#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 0.20 -2.82 0.55 0.87 -2.03 -3.28 113.55 107.04 2aaz h SER 14 Ca 0.00 0.08 -0.60 0.00 -1.23 0.00 0.00 61.79 60.03 2aaz h SER 14 Cb 0.00 0.06 -0.40 0.00 -0.44 0.00 0.00 62.40 61.62 2aaz h SER 14 CO 0.00 0.12 -0.78 0.21 -0.53 0.00 0.00 176.83 175.85 2aaz s ASN 15 N -5.38 3.11 0.22 6.23 2.47 -1.26 -4.97 114.94 115.36 2aaz s ASN 15 Ca -0.13 -3.31 0.16 0.00 0.42 0.00 0.00 52.86 50.01 2aaz s ASN 15 Cb 0.17 -0.99 0.83 0.00 -1.45 0.00 0.00 41.25 39.80 2aaz s ASN 15 CO 0.74 -0.15 1.49 -0.81 -3.72 0.00 0.00 177.10 174.65 2aaz n PRO 16 N 2.61 0.10 -0.06 0.43 -0.04 -1.24 -1.73 135.00 135.08 2aaz n PRO 16 Ca 0.23 0.57 0.12 0.00 -0.04 0.00 0.00 63.50 64.37 2aaz n PRO 16 Cb 0.41 -1.82 0.35 0.00 -0.04 0.00 0.00 33.50 32.40 2aaz n PRO 16 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2aaz n ASP 17 N -2.03 2.15 -4.69 3.54 8.00 -1.26 -4.92 116.55 117.34 2aaz n ASP 17 Ca -0.01 -1.74 -0.42 0.00 0.71 0.00 0.00 54.79 53.33 2aaz n ASP 17 Cb 0.05 -0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.04 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 -1.85 2.23 0.58 1.24 2.46 -0.71 -4.84 115.29 114.40 2aaz s HIS 18 Ca 0.34 0.03 0.28 0.00 0.47 0.00 0.00 55.06 56.18 2aaz s HIS 18 Cb 0.20 -4.16 1.57 0.00 -0.13 0.00 0.00 32.58 30.06 2aaz s HIS 18 CO 0.30 -4.76 2.02 0.93 -2.47 0.00 0.00 174.74 170.77 2aaz h GLU 19 N 8.43 0.00 0.00 2.88 5.08 -1.91 -1.58 114.58 127.48 2aaz h GLU 19 Ca -0.46 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.89 2aaz h GLU 19 Cb 1.22 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 -0.06 1.49 -1.00 0.00 0.00 179.01 180.39 2aaz h GLU 20 N 0.00 0.00 0.00 2.33 4.81 -1.96 -1.82 114.58 117.94 2aaz h GLU 20 Ca 0.14 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2aaz h GLU 20 Cb 0.75 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.13 2aaz h GLU 20 CO -0.00 0.06 -0.04 1.88 -0.73 0.00 0.00 179.01 180.17 2aaz h TYR 21 N 0.00 0.00 -0.38 0.92 -1.99 -1.66 -1.55 116.97 112.31 2aaz h TYR 21 Ca -0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 2aaz h TYR 21 Cb 0.31 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.02 2aaz h TYR 21 CO 0.00 0.04 0.22 1.96 -0.00 0.00 0.00 178.16 180.39 2aaz h GLN 22 N 0.00 0.52 -0.10 4.88 4.20 -1.53 0.37 115.11 123.45 2aaz h GLN 22 Ca -0.00 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 2aaz h GLN 22 Cb 0.22 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.89 2aaz h GLN 22 CO 0.01 0.40 -0.00 -0.92 -0.67 0.00 0.00 178.83 177.64 2aaz h TYR 23 N 0.49 0.19 -0.42 2.96 5.03 -1.47 -2.07 116.97 121.69 2aaz h TYR 23 Ca 0.14 -0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.37 2aaz h TYR 23 Cb 0.01 -0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.23 2aaz h TYR 23 CO -0.03 0.44 0.12 -0.07 -1.32 0.00 0.00 178.16 177.29 2aaz h LEU 24 N -0.11 0.62 -0.91 2.82 3.38 -1.24 -2.51 115.31 117.37 2aaz h LEU 24 Ca 0.03 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2aaz h LEU 24 Cb 0.36 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 2aaz h LEU 24 CO 0.01 0.68 0.52 0.44 0.09 0.00 0.00 178.44 180.17 2aaz h ASP 25 N 0.53 1.12 -0.63 -0.43 3.45 -0.29 -1.55 116.42 118.61 2aaz h ASP 25 Ca 0.13 -0.09 -0.06 0.00 0.43 0.00 0.00 57.03 57.44 2aaz h ASP 25 Cb 0.29 -0.28 -0.03 0.00 -0.56 0.00 0.00 39.33 38.75 2aaz h ASP 25 CO -0.00 0.88 0.14 0.25 -1.57 0.00 0.00 179.24 178.94 2aaz h LEU 26 N 1.26 0.97 -0.49 1.55 5.85 -1.19 -0.02 115.31 123.23 2aaz h LEU 26 Ca 0.32 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2aaz h LEU 26 Cb -0.00 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 2aaz h LEU 26 CO -0.06 0.96 0.23 0.40 -0.34 0.00 0.00 178.44 179.63 2aaz h ILE 27 N 0.93 1.19 -0.56 4.05 2.04 -1.17 0.31 117.51 124.31 2aaz h ILE 27 Ca 0.20 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2aaz h ILE 27 Cb 0.37 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 2aaz h ILE 27 CO 0.00 0.22 0.36 -0.09 0.00 0.00 0.00 178.15 178.64 2aaz h ARG 28 N 0.65 0.74 -0.45 2.37 2.43 -0.93 -1.01 114.38 118.18 2aaz h ARG 28 Ca 0.17 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 2aaz h ARG 28 Cb 0.13 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 2aaz h ARG 28 CO -0.02 0.50 0.20 -0.09 -1.51 0.00 0.00 179.97 179.05 2aaz h ARG 29 N 0.75 0.66 -0.47 0.20 2.43 -0.58 -0.45 114.38 116.92 2aaz h ARG 29 Ca 0.20 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2aaz h ARG 29 Cb -0.06 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 2aaz h ARG 29 CO -0.04 0.59 0.29 0.82 -1.51 0.00 0.00 179.97 180.12 2aaz h ILE 30 N 0.58 1.14 -0.63 1.20 2.04 -0.63 0.17 117.51 121.38 2aaz h ILE 30 Ca 0.15 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 2aaz h ILE 30 Cb 0.16 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.70 2aaz h ILE 30 CO -0.02 0.14 0.30 0.40 0.00 0.00 0.00 178.15 178.97 2aaz h ILE 31 N 0.63 1.22 0.30 -0.67 2.04 -1.03 0.27 117.51 120.26 2aaz h ILE 31 Ca 0.17 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.40 2aaz h ILE 31 Cb -0.03 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 2aaz h ILE 31 CO -0.03 0.25 -0.14 0.78 0.00 0.00 0.00 178.15 179.01 2aaz h ASN 32 N 0.86 -0.34 -0.09 1.72 -0.26 -0.63 -3.39 115.58 113.46 2aaz h ASN 32 Ca 0.22 -0.20 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 2aaz h ASN 32 Cb 0.12 0.09 0.00 0.00 -1.06 0.00 0.00 38.32 37.47 2aaz h ASN 32 CO -0.03 0.10 0.00 1.33 -1.06 0.00 0.00 177.43 177.77 2aaz n VAL 33 N -5.08 0.71 -1.15 2.81 0.24 0.55 -5.05 118.33 111.36 2aaz n VAL 33 Ca -0.09 -0.86 -0.32 0.00 -2.04 0.00 0.00 64.34 61.04 2aaz n VAL 33 Cb 0.27 0.67 0.11 0.00 -1.47 0.00 0.00 33.84 33.42 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 -0.81 1.84 -0.15 7.63 0.00 0.94 -4.98 107.32 111.78 2aaz s GLY 34 Ca 0.07 0.50 -0.16 0.00 0.00 0.00 0.00 44.72 45.13 2aaz s GLY 34 CO 0.05 0.88 0.39 1.85 0.00 0.00 0.00 173.10 176.28 2aaz s GLU 35 N -4.58 4.28 -0.07 2.90 2.12 -0.06 -4.67 118.70 118.62 2aaz s GLU 35 Ca 0.66 0.27 -0.30 0.00 0.36 0.00 0.00 54.97 55.96 2aaz s GLU 35 Cb -0.21 -3.45 -0.04 0.00 0.26 0.00 0.00 34.13 30.69 2aaz s GLU 35 CO 0.53 0.15 1.38 0.08 -0.54 0.00 0.00 175.26 176.86 2aaz s VAL 36 N 0.69 3.95 0.05 3.70 1.01 -1.26 -0.79 120.40 127.75 2aaz s VAL 36 Ca 0.21 1.23 0.01 0.00 0.00 0.00 0.00 61.98 63.43 2aaz s VAL 36 Cb -0.14 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 2aaz s VAL 36 CO 0.07 -0.06 -0.05 -0.13 0.00 0.00 0.00 175.10 174.94 2aaz s ARG 37 N 3.02 0.58 0.68 2.72 0.52 0.40 -4.99 118.95 121.88 2aaz s ARG 37 Ca 0.62 -1.00 -0.10 0.00 -0.52 0.00 0.00 55.73 54.72 2aaz s ARG 37 Cb -0.28 -0.03 0.01 0.00 0.52 0.00 0.00 34.95 35.17 2aaz s ARG 37 CO 0.23 -0.04 1.06 -2.14 0.02 0.00 0.00 175.30 174.43 2aaz s PRO 38 N -2.79 2.88 0.28 3.54 0.02 -1.26 -1.43 135.00 136.24 2aaz s PRO 38 Ca -0.01 0.38 -0.15 0.00 0.02 0.00 0.00 61.00 61.24 2aaz s PRO 38 Cb -0.01 -2.07 0.01 0.00 0.02 0.00 0.00 34.50 32.45 2aaz s PRO 38 CO -0.04 -0.97 0.59 0.16 -0.33 0.00 0.00 177.00 176.41 2aaz s ASP 39 N -4.35 -0.06 0.25 2.53 -4.77 -1.26 -4.79 116.67 104.22 2aaz s ASP 39 Ca 0.57 -0.89 -0.03 0.00 -3.30 0.00 0.00 52.55 48.90 2aaz s ASP 39 Cb -0.11 0.66 0.49 0.00 -1.09 0.00 0.00 42.92 42.88 2aaz s ASP 39 CO 0.51 -1.27 1.73 -0.09 0.70 0.00 0.00 175.17 176.74 2aaz h ARG 40 N 2.14 0.44 0.00 2.11 2.43 -2.01 -2.44 114.38 117.04 2aaz h ARG 40 Ca -0.25 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 58.84 2aaz h ARG 40 Cb 1.25 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 2aaz h ARG 40 CO 0.32 0.29 -0.30 1.79 -1.51 0.00 0.00 179.97 180.57 2aaz h THR 41 N 0.45 0.94 0.00 0.20 1.35 -1.92 -3.47 112.91 110.46 2aaz h THR 41 Ca 0.44 -1.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 2aaz h THR 41 Cb 0.68 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 2aaz h THR 41 CO -0.42 0.29 0.00 0.61 -0.25 0.00 0.00 175.52 175.76 2aaz n GLY 42 N -0.30 0.90 0.10 5.82 0.00 -0.92 -4.90 105.19 105.88 2aaz n GLY 42 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 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 0.96 0.00 2.61 1.35 -1.91 -3.48 112.91 112.44 2aaz h THR 43 Ca 0.00 -2.54 0.00 0.00 -0.55 0.00 0.00 66.41 63.32 2aaz h THR 43 Cb 0.00 2.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 2aaz h THR 43 CO 0.00 0.55 0.00 0.61 -0.25 0.00 0.00 175.52 176.43 2aaz n GLY 44 N 1.37 -0.11 3.43 5.82 0.00 -1.26 -4.55 105.19 109.89 2aaz n GLY 44 Ca -0.06 -1.60 -0.13 0.00 0.00 0.00 0.00 46.02 44.24 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 -2.97 0.00 -0.08 2.61 -4.23 -0.52 -1.55 115.64 108.91 2aaz s THR 45 Ca 0.00 -1.67 0.04 0.00 -1.18 0.00 0.00 61.69 58.88 2aaz s THR 45 Cb 0.00 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.36 2aaz s THR 45 CO 0.00 0.00 -0.21 0.54 -0.54 0.00 0.00 174.62 174.41 2aaz s VAL 46 N -3.60 1.82 0.12 2.29 0.11 -0.56 -0.45 120.40 120.13 2aaz s VAL 46 Ca 0.31 -0.89 -0.06 0.00 -2.93 0.00 0.00 61.98 58.41 2aaz s VAL 46 Cb 0.01 -1.58 -0.02 0.00 -1.53 0.00 0.00 36.38 33.27 2aaz s VAL 46 CO 0.16 0.51 0.16 0.00 -3.33 0.00 0.00 175.10 172.60 2aaz s ALA 47 N 0.33 0.19 0.01 1.54 0.00 0.03 -1.26 121.76 122.60 2aaz s ALA 47 Ca -0.15 -0.98 0.02 0.00 0.00 0.00 0.00 51.96 50.85 2aaz s ALA 47 Cb -0.17 0.67 -0.01 0.00 0.00 0.00 0.00 23.12 23.61 2aaz s ALA 47 CO 0.07 -0.53 -0.06 -0.51 0.00 0.00 0.00 175.76 174.72 2aaz s LEU 48 N -2.95 2.09 -0.14 0.00 1.43 -0.37 -0.89 118.68 117.85 2aaz s LEU 48 Ca 0.14 -0.24 -0.07 0.00 -1.03 0.00 0.00 54.13 52.92 2aaz s LEU 48 Cb 0.05 -0.24 -0.04 0.00 0.03 0.00 0.00 46.19 45.99 2aaz s LEU 48 CO -0.04 -0.02 0.10 0.12 0.23 0.00 0.00 176.35 176.73 2aaz s PHE 49 N -0.53 3.42 -1.27 0.29 5.36 -1.26 -1.64 117.98 122.34 2aaz s PHE 49 Ca -0.02 0.35 -0.09 0.00 -0.96 0.00 0.00 56.93 56.21 2aaz s PHE 49 Cb -0.05 -1.98 -0.00 0.00 -0.34 0.00 0.00 43.02 40.65 2aaz s PHE 49 CO 0.00 0.49 0.63 0.00 -1.46 0.00 0.00 175.22 174.88 2aaz n ALA 50 N 2.60 -2.24 -1.47 11.12 