#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aaz h SER 14 N 0.00 0.33 -3.06 0.55 0.87 -2.03 -3.35 113.55 106.85 2aaz h SER 14 Ca 0.00 -0.18 -0.60 0.00 -1.23 0.00 0.00 61.79 59.77 2aaz h SER 14 Cb 0.00 -0.09 -0.40 0.00 -0.44 0.00 0.00 62.40 61.47 2aaz h SER 14 CO 0.00 0.83 -0.78 0.21 -0.53 0.00 0.00 176.83 176.57 2aaz s ASN 15 N -6.90 3.26 0.60 6.23 2.47 -1.26 -4.98 114.94 114.37 2aaz s ASN 15 Ca -0.05 -2.92 0.37 0.00 0.42 0.00 0.00 52.86 50.68 2aaz s ASN 15 Cb 0.12 -0.94 1.94 0.00 -1.45 0.00 0.00 41.25 40.92 2aaz s ASN 15 CO 0.80 -0.21 2.22 -0.65 -3.72 0.00 0.00 177.10 175.54 2aaz h PRO 16 N 6.25 0.00 -0.11 0.43 0.11 -2.04 -2.72 132.00 133.92 2aaz h PRO 16 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2aaz h PRO 16 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 2aaz h PRO 16 CO 0.48 0.03 0.00 -0.25 -0.21 0.00 0.00 178.00 178.05 2aaz n ASP 17 N -3.34 1.46 -4.70 -2.05 8.00 -1.26 -4.90 116.55 109.76 2aaz n ASP 17 Ca -0.02 -1.61 -0.42 0.00 0.71 0.00 0.00 54.79 53.45 2aaz n ASP 17 Cb 0.15 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 2aaz n ASP 17 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2aaz s HIS 18 N -1.87 2.33 0.61 1.24 2.46 -1.03 -4.85 115.29 114.18 2aaz s HIS 18 Ca 0.34 0.08 0.30 0.00 0.47 0.00 0.00 55.06 56.26 2aaz s HIS 18 Cb 0.18 -4.15 1.71 0.00 -0.13 0.00 0.00 32.58 30.19 2aaz s HIS 18 CO 0.28 -4.67 2.09 0.93 -2.47 0.00 0.00 174.74 170.90 2aaz h GLU 19 N 8.18 0.00 0.00 2.88 5.08 -1.92 -1.76 114.58 127.03 2aaz h GLU 19 Ca -0.45 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 2aaz h GLU 19 Cb 1.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 2aaz h GLU 19 CO 0.95 0.00 -0.10 1.49 -1.00 0.00 0.00 179.01 180.35 2aaz h GLU 20 N 0.00 0.00 0.00 2.33 4.81 -1.96 -2.09 114.58 117.67 2aaz h GLU 20 Ca 0.08 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2aaz h GLU 20 Cb 0.52 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.90 2aaz h GLU 20 CO -0.00 0.10 -0.02 1.88 -0.73 0.00 0.00 179.01 180.23 2aaz h TYR 21 N 0.00 0.00 -0.44 0.92 -1.99 -1.68 -1.17 116.97 112.61 2aaz h TYR 21 Ca -0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 2aaz h TYR 21 Cb 0.36 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.07 2aaz h TYR 21 CO 0.00 0.02 0.22 1.96 -0.00 0.00 0.00 178.16 180.36 2aaz h GLN 22 N 0.00 0.63 -0.04 4.88 4.20 -1.58 0.29 115.11 123.50 2aaz h GLN 22 Ca -0.00 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 2aaz h GLN 22 Cb 0.15 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 2aaz h GLN 22 CO 0.00 0.54 -0.01 -0.92 -0.67 0.00 0.00 178.83 177.77 2aaz h TYR 23 N 0.57 0.08 -0.46 2.96 5.03 -1.40 -2.35 116.97 121.40 2aaz h TYR 23 Ca 0.15 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.44 2aaz h TYR 23 Cb 0.11 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.35 2aaz h TYR 23 CO -0.01 0.44 0.27 -0.07 -1.32 0.00 0.00 178.16 177.46 2aaz h LEU 24 N -0.30 0.57 -0.99 2.82 3.38 -1.31 -2.51 115.31 116.96 2aaz h LEU 24 Ca 0.01 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2aaz h LEU 24 Cb 0.41 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 2aaz h LEU 24 CO 0.00 0.47 0.27 0.44 0.09 0.00 0.00 178.44 179.71 2aaz h ASP 25 N 0.61 0.91 -0.58 -0.43 3.45 -0.46 -1.64 116.42 118.28 2aaz h ASP 25 Ca 0.16 -0.13 -0.09 0.00 0.43 0.00 0.00 57.03 57.40 2aaz h ASP 25 Cb 0.02 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 38.53 2aaz h ASP 25 CO -0.03 0.81 -0.00 0.25 -1.57 0.00 0.00 179.24 178.70 2aaz h LEU 26 N 0.97 1.01 -0.55 1.55 5.85 -1.23 -0.35 115.31 122.57 2aaz h LEU 26 Ca 0.23 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 2aaz h LEU 26 Cb 0.19 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 2aaz h LEU 26 CO -0.02 1.07 0.22 0.40 -0.34 0.00 0.00 178.44 179.78 2aaz h ILE 27 N 0.92 1.22 -0.66 4.05 2.04 -1.20 0.56 117.51 124.45 2aaz h ILE 27 Ca 0.16 -0.68 -0.00 0.00 1.00 0.00 0.00 64.86 65.34 2aaz h ILE 27 Cb 0.56 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 2aaz h ILE 27 CO 0.03 0.26 0.40 -0.09 0.00 0.00 0.00 178.15 178.75 2aaz h ARG 28 N 0.76 0.90 -0.33 2.37 2.43 -1.01 -1.13 114.38 118.36 2aaz h ARG 28 Ca 0.19 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.23 2aaz h ARG 28 Cb 0.19 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 2aaz h ARG 28 CO -0.02 0.65 0.06 -0.09 -1.51 0.00 0.00 179.97 179.06 2aaz h ARG 29 N 0.90 0.55 -0.58 0.20 2.43 -0.62 -0.87 114.38 116.39 2aaz h ARG 29 Ca 0.24 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 59.27 2aaz h ARG 29 Cb -0.02 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 2aaz h ARG 29 CO -0.04 0.62 0.38 0.82 -1.51 0.00 0.00 179.97 180.24 2aaz h ILE 30 N 0.38 1.15 -0.66 1.20 2.04 -0.64 0.18 117.51 121.17 2aaz h ILE 30 Ca 0.10 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 2aaz h ILE 30 Cb 0.34 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 2aaz h ILE 30 CO 0.01 0.14 0.28 0.40 0.00 0.00 0.00 178.15 178.98 2aaz h ILE 31 N 0.78 1.23 0.34 -0.67 2.04 -1.08 0.22 117.51 120.38 2aaz h ILE 31 Ca 0.21 -0.71 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 2aaz h ILE 31 Cb -0.09 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 2aaz h ILE 31 CO -0.05 0.28 -0.16 0.78 0.00 0.00 0.00 178.15 179.00 2aaz h ASN 32 N 0.92 -0.39 -0.13 1.72 -0.26 -0.57 -3.39 115.58 113.48 2aaz h ASN 32 Ca 0.22 -0.15 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 2aaz h ASN 32 Cb 0.18 0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.54 2aaz h ASN 32 CO -0.02 0.06 0.00 1.33 -1.06 0.00 0.00 177.43 177.74 2aaz n VAL 33 N -5.10 0.74 -1.12 2.81 0.24 0.59 -5.05 118.33 111.44 2aaz n VAL 33 Ca -0.08 -0.87 -0.31 0.00 -2.04 0.00 0.00 64.34 61.03 2aaz n VAL 33 Cb 0.26 0.66 0.11 0.00 -1.47 0.00 0.00 33.84 33.41 2aaz n VAL 33 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2aaz s GLY 34 N -0.86 1.77 -0.13 7.63 0.00 0.77 -4.99 107.32 111.51 2aaz s GLY 34 Ca 0.11 0.45 -0.16 0.00 0.00 0.00 0.00 44.72 45.12 2aaz s GLY 34 CO 0.08 0.83 0.39 1.85 0.00 0.00 0.00 173.10 176.25 2aaz s GLU 35 N -4.67 4.29 -0.05 2.90 2.12 -0.07 -4.68 118.70 118.54 2aaz s GLU 35 Ca 0.65 0.29 -0.30 0.00 0.36 0.00 0.00 54.97 55.97 2aaz s GLU 35 Cb -0.20 -3.43 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 2aaz s GLU 35 CO 0.55 0.21 1.22 0.08 -0.54 0.00 0.00 175.26 176.77 2aaz s VAL 36 N 0.51 4.20 0.03 3.70 1.01 -1.26 -0.75 120.40 127.85 2aaz s VAL 36 Ca 0.22 1.54 -0.01 0.00 0.00 0.00 0.00 61.98 63.72 2aaz s VAL 36 Cb -0.14 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 2aaz s VAL 36 CO 0.07 0.00 -0.00 -0.13 0.00 0.00 0.00 175.10 175.04 2aaz s ARG 37 N 2.17 0.48 0.66 2.72 0.52 0.54 -4.99 118.95 121.06 2aaz s ARG 37 Ca 0.57 -0.87 -0.10 0.00 -0.52 0.00 0.00 55.73 54.81 2aaz s ARG 37 Cb -0.25 0.17 -0.00 0.00 0.52 0.00 0.00 34.95 35.39 2aaz s ARG 37 CO 0.23 -0.09 1.04 -2.14 0.02 0.00 0.00 175.30 174.35 2aaz s PRO 38 N -2.61 3.05 0.30 3.54 0.02 -1.26 -1.31 135.00 136.73 2aaz s PRO 38 Ca -0.05 0.44 -0.12 0.00 0.02 0.00 0.00 61.00 61.29 2aaz s PRO 38 Cb -0.01 -2.09 0.01 0.00 0.02 0.00 0.00 34.50 32.43 2aaz s PRO 38 CO -0.05 -0.85 0.57 0.16 -0.33 0.00 0.00 177.00 176.50 2aaz s ASP 39 N -4.30 0.11 0.25 2.53 -4.77 -1.26 -4.79 116.67 104.43 2aaz s ASP 39 Ca 0.56 -1.03 -0.03 0.00 -3.30 0.00 0.00 52.55 48.75 2aaz s ASP 39 Cb -0.11 0.67 0.45 0.00 -1.09 0.00 0.00 42.92 42.84 2aaz s ASP 39 CO 0.51 -1.30 1.77 -0.09 0.70 0.00 0.00 175.17 176.76 2aaz h ARG 40 N 2.14 0.62 0.00 2.11 2.43 -2.01 -2.49 114.38 117.19 2aaz h ARG 40 Ca -0.26 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 58.81 2aaz h ARG 40 Cb 1.25 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.65 2aaz h ARG 40 CO 0.35 0.41 -0.27 1.79 -1.51 0.00 0.00 179.97 180.74 2aaz h THR 41 N 0.64 0.72 0.00 0.20 1.35 -1.92 -3.47 112.91 110.43 2aaz h THR 41 Ca 0.42 -1.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 2aaz h THR 41 Cb 0.52 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 2aaz h THR 41 CO -0.32 0.27 0.00 0.61 -0.25 0.00 0.00 175.52 175.83 2aaz n GLY 42 N 0.01 0.92 0.11 5.82 0.00 -0.94 -4.91 105.19 106.21 2aaz n GLY 42 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.02 2aaz n GLY 42 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2aaz h THR 43 N 0.00 0.62 0.00 2.61 1.35 -1.91 -3.47 112.91 112.11 2aaz h THR 43 Ca 0.00 -2.07 0.00 0.00 -0.55 0.00 0.00 66.41 63.79 2aaz h THR 43 Cb 0.00 2.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.57 2aaz h THR 43 CO 0.00 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.23 2aaz n GLY 44 N 1.34 -0.54 3.45 5.82 0.00 -1.26 -4.54 105.19 109.45 2aaz n GLY 44 Ca -0.06 -1.57 -0.13 0.00 0.00 0.00 0.00 46.02 44.26 2aaz n GLY 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2aaz s THR 45 N -3.06 0.00 -0.09 2.61 -4.23 -0.43 -1.87 115.64 108.57 2aaz s THR 45 Ca 0.00 -1.65 0.03 0.00 -1.18 0.00 0.00 61.69 58.89 2aaz s THR 45 Cb 0.00 -2.51 0.01 0.00 1.34 0.00 0.00 72.50 71.33 2aaz s THR 45 CO 0.00 0.00 -0.19 0.54 -0.54 0.00 0.00 174.62 174.43 2aaz s VAL 46 N -3.46 1.67 0.10 2.29 0.11 -0.63 -0.34 120.40 120.14 2aaz s VAL 46 Ca 0.31 -0.79 -0.05 0.00 -2.93 0.00 0.00 61.98 58.52 2aaz s VAL 46 Cb 0.01 -1.48 -0.02 0.00 -1.53 0.00 0.00 36.38 33.36 2aaz s VAL 46 CO 0.17 0.47 0.12 0.00 -3.33 0.00 0.00 175.10 172.54 2aaz s ALA 47 N 0.55 0.23 0.02 1.54 0.00 0.07 -1.14 121.76 123.03 2aaz s ALA 47 Ca -0.16 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 50.84 2aaz s ALA 47 Cb -0.17 0.57 -0.02 0.00 0.00 0.00 0.00 23.12 23.51 2aaz s ALA 47 CO 0.05 -0.49 -0.10 -0.51 0.00 0.00 0.00 175.76 174.71 2aaz s LEU 48 N -2.93 2.14 -0.13 0.00 1.43 -0.41 -0.90 118.68 117.87 2aaz s LEU 48 Ca 0.12 -0.37 -0.07 0.00 -1.03 0.00 0.00 54.13 52.78 2aaz s LEU 48 Cb 0.06 -0.42 -0.04 0.00 0.03 0.00 0.00 46.19 45.82 2aaz s LEU 48 CO -0.06 -0.01 0.10 0.12 0.23 0.00 0.00 176.35 176.74 2aaz s PHE 49 N -0.75 3.44 -1.26 0.29 5.36 -1.26 -1.50 117.98 122.30 2aaz s PHE 49 Ca -0.01 0.38 -0.14 0.00 -0.96 0.00 0.00 56.93 56.20 2aaz s PHE 49 Cb -0.07 -1.97 0.00 0.00 -0.34 0.00 0.00 43.02 40.65 2aaz s PHE 49 CO 0.01 0.54 0.62 0.00 -1.46 0.00 0.00 175.22 174.92 2aaz n ALA 50 N 2.45 -2.33 -1.55 11.12 0.00 -0.07 -4.97 120.51 125.17 2aaz n ALA 50 Ca -0.19 -0.29 -0.29 0.00 0.00 0.00 0.00 53.44 52.67 2aaz n ALA 50 Cb 0.54 -2.83 0.11 0.00 0.00 0.00 0.00 19.45 17.28 