h ASN 404 Ca 0.00 -0.03 -0.54 0.00 -0.55 0.00 0.00 56.30 55.17 1n15 h ASN 404 Cb 0.00 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 37.97 1n15 h ASN 404 CO 0.00 0.02 -1.09 1.41 -1.65 0.00 0.00 177.43 176.12 1n15 n HIS 405 N -2.66 0.14 0.25 1.19 8.25 0.34 -4.96 115.22 117.76 1n15 n HIS 405 Ca 0.03 -3.68 0.10 0.00 -0.26 0.00 0.00 57.72 53.91 1n15 n HIS 405 Cb 0.50 -0.39 0.63 0.00 1.12 0.00 0.00 29.99 31.85 1n15 n HIS 405 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1n15 h PRO 406 N 3.71 0.00 0.00 -0.41 0.11 -1.58 -2.02 132.00 131.81 1n15 h PRO 406 Ca 0.09 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.13 1n15 h PRO 406 Cb 0.88 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 1n15 h PRO 406 CO 0.50 0.16 -0.33 -0.56 -0.21 0.00 0.00 178.00 177.56 1n15 h GLN 407 N 0.00 0.00 -0.01 1.05 -0.00 -1.90 -3.24 115.11 111.01 1n15 h GLN 407 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1n15 h GLN 407 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.85 1n15 h GLN 407 CO 0.02 0.33 -0.30 0.66 -0.00 0.00 0.00 178.83 179.55 1n15 n TYR 408 N -3.38 0.00 -1.93 0.06 4.01 -0.91 -4.94 117.16 110.08 1n15 n TYR 408 Ca 0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.33 1n15 n TYR 408 Cb 0.54 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.54 1n15 n TYR 408 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1n15 s ALA 409 N -1.75 3.76 -1.41 -0.72 0.00 -0.81 -2.72 121.76 118.12 1n15 s ALA 409 Ca 0.12 1.38 -0.06 0.00 0.00 0.00 0.00 51.96 53.40 1n15 s ALA 409 Cb 0.12 -3.62 0.03 0.00 0.00 0.00 0.00 23.12 19.65 1n15 s ALA 409 CO 0.36 -0.79 0.46 0.91 0.00 0.00 0.00 175.76 176.71 1n15 n TRP 410 N 3.67 -1.79 -4.86 0.00 5.03 -0.16 -4.91 117.44 114.42 1n15 n TRP 410 Ca 0.13 0.42 -0.31 0.00 3.03 0.00 0.00 57.50 60.77 1n15 n TRP 410 Cb 0.39 -3.68 -0.14 0.00 -1.03 0.00 0.00 31.31 26.84 1n15 n TRP 410 CO 0.00 0.00 0.00 0.15 -0.03 0.00 0.00 177.69 177.81 1n15 s LYS 411 N -5.72 1.94 -1.29 -0.99 1.02 -1.10 -4.72 119.74 108.88 1n15 s LYS 411 Ca 0.29 -1.04 -0.18 0.00 0.02 0.00 0.00 55.97 55.06 1n15 s LYS 411 Cb -0.14 -2.07 0.06 0.00 -0.52 0.00 0.00 37.83 35.16 1n15 s LYS 411 CO 0.36 0.53 1.74 0.21 -0.92 0.00 0.00 175.35 177.28 1n15 s LYS 412 N -1.23 3.92 0.26 1.68 2.20 -1.26 -2.05 119.74 123.26 1n15 s LYS 412 Ca 0.12 -1.96 -0.02 0.00 -0.36 0.00 0.00 55.97 53.76 1n15 s LYS 412 Cb -0.10 -5.53 0.53 0.00 -1.51 0.00 0.00 37.83 31.22 1n15 s LYS 412 CO 0.03 -2.33 1.72 -0.24 -0.36 0.00 0.00 175.35 174.16 1n15 h VAL 413 N 5.61 0.60 -3.20 4.02 3.04 -1.55 -3.47 116.25 121.30 1n15 h VAL 413 Ca 0.44 -0.15 -0.13 0.00 -1.01 0.00 0.00 66.70 65.85 1n15 h VAL 413 Cb 0.87 0.14 -0.02 0.00 -2.01 0.00 0.00 31.29 30.27 1n15 h VAL 413 CO 1.45 0.08 0.04 0.00 -1.01 0.00 0.00 177.57 178.13 1n15 n ALA 414 N -2.53 -0.80 -3.20 3.17 0.00 -1.19 -5.05 120.51 110.91 1n15 n ALA 414 Ca 0.16 -1.14 -0.13 0.00 0.00 0.00 0.00 53.44 52.33 1n15 n ALA 414 Cb 0.48 0.92 -0.09 0.00 0.00 0.00 0.00 19.45 20.75 1n15 n ALA 414 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1n15 s GLU 415 N -2.36 0.55 0.18 0.00 2.12 -1.26 -2.17 118.70 115.76 1n15 s GLU 415 Ca 0.18 -0.07 0.08 0.00 0.36 0.00 0.00 54.97 55.52 1n15 s GLU 415 Cb -0.02 0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.57 1n15 s GLU 415 CO 0.13 -0.13 -0.16 -0.51 -0.54 0.00 0.00 175.26 174.04 1n15 s LEU 416 N -0.94 2.49 -0.12 2.70 1.43 -0.35 -4.96 118.68 118.93 1n15 s LEU 416 Ca -0.10 -0.93 0.03 0.00 -1.03 0.00 0.00 54.13 52.10 1n15 s LEU 416 Cb -0.05 -0.75 0.01 0.00 0.03 0.00 0.00 46.19 45.43 1n15 s LEU 416 CO 0.03 -0.10 -0.23 -1.10 0.23 0.00 0.00 176.35 175.18 1n15 s GLN 417 N -3.18 3.00 0.02 1.70 -1.52 -1.26 -0.92 119.66 117.49 1n15 s GLN 417 Ca 0.19 -0.85 0.00 0.00 -1.95 0.00 0.00 55.36 52.75 1n15 s GLN 417 Cb -0.03 -2.34 0.00 0.00 -0.22 0.00 0.00 33.01 30.42 1n15 s GLN 417 CO 0.07 0.08 0.02 0.41 -0.25 0.00 0.00 175.29 175.62 1n15 n GLY 418 N 3.80 2.25 0.34 3.09 0.00 0.55 -4.78 105.19 110.44 1n15 n GLY 418 Ca -0.20 -2.15 0.23 0.00 0.00 0.00 0.00 46.02 43.91 1n15 n GLY 418 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1n15 h GLN 419 N 0.00 0.00 0.00 1.61 4.20 -1.96 -3.46 115.11 115.50 1n15 h GLN 419 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1n15 h GLN 419 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1n15 h GLN 419 CO 0.02 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.59 1n15 n GLY 420 N -1.09 0.09 3.10 3.46 0.00 -1.26 -5.02 105.19 104.47 1n15 n GLY 420 Ca -0.03 -1.61 -0.24 0.00 0.00 0.00 0.00 46.02 44.15 1n15 n GLY 420 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n15 n GLY 421 N 0.00 -1.49 1.50 -0.02 0.00 -1.24 -3.97 105.19 99.97 1n15 n GLY 421 Ca 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1n15 n GLY 421 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n15 n GLY 422 N -2.07 0.62 3.79 -0.02 0.00 -0.30 -4.06 105.19 103.15 1n15 n GLY 422 Ca 0.13 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1n15 n GLY 422 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n15 s SER 423 N -2.06 6.11 0.00 1.61 0.15 -0.64 -1.57 113.70 117.29 1n15 s SER 423 Ca 0.00 2.04 0.00 0.00 0.70 0.00 0.00 55.95 58.69 1n15 s SER 423 Cb 0.00 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 1n15 s SER 423 CO 0.00 -0.94 0.00 0.18 1.20 0.00 0.00 173.24 173.68 1n15 n LEU 424 N -1.05 0.89 -3.87 3.45 4.32 -1.25 -3.68 117.00 115.81 1n15 n LEU 424 Ca 0.10 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.96 1n15 n LEU 424 Cb 0.52 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 42.17 1n15 n LEU 424 CO 0.41 0.15 -0.36 -0.36 -1.22 0.00 0.00 177.39 176.00 1n15 s PHE 425 N -1.48 0.07 0.03 -1.77 0.08 -1.26 -4.14 117.98 109.50 1n15 s PHE 425 Ca 0.00 -0.00 0.09 0.00 0.12 0.00 0.00 56.93 57.14 1n15 s PHE 425 Cb 0.00 -0.07 -0.03 0.00 -0.57 0.00 0.00 43.02 42.36 1n15 s PHE 425 CO 0.00 -0.01 -0.26 -1.50 -0.10 0.00 0.00 175.22 173.35 1n15 s ILE 426 N 0.10 2.11 -0.03 0.64 2.07 -1.26 -1.63 121.20 123.20 1n15 s ILE 426 Ca -0.01 -1.31 -0.14 0.00 -1.41 0.00 0.00 60.65 57.78 1n15 s ILE 426 Cb -0.02 -1.79 0.02 0.00 0.13 0.00 0.00 42.46 40.81 1n15 s ILE 426 CO -0.00 0.43 0.31 -0.75 -1.91 0.00 0.00 174.94 173.01 1n15 s LYS 427 N -1.06 0.63 0.21 3.50 2.47 0.16 -4.46 119.74 121.18 1n15 s LYS 427 Ca 0.11 -0.11 -0.06 0.00 -1.56 0.00 0.00 55.97 54.34 1n15 s LYS 427 Cb -0.10 0.28 0.03 0.00 -1.46 0.00 0.00 37.83 36.58 1n15 s LYS 427 CO 0.01 -0.16 0.39 -2.37 0.16 0.00 0.00 175.35 173.38 1n15 n THR 428 N 1.49 0.00 -3.62 3.43 5.66 -1.26 -0.89 114.28 119.08 1n15 n THR 428 Ca -0.21 -0.64 -0.16 0.00 -3.05 0.00 0.00 64.05 59.99 1n15 n THR 428 Cb 0.56 0.55 -0.07 0.00 -1.55 0.00 0.00 70.33 69.82 1n15 n THR 428 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 175.07 169.74 1n15 s HIS 429 N -4.96 -0.46 0.41 1.09 2.46 -1.26 -4.73 115.29 107.83 1n15 s HIS 429 Ca 0.10 0.78 0.16 0.00 0.47 0.00 0.00 55.06 56.57 1n15 s HIS 429 Cb -0.02 0.28 1.04 0.00 -0.13 0.00 0.00 32.58 33.75 1n15 s HIS 429 CO 0.08 -0.52 1.86 -1.35 -2.47 0.00 0.00 174.74 172.34 1n15 h PRO 430 N 3.36 0.44 -0.01 2.88 0.11 -1.92 -0.88 132.00 135.98 1n15 h PRO 430 Ca -0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1n15 h PRO 430 Cb 1.16 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1n15 h PRO 430 CO 0.39 0.29 -0.27 1.63 -0.21 0.00 0.00 178.00 179.83 1n15 n LYS 431 N -4.52 0.80 -3.95 1.05 4.76 -1.26 -4.92 118.16 110.12 1n15 n LYS 431 Ca 0.19 -0.48 -0.27 0.00 -2.87 0.00 0.00 58.31 54.88 1n15 n LYS 431 Cb 0.65 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 32.31 1n15 n LYS 431 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1n15 s SER 432 N -2.53 6.28 -0.11 4.39 0.15 -0.34 -4.99 113.70 116.55 1n15 s SER 432 Ca 0.24 0.16 0.17 0.00 0.70 0.00 0.00 55.95 57.21 1n15 s SER 432 Cb 0.19 -1.88 0.26 0.00 -1.71 0.00 0.00 66.02 62.88 1n15 s SER 432 CO 0.53 0.07 1.13 -1.54 1.20 0.00 0.00 173.24 174.63 1n15 n SER 433 N -0.42 2.17 -4.49 5.45 3.41 -1.26 -4.62 113.62 113.86 1n15 n SER 433 Ca -0.07 -2.95 -0.26 0.00 -0.26 0.00 0.00 58.87 55.32 1n15 n SER 433 Cb 0.54 -0.39 -0.11 0.00 -0.26 0.00 0.00 64.21 63.99 1n15 n SER 433 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1n15 s HIS 434 N -2.58 2.42 -0.21 7.33 3.76 -1.26 -0.92 115.29 123.82 1n15 s HIS 434 Ca 0.28 -0.31 -0.01 0.00 -0.15 0.00 0.00 55.06 54.87 1n15 s HIS 434 Cb 0.25 -1.17 0.06 0.00 1.11 0.00 0.00 32.58 32.83 1n15 s HIS 434 CO 0.03 0.54 0.00 -1.17 -0.85 0.00 0.00 174.74 173.29 1n15 s LEU 435 N -2.89 1.74 -0.01 0.89 2.96 -0.77 -4.52 118.68 116.08 1n15 s LEU 435 Ca 0.24 -0.97 -0.08 0.00 -0.22 0.00 0.00 54.13 53.10 1n15 s LEU 435 Cb -0.08 -0.83 -0.05 0.00 0.50 0.00 0.00 46.19 45.74 1n15 s LEU 435 CO 0.13 -0.28 0.27 -0.31 -1.32 0.00 0.00 176.35 174.83 1n15 s TYR 436 N 1.67 3.60 -0.11 5.38 1.51 -0.07 -0.69 117.35 128.64 1n15 s TYR 436 Ca -0.03 0.62 -0.05 0.00 -1.01 0.00 0.00 57.07 56.61 1n15 s TYR 436 Cb -0.18 -2.02 0.05 0.00 -0.11 0.00 0.00 41.96 39.70 1n15 s TYR 436 CO -0.07 0.64 0.23 0.14 -1.11 0.00 0.00 175.55 175.38 1n15 s VAL 437 N -1.23 -0.17 0.75 0.71 -7.23 -0.68 0.39 120.40 112.94 1n15 s VAL 437 Ca 0.25 0.21 -0.04 0.00 -1.81 0.00 0.00 61.98 60.59 1n15 s VAL 437 Cb -0.13 -0.38 0.12 0.00 0.56 0.00 0.00 36.38 36.55 1n15 s VAL 437 CO 0.14 0.09 1.04 1.51 -0.31 0.00 0.00 175.10 177.56 1n15 s ASP 438 N 1.69 4.27 -0.31 4.85 1.47 -0.65 -1.72 116.67 126.27 1n15 s ASP 438 Ca -0.05 -0.09 0.17 0.00 1.18 0.00 0.00 52.55 53.77 1n15 s ASP 438 Cb -0.11 -0.32 0.46 0.00 -0.34 0.00 0.00 42.92 42.61 1n15 s ASP 438 CO -0.08 -1.92 1.28 1.07 0.68 0.00 0.00 175.17 176.20 1n15 n THR 439 N -2.98 0.65 -0.30 2.11 5.66 -1.26 -3.90 114.28 114.26 1n15 n THR 439 Ca 0.13 -2.08 0.11 0.00 -3.05 0.00 0.00 64.05 59.17 1n15 n THR 439 Cb 0.60 1.10 0.22 0.00 -1.55 0.00 0.00 70.33 70.71 1n15 n THR 439 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1n15 n THR 440 N -0.91 -0.36 -0.91 1.09 -1.04 -1.13 -1.07 114.28 109.96 1n15 n THR 440 Ca -0.03 1.88 0.07 0.00 -2.04 0.00 0.00 64.05 63.93 1n15 n THR 440 Cb 0.84 -2.72 0.41 0.00 -1.82 0.00 0.00 70.33 67.04 1n15 n THR 440 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1n15 n PHE 441 N -5.25 2.09 -2.19 -1.42 3.72 -0.61 -4.82 117.46 108.98 1n15 n PHE 441 Ca 0.19 -0.73 -0.42 0.00 -0.05 0.00 0.00 57.45 56.44 1n15 n PHE 441 Cb 0.61 -0.51 -0.03 0.00 -0.94 0.00 0.00 39.48 38.61 1n15 n PHE 441 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1n15 s ASN 442 N -0.79 6.84 0.29 4.37 3.84 -0.23 -4.68 114.94 124.58 1n15 s ASN 442 Ca 0.55 2.29 0.19 0.00 0.21 0.00 0.00 52.86 56.09 1n15 s ASN 442 Cb 0.42 -2.58 1.03 0.00 -0.55 0.00 0.00 41.25 39.56 1n15 s ASN 442 CO 0.16 -0.65 1.57 -0.81 -2.79 0.00 0.00 177.10 174.59 1n15 n PRO 443 N 4.07 0.12 -3.30 0.43 -0.04 -1.26 -4.51 135.00 130.51 1n15 n PRO 443 Ca 0.11 0.62 -0.38 0.00 -0.04 0.00 0.00 63.50 63.81 1n15 n PRO 443 Cb 0.43 -1.92 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 1n15 n PRO 443 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1n15 s ASP 444 N -3.88 6.64 0.10 3.54 2.15 -1.26 -4.99 116.67 118.97 1n15 s ASP 444 Ca -0.02 0.76 -0.24 0.00 0.43 0.00 0.00 52.55 53.48 1n15 s ASP 444 Cb 0.05 -2.29 -0.11 0.00 -0.30 0.00 0.00 42.92 40.27 1n15 s ASP 444 CO 0.17 -0.05 1.70 0.00 -0.17 0.00 0.00 175.17 176.82 1n15 h ALA 445 N 6.95 -0.16 -0.96 3.66 0.00 -1.97 -0.99 119.26 125.80 1n15 h ALA 445 Ca -0.39 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 1n15 h ALA 445 Cb 1.17 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.06 1n15 h ALA 445 CO 0.75 -0.61 0.60 -0.09 0.00 0.00 0.00 179.25 179.90 1n15 h ARG 446 N -0.20 1.29 -0.27 0.00 2.43 -1.95 0.68 114.38 116.36 1n15 h ARG 446 Ca 0.02 -0.10 -0.09 0.00 -0.81 0.00 0.00 59.98 58.99 1n15 h ARG 446 Cb 0.21 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1n15 h ARG 446 CO -0.05 0.89 -0.18 0.82 -1.51 0.00 0.00 179.97 179.93 1n15 h ILE 447 N 1.32 1.30 0.00 1.20 2.04 -1.88 -2.92 117.51 118.57 1n15 h ILE 447 Ca 0.35 -1.30 0.00 0.00 1.00 0.00 0.00 64.86 64.91 1n15 h ILE 447 Cb -0.09 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1n15 h ILE 447 CO -0.07 0.41 0.00 0.77 0.00 0.00 0.00 178.15 179.26 1n15 h SER 448 N 0.33 0.00 -0.46 1.72 4.64 -0.72 -2.60 113.55 116.46 1n15 h SER 448 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1n15 h SER 448 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1n15 h SER 448 CO 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 1n15 n GLN 449 N -2.99 2.18 -4.08 4.77 6.02 0.19 -2.27 117.38 121.21 1n15 n GLN 449 Ca 0.01 -1.82 -0.10 0.00 -0.01 0.00 0.00 57.00 55.08 1n15 n GLN 449 Cb 0.30 -1.42 -0.08 0.00 1.02 0.00 0.00 30.24 30.07 1n15 n GLN 449 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1n15 s SER 450 N -1.13 0.14 0.23 1.08 1.04 -0.98 -1.76 113.70 112.32 1n15 s SER 450 Ca 0.35 -1.09 0.09 0.00 0.48 0.00 0.00 55.95 55.78 1n15 s SER 450 Cb 0.19 0.39 -0.05 0.00 0.10 0.00 0.00 66.02 66.65 1n15 s SER 450 CO 0.25 -0.85 -0.17 0.68 0.98 0.00 0.00 173.24 174.13 1n15 s VAL 451 N -4.04 2.04 0.04 5.02 -7.23 -0.90 -4.32 120.40 111.02 1n15 s VAL 451 Ca 0.24 -2.28 0.01 0.00 -1.81 0.00 0.00 61.98 58.15 1n15 s VAL 451 Cb 0.05 -2.14 -0.04 0.00 0.56 0.00 0.00 36.38 34.81 1n15 s VAL 451 CO 0.04 -0.50 0.11 0.00 -0.31 0.00 0.00 175.10 174.44 1n15 s ALA 452 N -2.73 3.69 -0.06 1.32 0.00 -0.70 -1.70 121.76 121.59 1n15 s ALA 452 Ca 0.25 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.30 1n15 s ALA 452 Cb -0.03 -1.59 0.02 0.00 0.00 0.00 0.00 23.12 21.52 1n15 s ALA 452 CO 0.10 0.75 -0.04 0.08 0.00 0.00 0.00 175.76 176.65 1n15 s VAL 453 N -1.35 0.54 0.18 0.00 1.01 -0.72 -1.69 120.40 118.37 1n15 s VAL 453 Ca 0.28 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.24 1n15 s VAL 453 Cb -0.12 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 1n15 s VAL 453 CO 0.21 0.25 0.17 -0.36 0.00 0.00 0.00 175.10 175.36 1n15 s PHE 454 N 1.25 3.20 -0.35 5.22 0.40 0.13 -1.54 117.98 126.28 1n15 s PHE 454 Ca -0.06 -0.01 -0.16 0.00 -0.60 0.00 0.00 56.93 56.10 1n15 s PHE 454 Cb -0.14 -1.52 -0.01 0.00 0.51 0.00 0.00 43.02 41.87 1n15 s PHE 454 CO -0.02 0.52 0.39 0.34 0.70 0.00 0.00 175.22 177.15 1n15 s ASP 455 N -3.25 6.19 0.03 1.36 2.15 -1.26 -1.84 116.67 120.05 1n15 s ASP 455 Ca 0.32 -0.27 0.18 0.00 0.43 0.00 0.00 52.55 53.21 1n15 s ASP 455 Cb -0.10 -2.21 0.76 0.00 -0.30 0.00 0.00 42.92 41.07 1n15 s ASP 455 CO 0.24 -0.38 1.57 0.18 -0.17 0.00 0.00 175.17 176.61 1n15 n LEU 456 N 5.45 0.09 -0.67 -1.34 4.77 -0.10 -1.87 117.00 123.33 1n15 n LEU 456 Ca -0.08 0.52 0.12 