0.00 -0.27 -4.97 120.51 125.28 2aaz n ALA 50 Ca -0.18 -0.24 -0.29 0.00 0.00 0.00 0.00 53.44 52.73 2aaz n ALA 50 Cb 0.54 -2.69 0.13 0.00 0.00 0.00 0.00 19.45 17.43 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 -6.19 1.35 0.39 0.00 0.04 -1.26 -4.93 135.00 124.40 2aaz s PRO 51 Ca 0.20 0.47 -0.25 0.00 0.04 0.00 0.00 61.00 61.46 2aaz s PRO 51 Cb -0.07 -1.85 -0.12 0.00 0.04 0.00 0.00 34.50 32.50 2aaz s PRO 51 CO 0.86 -2.09 0.95 -2.30 0.04 0.00 0.00 177.00 174.46 2aaz n PRO 52 N -3.72 1.24 -1.37 0.56 -0.02 -1.26 -4.60 135.00 125.83 2aaz n PRO 52 Ca 0.07 0.44 -0.31 0.00 -2.02 0.00 0.00 63.50 61.68 2aaz n PRO 52 Cb 0.58 -1.92 0.08 0.00 -0.02 0.00 0.00 33.50 32.22 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 -0.72 4.76 0.05 2.55 1.04 -1.26 -4.88 113.70 115.24 2aaz s SER 53 Ca 0.62 1.78 -0.06 0.00 0.48 0.00 0.00 55.95 58.78 2aaz s SER 53 Cb -0.60 -2.52 -0.05 0.00 0.10 0.00 0.00 66.02 62.95 2aaz s SER 53 CO 0.58 -1.86 0.30 -0.36 0.98 0.00 0.00 173.24 172.87 2aaz s PHE 54 N -2.90 3.55 -0.06 5.02 0.08 -0.09 -4.92 117.98 118.67 2aaz s PHE 54 Ca 0.61 0.55 0.02 0.00 0.12 0.00 0.00 56.93 58.23 2aaz s PHE 54 Cb -0.17 -1.98 0.02 0.00 -0.57 0.00 0.00 43.02 40.32 2aaz s PHE 54 CO 0.55 0.56 -0.09 1.03 -0.10 0.00 0.00 175.22 177.17 2aaz s ARG 55 N -2.06 1.35 -0.06 0.44 0.52 -1.26 -0.72 118.95 117.17 2aaz s ARG 55 Ca 0.32 -0.29 0.02 0.00 -0.52 0.00 0.00 55.73 55.26 2aaz s ARG 55 Cb -0.13 -1.17 0.01 0.00 0.52 0.00 0.00 34.95 34.18 2aaz s ARG 55 CO 0.20 -0.01 -0.10 -0.06 0.02 0.00 0.00 175.30 175.34 2aaz s PHE 56 N 0.75 1.27 0.15 -0.53 0.08 0.21 -4.97 117.98 114.93 2aaz s PHE 56 Ca -0.13 -0.44 -0.30 0.00 0.12 0.00 0.00 56.93 56.18 2aaz s PHE 56 Cb -0.15 -0.95 -0.07 0.00 -0.57 0.00 0.00 43.02 41.28 2aaz s PHE 56 CO 0.02 -0.24 1.03 0.45 -0.10 0.00 0.00 175.22 176.38 2aaz s SER 57 N 0.67 7.39 -0.01 1.36 0.15 -1.26 -0.94 113.70 121.07 2aaz s SER 57 Ca -0.13 1.94 0.09 0.00 0.70 0.00 0.00 55.95 58.55 2aaz s SER 57 Cb -0.15 -2.60 0.26 0.00 -1.71 0.00 0.00 66.02 61.82 2aaz s SER 57 CO 0.03 -0.13 1.22 0.18 1.20 0.00 0.00 173.24 175.73 2aaz n LEU 58 N 2.53 2.80 -4.78 3.45 4.77 0.63 -4.76 117.00 121.64 2aaz n LEU 58 Ca 0.02 -2.04 -0.32 0.00 -0.03 0.00 0.00 56.01 53.65 2aaz n LEU 58 Cb 0.48 -0.20 0.06 0.00 -2.33 0.00 0.00 43.42 41.43 2aaz n LEU 58 CO 0.52 0.69 0.71 0.00 -1.33 0.00 0.00 177.39 177.99 2aaz s ALA 59 N -1.07 2.44 -1.43 -1.18 0.00 -1.22 -3.58 121.76 115.73 2aaz s ALA 59 Ca 0.20 0.32 -0.10 0.00 0.00 0.00 0.00 51.96 52.39 2aaz s ALA 59 Cb 0.11 -3.26 0.03 0.00 0.00 0.00 0.00 23.12 19.99 2aaz s ALA 59 CO 0.13 -1.43 1.05 -0.25 0.00 0.00 0.00 175.76 175.25 2aaz n ASP 60 N -2.99 -5.92 -2.02 0.00 8.00 -1.26 -2.05 116.55 110.30 2aaz n ASP 60 Ca 0.09 -0.56 -0.18 0.00 0.71 0.00 0.00 54.79 54.85 2aaz n ASP 60 Cb 0.53 -4.69 -0.04 0.00 -0.02 0.00 0.00 41.12 36.90 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 -2.89 -5.04 -4.74 -2.24 4.13 -1.25 -4.88 115.26 98.35 2aaz n ASN 61 Ca 0.00 0.23 -0.41 0.00 1.68 0.00 0.00 54.58 56.08 2aaz n ASN 61 Cb 0.56 -4.34 -0.04 0.00 -1.54 0.00 0.00 39.78 34.42 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 -2.74 3.74 -0.24 3.41 2.01 -0.87 -0.07 115.64 120.87 2aaz s THR 62 Ca 0.00 1.49 0.02 0.00 0.31 0.00 0.00 61.69 63.51 2aaz s THR 62 Cb 0.00 -3.95 0.05 0.00 0.01 0.00 0.00 72.50 68.60 2aaz s THR 62 CO 0.00 0.26 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.84 2aaz s LEU 63 N -0.37 3.10 -0.96 4.42 2.96 -0.47 -4.58 118.68 122.77 2aaz s LEU 63 Ca 0.50 -1.15 -0.16 0.00 -0.22 0.00 0.00 54.13 53.10 2aaz s LEU 63 Cb -0.31 -1.55 -0.10 0.00 0.50 0.00 0.00 46.19 44.74 2aaz s LEU 63 CO 0.36 -0.14 2.07 -0.81 -1.32 0.00 0.00 176.35 176.51 2aaz n PRO 64 N 4.51 1.97 -3.28 0.98 -0.04 -1.26 -3.73 135.00 134.15 2aaz n PRO 64 Ca -0.16 -1.88 -0.42 0.00 -0.04 0.00 0.00 63.50 61.00 2aaz n PRO 64 Cb 0.45 -2.85 -0.08 0.00 -0.04 0.00 0.00 33.50 30.97 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 1.01 4.56 0.30 1.53 2.96 -1.26 -4.30 118.68 123.48 2aaz s LEU 65 Ca 0.52 -0.32 -0.27 0.00 -0.22 0.00 0.00 54.13 53.83 2aaz s LEU 65 Cb 0.13 -2.49 -0.14 0.00 0.50 0.00 0.00 46.19 44.19 2aaz s LEU 65 CO 0.04 -0.53 0.93 0.18 -1.32 0.00 0.00 176.35 175.65 2aaz n LEU 66 N 5.70 1.47 -0.00 -0.68 4.77 -1.26 -4.73 117.00 122.27 2aaz n LEU 66 Ca -0.06 1.15 0.05 0.00 -0.03 0.00 0.00 56.01 57.11 2aaz n LEU 66 Cb 0.48 -1.25 -0.06 0.00 -2.33 0.00 0.00 43.42 40.26 2aaz n LEU 66 CO 0.46 -1.65 -0.08 0.35 -1.33 0.00 0.00 177.39 175.14 2aaz n THR 67 N 0.07 0.00 1.49 -5.08 -2.24 -1.26 -4.50 114.28 102.76 2aaz n THR 67 Ca 0.10 -0.27 0.12 0.00 -2.27 0.00 0.00 64.05 61.74 2aaz n THR 67 Cb 0.32 0.93 0.71 0.00 -2.10 0.00 0.00 70.33 70.19 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 -1.29 0.01 -3.49 4.28 -2.24 -1.26 -0.84 114.28 109.44 2aaz n THR 68 Ca 0.01 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.65 2aaz n THR 68 Cb 0.16 -0.63 -0.04 0.00 -2.10 0.00 0.00 70.33 67.72 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 -2.01 1.08 -0.08 -0.78 -2.85 -1.26 -4.64 119.74 109.19 2aaz s LYS 69 Ca 0.36 -0.03 -0.30 0.00 -1.00 0.00 0.00 55.97 55.00 2aaz s LYS 69 Cb 0.16 0.50 -0.03 0.00 -2.06 0.00 0.00 37.83 36.41 2aaz s LYS 69 CO 0.28 -0.40 1.25 0.50 0.10 0.00 0.00 175.35 177.08 2aaz s ARG 70 N -2.15 4.31 -0.15 1.78 3.52 -1.08 -4.58 118.95 120.59 2aaz s ARG 70 Ca -0.05 1.71 -0.07 0.00 -0.13 0.00 0.00 55.73 57.19 2aaz s ARG 70 Cb -0.00 -3.63 -0.04 0.00 -1.56 0.00 0.00 34.95 29.72 2aaz s ARG 70 CO 0.01 -0.55 0.08 0.08 -0.81 0.00 0.00 175.30 174.10 2aaz s VAL 71 N 2.65 4.93 -1.07 7.11 1.01 -1.26 -4.75 120.40 129.02 2aaz s VAL 71 Ca 0.57 0.01 -0.23 0.00 0.00 0.00 0.00 61.98 62.32 2aaz s VAL 71 Cb -0.25 -3.18 -0.12 0.00 0.00 0.00 0.00 36.38 32.83 2aaz s VAL 71 CO 0.20 0.52 1.93 0.33 0.00 0.00 0.00 175.10 178.09 2aaz n PHE 72 N 2.90 2.39 -0.13 5.22 -0.00 -1.26 -4.78 117.46 121.79 2aaz n PHE 72 Ca -0.18 -1.44 -0.04 0.00 -0.00 0.00 0.00 57.45 55.80 2aaz n PHE 72 Cb 0.53 -2.39 0.03 0.00 -0.00 0.00 0.00 39.48 37.65 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 17.24 -0.34 -1.48 -2.13 5.85 -2.00 -1.13 115.31 131.32 2aaz h LEU 73 Ca 0.25 0.12 0.07 0.00 0.84 0.00 0.00 57.88 59.16 2aaz h LEU 73 Cb 0.88 0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 2aaz h LEU 73 CO 1.38 -0.12 0.43 -0.09 -0.34 0.00 0.00 178.44 179.71 2aaz h ARG 74 N 0.03 0.61 -0.45 1.25 2.43 -2.00 -0.84 114.38 115.41 2aaz h ARG 74 Ca 0.21 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.23 2aaz h ARG 74 Cb 0.32 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 2aaz h ARG 74 CO -0.43 0.40 -0.17 0.78 -1.51 0.00 0.00 179.97 179.05 2aaz h GLY 75 N 0.63 0.95 0.80 2.80 0.00 -1.62 0.24 103.07 106.86 2aaz h GLY 75 Ca 0.29 -0.79 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 2aaz h GLY 75 CO -0.09 0.72 -0.06 -2.08 0.00 0.00 0.00 176.54 175.03 2aaz h VAL 76 N 0.77 0.98 -0.26 4.60 2.07 -0.62 -1.25 116.25 122.55 2aaz h VAL 76 Ca 0.11 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.20 2aaz h VAL 76 Cb 0.70 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 2aaz h VAL 76 CO 0.05 0.11 0.15 0.40 0.02 0.00 0.00 177.57 178.30 2aaz h ILE 77 N -0.38 1.03 -0.41 4.57 2.04 -1.16 -1.18 117.51 122.04 2aaz h ILE 77 Ca -0.02 -0.11 0.03 0.00 1.00 0.00 0.00 64.86 65.77 2aaz h ILE 77 Cb 0.30 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2aaz h ILE 77 CO 0.03 0.06 0.20 0.00 0.00 0.00 0.00 178.15 178.44 2aaz h ALA 78 N 1.11 0.51 -0.86 1.87 0.00 -0.91 -0.97 119.26 120.00 2aaz h ALA 78 Ca 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2aaz h ALA 78 Cb -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2aaz h ALA 78 CO -0.04 -0.16 0.51 1.49 0.00 0.00 0.00 179.25 181.05 2aaz h GLU 79 N 0.41 1.18 -0.29 0.00 4.81 -1.00 -1.55 114.58 118.14 2aaz h GLU 79 Ca 0.17 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 2aaz h GLU 79 Cb 0.08 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 2aaz h GLU 79 CO -0.12 0.83 0.09 1.25 -0.73 0.00 0.00 179.01 180.33 2aaz h LEU 80 N 1.19 0.42 -1.47 1.64 5.85 -0.70 -0.10 115.31 122.14 2aaz h LEU 80 Ca 0.31 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 2aaz h LEU 80 Cb -0.04 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 2aaz h LEU 80 CO -0.06 0.52 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.24 2aaz h LEU 81 N 0.31 0.00 -0.18 2.25 3.38 -1.06 -0.95 115.31 119.05 2aaz h LEU 81 Ca 0.09 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 2aaz h LEU 81 Cb 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 2aaz h LEU 81 CO -0.00 0.25 -0.13 -0.25 0.09 0.00 0.00 178.44 178.40 2aaz h TRP 82 N 0.00 0.48 0.32 1.13 7.01 -0.80 -1.39 115.95 122.70 2aaz h TRP 82 Ca -0.00 -0.13 -0.01 0.00 2.11 0.00 0.00 58.89 60.85 2aaz h TRP 82 Cb 0.55 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.50 2aaz h TRP 82 CO 0.00 0.75 -0.21 0.74 -2.79 0.00 0.00 178.44 176.93 2aaz h PHE 83 N 0.08 -0.54 -0.89 2.65 0.04 -0.26 -2.68 116.94 115.34 2aaz h PHE 83 Ca 0.03 -0.00 0.15 0.00 2.80 0.00 0.00 57.97 60.95 2aaz h PHE 83 Cb 0.65 0.20 -0.10 0.00 2.20 0.00 0.00 35.95 38.90 2aaz h PHE 83 CO 0.07 -0.32 0.48 0.28 -0.60 0.00 0.00 178.31 178.22 2aaz h VAL 84 N -0.51 0.73 0.00 -0.55 2.07 -1.18 0.97 116.25 117.77 2aaz h VAL 84 Ca -0.03 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.26 2aaz h VAL 84 Cb 0.43 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 2aaz h VAL 84 CO 0.02 0.12 0.00 -1.54 0.02 0.00 0.00 177.57 176.19 2aaz n SER 85 N -4.84 0.65 0.00 0.57 3.41 -0.53 -4.85 113.62 108.03 2aaz n SER 85 Ca 0.18 0.71 0.00 0.00 -0.26 0.00 0.00 58.87 59.50 2aaz n SER 85 Cb 0.46 -0.83 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 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 -0.50 0.83 3.77 5.00 0.00 0.34 -5.02 105.19 109.61 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 0.01 1.01 -3.35 0.00 -2.24 -1.26 -4.54 114.28 103.90 2aaz n THR 88 Ca 0.05 -1.14 -0.43 