2aaz n ALA 50 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2aaz s PRO 51 N -6.40 1.58 0.39 0.00 0.04 -1.26 -4.93 135.00 124.42 2aaz s PRO 51 Ca 0.28 0.45 -0.24 0.00 0.04 0.00 0.00 61.00 61.52 2aaz s PRO 51 Cb -0.11 -1.88 -0.12 0.00 0.04 0.00 0.00 34.50 32.44 2aaz s PRO 51 CO 0.89 -1.93 0.87 -2.30 0.04 0.00 0.00 177.00 174.57 2aaz n PRO 52 N -3.61 1.09 -1.40 0.56 -0.02 -1.26 -4.58 135.00 125.78 2aaz n PRO 52 Ca 0.07 0.39 -0.31 0.00 -2.02 0.00 0.00 63.50 61.63 2aaz n PRO 52 Cb 0.58 -1.83 0.07 0.00 -0.02 0.00 0.00 33.50 32.30 2aaz n PRO 52 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2aaz s SER 53 N -0.78 4.89 0.04 2.55 1.04 -1.26 -4.87 113.70 115.30 2aaz s SER 53 Ca 0.63 1.74 -0.08 0.00 0.48 0.00 0.00 55.95 58.72 2aaz s SER 53 Cb -0.60 -2.51 -0.05 0.00 0.10 0.00 0.00 66.02 62.96 2aaz s SER 53 CO 0.57 -1.78 0.32 -0.36 0.98 0.00 0.00 173.24 172.97 2aaz s PHE 54 N -2.95 3.58 -0.06 5.02 0.08 0.03 -4.91 117.98 118.76 2aaz s PHE 54 Ca 0.60 0.64 0.02 0.00 0.12 0.00 0.00 56.93 58.31 2aaz s PHE 54 Cb -0.16 -2.04 0.01 0.00 -0.57 0.00 0.00 43.02 40.26 2aaz s PHE 54 CO 0.55 0.58 -0.11 1.03 -0.10 0.00 0.00 175.22 177.16 2aaz s ARG 55 N -1.84 1.63 -0.05 0.44 0.52 -1.26 -0.74 118.95 117.64 2aaz s ARG 55 Ca 0.30 -0.38 0.02 0.00 -0.52 0.00 0.00 55.73 55.15 2aaz s ARG 55 Cb -0.13 -1.37 0.01 0.00 0.52 0.00 0.00 34.95 33.98 2aaz s ARG 55 CO 0.17 0.01 -0.11 -0.06 0.02 0.00 0.00 175.30 175.33 2aaz s PHE 56 N 0.71 1.31 0.16 -0.53 0.08 0.30 -4.98 117.98 115.02 2aaz s PHE 56 Ca -0.14 -0.44 -0.30 0.00 0.12 0.00 0.00 56.93 56.17 2aaz s PHE 56 Cb -0.16 -0.96 -0.07 0.00 -0.57 0.00 0.00 43.02 41.26 2aaz s PHE 56 CO 0.03 -0.22 1.00 0.45 -0.10 0.00 0.00 175.22 176.38 2aaz s SER 57 N 0.56 7.45 -0.00 1.36 0.15 -1.26 -0.83 113.70 121.12 2aaz s SER 57 Ca -0.11 1.92 0.09 0.00 0.70 0.00 0.00 55.95 58.55 2aaz s SER 57 Cb -0.14 -2.60 0.25 0.00 -1.71 0.00 0.00 66.02 61.82 2aaz s SER 57 CO 0.03 -0.08 1.21 0.18 1.20 0.00 0.00 173.24 175.78 2aaz n LEU 58 N 2.40 2.76 -4.77 3.45 4.77 0.18 -4.77 117.00 121.03 2aaz n LEU 58 Ca 0.02 -2.03 -0.31 0.00 -0.03 0.00 0.00 56.01 53.66 2aaz n LEU 58 Cb 0.48 -0.19 0.09 0.00 -2.33 0.00 0.00 43.42 41.47 2aaz n LEU 58 CO 0.52 0.68 0.70 0.00 -1.33 0.00 0.00 177.39 177.96 2aaz s ALA 59 N -1.05 2.21 -1.51 -1.18 0.00 -1.23 -3.62 121.76 115.37 2aaz s ALA 59 Ca 0.19 0.16 -0.13 0.00 0.00 0.00 0.00 51.96 52.18 2aaz s ALA 59 Cb 0.10 -3.24 0.08 0.00 0.00 0.00 0.00 23.12 20.06 2aaz s ALA 59 CO 0.12 -1.77 1.00 -0.25 0.00 0.00 0.00 175.76 174.86 2aaz n ASP 60 N -3.51 -4.88 -1.85 0.00 8.00 -1.26 -1.89 116.55 111.16 2aaz n ASP 60 Ca 0.08 -0.76 -0.18 0.00 0.71 0.00 0.00 54.79 54.65 2aaz n ASP 60 Cb 0.54 -4.00 -0.05 0.00 -0.02 0.00 0.00 41.12 37.59 2aaz n ASP 60 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2aaz n ASN 61 N -2.86 -4.82 -4.75 -2.24 4.13 -1.25 -4.88 115.26 98.59 2aaz n ASN 61 Ca 0.03 0.30 -0.41 0.00 1.68 0.00 0.00 54.58 56.18 2aaz n ASN 61 Cb 0.53 -4.22 -0.04 0.00 -1.54 0.00 0.00 39.78 34.51 2aaz n ASN 61 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2aaz s THR 62 N -2.63 3.40 -0.22 3.41 2.01 -0.79 0.28 115.64 121.09 2aaz s THR 62 Ca 0.00 1.31 0.02 0.00 0.31 0.00 0.00 61.69 63.33 2aaz s THR 62 Cb 0.00 -3.84 0.04 0.00 0.01 0.00 0.00 72.50 68.72 2aaz s THR 62 CO 0.00 0.28 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.86 2aaz s LEU 63 N -1.06 2.63 -1.05 4.42 2.96 -0.51 -4.59 118.68 121.47 2aaz s LEU 63 Ca 0.48 -1.01 -0.16 0.00 -0.22 0.00 0.00 54.13 53.22 2aaz s LEU 63 Cb -0.33 -1.38 -0.08 0.00 0.50 0.00 0.00 46.19 44.90 2aaz s LEU 63 CO 0.41 -0.13 2.13 -0.81 -1.32 0.00 0.00 176.35 176.63 2aaz n PRO 64 N 4.59 2.15 -3.26 0.98 -0.04 -1.26 -3.75 135.00 134.40 2aaz n PRO 64 Ca -0.16 -1.99 -0.42 0.00 -0.04 0.00 0.00 63.50 60.89 2aaz n PRO 64 Cb 0.46 -2.91 -0.08 0.00 -0.04 0.00 0.00 33.50 30.92 2aaz n PRO 64 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2aaz s LEU 65 N 1.14 4.57 0.24 1.53 2.96 -1.26 -4.24 118.68 123.63 2aaz s LEU 65 Ca 0.52 -0.34 -0.29 0.00 -0.22 0.00 0.00 54.13 53.80 2aaz s LEU 65 Cb 0.14 -2.51 -0.15 0.00 0.50 0.00 0.00 46.19 44.17 2aaz s LEU 65 CO 0.02 -0.56 0.95 0.18 -1.32 0.00 0.00 176.35 175.62 2aaz n LEU 66 N 5.75 1.15 -0.00 -0.68 4.77 -1.26 -4.74 117.00 121.99 2aaz n LEU 66 Ca -0.06 1.16 0.06 0.00 -0.03 0.00 0.00 56.01 57.15 2aaz n LEU 66 Cb 0.48 -1.21 -0.08 0.00 -2.33 0.00 0.00 43.42 40.29 2aaz n LEU 66 CO 0.46 -1.68 -0.16 0.35 -1.33 0.00 0.00 177.39 175.03 2aaz n THR 67 N 0.46 0.00 1.51 -5.08 -2.24 -1.26 -4.50 114.28 103.17 2aaz n THR 67 Ca 0.12 -0.23 0.12 0.00 -2.27 0.00 0.00 64.05 61.79 2aaz n THR 67 Cb 0.29 0.83 0.69 0.00 -2.10 0.00 0.00 70.33 70.04 2aaz n THR 67 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2aaz n THR 68 N -1.43 0.00 -3.50 4.28 -2.24 -1.26 -0.79 114.28 109.34 2aaz n THR 68 Ca 0.01 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.64 2aaz n THR 68 Cb 0.22 -0.61 -0.05 0.00 -2.10 0.00 0.00 70.33 67.80 2aaz n THR 68 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2aaz s LYS 69 N -2.00 1.03 -0.18 -0.78 -2.85 -1.26 -4.65 119.74 109.05 2aaz s LYS 69 Ca 0.35 0.04 -0.29 0.00 -1.00 0.00 0.00 55.97 55.06 2aaz s LYS 69 Cb 0.16 0.48 -0.01 0.00 -2.06 0.00 0.00 37.83 36.40 2aaz s LYS 69 CO 0.27 -0.36 1.29 0.50 0.10 0.00 0.00 175.35 177.15 2aaz s ARG 70 N -1.91 4.19 -0.14 1.78 3.52 -1.13 -4.60 118.95 120.66 2aaz s ARG 70 Ca -0.06 1.64 -0.11 0.00 -0.13 0.00 0.00 55.73 57.08 2aaz s ARG 70 Cb -0.00 -3.79 -0.05 0.00 -1.56 0.00 0.00 34.95 29.55 2aaz s ARG 70 CO 0.02 -0.77 0.21 0.08 -0.81 0.00 0.00 175.30 174.04 2aaz s VAL 71 N 3.65 5.36 -1.06 7.11 1.01 -1.26 -4.76 120.40 130.45 2aaz s VAL 71 Ca 0.56 0.38 -0.24 0.00 0.00 0.00 0.00 61.98 62.68 2aaz s VAL 71 Cb -0.22 -3.53 -0.13 0.00 0.00 0.00 0.00 36.38 32.50 2aaz s VAL 71 CO 0.16 0.49 1.94 0.33 0.00 0.00 0.00 175.10 178.03 2aaz n PHE 72 N 2.91 2.22 -0.10 5.22 -0.00 -1.26 -4.78 117.46 121.67 2aaz n PHE 72 Ca -0.16 -1.28 -0.06 0.00 -0.00 0.00 0.00 57.45 55.95 2aaz n PHE 72 Cb 0.53 -2.41 0.00 0.00 -0.00 0.00 0.00 39.48 37.61 2aaz n PHE 72 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 2aaz h LEU 73 N 17.91 -0.50 -1.28 -2.13 5.85 -2.00 -1.51 115.31 131.65 2aaz h LEU 73 Ca 0.22 0.13 0.13 0.00 0.84 0.00 0.00 57.88 59.19 2aaz h LEU 73 Cb 0.90 0.28 -0.07 0.00 0.37 0.00 0.00 40.66 42.14 2aaz h LEU 73 CO 1.34 -0.18 0.57 -0.09 -0.34 0.00 0.00 178.44 179.73 2aaz h ARG 74 N -0.08 0.71 -0.45 1.25 2.43 -2.00 0.11 114.38 116.36 2aaz h ARG 74 Ca 0.17 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.20 2aaz h ARG 74 Cb 0.35 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 2aaz h ARG 74 CO -0.40 0.47 -0.14 0.78 -1.51 0.00 0.00 179.97 179.17 2aaz h GLY 75 N 0.73 0.89 0.80 2.80 0.00 -1.69 0.07 103.07 106.68 2aaz h GLY 75 Ca 0.43 -0.70 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 2aaz h GLY 75 CO -0.19 0.65 0.01 -2.08 0.00 0.00 0.00 176.54 174.92 2aaz h VAL 76 N 0.74 1.17 -0.16 4.60 2.07 -0.47 -1.47 116.25 122.73 2aaz h VAL 76 Ca 0.12 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.14 2aaz h VAL 76 Cb 0.64 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 2aaz h VAL 76 CO 0.04 0.13 0.10 0.40 0.02 0.00 0.00 177.57 178.27 2aaz h ILE 77 N -0.16 1.05 -0.41 4.57 2.04 -1.17 -1.32 117.51 122.12 2aaz h ILE 77 Ca 0.01 -0.12 0.03 0.00 1.00 0.00 0.00 64.86 65.78 2aaz h ILE 77 Cb 0.21 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 2aaz h ILE 77 CO -0.00 0.05 0.22 0.00 0.00 0.00 0.00 178.15 178.42 2aaz h ALA 78 N 1.04 0.52 -0.88 1.87 0.00 -0.93 -0.81 119.26 120.08 2aaz h ALA 78 Ca 0.06 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2aaz h ALA 78 Cb -0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 2aaz h ALA 78 CO -0.01 -0.14 0.45 1.49 0.00 0.00 0.00 179.25 181.05 2aaz h GLU 79 N 0.43 1.24 -0.13 0.00 4.81 -1.13 -1.52 114.58 118.28 2aaz h GLU 79 Ca 0.17 -0.16 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 2aaz h GLU 79 Cb 0.07 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 2aaz h GLU 79 CO -0.11 0.93 0.05 1.25 -0.73 0.00 0.00 179.01 180.39 2aaz h LEU 80 N 1.24 0.18 -1.80 1.64 5.85 -0.62 -0.27 115.31 121.53 2aaz h LEU 80 Ca 0.31 -0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2aaz h LEU 80 Cb 0.07 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 2aaz h LEU 80 CO -0.04 0.32 -0.15 -0.07 -0.34 0.00 0.00 178.44 178.15 2aaz h LEU 81 N 0.04 0.00 -0.17 2.25 3.38 -1.05 -0.92 115.31 118.84 2aaz h LEU 81 Ca 0.04 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 2aaz h LEU 81 Cb 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2aaz h LEU 81 CO -0.00 0.15 -0.27 -0.25 0.09 0.00 0.00 178.44 178.16 2aaz h TRP 82 N 0.00 0.59 0.29 1.13 7.01 -0.86 -1.90 115.95 122.22 2aaz h TRP 82 Ca -0.00 -0.20 -0.01 0.00 2.11 0.00 0.00 58.89 60.78 2aaz h TRP 82 Cb 0.36 -0.12 -0.00 0.00 -2.10 0.00 0.00 29.16 27.30 2aaz h TRP 82 CO 0.00 0.90 -0.16 0.74 -2.79 0.00 0.00 178.44 177.13 2aaz h PHE 83 N 0.12 -0.42 -0.95 2.65 0.04 -0.12 -2.82 116.94 115.44 2aaz h PHE 83 Ca 0.01 -0.01 0.15 0.00 2.80 0.00 0.00 57.97 60.93 2aaz h PHE 83 Cb 0.84 0.15 -0.09 0.00 2.20 0.00 0.00 35.95 39.05 2aaz h PHE 83 CO 0.09 -0.26 0.56 0.28 -0.60 0.00 0.00 178.31 178.38 2aaz h VAL 84 N -0.43 0.80 0.00 -0.55 2.07 -1.21 0.15 116.25 117.09 2aaz h VAL 84 Ca -0.03 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2aaz h VAL 84 Cb 0.35 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 2aaz h VAL 84 CO 0.04 0.15 0.00 -1.54 0.02 0.00 0.00 177.57 176.24 2aaz n SER 85 N -4.75 0.68 0.00 0.57 3.41 -0.72 -4.85 113.62 107.97 2aaz n SER 85 Ca 0.19 0.70 0.00 0.00 -0.26 0.00 0.00 58.87 59.51 2aaz n SER 85 Cb 0.44 -0.83 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 2aaz n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2aaz n GLY 86 N -0.35 0.86 3.77 5.00 0.00 0.54 -5.01 105.19 110.00 2aaz n GLY 86 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2aaz n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aaz n THR 88 N 0.14 1.08 -3.41 0.00 -2.24 -1.26 -4.59 114.28 104.00 2aaz n THR 88 Ca 0.04 -1.25 -0.43 0.00 -2.27 0.00 0.00 64.05 60.14 2aaz n THR 88 Cb 0.48 0.22 -0.09 0.00 -2.10 0.00 0.00 70.33 68.84 2aaz n THR 88 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2aaz s ASP 89 N -1.73 6.14 0.64 3.42 3.68 -1.26 -2.48 116.67 125.08 2aaz s ASP 