#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 0.01 -2.99 0.55 0.87 -2.03 -3.21 113.55 106.75 2aaz h SER 14 Ca 0.00 0.17 -0.60 0.00 -1.23 0.00 0.00 61.79 60.13 2aaz h SER 14 Cb 0.00 0.23 -0.40 0.00 -0.44 0.00 0.00 62.40 61.80 2aaz h SER 14 CO 0.00 -0.10 -0.79 0.21 -0.53 0.00 0.00 176.83 175.62 2aaz s ASN 15 N -5.16 3.14 0.67 6.23 2.47 -1.26 -4.97 114.94 116.05 2aaz s ASN 15 Ca -0.12 -2.88 0.44 0.00 0.42 0.00 0.00 52.86 50.72 2aaz s ASN 15 Cb 0.24 -0.88 2.42 0.00 -1.45 0.00 0.00 41.25 41.58 2aaz s ASN 15 CO 0.77 -0.22 2.36 -0.65 -3.72 0.00 0.00 177.10 175.64 2aaz h PRO 16 N 6.26 0.00 -0.10 0.43 0.11 -2.04 -2.26 132.00 134.40 2aaz h PRO 16 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 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 0.46 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.00 2aaz n ASP 17 N -3.07 1.73 -4.69 -2.05 8.00 -1.26 -4.91 116.55 110.30 2aaz n ASP 17 Ca -0.03 -1.64 -0.42 0.00 0.71 0.00 0.00 54.79 53.41 2aaz n ASP 17 Cb 0.08 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.09 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 -1.89 2.22 0.58 1.24 2.46 -0.85 -4.85 115.29 114.20 2aaz s HIS 18 Ca 0.35 0.03 0.28 0.00 0.47 0.00 0.00 55.06 56.19 2aaz s HIS 18 Cb 0.19 -4.16 1.54 0.00 -0.13 0.00 0.00 32.58 30.03 2aaz s HIS 18 CO 0.30 -4.76 2.00 0.93 -2.47 0.00 0.00 174.74 170.74 2aaz h GLU 19 N 8.46 0.00 0.00 2.88 5.08 -1.91 -1.50 114.58 127.59 2aaz h GLU 19 Ca -0.46 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.90 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 -0.04 1.49 -1.00 0.00 0.00 179.01 180.41 2aaz h GLU 20 N 0.00 0.00 0.00 2.33 4.81 -1.96 -1.85 114.58 117.91 2aaz h GLU 20 Ca 0.16 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2aaz h GLU 20 Cb 0.85 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.22 2aaz h GLU 20 CO -0.00 0.04 -0.05 1.88 -0.73 0.00 0.00 179.01 180.15 2aaz h TYR 21 N 0.00 0.00 -0.35 0.92 -1.99 -1.63 -1.77 116.97 112.14 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 0.05 0.23 1.96 -0.00 0.00 0.00 178.16 180.39 2aaz h GLN 22 N 0.00 0.47 -0.08 4.88 4.20 -1.53 0.41 115.11 123.46 2aaz h GLN 22 Ca -0.00 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2aaz h GLN 22 Cb 0.20 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 2aaz h GLN 22 CO 0.01 0.33 -0.00 -0.92 -0.67 0.00 0.00 178.83 177.57 2aaz h TYR 23 N 0.47 0.16 -0.52 2.96 5.03 -1.51 -2.19 116.97 121.37 2aaz h TYR 23 Ca 0.13 -0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.36 2aaz h TYR 23 Cb -0.03 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 38.19 2aaz h TYR 23 CO -0.05 0.42 0.13 -0.07 -1.32 0.00 0.00 178.16 177.28 2aaz h LEU 24 N -0.15 0.77 -0.84 2.82 3.38 -1.20 -2.63 115.31 117.46 2aaz h LEU 24 Ca 0.02 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 2aaz h LEU 24 Cb 0.36 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2aaz h LEU 24 CO 0.01 0.80 0.38 0.44 0.09 0.00 0.00 178.44 180.15 2aaz h ASP 25 N 0.71 1.12 -0.63 -0.43 3.45 -0.20 -1.83 116.42 118.61 2aaz h ASP 25 Ca 0.16 -0.15 -0.07 0.00 0.43 0.00 0.00 57.03 57.41 2aaz h ASP 25 Cb 0.32 -0.29 -0.03 0.00 -0.56 0.00 0.00 39.33 38.78 2aaz h ASP 25 CO 0.00 0.96 0.13 0.25 -1.57 0.00 0.00 179.24 179.01 2aaz h LEU 26 N 1.20 0.98 -0.49 1.55 5.85 -1.26 -0.09 115.31 123.05 2aaz h LEU 26 Ca 0.28 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2aaz h LEU 26 Cb 0.16 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 2aaz h LEU 26 CO -0.03 0.97 0.24 0.40 -0.34 0.00 0.00 178.44 179.68 2aaz h ILE 27 N 0.94 1.19 -0.64 4.05 2.04 -1.28 0.50 117.51 124.31 2aaz h ILE 27 Ca 0.20 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 2aaz h ILE 27 Cb 0.39 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 2aaz h ILE 27 CO 0.01 0.21 0.39 -0.09 0.00 0.00 0.00 178.15 178.66 2aaz h ARG 28 N 0.65 0.88 -0.39 2.37 2.43 -0.99 -0.99 114.38 118.34 2aaz h ARG 28 Ca 0.17 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2aaz h ARG 28 Cb 0.11 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 2aaz h ARG 28 CO -0.02 0.63 0.13 -0.09 -1.51 0.00 0.00 179.97 179.11 2aaz h ARG 29 N 0.88 0.60 -0.59 0.20 2.43 -0.60 -0.43 114.38 116.86 2aaz h ARG 29 Ca 0.23 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 2aaz h ARG 29 Cb -0.02 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 2aaz h ARG 29 CO -0.04 0.59 0.36 0.82 -1.51 0.00 0.00 179.97 180.19 2aaz h ILE 30 N 0.48 1.17 -0.55 1.20 2.04 -0.57 0.18 117.51 121.47 2aaz h ILE 30 Ca 0.13 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 2aaz h ILE 30 Cb 0.23 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 2aaz h ILE 30 CO -0.01 0.18 0.20 0.40 0.00 0.00 0.00 178.15 178.92 2aaz h ILE 31 N 0.80 1.23 0.33 -0.67 2.04 -1.04 0.28 117.51 120.46 2aaz h ILE 31 Ca 0.21 -0.72 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 2aaz h ILE 31 Cb -0.03 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2aaz h ILE 31 CO -0.04 0.27 -0.16 0.78 0.00 0.00 0.00 178.15 179.01 2aaz h ASN 32 N 0.75 -0.37 -0.09 1.72 -0.26 -0.57 -3.39 115.58 113.36 2aaz h ASN 32 Ca 0.18 -0.18 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2aaz h ASN 32 Cb 0.23 0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.58 2aaz h ASN 32 CO -0.01 0.05 0.00 1.33 -1.06 0.00 0.00 177.43 177.74 2aaz n VAL 33 N -5.11 0.67 -1.14 2.81 0.24 0.60 -5.05 118.33 111.35 2aaz n VAL 33 Ca -0.09 -0.83 -0.32 0.00 -2.04 0.00 0.00 64.34 61.06 2aaz n VAL 33 Cb 0.27 0.70 0.11 0.00 -1.47 0.00 0.00 33.84 33.45 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 -0.79 1.86 -0.15 7.63 0.00 0.97 -4.99 107.32 111.85 2aaz s GLY 34 Ca 0.08 0.54 -0.16 0.00 0.00 0.00 0.00 44.72 45.17 2aaz s GLY 34 CO 0.06 0.92 0.40 1.85 0.00 0.00 0.00 173.10 176.33 2aaz s GLU 35 N -4.53 4.28 -0.05 2.90 2.12 