0.00 -0.03 0.00 0.00 56.01 56.54 1n15 n LEU 456 Cb 0.49 -0.50 0.21 0.00 -2.33 0.00 0.00 43.42 41.28 1n15 n LEU 456 CO 0.41 -0.24 0.62 0.29 -1.33 0.00 0.00 177.39 177.14 1n15 n LYS 457 N -1.59 1.76 -2.75 3.23 5.02 -1.26 -4.53 118.16 118.04 1n15 n LYS 457 Ca 0.04 -1.34 -0.07 0.00 -2.02 0.00 0.00 58.31 54.92 1n15 n LYS 457 Cb 0.21 -1.47 0.05 0.00 -0.02 0.00 0.00 35.03 33.79 1n15 n LYS 457 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1n15 n ASN 458 N 0.55 -2.89 0.25 4.39 5.15 -0.78 -5.02 115.26 116.90 1n15 n ASN 458 Ca 0.14 -3.18 0.17 0.00 -0.60 0.00 0.00 54.58 51.10 1n15 n ASN 458 Cb 0.49 1.77 0.76 0.00 -0.53 0.00 0.00 39.78 42.27 1n15 n ASN 458 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1n15 h LEU 459 N 4.07 0.00 -0.82 1.20 3.38 -1.72 -2.47 115.31 118.95 1n15 h LEU 459 Ca -0.13 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.73 1n15 h LEU 459 Cb 1.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1n15 h LEU 459 CO 0.27 0.00 -0.52 0.44 0.09 0.00 0.00 178.44 178.71 1n15 h ASP 460 N 0.00 0.00 -4.02 -0.43 3.32 -1.95 -3.44 116.42 109.89 1n15 h ASP 460 Ca 0.00 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.55 1n15 h ASP 460 Cb 0.29 0.00 0.05 0.00 0.22 0.00 0.00 39.33 39.89 1n15 h ASP 460 CO 0.00 0.52 0.45 0.00 -1.72 0.00 0.00 179.24 178.49 1n15 s ALA 461 N -3.60 2.93 0.73 3.45 0.00 -0.93 -5.02 121.76 119.31 1n15 s ALA 461 Ca -0.01 0.82 -0.11 0.00 0.00 0.00 0.00 51.96 52.66 1n15 s ALA 461 Cb 0.12 -3.34 0.03 0.00 0.00 0.00 0.00 23.12 19.93 1n15 s ALA 461 CO 0.73 -0.54 1.07 0.21 0.00 0.00 0.00 175.76 177.24 1n15 s LYS 462 N -2.85 2.61 0.79 0.00 2.20 -1.26 -4.81 119.74 116.42 1n15 s LYS 462 Ca 0.65 1.00 -0.11 0.00 -0.36 0.00 0.00 55.97 57.15 1n15 s LYS 462 Cb -0.25 -1.95 0.07 0.00 -1.51 0.00 0.00 37.83 34.19 1n15 s LYS 462 CO 0.30 -1.35 1.09 1.52 -0.36 0.00 0.00 175.35 176.54 1n15 s TYR 463 N -3.00 2.61 0.25 4.03 -0.85 -1.26 -4.85 117.35 114.27 1n15 s TYR 463 Ca 0.59 1.44 0.07 0.00 -0.52 0.00 0.00 57.07 58.65 1n15 s TYR 463 Cb -0.15 -3.06 -0.04 0.00 0.38 0.00 0.00 41.96 39.10 1n15 s TYR 463 CO 0.55 -1.86 0.21 -0.65 -1.52 0.00 0.00 175.55 172.29 1n15 s GLN 464 N -4.95 2.97 -0.27 -3.49 -0.21 -0.59 -4.88 119.66 108.24 1n15 s GLN 464 Ca 0.61 -1.03 0.02 0.00 0.02 0.00 0.00 55.36 54.98 1n15 s GLN 464 Cb -0.17 -2.59 0.06 0.00 1.00 0.00 0.00 33.01 31.31 1n15 s GLN 464 CO 0.56 0.40 -0.09 0.08 -2.12 0.00 0.00 175.29 174.13 1n15 s VAL 465 N -2.12 2.36 -0.27 1.09 1.01 -1.26 -1.76 120.40 119.45 1n15 s VAL 465 Ca 0.33 -1.57 -0.22 0.00 0.00 0.00 0.00 61.98 60.53 1n15 s VAL 465 Cb -0.08 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.92 1n15 s VAL 465 CO 0.25 -0.04 0.70 -0.76 0.00 0.00 0.00 175.10 175.25 1n15 s LEU 466 N 1.14 4.08 -1.44 3.92 1.02 -0.69 -4.95 118.68 121.76 1n15 s LEU 466 Ca -0.08 0.72 -0.14 0.00 0.02 0.00 0.00 54.13 54.64 1n15 s LEU 466 Cb -0.20 -2.95 0.04 0.00 0.02 0.00 0.00 46.19 43.10 1n15 s LEU 466 CO -0.04 -0.46 2.18 -0.81 0.02 0.00 0.00 176.35 177.24 1n15 n PRO 467 N 5.88 2.86 0.10 1.29 -0.04 -1.26 -2.11 135.00 141.72 1n15 n PRO 467 Ca 0.01 -2.65 -0.13 0.00 -0.04 0.00 0.00 63.50 60.70 1n15 n PRO 467 Cb 0.48 -3.30 -0.06 0.00 -0.04 0.00 0.00 33.50 30.58 1n15 n PRO 467 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1n15 h ILE 468 N 4.15 0.31 -0.75 0.52 1.08 -1.93 -0.42 117.51 120.47 1n15 h ILE 468 Ca 0.56 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.98 1n15 h ILE 468 Cb 0.66 0.31 -0.03 0.00 -3.07 0.00 0.00 36.82 34.69 1n15 h ILE 468 CO 1.85 0.00 0.29 0.00 -0.69 0.00 0.00 178.15 179.61 1n15 h ALA 469 N 0.15 1.10 -0.32 1.87 0.00 -1.65 -2.15 119.26 118.26 1n15 h ALA 469 Ca 0.04 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1n15 h ALA 469 Cb 0.57 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1n15 h ALA 469 CO -0.22 0.64 -0.17 1.49 0.00 0.00 0.00 179.25 180.99 1n15 h GLU 470 N 1.09 0.58 -0.15 0.00 4.81 -1.72 -2.55 114.58 116.64 1n15 h GLU 470 Ca 0.25 -0.20 -0.08 0.00 -0.13 0.00 0.00 59.36 59.20 1n15 h GLU 470 Cb 0.21 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1n15 h GLU 470 CO -0.02 0.73 -0.27 -1.49 -0.73 0.00 0.00 179.01 177.22 1n15 h TRP 471 N 0.53 0.32 0.00 0.92 6.55 -0.50 -2.61 115.95 121.14 1n15 h TRP 471 Ca 0.09 -0.06 -0.02 0.00 0.95 0.00 0.00 58.89 59.84 1n15 h TRP 471 Cb 0.60 -0.08 -0.00 0.00 -0.86 0.00 0.00 29.16 28.81 1n15 h TRP 471 CO 0.02 0.54 -0.11 0.00 -1.05 0.00 0.00 178.44 177.84 1n15 h ALA 472 N 1.46 1.19 -5.90 1.49 0.00 -0.97 -3.47 119.26 113.06 1n15 h ALA 472 Ca 0.04 -0.10 -0.23 0.00 0.00 0.00 0.00 54.91 54.62 1n15 h ALA 472 Cb 0.62 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.43 1n15 h ALA 472 CO 0.04 0.14 -0.53 -3.47 0.00 0.00 0.00 179.25 175.43 1n15 n ASP 473 N -3.49 -6.48 -0.00 0.00 2.03 -0.99 -4.96 116.55 102.65 1n15 n ASP 473 Ca -0.01 -0.53 0.07 0.00 