89 Ca 0.14 -0.90 0.39 0.00 2.13 0.00 0.00 52.55 54.32 2aaz s ASP 89 Cb 0.12 -2.18 2.22 0.00 -1.45 0.00 0.00 42.92 41.64 2aaz s ASP 89 CO 0.01 -0.51 2.33 0.00 0.13 0.00 0.00 175.17 177.13 2aaz h ALA 90 N 8.68 1.19 0.00 3.66 0.00 -0.93 -1.27 119.26 130.59 2aaz h ALA 90 Ca -0.27 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2aaz h ALA 90 Cb 1.12 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 2aaz h ALA 90 CO 0.77 -0.01 -0.04 0.87 0.00 0.00 0.00 179.25 180.85 2aaz h LYS 91 N 0.00 0.00 0.00 0.00 1.79 -1.89 0.77 116.57 117.24 2aaz h LYS 91 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2aaz h LYS 91 Cb 0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 2aaz h LYS 91 CO -0.00 0.04 0.00 0.52 -1.08 0.00 0.00 179.45 178.93 2aaz h MET 92 N 0.00 0.00 0.02 3.15 2.86 -1.62 -0.52 114.93 118.82 2aaz h MET 92 Ca -0.00 0.00 -0.38 0.00 -2.06 0.00 0.00 59.70 57.26 2aaz h MET 92 Cb 0.22 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.83 2aaz h MET 92 CO 0.00 0.00 -2.16 1.28 1.06 0.00 0.00 176.91 177.09 2aaz n LEU 93 N -2.70 2.32 0.22 1.22 4.77 0.17 -4.22 117.00 118.78 2aaz n LEU 93 Ca 0.02 0.21 0.06 0.00 -0.03 0.00 0.00 56.01 56.27 2aaz n LEU 93 Cb 0.30 -0.93 0.49 0.00 -2.33 0.00 0.00 43.42 40.96 2aaz n LEU 93 CO 0.25 0.65 0.85 0.77 -1.33 0.00 0.00 177.39 178.59 2aaz h SER 94 N -0.56 0.00 0.75 -1.43 4.64 -0.35 0.14 113.55 116.74 2aaz h SER 94 Ca -0.55 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.75 2aaz h SER 94 Cb 1.69 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.78 2aaz h SER 94 CO -0.21 0.24 -0.08 0.77 -0.87 0.00 0.00 176.83 176.67 2aaz h SER 95 N 0.00 0.00 -0.43 4.97 4.64 -1.29 -2.19 113.55 119.26 2aaz h SER 95 Ca -0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2aaz h SER 95 Cb 0.44 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.51 2aaz h SER 95 CO 0.03 0.08 0.03 0.00 -0.87 0.00 0.00 176.83 176.10 2aaz n GLN 96 N -3.28 3.61 -1.17 4.77 10.64 -0.68 -4.94 117.38 126.33 2aaz n GLN 96 Ca -0.00 -3.00 0.00 0.00 -1.83 0.00 0.00 57.00 52.16 2aaz n GLN 96 Cb 0.30 -2.03 0.00 0.00 -0.86 0.00 0.00 30.24 27.65 2aaz n GLN 96 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2aaz n GLY 97 N -0.14 0.42 3.05 2.61 0.00 -0.82 -5.04 105.19 105.27 2aaz n GLY 97 Ca 0.27 -1.01 -0.32 0.00 0.00 0.00 0.00 46.02 44.96 2aaz n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aaz s VAL 98 N -2.00 2.07 -0.21 1.61 1.01 -0.05 -4.98 120.40 117.86 2aaz s VAL 98 Ca 0.00 -1.54 0.15 0.00 0.00 0.00 0.00 61.98 60.59 2aaz s VAL 98 Cb 0.00 -2.19 0.60 0.00 0.00 0.00 0.00 36.38 34.79 2aaz s VAL 98 CO 0.00 -0.01 1.52 0.61 0.00 0.00 0.00 175.10 177.21 2aaz n GLY 99 N 4.47 3.90 0.32 4.51 0.00 -1.26 -1.65 105.19 115.48 2aaz n GLY 99 Ca -0.14 -1.04 0.17 0.00 0.00 0.00 0.00 46.02 45.01 2aaz n GLY 99 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2aaz h ILE 100 N 2.19 0.44 -0.37 -0.61 3.07 -1.95 -1.47 117.51 118.81 2aaz h ILE 100 Ca 0.04 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.45 2aaz h ILE 100 Cb 1.63 0.93 0.00 0.00 -0.27 0.00 0.00 36.82 39.11 2aaz h ILE 100 CO 0.33 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 178.22 2aaz n TRP 101 N -3.74 0.48 -0.19 0.16 7.02 -1.26 -4.50 117.44 115.43 2aaz n TRP 101 Ca -0.01 -0.32 -0.05 0.00 -1.02 0.00 0.00 57.50 56.09 2aaz n TRP 101 Cb 0.18 -0.01 0.12 0.00 -2.42 0.00 0.00 31.31 29.17 2aaz n TRP 101 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 2aaz h ASP 102 N 3.34 0.92 -0.44 -0.99 3.45 -1.59 -1.73 116.42 119.38 2aaz h ASP 102 Ca 0.00 -0.19 0.01 0.00 0.43 0.00 0.00 57.03 57.27 2aaz h ASP 102 Cb 0.83 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 39.33 2aaz h ASP 102 CO 0.00 0.91 0.29 1.23 -1.57 0.00 0.00 179.24 180.10 2aaz h GLY 103 N 1.03 0.62 0.12 2.75 0.00 -1.79 -1.37 103.07 104.43 2aaz h GLY 103 Ca 0.19 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2aaz h GLY 103 CO 0.01 0.22 -0.21 0.70 0.00 0.00 0.00 176.54 177.26 2aaz n ASN 104 N -4.78 1.10 -0.59 0.19 4.13 -1.18 -3.74 115.26 110.39 2aaz n ASN 104 Ca 0.01 -0.99 0.09 0.00 1.68 0.00 0.00 54.58 55.37 2aaz n ASN 104 Cb 0.02 0.11 0.04 0.00 -1.54 0.00 0.00 39.78 38.41 2aaz n ASN 104 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2aaz n GLY 105 N 1.31 0.24 3.76 7.41 0.00 -0.66 -4.49 105.19 112.76 2aaz n GLY 105 Ca 0.13 -0.55 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 2aaz n GLY 105 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2aaz s SER 106 N -1.90 5.05 0.25 1.61 1.04 -0.54 0.61 113.70 119.83 2aaz s SER 106 Ca 0.19 2.16 -0.05 0.00 0.48 0.00 0.00 55.95 58.73 2aaz s SER 106 Cb 0.16 -2.57 0.32 0.00 0.10 0.00 0.00 66.02 64.03 2aaz s SER 106 CO 0.37 -1.67 1.89 0.50 0.98 0.00 0.00 173.24 175.30 2aaz h LYS 107 N 0.32 1.13 -0.63 4.02 3.11 -1.93 -1.15 116.57 121.44 2aaz h LYS 107 Ca -0.48 -0.07 0.01 0.00 -2.81 0.00 0.00 60.65 57.30 2aaz h LYS 107 Cb 1.27 -0.26 -0.03 0.00 -1.00 0.00 0.00 32.23 32.21 2aaz h LYS 107 CO 0.54 0.75 0.41 1.49 -2.81 0.00 0.00 179.45 179.83 2aaz h GLU 108 N 1.17 0.82 -0.12 1.90 4.81 -1.95 0.31 114.58 121.52 2aaz h GLU 108 Ca 0.39 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.51 2aaz h GLU 108 Cb 0.05 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.24 2aaz h GLU 108 CO -0.14 0.54 -0.13 0.35 -0.73 0.00 0.00 179.01 178.90 2aaz h PHE 109 N 0.84 0.37 -0.32 0.92 3.57 -1.72 -0.45 116.94 120.16 2aaz h PHE 109 Ca 0.23 -0.11 0.05 0.00 3.53 0.00 0.00 57.97 61.66 2aaz h PHE 109 Cb -0.09 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.53 2aaz h PHE 109 CO -0.03 0.72 0.05 -0.07 -2.23 0.00 0.00 178.31 176.75 2aaz h LEU 110 N -0.08 -0.02 -1.36 0.59 3.38 -0.92 -0.61 115.31 116.29 2aaz h LEU 110 Ca 0.02 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2aaz h LEU 110 Cb 0.66 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 2aaz h LEU 110 CO 0.03 0.03 -0.03 -0.33 0.09 0.00 0.00 178.44 178.23 2aaz h GLU 111 N 0.16 0.39 -0.56 1.13 5.08 -0.39 0.31 114.58 120.69 2aaz h GLU 111 Ca 0.15 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 2aaz h GLU 111 Cb 0.17 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2aaz h GLU 111 CO -0.21 0.44 0.16 -0.22 -1.00 0.00 0.00 179.01 178.18 2aaz h LYS 112 N 0.38 0.85 -0.65 2.33 3.64 0.36 -2.61 116.57 120.87 2aaz h LYS 112 Ca 0.08 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2aaz h LYS 112 Cb 0.29 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2aaz h LYS 112 CO 0.01 0.75 0.00 1.33 -2.27 0.00 0.00 179.45 179.27 2aaz n VAL 113 N -4.28 2.27 -1.03 2.00 0.24 -0.40 -4.91 118.33 112.21 2aaz n VAL 113 Ca 0.04 -1.16 -0.00 0.00 -2.04 0.00 0.00 64.34 61.18 2aaz n VAL 113 Cb 0.21 -0.29 -0.00 0.00 -1.47 0.00 0.00 33.84 32.29 2aaz n VAL 113 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2aaz n GLY 114 N 0.56 0.38 2.13 7.63 0.00 -0.98 -4.96 105.19 109.95 2aaz n GLY 114 Ca 0.23 -1.09 -0.26 0.00 0.00 0.00 0.00 46.02 44.90 2aaz n GLY 114 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2aaz n LEU 115 N -0.01 5.14 0.21 0.99 4.77 0.10 -4.81 117.00 123.41 2aaz n LEU 115 Ca -0.00 -4.79 0.15 0.00 -0.03 0.00 0.00 56.01 51.34 2aaz n LEU 115 Cb 0.01 -0.42 0.68 0.00 -2.33 0.00 0.00 43.42 41.37 2aaz n LEU 115 CO 0.00 2.08 0.95 1.23 -1.33 0.00 0.00 177.39 180.31 2aaz h GLY 116 N 2.24 0.00 1.46 -0.72 0.00 -1.80 -2.66 103.07 101.59 2aaz h GLY 116 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2aaz h GLY 116 CO 0.85 0.00 0.00 -2.39 0.00 0.00 0.00 176.54 175.00 2aaz n HIS 117 N -2.64 0.00 -3.78 5.60 1.44 -1.26 -4.81 115.22 109.76 2aaz n HIS 117 Ca 0.00 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.40 2aaz n HIS 117 Cb 0.20 -0.23 -0.05 0.00 0.12 0.00 0.00 29.99 30.03 2aaz n HIS 117 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2aaz s ARG 118 N -2.46 3.54 0.60 -1.40 0.52 -1.00 -5.08 118.95 113.66 2aaz s ARG 118 Ca 0.27 -0.22 -0.15 0.00 -0.52 0.00 0.00 55.73 55.11 2aaz s ARG 118 Cb 0.17 -2.96 -0.04 0.00 0.52 0.00 0.00 34.95 32.65 2aaz s ARG 118 CO 0.37 0.55 1.05 -0.98 0.02 0.00 0.00 175.30 176.31 2aaz s ARG 119 N -2.46 3.35 0.26 3.54 1.70 -1.26 -4.94 118.95 119.14 2aaz s ARG 119 Ca 0.37 1.12 -0.31 0.00 -0.47 0.00 0.00 55.73 56.44 2aaz s ARG 119 Cb -0.13 -2.04 -0.13 0.00 -0.57 0.00 0.00 34.95 32.08 2aaz s ARG 119 CO 0.25 -0.78 1.43 -1.91 -1.08 0.00 0.00 175.30 173.20 2aaz n GLU 120 N -2.15 2.16 0.00 3.89 2.13 -1.26 -2.12 120.64 123.28 2aaz n GLU 120 Ca 0.08 0.77 0.00 0.00 0.66 0.00 0.00 57.16 58.67 2aaz n GLU 120 Cb 0.53 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.81 2aaz n GLU 120 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2aaz n GLY 121 N 2.00 2.25 3.49 8.31 0.00 0.20 -4.86 105.19 116.59 2aaz n GLY 121 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2aaz n GLY 121 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2aaz s ASP 122 N -1.66 6.42 0.38 1.61 -1.08 -0.90 -0.18 116.67 121.26 2aaz s ASP 122 Ca 0.00 -1.42 0.28 0.00 -0.52 0.00 0.00 52.55 50.89 2aaz s ASP 122 Cb 0.00 -2.47 1.03 0.00 -1.46 0.00 0.00 42.92 40.02 2aaz s ASP 122 CO 0.00 -1.38 1.81 -0.07 0.52 0.00 0.00 175.17 176.05 2aaz h LEU 123 N 11.63 0.00 0.00 -1.34 3.38 -1.81 -3.46 115.31 123.71 2aaz h LEU 123 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2aaz h LEU 123 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2aaz h LEU 123 CO 1.24 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.38 2aaz n GLY 124 N 0.30 -1.57 2.44 0.83 0.00 -1.26 -1.16 105.19 104.77 2aaz n GLY 124 Ca 0.02 -2.07 -0.31 0.00 0.00 0.00 0.00 46.02 43.66 2aaz n GLY 124 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2aaz n PRO 125 N 0.00 2.97 -0.89 1.61 -0.04 -1.26 -4.77 135.00 132.61 2aaz n PRO 125 Ca 0.00 -1.85 -0.09 0.00 -0.04 0.00 0.00 63.50 61.52 2aaz n PRO 125 Cb 0.00 -2.63 0.06 0.00 -0.04 0.00 0.00 33.50 30.89 2aaz n PRO 125 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2aaz n VAL 126 N 3.83 0.00 0.00 0.52 0.24 -1.26 -4.45 118.33 117.21 2aaz n VAL 126 Ca 0.63 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 62.52 2aaz n VAL 126 Cb 0.20 -1.60 0.00 0.00 -1.47 0.00 0.00 33.84 30.97 2aaz n VAL 126 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2aaz n TYR 127 N -2.35 0.00 -0.34 6.34 4.01 -1.26 -0.60 117.16 122.96 2aaz n TYR 127 Ca 0.06 0.00 0.17 0.00 -0.16 0.00 0.00 57.90 57.97 2aaz n TYR 127 Cb 0.20 0.00 0.39 0.00 -0.31 0.00 0.00 