0.06 -4.68 118.70 118.80 2aaz s GLU 35 Ca 0.66 0.28 -0.30 0.00 0.36 0.00 0.00 54.97 55.97 2aaz s GLU 35 Cb -0.22 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.67 2aaz s GLU 35 CO 0.53 0.14 1.36 0.08 -0.54 0.00 0.00 175.26 176.82 2aaz s VAL 36 N 0.74 3.93 0.04 3.70 1.01 -1.26 -0.80 120.40 127.76 2aaz s VAL 36 Ca 0.21 1.25 -0.00 0.00 0.00 0.00 0.00 61.98 63.44 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 0.08 -0.04 -0.04 -0.13 0.00 0.00 0.00 175.10 174.97 2aaz s ARG 37 N 2.77 0.48 0.72 2.72 0.52 0.25 -4.99 118.95 121.41 2aaz s ARG 37 Ca 0.61 -0.90 -0.11 0.00 -0.52 0.00 0.00 55.73 54.81 2aaz s ARG 37 Cb -0.28 0.09 0.03 0.00 0.52 0.00 0.00 34.95 35.31 2aaz s ARG 37 CO 0.23 -0.06 1.10 -2.14 0.02 0.00 0.00 175.30 174.45 2aaz s PRO 38 N -2.56 2.69 0.28 3.54 0.02 -1.26 -1.38 135.00 136.34 2aaz s PRO 38 Ca -0.05 0.35 -0.17 0.00 0.02 0.00 0.00 61.00 61.16 2aaz s PRO 38 Cb -0.02 -2.03 0.01 0.00 0.02 0.00 0.00 34.50 32.48 2aaz s PRO 38 CO -0.05 -1.11 0.62 0.16 -0.33 0.00 0.00 177.00 176.30 2aaz s ASP 39 N -4.40 -0.12 0.26 2.53 -4.77 -1.26 -4.78 116.67 104.13 2aaz s ASP 39 Ca 0.59 -0.82 -0.01 0.00 -3.30 0.00 0.00 52.55 49.01 2aaz s ASP 39 Cb -0.11 0.68 0.54 0.00 -1.09 0.00 0.00 42.92 42.95 2aaz s ASP 39 CO 0.51 -1.30 1.75 -0.09 0.70 0.00 0.00 175.17 176.74 2aaz h ARG 40 N 2.10 0.56 0.00 2.11 2.43 -2.01 -2.37 114.38 117.20 2aaz h ARG 40 Ca -0.23 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 58.83 2aaz h ARG 40 Cb 1.25 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 2aaz h ARG 40 CO 0.30 0.37 -0.33 1.79 -1.51 0.00 0.00 179.97 180.58 2aaz h THR 41 N 0.57 0.93 0.00 0.20 1.35 -1.92 -3.47 112.91 110.57 2aaz h THR 41 Ca 0.47 -1.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 2aaz h THR 41 Cb 0.70 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 2aaz h THR 41 CO -0.39 0.33 0.00 0.61 -0.25 0.00 0.00 175.52 175.82 2aaz n GLY 42 N -0.10 0.85 0.09 5.82 0.00 -0.89 -4.90 105.19 106.05 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 1.17 0.00 2.61 1.35 -1.91 -3.47 112.91 112.65 2aaz h THR 43 Ca 0.00 -2.77 0.00 0.00 -0.55 0.00 0.00 66.41 63.09 2aaz h THR 43 Cb 0.00 2.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 2aaz h THR 43 CO 0.00 0.67 0.00 0.61 -0.25 0.00 0.00 175.52 176.55 2aaz n GLY 44 N 1.35 0.22 3.41 5.82 0.00 -1.26 -4.57 105.19 110.15 2aaz n GLY 44 Ca -0.03 -1.61 -0.14 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 -2.86 0.00 -0.08 2.61 -4.23 -0.48 -1.75 115.64 108.85 2aaz s THR 45 Ca 0.00 -1.71 0.04 0.00 -1.18 0.00 0.00 61.69 58.83 2aaz s THR 45 Cb 0.00 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.35 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 -3.58 1.77 0.13 2.29 0.11 -0.65 -0.59 120.40 119.88 2aaz s VAL 46 Ca 0.32 -0.87 -0.06 0.00 -2.93 0.00 0.00 61.98 58.45 2aaz s VAL 46 Cb 0.02 -1.54 -0.02 0.00 -1.53 0.00 0.00 36.38 33.31 2aaz s VAL 46 CO 0.17 0.50 0.17 0.00 -3.33 0.00 0.00 175.10 172.61 2aaz s ALA 47 N 0.30 0.20 0.02 1.54 0.00 0.02 -1.22 121.76 122.61 2aaz s ALA 47 Ca -0.14 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 50.85 2aaz s ALA 47 Cb -0.16 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.66 2aaz s ALA 47 CO 0.06 -0.55 -0.07 -0.51 0.00 0.00 0.00 175.76 174.70 2aaz s LEU 48 N -2.96 2.11 -0.13 0.00 1.43 -0.42 -0.76 118.68 117.96 2aaz s LEU 48 Ca 0.15 -0.28 -0.06 0.00 -1.03 0.00 0.00 54.13 52.90 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 -0.03 -0.04 0.08 0.12 0.23 0.00 0.00 176.35 176.71 2aaz s PHE 49 N -0.64 3.38 -1.25 0.29 5.36 -1.26 -1.58 117.98 122.28 2aaz s PHE 49 Ca -0.03 0.31 -0.13 0.00 -0.96 0.00 0.00 56.93 56.12 2aaz s PHE 49 Cb -0.05 -1.95 -0.00 0.00 -0.34 0.00 0.00 43.02 40.67 2aaz s PHE 49 CO 0.00 0.49 0.64 0.00 -1.46 0.00 0.00 175.22 174.89 2aaz n ALA 50 N 2.53 -2.33 -1.53 11.12 0.00 -0.31 -4.97 120.51 125.02 2aaz n ALA 50 Ca -0.18 -0.27 -0.29 0.00 0.00 0.00 0.00 53.44 52.69 2aaz n ALA 50 Cb 0.54 -2.96 0.12 0.00 0.00 0.00 0.00 19.45 17.14 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 -6.29 1.47 0.38 0.00 0.04 -1.26 -4.93 135.00 124.40 2aaz s PRO 51 Ca 0.28 0.43 -0.25 0.00 0.04 0.00 0.00 61.00 61.49 2aaz s PRO 51 Cb -0.11 -1.87 -0.12 0.00 0.04 0.00 0.00 34.50 32.45 2aaz s PRO 51 CO 0.88 -2.00 1.00 -2.30 0.04 0.00 0.00 177.00 174.61 2aaz n PRO 52 N -3.66 1.35 -1.37 0.56 -0.02 -1.26 -4.60 135.00 126.00 2aaz n PRO 52 Ca 0.07 0.48 -0.31 0.00 -2.02 0.00 0.00 63.50 61.71 2aaz n PRO 52 Cb 0.58 -1.97 0.08 0.00 -0.02 0.00 0.00 33.50 32.17 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 -0.68 4.69 0.09 2.55 1.04 -1.26 -4.88 113.70 115.25 2aaz s SER 53 Ca 0.61 1.83 -0.08 0.00 0.48 0.00 0.00 55.95 58.80 2aaz s SER 53 Cb -0.60 -2.52 -0.06 0.00 0.10 0.00 0.00 66.02 62.94 2aaz s SER 53 CO 0.58 -1.91 0.38 -0.36 0.98 0.00 0.00 173.24 172.91 2aaz s PHE 54 N -2.82 3.54 -0.05 5.02 0.08 -0.29 -4.92 117.98 118.53 2aaz s PHE 54 Ca 0.62 0.68 0.02 0.00 0.12 0.00 0.00 56.93 58.36 2aaz s PHE 54 Cb -0.17 -2.08 0.02 0.00 -0.57 0.00 0.00 43.02 40.21 2aaz s PHE 54 CO 0.53 0.50 -0.09 1.03 -0.10 0.00 0.00 175.22 177.09 2aaz s ARG 55 N -2.16 1.29 -0.06 0.44 0.52 -1.26 -1.04 118.95 116.68 2aaz s ARG 55 Ca 0.35 -0.27 0.02 0.00 -0.52 0.00 0.00 55.73 55.31 2aaz s ARG 55 Cb -0.13 -1.13 0.02 0.00 0.52 0.00 0.00 34.95 34.22 2aaz s ARG 55 CO 0.20 -0.02 -0.10 -0.06 0.02 0.00 0.00 175.30 175.34 2aaz s PHE 56 N 0.76 1.32 0.13 -0.53 0.08 0.08 -4.97 117.98 114.84 2aaz s PHE 56 Ca -0.13 -0.48 -0.30 0.00 0.12 0.00 0.00 56.93 56.14 2aaz s PHE 56 Cb -0.15 -1.00 -0.06 0.00 -0.57 0.00 0.00 43.02 41.24 2aaz s PHE 56 CO 0.02 -0.27 1.08 0.45 -0.10 0.00 0.00 175.22 176.40 2aaz s SER 57 N 0.78 7.29 -0.01 1.36 0.15 -1.26 -1.07 113.70 120.93 2aaz s SER 57 Ca -0.13 1.98 0.12 0.00 0.70 0.00 0.00 55.95 58.62 2aaz s SER 57 Cb -0.15 -2.59 0.34 0.00 -1.71 0.00 0.00 66.02 61.90 2aaz s SER 57 CO 0.02 -0.24 1.28 0.18 1.20 0.00 0.00 173.24 175.69 2aaz n LEU 58 N 2.87 3.06 -4.77 3.45 4.77 0.39 -4.75 117.00 122.01 2aaz n LEU 58 Ca 0.04 -2.08 -0.31 0.00 -0.03 0.00 0.00 56.01 53.63 2aaz n LEU 58 Cb 0.47 -0.27 0.09 0.00 -2.33 0.00 0.00 43.42 41.38 2aaz n LEU 58 CO 0.53 0.74 0.70 0.00 -1.33 0.00 0.00 177.39 178.03 2aaz s ALA 59 N -1.14 2.26 -1.49 -1.18 0.00 -1.22 -3.57 121.76 115.42 2aaz s ALA 59 Ca 0.26 0.17 -0.12 0.00 0.00 0.00 0.00 51.96 52.27 2aaz s ALA 59 Cb 0.14 -3.24 0.07 0.00 0.00 0.00 0.00 23.12 20.09 2aaz s ALA 59 CO 0.16 -1.72 1.00 -0.25 0.00 0.00 0.00 175.76 174.94 2aaz n ASP 60 N -3.48 -4.75 -1.99 0.00 8.00 -1.26 -1.73 116.55 111.33 2aaz n ASP 60 Ca 0.08 -0.74 -0.17 0.00 0.71 0.00 0.00 54.79 54.67 2aaz n ASP 60 Cb 0.53 -4.09 -0.04 0.00 -0.02 0.00 0.00 41.12 37.50 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 -2.88 -4.82 -4.75 -2.24 4.13 -1.25 -4.89 115.26 98.57 2aaz n ASN 61 Ca 0.01 0.24 -0.41 0.00 1.68 0.00 0.00 54.58 56.10 2aaz n ASN 61 Cb 0.54 -4.17 -0.04 0.00 -1.54 0.00 0.00 39.78 34.57 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 -2.67 3.62 -0.23 3.41 2.01 -0.71 -0.15 115.64 120.93 2aaz s THR 62 Ca 0.00 1.48 0.02 0.00 0.31 0.00 0.00 61.69 63.50 2aaz s THR 62 Cb 0.00 -3.95 0.05 0.00 0.01 0.00 0.00 72.50 68.61 2aaz s THR 62 CO 0.00 0.29 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.88 2aaz s LEU 63 N -0.80 2.85 -0.97 4.42 2.96 -0.55 -4.59 118.68 121.99 2aaz s LEU 63 Ca 0.48 -1.12 -0.17 0.00 -0.22 0.00 0.00 54.13 53.10 2aaz s LEU 63 Cb -0.31 -1.43 -0.10 0.00 0.50 0.00 0.00 46.19 44.85 2aaz s LEU 63 CO 0.38 -0.15 2.06 -0.81 -1.32 0.00 0.00 176.35 176.51 2aaz n PRO 64 N 4.55 1.97 -3.32 0.98 -0.04 -1.26 -3.78 135.00 134.10 2aaz n PRO 64 Ca -0.15 -1.96 -0.42 0.00 -0.04 0.00 0.00 63.50 60.93 2aaz n PRO 64 Cb 0.45 -2.92 -0.09 0.00 -0.04 0.00 0.00 33.50 30.90 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 1.18 4.70 0.28 1.53 2.96 -1.26 -4.28 118.68 123.79 2aaz s LEU 65 Ca 0.53 -0.50 -0.28 0.00 -0.22 0.00 0.00 54.13 53.66 2aaz s LEU 65 Cb 0.14 -2.41 -0.14 0.00 0.50 0.00 0.00 46.19 44.27 2aaz s LEU 65 CO 0.04 -0.53 0.91 0.18 -1.32 0.00 0.00 176.35 175.63 2aaz n LEU 66 N 5.60 1.21 -0.00 -0.68 4.77 -1.26 -4.74 117.00 121.91 2aaz n LEU 66 Ca -0.07 1.16 0.04 0.00 -0.03 0.00 0.00 56.01 57.12 2aaz n LEU 66 Cb 0.48 -1.22 -0.06 0.00 -2.33 0.00 0.00 43.42 40.29 2aaz n LEU 66 CO 0.45 -1.72 -0.08 0.35 -1.33 0.00 0.00 177.39 175.06 2aaz n THR 67 N 0.14 0.00 1.47 -5.08 -2.24 -1.26 -4.50 114.28 102.82 2aaz n THR 67 Ca 0.11 -0.27 0.12 0.00 -2.27 0.00 0.00 64.05 61.74 2aaz n THR 67 Cb 0.31 0.93 0.70 0.00 -2.10 0.00 0.00 70.33 70.17 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 -0.82 114.28 109.48 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 67.71 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 -2.03 1.09 -0.11 -0.78 -2.85 -1.26 -4.64 119.74 109.16 2aaz s LYS 69 Ca 0.35 -0.02 -0.30 0.00 -1.00 0.00 0.00 55.97 55.01 2aaz s LYS 69 Cb 0.16 0.51 -0.03 0.00 -2.06 0.00 0.00 37.83 36.42 2aaz s LYS 69 CO 0.28 -0.40 1.26 0.50 0.10 0.00 0.00 175.35 177.09 2aaz s ARG 70 N -2.14 4.28 -0.16 1.78 3.52 -1.11 -4.58 118.95 120.55 2aaz s ARG 70 Ca -0.06 1.70 -0.08 0.00 -0.13 0.00 0.00 55.73 57.17 2aaz s ARG 70 Cb -0.00 -3.68 -0.04 0.00 -1.56 0.00 0.00 34.95 29.66 2aaz s ARG 70 CO 0.01 -0.61 0.13 0.08 -0.81 0.00 0.00 175.30 174.10 2aaz s VAL 71 N 2.96 5.42 -0.99 7.11 1.01 -1.26 -4.76 120.40 129.90 2aaz s VAL 71 Ca 0.56 0.19 -0.23 0.00 0.00 0.00 0.00 61.98 62.50 2aaz s VAL 71 Cb -0.24 -3.41 -0.13 0.00 0.00 0.00 0.00 36.38 32.60 2aaz s VAL 71 CO 0.19 0.53 1.92 0.33 0.00 0.00 0.00 175.10 178.07 2aaz n PHE 72 N 2.73 2.30 -0.14 5.22 -0.00 -1.26 -4.78 117.46 121.52 2aaz n PHE 72 Ca -0.18 -1.54 -0.04 0.00 -0.00 0.00 0.00 57.45 55.69 2aaz n PHE 72 Cb 0.54 -2.22 0.02 0.00 -0.00 0.00 0.00 39.48 37.81 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 16.39 -0.64 -1.45 -2.13 5.85 -2.00 -0.70 115.31 130.64 2aaz h LEU 73 Ca 0.29 0.16 0.10 0.00 0.84 0.00 0.00 57.88 59.27 2aaz h LEU 73 Cb 0.83 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 42.18 2aaz h LEU 73 CO 1.52 -0.22 0.48 -0.09 -0.34 0.00 0.00 178.44 179.79 2aaz h ARG 74 N -0.08 0.60 -0.49 1.25 2.43 -2.00 -0.39 114.38 115.70 2aaz h ARG 74 Ca 0.22 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.25 2aaz h ARG 74 Cb 0.43 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 2aaz h ARG 74 CO -0.52 0.40 -0.13 0.78 -1.51 0.00 0.00 179.97 178.98 2aaz h GLY 75 N 0.62 0.99 0.80 2.80 0.00 -1.54 0.19 103.07 106.92 2aaz h GLY 75 Ca 0.33 -0.80 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 2aaz h GLY 75 CO -0.12 0.73 -0.03 -2.08 0.00 0.00 0.00 176.54 175.04 2aaz h VAL 76 N 0.82 1.07 -0.28 4.60 2.07 -0.57 -1.59 116.25 122.36 2aaz h VAL 76 Ca 0.13 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2aaz h VAL 76 Cb 0.67 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2aaz h VAL 76 CO 0.05 0.12 0.18 0.40 0.02 0.00 0.00 177.57 178.34 2aaz h ILE 77 N -0.30 1.08 -0.37 4.57 2.04 -1.13 -1.23 117.51 122.17 2aaz h ILE 77 Ca -0.01 -0.15 0.03 0.00 1.00 0.00 0.00 64.86 65.73 2aaz h ILE 77 Cb 0.26 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 2aaz h ILE 77 CO 0.02 0.07 0.18 0.00 0.00 0.00 0.00 178.15 178.42 2aaz h ALA 78 N 1.10 0.46 -0.85 1.87 0.00 -0.94 -1.20 119.26 119.69 2aaz h ALA 78 Ca 0.10 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2aaz h ALA 78 Cb -0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2aaz h ALA 78 CO -0.02 -0.18 0.43 1.49 0.00 0.00 0.00 179.25 180.97 2aaz h GLU 79 N 0.38 1.20 -0.31 0.00 4.81 -1.05 -1.66 114.58 117.95 2aaz h GLU 79 Ca 0.16 -0.16 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 