0.52 0.00 0.00 54.79 54.83 1n15 n ASP 473 Cb 0.25 -3.97 -0.09 0.00 -0.72 0.00 0.00 41.12 36.59 1n15 n ASP 473 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1n15 n LEU 474 N -2.54 0.18 0.00 -2.67 4.77 -1.26 -5.11 117.00 110.37 1n15 n LEU 474 Ca -0.11 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 1n15 n LEU 474 Cb 0.58 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1n15 n LEU 474 CO 0.59 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1n15 n GLY 475 N 1.61 0.68 3.77 -0.72 0.00 -1.26 -4.72 105.19 104.55 1n15 n GLY 475 Ca -0.01 -1.42 -0.31 0.00 0.00 0.00 0.00 46.02 44.28 1n15 n GLY 475 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1n15 s GLU 476 N 0.00 2.14 0.00 1.61 -1.05 -1.26 -4.99 118.70 115.15 1n15 s GLU 476 Ca 0.00 0.95 0.00 0.00 -0.15 0.00 0.00 54.97 55.77 1n15 s GLU 476 Cb 0.00 -1.90 0.00 0.00 -0.44 0.00 0.00 34.13 31.79 1n15 s GLU 476 CO 0.00 -1.66 0.00 0.41 0.95 0.00 0.00 175.26 174.96 1n15 n GLY 477 N -1.52 3.02 0.30 -3.83 0.00 -1.26 -4.71 105.19 97.19 1n15 n GLY 477 Ca 0.08 -2.00 0.04 0.00 0.00 0.00 0.00 46.02 44.14 1n15 n GLY 477 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n15 h ALA 478 N 0.00 1.68 -6.54 4.61 0.00 -1.94 -3.47 119.26 113.61 1n15 h ALA 478 Ca 0.00 -0.05 -0.51 0.00 0.00 0.00 0.00 54.91 54.35 1n15 h ALA 478 Cb 0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 17.79 17.56 1n15 h ALA 478 CO 0.00 0.27 -0.87 1.63 0.00 0.00 0.00 179.25 180.28 1n15 n LYS 479 N -4.45 -3.34 -2.06 0.00 5.02 -1.26 -4.82 118.16 107.24 1n15 n LYS 479 Ca 0.02 0.40 -0.42 0.00 -2.02 0.00 0.00 58.31 56.29 1n15 n LYS 479 Cb 0.09 -4.67 -0.03 0.00 -0.02 0.00 0.00 35.03 30.40 1n15 n LYS 479 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1n15 s ARG 480 N -6.64 4.24 0.03 1.97 0.52 -1.21 -4.52 118.95 113.35 1n15 s ARG 480 Ca 0.17 2.17 -0.15 0.00 -0.52 0.00 0.00 55.73 57.40 1n15 s ARG 480 Cb -0.09 -3.51 -0.06 0.00 0.52 0.00 0.00 34.95 31.81 1n15 s ARG 480 CO 0.89 -0.63 0.45 0.08 0.02 0.00 0.00 175.30 176.12 1n15 s VAL 481 N 2.23 4.96 -0.02 3.52 1.01 -0.96 0.18 120.40 131.32 1n15 s VAL 481 Ca 0.69 0.89 -0.17 0.00 0.00 0.00 0.00 61.98 63.39 1n15 s VAL 481 Cb -0.37 -3.75 0.03 0.00 0.00 0.00 0.00 36.38 32.29 1n15 s VAL 481 CO 0.30 0.52 0.35 0.54 0.00 0.00 0.00 175.10 176.81 1n15 s VAL 482 N -1.15 0.05 0.02 2.92 0.11 -0.54 -3.89 120.40 117.92 1n15 s VAL 482 Ca 0.27 -0.43 0.00 0.00 -2.93 0.00 0.00 61.98 58.89 1n15 s VAL 482 Cb -0.17 -0.65 0.00 0.00 -1.53 0.00 0.00 36.38 34.03 1n15 s VAL 482 CO 0.15 -0.23 0.00 1.67 -3.33 0.00 0.00 175.10 173.36 1n15 n GLN 483 N 1.23 -1.27 -2.85 1.54 7.27 -1.26 -2.14 117.38 119.90 1n15 n GLN 483 Ca -0.21 0.91 -0.38 0.00 0.07 0.00 0.00 57.00 57.39 1n15 n GLN 483 Cb 0.56 -1.49 -0.06 0.00 2.41 0.00 0.00 30.24 31.66 1n15 n GLN 483 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 1n15 s PRO 484 N -0.14 4.61 -0.15 3.69 0.02 -1.26 -4.35 135.00 137.41 1n15 s PRO 484 Ca 0.00 1.28 -0.08 0.00 0.02 0.00 0.00 61.00 62.22 1n15 s PRO 484 Cb 0.00 -3.01 0.06 0.00 0.02 0.00 0.00 34.50 31.56 1n15 s PRO 484 CO 0.00 0.41 0.37 -2.00 -0.33 0.00 0.00 177.00 175.44 1n15 s GLU 485 N -1.66 0.34 0.55 5.54 2.56 -0.67 -4.88 118.70 120.47 1n15 s GLU 485 Ca 0.44 0.72 -0.04 0.00 0.00 0.00 0.00 54.97 56.10 1n15 s GLU 485 Cb -0.21 -0.04 0.00 0.00 2.00 0.00 0.00 34.13 35.88 1n15 s GLU 485 CO 0.26 -0.16 0.83 0.71 -0.56 0.00 0.00 175.26 176.34 1n15 s TYR 486 N 1.40 3.27 0.74 5.30 1.51 -1.26 -0.09 117.35 128.22 1n15 s TYR 486 Ca -0.09 0.55 -0.02 0.00 -1.01 0.00 0.00 57.07 56.49 1n15 s TYR 486 Cb -0.09 -2.60 0.13 0.00 -0.11 0.00 0.00 41.96 39.30 1n15 s TYR 486 CO -0.12 -0.66 1.03 0.54 -1.11 0.00 0.00 175.55 175.23 1n15 s ASN 487 N -4.27 4.23 0.40 2.29 4.22 -1.01 -4.66 114.94 116.14 1n15 s ASN 487 Ca 0.52 -0.29 0.06 0.00 -2.14 0.00 0.00 52.86 51.01 1n15 s ASN 487 Cb -0.10 -0.06 0.81 0.00 1.28 0.00 0.00 41.25 43.17 1n15 s ASN 487 CO 0.43 -1.95 2.03 0.50 -2.04 0.00 0.00 177.10 176.07 1n15 h LYS 488 N -0.64 0.55 -0.02 3.55 3.64 -1.90 -2.44 116.57 119.31 1n15 h LYS 488 Ca -0.37 -0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 58.81 1n15 h LYS 488 Cb 1.26 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 1n15 h LYS 488 CO 0.40 0.40 -0.68 -0.09 -2.27 0.00 0.00 179.45 177.21 1n15 h ARG 489 N 0.56 0.09 0.00 1.90 2.43 -1.96 -3.48 114.38 113.92 1n15 h ARG 489 Ca 0.15 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1n15 h ARG 489 Cb -0.00 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1n15 h ARG 489 CO -0.03 0.73 0.00 0.41 -1.51 0.00 0.00 179.97 179.58 1n15 n GLY 490 N 0.42 0.58 0.54 2.80 0.00 -0.92 -4.87 105.19 103.73 1n15 n GLY 490 Ca -0.02 -0.55 0.06 0.00 0.00 0.00 0.00 46.02 45.51 1n15 n GLY 490 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n15 n ASP 491 N 1.00 2.44 -4.01 1.61 5.68 -1.26 -4.46 116.55 117.55 