39.34 39.62 2aaz n TYR 127 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2aaz h GLY 128 N 0.00 1.71 0.94 2.72 0.00 -1.81 -0.46 103.07 106.16 2aaz h GLY 128 Ca 0.00 -0.30 -0.06 0.00 0.00 0.00 0.00 47.33 46.96 2aaz h GLY 128 CO 0.00 -0.16 -0.01 -2.75 0.00 0.00 0.00 176.54 173.63 2aaz h PHE 129 N 0.60 0.74 -0.47 5.60 3.04 -0.88 -2.22 116.94 123.37 2aaz h PHE 129 Ca 0.61 -0.13 -0.07 0.00 3.98 0.00 0.00 57.97 62.36 2aaz h PHE 129 Cb 1.17 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 39.47 2aaz h PHE 129 CO -0.00 0.77 0.03 1.96 -2.02 0.00 0.00 178.31 179.04 2aaz h GLN 130 N 0.50 0.81 -0.64 1.11 1.08 -1.06 0.50 115.11 117.41 2aaz h GLN 130 Ca 0.11 -0.24 0.08 0.00 -1.45 0.00 0.00 58.65 57.14 2aaz h GLN 130 Cb 0.48 -0.08 -0.06 0.00 -0.05 0.00 0.00 27.48 27.77 2aaz h GLN 130 CO 0.02 0.85 0.31 -1.49 -0.95 0.00 0.00 178.83 177.57 2aaz h TRP 131 N 0.66 0.56 0.00 2.96 4.06 -1.05 -1.98 115.95 121.16 2aaz h TRP 131 Ca 0.14 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.11 2aaz h TRP 131 Cb 0.47 -0.16 0.00 0.00 -1.00 0.00 0.00 29.16 28.47 2aaz h TRP 131 CO 0.03 0.22 -1.24 0.54 -3.56 0.00 0.00 178.44 174.44 2aaz n ARG 132 N -4.88 1.11 -1.89 0.49 5.12 -0.84 -1.50 116.66 114.28 2aaz n ARG 132 Ca 0.09 -0.07 0.03 0.00 -1.93 0.00 0.00 57.85 55.96 2aaz n ARG 132 Cb 0.23 -1.32 0.03 0.00 -1.16 0.00 0.00 32.46 30.23 2aaz n ARG 132 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2aaz n HIS 133 N -1.72 0.36 -1.62 -1.55 8.25 0.18 -3.48 115.22 115.64 2aaz n HIS 133 Ca 0.00 -0.97 -0.50 0.00 -0.26 0.00 0.00 57.72 55.98 2aaz n HIS 133 Cb 0.34 -0.17 -0.05 0.00 1.12 0.00 0.00 29.99 31.23 2aaz n HIS 133 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2aaz n PHE 134 N 0.18 1.81 0.00 4.41 -0.00 -0.75 -1.00 117.46 122.11 2aaz n PHE 134 Ca 0.06 0.50 0.00 0.00 -0.00 0.00 0.00 57.45 58.01 2aaz n PHE 134 Cb 1.05 -2.42 0.00 0.00 -0.00 0.00 0.00 39.48 38.11 2aaz n PHE 134 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2aaz n GLY 135 N 2.96 3.32 3.73 7.13 0.00 -1.26 -0.35 105.19 120.71 2aaz n GLY 135 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2aaz n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aaz s ALA 136 N -2.60 2.03 -0.06 4.61 0.00 -0.17 -4.90 121.76 120.67 2aaz s ALA 136 Ca 0.00 0.59 -0.28 0.00 0.00 0.00 0.00 51.96 52.27 2aaz s ALA 136 Cb 0.00 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 2aaz s ALA 136 CO 0.00 -2.00 0.91 -2.00 0.00 0.00 0.00 175.76 172.67 2aaz s GLU 137 N -4.39 4.47 -0.15 0.00 2.12 -1.26 -5.02 118.70 114.47 2aaz s GLU 137 Ca 0.68 1.25 -0.14 0.00 0.36 0.00 0.00 54.97 57.12 2aaz s GLU 137 Cb -0.23 -3.49 -0.05 0.00 0.26 0.00 0.00 34.13 30.63 2aaz s GLU 137 CO 0.51 -0.12 0.30 -0.47 -0.54 0.00 0.00 175.26 174.94 2aaz s TYR 138 N 1.32 3.48 0.00 5.30 5.04 -1.26 -4.98 117.35 126.24 2aaz s TYR 138 Ca 0.47 0.62 0.00 0.00 -2.44 0.00 0.00 57.07 55.71 2aaz s TYR 138 Cb -0.19 -2.33 0.00 0.00 0.35 0.00 0.00 41.96 39.78 2aaz s TYR 138 CO 0.22 0.27 0.00 0.25 -1.34 0.00 0.00 175.55 174.95 2aaz n THR 139 N 3.46 0.00 -3.99 4.34 -2.24 -1.26 -5.09 114.28 109.50 2aaz n THR 139 Ca -0.12 0.24 -0.12 0.00 -2.27 0.00 0.00 64.05 61.79 2aaz n THR 139 Cb 0.52 -1.20 -0.03 0.00 -2.10 0.00 0.00 70.33 67.52 2aaz n THR 139 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2aaz n ASP 140 N -2.14 -0.92 0.07 3.42 3.85 -1.26 -5.03 116.55 114.54 2aaz n ASP 140 Ca 0.00 -2.47 0.10 0.00 -0.71 0.00 0.00 54.79 51.71 2aaz n ASP 140 Cb 0.00 1.78 0.41 0.00 -1.35 0.00 0.00 41.12 41.96 2aaz n ASP 140 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2aaz n ALA 141 N -1.27 1.67 1.20 2.12 0.00 -1.26 -2.35 120.51 120.62 2aaz n ALA 141 Ca -0.10 0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.49 2aaz n ALA 141 Cb 0.44 -1.32 0.27 0.00 0.00 0.00 0.00 19.45 18.84 2aaz n ALA 141 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2aaz n ASP 142 N -1.91 1.55 -4.64 0.00 10.43 -1.26 -4.78 116.55 115.93 2aaz n ASP 142 Ca 0.03 -1.26 -0.35 0.00 2.57 0.00 0.00 54.79 55.78 2aaz n ASP 142 Cb 0.21 0.20 0.10 0.00 1.84 0.00 0.00 41.12 43.46 2aaz n ASP 142 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2aaz n GLY 143 N 1.34 -0.30 3.43 0.44 0.00 -0.99 -4.95 105.19 104.15 2aaz n GLY 143 Ca 0.13 -0.39 -0.44 0.00 0.00 0.00 0.00 46.02 45.32 2aaz n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2aaz s ASP 144 N -1.78 6.21 0.00 1.61 2.15 -1.26 -4.87 116.67 118.73 2aaz s ASP 144 Ca 0.73 -1.05 0.13 0.00 0.43 0.00 0.00 52.55 52.79 2aaz s ASP 144 Cb -0.33 -2.30 0.18 0.00 -0.30 0.00 0.00 42.92 40.17 2aaz s ASP 144 CO 0.50 -0.99 1.03 -1.22 -0.17 0.00 0.00 175.17 174.32 2aaz n TYR 145 N 6.31 0.15 -1.67 -5.34 4.01 -1.26 -4.95 117.16 114.41 2aaz n TYR 145 Ca -0.07 -0.14 -0.46 0.00 -0.16 0.00 0.00 57.90 57.07 2aaz n TYR 145 Cb 0.45 -0.01 -0.04 0.00 -0.31 0.00 0.00 39.34 39.43 2aaz n TYR 145 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2aaz n LYS 146 N 0.73 2.19 -0.94 -0.72 4.81 -1.26 -0.47 118.16 122.50 2aaz n LYS 146 Ca 0.09 0.79 0.00 0.00 -0.87 0.00 0.00 58.31 58.33 2aaz n LYS 146 Cb 0.37 -2.59 0.00 0.00 0.02 0.00 0.00 35.03 32.83 2aaz n LYS 146 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2aaz n GLY 147 N 3.69 0.54 3.69 3.14 0.00 -1.26 -5.01 105.19 109.99 2aaz n GLY 147 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2aaz n GLY 147 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2aaz s LYS 148 N -0.40 2.79 0.40 1.61 1.02 0.38 -5.02 119.74 120.52 2aaz s LYS 148 Ca 0.00 -0.61 0.00 0.00 0.02 0.00 0.00 55.97 55.38 2aaz s LYS 148 Cb 0.00 -2.68 0.00 0.00 -0.52 0.00 0.00 37.83 34.63 2aaz s LYS 148 CO 0.00 0.62 0.00 0.41 -0.92 0.00 0.00 175.35 175.46 2aaz n GLY 149 N 1.33 -2.08 3.66 -3.33 0.00 -1.26 -4.40 105.19 99.10 2aaz n GLY 149 Ca -0.14 -1.41 -0.39 0.00 0.00 0.00 0.00 46.02 44.07 2aaz n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aaz s VAL 150 N -0.93 5.11 -1.07 1.61 1.01 0.53 -4.74 120.40 121.91 2aaz s VAL 150 Ca 0.00 0.94 -0.17 0.00 0.00 0.00 0.00 61.98 62.75 2aaz s VAL 150 Cb 0.00 -3.84 0.14 0.00 0.00 0.00 0.00 36.38 32.68 2aaz s VAL 150 CO 0.00 0.18 1.31 -0.62 0.00 0.00 0.00 175.10 175.97 2aaz s ASP 151 N 1.16 6.80 0.22 3.32 3.68 -1.23 -2.33 116.67 128.29 2aaz s ASP 151 Ca 0.24 -2.38 -0.09 0.00 2.13 0.00 0.00 52.55 52.45 2aaz s ASP 151 Cb -0.15 -2.43 0.17 0.00 -1.45 0.00 0.00 42.92 39.06 2aaz s ASP 151 CO 0.09 -0.99 1.87 1.56 0.13 0.00 0.00 175.17 177.83 2aaz h GLN 152 N 8.20 1.08 -0.04 4.34 4.20 -1.53 -2.63 115.11 128.73 2aaz h GLN 152 Ca 0.24 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 2aaz h GLN 152 Cb 0.96 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.50 2aaz h GLN 152 CO 1.21 0.75 0.02 1.25 -0.67 0.00 0.00 178.83 181.39 2aaz h LEU 153 N 1.10 0.05 -1.03 1.46 5.85 -1.85 -0.31 115.31 120.58 2aaz h LEU 153 Ca 0.29 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 2aaz h LEU 153 Cb -0.06 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2aaz h LEU 153 CO -0.06 0.10 -0.01 -0.61 -0.34 0.00 0.00 178.44 177.52 2aaz h GLN 154 N 0.00 0.68 -0.89 1.25 5.75 -1.88 -2.11 115.11 117.92 2aaz h GLN 154 Ca 0.01 -0.17 -0.02 0.00 -0.15 0.00 0.00 58.65 58.32 2aaz h GLN 154 Cb 0.06 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 28.48 2aaz h GLN 154 CO -0.00 0.71 0.46 -0.09 -2.65 0.00 0.00 178.83 177.26 2aaz h ARG 155 N 0.64 1.25 -0.52 1.69 9.65 -1.08 0.18 114.38 126.20 2aaz h ARG 155 Ca 0.13 -0.16 0.02 0.00 -1.10 0.00 0.00 59.98 58.87 2aaz h ARG 155 Cb 0.42 -0.24 -0.03 0.00 -1.39 0.00 0.00 29.97 28.73 2aaz h ARG 155 CO 0.02 0.93 0.32 0.28 2.80 0.00 0.00 179.97 184.32 2aaz h VAL 156 N 1.25 1.07 0.30 0.20 2.07 -0.45 0.24 116.25 120.93 2aaz h VAL 156 Ca 0.31 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 2aaz h VAL 156 Cb 0.06 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 2aaz h VAL 156 CO -0.05 0.12 -0.15 0.40 0.02 0.00 0.00 177.57 177.92 2aaz h ILE 157 N 0.64 0.71 -0.88 4.57 1.08 -0.75 -1.38 117.51 121.50 2aaz h ILE 157 Ca 0.21 -0.07 0.05 0.00 -0.39 0.00 0.00 64.86 64.66 2aaz h ILE 157 Cb 0.00 0.75 -0.05 0.00 -3.07 0.00 0.00 36.82 34.45 2aaz h ILE 157 CO -0.08 0.02 0.57 0.44 -0.69 0.00 0.00 178.15 178.40 2aaz h ASP 158 N -0.44 0.91 -0.26 1.72 3.45 -0.80 -2.25 116.42 118.74 2aaz h ASP 158 Ca -0.04 -0.00 -0.18 0.00 0.43 0.00 0.00 57.03 57.24 2aaz h ASP 158 Cb 0.34 -0.20 0.00 0.00 -0.56 0.00 0.00 39.33 38.91 2aaz h ASP 158 CO 0.07 0.60 -0.54 0.74 -1.57 0.00 0.00 179.24 178.54 2aaz h THR 159 N 1.04 1.28 -0.84 0.35 2.02 -0.79 -0.88 112.91 115.09 2aaz h THR 159 Ca 0.36 -1.73 -0.03 0.00 0.77 0.00 0.00 66.41 65.78 2aaz h THR 159 Cb 0.12 1.70 -0.04 0.00 -1.74 0.00 0.00 68.15 68.19 2aaz h THR 159 CO -0.12 0.56 0.41 0.40 0.37 0.00 0.00 175.52 177.14 2aaz h ILE 160 N 0.60 1.26 -0.09 3.11 2.04 -0.97 0.28 117.51 123.74 2aaz h ILE 160 Ca 0.01 -0.70 -0.23 0.00 1.00 0.00 0.00 64.86 64.93 2aaz h ILE 160 Cb 1.16 0.17 0.01 0.00 -0.74 0.00 0.00 36.82 37.42 2aaz h ILE 160 CO 0.12 0.30 -0.86 0.11 0.00 0.00 0.00 178.15 177.83 2aaz h LYS 161 N 1.19 0.73 0.00 2.37 1.57 -1.36 -3.31 116.57 117.76 2aaz h LYS 161 Ca 0.29 -0.67 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 2aaz h LYS 161 Cb 0.10 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2aaz h LYS 161 CO -0.04 1.27 -1.28 0.09 -0.57 0.00 0.00 179.45 178.92 2aaz n ASN 162 N -3.94 1.41 -2.90 0.86 3.02 -0.34 -4.77 115.26 108.61 2aaz n ASN 162 Ca -0.09 -0.29 -0.13 0.00 -0.03 0.00 0.00 54.58 54.05 2aaz n ASN 162 Cb 0.79 1.41 0.04 0.00 -0.61 0.00 0.00 39.78 41.41 2aaz n ASN 162 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2aaz n ASN 163 N -1.75 -1.37 -0.24 6.41 5.15 0.91 -5.02 115.26 119.36 2aaz n ASN 163 Ca -0.01 -3.37 0.26 0.00 -0.60 0.00 0.00 54.58 50.87 2aaz n ASN 163 Cb 0.31 1.01 0.64 0.00 -0.53 0.00 0.00 39.78 41.21 2aaz n ASN 163 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2aaz h PRO 164 N 3.25 0.16 -0.03 1.20 0.13 -1.44 -0.97 132.00 134.29 2aaz h PRO 164 Ca -0.04 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2aaz h PRO 164 Cb 1.03 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2aaz h PRO 164 CO 0.29 0.11 0.00 0.25 -0.23 0.00 0.00 178.00 178.42 2aaz n THR 165 N -4.38 0.04 -1.70 1.56 -2.24 -1.26 -4.25 114.28 102.04 2aaz n THR 165 Ca 0.21 -0.08 -0.38 0.00 -2.27 0.00 0.00 64.05 61.53 2aaz n THR 165 Cb 0.92 -0.16 0.05 0.00 -2.10 0.00 0.00 70.33 