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 0.90 0.06 1.25 -0.73 0.00 0.00 179.01 180.38 2aaz h LEU 80 N 1.20 0.48 -1.43 1.64 5.85 -0.77 -0.11 115.31 122.18 2aaz h LEU 80 Ca 0.30 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.71 2aaz h LEU 80 Cb 0.08 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 2aaz h LEU 80 CO -0.04 0.61 -0.26 -0.07 -0.34 0.00 0.00 178.44 178.34 2aaz h LEU 81 N 0.34 0.00 -0.13 2.25 3.38 -1.10 -0.95 115.31 119.10 2aaz h LEU 81 Ca 0.09 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 2aaz h LEU 81 Cb 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2aaz h LEU 81 CO 0.00 0.26 -0.10 -0.25 0.09 0.00 0.00 178.44 178.45 2aaz h TRP 82 N 0.00 0.36 0.20 1.13 7.01 -0.80 -1.35 115.95 122.50 2aaz h TRP 82 Ca -0.00 -0.10 0.01 0.00 2.11 0.00 0.00 58.89 60.90 2aaz h TRP 82 Cb 0.58 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.54 2aaz h TRP 82 CO 0.00 0.68 -0.24 0.74 -2.79 0.00 0.00 178.44 176.83 2aaz h PHE 83 N -0.06 -0.62 -0.81 2.65 0.04 -0.31 -2.55 116.94 115.27 2aaz h PHE 83 Ca 0.03 0.01 0.15 0.00 2.80 0.00 0.00 57.97 60.95 2aaz h PHE 83 Cb 0.60 0.25 -0.10 0.00 2.20 0.00 0.00 35.95 38.90 2aaz h PHE 83 CO 0.08 -0.34 0.37 0.28 -0.60 0.00 0.00 178.31 178.09 2aaz h VAL 84 N -0.48 0.67 0.00 -0.55 2.07 -1.15 0.91 116.25 117.72 2aaz h VAL 84 Ca 0.01 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.35 2aaz h VAL 84 Cb 0.47 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2aaz h VAL 84 CO -0.08 0.09 0.00 -1.54 0.02 0.00 0.00 177.57 176.07 2aaz n SER 85 N -4.95 0.61 0.00 0.57 3.41 -0.52 -4.84 113.62 107.90 2aaz n SER 85 Ca 0.16 0.71 0.00 0.00 -0.26 0.00 0.00 58.87 59.48 2aaz n SER 85 Cb 0.45 -0.81 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 -0.60 0.79 3.78 5.00 0.00 0.32 -5.01 105.19 109.46 2aaz n GLY 86 Ca 0.01 0.00 -0.37 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 0.06 1.00 -3.36 0.00 -2.24 -1.26 -4.55 114.28 103.94 2aaz n THR 88 Ca 0.04 -1.14 -0.43 0.00 -2.27 0.00 0.00 64.05 60.26 2aaz n THR 88 Cb 0.48 0.31 -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 -1.52 6.18 0.62 3.42 3.68 -1.26 -2.61 116.67 125.18 2aaz s ASP 89 Ca 0.11 -0.66 0.36 0.00 2.13 0.00 0.00 52.55 54.49 2aaz s ASP 89 Cb 0.10 -2.21 2.08 0.00 -1.45 0.00 0.00 42.92 41.44 2aaz s ASP 89 CO 0.01 -0.52 2.31 0.00 0.13 0.00 0.00 175.17 177.09 2aaz h ALA 90 N 8.68 1.31 0.00 3.66 0.00 -1.35 -1.58 119.26 129.98 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 0.00 -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 0.47 116.57 116.94 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 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 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 -1.68 -0.79 114.93 118.49 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 0.15 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.76 2aaz h MET 92 CO 0.01 0.00 -2.12 1.28 1.06 0.00 0.00 176.91 177.14 2aaz n LEU 93 N -2.73 2.28 0.22 1.22 4.77 0.07 -4.23 117.00 118.61 2aaz n LEU 93 Ca 0.01 0.23 0.06 0.00 -0.03 0.00 0.00 56.01 56.28 2aaz n LEU 93 Cb 0.28 -0.93 0.50 0.00 -2.33 0.00 0.00 43.42 40.94 2aaz n LEU 93 CO 0.24 0.63 0.87 0.77 -1.33 0.00 0.00 177.39 178.57 2aaz h SER 94 N -0.59 0.00 0.63 -1.43 4.64 -0.41 -0.08 113.55 116.30 2aaz h SER 94 Ca -0.54 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.75 2aaz h SER 94 Cb 1.68 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.76 2aaz h SER 94 CO -0.21 0.22 -0.15 0.77 -0.87 0.00 0.00 176.83 176.59 2aaz h SER 95 N 0.00 0.00 -0.53 4.97 4.64 -1.34 -2.03 113.55 119.25 2aaz h SER 95 Ca -0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 2aaz h SER 95 Cb 0.41 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.42 2aaz h SER 95 CO 0.03 0.15 0.12 0.00 -0.87 0.00 0.00 176.83 176.26 2aaz n GLN 96 N -3.46 3.35 -1.49 4.77 10.64 -0.64 -4.95 117.38 125.60 2aaz n GLN 96 Ca -0.01 -3.05 -0.03 0.00 -1.83 0.00 0.00 57.00 52.08 2aaz n GLN 96 Cb 0.31 -2.06 -0.01 0.00 -0.86 0.00 0.00 30.24 27.62 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 -0.32 0.47 3.03 2.61 0.00 -0.76 -5.03 105.19 105.18 2aaz n GLY 97 Ca 0.33 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.14 1.97 -0.20 1.61 1.01 -0.14 -4.98 120.40 117.53 2aaz s VAL 98 Ca 0.00 -1.52 0.16 0.00 0.00 0.00 0.00 61.98 60.62 2aaz s VAL 98 Cb 0.00 -2.13 0.59 0.00 0.00 0.00 0.00 36.38 34.84 2aaz s VAL 98 CO 0.00 -0.06 1.50 0.61 0.00 0.00 0.00 175.10 177.14 2aaz n GLY 99 N 4.50 3.86 0.33 4.51 0.00 -1.26 -1.69 105.19 115.45 2aaz n GLY 99 Ca -0.13 -1.03 0.16 0.00 0.00 0.00 0.00 46.02 45.02 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 2.22 0.56 -0.39 -0.61 3.07 -1.95 -0.91 117.51 119.49 2aaz h ILE 100 Ca 0.01 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.42 2aaz h ILE 100 Cb 1.58 0.86 0.00 0.00 -0.27 0.00 0.00 36.82 38.99 2aaz h ILE 100 CO 0.30 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 178.19 2aaz n TRP 101 N -3.95 0.51 -0.06 0.16 7.02 -1.26 -4.47 117.44 115.40 2aaz n TRP 101 Ca 0.02 -0.32 -0.02 0.00 -1.02 0.00 0.00 57.50 56.15 2aaz n TRP 101 Cb 0.31 -0.01 0.23 0.00 -2.42 0.00 0.00 31.31 29.42 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 3.57 0.63 -0.41 -0.99 3.45 -1.49 -1.88 116.42 119.30 2aaz h ASP 102 Ca 0.00 -0.13 -0.02 0.00 0.43 0.00 0.00 57.03 57.30 2aaz h ASP 102 Cb 0.86 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 39.45 2aaz h ASP 102 CO 0.00 0.69 0.17 1.23 -1.57 0.00 0.00 179.24 179.76 2aaz h GLY 103 N 0.92 0.66 0.27 2.75 0.00 -1.78 -1.63 103.07 104.27 2aaz h GLY 103 Ca 0.13 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.10 2aaz h GLY 103 CO 0.01 0.34 -0.20 0.70 0.00 0.00 0.00 176.54 177.39 2aaz n ASN 104 N -4.64 0.98 -0.59 0.19 4.13 -1.19 -3.68 115.26 110.46 2aaz n ASN 104 Ca 0.00 -0.91 0.08 0.00 1.68 0.00 0.00 