1n15 n ASP 491 Ca 0.00 -1.74 -0.19 0.00 -0.50 0.00 0.00 54.79 52.36 1n15 n ASP 491 Cb 0.00 -0.12 -0.15 0.00 -1.14 0.00 0.00 41.12 39.71 1n15 n ASP 491 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1n15 s GLU 492 N -0.96 0.74 -0.14 0.11 2.02 -1.26 -1.67 118.70 117.54 1n15 s GLU 492 Ca 0.18 -0.29 0.01 0.00 0.02 0.00 0.00 54.97 54.88 1n15 s GLU 492 Cb 0.11 -0.71 0.02 0.00 0.10 0.00 0.00 34.13 33.65 1n15 s GLU 492 CO 0.15 0.16 -0.14 0.08 0.02 0.00 0.00 175.26 175.53 1n15 s VAL 493 N -0.08 1.49 0.18 2.63 1.01 -0.66 -2.39 120.40 122.59 1n15 s VAL 493 Ca 0.01 -0.59 -0.02 0.00 0.00 0.00 0.00 61.98 61.38 1n15 s VAL 493 Cb -0.05 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.88 1n15 s VAL 493 CO -0.00 0.44 0.39 0.26 0.00 0.00 0.00 175.10 176.19 1n15 s TRP 494 N 1.41 3.48 0.01 5.22 0.52 0.87 -1.10 118.94 129.37 1n15 s TRP 494 Ca 0.03 0.43 -0.05 0.00 0.02 0.00 0.00 56.10 56.53 1n15 s TRP 494 Cb -0.13 -1.91 -0.01 0.00 -1.15 0.00 0.00 33.47 30.27 1n15 s TRP 494 CO -0.09 0.39 0.07 -0.06 0.02 0.00 0.00 176.95 177.28 1n15 s PHE 495 N -1.81 0.14 -0.13 -1.98 0.40 0.08 -1.67 117.98 113.02 1n15 s PHE 495 Ca 0.40 -0.33 -0.05 0.00 -0.60 0.00 0.00 56.93 56.34 1n15 s PHE 495 Cb -0.11 -0.11 -0.04 0.00 0.51 0.00 0.00 43.02 43.26 1n15 s PHE 495 CO 0.28 -0.27 0.06 -1.12 0.70 0.00 0.00 175.22 174.87 1n15 s SER 496 N -1.54 5.66 -0.83 1.36 0.01 -0.91 -1.35 113.70 116.10 1n15 s SER 496 Ca -0.13 0.21 -0.07 0.00 1.31 0.00 0.00 55.95 57.26 1n15 s SER 496 Cb -0.07 -1.79 0.21 0.00 0.21 0.00 0.00 66.02 64.57 1n15 s SER 496 CO -0.00 0.32 0.72 -0.69 0.41 0.00 0.00 173.24 174.00 1n15 s VAL 497 N -0.51 4.79 -1.21 3.43 1.01 0.70 -1.47 120.40 127.15 1n15 s VAL 497 Ca 0.10 -3.11 -0.22 0.00 0.00 0.00 0.00 61.98 58.75 1n15 s VAL 497 Cb -0.12 -3.99 -0.06 0.00 0.00 0.00 0.00 36.38 32.22 1n15 s VAL 497 CO 0.02 -1.02 1.90 0.86 0.00 0.00 0.00 175.10 176.86 1n15 s TRP 498 N -0.50 2.10 0.71 5.22 -0.00 0.13 -3.08 118.94 123.53 1n15 s TRP 498 Ca 0.22 0.09 0.01 0.00 -0.00 0.00 0.00 56.10 56.41 1n15 s TRP 498 Cb -0.13 -4.14 0.13 0.00 -0.00 0.00 0.00 33.47 29.34 1n15 s TRP 498 CO -0.08 -1.31 0.98 1.21 -0.00 0.00 0.00 176.95 177.76 1n15 s ASN 499 N 6.07 4.37 1.17 5.86 3.84 -1.26 -3.31 114.94 131.68 1n15 s ASN 499 Ca 0.66 -0.50 -0.17 0.00 0.21 0.00 0.00 52.86 53.06 1n15 s ASN 499 Cb 0.00 0.15 0.27 0.00 -0.55 0.00 0.00 41.25 41.12 1n15 s ASN 499 CO 0.12 -1.86 1.08 -0.83 -2.79 0.00 0.00 177.10 172.82 1n15 s GLY 500 N -4.76 1.55 0.31 1.21 0.00 -1.26 -4.33 107.32 100.03 1n15 s GLY 500 Ca 0.67 -0.69 0.16 0.00 0.00 0.00 0.00 44.72 44.85 1n15 s GLY 500 CO 0.44 0.11 1.58 0.07 0.00 0.00 0.00 173.10 175.30 1n15 h LYS 501 N -2.50 0.00 -0.48 2.90 2.10 -1.98 -3.05 116.57 113.57 1n15 h LYS 501 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 1n15 h LYS 501 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 1n15 h LYS 501 CO 0.42 0.51 0.00 0.09 -2.00 0.00 0.00 179.45 178.47 1n15 n ASN 502 N -3.43 3.52 -4.84 7.07 5.03 -1.26 -4.92 115.26 116.44 1n15 n ASN 502 Ca 0.00 -1.99 -0.27 0.00 0.87 0.00 0.00 54.58 53.20 1n15 n ASN 502 Cb 0.64 -0.31 -0.04 0.00 -1.02 0.00 0.00 39.78 39.05 1n15 n ASN 502 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1n15 s ASP 503 N -1.35 4.53 -0.17 6.41 1.01 -1.15 -5.12 116.67 120.82 1n15 s ASP 503 Ca 0.41 -1.24 -0.13 0.00 0.71 0.00 0.00 52.55 52.31 1n15 s ASP 503 Cb 0.23 0.14 -0.05 0.00 1.01 0.00 0.00 42.92 44.26 1n15 s ASP 503 CO 0.32 -0.89 0.26 -0.44 0.21 0.00 0.00 175.17 174.63 1n15 s SER 504 N -4.11 6.39 0.38 0.27 0.01 -1.26 -4.72 113.70 110.66 1n15 s SER 504 Ca 0.32 0.45 0.08 0.00 1.31 0.00 0.00 55.95 58.11 1n15 s SER 504 Cb -0.00 -2.17 -0.07 0.00 0.21 0.00 0.00 66.02 63.99 1n15 s SER 504 CO 0.19 0.11 0.00 -0.44 0.41 0.00 0.00 173.24 173.51 1n15 s SER 505 N 0.47 3.95 0.26 2.44 0.01 -1.26 -4.71 113.70 114.86 1n15 s SER 505 Ca 0.15 -1.23 -0.20 0.00 1.31 0.00 0.00 55.95 55.98 1n15 s SER 505 Cb -0.13 -0.41 0.02 0.00 0.21 0.00 0.00 66.02 65.71 1n15 s SER 505 CO 0.03 -0.37 0.65 0.00 0.41 0.00 0.00 173.24 173.97 1n15 s ALA 506 N -2.64 -1.06 -0.18 1.44 0.00 -1.18 -4.67 121.76 113.47 1n15 s ALA 506 Ca 0.35 -0.33 -0.00 0.00 0.00 0.00 0.00 51.96 51.98 1n15 s ALA 506 Cb 0.06 0.89 0.01 0.00 0.00 0.00 0.00 23.12 24.08 1n15 s ALA 506 CO 0.18 -0.97 -0.16 -0.51 0.00 0.00 0.00 175.76 174.31 1n15 s LEU 507 N -2.92 2.38 -0.10 0.00 1.43 -0.54 -0.21 118.68 118.71 1n15 s LEU 507 Ca 0.12 -0.55 -0.05 0.00 -1.03 0.00 0.00 54.13 52.61 1n15 s LEU 507 Cb -0.04 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 1n15 s LEU 507 CO 0.05 0.02 0.11 -0.69 0.23 0.00 0.00 176.35 176.07 1n15 s VAL 508 N 1.21 5.23 -0.02 -1.59 1.01 -0.46 -0.25 120.40 125.52 1n15 s VAL 508 Ca 0.02 0.07 0.08 0.00 0.00 0.00 0.00 61.98 62.15 1n15 s VAL 508 Cb -0.14 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 32.94 1n15 s