69.04 2aaz n THR 165 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2aaz n ASP 166 N -0.57 2.00 -0.90 3.42 -0.08 -0.37 -4.92 116.55 115.13 2aaz n ASP 166 Ca 0.17 0.89 0.07 0.00 -1.51 0.00 0.00 54.79 54.41 2aaz n ASP 166 Cb 0.14 -1.52 0.23 0.00 2.34 0.00 0.00 41.12 42.31 2aaz n ASP 166 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2aaz n ARG 167 N -1.28 3.04 -0.57 -0.67 1.74 -1.26 -4.48 116.66 113.18 2aaz n ARG 167 Ca 0.13 -2.46 0.04 0.00 -0.77 0.00 0.00 57.85 54.79 2aaz n ARG 167 Cb 0.46 -1.57 0.20 0.00 -1.02 0.00 0.00 32.46 30.53 2aaz n ARG 167 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2aaz n ARG 168 N 0.33 1.65 -2.18 5.56 3.00 -1.26 -4.93 116.66 118.83 2aaz n ARG 168 Ca 0.17 -3.17 -0.41 0.00 -0.01 0.00 0.00 57.85 54.44 2aaz n ARG 168 Cb 0.66 -1.66 -0.01 0.00 0.00 0.00 0.00 32.46 31.45 2aaz n ARG 168 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 2aaz n ILE 169 N -1.14 3.36 -4.83 0.55 5.41 -1.26 -4.91 119.36 116.54 2aaz n ILE 169 Ca 0.22 -3.33 -0.32 0.00 1.00 0.00 0.00 62.75 60.31 2aaz n ILE 169 Cb 0.77 -2.39 -0.13 0.00 -0.71 0.00 0.00 39.64 37.19 2aaz n ILE 169 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2aaz s ILE 170 N 5.04 3.08 -0.21 1.39 -1.09 -1.26 -1.45 121.20 126.70 2aaz s ILE 170 Ca 0.55 -0.78 0.01 0.00 -2.23 0.00 0.00 60.65 58.19 2aaz s ILE 170 Cb 0.07 -2.23 0.05 0.00 -1.58 0.00 0.00 42.46 38.77 2aaz s ILE 170 CO 0.05 0.54 -0.07 -0.22 -1.23 0.00 0.00 174.94 174.01 2aaz s LEU 171 N -0.88 2.29 0.00 2.97 2.96 -0.55 -4.88 118.68 120.59 2aaz s LEU 171 Ca 0.12 -0.99 0.03 0.00 -0.22 0.00 0.00 54.13 53.07 2aaz s LEU 171 Cb -0.11 -1.14 -0.01 0.00 0.50 0.00 0.00 46.19 45.43 2aaz s LEU 171 CO 0.02 -0.20 -0.08 -0.55 -1.32 0.00 0.00 176.35 174.22 2aaz s SER 172 N 1.44 0.97 0.00 3.68 0.15 -1.26 -1.07 113.70 117.61 2aaz s SER 172 Ca -0.03 -0.19 0.15 0.00 0.70 0.00 0.00 55.95 56.58 2aaz s SER 172 Cb -0.17 -0.09 -0.08 0.00 -1.71 0.00 0.00 66.02 63.96 2aaz s SER 172 CO -0.07 0.07 0.72 0.00 1.20 0.00 0.00 173.24 175.16 2aaz n ALA 173 N 2.73 3.52 -2.20 5.45 0.00 -0.68 -4.35 120.51 124.98 2aaz n ALA 173 Ca -0.14 -0.46 -0.42 0.00 0.00 0.00 0.00 53.44 52.41 2aaz n ALA 173 Cb 0.57 -0.53 -0.03 0.00 0.00 0.00 0.00 19.45 19.46 2aaz n ALA 173 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2aaz s TRP 174 N -2.10 2.67 -0.33 0.00 -0.11 -1.17 -4.82 118.94 113.08 2aaz s TRP 174 Ca 0.09 0.71 0.00 0.00 1.22 0.00 0.00 56.10 58.12 2aaz s TRP 174 Cb 0.12 -3.70 0.14 0.00 -1.50 0.00 0.00 33.47 28.52 2aaz s TRP 174 CO 0.49 -2.67 0.27 1.21 -4.62 0.00 0.00 176.95 171.63 2aaz s ASN 175 N 2.18 2.13 0.41 5.86 3.84 -1.26 -5.02 114.94 123.08 2aaz s ASN 175 Ca 0.65 -1.42 0.18 0.00 0.21 0.00 0.00 52.86 52.49 2aaz s ASN 175 Cb -0.31 0.18 1.10 0.00 -0.55 0.00 0.00 41.25 41.67 2aaz s ASN 175 CO 0.26 -0.34 1.80 -0.65 -2.79 0.00 0.00 177.10 175.38 2aaz h PRO 176 N 7.65 0.39 -0.37 0.43 0.11 -2.01 -1.40 132.00 136.79 2aaz h PRO 176 Ca -0.05 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.87 2aaz h PRO 176 Cb 1.03 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 2aaz h PRO 176 CO 0.30 0.26 -0.42 -0.22 -0.21 0.00 0.00 178.00 177.70 2aaz h LYS 177 N 0.40 0.94 0.00 1.05 3.64 -2.02 -3.28 116.57 117.30 2aaz h LYS 177 Ca 0.55 -0.51 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2aaz h LYS 177 Cb 1.41 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.25 2aaz h LYS 177 CO -0.25 1.17 -0.32 -0.25 -2.27 0.00 0.00 179.45 177.53 2aaz n ASP 178 N -4.05 0.50 -0.26 4.20 9.92 -0.61 -4.47 116.55 121.78 2aaz n ASP 178 Ca -0.03 0.21 -0.03 0.00 -0.53 0.00 0.00 54.79 54.41 2aaz n ASP 178 Cb 0.56 -0.17 0.03 0.00 -0.64 0.00 0.00 41.12 40.91 2aaz n ASP 178 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2aaz h LEU 179 N 0.00 -1.17 -2.51 0.64 3.38 -1.41 0.73 115.31 114.98 2aaz h LEU 179 Ca 0.00 0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2aaz h LEU 179 Cb 0.62 0.61 0.00 0.00 0.09 0.00 0.00 40.66 41.98 2aaz h LEU 179 CO 0.00 -0.29 0.04 1.55 0.09 0.00 0.00 178.44 179.83 2aaz h PRO 180 N -0.09 0.00 -0.00 1.13 0.13 -1.83 0.44 132.00 131.78 2aaz h PRO 180 Ca 0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.42 2aaz h PRO 180 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 2aaz h PRO 180 CO -0.79 0.00 -0.26 1.28 -0.23 0.00 0.00 178.00 178.01 2aaz n LEU 181 N -2.86 0.66 -4.77 1.56 4.77 0.24 -4.87 117.00 111.73 2aaz n LEU 181 Ca -0.03 -0.07 -0.38 0.00 -0.03 0.00 0.00 56.01 55.51 2aaz n LEU 181 Cb 0.10 -0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 40.93 2aaz n LEU 181 CO 0.17 0.13 0.17 -0.04 -1.33 0.00 0.00 177.39 176.49 2aaz s MET 182 N -2.66 4.18 0.39 3.23 -1.94 0.14 -4.27 119.30 118.38 2aaz s MET 182 Ca 0.21 0.49 0.06 0.00 -1.71 0.00 0.00 55.69 54.74 2aaz s MET 182 Cb 0.19 -3.33 0.80 0.00 2.01 0.00 0.00 34.83 34.50 2aaz s MET 182 CO 0.55 0.42 2.03 0.00 -0.01 0.00 0.00 175.02 178.02 2aaz h ALA 183 N 5.68 1.68 -2.92 3.03 0.00 -1.43 -3.42 119.26 121.88 2aaz h ALA 183 Ca -0.46 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.27 2aaz h ALA 183 Cb 1.20 -0.19 -0.25 0.00 0.00 0.00 0.00 17.79 18.54 2aaz h ALA 183 CO 0.69 0.28 -0.35 -1.17 0.00 0.00 0.00 179.25 178.70 2aaz s LEU 184 N -9.57 0.63 0.60 0.00 2.96 -1.26 -5.04 118.68 107.00 2aaz s LEU 184 Ca -0.09 0.67 -0.17 0.00 -0.22 0.00 0.00 54.13 54.32 2aaz s LEU 184 Cb 0.18 1.11 -0.03 0.00 0.50 0.00 0.00 46.19 47.94 2aaz s LEU 184 CO 0.74 -0.13 1.10 -2.84 -1.32 0.00 0.00 176.35 173.91 2aaz s PRO 185 N 0.40 3.14 0.25 0.98 0.02 -1.26 -4.95 135.00 133.58 2aaz s PRO 185 Ca -0.02 1.40 -0.31 0.00 0.02 0.00 0.00 61.00 62.09 2aaz s PRO 185 Cb -0.04 -1.99 -0.12 0.00 0.02 0.00 0.00 34.50 32.36 2aaz s PRO 185 CO -0.02 -0.98 1.56 -2.30 -0.33 0.00 0.00 177.00 174.93 2aaz n PRO 186 N -1.93 2.47 -0.09 5.54 -0.02 -1.26 -4.93 135.00 134.78 2aaz n PRO 186 Ca 0.10 0.88 -0.14 0.00 -2.02 0.00 0.00 63.50 62.33 2aaz n PRO 186 Cb 0.52 -2.64 -0.07 0.00 -0.02 0.00 0.00 33.50 31.29 2aaz n PRO 186 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2aaz s HIS 188 N -2.26 2.67 -0.56 0.00 0.00 -1.26 -1.18 115.29 112.70 2aaz s HIS 188 Ca -0.21 -0.66 0.24 0.00 -3.00 0.00 0.00 55.06 51.43 2aaz s HIS 188 Cb 0.04 -4.40 0.51 0.00 -4.00 0.00 0.00 32.58 24.73 2aaz s HIS 188 CO 0.42 -1.73 1.63 0.00 -1.00 0.00 0.00 174.74 174.06 2aaz h MET 189 N 9.54 0.00 0.00 -0.38 3.00 -1.66 -3.43 114.93 121.99 2aaz h MET 189 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.56 2aaz h MET 189 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.65 2aaz h MET 189 CO 1.21 0.00 0.00 1.97 0.00 0.00 0.00 176.91 180.09 2aaz n PHE 190 N -2.69 0.00 -3.78 -0.10 1.16 -1.24 -1.68 117.46 109.12 2aaz n PHE 190 Ca 0.04 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.53 2aaz n PHE 190 Cb 0.49 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.29 2aaz n PHE 190 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2aaz s GLN 192 N -3.64 1.27 0.10 0.00 0.74 0.67 -1.49 119.66 117.31 2aaz s GLN 192 Ca 0.03 -0.44 0.03 0.00 0.05 0.00 0.00 55.36 55.03 2aaz s GLN 192 Cb 0.03 -1.16 -0.04 0.00 1.10 0.00 0.00 33.01 32.94 2aaz s GLN 192 CO -0.10 0.19 0.10 -0.06 -0.55 0.00 0.00 175.29 174.87 2aaz s PHE 193 N 0.05 3.21 -0.01 1.67 0.40 -0.53 -1.02 117.98 121.76 2aaz s PHE 193 Ca -0.02 0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.39 2aaz s PHE 193 Cb -0.09 -1.61 0.00 0.00 0.51 0.00 0.00 43.02 41.83 2aaz s PHE 193 CO 0.01 0.53 -0.02 0.12 0.70 0.00 0.00 175.22 176.56 2aaz s PHE 194 N -1.47 0.23 -0.17 0.36 2.19 -0.58 -4.61 117.98 113.92 2aaz s PHE 194 Ca 0.30 -0.03 0.01 0.00 0.33 0.00 0.00 56.93 57.54 2aaz s PHE 194 Cb -0.12 -0.19 0.02 0.00 -1.31 0.00 0.00 43.02 41.41 2aaz s PHE 194 CO 0.23 -0.03 -0.19 0.08 1.83 0.00 0.00 175.22 177.14 2aaz s VAL 195 N 0.18 2.18 -0.08 3.12 1.01 -1.26 -0.66 120.40 124.89 2aaz s VAL 195 Ca -0.01 -0.91 -0.19 0.00 0.00 0.00 0.00 61.98 60.86 2aaz s VAL 195 Cb -0.04 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 2aaz s VAL 195 CO -0.00 0.53 0.52 -0.44 0.00 0.00 0.00 175.10 175.71 2aaz s SER 196 N 1.18 6.79 0.61 3.32 0.01 0.22 -4.76 113.70 121.07 2aaz s SER 196 Ca 0.02 0.94 -0.15 0.00 1.31 0.00 0.00 55.95 58.07 2aaz s SER 196 Cb -0.14 -2.31 -0.03 0.00 0.21 0.00 0.00 66.02 63.75 2aaz s SER 196 CO -0.09 0.03 1.06 -0.76 0.41 0.00 0.00 173.24 173.89 2aaz s LEU 197 N 0.33 3.45 0.26 2.44 1.43 -1.26 -1.70 118.68 123.63 2aaz s LEU 197 Ca 0.28 1.79 -0.31 0.00 -1.03 0.00 0.00 54.13 54.86 2aaz s LEU 197 Cb -0.16 -4.53 -0.12 0.00 0.03 0.00 0.00 46.19 41.41 2aaz s LEU 197 CO 0.13 -1.21 1.63 -2.65 0.23 0.00 0.00 176.35 174.48 2aaz n PRO 198 N -2.17 2.67 -0.61 1.29 -0.02 -1.26 -4.84 135.00 130.06 2aaz n PRO 198 Ca 0.09 0.96 -0.30 0.00 -2.02 0.00 0.00 63.50 62.23 2aaz n PRO 198 Cb 0.53 -2.75 0.21 0.00 -0.02 0.00 0.00 33.50 31.47 2aaz n PRO 198 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2aaz s PRO 199 N 0.14 0.01 0.09 0.52 0.02 -1.26 -4.79 135.00 129.73 2aaz s PRO 199 Ca 0.69 1.20 -0.22 0.00 0.02 0.00 0.00 61.00 62.68 2aaz s PRO 199 Cb -0.51 -1.64 -0.14 0.00 0.02 0.00 0.00 34.50 32.23 2aaz s PRO 199 CO 0.42 -3.21 1.72 0.00 -0.33 0.00 0.00 177.00 175.61 2aaz h ALA 200 N -2.27 0.05 0.00 -1.55 0.00 -2.01 -2.79 119.26 110.70 2aaz h ALA 200 Ca -0.53 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2aaz h ALA 200 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2aaz h ALA 200 CO 0.46 -0.44 0.06 -0.40 0.00 0.00 0.00 179.25 178.93 2aaz n ASP 201 N -5.05 0.25 -2.79 0.00 5.75 -1.26 -3.85 116.55 109.60 2aaz n ASP 201 Ca -0.06 0.58 -0.06 0.00 -0.01 0.00 0.00 54.79 55.24 2aaz n ASP 201 Cb 0.04 -0.60 0.01 0.00 -1.03 0.00 0.00 41.12 39.54 2aaz n ASP 201 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2aaz n SER 202 N -1.83 -3.24 0.00 -1.12 3.41 -1.06 -4.98 113.62 104.80 2aaz n SER 202 Ca -0.01 -2.92 0.08 0.00 -0.26 0.00 0.00 58.87 55.76 2aaz n SER 202 Cb 0.08 1.63 0.47 0.00 -0.26 0.00 0.00 64.21 66.13 2aaz n SER 202 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2aaz n PRO 203 N 2.81 0.44 0.15 4.33 -0.04 -1.19 -2.33 135.00 139.17 2aaz n PRO 203 Ca 0.18 0.04 0.10 0.00 -0.04 0.00 0.00 63.50 63.78 2aaz n PRO 203 Cb 0.56 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.58 2aaz n PRO 203 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2aaz h GLY 204 N 2.66 0.00 -1.47 0.55 0.00 -1.94 -3.47 103.07 99.40 2aaz h