54.58 55.44 2aaz n ASN 104 Cb 0.14 0.08 0.05 0.00 -1.54 0.00 0.00 39.78 38.51 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 0.19 3.76 7.41 0.00 -0.71 -4.54 105.19 112.60 2aaz n GLY 105 Ca 0.13 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.58 5.31 0.25 1.61 1.04 -0.63 -0.16 113.70 119.54 2aaz s SER 106 Ca 0.18 2.36 -0.03 0.00 0.48 0.00 0.00 55.95 58.93 2aaz s SER 106 Cb 0.14 -2.60 0.42 0.00 0.10 0.00 0.00 66.02 64.08 2aaz s SER 106 CO 0.28 -1.51 1.82 0.50 0.98 0.00 0.00 173.24 175.30 2aaz h LYS 107 N 0.98 0.82 -0.72 4.02 1.63 -1.93 -1.07 116.57 120.30 2aaz h LYS 107 Ca -0.50 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.23 2aaz h LYS 107 Cb 1.29 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 32.70 2aaz h LYS 107 CO 0.56 0.54 0.37 1.49 -3.45 0.00 0.00 179.45 178.96 2aaz h GLU 108 N 0.84 1.01 -0.10 1.90 4.81 -1.95 -2.34 114.58 118.74 2aaz h GLU 108 Ca 0.41 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 59.45 2aaz h GLU 108 Cb 0.37 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2aaz h GLU 108 CO -0.24 0.77 -0.20 0.35 -0.73 0.00 0.00 179.01 178.96 2aaz h PHE 109 N 0.99 0.40 -0.43 0.92 3.57 -1.65 -2.57 116.94 118.17 2aaz h PHE 109 Ca 0.25 -0.14 0.07 0.00 3.53 0.00 0.00 57.97 61.68 2aaz h PHE 109 Cb 0.07 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.67 2aaz h PHE 109 CO 0.00 0.81 0.05 -0.07 -2.23 0.00 0.00 178.31 176.86 2aaz h LEU 110 N -0.13 -0.08 -1.36 0.59 3.38 -1.20 0.03 115.31 116.55 2aaz h LEU 110 Ca 0.00 0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 2aaz h LEU 110 Cb 0.78 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2aaz h LEU 110 CO 0.04 -0.01 -0.02 -0.33 0.09 0.00 0.00 178.44 178.22 2aaz h GLU 111 N 0.16 0.40 -0.65 1.13 5.08 -1.48 0.42 114.58 119.65 2aaz h GLU 111 Ca 0.21 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 2aaz h GLU 111 Cb 0.29 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2aaz h GLU 111 CO -0.31 0.44 0.25 -0.22 -1.00 0.00 0.00 179.01 178.17 2aaz h LYS 112 N 0.39 0.96 -0.71 2.33 3.64 -0.61 -2.71 116.57 119.86 2aaz h LYS 112 Ca 0.09 -0.16 -0.07 0.00 -1.27 0.00 0.00 60.65 59.24 2aaz h LYS 112 Cb 0.29 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 2aaz h LYS 112 CO 0.01 0.79 0.08 1.33 -2.27 0.00 0.00 179.45 179.39 2aaz n VAL 113 N -4.30 2.37 -1.33 2.00 0.24 -0.51 -4.91 118.33 111.89 2aaz n VAL 113 Ca 0.06 -1.22 -0.04 0.00 -2.04 0.00 0.00 64.34 61.09 2aaz n VAL 113 Cb 0.18 -0.36 -0.01 0.00 -1.47 0.00 0.00 33.84 32.18 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 0.30 0.60 2.17 7.63 0.00 -1.02 -4.95 105.19 109.92 2aaz n GLY 114 Ca 0.27 -0.84 -0.26 0.00 0.00 0.00 0.00 46.02 45.19 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 -0.51 5.33 0.25 0.99 4.77 0.14 -4.79 117.00 123.18 2aaz n LEU 115 Ca -0.04 -4.78 0.17 0.00 -0.03 0.00 0.00 56.01 51.32 2aaz n LEU 115 Cb 0.23 -0.47 0.73 0.00 -2.33 0.00 0.00 43.42 41.58 2aaz n LEU 115 CO 0.06 2.04 0.99 1.23 -1.33 0.00 0.00 177.39 180.38 2aaz h GLY 116 N 2.26 0.00 1.25 -0.72 0.00 -1.81 -2.66 103.07 101.39 2aaz h GLY 116 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 2aaz h GLY 116 CO 0.91 0.00 0.00 -2.39 0.00 0.00 0.00 176.54 175.06 2aaz n HIS 117 N -2.84 0.00 -3.83 5.60 1.44 -1.26 -4.81 115.22 109.52 2aaz n HIS 117 Ca 0.00 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.41 2aaz n HIS 117 Cb 0.23 -0.12 -0.04 0.00 0.12 0.00 0.00 29.99 30.17 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 -2.25 3.50 0.60 -1.40 0.52 -1.00 -5.08 118.95 113.83 2aaz s ARG 118 Ca 0.36 -0.35 -0.14 0.00 -0.52 0.00 0.00 55.73 55.08 2aaz s ARG 118 Cb 0.19 -2.95 -0.04 0.00 0.52 0.00 0.00 34.95 32.67 2aaz s ARG 118 CO 0.38 0.53 1.03 -0.98 0.02 0.00 0.00 175.30 176.28 2aaz s ARG 119 N -2.76 3.48 0.28 3.54 1.70 -1.26 -4.96 118.95 118.97 2aaz s ARG 119 Ca 0.37 0.99 -0.30 0.00 -0.47 0.00 0.00 55.73 56.32 2aaz s ARG 119 Cb -0.12 -2.06 -0.13 0.00 -0.57 0.00 0.00 34.95 32.07 2aaz s ARG 119 CO 0.27 -0.66 1.42 -1.91 -1.08 0.00 0.00 175.30 173.34 2aaz n GLU 120 N -2.27 2.21 0.00 3.89 2.13 -1.26 -1.92 120.64 123.42 2aaz n GLU 120 Ca 0.07 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.68 2aaz n GLU 120 Cb 0.54 -2.45 0.00 0.00 0.27 0.00 0.00 31.44 29.79 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 1.79 2.58 3.53 8.31 0.00 0.78 -4.86 105.19 117.32 2aaz n GLY 121 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.50 6.51 0.56 1.61 -1.08 -0.81 -0.83 116.67 121.12 2aaz s ASP 122 Ca 0.00 -1.55 0.34 0.00 -0.52 0.00 0.00 52.55 50.83 2aaz s ASP 122 Cb 0.00 -2.52 1.48 0.00 -1.46 0.00 0.00 42.92 40.42 2aaz s ASP 122 CO 0.00 -1.40 2.03 -0.07 0.52 0.00 0.00 175.17 176.25 2aaz h LEU 123 N 12.09 0.00 0.00 -1.34 3.38 -1.83 -3.46 115.31 124.15 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 1.32 0.02 0.00 0.61 0.09 0.00 0.00 178.44 180.48 2aaz n GLY 124 N -0.12 -1.37 2.59 0.83 0.00 -1.26 -1.23 105.19 104.62 2aaz n GLY 124 Ca 0.00 -2.10 -0.34 0.00 0.00 0.00 0.00 46.02 43.58 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 2.72 -0.80 1.61 -0.04 -1.26 -4.80 135.00 132.44 2aaz n PRO 125 Ca 0.00 -1.96 -0.06 0.00 -0.04 0.00 0.00 63.50 61.44 2aaz n PRO 125 Cb 0.00 -2.77 0.03 0.00 -0.04 0.00 0.00 33.50 30.72 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 4.36 0.00 0.00 0.52 0.24 -1.26 -4.48 118.33 117.71 2aaz n VAL 126 Ca 0.59 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.59 2aaz n VAL 126 Cb 0.24 -1.52 0.00 0.00 -1.47 0.00 0.00 33.84 31.09 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 -1.99 0.00 -0.34 6.34 4.01 -1.26 -0.56 117.16 123.35 2aaz n TYR 127 Ca 0.04 0.00 0.18 0.00 -0.16 0.00 0.00 57.90 57.95 2aaz n TYR 127 Cb 0.13 0.00 0.39 0.00 -0.31 0.00 0.00 39.34 39.55 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 1.80 0.93 2.72 