0.00 -2.27 0.00 0.00 64.05 60.25 2aaz n THR 88 Cb 0.48 0.32 -0.09 0.00 -2.10 0.00 0.00 70.33 68.93 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 -1.51 6.18 0.65 3.42 3.68 -1.26 -2.65 116.67 125.18 2aaz s ASP 89 Ca 0.11 -0.72 0.42 0.00 2.13 0.00 0.00 52.55 54.49 2aaz s ASP 89 Cb 0.10 -2.21 2.29 0.00 -1.45 0.00 0.00 42.92 41.64 2aaz s ASP 89 CO 0.01 -0.55 2.33 0.00 0.13 0.00 0.00 175.17 177.09 2aaz h ALA 90 N 8.71 1.07 0.00 3.66 0.00 -1.37 -1.50 119.26 129.82 2aaz h ALA 90 Ca -0.27 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2aaz h ALA 90 Cb 1.11 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2aaz h ALA 90 CO 0.78 0.00 -0.08 0.87 0.00 0.00 0.00 179.25 180.83 2aaz h LYS 91 N 0.00 0.00 0.00 0.00 1.79 -1.89 0.09 116.57 116.56 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 0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 2aaz h LYS 91 CO 0.00 0.08 0.00 0.52 -1.08 0.00 0.00 179.45 178.97 2aaz h MET 92 N 0.00 0.00 0.01 3.15 2.86 -1.67 -0.26 114.93 119.03 2aaz h MET 92 Ca -0.00 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 57.27 2aaz h MET 92 Cb 0.26 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.87 2aaz h MET 92 CO 0.01 0.00 -2.09 1.28 1.06 0.00 0.00 176.91 177.17 2aaz n LEU 93 N -2.65 2.16 0.23 1.22 4.77 -0.06 -4.23 117.00 118.44 2aaz n LEU 93 Ca 0.01 0.28 0.07 0.00 -0.03 0.00 0.00 56.01 56.34 2aaz n LEU 93 Cb 0.27 -0.91 0.56 0.00 -2.33 0.00 0.00 43.42 41.00 2aaz n LEU 93 CO 0.23 0.57 0.93 0.77 -1.33 0.00 0.00 177.39 178.56 2aaz h SER 94 N -0.73 0.00 0.70 -1.43 4.64 -0.45 -0.22 113.55 116.06 2aaz h SER 94 Ca -0.55 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.75 2aaz h SER 94 Cb 1.61 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.70 2aaz h SER 94 CO -0.25 0.16 -0.13 0.77 -0.87 0.00 0.00 176.83 176.51 2aaz h SER 95 N 0.00 0.00 -0.49 4.97 4.64 -1.24 -2.10 113.55 119.32 2aaz h SER 95 Ca -0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2aaz h SER 95 Cb 0.30 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.34 2aaz h SER 95 CO 0.02 0.13 0.08 0.00 -0.87 0.00 0.00 176.83 176.19 2aaz n GLN 96 N -3.38 3.47 -1.21 4.77 10.64 -0.56 -4.94 117.38 126.17 2aaz n GLN 96 Ca -0.01 -3.03 -0.02 0.00 -1.83 0.00 0.00 57.00 52.12 2aaz n GLN 96 Cb 0.32 -2.05 -0.01 0.00 -0.86 0.00 0.00 30.24 27.64 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 -0.24 0.47 3.08 2.61 0.00 -0.79 -5.03 105.19 105.29 2aaz n GLY 97 Ca 0.31 -0.99 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.06 2.25 -0.20 1.61 1.01 -0.20 -4.98 120.40 117.83 2aaz s VAL 98 Ca 0.00 -1.57 0.16 0.00 0.00 0.00 0.00 61.98 60.57 2aaz s VAL 98 Cb 0.00 -2.30 0.57 0.00 0.00 0.00 0.00 36.38 34.65 2aaz s VAL 98 CO 0.00 0.00 1.48 0.61 0.00 0.00 0.00 175.10 177.19 2aaz n GLY 99 N 4.46 4.01 0.31 4.51 0.00 -1.26 -1.53 105.19 115.69 2aaz n GLY 99 Ca -0.14 -1.05 0.15 0.00 0.00 0.00 0.00 46.02 44.97 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 1.97 0.66 -0.42 -0.61 3.07 -1.95 -1.08 117.51 119.14 2aaz h ILE 100 Ca 0.03 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.44 2aaz h ILE 100 Cb 1.56 0.91 0.00 0.00 -0.27 0.00 0.00 36.82 39.02 2aaz h ILE 100 CO 0.29 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 178.18 2aaz n TRP 101 N -4.08 0.54 -0.10 0.16 7.02 -1.26 -4.46 117.44 115.26 2aaz n TRP 101 Ca 0.00 -0.33 -0.03 0.00 -1.02 0.00 0.00 57.50 56.12 2aaz n TRP 101 Cb 0.24 -0.01 0.19 0.00 -2.42 0.00 0.00 31.31 29.31 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 3.74 0.72 -0.53 -0.99 3.45 -1.52 -1.73 116.42 119.56 2aaz h ASP 102 Ca 0.00 -0.16 -0.03 0.00 0.43 0.00 0.00 57.03 57.27 2aaz h ASP 102 Cb 0.89 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 39.44 2aaz h ASP 102 CO 0.00 0.77 0.20 1.23 -1.57 0.00 0.00 179.24 179.87 2aaz h GLY 103 N 0.95 0.86 0.54 2.75 0.00 -1.78 -1.55 103.07 104.85 2aaz h GLY 103 Ca 0.15 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2aaz h GLY 103 CO 0.01 0.45 -0.32 0.70 0.00 0.00 0.00 176.54 177.38 2aaz n ASN 104 N -4.51 0.81 -0.62 0.19 4.13 -1.19 -3.74 115.26 110.33 2aaz n ASN 104 Ca 0.02 -0.65 0.10 0.00 1.68 0.00 0.00 54.58 55.73 2aaz n ASN 104 Cb 0.17 0.15 0.04 0.00 -1.54 0.00 0.00 39.78 38.60 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 1.39 0.30 3.75 7.41 0.00 -0.66 -4.53 105.19 112.85 2aaz n GLY 105 Ca 0.10 -0.56 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.88 5.27 0.27 1.61 1.04 -0.60 0.16 113.70 119.57 2aaz s SER 106 Ca 0.20 2.41 -0.01 0.00 0.48 0.00 0.00 55.95 59.03 2aaz s SER 106 Cb 0.16 -2.60 0.47 0.00 0.10 0.00 0.00 66.02 64.15 2aaz s SER 106 CO 0.35 -1.54 1.84 0.50 0.98 0.00 0.00 173.24 175.38 2aaz h LYS 107 N 1.02 0.96 -0.57 4.02 1.63 -1.93 -1.08 116.57 120.62 2aaz h LYS 107 Ca -0.50 -0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 59.22 2aaz h LYS 107 Cb 1.29 -0.22 -0.03 0.00 -0.60 0.00 0.00 32.23 32.68 2aaz h LYS 107 CO 0.56 0.64 0.30 0.93 -3.45 0.00 0.00 179.45 178.42 2aaz h GLU 108 N 0.99 0.81 -0.15 1.90 5.08 -1.95 -2.19 114.58 119.07 2aaz h GLU 108 Ca 0.45 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.61 2aaz h GLU 108 Cb 0.37 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2aaz h GLU 108 CO -0.24 0.64 -0.29 0.35 -1.00 0.00 0.00 179.01 178.48 2aaz h PHE 109 N 0.77 0.57 -0.40 4.33 3.57 -1.65 -2.43 116.94 121.71 2aaz h PHE 109 Ca 0.20 -0.21 0.06 0.00 3.53 0.00 0.00 57.97 61.55 2aaz h PHE 109 Cb 0.08 -0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.66 2aaz h PHE 109 CO -0.01 0.91 0.10 -0.07 -2.23 0.00 0.00 178.31 177.01 2aaz h LEU 110 N 0.07 0.05 -1.39 0.59 3.38 -1.18 -0.26 115.31 116.57 2aaz h LEU 110 Ca 0.01 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2aaz h LEU 110 Cb 0.88 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 2aaz h LEU 110 CO 0.06 0.06 -0.08 -0.33 0.09 0.00 0.00 178.44 178.25 2aaz h GLU 111 N 0.23 0.31 -0.67 1.13 5.08 -1.44 0.37 114.58 119.60 2aaz h GLU 111 Ca 0.19 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2aaz h GLU 111 Cb 0.21 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 2aaz h GLU 111 CO -0.23 0.41 0.24 -0.22 -1.00 0.00 0.00 179.01 178.20 2aaz h LYS 112 N 0.30 1.00 -0.66 2.33 3.64 -0.57 -2.84 116.57 119.77 2aaz h LYS 112 Ca 0.06 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2aaz h LYS 112 Cb 0.33 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2aaz h LYS 112 CO 0.02 0.83 0.00 1.33 -2.27 0.00 0.00 179.45 179.36 2aaz n VAL 113 N -4.29 2.26 -1.26 2.00 0.24 -0.52 -4.91 118.33 111.86 2aaz n VAL 113 Ca 0.06 -1.14 -0.02 0.00 -2.04 0.00 0.00 64.34 61.19 2aaz n VAL 113 Cb 0.19 -0.31 -0.01 0.00 -1.47 0.00 0.00 33.84 32.25 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 0.53 0.48 2.20 7.63 0.00 -1.07 -4.95 105.19 110.00 2aaz n GLY 114 Ca 0.23 -0.96 -0.26 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.23 5.14 0.17 0.99 4.77 0.13 -4.79 117.00 123.18 2aaz n LEU 115 Ca -0.02 -4.85 0.13 0.00 -0.03 0.00 0.00 56.01 51.24 2aaz n LEU 115 Cb 0.16 -0.44 0.55 0.00 -2.33 0.00 0.00 43.42 41.36 2aaz n LEU 115 CO 0.03 2.09 0.89 1.23 -1.33 0.00 0.00 177.39 180.30 2aaz h GLY 116 N 2.30 0.00 1.01 -0.72 0.00 -1.81 -2.80 103.07 101.05 2aaz h GLY 116 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 2aaz h GLY 116 CO 0.86 0.00 -0.00 -2.39 0.00 0.00 0.00 176.54 175.01 2aaz n HIS 117 N -2.43 0.00 -3.95 5.60 1.44 -1.26 -4.81 115.22 109.80 2aaz n HIS 117 Ca 0.01 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.42 2aaz n HIS 117 Cb 0.23 -0.03 -0.04 0.00 0.12 0.00 0.00 29.99 30.27 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 -2.06 3.33 0.57 -1.40 0.52 -1.06 -5.09 118.95 113.77 2aaz s ARG 118 Ca 0.46 -0.52 -0.15 0.00 -0.52 0.00 0.00 55.73 55.00 2aaz s ARG 118 Cb 0.22 -2.97 -0.05 0.00 0.52 0.00 0.00 34.95 32.67 2aaz s ARG 118 CO 0.38 0.59 1.02 -0.98 0.02 0.00 0.00 175.30 176.33 2aaz s ARG 119 N -2.61 3.60 0.22 3.54 1.70 -1.26 -4.95 118.95 119.19 2aaz s ARG 119 Ca 0.34 1.04 -0.32 0.00 -0.47 0.00 0.00 55.73 56.32 2aaz s ARG 119 Cb -0.12 -2.08 -0.14 0.00 -0.57 0.00 0.00 34.95 32.04 2aaz s ARG 119 CO 0.27 -0.57 1.36 -1.91 -1.08 0.00 0.00 175.30 173.37 2aaz n GLU 120 N -1.97 1.87 0.00 3.89 2.13 -1.26 -1.77 120.64 123.53 2aaz n GLU 120 Ca 0.07 0.67 0.00 0.00 0.66 0.00 0.00 57.16 58.56 2aaz n GLU 120 Cb 0.53 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 29.95 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 2.15 2.62 3.53 8.31 0.00 0.12 -4.86 105.19 117.07 2aaz n GLY 121 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.42 6.50 0.51 1.61 -1.08 -0.73 -0.88 116.67 121.19 2aaz s ASP 122 Ca 0.00 -1.52 0.33 0.00 -0.52 0.00 0.00 52.55 50.83 2aaz s ASP 122 Cb 0.00 -2.53 1.38 0.00 -1.46 0.00 0.00 42.92 40.32 2aaz s ASP 122 CO 0.00 -1.42 1.96 -0.07 0.52 0.00 0.00 175.17 176.16 2aaz h LEU 123 N 12.23 0.00 0.00 -1.34 3.38 -1.83 -3.46 115.31 124.28 2aaz h LEU 123 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2aaz h LEU 123 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2aaz h LEU 123 CO 1.34 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.48 2aaz n GLY 124 N -0.07 -1.41 2.52 0.83 0.00 -1.26 -1.13 105.19 104.66 2aaz n GLY 124 Ca 0.01 -2.09 -0.31 0.00 0.00 0.00 0.00 46.02 43.62 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 2.76 -0.73 1.61 -0.04 -1.26 -4.79 135.00 132.55 2aaz n PRO 125 Ca 0.00 -1.83 -0.06 0.00 -0.04 0.00 0.00 63.50 61.57 2aaz n PRO 125 Cb 0.00 -2.65 0.03 0.00 -0.04 0.00 0.00 33.50 30.84 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 4.08 0.00 0.00 0.52 0.24 -1.26 -4.44 118.33 117.46 2aaz n VAL 126 Ca 0.59 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 62.62 2aaz n VAL 126 Cb 0.20 -1.58 0.00 0.00 -1.47 0.00 0.00 33.84 30.98 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 -2.04 0.00 -0.33 6.34 4.01 -1.26 -0.51 117.16 123.36 2aaz n TYR 127 Ca 0.04 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.92 2aaz n TYR 127 Cb 0.13 0.00 0.34 0.00 -0.31 0.00 0.00 39.34 39.49 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 1.74 0.92 2.72 0.00 -1.80 -0.71 103.07 105.94 2aaz h GLY 128 Ca 0.00 -0.27 -0.06 0.00 0.00 0.00 0.00 47.33 47.00 2aaz h GLY 128 CO 0.00 -0.21 0.00 -2.75 0.00 0.00 0.00 176.54 173.59 2aaz h PHE 129 N 0.56 0.69 -0.61 5.60 3.04 -0.83 -2.37 116.94 123.02 2aaz h PHE 129 Ca 0.59 -0.12 -0.07 0.00 3.98 0.00 0.00 57.97 62.36 2aaz h PHE 129 Cb 1.08 -0.18 -0.02 0.00 2.56 0.00 0.00 35.95 39.38 2aaz h PHE 129 CO -0.05 0.74 0.13 1.96 -2.02 0.00 0.00 178.31 179.06 2aaz h GLN 130 N 0.45 1.00 -0.77 1.11 1.08 -1.09 0.36 115.11 117.25 2aaz h GLN 130 Ca 0.10 -0.25 0.04 0.00 -1.45 0.00 0.00 58.65 57.09 2aaz h GLN 130 Cb 0.46 -0.12 -0.05 0.00 -0.05 0.00 0.00 27.48 27.71 2aaz h GLN 130 CO 0.02 0.92 0.48 -1.49 -0.95 0.00 0.00 178.83 177.81 2aaz h TRP 131 N 0.91 0.89 0.00 2.96 4.06 -1.03 -2.37 115.95 121.37 2aaz h TRP 131 Ca 0.19 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.16 2aaz h TRP 131 Cb 0.39 -0.29 0.00 0.00 -1.00 0.00 0.00 29.16 28.26 2aaz h TRP 131 CO 0.03 0.48 -1.05 0.54 -3.56 0.00 0.00 178.44 174.88 2aaz n ARG 132 N -4.65 1.53 -1.97 0.49 5.12 -0.91 -1.40 116.66 114.89 2aaz n ARG 132 Ca 0.10 -0.05 0.02 0.00 -1.93 0.00 0.00 57.85 55.99 2aaz n ARG 132 Cb 0.12 -1.26 0.03 0.00 -1.16 0.00 0.00 32.46 30.20 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 -1.59 0.40 -1.64 -1.55 8.25 0.13 -3.55 115.22 115.67 2aaz n HIS 133 Ca 0.01 -1.09 -0.50 0.00 -0.26 0.00 0.00 57.72 55.89 2aaz n HIS 133 Cb 0.29 -0.13 -0.05 0.00 1.12 0.00 0.00 29.99 31.22 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 0.07 1.94 0.00 4.41 -0.00 -0.89 -1.21 117.46 121.77 2aaz n PHE 134 Ca 0.05 0.42 0.00 0.00 -0.00 0.00 0.00 57.45 57.92 2aaz n PHE 134 Cb 1.01 -2.46 0.00 0.00 -0.00 0.00 0.00 39.48 38.04 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 3.16 3.38 3.75 7.13 0.00 -1.26 -0.49 105.19 120.86 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 2.23 -0.09 4.61 0.00 -0.35 -4.90 121.76 120.66 2aaz s ALA 136 Ca 0.00 0.51 -0.28 0.00 0.00 0.00 0.00 51.96 52.19 2aaz s ALA 136 Cb 0.00 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.76 2aaz s ALA 136 CO 0.00 -1.71 0.95 -2.00 0.00 0.00 0.00 175.76 173.00 2aaz s GLU 137 N -4.39 4.44 -0.15 0.00 2.12 -1.26 -5.02 118.70 114.44 2aaz s GLU 137 Ca 0.66 1.29 -0.15 0.00 0.36 0.00 0.00 54.97 57.14 2aaz s GLU 137 Cb -0.21 -3.52 -0.05 0.00 0.26 0.00 0.00 34.13 30.62 2aaz s GLU 137 CO 0.49 -0.22 0.35 -0.47 -0.54 0.00 0.00 175.26 174.87 2aaz s TYR 138 N 1.68 3.48 0.00 5.30 5.04 -1.26 -4.98 117.35 126.61 2aaz s TYR 138 Ca 0.47 0.69 0.00 0.00 -2.44 0.00 0.00 57.07 55.78 2aaz s TYR 138 Cb -0.19 -2.40 0.00 0.00 0.35 0.00 0.00 41.96 39.73 2aaz s TYR 138 CO 0.20 0.23 0.00 0.25 -1.34 0.00 0.00 175.55 174.88 2aaz n THR 139 N 3.56 0.00 -3.96 4.34 -2.24 -1.26 -5.08 114.28 109.64 2aaz n THR 139 Ca -0.11 0.16 -0.07 0.00 -2.27 0.00 0.00 64.05 61.76 2aaz n THR 139 Cb 0.52 -1.07 -0.02 0.00 -2.10 0.00 0.00 70.33 67.65 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 -1.86 -0.44 0.05 3.42 3.85 -1.26 -5.03 116.55 115.27 2aaz n ASP 140 Ca 0.00 -1.88 0.10 0.00 -0.71 0.00 0.00 54.79 52.30 2aaz n ASP 140 Cb 0.00 0.90 0.42 0.00 -1.35 0.00 0.00 41.12 41.09 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 -2.01 1.84 1.15 2.12 0.00 -1.26 -2.69 120.51 119.66 2aaz n ALA 141 Ca -0.05 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.49 2aaz n ALA 141 Cb 0.26 -1.34 0.22 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.78 1.50 -4.63 0.00 10.43 -1.26 -4.81 116.55 116.01 2aaz n ASP 142 Ca 0.04 -1.20 -0.36 0.00 2.57 0.00 0.00 54.79 55.84 2aaz n ASP 142 Cb 0.24 0.26 0.08 0.00 1.84 0.00 0.00 41.12 43.55 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 1.37 -0.32 3.46 0.44 0.00 -1.10 -4.94 105.19 104.09 2aaz n GLY 143 Ca 0.11 -0.31 -0.44 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.60 6.24 0.00 1.61 2.15 -1.26 -4.87 116.67 118.94 2aaz s ASP 144 Ca 0.74 -0.84 0.12 0.00 0.43 0.00 0.00 52.55 53.01 2aaz s ASP 144 Cb -0.35 -2.31 0.11 0.00 -0.30 0.00 0.00 42.92 40.07 2aaz s ASP 144 CO 0.49 -0.93 0.90 -1.22 -0.17 0.00 0.00 175.17 174.24 2aaz n TYR 145 N 6.32 0.02 -1.66 -5.34 4.01 -1.26 -4.96 117.16 114.29 2aaz n TYR 145 Ca -0.05 -0.02 -0.49 0.00 -0.16 0.00 0.00 57.90 57.17 2aaz n TYR 145 Cb 0.46 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.44 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 0.66 1.87 -0.95 -0.72 4.81 -1.26 -0.25 118.16 122.31 2aaz n LYS 146 Ca 0.07 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 2aaz n LYS 146 Cb 0.30 -2.44 0.00 0.00 0.02 0.00 0.00 35.03 32.92 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 3.62 0.55 3.65 3.14 0.00 -1.26 -5.01 105.19 109.87 2aaz n GLY 147 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.35 2.78 0.18 1.61 1.02 0.65 -5.02 119.74 120.61 2aaz s LYS 148 Ca 0.00 -0.58 0.00 0.00 0.02 0.00 0.00 55.97 55.41 2aaz s LYS 148 Cb 0.00 -2.65 0.00 0.00 -0.52 0.00 0.00 37.83 34.66 2aaz s LYS 148 CO 0.00 0.64 0.00 0.41 -0.92 0.00 0.00 175.35 175.48 2aaz n GLY 149 N 1.72 -2.21 3.66 -3.33 0.00 -1.26 -4.39 105.19 99.38 2aaz n GLY 149 Ca -0.16 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 43.97 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 -0.92 5.08 -1.10 1.61 1.01 0.35 -4.74 120.40 121.69 2aaz s VAL 150 Ca 0.00 1.00 -0.17 0.00 0.00 0.00 0.00 61.98 62.82 2aaz s VAL 150 Cb 0.00 -3.86 0.14 0.00 0.00 0.00 0.00 36.38 32.65 2aaz s VAL 150 CO 0.00 0.15 1.35 -0.62 0.00 0.00 0.00 175.10 175.98 2aaz s ASP 151 N 1.21 6.85 0.28 3.32 3.68 -1.23 -2.25 116.67 128.53 2aaz s ASP 151 Ca 0.25 -2.49 -0.04 0.00 2.13 0.00 0.00 52.55 52.40 2aaz s ASP 151 Cb -0.16 -2.43 0.36 0.00 -1.45 0.00 0.00 42.92 39.25 2aaz s ASP 151 CO 0.10 -0.95 1.95 1.56 0.13 0.00 0.00 175.17 177.95 2aaz h GLN 152 N 7.99 1.19 -0.02 4.34 4.20 -1.50 -2.49 115.11 128.82 2aaz h GLN 152 Ca 0.26 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.90 2aaz h GLN 152 Cb 0.94 -0.27 -0.00 0.00 0.30 0.00 0.00 27.48 28.45 2aaz h GLN 152 CO 1.23 0.79 0.01 1.25 -0.67 0.00 0.00 178.83 181.43 2aaz h LEU 153 N 1.22 0.03 -1.26 1.46 5.85 -1.83 -0.67 115.31 120.11 2aaz h LEU 153 Ca 0.33 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 2aaz h LEU 153 Cb -0.14 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 2aaz h LEU 153 CO -0.07 0.17 -0.07 -0.61 -0.34 0.00 0.00 178.44 177.52 2aaz h GLN 154 N -0.12 0.41 -0.48 1.25 5.75 -1.86 -2.03 115.11 118.03 2aaz h GLN 154 Ca 0.01 -0.10 -0.08 0.00 -0.15 0.00 0.00 58.65 58.33 2aaz h GLN 154 Cb 0.15 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 2aaz h GLN 154 CO -0.00 0.50 -0.02 -0.09 -2.65 0.00 0.00 178.83 176.57 2aaz h ARG 155 N 0.39 0.82 -0.42 1.69 9.65 -1.11 0.04 114.38 125.44 2aaz h ARG 155 Ca 0.08 -0.24 -0.01 0.00 -1.10 0.00 0.00 59.98 58.72 2aaz h ARG 155 Cb 0.38 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.85 2aaz h ARG 155 CO 0.02 0.84 0.23 0.28 2.80 0.00 0.00 179.97 184.14 2aaz h VAL 156 N 0.76 1.16 0.10 0.20 2.07 -0.51 -0.47 116.25 119.56 2aaz h VAL 156 Ca 0.14 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 2aaz h VAL 156 Cb 0.49 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2aaz h VAL 156 CO 0.02 0.17 -0.05 0.40 0.02 0.00 0.00 177.57 178.13 2aaz h ILE 157 N 0.55 0.91 -0.95 4.57 1.08 -0.85 -1.30 117.51 121.52 2aaz h ILE 157 Ca 0.15 -0.03 0.02 0.00 -0.39 0.00 0.00 64.86 64.61 2aaz h ILE 157 Cb 0.06 0.92 -0.05 0.00 -3.07 0.00 0.00 36.82 34.69 2aaz h ILE 157 CO -0.02 0.01 0.62 0.44 -0.69 0.00 0.00 178.15 178.51 2aaz h ASP 158 N -0.15 1.06 -0.34 1.72 3.45 -0.84 -2.36 116.42 118.96 2aaz h ASP 158 Ca -0.01 -0.02 -0.17 0.00 0.43 0.00 0.00 57.03 57.25 2aaz h ASP 158 Cb 0.12 -0.26 -0.00 0.00 -0.56 0.00 0.00 39.33 38.63 2aaz h ASP 158 CO 0.02 0.75 -0.46 0.74 -1.57 0.00 0.00 179.24 178.72 2aaz h THR 159 N 1.24 1.27 -0.72 0.35 2.02 -0.91 -0.55 112.91 115.61 2aaz h THR 159 Ca 0.36 -1.64 -0.04 0.00 0.77 0.00 0.00 66.41 65.86 2aaz h THR 159 Cb -0.08 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 2aaz h THR 159 CO -0.09 0.54 0.31 0.40 0.37 0.00 0.00 175.52 177.05 2aaz h ILE 160 N 0.72 1.24 0.05 3.11 2.04 -0.95 0.23 117.51 123.94 2aaz h ILE 160 Ca 0.04 -0.72 -0.28 0.00 1.00 0.00 0.00 64.86 64.90 2aaz h ILE 160 Cb 1.07 0.35 0.02 0.00 -0.74 0.00 0.00 36.82 37.53 2aaz h ILE 160 CO 0.11 0.30 -1.11 0.11 0.00 0.00 0.00 178.15 177.56 2aaz h LYS 161 N 1.04 0.67 0.00 2.37 1.57 -1.32 -3.31 116.57 117.58 2aaz h LYS 161 Ca 0.25 -0.78 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 2aaz h LYS 161 Cb 0.16 0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2aaz h LYS 161 CO -0.03 1.34 -1.32 0.09 -0.57 0.00 0.00 179.45 178.96 2aaz n ASN 162 N -3.85 1.04 -2.85 0.86 3.02 -0.23 -4.77 115.26 108.49 2aaz n ASN 162 Ca -0.12 -0.37 -0.11 0.00 -0.03 0.00 0.00 54.58 53.94 2aaz n ASN 162 Cb 0.92 1.43 0.05 0.00 -0.61 0.00 0.00 39.78 41.56 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 -1.77 -1.79 -0.21 6.41 5.15 0.75 -5.02 115.26 118.77 2aaz n ASN 163 Ca -0.00 -3.41 0.24 0.00 -0.60 0.00 0.00 54.58 50.80 2aaz n ASN 163 Cb 0.35 1.30 0.61 0.00 -0.53 0.00 0.00 39.78 41.51 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 3.35 0.20 -0.00 1.20 0.13 -1.49 -1.34 132.00 134.05 2aaz h PRO 164 Ca -0.07 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2aaz h PRO 164 Cb 1.04 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2aaz h PRO 164 CO 0.27 0.13 0.00 0.25 -0.23 0.00 0.00 178.00 178.42 2aaz n THR 165 N -4.41 0.00 -1.65 1.56 -2.24 -1.26 -4.24 114.28 102.05 2aaz n THR 165 Ca 0.19 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.56 2aaz n THR 165 Cb 0.82 -0.37 0.05 0.00 -2.10 0.00 0.00 70.33 68.73 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 -0.85 1.28 -1.02 3.42 -0.08 -0.51 -4.91 116.55 113.88 2aaz n ASP 166 Ca 0.23 0.87 0.08 0.00 -1.51 0.00 0.00 54.79 54.45 2aaz n ASP 166 Cb 0.13 -1.43 0.25 0.00 2.34 