GLY 204 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 2aaz h GLY 204 CO 0.00 0.00 0.29 -0.56 0.00 0.00 0.00 176.54 176.27 2aaz s SER 205 N -5.85 3.25 0.28 0.19 0.01 -0.98 -4.98 113.70 105.63 2aaz s SER 205 Ca 0.03 2.31 -0.27 0.00 1.31 0.00 0.00 55.95 59.33 2aaz s SER 205 Cb 0.07 -2.58 -0.09 0.00 0.21 0.00 0.00 66.02 63.63 2aaz s SER 205 CO 0.74 -2.89 0.92 -0.54 0.41 0.00 0.00 173.24 171.88 2aaz s LYS 206 N -4.35 4.64 0.66 12.44 1.02 -1.26 -4.72 119.74 128.18 2aaz s LYS 206 Ca 0.71 1.33 -0.17 0.00 0.02 0.00 0.00 55.97 57.86 2aaz s LYS 206 Cb -0.26 -2.96 0.00 0.00 -0.52 0.00 0.00 37.83 34.08 2aaz s LYS 206 CO 0.54 0.37 1.23 -2.14 -0.92 0.00 0.00 175.35 174.43 2aaz s PRO 207 N -1.76 2.52 -0.12 -1.68 0.02 -1.26 -4.62 135.00 128.11 2aaz s PRO 207 Ca 0.46 1.87 -0.13 0.00 0.02 0.00 0.00 61.00 63.23 2aaz s PRO 207 Cb -0.21 -1.87 -0.05 0.00 0.02 0.00 0.00 34.50 32.40 2aaz s PRO 207 CO 0.26 -1.57 0.30 0.15 -0.33 0.00 0.00 177.00 175.81 2aaz s LYS 208 N -3.58 4.06 -0.17 5.54 1.02 -0.69 -0.54 119.74 125.38 2aaz s LYS 208 Ca 0.78 0.14 -0.06 0.00 0.02 0.00 0.00 55.97 56.85 2aaz s LYS 208 Cb -0.32 -3.34 -0.03 0.00 -0.52 0.00 0.00 37.83 33.61 2aaz s LYS 208 CO 0.40 0.42 0.02 -1.17 -0.92 0.00 0.00 175.35 174.10 2aaz s LEU 209 N -0.11 3.56 0.20 3.17 2.96 0.49 -0.61 118.68 128.35 2aaz s LEU 209 Ca 0.18 -0.02 0.08 0.00 -0.22 0.00 0.00 54.13 54.15 2aaz s LEU 209 Cb -0.14 -1.89 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 2aaz s LEU 209 CO 0.06 0.16 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.66 2aaz s SER 210 N 0.42 2.67 -0.05 3.68 0.01 0.17 0.38 113.70 120.98 2aaz s SER 210 Ca 0.00 -0.99 -0.02 0.00 1.31 0.00 0.00 55.95 56.25 2aaz s SER 210 Cb -0.13 -0.15 0.03 0.00 0.21 0.00 0.00 66.02 65.98 2aaz s SER 210 CO 0.01 -0.13 0.10 0.00 0.41 0.00 0.00 173.24 173.64 2aaz s LEU 212 N 1.01 2.28 0.00 0.00 0.20 -0.19 0.27 118.68 122.26 2aaz s LEU 212 Ca -0.08 -0.55 0.07 0.00 0.69 0.00 0.00 54.13 54.26 2aaz s LEU 212 Cb -0.11 -1.51 -0.03 0.00 -0.43 0.00 0.00 46.19 44.12 2aaz s LEU 212 CO -0.04 0.07 -0.23 -0.32 -0.29 0.00 0.00 176.35 175.54 2aaz s MET 213 N 0.91 2.09 -0.16 1.98 -2.45 0.09 -0.24 119.30 121.53 2aaz s MET 213 Ca -0.04 -0.94 0.00 0.00 -1.25 0.00 0.00 55.69 53.45 2aaz s MET 213 Cb -0.15 -2.11 -0.00 0.00 1.25 0.00 0.00 34.83 33.82 2aaz s MET 213 CO -0.03 0.56 -0.15 -0.47 1.05 0.00 0.00 175.02 175.98 2aaz s TYR 214 N -0.74 2.79 -0.24 4.11 5.04 -0.57 -1.13 117.35 126.61 2aaz s TYR 214 Ca 0.12 -1.00 -0.01 0.00 -2.44 0.00 0.00 57.07 53.73 2aaz s TYR 214 Cb -0.10 -1.89 0.03 0.00 0.35 0.00 0.00 41.96 40.34 2aaz s TYR 214 CO 0.01 -0.45 -0.07 -1.14 -1.34 0.00 0.00 175.55 172.56 2aaz s GLN 215 N 0.80 2.84 0.30 4.97 0.74 -0.41 -2.24 119.66 126.66 2aaz s GLN 215 Ca -0.05 -0.97 0.04 0.00 0.05 0.00 0.00 55.36 54.43 2aaz s GLN 215 Cb -0.15 -2.97 0.48 0.00 1.10 0.00 0.00 33.01 31.47 2aaz s GLN 215 CO 0.00 -0.39 1.76 0.07 -0.55 0.00 0.00 175.29 176.18 2aaz h ARG 216 N 8.01 0.42 -3.78 1.67 0.11 -1.46 0.11 114.38 119.46 2aaz h ARG 216 Ca -0.33 -0.15 -0.38 0.00 0.10 0.00 0.00 59.98 59.22 2aaz h ARG 216 Cb 1.11 -0.03 -0.35 0.00 1.11 0.00 0.00 29.97 31.81 2aaz h ARG 216 CO 0.57 0.63 -0.76 0.45 0.10 0.00 0.00 179.97 180.97 2aaz s SER 217 N -6.82 0.87 -0.18 0.08 0.15 -1.26 -0.35 113.70 106.19 2aaz s SER 217 Ca -0.06 -0.06 -0.01 0.00 0.70 0.00 0.00 55.95 56.51 2aaz s SER 217 Cb 0.14 -0.33 0.05 0.00 -1.71 0.00 0.00 66.02 64.17 2aaz s SER 217 CO 0.78 -0.11 -0.02 0.00 1.20 0.00 0.00 173.24 175.08 2aaz s ASP 219 N 1.66 6.25 0.31 0.00 3.68 -1.26 -1.51 116.67 125.81 2aaz s ASP 219 Ca -0.01 -1.08 -0.00 0.00 2.13 0.00 0.00 52.55 53.59 2aaz s ASP 219 Cb -0.16 -2.45 0.51 0.00 -1.45 0.00 0.00 42.92 39.37 2aaz s ASP 219 CO -0.07 -1.46 1.96 -0.07 0.13 0.00 0.00 175.17 175.66 2aaz h LEU 220 N 11.57 0.89 0.27 -1.34 4.07 -1.72 0.40 115.31 129.46 2aaz h LEU 220 Ca -0.20 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.74 2aaz h LEU 220 Cb 1.06 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.59 2aaz h LEU 220 CO 1.20 0.62 -0.13 1.23 -1.08 0.00 0.00 178.44 180.28 2aaz h GLY 221 N 1.04 -0.39 0.00 0.83 0.00 -1.90 -3.38 103.07 99.27 2aaz h GLY 221 Ca 0.32 0.14 -0.39 0.00 0.00 0.00 0.00 47.33 47.40 2aaz h GLY 221 CO -0.09 -0.14 -2.39 1.04 0.00 0.00 0.00 176.54 174.96 2aaz n LEU 222 N -5.15 2.46 0.04 3.11 4.77 -1.19 -4.71 117.00 116.32 2aaz n LEU 222 Ca -0.10 0.07 -0.09 0.00 -0.03 0.00 0.00 56.01 55.86 2aaz n LEU 222 Cb 0.23 -0.80 -0.07 0.00 -2.33 0.00 0.00 43.42 40.45 2aaz n LEU 222 CO 0.33 0.74 0.32 1.23 -1.33 0.00 0.00 177.39 178.67 2aaz h GLY 223 N 0.62 -0.21 -0.19 -0.72 0.00 -1.20 -3.36 103.07 98.01 2aaz h GLY 223 Ca -0.59 0.08 0.21 0.00 0.00 0.00 0.00 47.33 47.03 2aaz h GLY 223 CO -0.22 -0.07 0.35 -2.08 0.00 0.00 0.00 176.54 174.52 2aaz h VAL 224 N -0.93 0.48 -0.82 4.60 2.07 -1.48 0.24 116.25 120.41 2aaz h VAL 224 Ca -0.02 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.42 2aaz h VAL 224 Cb 0.49 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.28 2aaz h VAL 224 CO 0.03 0.07 0.54 -0.65 0.02 0.00 0.00 177.57 177.58 2aaz h PRO 225 N 0.38 0.94 -0.08 1.57 0.11 -1.76 -0.07 132.00 133.09 2aaz h PRO 225 Ca 0.54 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 66.51 2aaz h PRO 225 Cb 1.00 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.90 2aaz h PRO 225 CO -0.53 0.62 -0.27 0.74 -0.21 0.00 0.00 178.00 178.36 2aaz h PHE 226 N 0.97 0.42 -0.76 0.65 -1.00 -0.77 -3.07 116.94 113.38 2aaz h PHE 226 Ca 0.34 -0.17 0.06 0.00 2.81 0.00 0.00 57.97 61.01 2aaz h PHE 226 Cb 0.11 -0.07 -0.06 0.00 3.61 0.00 0.00 35.95 39.54 2aaz h PHE 226 CO -0.00 0.88 0.45 -0.91 -1.61 0.00 0.00 178.31 177.12 2aaz h ASN 227 N -0.16 0.69 0.19 2.17 -0.26 -0.51 0.21 115.58 117.90 2aaz h ASN 227 Ca -0.01 0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.74 2aaz h ASN 227 Cb 0.90 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 38.04 2aaz h ASN 227 CO 0.06 0.44 -0.09 0.40 -1.06 0.00 0.00 177.43 177.17 2aaz h ILE 228 N 0.82 0.86 -0.67 2.81 2.04 -1.08 -1.98 117.51 120.30 2aaz h ILE 228 Ca 0.34 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.91 2aaz h ILE 228 Cb 0.19 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 2aaz h ILE 228 CO -0.18 0.05 0.17 0.00 0.00 0.00 0.00 178.15 178.19 2aaz h ALA 229 N 0.43 0.89 0.38 1.87 0.00 -1.39 -2.02 119.26 119.42 2aaz h ALA 229 Ca -0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2aaz h ALA 229 Cb 0.28 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2aaz h ALA 229 CO 0.04 0.60 -0.35 1.03 0.00 0.00 0.00 179.25 180.57 2aaz h SER 230 N 1.00 -0.93 0.44 0.00 0.87 -0.49 0.10 113.55 114.54 2aaz h SER 230 Ca 0.21 0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.78 2aaz h SER 230 Cb 0.36 0.31 -0.01 0.00 -0.44 0.00 0.00 62.40 62.62 2aaz h SER 230 CO 0.00 -0.50 -0.32 1.88 -0.53 0.00 0.00 176.83 177.37 2aaz h TYR 231 N -0.74 0.00 -0.40 2.24 0.05 -1.37 0.86 116.97 117.61 2aaz h TYR 231 Ca -0.03 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.67 2aaz h TYR 231 Cb 0.66 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.39 2aaz h TYR 231 CO -0.19 0.32 -0.06 0.00 -1.05 0.00 0.00 178.16 177.19 2aaz h ALA 232 N 1.68 0.54 -0.63 3.88 0.00 -1.04 -1.73 119.26 121.96 2aaz h ALA 232 Ca -0.00 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 2aaz h ALA 232 Cb 0.62 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2aaz h ALA 232 CO 0.04 0.38 0.08 -0.07 0.00 0.00 0.00 179.25 179.67 2aaz h LEU 233 N 0.56 1.03 -0.85 0.00 3.38 -0.12 -1.89 115.31 117.42 2aaz h LEU 233 Ca 0.11 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.83 2aaz h LEU 233 Cb 0.56 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 2aaz h LEU 233 CO 0.03 1.04 0.55 0.25 0.09 0.00 0.00 178.44 180.41 2aaz h LEU 234 N 0.98 0.92 -0.52 1.67 5.85 -0.69 0.11 115.31 123.63 2aaz h LEU 234 Ca 0.19 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 2aaz h LEU 234 Cb 0.47 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 2aaz h LEU 234 CO 0.02 0.64 0.11 0.74 -0.34 0.00 0.00 178.44 179.60 2aaz h THR 235 N 1.08 1.25 -0.68 1.05 2.02 -1.03 0.49 112.91 117.09 2aaz h THR 235 Ca 0.34 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.60 2aaz h THR 235 Cb -0.02 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 2aaz h THR 235 CO -0.11 0.33 0.35 0.45 0.37 0.00 0.00 175.52 176.90 2aaz h HIS 236 N 0.73 0.97 0.16 3.16 3.86 -0.78 0.41 115.15 123.66 2aaz h HIS 236 Ca 0.16 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 2aaz h HIS 236 Cb 0.37 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.54 2aaz h HIS 236 CO 0.03 0.71 -0.08 0.52 0.86 0.00 0.00 177.93 179.97 2aaz h MET 237 N 0.94 -0.21 -0.72 2.45 2.07 -0.32 -2.04 114.93 117.10 2aaz h MET 237 Ca 0.24 0.01 -0.02 0.00 -2.07 0.00 0.00 59.70 57.86 2aaz h MET 237 Cb 0.09 0.05 -0.03 0.00 -1.87 0.00 0.00 31.60 29.83 2aaz h MET 237 CO -0.03 -0.10 0.38 0.82 1.07 0.00 0.00 176.91 179.05 2aaz h ILE 238 N -0.26 1.22 -0.80 -1.22 2.04 -0.81 -2.14 117.51 115.54 2aaz h ILE 238 Ca -0.02 -0.57 0.02 0.00 1.00 0.00 0.00 64.86 65.28 2aaz h ILE 238 Cb 0.20 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 36.50 2aaz h ILE 238 CO 0.04 0.25 0.52 0.00 0.00 0.00 0.00 178.15 178.96 2aaz h ALA 239 N 1.40 1.02 -0.30 1.87 0.00 -0.67 -0.97 119.26 121.62 2aaz h ALA 239 Ca 0.25 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2aaz h ALA 239 Cb 0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2aaz h ALA 239 CO -0.04 0.40 0.17 1.25 0.00 0.00 0.00 179.25 181.02 2aaz h LEU 240 N 1.06 0.37 -1.18 0.00 5.85 -0.73 -1.22 115.31 119.46 2aaz h LEU 240 Ca 0.30 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.87 2aaz h LEU 240 Cb -0.08 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 2aaz h LEU 240 CO -0.08 0.35 -0.32 0.40 -0.34 0.00 0.00 178.44 178.45 2aaz h ILE 241 N 0.37 0.89 -0.41 4.05 1.08 -1.16 -3.17 117.51 119.15 2aaz h ILE 241 Ca 0.11 -1.28 0.00 0.00 -0.39 0.00 0.00 64.86 63.29 2aaz h ILE 241 Cb 0.05 1.77 0.00 0.00 -3.07 0.00 0.00 36.82 35.58 2aaz h ILE 241 CO -0.02 0.32 0.00 0.35 -0.69 0.00 0.00 178.15 178.11 2aaz n THR 242 N -3.65 0.65 -3.30 -0.27 -2.24 -0.39 -4.97 114.28 100.10 2aaz n THR 242 Ca -0.01 -0.82 -0.24 0.00 -2.27 0.00 0.00 64.05 60.71 2aaz n THR 242 Cb 0.44 0.82 0.05 0.00 -2.10 0.00 0.00 70.33 69.54 2aaz n THR 242 