0.00 -1.80 -0.47 103.07 106.24 2aaz h GLY 128 Ca 0.00 -0.30 -0.08 0.00 0.00 0.00 0.00 47.33 46.94 2aaz h GLY 128 CO 0.00 -0.20 -0.13 -2.75 0.00 0.00 0.00 176.54 173.46 2aaz h PHE 129 N 0.59 0.74 -0.61 5.60 3.04 -0.86 -2.31 116.94 123.12 2aaz h PHE 129 Ca 0.63 -0.18 -0.08 0.00 3.98 0.00 0.00 57.97 62.32 2aaz h PHE 129 Cb 1.21 -0.17 -0.02 0.00 2.56 0.00 0.00 35.95 39.53 2aaz h PHE 129 CO -0.01 0.85 0.06 1.96 -2.02 0.00 0.00 178.31 179.16 2aaz h GLN 130 N 0.42 1.04 -0.75 1.11 1.08 -1.07 0.42 115.11 117.36 2aaz h GLN 130 Ca 0.07 -0.30 0.04 0.00 -1.45 0.00 0.00 58.65 57.01 2aaz h GLN 130 Cb 0.64 -0.11 -0.05 0.00 -0.05 0.00 0.00 27.48 27.91 2aaz h GLN 130 CO 0.04 0.99 0.47 -1.49 -0.95 0.00 0.00 178.83 177.89 2aaz h TRP 131 N 0.95 0.88 0.00 2.96 4.06 -1.00 -2.38 115.95 121.42 2aaz h TRP 131 Ca 0.18 0.02 0.00 0.00 2.06 0.00 0.00 58.89 61.16 2aaz h TRP 131 Cb 0.48 -0.29 0.00 0.00 -1.00 0.00 0.00 29.16 28.35 2aaz h TRP 131 CO 0.04 0.50 -1.01 0.54 -3.56 0.00 0.00 178.44 174.94 2aaz n ARG 132 N -4.64 1.60 -1.69 0.49 5.12 -0.88 -1.21 116.66 115.46 2aaz n ARG 132 Ca 0.09 -0.04 0.03 0.00 -1.93 0.00 0.00 57.85 55.99 2aaz n ARG 132 Cb 0.10 -1.25 0.02 0.00 -1.16 0.00 0.00 32.46 30.17 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 -1.56 0.17 -1.62 -1.55 8.25 0.15 -3.52 115.22 115.54 2aaz n HIS 133 Ca 0.01 -0.77 -0.51 0.00 -0.26 0.00 0.00 57.72 56.19 2aaz n HIS 133 Cb 0.28 -0.10 -0.06 0.00 1.12 0.00 0.00 29.99 31.24 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 0.27 1.73 0.00 4.41 -0.00 -0.90 -1.19 117.46 121.78 2aaz n PHE 134 Ca 0.04 0.54 0.00 0.00 -0.00 0.00 0.00 57.45 58.03 2aaz n PHE 134 Cb 1.06 -2.39 0.00 0.00 -0.00 0.00 0.00 39.48 38.15 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 2.87 3.24 3.74 7.13 0.00 -1.26 -0.44 105.19 120.46 2aaz n GLY 135 Ca 0.19 0.00 -0.33 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 -2.57 2.14 -0.09 4.61 0.00 -0.33 -4.90 121.76 120.62 2aaz s ALA 136 Ca 0.00 0.66 -0.29 0.00 0.00 0.00 0.00 51.96 52.33 2aaz s ALA 136 Cb 0.00 -3.40 -0.02 0.00 0.00 0.00 0.00 23.12 19.71 2aaz s ALA 136 CO 0.00 -1.82 0.97 -2.00 0.00 0.00 0.00 175.76 172.91 2aaz s GLU 137 N -4.21 4.44 -0.15 0.00 2.12 -1.26 -5.02 118.70 114.63 2aaz s GLU 137 Ca 0.69 1.34 -0.14 0.00 0.36 0.00 0.00 54.97 57.22 2aaz s GLU 137 Cb -0.24 -3.52 -0.05 0.00 0.26 0.00 0.00 34.13 30.58 2aaz s GLU 137 CO 0.47 -0.24 0.32 -0.47 -0.54 0.00 0.00 175.26 174.81 2aaz s TYR 138 N 1.74 3.48 0.00 5.30 5.04 -1.26 -4.98 117.35 126.67 2aaz s TYR 138 Ca 0.48 0.66 0.00 0.00 -2.44 0.00 0.00 57.07 55.77 2aaz s TYR 138 Cb -0.19 -2.36 0.00 0.00 0.35 0.00 0.00 41.96 39.76 2aaz s TYR 138 CO 0.20 0.26 0.00 0.25 -1.34 0.00 0.00 175.55 174.92 2aaz n THR 139 N 3.47 0.00 -3.99 4.34 -2.24 -1.26 -5.08 114.28 109.52 2aaz n THR 139 Ca -0.11 0.20 -0.09 0.00 -2.27 0.00 0.00 64.05 61.77 2aaz n THR 139 Cb 0.52 -1.14 -0.03 0.00 -2.10 0.00 0.00 70.33 67.58 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 -1.97 -0.60 0.08 3.42 3.85 -1.26 -5.04 116.55 115.03 2aaz n ASP 140 Ca 0.00 -2.14 0.11 0.00 -0.71 0.00 0.00 54.79 52.05 2aaz n ASP 140 Cb 0.00 1.21 0.43 0.00 -1.35 0.00 0.00 41.12 41.41 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 -1.71 1.76 1.15 2.12 0.00 -1.26 -2.63 120.51 119.94 2aaz n ALA 141 Ca -0.07 0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.51 2aaz n ALA 141 Cb 0.33 -1.35 0.25 0.00 0.00 0.00 0.00 19.45 18.68 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 -1.97 1.21 -4.58 0.00 10.43 -1.26 -4.81 116.55 115.57 2aaz n ASP 142 Ca 0.03 -0.98 -0.35 0.00 2.57 0.00 0.00 54.79 56.06 2aaz n ASP 142 Cb 0.24 0.27 0.09 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 1.38 -0.73 3.43 0.44 0.00 -1.08 -4.94 105.19 103.69 2aaz n GLY 143 Ca 0.10 -0.38 -0.44 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.66 6.21 0.00 1.61 2.15 -1.26 -4.87 116.67 118.85 2aaz s ASP 144 Ca 0.71 -1.05 0.12 0.00 0.43 0.00 0.00 52.55 52.76 2aaz s ASP 144 Cb -0.34 -2.28 0.13 0.00 -0.30 0.00 0.00 42.92 40.14 2aaz s ASP 144 CO 0.53 -0.91 0.95 -1.22 -0.17 0.00 0.00 175.17 174.35 2aaz n TYR 145 N 6.10 0.08 -1.66 -5.34 4.01 -1.26 -4.95 117.16 114.13 2aaz n TYR 145 Ca -0.08 -0.07 -0.49 0.00 -0.16 0.00 0.00 57.90 57.10 2aaz n TYR 145 Cb 0.45 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.42 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 0.69 1.88 -0.97 -0.72 4.81 -1.26 -0.32 118.16 122.27 2aaz n LYS 146 Ca 0.08 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.20 2aaz n LYS 146 Cb 0.33 -2.45 0.00 0.00 0.02 0.00 0.00 35.03 32.93 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 3.67 0.47 3.63 3.14 0.00 -1.26 -5.01 105.19 109.83 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 -0.43 2.71 0.25 1.61 1.02 0.56 -5.02 119.74 120.44 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 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 2aaz s LYS 148 CO 0.00 0.63 0.00 0.41 -0.92 0.00 0.00 175.35 175.47 2aaz n GLY 149 N 1.74 -2.17 3.65 -3.33 0.00 -1.26 -4.38 105.19 99.43 2aaz n GLY 149 Ca -0.16 -1.47 -0.40 0.00 0.00 0.00 0.00 46.02 43.99 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 5.07 -1.06 1.61 1.01 0.41 -4.74 120.40 121.77 2aaz s VAL 150 Ca 0.00 1.02 -0.18 0.00 0.00 0.00 0.00 61.98 62.82 2aaz s VAL 150 Cb 0.00 -3.87 0.13 0.00 0.00 0.00 0.00 36.38 32.63 2aaz s VAL 150 CO 0.00 0.14 1.32 -0.62 0.00 0.00 0.00 175.10 175.95 2aaz s ASP 151 N 1.22 6.77 0.27 3.32 3.68 -1.23 -2.29 116.67 128.41 2aaz s ASP 151 Ca 0.25 -2.30 -0.04 0.00 2.13 0.00 0.00 52.55 52.60 2aaz s ASP 151 Cb -0.16 -2.44 0.34 0.00 -1.45 0.00 0.00 42.92 39.21 2aaz s ASP 151 CO 0.10 -1.04 1.89 1.56 0.13 0.00 0.00 175.17 177.81 2aaz h GLN 152 N 8.33 1.10 -0.09 4.34 4.20 -1.42 -2.47 115.11 129.10 2aaz h GLN 152 Ca 0.24 