VAL 508 CO -0.07 0.59 -0.26 -0.69 0.00 0.00 0.00 175.10 174.66 1n15 s VAL 509 N -1.03 2.06 -0.01 2.92 1.01 -0.73 -0.74 120.40 123.88 1n15 s VAL 509 Ca 0.16 -1.11 0.06 0.00 0.00 0.00 0.00 61.98 61.09 1n15 s VAL 509 Cb -0.12 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1n15 s VAL 509 CO 0.05 0.58 -0.20 -0.69 0.00 0.00 0.00 175.10 174.84 1n15 s VAL 510 N -0.60 1.58 -0.39 2.92 1.01 -0.25 -1.03 120.40 123.64 1n15 s VAL 510 Ca 0.10 -0.86 -0.29 0.00 0.00 0.00 0.00 61.98 60.93 1n15 s VAL 510 Cb -0.10 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 34.98 1n15 s VAL 510 CO -0.01 0.44 1.30 -0.62 0.00 0.00 0.00 175.10 176.22 1n15 s ASP 511 N -0.48 6.54 0.40 3.32 -1.08 -0.31 -1.66 116.67 123.40 1n15 s ASP 511 Ca 0.08 0.89 0.11 0.00 -0.52 0.00 0.00 52.55 53.11 1n15 s ASP 511 Cb -0.08 -2.54 0.83 0.00 -1.46 0.00 0.00 42.92 39.67 1n15 s ASP 511 CO -0.01 -1.26 1.92 -0.78 0.52 0.00 0.00 175.17 175.57 1n15 h ASP 512 N 9.81 0.12 0.59 -0.34 3.58 -1.65 1.02 116.42 129.56 1n15 h ASP 512 Ca -0.26 -0.03 -0.08 0.00 0.42 0.00 0.00 57.03 57.09 1n15 h ASP 512 Cb 1.09 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 42.10 1n15 h ASP 512 CO 1.08 0.32 -0.37 0.50 -2.88 0.00 0.00 179.24 177.89 1n15 h LYS 513 N 0.12 0.00 0.00 0.28 3.64 -1.90 -3.33 116.57 115.37 1n15 h LYS 513 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1n15 h LYS 513 Cb 0.42 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1n15 h LYS 513 CO 0.03 0.37 -0.53 0.25 -2.27 0.00 0.00 179.45 177.29 1n15 n THR 514 N -3.76 0.00 -1.33 1.00 -2.24 -1.00 -5.01 114.28 101.95 1n15 n THR 514 Ca -0.01 -0.22 -0.11 0.00 -2.27 0.00 0.00 64.05 61.44 1n15 n THR 514 Cb 0.45 0.71 -0.05 0.00 -2.10 0.00 0.00 70.33 69.35 1n15 n THR 514 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1n15 n LEU 515 N -1.23 -0.82 -4.91 3.22 4.77 0.35 -5.00 117.00 113.38 1n15 n LEU 515 Ca 0.00 0.28 -0.33 0.00 -0.03 0.00 0.00 56.01 55.93 1n15 n LEU 515 Cb 0.00 -1.78 -0.05 0.00 -2.33 0.00 0.00 43.42 39.26 1n15 n LEU 515 CO 0.00 -0.59 -0.15 -0.54 -1.33 0.00 0.00 177.39 174.78 1n15 s LYS 516 N -2.95 3.45 0.18 3.23 3.01 -1.21 -4.86 119.74 120.59 1n15 s LYS 516 Ca 0.00 -0.34 -0.33 0.00 -1.01 0.00 0.00 55.97 54.28 1n15 s LYS 516 Cb 0.00 -3.08 -0.13 0.00 -1.01 0.00 0.00 37.83 33.61 1n15 s LYS 516 CO 0.00 0.65 1.60 -0.11 0.51 0.00 0.00 175.35 178.01 1n15 n LEU 517 N 0.75 3.35 -0.08 3.17 7.94 -1.26 -1.16 117.00 129.70 1n15 n LEU 517 Ca -0.09 1.08 -0.15 0.00 -1.11 0.00 0.00 56.01 55.74 1n15 n LEU 517 Cb 0.52 -1.47 -0.07 0.00 0.53 0.00 0.00 43.42 42.93 1n15 n LEU 517 CO 0.46 -0.17 -1.07 1.17 -1.11 0.00 0.00 177.39 176.67 1n15 n LYS 518 N 3.43 0.39 -3.74 1.96 4.81 -0.20 -4.79 118.16 120.02 1n15 n LYS 518 Ca 0.16 0.13 -0.10 0.00 -0.87 0.00 0.00 58.31 57.63 1n15 n LYS 518 Cb 0.31 -1.22 -0.04 0.00 0.02 0.00 0.00 35.03 34.10 1n15 n LYS 518 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1n15 s ALA 519 N -2.32 -0.90 -0.10 3.14 0.00 -1.15 -5.01 121.76 115.42 1n15 s ALA 519 Ca -0.23 -0.24 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 1n15 s ALA 519 Cb 0.08 0.85 0.04 0.00 0.00 0.00 0.00 23.12 24.09 1n15 s ALA 519 CO 0.34 -0.79 0.06 0.08 0.00 0.00 0.00 175.76 175.45 1n15 s VAL 520 N -3.87 0.02 -0.52 0.00 1.01 -1.26 -1.77 120.40 114.01 1n15 s VAL 520 Ca 0.09 0.10 -0.19 0.00 0.00 0.00 0.00 61.98 61.98 1n15 s VAL 520 Cb -0.01 -0.42 0.06 0.00 0.00 0.00 0.00 36.38 36.01 1n15 s VAL 520 CO -0.03 0.00 0.64 -0.69 0.00 0.00 0.00 175.10 175.02 1n15 s VAL 521 N 2.11 4.86 0.21 2.92 1.01 0.65 -4.93 120.40 127.22 1n15 s VAL 521 Ca 0.03 -0.53 0.10 0.00 0.00 0.00 0.00 61.98 61.59 1n15 s VAL 521 Cb -0.14 -4.32 -0.04 0.00 0.00 0.00 0.00 36.38 31.88 1n15 s VAL 521 CO -0.06 -0.84 -0.16 -0.54 0.00 0.00 0.00 175.10 173.50 1n15 s LYS 522 N 2.65 1.81 0.00 2.72 1.02 -1.26 -1.46 119.74 125.22 1n15 s LYS 522 Ca 0.15 -1.46 0.00 0.00 0.02 0.00 0.00 55.97 54.68 1n15 s LYS 522 Cb -0.20 -1.98 0.00 0.00 -0.52 0.00 0.00 37.83 35.14 1n15 s LYS 522 CO 0.11 0.40 0.00 -3.47 -0.92 0.00 0.00 175.35 171.47 1n15 n ASP 523 N -0.06 0.00 0.29 2.83 -0.08 -1.26 -5.00 116.55 113.26 1n15 n ASP 523 Ca -0.10 0.00 0.16 0.00 -1.51 0.00 0.00 54.79 53.34 1n15 n ASP 523 Cb 0.57 0.00 0.93 0.00 2.34 0.00 0.00 41.12 44.95 1n15 n ASP 523 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1n15 h PRO 524 N 0.00 0.00 0.00 -0.67 0.13 -2.00 -1.68 132.00 127.78 1n15 h PRO 524 Ca 0.00 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.07 1n15 h PRO 524 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1n15 h PRO 524 CO 0.00 0.00 -0.31 0.00 -0.23 0.00 0.00 178.00 177.46 1n15 h ARG 525 N 0.00 0.00 -5.00 0.86 3.08 -2.00 -3.41 114.38 107.91 1n15 h ARG 525 Ca 0.01 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.57 1n15 h ARG 525 Cb 0.08 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.14 1n15 