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2aaz n ASP 243 N 1.25 -6.09 -4.71 3.42 10.43 -0.65 -4.79 116.55 115.42 2aaz n ASP 243 Ca 0.18 -0.41 -0.26 0.00 2.57 0.00 0.00 54.79 56.87 2aaz n ASP 243 Cb 0.54 -4.87 -0.08 0.00 1.84 0.00 0.00 41.12 38.55 2aaz n ASP 243 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2aaz s THR 244 N -3.23 2.22 -0.22 -3.53 -4.23 -0.55 -4.45 115.64 101.64 2aaz s THR 244 Ca 0.44 -1.78 -0.05 0.00 -1.18 0.00 0.00 61.69 59.12 2aaz s THR 244 Cb -0.20 -2.99 -0.02 0.00 1.34 0.00 0.00 72.50 70.63 2aaz s THR 244 CO 0.54 0.00 -0.01 -0.70 -0.54 0.00 0.00 174.62 173.91 2aaz s GLU 245 N -3.86 3.48 0.27 3.99 2.56 0.30 -4.45 118.70 121.00 2aaz s GLU 245 Ca 0.39 -0.58 -0.31 0.00 0.00 0.00 0.00 54.97 54.48 2aaz s GLU 245 Cb 0.05 -3.08 -0.12 0.00 2.00 0.00 0.00 34.13 32.98 2aaz s GLU 245 CO 0.21 -0.15 1.54 -0.35 -0.56 0.00 0.00 175.26 175.96 2aaz n PRO 246 N 4.69 2.48 0.04 4.30 -0.04 -1.26 -0.38 135.00 144.82 2aaz n PRO 246 Ca -0.18 0.88 -0.00 0.00 -0.04 0.00 0.00 63.50 64.16 2aaz n PRO 246 Cb 0.51 -2.63 -0.00 0.00 -0.04 0.00 0.00 33.50 31.34 2aaz n PRO 246 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 2aaz n HIS 247 N 2.18 0.00 -3.78 0.54 -0.00 0.16 -3.76 115.22 110.56 2aaz n HIS 247 Ca 0.10 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.15 2aaz n HIS 247 Cb 0.35 -0.02 -0.10 0.00 -0.12 0.00 0.00 29.99 30.11 2aaz n HIS 247 CO 0.00 0.00 0.00 -2.00 0.46 0.00 0.00 176.34 174.80 2aaz s GLU 248 N -1.95 0.55 -0.10 1.57 2.12 -1.22 -0.65 118.70 119.02 2aaz s GLU 248 Ca -0.01 -0.06 0.03 0.00 0.36 0.00 0.00 54.97 55.29 2aaz s GLU 248 Cb 0.00 0.25 0.01 0.00 0.26 0.00 0.00 34.13 34.64 2aaz s GLU 248 CO 0.01 -0.13 -0.20 0.12 -0.54 0.00 0.00 175.26 174.52 2aaz s PHE 249 N -0.92 2.29 -0.08 5.30 5.36 -0.01 -1.05 117.98 128.86 2aaz s PHE 249 Ca -0.10 -1.00 0.04 0.00 -0.96 0.00 0.00 56.93 54.91 2aaz s PHE 249 Cb -0.05 -1.57 -0.01 0.00 -0.34 0.00 0.00 43.02 41.05 2aaz s PHE 249 CO 0.03 -0.45 -0.21 0.42 -1.46 0.00 0.00 175.22 173.55 2aaz s ILE 250 N 0.62 2.40 -0.21 3.12 1.09 0.14 -0.54 121.20 127.82 2aaz s ILE 250 Ca -0.13 -0.93 0.01 0.00 -1.10 0.00 0.00 60.65 58.50 2aaz s ILE 250 Cb -0.17 -1.92 0.04 0.00 -1.06 0.00 0.00 42.46 39.36 2aaz s ILE 250 CO 0.04 0.56 -0.12 -0.22 -0.10 0.00 0.00 174.94 175.10 2aaz s LEU 251 N -0.05 2.49 -0.18 2.97 2.96 0.08 -0.73 118.68 126.22 2aaz s LEU 251 Ca -0.06 -0.95 -0.06 0.00 -0.22 0.00 0.00 54.13 52.83 2aaz s LEU 251 Cb -0.14 -1.33 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 2aaz s LEU 251 CO 0.05 -0.13 0.04 -1.58 -1.32 0.00 0.00 176.35 173.40 2aaz s GLN 252 N 1.32 3.88 0.09 1.98 2.00 -0.28 -0.79 119.66 127.85 2aaz s GLN 252 Ca -0.02 -0.40 0.04 0.00 -2.00 0.00 0.00 55.36 52.98 2aaz s GLN 252 Cb -0.16 -3.15 -0.04 0.00 0.80 0.00 0.00 33.01 30.46 2aaz s GLN 252 CO -0.08 0.23 0.06 -1.64 -0.50 0.00 0.00 175.29 173.36 2aaz s MET 253 N 0.45 2.80 0.00 1.67 -1.94 -1.26 -1.29 119.30 119.73 2aaz s MET 253 Ca 0.01 -0.74 0.00 0.00 -1.71 0.00 0.00 55.69 53.26 2aaz s MET 253 Cb -0.13 -2.67 0.00 0.00 2.01 0.00 0.00 34.83 34.04 2aaz s MET 253 CO 0.01 0.55 0.00 0.41 -0.01 0.00 0.00 175.02 175.99 2aaz n GLY 254 N 0.43 0.01 3.54 -0.03 0.00 0.39 -3.55 105.19 105.98 2aaz n GLY 254 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 2aaz n GLY 254 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2aaz s ASP 255 N -1.00 6.19 -0.31 1.61 3.68 0.53 -0.89 116.67 126.48 2aaz s ASP 255 Ca 0.00 -0.48 -0.14 0.00 2.13 0.00 0.00 52.55 54.06 2aaz s ASP 255 Cb 0.00 -2.54 -0.03 0.00 -1.45 0.00 0.00 42.92 38.91 2aaz s ASP 255 CO 0.00 -1.74 0.31 0.00 0.13 0.00 0.00 175.17 173.87 2aaz s ALA 256 N 5.38 3.52 0.07 3.66 0.00 -0.56 -0.43 121.76 133.41 2aaz s ALA 256 Ca 0.34 -1.13 -0.00 0.00 0.00 0.00 0.00 51.96 51.17 2aaz s ALA 256 Cb -0.09 -2.70 -0.04 0.00 0.00 0.00 0.00 23.12 20.29 2aaz s ALA 256 CO 0.15 -0.85 -0.02 -3.38 0.00 0.00 0.00 175.76 171.66 2aaz s HIS 257 N 1.93 0.66 -0.15 0.00 -0.00 -0.57 -1.29 115.29 115.87 2aaz s HIS 257 Ca 0.11 -1.06 0.01 0.00 -0.00 0.00 0.00 55.06 54.11 2aaz s HIS 257 Cb -0.16 -0.44 0.02 0.00 -0.00 0.00 0.00 32.58 32.00 2aaz s HIS 257 CO 0.11 -0.35 -0.16 0.08 -0.00 0.00 0.00 174.74 174.42 2aaz s VAL 258 N -3.88 1.69 0.53 -5.38 1.01 -0.29 -1.68 120.40 112.40 2aaz s VAL 258 Ca 0.11 -0.71 -0.21 0.00 0.00 0.00 0.00 61.98 61.16 2aaz s VAL 258 Cb 0.07 -1.56 -0.05 0.00 0.00 0.00 0.00 36.38 34.84 2aaz s VAL 258 CO -0.07 0.48 1.25 -0.31 0.00 0.00 0.00 175.10 176.45 2aaz s TYR 259 N 1.39 2.52 0.26 5.22 1.51 -1.26 -1.60 117.35 125.39 2aaz s TYR 259 Ca 0.04 1.47 -0.01 0.00 -1.01 0.00 0.00 57.07 57.56 2aaz s TYR 259 Cb -0.13 -3.57 0.53 0.00 -0.11 0.00 0.00 41.96 38.68 2aaz s TYR 259 CO -0.10 -2.24 1.77 0.00 -1.11 0.00 0.00 175.55 173.87 2aaz h ARG 260 N 1.51 0.65 -0.05 -0.62 2.47 -1.61 0.84 114.38 117.57 2aaz h ARG 260 Ca -0.50 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.18 2aaz h ARG 260 Cb 1.28 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.46 2aaz h ARG 260 CO 0.58 0.43 0.00 -0.40 0.56 0.00 0.00 179.97 181.14 2aaz n ASP 261 N -4.84 0.29 -0.00 7.04 5.75 -1.26 -3.21 116.55 120.32 2aaz n ASP 261 Ca 0.17 -1.97 0.06 0.00 -0.01 0.00 0.00 54.79 53.04 2aaz n ASP 261 Cb 0.42 -0.04 -0.09 0.00 -1.03 0.00 0.00 41.12 40.39 2aaz n ASP 261 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2aaz n HIS 262 N -0.36 0.00 0.02 2.11 8.25 0.28 -4.67 115.22 120.85 2aaz n HIS 262 Ca 0.03 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 2aaz n HIS 262 Cb 0.05 -0.22 -0.05 0.00 1.12 0.00 0.00 29.99 30.89 2aaz n HIS 262 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2aaz h VAL 263 N 0.00 0.24 -0.27 1.59 2.07 -1.50 -0.70 116.25 117.68 2aaz h VAL 263 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2aaz h VAL 263 Cb 0.51 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2aaz h VAL 263 CO 0.00 0.00 0.11 -0.33 0.02 0.00 0.00 177.57 177.37 2aaz h GLU 264 N -0.46 0.41 -0.72 1.57 4.39 -1.84 -1.86 114.58 116.08 2aaz h GLU 264 Ca 0.08 -0.08 0.02 0.00 0.34 0.00 0.00 59.36 59.72 2aaz h GLU 264 Cb 0.58 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.13 2aaz h GLU 264 CO -0.34 0.44 0.47 -1.35 -1.16 0.00 0.00 179.01 177.08 2aaz h PRO 265 N 0.29 0.90 -0.14 2.33 0.11 -1.79 -2.36 132.00 131.34 2aaz h PRO 265 Ca 0.09 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.03 2aaz h PRO 265 Cb 0.19 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 2aaz h PRO 265 CO -0.01 0.59 -0.43 -0.07 -0.21 0.00 0.00 178.00 177.88 2aaz h LEU 266 N 0.93 0.35 -1.70 2.35 3.38 -0.89 -2.68 115.31 117.04 2aaz h LEU 266 Ca 0.27 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.13 2aaz h LEU 266 Cb -0.04 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2aaz h LEU 266 CO -0.07 0.74 0.27 0.11 0.09 0.00 0.00 178.44 179.58 2aaz h LYS 267 N 0.27 0.37 -0.47 1.13 1.57 -0.79 0.17 116.57 118.82 2aaz h LYS 267 Ca 0.02 -0.02 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 2aaz h LYS 267 Cb 0.87 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 2aaz h LYS 267 CO 0.07 0.24 -0.23 1.15 -0.57 0.00 0.00 179.45 180.11 2aaz h THR 268 N 0.38 1.27 -0.25 -0.16 2.02 -1.42 -2.99 112.91 111.75 2aaz h THR 268 Ca 0.17 -1.40 -0.12 0.00 0.77 0.00 0.00 66.41 65.83 2aaz h THR 268 Cb 0.19 1.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 2aaz h THR 268 CO -0.04 0.48 -0.33 -0.61 0.37 0.00 0.00 175.52 175.39 2aaz h GLN 269 N 0.85 0.54 0.00 6.66 4.15 -0.87 -2.96 115.11 123.48 2aaz h GLN 269 Ca 0.11 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.28 2aaz h GLN 269 Cb 0.82 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.49 2aaz h GLN 269 CO 0.07 0.80 0.00 -0.07 -1.93 0.00 0.00 178.83 177.70 2aaz h LEU 270 N 0.46 0.00 0.00 -2.39 3.38 -0.62 -1.36 115.31 114.78 2aaz h LEU 270 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2aaz h LEU 270 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2aaz h LEU 270 CO 0.07 0.00 -0.12 -0.62 0.09 0.00 0.00 178.44 177.86 2aaz n GLU 271 N -2.95 0.08 -3.41 1.13 1.02 -1.12 -4.88 120.64 110.51 2aaz n GLU 271 Ca -0.02 0.05 -0.37 0.00 -0.02 0.00 0.00 57.16 56.80 2aaz n GLU 271 Cb 0.09 -1.58 -0.06 0.00 -0.02 0.00 0.00 31.44 29.88 2aaz n GLU 271 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2aaz s ARG 272 N -3.03 3.99 -0.15 3.49 0.52 -0.51 -5.07 118.95 118.19 2aaz s ARG 272 Ca 0.12 0.49 -0.19 0.00 -0.52 0.00 0.00 55.73 55.63 2aaz s ARG 272 Cb 0.17 -3.09 -0.04 0.00 0.52 0.00 0.00 34.95 32.51 2aaz s ARG 272 CO 0.58 0.58 0.53 -2.00 0.02 0.00 0.00 175.30 175.01 2aaz s GLU 273 N -1.52 4.29 0.62 3.54 2.12 -1.26 -4.97 118.70 121.52 2aaz s GLU 273 Ca 0.31 0.50 -0.19 0.00 0.36 0.00 0.00 54.97 55.95 2aaz s GLU 273 Cb -0.16 -3.49 -0.02 0.00 0.26 0.00 0.00 34.13 30.72 2aaz s GLU 273 CO 0.17 0.02 1.32 -2.14 -0.54 0.00 0.00 175.26 174.09 2aaz s PRO 274 N 1.07 2.72 0.20 4.30 0.02 -1.26 -4.88 135.00 137.18 2aaz s PRO 274 Ca 0.27 2.14 0.05 0.00 0.02 0.00 0.00 61.00 63.48 2aaz s PRO 274 Cb -0.16 -1.97 -0.04 0.00 0.02 0.00 0.00 34.50 32.36 2aaz s PRO 274 CO 0.11 -1.49 0.22 1.03 -0.33 0.00 0.00 177.00 176.54 2aaz s ARG 275 N -3.23 3.10 0.31 5.54 3.00 -1.26 -5.05 118.95 121.36 2aaz s ARG 275 Ca 0.79 -0.86 -0.29 0.00 0.00 0.00 0.00 55.73 55.38 2aaz s ARG 275 Cb -0.39 -2.72 -0.13 0.00 0.00 0.00 0.00 34.95 31.71 2aaz s ARG 275 CO 0.43 0.45 1.27 -0.25 0.00 0.00 0.00 175.30 177.20 2aaz n ASP 276 N -0.84 2.51 -4.72 0.23 8.00 -1.26 -4.81 116.55 115.65 2aaz n ASP 276 Ca -0.08 1.19 -0.36 0.00 0.71 0.00 0.00 54.79 56.25 2aaz n ASP 276 Cb 0.56 -1.44 0.08 0.00 -0.02 0.00 0.00 41.12 40.30 2aaz n ASP 276 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2aaz s PHE 277 N -0.88 2.03 0.90 1.24 0.08 -1.26 -4.74 117.98 115.35 2aaz s PHE 277 Ca 0.59 1.54 -0.14 0.00 0.12 0.00 0.00 56.93 59.03 2aaz s PHE 277 Cb -0.61 -3.62 0.14 0.00 -0.57 0.00 0.00 43.02 38.36 2aaz s PHE 277 CO 0.59 -2.86 1.23 -1.25 -0.10 0.00 0.00 175.22 172.83 2aaz s PRO 278 N -3.59 1.19 0.16 0.24 0.04 -1.25 -4.85 135.00 126.94 2aaz s PRO 278 Ca 0.80 -0.08 0.10 0.00 0.04 0.00 0.00 61.00 61.85 2aaz s PRO 278 Cb -0.35 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 2aaz s PRO 278 CO 0.42 -2.09 -0.17 0.15 0.04 0.00 0.00 177.00 175.35 2aaz s LYS 279 N -5.66 1.81 -0.13 4.56 1.02 -0.28 -1.43 119.74 119.64 2aaz s LYS 279 Ca 0.67 -1.30 -0.04 0.00 0.02 0.00 0.00 55.97 55.33 