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.82 2aaz h GLN 152 Cb 0.96 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 28.52 2aaz h GLN 152 CO 1.23 0.81 0.03 1.25 -0.67 0.00 0.00 178.83 181.48 2aaz h LEU 153 N 1.11 0.14 -1.10 1.46 5.85 -1.84 -0.74 115.31 120.19 2aaz h LEU 153 Ca 0.28 -0.19 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 2aaz h LEU 153 Cb 0.03 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2aaz h LEU 153 CO -0.04 0.29 -0.06 -0.61 -0.34 0.00 0.00 178.44 177.68 2aaz h GLN 154 N -0.03 0.56 -0.67 1.25 5.75 -1.86 -2.12 115.11 117.99 2aaz h GLN 154 Ca 0.03 -0.15 -0.05 0.00 -0.15 0.00 0.00 58.65 58.33 2aaz h GLN 154 Cb 0.21 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 2aaz h GLN 154 CO -0.00 0.63 0.22 -0.09 -2.65 0.00 0.00 178.83 176.94 2aaz h ARG 155 N 0.53 1.02 -0.39 1.69 9.65 -1.17 -0.15 114.38 125.56 2aaz h ARG 155 Ca 0.10 -0.20 -0.00 0.00 -1.10 0.00 0.00 59.98 58.78 2aaz h ARG 155 Cb 0.44 -0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 28.84 2aaz h ARG 155 CO 0.02 0.87 0.24 0.28 2.80 0.00 0.00 179.97 184.18 2aaz h VAL 156 N 0.99 1.13 0.02 0.20 2.07 -0.60 -0.17 116.25 119.89 2aaz h VAL 156 Ca 0.22 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 2aaz h VAL 156 Cb 0.26 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2aaz h VAL 156 CO -0.01 0.13 -0.01 0.40 0.02 0.00 0.00 177.57 178.09 2aaz h ILE 157 N 0.51 0.99 -0.99 4.57 1.08 -0.85 -1.30 117.51 121.53 2aaz h ILE 157 Ca 0.14 -0.04 0.01 0.00 -0.39 0.00 0.00 64.86 64.58 2aaz h ILE 157 Cb -0.00 1.02 -0.05 0.00 -3.07 0.00 0.00 36.82 34.72 2aaz h ILE 157 CO -0.03 0.01 0.66 0.44 -0.69 0.00 0.00 178.15 178.54 2aaz h ASP 158 N -0.05 1.13 -0.39 1.72 3.45 -0.86 -2.35 116.42 119.06 2aaz h ASP 158 Ca -0.00 -0.03 -0.15 0.00 0.43 0.00 0.00 57.03 57.28 2aaz h ASP 158 Cb 0.04 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.52 2aaz h ASP 158 CO 0.00 0.81 -0.34 0.74 -1.57 0.00 0.00 179.24 178.89 2aaz h THR 159 N 1.33 1.27 -0.72 0.35 2.02 -0.82 -0.56 112.91 115.77 2aaz h THR 159 Ca 0.37 -1.51 -0.04 0.00 0.77 0.00 0.00 66.41 66.01 2aaz h THR 159 Cb -0.13 1.35 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 2aaz h THR 159 CO -0.09 0.51 0.31 0.40 0.37 0.00 0.00 175.52 177.02 2aaz h ILE 160 N 0.74 1.24 0.06 3.11 2.04 -1.00 0.26 117.51 123.96 2aaz h ILE 160 Ca 0.07 -0.73 -0.26 0.00 1.00 0.00 0.00 64.86 64.94 2aaz h ILE 160 Cb 0.93 0.35 0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2aaz h ILE 160 CO 0.09 0.30 -1.07 0.11 0.00 0.00 0.00 178.15 177.58 2aaz h LYS 161 N 1.04 0.61 0.00 2.37 1.57 -1.32 -3.32 116.57 117.53 2aaz h LYS 161 Ca 0.25 -0.74 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 2aaz h LYS 161 Cb 0.16 0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2aaz h LYS 161 CO -0.03 1.32 -1.39 0.09 -0.57 0.00 0.00 179.45 178.87 2aaz n ASN 162 N -3.89 0.98 -2.85 0.86 3.02 -0.23 -4.77 115.26 108.39 2aaz n ASN 162 Ca -0.12 -0.34 -0.11 0.00 -0.03 0.00 0.00 54.58 53.97 2aaz n ASN 162 Cb 0.90 1.48 0.05 0.00 -0.61 0.00 0.00 39.78 41.59 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 -1.82 -1.80 -0.23 6.41 5.15 0.86 -5.03 115.26 118.80 2aaz n ASN 163 Ca -0.01 -3.40 0.23 0.00 -0.60 0.00 0.00 54.58 50.80 2aaz n ASN 163 Cb 0.37 1.29 0.59 0.00 -0.53 0.00 0.00 39.78 41.50 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 3.38 0.25 -0.00 1.20 0.13 -1.49 -1.53 132.00 133.94 2aaz h PRO 164 Ca -0.07 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2aaz h PRO 164 Cb 1.04 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2aaz h PRO 164 CO 0.27 0.17 0.00 0.25 -0.23 0.00 0.00 178.00 178.46 2aaz n THR 165 N -4.44 0.00 -1.63 1.56 -2.24 -1.26 -4.24 114.28 102.02 2aaz n THR 165 Ca 0.20 -0.02 -0.38 0.00 -2.27 0.00 0.00 64.05 61.58 2aaz n THR 165 Cb 0.81 -0.42 0.05 0.00 -2.10 0.00 0.00 70.33 68.67 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 -0.91 1.03 -0.92 3.42 -0.08 -0.58 -4.91 116.55 113.60 2aaz n ASP 166 Ca 0.23 0.83 0.07 0.00 -1.51 0.00 0.00 54.79 54.41 2aaz n ASP 166 Cb 0.12 -1.41 0.23 0.00 2.34 0.00 0.00 41.12 42.40 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 -1.03 3.07 -0.59 -0.67 1.74 -1.26 -4.51 116.66 113.41 2aaz n ARG 167 Ca 0.13 -2.52 0.06 0.00 -0.77 0.00 0.00 57.85 54.76 2aaz n ARG 167 Cb 0.47 -1.61 0.20 0.00 -1.02 0.00 0.00 32.46 30.50 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 0.25 1.52 -2.47 5.56 3.00 -1.26 -4.93 116.66 118.33 2aaz n ARG 168 Ca 0.18 -3.21 -0.43 0.00 -0.01 0.00 0.00 57.85 54.38 2aaz n ARG 168 Cb 0.70 -1.56 0.00 0.00 0.00 0.00 0.00 32.46 31.59 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 -1.10 3.89 -4.79 0.55 5.41 -1.26 -4.91 119.36 117.15 2aaz n ILE 169 Ca 0.18 -3.97 -0.31 0.00 1.00 0.00 0.00 62.75 59.65 2aaz n ILE 169 Cb 0.70 -2.38 -0.13 0.00 -0.71 0.00 0.00 39.64 37.11 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 4.09 2.82 -0.21 1.39 -1.09 -1.26 -1.43 121.20 125.51 2aaz s ILE 170 Ca 0.53 -1.03 -0.00 0.00 -2.23 0.00 0.00 60.65 57.92 2aaz s ILE 170 Cb 0.05 -2.15 0.05 0.00 -1.58 0.00 0.00 42.46 38.84 2aaz s ILE 170 CO 0.06 0.44 -0.04 -0.22 -1.23 0.00 0.00 174.94 173.95 2aaz s LEU 171 N -1.15 2.03 0.00 2.97 2.96 -0.56 -4.87 118.68 120.06 2aaz s LEU 171 Ca 0.13 -0.96 0.04 0.00 -0.22 0.00 0.00 54.13 53.12 2aaz s LEU 171 Cb -0.10 -0.99 -0.01 0.00 0.50 0.00 0.00 46.19 45.58 2aaz s LEU 171 CO 0.03 -0.23 -0.12 -0.55 -1.32 0.00 0.00 176.35 174.16 2aaz s SER 172 N 1.55 1.40 0.00 3.68 0.15 -1.26 -1.09 113.70 118.13 2aaz s SER 172 Ca -0.03 -0.27 0.14 0.00 0.70 0.00 0.00 55.95 56.49 2aaz s SER 172 Cb -0.17 -0.13 0.03 0.00 -1.71 0.00 0.00 66.02 64.03 2aaz s SER 172 CO -0.07 0.11 0.82 0.00 1.20 0.00 0.00 173.24 175.29 2aaz n ALA 173 N 2.56 2.89 -2.42 5.45 0.00 -0.36 -4.36 120.51 124.27 2aaz n ALA 173 Ca -0.15 -0.53 -0.43 0.00 0.00 0.00 