0.00 0.00 41.12 42.42 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 -0.92 3.18 -0.54 -0.67 1.74 -1.26 -4.51 116.66 113.67 2aaz n ARG 167 Ca 0.13 -2.58 0.06 0.00 -0.77 0.00 0.00 57.85 54.69 2aaz n ARG 167 Cb 0.46 -1.66 0.20 0.00 -1.02 0.00 0.00 32.46 30.44 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 0.34 1.56 -2.43 5.56 3.00 -1.26 -4.93 116.66 118.49 2aaz n ARG 168 Ca 0.19 -3.22 -0.42 0.00 -0.01 0.00 0.00 57.85 54.39 2aaz n ARG 168 Cb 0.73 -1.61 -0.00 0.00 0.00 0.00 0.00 32.46 31.58 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 -1.16 3.80 -4.91 0.55 5.41 -1.26 -4.91 119.36 116.88 2aaz n ILE 169 Ca 0.19 -3.87 -0.32 0.00 1.00 0.00 0.00 62.75 59.75 2aaz n ILE 169 Cb 0.69 -2.38 -0.14 0.00 -0.71 0.00 0.00 39.64 37.10 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 4.32 2.73 -0.20 1.39 -1.09 -1.26 -1.42 121.20 125.66 2aaz s ILE 170 Ca 0.54 -0.97 0.00 0.00 -2.23 0.00 0.00 60.65 57.98 2aaz s ILE 170 Cb 0.05 -2.07 0.05 0.00 -1.58 0.00 0.00 42.46 38.91 2aaz s ILE 170 CO 0.06 0.50 -0.06 -0.22 -1.23 0.00 0.00 174.94 174.00 2aaz s LEU 171 N -0.94 2.06 0.01 2.97 2.96 -0.50 -4.88 118.68 120.37 2aaz s LEU 171 Ca 0.12 -0.91 0.03 0.00 -0.22 0.00 0.00 54.13 53.16 2aaz s LEU 171 Cb -0.10 -1.05 -0.01 0.00 0.50 0.00 0.00 46.19 45.53 2aaz s LEU 171 CO 0.02 -0.20 -0.10 -0.55 -1.32 0.00 0.00 176.35 174.19 2aaz s SER 172 N 1.52 1.22 0.00 3.68 0.15 -1.26 -0.95 113.70 118.06 2aaz s SER 172 Ca -0.02 -0.29 0.12 0.00 0.70 0.00 0.00 55.95 56.46 2aaz s SER 172 Cb -0.17 -0.10 -0.02 0.00 -1.71 0.00 0.00 66.02 64.02 2aaz s SER 172 CO -0.07 0.06 0.68 0.00 1.20 0.00 0.00 173.24 175.11 2aaz n ALA 173 N 2.45 3.06 -2.29 5.45 0.00 -0.38 -4.35 120.51 124.45 2aaz n ALA 173 Ca -0.16 -0.45 -0.43 0.00 0.00 0.00 0.00 53.44 52.41 2aaz n ALA 173 Cb 0.56 -0.43 -0.02 0.00 0.00 0.00 0.00 19.45 19.55 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 -1.66 2.68 -0.32 0.00 -0.11 -1.17 -4.83 118.94 113.54 2aaz s TRP 174 Ca 0.09 0.80 -0.01 0.00 1.22 0.00 0.00 56.10 58.20 2aaz s TRP 174 Cb 0.10 -3.62 0.12 0.00 -1.50 0.00 0.00 33.47 28.57 2aaz s TRP 174 CO 0.34 -2.31 0.22 1.21 -4.62 0.00 0.00 176.95 171.78 2aaz s ASN 175 N 2.23 2.71 0.44 5.86 3.84 -1.26 -5.02 114.94 123.74 2aaz s ASN 175 Ca 0.61 -1.44 0.20 0.00 0.21 0.00 0.00 52.86 52.44 2aaz s ASN 175 Cb -0.27 -0.07 1.17 0.00 -0.55 0.00 0.00 41.25 41.53 2aaz s ASN 175 CO 0.21 -0.37 1.86 -0.65 -2.79 0.00 0.00 177.10 175.36 2aaz h PRO 176 N 7.86 0.31 -0.27 0.43 0.11 -2.01 -1.28 132.00 137.16 2aaz h PRO 176 Ca -0.09 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.82 2aaz h PRO 176 Cb 1.02 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.06 2aaz h PRO 176 CO 0.34 0.21 -0.56 -0.22 -0.21 0.00 0.00 178.00 177.56 2aaz h LYS 177 N 0.32 0.85 0.00 1.05 3.64 -2.02 -3.29 116.57 117.12 2aaz h LYS 177 Ca 0.46 -0.56 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2aaz h LYS 177 Cb 1.29 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 2aaz h LYS 177 CO -0.15 1.19 -0.26 -0.25 -2.27 0.00 0.00 179.45 177.71 2aaz n ASP 178 N -4.03 0.68 -0.32 4.20 8.00 -0.63 -4.47 116.55 119.98 2aaz n ASP 178 Ca -0.05 0.36 0.01 0.00 0.71 0.00 0.00 54.79 55.81 2aaz n ASP 178 Cb 0.63 -0.36 0.07 0.00 -0.02 0.00 0.00 41.12 41.45 2aaz n ASP 178 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2aaz h LEU 179 N 0.00 -1.11 -2.08 0.64 3.38 -1.34 0.14 115.31 114.94 2aaz h LEU 179 Ca 0.00 0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2aaz h LEU 179 Cb 0.71 0.63 0.00 0.00 0.09 0.00 0.00 40.66 42.09 2aaz h LEU 179 CO 0.00 -0.30 0.00 1.55 0.09 0.00 0.00 178.44 179.78 2aaz h PRO 180 N -0.03 0.00 -0.00 1.13 0.13 -1.83 -0.22 132.00 131.18 2aaz h PRO 180 Ca 0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.50 2aaz h PRO 180 Cb 0.62 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.75 2aaz h PRO 180 CO -0.91 0.00 -0.36 1.28 -0.23 0.00 0.00 178.00 177.78 2aaz n LEU 181 N -2.68 0.45 -4.77 1.56 4.77 0.47 -4.88 117.00 111.91 2aaz n LEU 181 Ca -0.02 0.07 -0.38 0.00 -0.03 0.00 0.00 56.01 55.65 2aaz n LEU 181 Cb 0.08 -0.28 -0.06 0.00 -2.33 0.00 0.00 43.42 40.83 2aaz n LEU 181 CO 0.16 0.11 0.22 -0.04 -1.33 0.00 0.00 177.39 176.51 2aaz s MET 182 N -2.92 4.23 0.50 3.23 -1.94 -0.10 -4.35 119.30 117.95 2aaz s MET 182 Ca 0.14 0.59 0.15 0.00 -1.71 0.00 0.00 55.69 54.86 2aaz s MET 182 Cb 0.18 -3.33 1.18 0.00 2.01 0.00 0.00 34.83 34.88 2aaz s MET 182 CO 0.64 0.41 2.11 0.00 -0.01 0.00 0.00 175.02 178.17 2aaz h ALA 183 N 5.60 1.92 -2.46 3.03 0.00 -1.42 -3.42 119.26 122.51 2aaz h ALA 183 Ca -0.46 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 2aaz h ALA 183 Cb 1.20 -0.02 -0.23 0.00 0.00 0.00 0.00 17.79 18.74 2aaz h ALA 183 CO 0.69 0.07 -0.13 -1.17 0.00 0.00 0.00 179.25 178.71 2aaz s LEU 184 N -9.01 -0.10 0.53 0.00 2.96 -1.26 -5.05 118.68 106.74 2aaz s LEU 184 Ca -0.05 1.07 -0.19 0.00 -0.22 0.00 0.00 54.13 54.73 2aaz s LEU 184 Cb 0.17 1.77 -0.07 0.00 0.50 0.00 0.00 46.19 48.56 2aaz s LEU 184 CO 0.68 -0.19 1.09 -2.84 -1.32 0.00 0.00 176.35 173.77 2aaz s PRO 185 N 0.60 3.51 0.18 0.98 0.02 -1.26 -4.94 135.00 134.09 2aaz s PRO 185 Ca -0.03 1.50 -0.33 0.00 0.02 0.00 0.00 61.00 62.16 2aaz s PRO 185 Cb -0.05 -2.04 -0.14 0.00 0.02 0.00 0.00 34.50 32.29 2aaz s PRO 185 CO -0.04 -0.70 1.44 -2.30 -0.33 0.00 0.00 177.00 175.08 2aaz n PRO 186 N -1.23 1.90 -0.08 5.54 -0.02 -1.26 -4.92 135.00 134.92 2aaz n PRO 186 Ca 0.11 0.68 -0.09 0.00 -2.02 0.00 0.00 63.50 62.18 2aaz n PRO 186 Cb 0.52 -2.37 -0.05 0.00 -0.02 0.00 0.00 33.50 31.58 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 -2.14 2.65 -0.36 0.00 0.00 -1.26 -1.77 115.29 112.41 2aaz s HIS 188 Ca -0.16 -0.66 0.23 0.00 -3.00 0.00 0.00 55.06 51.47 2aaz s HIS 188 Cb 0.02 -4.44 0.38 0.00 -4.00 0.00 0.00 32.58 24.55 2aaz s HIS 188 CO 0.31 -1.76 1.62 0.00 -1.00 0.00 0.00 174.74 173.90 2aaz h MET 189 N 9.56 0.00 -1.31 -0.38 -0.00 -1.69 -3.44 114.93 117.68 2aaz h MET 189 Ca -0.11 0.00 0.30 0.00 -0.00 0.00 0.00 59.70 59.89 2aaz h MET 189 Cb 1.05 0.00 -0.18 0.00 -0.00 0.00 0.00 31.60 32.47 2aaz h MET 189 CO 1.23 0.06 0.88 -0.59 -0.00 0.00 0.00 176.91 178.49 2aaz s PHE 190 N -3.22 -0.07 0.05 -0.10 -0.12 -1.24 -1.25 117.98 112.03 2aaz s PHE 190 Ca 0.06 0.03 -0.05 0.00 -0.05 0.00 0.00 56.93 56.92 2aaz s PHE 190 Cb 0.06 0.51 -0.02 0.00 -0.63 0.00 0.00 43.02 42.94 2aaz s PHE 190 CO 0.67 -0.15 0.08 0.00 -0.05 0.00 0.00 175.22 175.77 2aaz s GLN 192 N -3.12 1.94 0.04 0.00 0.74 0.17 -1.40 119.66 118.02 2aaz s GLN 192 Ca -0.01 -0.57 -0.00 0.00 0.05 0.00 0.00 55.36 54.83 2aaz s GLN 192 Cb 0.02 -1.60 -0.04 0.00 1.10 0.00 0.00 33.01 32.49 2aaz s GLN 192 CO -0.07 0.15 0.20 -0.06 -0.55 0.00 0.00 175.29 174.96 2aaz s PHE 193 N 0.33 3.51 -0.01 1.67 0.40 -0.51 -0.54 117.98 122.84 2aaz s PHE 193 Ca -0.10 0.27 0.01 0.00 -0.60 0.00 0.00 56.93 56.51 2aaz s PHE 193 Cb -0.14 -1.77 0.00 0.00 0.51 0.00 0.00 43.02 41.62 2aaz s PHE 193 CO 0.04 0.60 -0.04 0.12 0.70 0.00 0.00 175.22 176.63 2aaz s PHE 194 N -1.46 0.47 -0.18 0.36 2.19 -0.13 -4.61 117.98 114.61 2aaz s PHE 194 Ca 0.33 -0.09 0.00 0.00 0.33 0.00 0.00 56.93 57.50 2aaz s PHE 194 Cb -0.13 -0.35 0.01 0.00 -1.31 0.00 0.00 43.02 41.24 2aaz s PHE 194 CO 0.26 -0.04 -0.17 0.08 1.83 0.00 0.00 175.22 177.17 2aaz s VAL 195 N 0.14 2.33 -0.11 3.12 1.01 -1.26 -0.36 120.40 125.27 2aaz s VAL 195 Ca -0.01 -0.86 -0.19 0.00 0.00 0.00 0.00 61.98 60.92 2aaz s VAL 195 Cb -0.05 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 2aaz s VAL 195 CO -0.00 0.52 0.51 -0.44 0.00 0.00 0.00 175.10 175.69 2aaz s SER 196 N 1.19 6.72 0.60 3.32 0.01 0.34 -4.76 113.70 121.12 2aaz s SER 196 Ca 0.02 0.86 -0.16 0.00 1.31 0.00 0.00 55.95 57.98 2aaz s SER 196 Cb -0.14 -2.30 -0.03 0.00 0.21 0.00 0.00 66.02 63.75 2aaz s SER 196 CO -0.08 -0.02 1.08 -0.76 0.41 0.00 0.00 173.24 173.86 2aaz s LEU 197 N 0.68 3.52 0.24 2.44 1.43 -1.26 -1.51 118.68 124.21 2aaz s LEU 197 Ca 0.28 1.91 -0.31 0.00 -1.03 0.00 0.00 54.13 54.97 2aaz s LEU 197 Cb -0.15 -4.54 -0.12 0.00 0.03 0.00 0.00 46.19 41.40 2aaz s LEU 197 CO 0.11 -1.26 1.63 -2.65 0.23 0.00 0.00 176.35 174.41 2aaz n PRO 198 N -1.98 2.61 -1.57 1.29 -0.02 -1.26 -4.83 135.00 129.24 2aaz n PRO 198 Ca 0.09 0.94 -0.37 0.00 -2.02 0.00 0.00 63.50 62.14 2aaz n PRO 198 Cb 0.52 -2.73 0.07 0.00 -0.02 0.00 0.00 33.50 31.34 2aaz n PRO 198 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2aaz n PRO 199 N 3.00 0.82 -0.13 0.52 -0.02 -1.26 -4.79 135.00 133.14 2aaz n PRO 199 Ca 0.13 0.33 -0.04 0.00 -2.02 0.00 0.00 63.50 61.90 2aaz n PRO 199 Cb 0.35 -2.27 0.03 0.00 -0.02 0.00 0.00 33.50 31.59 2aaz n PRO 199 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2aaz h ALA 200 N 0.26 0.35 -0.04 3.55 0.00 -2.00 -2.92 119.26 118.46 2aaz h ALA 200 Ca -0.49 0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 2aaz h ALA 200 Cb 1.35 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 19.38 2aaz h ALA 200 CO 0.50 -0.42 -0.09 -0.40 0.00 0.00 0.00 179.25 178.84 2aaz n ASP 201 N -5.27 5.40 0.00 0.00 5.75 -1.26 -4.00 116.55 117.18 2aaz n ASP 201 Ca 0.03 -2.49 0.00 0.00 -0.01 0.00 0.00 54.79 52.33 2aaz n ASP 201 Cb 0.23 -1.22 0.00 0.00 -1.03 0.00 0.00 41.12 39.11 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 1.73 0.00 0.00 -1.12 3.41 -1.11 -5.05 113.62 111.48 2aaz n SER 202 Ca 0.16 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.86 2aaz n SER 202 Cb 0.63 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 65.08 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 0.00 0.40 0.16 4.33 -0.04 -1.20 -3.00 135.00 135.65 2aaz n PRO 203 Ca 0.00 0.07 0.10 0.00 -0.04 0.00 0.00 63.50 63.63 2aaz n PRO 203 Cb 0.00 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.04 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 2.95 0.00 -1.48 0.55 0.00 -1.95 -3.47 103.07 99.67 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 0.16 1.44 0.00 0.00 0.00 176.54 178.14 2aaz n SER 205 N -2.92 0.27 -4.77 0.19 7.64 -1.16 -4.98 113.62 107.89 