2aaz s LYS 279 Cb -0.09 -2.06 -0.03 0.00 -0.52 0.00 0.00 37.83 35.13 2aaz s LYS 279 CO 0.51 0.44 0.01 -1.17 -0.92 0.00 0.00 175.35 174.22 2aaz s LEU 280 N -2.51 3.55 0.08 3.17 2.96 0.14 -1.15 118.68 124.92 2aaz s LEU 280 Ca 0.21 0.06 0.03 0.00 -0.22 0.00 0.00 54.13 54.21 2aaz s LEU 280 Cb -0.09 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.72 2aaz s LEU 280 CO 0.12 0.28 -0.10 -0.54 -1.32 0.00 0.00 176.35 174.79 2aaz s LYS 281 N -0.28 0.77 -0.13 1.98 -0.14 0.20 -4.82 119.74 117.32 2aaz s LYS 281 Ca 0.06 -1.06 -0.07 0.00 -1.36 0.00 0.00 55.97 53.54 2aaz s LYS 281 Cb -0.12 -0.47 -0.04 0.00 -1.68 0.00 0.00 37.83 35.52 2aaz s LYS 281 CO 0.02 0.07 0.12 -1.58 -0.76 0.00 0.00 175.35 173.23 2aaz s TRP 282 N -2.21 3.53 -0.73 3.18 0.52 -1.26 -0.85 118.94 121.12 2aaz s TRP 282 Ca 0.02 0.46 0.26 0.00 0.02 0.00 0.00 56.10 56.86 2aaz s TRP 282 Cb -0.04 -1.95 0.80 0.00 -1.15 0.00 0.00 33.47 31.13 2aaz s TRP 282 CO -0.00 0.65 1.77 0.00 0.02 0.00 0.00 176.95 179.39 2aaz n ALA 283 N 2.20 2.29 -2.31 0.98 0.00 -0.08 -4.86 120.51 118.72 2aaz n ALA 283 Ca -0.19 -0.02 -0.16 0.00 0.00 0.00 0.00 53.44 53.06 2aaz n ALA 283 Cb 0.54 -1.47 -0.10 0.00 0.00 0.00 0.00 19.45 18.42 2aaz n ALA 283 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2aaz s ARG 284 N -3.10 1.38 0.65 0.00 0.52 -1.26 -5.05 118.95 112.08 2aaz s ARG 284 Ca 0.11 -1.74 -0.05 0.00 -0.52 0.00 0.00 55.73 53.53 2aaz s ARG 284 Cb 0.12 -0.26 0.04 0.00 0.52 0.00 0.00 34.95 35.37 2aaz s ARG 284 CO 0.60 -0.28 0.94 -1.54 0.02 0.00 0.00 175.30 175.05 2aaz s SER 285 N -3.30 5.12 0.19 0.23 1.04 -1.26 -4.89 113.70 110.82 2aaz s SER 285 Ca 0.36 0.46 -0.12 0.00 0.48 0.00 0.00 55.95 57.13 2aaz s SER 285 Cb 0.08 -1.25 0.16 0.00 0.10 0.00 0.00 66.02 65.10 2aaz s SER 285 CO 0.13 -1.37 1.80 0.50 0.98 0.00 0.00 173.24 175.28 2aaz h LYS 286 N -0.37 0.59 -0.66 4.02 3.64 -1.98 -0.76 116.57 121.06 2aaz h LYS 286 Ca -0.44 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2aaz h LYS 286 Cb 1.30 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.95 2aaz h LYS 286 CO 0.59 0.39 0.42 0.93 -2.27 0.00 0.00 179.45 179.51 2aaz h GLU 287 N 0.61 0.88 -0.28 1.90 3.07 -1.94 0.31 114.58 119.13 2aaz h GLU 287 Ca 0.24 -0.07 -0.04 0.00 -0.50 0.00 0.00 59.36 59.00 2aaz h GLU 287 Cb 0.10 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 27.81 2aaz h GLU 287 CO -0.14 0.60 0.02 0.93 -1.40 0.00 0.00 179.01 179.02 2aaz h GLU 288 N 0.89 0.49 -0.50 2.33 5.08 -1.82 -2.90 114.58 118.15 2aaz h GLU 288 Ca 0.24 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 2aaz h GLU 288 Cb -0.07 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 2aaz h GLU 288 CO -0.05 0.63 -0.02 0.82 -1.00 0.00 0.00 179.01 179.38 2aaz h ILE 289 N 0.29 1.25 0.00 3.13 2.04 -0.94 -3.47 117.51 119.81 2aaz h ILE 289 Ca 0.08 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 64.86 2aaz h ILE 289 Cb 0.40 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 2aaz h ILE 289 CO 0.01 0.38 0.00 0.61 0.00 0.00 0.00 178.15 179.15 2aaz n GLY 290 N -0.55 2.26 1.16 5.37 0.00 0.11 -4.02 105.19 109.53 2aaz n GLY 290 Ca 0.02 -0.11 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 2aaz n GLY 290 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2aaz n ASP 291 N 4.43 -0.31 0.34 1.61 5.68 -1.26 -4.88 116.55 122.16 2aaz n ASP 291 Ca 0.00 -1.76 0.23 0.00 -0.50 0.00 0.00 54.79 52.75 2aaz n ASP 291 Cb 0.00 0.67 1.22 0.00 -1.14 0.00 0.00 41.12 41.87 2aaz n ASP 291 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2aaz h ILE 292 N 1.38 0.01 -0.15 2.12 6.09 -1.94 -0.55 117.51 124.47 2aaz h ILE 292 Ca -0.09 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.40 2aaz h ILE 292 Cb 0.43 1.00 0.00 0.00 0.47 0.00 0.00 36.82 38.72 2aaz h ILE 292 CO 0.12 0.00 0.00 0.47 -3.07 0.00 0.00 178.15 175.67 2aaz n ASP 293 N -3.09 2.42 -1.16 2.19 8.00 -1.26 -4.29 116.55 119.36 2aaz n ASP 293 Ca -0.03 -1.81 0.12 0.00 0.71 0.00 0.00 54.79 53.78 2aaz n ASP 293 Cb 0.07 -0.09 0.23 0.00 -0.02 0.00 0.00 41.12 41.31 2aaz n ASP 293 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2aaz n GLY 294 N 1.29 1.85 3.80 0.44 0.00 -0.21 -4.99 105.19 107.37 2aaz n GLY 294 Ca 0.17 -0.73 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 2aaz n GLY 294 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2aaz s PHE 295 N -1.39 3.12 0.09 1.61 0.40 -1.26 -4.79 117.98 115.76 2aaz s PHE 295 Ca 0.39 1.60 0.06 0.00 -0.60 0.00 0.00 56.93 58.38 2aaz s PHE 295 Cb 0.23 -3.02 -0.03 0.00 0.51 0.00 0.00 43.02 40.70 2aaz s PHE 295 CO 0.31 -0.61 -0.15 0.15 0.70 0.00 0.00 175.22 175.62 2aaz s LYS 296 N -3.10 0.90 0.24 0.44 1.02 -1.26 -5.05 119.74 112.94 2aaz s LYS 296 Ca 0.64 -1.06 -0.05 0.00 0.02 0.00 0.00 55.97 55.53 2aaz s LYS 296 Cb -0.15 -0.89 0.46 0.00 -0.52 0.00 0.00 37.83 36.73 2aaz s LYS 296 CO 0.19 0.19 1.68 0.28 -0.92 0.00 0.00 175.35 176.77 2aaz h VAL 297 N 4.04 0.48 0.00 3.17 2.07 -1.97 0.15 116.25 124.18 2aaz h VAL 297 Ca -0.41 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.03 2aaz h VAL 297 Cb 1.19 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2aaz h VAL 297 CO 0.43 0.04 0.00 -1.84 0.02 0.00 0.00 177.57 176.23 2aaz n GLU 298 N -5.19 0.03 0.18 1.57 0.00 -1.26 -2.02 120.64 113.95 2aaz n GLU 298 Ca 0.14 0.33 0.06 0.00 0.00 0.00 0.00 57.16 57.69 2aaz n GLU 298 Cb 0.47 -1.50 0.27 0.00 0.00 0.00 0.00 31.44 30.68 2aaz n GLU 298 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 2aaz h ASP 299 N 0.00 0.00 -2.87 -1.84 3.32 -1.10 -3.42 116.42 110.50 2aaz h ASP 299 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 2aaz h ASP 299 Cb 0.12 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.57 2aaz h ASP 299 CO 0.00 0.37 0.79 -0.36 -1.72 0.00 0.00 179.24 178.32 2aaz s PHE 300 N -3.42 2.59 -0.52 4.55 0.40 -0.86 -0.90 117.98 119.83 2aaz s PHE 300 Ca 0.01 -0.03 -0.13 0.00 -0.60 0.00 0.00 56.93 56.19 2aaz s PHE 300 Cb 0.10 -4.37 0.13 0.00 0.51 0.00 0.00 43.02 39.38 2aaz s PHE 300 CO 0.69 -1.66 0.43 0.08 0.70 0.00 0.00 175.22 175.46 2aaz s VAL 301 N 4.69 4.73 -0.34 -0.44 1.01 -0.03 -4.98 120.40 125.05 2aaz s VAL 301 Ca 0.33 -1.67 -0.17 0.00 0.00 0.00 0.00 61.98 60.47 2aaz s VAL 301 Cb -0.11 -4.07 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 2aaz s VAL 301 CO 0.18 -0.83 0.44 -0.69 0.00 0.00 0.00 175.10 174.20 2aaz s VAL 302 N 1.44 5.10 0.08 2.92 1.01 -1.26 -0.63 120.40 129.06 2aaz s VAL 302 Ca 0.05 0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.35 2aaz s VAL 302 Cb -0.28 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 2aaz s VAL 302 CO 0.01 -0.12 -0.13 -1.83 0.00 0.00 0.00 175.10 173.03 2aaz s GLU 303 N 2.20 2.11 0.00 2.72 -1.05 -0.30 -4.63 118.70 119.74 2aaz s GLU 303 Ca 0.15 -1.01 0.00 0.00 -0.15 0.00 0.00 54.97 53.97 2aaz s GLU 303 Cb -0.16 -2.27 0.00 0.00 -0.44 0.00 0.00 34.13 31.26 2aaz s GLU 303 CO 0.12 0.52 0.00 0.41 0.95 0.00 0.00 175.26 177.26 2aaz n GLY 304 N 0.98 0.41 3.64 -3.83 0.00 -1.26 -1.13 105.19 104.00 2aaz n GLY 304 Ca -0.15 -0.91 -0.43 0.00 0.00 0.00 0.00 46.02 44.54 2aaz n GLY 304 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2aaz s TYR 305 N -2.00 3.08 -0.50 1.61 6.04 -1.26 -4.33 117.35 119.98 2aaz s TYR 305 Ca 0.00 1.17 0.06 0.00 0.04 0.00 0.00 57.07 58.35 2aaz s TYR 305 Cb 0.00 -3.64 0.23 0.00 -1.04 0.00 0.00 41.96 37.51 2aaz s TYR 305 CO 0.00 -0.95 0.56 1.63 -1.54 0.00 0.00 175.55 175.25 2aaz n LYS 306 N 6.83 1.30 -2.08 4.97 5.02 -1.26 -5.08 118.16 127.86 2aaz n LYS 306 Ca 0.13 -3.80 -0.28 0.00 -2.02 0.00 0.00 58.31 52.34 2aaz n LYS 306 Cb 0.47 -1.72 0.05 0.00 -0.02 0.00 0.00 35.03 33.80 2aaz n LYS 306 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2aaz s PRO 307 N -1.41 2.69 0.36 1.97 0.04 -1.26 -4.73 135.00 132.66 2aaz s PRO 307 Ca 0.35 0.19 -0.05 0.00 0.04 0.00 0.00 61.00 61.53 2aaz s PRO 307 Cb 0.12 -2.11 0.08 0.00 0.04 0.00 0.00 34.50 32.63 2aaz s PRO 307 CO -0.10 -1.02 0.49 0.91 0.04 0.00 0.00 177.00 177.32 2aaz n TRP 308 N -2.90 -3.88 -0.95 0.56 7.02 0.03 -4.90 117.44 112.42 2aaz n TRP 308 Ca 0.06 -0.49 -0.30 0.00 -1.02 0.00 0.00 57.50 55.76 2aaz n TRP 308 Cb 0.58 -0.38 0.15 0.00 -2.42 0.00 0.00 31.31 29.25 2aaz n TRP 308 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 2aaz s GLY 309 N -4.01 1.64 0.66 6.99 0.00 -1.26 -2.83 107.32 108.51 2aaz s GLY 309 Ca 0.28 0.22 -0.14 0.00 0.00 0.00 0.00 44.72 45.08 2aaz s GLY 309 CO 0.20 0.69 1.09 -1.59 0.00 0.00 0.00 173.10 173.49 2aaz s LYS 310 N -4.76 2.85 -0.17 2.90 -2.85 -1.26 -2.95 119.74 113.50 2aaz s LYS 310 Ca 0.65 1.30 -0.00 0.00 -1.00 0.00 0.00 55.97 56.92 2aaz s LYS 310 Cb -0.20 -1.96 0.04 0.00 -2.06 0.00 0.00 37.83 33.64 2aaz s LYS 310 CO 0.58 -1.19 -0.06 0.42 0.10 0.00 0.00 175.35 175.20 2aaz s ILE 311 N -2.46 1.22 0.05 3.79 1.01 -1.26 -4.88 121.20 118.67 2aaz s ILE 311 Ca 0.65 -0.71 -0.31 0.00 0.00 0.00 0.00 60.65 60.28 2aaz s ILE 311 Cb -0.19 -1.38 -0.06 0.00 0.01 0.00 0.00 42.46 40.84 2aaz s ILE 311 CO 0.43 0.13 1.32 -1.81 0.00 0.00 0.00 174.94 175.01 2aaz s ASP 312 N 1.58 6.93 -0.07 3.58 1.01 -1.26 -5.02 116.67 123.43 2aaz s ASP 312 Ca 0.00 2.13 -0.03 0.00 0.71 0.00 0.00 52.55 55.36 2aaz s ASP 312 Cb -0.15 -2.57 0.04 0.00 1.01 0.00 0.00 42.92 41.24 2aaz s ASP 312 CO -0.08 -0.61 0.15 -0.04 0.21 0.00 0.00 175.17 174.81 2aaz s MET 313 N 1.53 0.10 0.18 8.23 -1.94 -1.26 -4.89 119.30 121.25 2aaz s MET 313 Ca 0.62 0.38 -0.27 0.00 -1.71 0.00 0.00 55.69 54.71 2aaz s MET 313 Cb -0.32 -0.17 -0.08 0.00 2.01 0.00 0.00 34.83 36.27 2aaz s MET 313 CO 0.28 -0.16 0.83 0.21 -0.01 0.00 0.00 175.02 176.17 2aaz s LYS 314 N 1.16 4.66 -0.04 2.03 2.20 -1.26 -5.05 119.74 123.44 2aaz s LYS 314 Ca -0.09 1.26 -0.19 0.00 -0.36 0.00 0.00 55.97 56.59 2aaz s LYS 314 Cb -0.11 -3.28 -0.05 0.00 -1.51 0.00 0.00 37.83 32.88 2aaz s LYS 314 CO -0.06 0.53 0.54 1.41 -0.36 0.00 0.00 175.35 177.40 2aaz s MET 315 N -1.06 4.27 -0.34 4.03 -2.45 -1.26 -4.97 119.30 117.52 2aaz s MET 315 Ca 0.38 0.61 -0.19 0.00 -1.25 0.00 0.00 55.69 55.24 2aaz s MET 315 Cb -0.24 -3.35 -0.00 0.00 1.25 0.00 0.00 34.83 32.48 2aaz s MET 315 CO 0.28 0.35 0.56 -1.12 1.05 0.00 0.00 175.02 176.14 2aaz s SER 316 N -0.08 6.37 0.00 1.11 0.01 -1.26 -5.16 113.70 114.70 2aaz s SER 316 Ca 0.29 0.11 0.13 0.00 1.31 0.00 0.00 55.95 57.78 2aaz s SER 316 Cb -0.17 -2.29 0.80 0.00 0.21 0.00 0.00 66.02 64.57 2aaz s SER 316 CO 0.15 -0.49 1.22 0.00 0.41 0.00 0.00 173.24 174.52