h ARG 525 CO -0.00 0.29 1.67 -0.11 -1.07 0.00 0.00 179.97 180.75 1n15 n LEU 526 N -3.16 3.54 -4.61 3.04 7.94 -0.63 -4.92 117.00 118.20 1n15 n LEU 526 Ca 0.03 -3.02 -0.39 0.00 -1.11 0.00 0.00 56.01 51.52 1n15 n LEU 526 Cb 0.65 -1.42 -0.10 0.00 0.53 0.00 0.00 43.42 43.08 1n15 n LEU 526 CO 0.38 -1.12 -0.02 -0.63 -1.11 0.00 0.00 177.39 174.89 1n15 s ILE 527 N 8.05 5.23 -1.26 1.96 1.01 -1.26 -4.43 121.20 130.50 1n15 s ILE 527 Ca 0.63 0.43 -0.11 0.00 0.00 0.00 0.00 60.65 61.59 1n15 s ILE 527 Cb 0.07 -3.63 -0.00 0.00 0.01 0.00 0.00 42.46 38.90 1n15 s ILE 527 CO 0.13 0.20 0.64 0.35 0.00 0.00 0.00 174.94 176.26 1n15 n THR 528 N 5.01 -4.59 -1.91 2.92 -2.24 -1.26 -3.51 114.28 108.70 1n15 n THR 528 Ca -0.11 -0.74 -0.42 0.00 -2.27 0.00 0.00 64.05 60.52 1n15 n THR 528 Cb 0.51 -3.60 -0.03 0.00 -2.10 0.00 0.00 70.33 65.12 1n15 n THR 528 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1n15 s PRO 529 N -6.24 4.20 0.00 -0.78 0.04 -1.25 -2.60 135.00 128.38 1n15 s PRO 529 Ca 0.25 2.39 0.00 0.00 0.04 0.00 0.00 61.00 63.68 1n15 s PRO 529 Cb -0.09 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1n15 s PRO 529 CO 0.87 -0.63 0.00 0.25 0.04 0.00 0.00 177.00 177.53 1n15 n THR 530 N 4.03 0.00 -2.02 1.26 -2.24 -0.57 -3.95 114.28 110.79 1n15 n THR 530 Ca 0.14 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.51 1n15 n THR 530 Cb 0.38 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.60 1n15 n THR 530 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1n15 s GLY 531 N 0.00 2.89 -0.06 3.38 0.00 -1.26 -4.72 107.32 107.55 1n15 s GLY 531 Ca 0.00 1.35 0.03 0.00 0.00 0.00 0.00 44.72 46.10 1n15 s GLY 531 CO 0.00 2.05 -0.14 0.54 0.00 0.00 0.00 173.10 175.55 1n15 s LYS 532 N -1.68 1.84 -0.22 2.90 1.02 -1.26 -1.32 119.74 121.02 1n15 s LYS 532 Ca 0.51 -0.49 -0.01 0.00 0.02 0.00 0.00 55.97 56.00 1n15 s LYS 532 Cb -0.42 -1.51 0.06 0.00 -0.52 0.00 0.00 37.83 35.44 1n15 s LYS 532 CO 0.54 0.08 -0.02 -0.06 -0.92 0.00 0.00 175.35 174.98 1n15 s PHE 533 N 0.51 1.90 0.15 3.18 0.08 -0.47 -4.90 117.98 118.43 1n15 s PHE 533 Ca -0.13 -1.45 -0.31 0.00 0.12 0.00 0.00 56.93 55.17 1n15 s PHE 533 Cb -0.15 -1.40 -0.08 0.00 -0.57 0.00 0.00 43.02 40.82 1n15 s PHE 533 CO 0.04 -0.72 1.38 1.21 -0.10 0.00 0.00 175.22 177.03 1n15 s ASN 534 N 1.56 6.82 0.09 1.36 3.84 -1.26 -1.27 114.94 126.07 1n15 s ASN 534 Ca -0.04 2.39 -0.31 0.00 0.21 0.00 0.00 52.86 55.11 1n15 s ASN 534 Cb -0.18 -2.60 -0.14 0.00 -0.55 0.00 0.00 41.25 37.78 1n15 s ASN 534 CO -0.07 -0.63 1.50 0.58 -2.79 0.00 0.00 177.10 175.68 1n15 h VAL 535 N 4.05 0.00 -0.28 -5.21 2.07 -1.01 -0.94 116.25 114.93 1n15 h VAL 535 Ca -0.43 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1n15 h VAL 535 Cb 1.21 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1n15 h VAL 535 CO 0.84 0.00 0.19 0.22 0.02 0.00 0.00 177.57 178.83 1n15 h TYR 536 N -0.78 0.35 -0.28 1.57 3.20 -1.27 -0.94 116.97 118.83 1n15 h TYR 536 Ca -0.03 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 1n15 h TYR 536 Cb 0.73 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 1n15 h TYR 536 CO -0.35 0.22 0.03 -0.91 -1.64 0.00 0.00 178.16 175.52 1n15 h ASN 537 N 0.38 0.37 0.06 -2.11 2.35 -1.81 -1.08 115.58 113.75 1n15 h ASN 537 Ca 0.10 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1n15 h ASN 537 Cb -0.04 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.23 1n15 h ASN 537 CO -0.02 0.41 -0.03 0.74 -1.65 0.00 0.00 177.43 176.87 1n15 h THR 538 N 0.40 1.24 -0.85 2.81 2.02 -0.75 -0.41 112.91 117.36 1n15 h THR 538 Ca 0.09 -1.49 0.13 0.00 0.77 0.00 0.00 66.41 65.91 1n15 h THR 538 Cb 0.21 2.15 -0.09 0.00 -1.74 0.00 0.00 68.15 68.68 1n15 h THR 538 CO 0.00 0.35 0.45 -0.61 0.37 0.00 0.00 175.52 176.08 1n15 h GLN 539 N -0.81 0.65 -0.54 6.66 4.15 -1.01 -2.42 115.11 121.80 1n15 h GLN 539 Ca -0.01 -0.04 -0.10 0.00 0.77 0.00 0.00 58.65 59.27 1n15 h GLN 539 Cb 0.63 -0.15 -0.06 0.00 0.21 0.00 0.00 27.48 28.11 1n15 h GLN 539 CO 0.01 0.43 0.10 0.72 -1.93 0.00 0.00 178.83 178.17 1n15 n HIS 540 N -4.83 1.85 -4.16 3.99 8.25 -0.42 -4.96 115.22 114.94 1n15 n HIS 540 Ca 0.16 -1.02 -0.33 0.00 -0.26 0.00 0.00 57.72 56.27 1n15 n HIS 540 Cb 0.39 -0.53 -0.06 0.00 1.12 0.00 0.00 29.99 30.91 1n15 n HIS 540 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1n15 n ASP 541 N -0.12 -0.35 -4.44 0.41 9.92 -0.91 -4.86 116.55 116.19 1n15 n ASP 541 Ca 0.32 -1.20 -0.44 0.00 -0.53 0.00 0.00 54.79 52.94 1n15 n ASP 541 Cb 1.18 -1.48 -0.04 0.00 -0.64 0.00 0.00 41.12 40.15 1n15 n ASP 541 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1n15 s VAL 542 N -4.12 4.50 0.00 2.53 1.01 -0.19 -5.01 120.40 119.13 1n15 s VAL 542 Ca 0.12 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1n15 s VAL 542 Cb -0.07 -4.68 0.00 0.00 0.00 0.00 0.00 36.38 31.63 1n15 s VAL 542 CO 0.93 -1.42 0.00 0.00 0.00 0.00 0.00 175.10 174.61