2aaz n SER 205 Ca 0.01 0.47 -0.39 0.00 1.01 0.00 0.00 58.87 59.97 2aaz n SER 205 Cb 0.57 -1.46 -0.06 0.00 -1.01 0.00 0.00 64.21 62.25 2aaz n SER 205 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2aaz s LYS 206 N -4.33 4.68 0.66 1.43 1.02 -1.26 -4.74 119.74 117.20 2aaz s LYS 206 Ca 0.68 1.33 -0.17 0.00 0.02 0.00 0.00 55.97 57.83 2aaz s LYS 206 Cb -0.25 -3.11 -0.00 0.00 -0.52 0.00 0.00 37.83 33.95 2aaz s LYS 206 CO 0.57 0.45 1.26 -2.14 -0.92 0.00 0.00 175.35 174.57 2aaz s PRO 207 N -1.48 2.50 -0.11 -1.68 0.02 -1.26 -4.60 135.00 128.39 2aaz s PRO 207 Ca 0.43 1.95 -0.14 0.00 0.02 0.00 0.00 61.00 63.26 2aaz s PRO 207 Cb -0.23 -1.85 -0.05 0.00 0.02 0.00 0.00 34.50 32.39 2aaz s PRO 207 CO 0.28 -1.60 0.34 0.15 -0.33 0.00 0.00 177.00 175.84 2aaz s LYS 208 N -3.50 4.13 -0.19 5.54 1.02 -0.57 -0.50 119.74 125.66 2aaz s LYS 208 Ca 0.80 0.22 -0.06 0.00 0.02 0.00 0.00 55.97 56.94 2aaz s LYS 208 Cb -0.34 -3.36 -0.03 0.00 -0.52 0.00 0.00 37.83 33.57 2aaz s LYS 208 CO 0.40 0.37 0.03 -1.17 -0.92 0.00 0.00 175.35 174.06 2aaz s LEU 209 N 0.01 3.53 0.24 3.17 2.96 0.42 -0.51 118.68 128.51 2aaz s LEU 209 Ca 0.20 -0.06 0.10 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 44.61 2aaz s LEU 209 CO 0.07 0.12 -0.19 -0.44 -1.32 0.00 0.00 176.35 174.60 2aaz s SER 210 N 0.67 3.19 -0.05 3.68 0.01 0.51 0.22 113.70 121.93 2aaz s SER 210 Ca 0.01 -1.00 -0.02 0.00 1.31 0.00 0.00 55.95 56.26 2aaz s SER 210 Cb -0.14 -0.23 0.04 0.00 0.21 0.00 0.00 66.02 65.89 2aaz s SER 210 CO 0.02 -0.02 0.10 0.00 0.41 0.00 0.00 173.24 173.74 2aaz s LEU 212 N 1.23 2.58 -0.01 0.00 0.20 0.30 0.19 118.68 123.17 2aaz s LEU 212 Ca -0.08 -0.40 0.08 0.00 0.69 0.00 0.00 54.13 54.42 2aaz s LEU 212 Cb -0.12 -1.58 -0.02 0.00 -0.43 0.00 0.00 46.19 44.04 2aaz s LEU 212 CO -0.05 0.14 -0.24 -0.32 -0.29 0.00 0.00 176.35 175.59 2aaz s MET 213 N 0.50 1.93 -0.15 1.98 -2.45 0.12 0.41 119.30 121.65 2aaz s MET 213 Ca -0.10 -0.91 -0.00 0.00 -1.25 0.00 0.00 55.69 53.43 2aaz s MET 213 Cb -0.16 -1.90 -0.01 0.00 1.25 0.00 0.00 34.83 34.01 2aaz s MET 213 CO 0.04 0.52 -0.13 -0.47 1.05 0.00 0.00 175.02 176.03 2aaz s TYR 214 N -0.61 2.81 -0.22 4.11 5.04 -0.37 -1.12 117.35 126.98 2aaz s TYR 214 Ca 0.10 -0.81 0.01 0.00 -2.44 0.00 0.00 57.07 53.93 2aaz s TYR 214 Cb -0.09 -1.88 0.03 0.00 0.35 0.00 0.00 41.96 40.37 2aaz s TYR 214 CO -0.00 -0.33 -0.13 -1.14 -1.34 0.00 0.00 175.55 172.61 2aaz s GLN 215 N 0.60 2.71 0.33 4.97 0.74 -0.22 -2.44 119.66 126.36 2aaz s GLN 215 Ca -0.08 -1.03 0.06 0.00 0.05 0.00 0.00 55.36 54.35 2aaz s GLN 215 Cb -0.16 -2.79 0.59 0.00 1.10 0.00 0.00 33.01 31.75 2aaz s GLN 215 CO 0.03 -0.38 1.83 0.07 -0.55 0.00 0.00 175.29 176.30 2aaz h ARG 216 N 7.91 0.40 -3.63 1.67 0.11 -1.65 0.30 114.38 119.49 2aaz h ARG 216 Ca -0.34 -0.11 -0.35 0.00 0.10 0.00 0.00 59.98 59.28 2aaz h ARG 216 Cb 1.10 -0.05 -0.35 0.00 1.11 0.00 0.00 29.97 31.78 2aaz h ARG 216 CO 0.56 0.54 -0.75 0.45 0.10 0.00 0.00 179.97 180.88 2aaz s SER 217 N -6.81 0.61 -0.20 0.08 0.15 -1.26 -0.04 113.70 106.23 2aaz s SER 217 Ca -0.06 -0.01 -0.01 0.00 0.70 0.00 0.00 55.95 56.56 2aaz s SER 217 Cb 0.15 -0.21 0.06 0.00 -1.71 0.00 0.00 66.02 64.30 2aaz s SER 217 CO 0.76 -0.14 -0.01 0.00 1.20 0.00 0.00 173.24 175.06 2aaz s ASP 219 N 1.66 6.20 0.33 0.00 3.68 -1.26 -1.69 116.67 125.59 2aaz s ASP 219 Ca -0.02 -0.78 0.02 0.00 2.13 0.00 0.00 52.55 53.89 2aaz s ASP 219 Cb -0.17 -2.50 0.56 0.00 -1.45 0.00 0.00 42.92 39.35 2aaz s ASP 219 CO -0.07 -1.64 1.92 -0.07 0.13 0.00 0.00 175.17 175.45 2aaz h LEU 220 N 12.26 0.69 0.20 -1.34 4.07 -1.74 -0.02 115.31 129.44 2aaz h LEU 220 Ca -0.24 -0.07 -0.01 0.00 0.08 0.00 0.00 57.88 57.64 2aaz h LEU 220 Cb 1.05 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 42.62 2aaz h LEU 220 CO 1.24 0.61 -0.10 1.23 -1.08 0.00 0.00 178.44 180.34 2aaz h GLY 221 N 0.88 -0.29 0.00 0.83 0.00 -1.90 -3.38 103.07 99.21 2aaz h GLY 221 Ca 0.19 0.11 -0.38 0.00 0.00 0.00 0.00 47.33 47.24 2aaz h GLY 221 CO -0.02 -0.10 -2.32 1.04 0.00 0.00 0.00 176.54 175.13 2aaz n LEU 222 N -5.10 2.13 0.00 3.11 4.77 -1.21 -4.72 117.00 115.99 2aaz n LEU 222 Ca -0.09 0.15 -0.12 0.00 -0.03 0.00 0.00 56.01 55.92 2aaz n LEU 222 Cb 0.21 -0.73 -0.10 0.00 -2.33 0.00 0.00 43.42 40.47 2aaz n LEU 222 CO 0.33 0.63 0.48 1.23 -1.33 0.00 0.00 177.39 178.72 2aaz h GLY 223 N 0.02 -0.09 0.09 -0.72 0.00 -1.29 -3.36 103.07 97.71 2aaz h GLY 223 Ca -0.57 0.03 0.18 0.00 0.00 0.00 0.00 47.33 46.96 2aaz h GLY 223 CO -0.27 -0.03 0.46 -2.08 0.00 0.00 0.00 176.54 174.61 2aaz h VAL 224 N -0.76 0.65 -0.78 4.60 2.07 -1.40 0.67 116.25 121.31 2aaz h VAL 224 Ca -0.01 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.33 2aaz h VAL 224 Cb 0.61 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 2aaz h VAL 224 CO 0.01 0.11 0.51 -0.65 0.02 0.00 0.00 177.57 177.58 2aaz h PRO 225 N 0.59 0.98 -0.09 1.57 0.11 -1.76 0.24 132.00 133.64 2aaz h PRO 225 Ca 0.51 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.47 2aaz h PRO 225 Cb 0.82 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.71 2aaz h PRO 225 CO -0.41 0.65 -0.31 0.74 -0.21 0.00 0.00 178.00 178.46 2aaz h PHE 226 N 1.01 0.49 -0.67 0.65 -1.00 -1.09 -3.06 116.94 113.26 2aaz h PHE 226 Ca 0.29 -0.20 0.05 0.00 2.81 0.00 0.00 57.97 60.92 2aaz h PHE 226 Cb -0.05 -0.08 -0.05 0.00 3.61 0.00 0.00 35.95 39.38 2aaz h PHE 226 CO -0.00 0.93 0.39 -0.91 -1.61 0.00 0.00 178.31 177.11 2aaz h ASN 227 N -0.09 0.61 -0.04 2.17 -0.26 -0.58 0.32 115.58 117.70 2aaz h ASN 227 Ca -0.01 0.02 -0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2aaz h ASN 227 Cb 0.94 -0.11 -0.00 0.00 -1.06 0.00 0.00 38.32 38.09 2aaz h ASN 227 CO 0.07 0.40 0.03 0.40 -1.06 0.00 0.00 177.43 177.27 2aaz h ILE 228 N 0.74 1.05 -0.35 2.81 2.04 -1.05 -1.96 117.51 120.79 2aaz h ILE 228 Ca 0.29 -0.15 -0.15 0.00 1.00 0.00 0.00 64.86 65.85 2aaz h ILE 228 Cb 0.11 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2aaz h ILE 228 CO -0.15 0.04 -0.37 0.00 0.00 0.00 0.00 178.15 177.68 2aaz h ALA 229 N 0.96 0.68 0.33 1.87 0.00 -1.37 -2.19 119.26 119.55 2aaz h ALA 229 Ca 0.02 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 2aaz h ALA 229 Cb 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2aaz h ALA 229 CO -0.00 0.67 -0.25 1.03 0.00 0.00 0.00 179.25 180.69 2aaz h SER 230 N 0.68 -0.65 0.48 0.00 0.87 -0.24 -0.09 113.55 114.60 2aaz h SER 230 Ca 0.06 0.05 -0.08 0.00 -1.23 0.00 0.00 61.79 60.59 2aaz h SER 230 Cb 0.93 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 63.09 2aaz h SER 230 CO 0.09 -0.38 -0.37 1.88 -0.53 0.00 0.00 176.83 177.51 2aaz h TYR 231 N -0.58 0.00 -0.37 2.24 0.05 -1.39 0.51 116.97 117.44 2aaz h TYR 231 Ca -0.03 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.70 2aaz h TYR 231 Cb 0.51 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.23 2aaz h TYR 231 CO -0.13 0.37 0.03 0.00 -1.05 0.00 0.00 178.16 177.38 2aaz h ALA 232 N 1.63 0.49 -0.63 3.88 0.00 -1.21 -1.56 119.26 121.86 2aaz h ALA 232 Ca -0.00 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 2aaz h ALA 232 Cb 0.71 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2aaz h ALA 232 CO 0.05 0.23 0.07 -0.07 0.00 0.00 0.00 179.25 179.53 2aaz h LEU 233 N 0.46 1.02 -0.76 0.00 3.38 -0.42 -1.81 115.31 117.19 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 0.41 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 2aaz h LEU 233 CO 0.01 1.04 0.48 0.25 0.09 0.00 0.00 178.44 180.32 2aaz h LEU 234 N 0.97 0.80 -0.62 1.67 5.85 -0.75 0.34 115.31 123.56 2aaz h LEU 234 Ca 0.19 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.85 2aaz h LEU 234 Cb 0.47 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2aaz h LEU 234 CO 0.02 0.55 0.16 0.74 -0.34 0.00 0.00 178.44 179.58 2aaz h THR 235 N 0.95 1.25 -0.51 1.05 2.02 -0.98 0.35 112.91 117.04 2aaz h THR 235 Ca 0.30 -0.90 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 2aaz h THR 235 Cb 0.00 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 2aaz h THR 235 CO -0.11 0.34 0.28 0.45 0.37 0.00 0.00 175.52 176.86 2aaz h HIS 236 N 0.91 0.70 0.24 3.16 3.86 -0.80 0.31 115.15 123.53 2aaz h HIS 236 Ca 0.20 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.38 2aaz h HIS 236 Cb 0.34 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 28.58 2aaz h HIS 236 CO 0.02 0.51 -0.14 0.52 0.86 0.00 0.00 177.93 179.71 2aaz h MET 237 N 0.68 -0.35 -0.68 2.45 2.07 -0.49 -1.99 114.93 116.62 2aaz h MET 237 Ca 0.18 0.02 0.00 0.00 -2.07 0.00 0.00 59.70 57.84 2aaz h MET 237 Cb 0.04 0.08 -0.03 0.00 -1.87 0.00 0.00 31.60 29.82 2aaz h MET 237 CO -0.03 -0.23 0.44 0.82 1.07 0.00 0.00 176.91 178.98 2aaz h ILE 238 N -0.36 1.18 -0.85 -1.22 2.04 -0.81 -2.12 117.51 115.36 2aaz h ILE 238 Ca -0.03 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 2aaz h ILE 238 Cb 0.30 0.19 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 2aaz h ILE 238 CO 0.03 0.18 0.49 0.00 0.00 0.00 0.00 178.15 178.85 2aaz h ALA 239 N 1.56 1.09 -0.28 1.87 0.00 -0.58 -0.91 119.26 122.01 2aaz h ALA 239 Ca 0.25 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2aaz h ALA 239 Cb -0.09 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 2aaz h ALA 239 CO -0.05 0.57 0.10 1.25 0.00 0.00 0.00 179.25 181.12 2aaz h LEU 240 N 1.18 0.40 -1.11 0.00 5.85 -0.71 -0.63 115.31 120.29 2aaz h LEU 240 Ca 0.30 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 2aaz h LEU 240 Cb -0.01 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 2aaz h LEU 240 CO -0.05 0.48 -0.38 0.40 -0.34 0.00 0.00 178.44 178.54 2aaz h ILE 241 N 0.29 1.02 -0.45 4.05 1.08 -1.21 -3.17 117.51 119.12 2aaz h ILE 241 Ca 0.09 -1.43 0.00 0.00 -0.39 0.00 0.00 64.86 63.13 2aaz h ILE 241 Cb 0.21 1.83 0.00 0.00 -3.07 0.00 0.00 36.82 35.80 2aaz h ILE 241 CO -0.00 0.37 0.00 0.35 -0.69 0.00 0.00 178.15 178.18 2aaz n THR 242 N -3.72 0.64 -3.50 -0.27 -2.24 -0.37 -4.97 114.28 99.86 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 0.47 0.85 0.06 0.00 -2.10 0.00 0.00 70.33 69.61 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 1.40 -6.10 -4.64 3.42 10.43 -0.60 -4.80 116.55 115.66 2aaz n ASP 243 Ca 0.19 -0.51 -0.26 0.00 2.57 0.00 0.00 54.79 56.79 2aaz n ASP 243 Cb 0.58 -4.84 -0.09 0.00 1.84 0.00 0.00 41.12 38.61 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 -3.28 2.31 -0.24 -3.53 -4.23 -0.34 -4.47 115.64 101.85 2aaz s THR 244 Ca 0.53 -1.96 -0.07 0.00 -1.18 0.00 0.00 61.69 59.01 2aaz s THR 244 Cb -0.24 -2.87 -0.02 0.00 1.34 0.00 0.00 72.50 70.70 2aaz s THR 244 CO 0.65 -0.10 0.05 -0.70 -0.54 0.00 0.00 174.62 173.98 2aaz s GLU 245 N -3.74 3.60 0.27 3.99 2.56 0.34 -4.45 118.70 121.28 2aaz s GLU 245 Ca 0.36 -0.51 -0.30 0.00 0.00 0.00 0.00 54.97 54.52 2aaz s GLU 245 Cb 0.04 -3.26 -0.13 0.00 2.00 0.00 0.00 34.13 32.79 2aaz s GLU 245 CO 0.19 -0.18 1.45 -0.35 -0.56 0.00 0.00 175.26 175.81 2aaz n PRO 246 N 4.87 2.26 0.03 4.30 -0.04 -1.26 -0.44 135.00 144.72 2aaz n PRO 246 Ca -0.17 0.80 -0.00 0.00 -0.04 0.00 0.00 63.50 64.10 2aaz n PRO 246 Cb 0.51 -2.49 -0.00 0.00 -0.04 0.00 0.00 33.50 31.48 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 1.80 0.00 -3.87 0.54 -0.00 0.13 -3.83 115.22 110.00 2aaz n HIS 247 Ca 0.10 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.17 2aaz n HIS 247 Cb 0.34 -0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 30.10 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 -1.57 0.41 -0.11 1.57 2.12 -1.23 -0.26 118.70 119.63 2aaz s GLU 248 Ca -0.00 -0.30 0.03 0.00 0.36 0.00 0.00 54.97 55.05 2aaz s GLU 248 Cb 0.00 0.17 0.01 0.00 0.26 0.00 0.00 34.13 34.57 2aaz s GLU 248 CO 0.00 -0.09 -0.19 0.12 -0.54 0.00 0.00 175.26 174.56 2aaz s PHE 249 N -1.11 2.30 -0.06 5.30 5.36 -0.12 -1.07 117.98 128.58 2aaz s PHE 249 Ca -0.12 -1.06 0.05 0.00 -0.96 0.00 0.00 56.93 54.84 2aaz s PHE 249 Cb -0.07 -1.59 -0.02 0.00 -0.34 0.00 0.00 43.02 41.01 2aaz s PHE 249 CO 0.01 -0.49 -0.21 0.42 -1.46 0.00 0.00 175.22 173.50 2aaz s ILE 250 N 0.74 2.45 -0.18 3.12 1.09 0.13 -0.62 121.20 127.93 2aaz s ILE 250 Ca -0.11 -0.93 0.01 0.00 -1.10 0.00 0.00 60.65 58.52 2aaz s ILE 250 Cb -0.16 -1.93 0.03 0.00 -1.06 0.00 0.00 42.46 39.35 2aaz s ILE 250 CO 0.01 0.57 -0.11 -0.22 -0.10 0.00 0.00 174.94 175.09 2aaz s LEU 251 N -0.31 2.00 -0.18 2.97 2.96 0.11 -0.71 118.68 125.52 2aaz s LEU 251 Ca 0.01 -0.71 -0.06 0.00 -0.22 0.00 0.00 54.13 53.15 2aaz s LEU 251 Cb -0.13 -1.19 -0.03 0.00 0.50 0.00 0.00 46.19 45.34 2aaz s LEU 251 CO 0.02 -0.11 0.02 -1.58 -1.32 0.00 0.00 176.35 173.38 2aaz s GLN 252 N 1.45 3.84 0.11 1.98 2.00 -0.28 -0.91 119.66 127.85 2aaz s GLN 252 Ca 0.01 -0.42 0.04 0.00 -2.00 0.00 0.00 55.36 52.99 2aaz s GLN 252 Cb -0.15 -3.10 -0.04 0.00 0.80 0.00 0.00 33.01 30.52 2aaz s GLN 252 CO -0.09 0.23 0.09 -1.64 -0.50 0.00 0.00 175.29 173.38 2aaz s MET 253 N 0.44 2.85 0.00 1.67 -1.94 -1.26 -1.06 119.30 120.01 2aaz s MET 253 Ca 0.00 -0.76 0.00 0.00 -1.71 0.00 0.00 55.69 53.22 2aaz s MET 253 Cb -0.13 -2.68 0.00 0.00 2.01 0.00 0.00 34.83 34.03 2aaz s MET 253 CO 0.01 0.54 0.00 0.41 -0.01 0.00 0.00 175.02 175.97 2aaz n GLY 254 N 0.20 0.04 3.54 -0.03 0.00 0.09 -3.68 105.19 105.35 2aaz n GLY 254 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.68 6.24 -0.33 1.61 3.68 0.95 -1.12 116.67 127.02 2aaz s ASP 255 Ca 0.00 -0.73 -0.15 0.00 2.13 0.00 0.00 52.55 53.79 2aaz s ASP 255 Cb 0.00 -2.55 -0.01 0.00 -1.45 0.00 0.00 42.92 38.91 2aaz s ASP 255 CO 0.00 -1.72 0.37 0.00 0.13 0.00 0.00 175.17 173.95 2aaz s ALA 256 N 5.37 3.50 0.12 3.66 0.00 -0.65 -0.66 121.76 133.09 2aaz s ALA 256 Ca 0.36 -1.15 0.01 0.00 0.00 0.00 0.00 51.96 51.17 2aaz s ALA 256 Cb -0.07 -2.82 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 2aaz s ALA 256 CO 0.09 -1.04 -0.01 -3.38 0.00 0.00 0.00 175.76 171.42 2aaz s HIS 257 N 2.05 0.93 -0.16 0.00 -0.00 -0.68 -1.24 115.29 116.18 2aaz s HIS 257 Ca 0.13 -1.04 0.00 0.00 -0.00 0.00 0.00 55.06 54.15 2aaz s HIS 257 Cb -0.16 -0.54 0.03 0.00 -0.00 0.00 0.00 32.58 31.90 2aaz s HIS 257 CO 0.12 -0.28 -0.12 0.08 -0.00 0.00 0.00 174.74 174.53 2aaz s VAL 258 N -3.77 1.54 0.55 -5.38 1.01 -0.39 -1.75 120.40 112.22 2aaz s VAL 258 Ca 0.17 -0.71 -0.21 0.00 0.00 0.00 0.00 61.98 61.23 2aaz s VAL 258 Cb 0.06 -1.51 -0.05 0.00 0.00 0.00 0.00 36.38 34.89 2aaz s VAL 258 CO -0.02 0.36 1.28 -0.31 0.00 0.00 0.00 175.10 176.42 2aaz s TYR 259 N 1.48 2.41 0.28 5.22 1.51 -1.26 -1.50 117.35 125.49 2aaz s TYR 259 Ca 0.03 1.45 0.01 0.00 -1.01 0.00 0.00 57.07 57.55 2aaz s TYR 259 Cb -0.14 -3.64 0.57 0.00 -0.11 0.00 0.00 41.96 38.65 2aaz s TYR 259 CO -0.10 -2.47 1.79 0.00 -1.11 0.00 0.00 175.55 173.67 2aaz h ARG 260 N 1.39 0.76 -0.09 -0.62 2.47 -1.52 0.10 114.38 116.88 2aaz h ARG 260 Ca -0.50 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.17 2aaz h ARG 260 Cb 1.29 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 29.44 2aaz h ARG 260 CO 0.57 0.50 0.00 -0.40 0.56 0.00 0.00 179.97 181.20 2aaz n ASP 261 N -4.76 0.51 -0.00 7.04 5.75 -1.26 -3.14 116.55 120.68 2aaz n ASP 261 Ca 0.19 -1.91 0.06 0.00 -0.01 0.00 0.00 54.79 53.12 2aaz n ASP 261 Cb 0.42 -0.06 -0.09 0.00 -1.03 0.00 0.00 41.12 40.37 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 -0.27 0.00 0.02 2.11 8.25 0.01 -4.67 115.22 120.68 2aaz n HIS 262 Ca 0.05 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.40 2aaz n HIS 262 Cb 0.09 -0.19 -0.05 0.00 1.12 0.00 0.00 29.99 30.96 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 -0.24 1.59 2.07 -1.48 -0.63 116.25 117.80 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 0.49 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2aaz h VAL 263 CO 0.00 0.00 0.09 -0.33 0.02 0.00 0.00 177.57 177.35 2aaz h GLU 264 N -0.45 0.36 -0.84 1.57 4.39 -1.84 -2.00 114.58 115.77 2aaz h GLU 264 Ca 0.08 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.74 2aaz h GLU 264 Cb 0.58 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.13 2aaz h GLU 264 CO -0.34 0.42 0.55 -1.35 -1.16 0.00 0.00 179.01 177.12 2aaz h PRO 265 N 0.23 1.02 -0.09 2.33 0.11 -1.79 -2.31 132.00 131.50 2aaz h PRO 265 Ca 0.08 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 66.02 2aaz h PRO 265 Cb 0.19 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 2aaz h PRO 265 CO -0.01 0.67 -0.43 -0.07 -0.21 0.00 0.00 178.00 177.96 2aaz h LEU 266 N 1.05 0.23 -1.51 2.35 3.38 -0.93 -2.75 115.31 117.13 2aaz h LEU 266 Ca 0.33 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.24 2aaz h LEU 266 Cb 0.01 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2aaz h LEU 266 CO -0.09 0.64 0.38 0.11 0.09 0.00 0.00 178.44 179.57 2aaz h LYS 267 N 0.18 0.61 -0.56 1.13 1.57 -0.78 0.14 116.57 118.87 2aaz h LYS 267 Ca 0.01 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 2aaz h LYS 267 Cb 0.84 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 2aaz h LYS 267 CO 0.07 0.40 -0.09 1.15 -0.57 0.00 0.00 179.45 180.41 2aaz h THR 268 N 0.63 1.27 -0.27 -0.16 2.02 -1.44 -2.93 112.91 112.03 2aaz h THR 268 Ca 0.24 -1.26 -0.11 0.00 0.77 0.00 0.00 66.41 66.04 2aaz h THR 268 Cb 0.15 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 2aaz h THR 268 CO -0.07 0.45 -0.31 -0.61 0.37 0.00 0.00 175.52 175.35 2aaz h GLN 269 N 0.94 0.56 0.00 6.66 4.15 -0.88 -2.89 115.11 123.64 2aaz h GLN 269 Ca 0.15 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.33 2aaz h GLN 269 Cb 0.67 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.34 2aaz h GLN 269 CO 0.05 0.80 0.00 -0.07 -1.93 0.00 0.00 178.83 177.68 2aaz h LEU 270 N 0.48 0.00 0.00 -2.39 3.38 -0.63 -1.48 115.31 114.66 2aaz h LEU 270 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2aaz h LEU 270 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2aaz h LEU 270 CO 0.06 0.00 -0.11 -0.62 0.09 0.00 0.00 178.44 177.86 2aaz n GLU 271 N -2.94 0.04 -3.43 1.13 1.02 -1.09 -4.88 120.64 110.49 2aaz n GLU 271 Ca -0.02 0.02 -0.37 0.00 -0.02 0.00 0.00 57.16 56.78 2aaz n GLU 271 Cb 0.11 -1.54 -0.06 0.00 -0.02 0.00 0.00 31.44 29.93 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 -3.02 3.96 -0.16 3.49 0.52 -0.56 -5.07 118.95 118.12 2aaz s ARG 272 Ca 0.13 0.45 -0.18 0.00 -0.52 0.00 0.00 55.73 55.61 2aaz s ARG 272 Cb 0.18 -3.09 -0.04 0.00 0.52 0.00 0.00 34.95 32.52 2aaz s ARG 272 CO 0.57 0.59 0.49 -2.00 0.02 0.00 0.00 175.30 174.97 2aaz s GLU 273 N -1.51 4.26 0.63 3.54 2.12 -1.26 -4.96 118.70 121.52 2aaz s GLU 273 Ca 0.31 0.41 -0.19 0.00 0.36 0.00 0.00 54.97 55.87 2aaz s GLU 273 Cb -0.16 -3.50 -0.02 0.00 0.26 0.00 0.00 34.13 30.71 2aaz s GLU 273 CO 0.17 0.01 1.27 -2.30 -0.54 0.00 0.00 175.26 173.87 2aaz n PRO 274 N 4.22 1.16 -4.06 4.30 -0.02 -1.26 -4.88 135.00 134.46 2aaz n PRO 274 Ca -0.06 0.45 -0.24 0.00 -2.02 0.00 0.00 63.50 61.63 2aaz n PRO 274 Cb 0.51 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.45 2aaz n PRO 274 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2aaz s ARG 275 N -3.25 3.05 0.34 -0.52 3.00 -1.26 -5.03 118.95 115.27 2aaz s ARG 275 Ca 0.81 -0.89 -0.28 0.00 0.00 0.00 0.00 55.73 55.37 2aaz s ARG 275 Cb -0.39 -2.69 -0.12 0.00 0.00 0.00 0.00 34.95 31.75 2aaz s ARG 275 CO 0.42 0.45 1.28 -0.25 0.00 0.00 0.00 175.30 177.20 2aaz n ASP 276 N -0.82 2.70 -4.73 0.23 8.00 -1.26 -4.81 116.55 115.86 2aaz n ASP 276 Ca -0.08 1.20 -0.36 0.00 0.71 0.00 0.00 54.79 56.27 2aaz n ASP 276 Cb 0.56 -1.47 0.07 0.00 -0.02 0.00 0.00 41.12 40.26 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 -1.05 2.15 0.95 1.24 0.08 -1.26 -4.75 117.98 115.34 2aaz s PHE 277 Ca 0.56 1.54 -0.14 0.00 0.12 0.00 0.00 56.93 59.01 2aaz s PHE 277 Cb -0.58 -3.54 0.17 0.00 -0.57 0.00 0.00 43.02 38.50 2aaz s PHE 277 CO 0.62 -2.60 1.21 -1.25 -0.10 0.00 0.00 175.22 173.09 2aaz s PRO 278 N -3.60 0.83 0.15 0.24 0.04 -1.24 -4.84 135.00 126.58 2aaz s PRO 278 Ca 0.78 -0.04 0.10 0.00 0.04 0.00 0.00 61.00 61.88 2aaz s PRO 278 Cb -0.32 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 2aaz s PRO 278 CO 0.40 -2.34 -0.20 0.15 0.04 0.00 0.00 177.00 175.05 2aaz s LYS 279 N -5.57 1.69 -0.12 4.56 1.02 -0.20 -1.37 119.74 119.75 2aaz s LYS 279 Ca 0.68 -1.31 -0.03 0.00 0.02 0.00 0.00 55.97 55.33 2aaz s LYS 279 Cb -0.09 -2.02 -0.03 0.00 -0.52 0.00 0.00 37.83 35.16 2aaz s LYS 279 CO 0.53 0.45 -0.00 -1.17 -0.92 0.00 0.00 175.35 174.23 2aaz s LEU 280 N -2.35 3.51 0.07 3.17 2.96 0.89 -1.00 118.68 125.93 2aaz s LEU 280 Ca 0.19 0.05 0.03 0.00 -0.22 0.00 0.00 54.13 54.18 2aaz s LEU 280 Cb -0.10 -1.82 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 2aaz s LEU 280 CO 0.10 0.29 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.80 2aaz s LYS 281 N -0.36 0.72 -0.15 1.98 -0.14 0.34 -4.82 119.74 117.30 2aaz s LYS 281 Ca 0.07 -1.03 -0.08 0.00 -1.36 0.00 0.00 55.97 53.57 2aaz s LYS 281 Cb -0.12 -0.38 -0.04 0.00 -1.68 0.00 0.00 37.83 35.60 2aaz s LYS 281 CO 0.02 0.05 0.13 -1.58 -0.76 0.00 0.00 175.35 173.22 2aaz s TRP 282 N -2.23 3.51 -0.70 3.18 0.52 -1.26 -0.85 118.94 121.12 2aaz s TRP 282 Ca 0.00 0.44 0.26 0.00 0.02 0.00 0.00 56.10 56.81 2aaz s TRP 282 Cb -0.04 -2.03 0.88 0.00 -1.15 0.00 0.00 33.47 31.13 2aaz s TRP 282 CO -0.01 0.54 1.77 0.00 0.02 0.00 0.00 176.95 179.27 2aaz n ALA 283 N 2.63 2.13 -2.29 0.98 0.00 -0.07 -4.85 120.51 119.04 2aaz n ALA 283 Ca -0.18 -0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.10 2aaz n ALA 283 Cb 0.54 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.44 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 -3.14 1.35 0.61 0.00 0.52 -1.26 -5.05 118.95 111.97 2aaz s ARG 284 Ca 0.09 -1.72 -0.04 0.00 -0.52 0.00 0.00 55.73 53.54 2aaz s ARG 284 Cb 0.12 -0.20 0.03 0.00 0.52 0.00 0.00 34.95 35.42 2aaz s ARG 284 CO 0.54 -0.29 0.89 -1.54 0.02 0.00 0.00 175.30 174.92 2aaz s SER 285 N -3.28 5.25 0.20 0.23 1.04 -1.26 -4.90 113.70 110.98 2aaz s SER 285 Ca 0.36 0.40 -0.11 0.00 0.48 0.00 0.00 55.95 57.09 2aaz s SER 285 Cb 0.08 -1.27 0.19 0.00 0.10 0.00 0.00 66.02 65.12 2aaz s SER 285 CO 0.12 -1.25 1.80 0.50 0.98 0.00 0.00 173.24 175.40 2aaz h LYS 286 N -0.22 0.60 -0.72 4.02 3.64 -1.98 -0.56 116.57 121.35 2aaz h LYS 286 Ca -0.44 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 2aaz h LYS 286 Cb 1.29 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 2aaz h LYS 286 CO 0.58 0.40 0.43 0.93 -2.27 0.00 0.00 179.45 179.51 2aaz h GLU 287 N 0.62 0.99 -0.29 1.90 3.07 -1.94 0.33 114.58 119.26 2aaz h GLU 287 Ca 0.27 -0.10 -0.05 0.00 -0.50 0.00 0.00 59.36 58.98 2aaz h GLU 287 Cb 0.15 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.85 2aaz h GLU 287 CO -0.17 0.71 -0.03 0.93 -1.40 0.00 0.00 179.01 179.06 2aaz h GLU 288 N 0.99 0.53 -0.62 2.33 5.08 -1.79 -2.95 114.58 118.15 2aaz h GLU 288 Ca 0.26 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 2aaz h GLU 288 Cb -0.01 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 2aaz h GLU 288 CO -0.05 0.70 0.01 0.82 -1.00 0.00 0.00 179.01 179.50 2aaz h ILE 289 N 0.31 1.27 0.00 3.13 2.04 -0.93 -3.47 117.51 119.86 2aaz h ILE 289 Ca 0.08 -1.14 0.00 0.00 1.00 0.00 0.00 64.86 64.80 2aaz h ILE 289 Cb 0.48 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 2aaz h ILE 289 CO 0.02 0.42 0.00 0.61 0.00 0.00 0.00 178.15 179.20 2aaz n GLY 290 N -0.45 2.22 1.48 5.37 0.00 0.11 -4.06 105.19 109.88 2aaz n GLY 290 Ca 0.03 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.38 0.33 1.61 5.68 -1.26 -4.89 116.55 122.07 2aaz n ASP 291 Ca 0.00 -1.98 0.21 0.00 -0.50 0.00 0.00 54.79 52.51 2aaz n ASP 291 Cb 0.00 0.84 1.12 0.00 -1.14 0.00 0.00 41.12 41.94 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 1.49 0.09 -0.21 2.12 6.09 -1.94 -0.88 117.51 124.26 2aaz h ILE 292 Ca -0.11 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.38 2aaz h ILE 292 Cb 0.55 0.95 0.00 0.00 0.47 0.00 0.00 36.82 38.79 2aaz h ILE 292 CO 0.16 0.00 0.00 0.47 -3.07 0.00 0.00 178.15 175.71 2aaz n ASP 293 N -3.19 2.48 -1.26 2.19 8.00 -1.26 -4.28 116.55 119.24 2aaz n ASP 293 Ca -0.03 -1.83 0.11 0.00 0.71 0.00 0.00 54.79 53.75 2aaz n ASP 293 Cb 0.12 -0.13 0.28 0.00 -0.02 0.00 0.00 41.12 41.37 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 1.30 2.30 3.81 0.44 0.00 -0.34 -4.99 105.19 107.72 2aaz n GLY 294 Ca 0.17 -0.75 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.12 3.26 0.10 1.61 0.40 -1.26 -4.78 117.98 116.19 2aaz s PHE 295 Ca 0.45 1.61 0.05 0.00 -0.60 0.00 0.00 56.93 58.44 2aaz s PHE 295 Cb 0.24 -2.91 -0.03 0.00 0.51 0.00 0.00 43.02 40.82 2aaz s PHE 295 CO 0.32 -0.28 -0.13 0.15 0.70 0.00 0.00 175.22 175.98 2aaz s LYS 296 N -3.10 0.90 0.24 0.44 1.02 -1.26 -5.05 119.74 112.93 2aaz s LYS 296 Ca 0.62 -1.12 -0.05 0.00 0.02 0.00 0.00 55.97 55.45 2aaz s LYS 296 Cb -0.12 -0.77 0.43 0.00 -0.52 0.00 0.00 37.83 36.86 2aaz s LYS 296 CO 0.16 0.15 1.72 0.28 -0.92 0.00 0.00 175.35 176.74 2aaz h VAL 297 N 3.80 0.64 0.00 3.17 2.07 -1.98 0.11 116.25 124.06 2aaz h VAL 297 Ca -0.39 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.99 2aaz h VAL 297 Cb 1.19 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2aaz h VAL 297 CO 0.48 0.07 0.00 -1.84 0.02 0.00 0.00 177.57 176.30 2aaz n GLU 298 N -5.04 0.05 0.19 1.57 0.00 -1.26 -2.08 120.64 114.08 2aaz n GLU 298 Ca 0.13 0.29 0.08 0.00 0.00 0.00 0.00 57.16 57.66 2aaz n GLU 298 Cb 0.41 -1.50 0.26 0.00 0.00 0.00 0.00 31.44 30.61 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 -2.65 -1.84 3.32 -1.18 -3.43 116.42 110.64 2aaz h ASP 299 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 2aaz h ASP 299 Cb 0.12 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.55 2aaz h ASP 299 CO 0.00 0.28 0.72 -0.36 -1.72 0.00 0.00 179.24 178.16 2aaz s PHE 300 N -3.33 2.57 -0.51 4.55 0.40 -0.88 -0.89 117.98 119.88 2aaz s PHE 300 Ca 0.03 -0.30 -0.14 0.00 -0.60 0.00 0.00 56.93 55.92 2aaz s PHE 300 Cb 0.08 -4.37 0.12 0.00 0.51 0.00 0.00 43.02 39.36 2aaz s PHE 300 CO 0.68 -1.74 0.45 0.08 0.70 0.00 0.00 175.22 175.38 2aaz s VAL 301 N 4.59 4.95 -0.33 -0.44 1.01 -0.03 -4.98 120.40 125.17 2aaz s VAL 301 Ca 0.28 -1.53 -0.15 0.00 0.00 0.00 0.00 61.98 60.58 2aaz s VAL 301 Cb -0.13 -4.17 -0.02 0.00 0.00 0.00 0.00 36.38 32.06 2aaz s VAL 301 CO 0.13 -0.81 0.38 -0.69 0.00 0.00 0.00 175.10 174.11 2aaz s VAL 302 N 1.54 5.15 0.07 2.92 1.01 -1.26 -0.51 120.40 129.32 2aaz s VAL 302 Ca 0.04 0.19 0.07 0.00 0.00 0.00 0.00 61.98 62.28 2aaz s VAL 302 Cb -0.28 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 2aaz s VAL 302 CO 0.02 -0.06 -0.16 -1.83 0.00 0.00 0.00 175.10 173.08 2aaz s GLU 303 N 2.08 2.03 0.00 2.72 -1.05 -0.17 -4.63 118.70 119.68 2aaz s GLU 303 Ca 0.13 -1.03 0.00 0.00 -0.15 0.00 0.00 54.97 53.92 2aaz s GLU 303 Cb -0.16 -2.21 0.00 0.00 -0.44 0.00 0.00 34.13 31.32 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 1.19 0.52 3.64 -3.83 0.00 -1.26 -1.03 105.19 104.42 2aaz n GLY 304 Ca -0.15 -0.46 -0.43 0.00 0.00 0.00 0.00 46.02 44.98 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 2.88 -0.51 1.61 6.04 -1.26 -4.38 117.35 119.73 2aaz s TYR 305 Ca 0.00 1.01 0.06 0.00 0.04 0.00 0.00 57.07 58.19 2aaz s TYR 305 Cb 0.00 -3.77 0.23 0.00 -1.04 0.00 0.00 41.96 37.38 2aaz s TYR 305 CO 0.00 -1.35 0.56 1.63 -1.54 0.00 0.00 175.55 174.85 2aaz n LYS 306 N 7.05 1.35 -2.19 4.97 5.02 -1.26 -5.07 118.16 128.03 2aaz n LYS 306 Ca 0.14 -3.84 -0.28 0.00 -2.02 0.00 0.00 58.31 52.31 2aaz n LYS 306 Cb 0.47 -1.75 0.03 0.00 -0.02 0.00 0.00 35.03 33.76 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 -1.45 2.96 0.60 1.97 0.04 -1.26 -4.74 135.00 133.13 2aaz s PRO 307 Ca 0.35 0.22 -0.10 0.00 0.04 0.00 0.00 61.00 61.52 2aaz s PRO 307 Cb 0.12 -2.17 0.14 0.00 0.04 0.00 0.00 34.50 32.62 2aaz s PRO 307 CO -0.10 -0.79 0.82 0.91 0.04 0.00 0.00 177.00 177.88 2aaz n TRP 308 N -2.74 -3.92 -0.82 0.56 7.02 -0.02 -4.89 117.44 112.64 2aaz n TRP 308 Ca 0.05 -0.77 -0.30 0.00 -1.02 0.00 0.00 57.50 55.46 2aaz n TRP 308 Cb 0.57 -0.63 0.17 0.00 -2.42 0.00 0.00 31.31 29.00 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 -4.76 1.64 0.63 6.99 0.00 -1.26 -2.65 107.32 107.91 2aaz s GLY 309 Ca 0.47 0.27 -0.15 0.00 0.00 0.00 0.00 44.72 45.31 2aaz s GLY 309 CO 0.33 0.76 1.09 -1.59 0.00 0.00 0.00 173.10 173.69 2aaz s LYS 310 N -4.68 3.02 -0.20 2.90 -2.85 -1.26 -2.97 119.74 113.70 2aaz s LYS 310 Ca 0.66 1.30 0.00 0.00 -1.00 0.00 0.00 55.97 56.93 2aaz s LYS 310 Cb -0.22 -1.99 0.05 0.00 -2.06 0.00 0.00 37.83 33.62 2aaz s LYS 310 CO 0.59 -1.06 -0.06 0.42 0.10 0.00 0.00 175.35 175.34 2aaz s ILE 311 N -2.40 1.33 0.09 3.79 1.01 -1.26 -4.88 121.20 118.88 2aaz s ILE 311 Ca 0.65 -0.90 -0.31 0.00 0.00 0.00 0.00 60.65 60.10 2aaz s ILE 311 Cb -0.19 -1.53 -0.07 0.00 0.01 0.00 0.00 42.46 40.68 2aaz s ILE 311 CO 0.40 0.05 1.36 -1.81 0.00 0.00 0.00 174.94 174.93 2aaz s ASP 312 N 1.52 6.88 -0.08 3.58 1.01 -1.26 -5.02 116.67 123.30 2aaz s ASP 312 Ca -0.02 2.24 -0.03 0.00 0.71 0.00 0.00 52.55 55.45 2aaz s ASP 312 Cb -0.17 -2.58 0.04 0.00 1.01 0.00 0.00 42.92 41.22 2aaz s ASP 312 CO -0.07 -0.63 0.17 -0.04 0.21 0.00 0.00 175.17 174.81 2aaz s MET 313 N 1.27 0.12 0.19 8.23 -1.94 -1.26 -4.89 119.30 121.03 2aaz s MET 313 Ca 0.63 0.42 -0.26 0.00 -1.71 0.00 0.00 55.69 54.78 2aaz s MET 313 Cb -0.35 -0.17 -0.08 0.00 2.01 0.00 0.00 34.83 36.24 2aaz s MET 313 CO 0.30 -0.17 0.81 0.21 -0.01 0.00 0.00 175.02 176.16 2aaz s LYS 314 N 1.24 4.60 -0.03 2.03 2.20 -1.26 -5.04 119.74 123.47 2aaz s LYS 314 Ca -0.09 1.21 -0.18 0.00 -0.36 0.00 0.00 55.97 56.55 2aaz s LYS 314 Cb -0.11 -3.21 -0.05 0.00 -1.51 0.00 0.00 37.83 32.94 2aaz s LYS 314 CO -0.07 0.53 0.49 1.41 -0.36 0.00 0.00 175.35 177.36 2aaz s MET 315 N -1.27 4.19 -0.28 4.03 -2.45 -1.26 -4.97 119.30 117.29 2aaz s MET 315 Ca 0.38 0.54 -0.17 0.00 -1.25 0.00 0.00 55.69 55.19 2aaz s MET 315 Cb -0.23 -3.33 -0.03 0.00 1.25 0.00 0.00 34.83 32.50 2aaz s MET 315 CO 0.27 0.43 0.46 -1.12 1.05 0.00 0.00 175.02 176.10 2aaz s SER 316 N -0.29 6.34 0.00 1.11 0.01 -1.26 -5.16 113.70 114.45 2aaz s SER 316 Ca 0.27 0.32 0.17 0.00 1.31 0.00 0.00 55.95 58.01 2aaz s SER 316 Cb -0.17 -2.25 0.99 0.00 0.21 0.00 0.00 66.02 64.80 2aaz s SER 316 CO 0.14 -0.29 1.40 0.00 0.41 0.00 0.00 173.24 174.90