0.00 53.44 52.34 2aaz n ALA 173 Cb 0.56 -0.48 -0.02 0.00 0.00 0.00 0.00 19.45 19.50 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 -1.55 2.95 -0.32 0.00 -0.11 -1.17 -4.81 118.94 113.93 2aaz s TRP 174 Ca 0.13 1.06 -0.01 0.00 1.22 0.00 0.00 56.10 58.50 2aaz s TRP 174 Cb 0.11 -3.49 0.13 0.00 -1.50 0.00 0.00 33.47 28.72 2aaz s TRP 174 CO 0.30 -1.63 0.23 1.21 -4.62 0.00 0.00 176.95 172.44 2aaz s ASN 175 N 1.82 2.52 0.45 5.86 3.84 -1.26 -5.02 114.94 123.15 2aaz s ASN 175 Ca 0.56 -1.40 0.21 0.00 0.21 0.00 0.00 52.86 52.43 2aaz s ASN 175 Cb -0.23 0.02 1.18 0.00 -0.55 0.00 0.00 41.25 41.67 2aaz s ASN 175 CO 0.18 -0.37 1.87 -0.65 -2.79 0.00 0.00 177.10 175.35 2aaz h PRO 176 N 7.83 0.29 -0.23 0.43 0.11 -2.01 -1.38 132.00 137.04 2aaz h PRO 176 Ca -0.08 -0.02 -0.20 0.00 0.11 0.00 0.00 66.00 65.82 2aaz h PRO 176 Cb 1.03 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2aaz h PRO 176 CO 0.33 0.19 -0.63 -0.22 -0.21 0.00 0.00 178.00 177.47 2aaz h LYS 177 N 0.30 0.80 0.00 1.05 3.64 -2.02 -3.30 116.57 117.04 2aaz h LYS 177 Ca 0.44 -0.56 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2aaz h LYS 177 Cb 1.25 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 2aaz h LYS 177 CO -0.13 1.18 -0.37 -0.25 -2.27 0.00 0.00 179.45 177.61 2aaz n ASP 178 N -3.97 0.75 -0.33 4.20 8.00 -0.62 -4.48 116.55 120.10 2aaz n ASP 178 Ca -0.05 0.30 0.03 0.00 0.71 0.00 0.00 54.79 55.78 2aaz n ASP 178 Cb 0.67 -0.23 0.10 0.00 -0.02 0.00 0.00 41.12 41.64 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 -1.01 -1.66 0.64 3.38 -1.38 0.17 115.31 115.46 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 0.74 0.61 0.00 0.00 0.09 0.00 0.00 40.66 42.10 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 -0.01 0.00 -0.00 1.13 0.13 -1.83 -0.73 132.00 130.69 2aaz h PRO 180 Ca 0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.54 2aaz h PRO 180 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 2aaz h PRO 180 CO -0.94 0.00 -0.40 1.28 -0.23 0.00 0.00 178.00 177.71 2aaz n LEU 181 N -2.51 0.48 -4.78 1.56 4.77 0.60 -4.87 117.00 112.25 2aaz n LEU 181 Ca -0.01 0.04 -0.39 0.00 -0.03 0.00 0.00 56.01 55.63 2aaz n LEU 181 Cb 0.10 -0.27 -0.06 0.00 -2.33 0.00 0.00 43.42 40.87 2aaz n LEU 181 CO 0.15 0.11 0.24 -0.04 -1.33 0.00 0.00 177.39 176.53 2aaz s MET 182 N -2.94 4.24 0.46 3.23 -1.94 -0.28 -4.35 119.30 117.72 2aaz s MET 182 Ca 0.13 0.65 0.13 0.00 -1.71 0.00 0.00 55.69 54.89 2aaz s MET 182 Cb 0.18 -3.32 1.04 0.00 2.01 0.00 0.00 34.83 34.74 2aaz s MET 182 CO 0.65 0.43 2.05 0.00 -0.01 0.00 0.00 175.02 178.14 2aaz h ALA 183 N 5.47 1.78 -2.60 3.03 0.00 -1.47 -3.42 119.26 122.06 2aaz h ALA 183 Ca -0.46 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.26 2aaz h ALA 183 Cb 1.20 -0.05 -0.24 0.00 0.00 0.00 0.00 17.79 18.70 2aaz h ALA 183 CO 0.68 0.17 -0.20 -1.17 0.00 0.00 0.00 179.25 178.73 2aaz s LEU 184 N -8.97 0.08 0.57 0.00 2.96 -1.26 -5.05 118.68 107.01 2aaz s LEU 184 Ca -0.05 0.95 -0.18 0.00 -0.22 0.00 0.00 54.13 54.62 2aaz s LEU 184 Cb 0.16 1.55 -0.04 0.00 0.50 0.00 0.00 46.19 48.36 2aaz s LEU 184 CO 0.70 -0.17 1.10 -2.84 -1.32 0.00 0.00 176.35 173.82 2aaz s PRO 185 N 0.66 3.26 0.23 0.98 0.02 -1.26 -4.94 135.00 133.95 2aaz s PRO 185 Ca -0.03 1.47 -0.31 0.00 0.02 0.00 0.00 61.00 62.14 2aaz s PRO 185 Cb -0.05 -2.01 -0.13 0.00 0.02 0.00 0.00 34.50 32.33 2aaz s PRO 185 CO -0.04 -0.90 1.41 -2.30 -0.33 0.00 0.00 177.00 174.84 2aaz n PRO 186 N -1.65 2.02 -0.09 5.54 -0.02 -1.26 -4.92 135.00 134.62 2aaz n PRO 186 Ca 0.11 0.72 -0.12 0.00 -2.02 0.00 0.00 63.50 62.18 2aaz n PRO 186 Cb 0.52 -2.38 -0.06 0.00 -0.02 0.00 0.00 33.50 31.56 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 -2.29 2.72 -0.35 0.00 0.00 -1.26 -1.84 115.29 112.28 2aaz s HIS 188 Ca -0.21 -0.75 0.24 0.00 -3.00 0.00 0.00 55.06 51.34 2aaz s HIS 188 Cb 0.04 -4.38 0.47 0.00 -4.00 0.00 0.00 32.58 24.70 2aaz s HIS 188 CO 0.38 -1.70 1.65 0.00 -1.00 0.00 0.00 174.74 174.07 2aaz h MET 189 N 9.46 0.00 -1.22 -0.38 -0.00 -1.71 -3.43 114.93 117.65 2aaz h MET 189 Ca -0.11 0.00 0.33 0.00 -0.00 0.00 0.00 59.70 59.92 2aaz h MET 189 Cb 1.05 0.00 -0.17 0.00 -0.00 0.00 0.00 31.60 32.48 2aaz h MET 189 CO 1.21 0.03 0.91 -0.59 -0.00 0.00 0.00 176.91 178.47 2aaz s PHE 190 N -3.26 -0.04 0.06 -0.10 -0.12 -1.24 -1.22 117.98 112.05 2aaz s PHE 190 Ca 0.06 0.01 -0.09 0.00 -0.05 0.00 0.00 56.93 56.86 2aaz s PHE 190 Cb 0.06 0.51 0.00 0.00 -0.63 0.00 0.00 43.02 42.96 2aaz s PHE 190 CO 0.66 -0.11 0.19 0.00 -0.05 0.00 0.00 175.22 175.90 2aaz s GLN 192 N -3.02 2.21 0.11 0.00 0.74 0.11 -1.50 119.66 118.31 2aaz s GLN 192 Ca -0.02 -0.63 -0.01 0.00 0.05 0.00 0.00 55.36 54.75 2aaz s GLN 192 Cb 0.01 -1.77 -0.04 0.00 1.10 0.00 0.00 33.01 32.31 2aaz s GLN 192 CO -0.06 0.13 0.29 -0.06 -0.55 0.00 0.00 175.29 175.03 2aaz s PHE 193 N 0.41 3.50 -0.01 1.67 0.40 -0.52 -0.96 117.98 122.48 2aaz s PHE 193 Ca -0.14 0.35 0.01 0.00 -0.60 0.00 0.00 56.93 56.55 2aaz s PHE 193 Cb -0.16 -1.84 0.01 0.00 0.51 0.00 0.00 43.02 41.54 2aaz s PHE 193 CO 0.05 0.51 -0.01 0.12 0.70 0.00 0.00 175.22 176.60 2aaz s PHE 194 N -1.61 0.19 -0.19 0.36 2.19 -0.50 -4.62 117.98 113.80 2aaz s PHE 194 Ca 0.37 -0.01 0.00 0.00 0.33 0.00 0.00 56.93 57.62 2aaz s PHE 194 Cb -0.12 -0.18 0.01 0.00 -1.31 0.00 0.00 43.02 41.43 2aaz s PHE 194 CO 0.27 -0.03 -0.17 0.08 1.83 0.00 0.00 175.22 177.20 2aaz s VAL 195 N 0.23 2.33 -0.08 3.12 1.01 -1.26 -0.44 120.40 125.31 2aaz s VAL 195 Ca -0.02 -0.86 -0.21 0.00 0.00 0.00 0.00 61.98 60.89 2aaz s VAL 195 Cb -0.04 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 2aaz s VAL 195 CO -0.01 0.51 0.59 -0.44 0.00 0.00 0.00 175.10 175.75 2aaz s SER 196 N 1.33 6.86 0.60 3.32 0.01 0.32 -4.76 113.70 121.38 2aaz s SER 196 Ca 0.05 1.03 -0.16 0.00 1.31 0.00 0.00 55.95 58.18 2aaz s SER 196 Cb -0.13 -2.35 -0.03 0.00 0.21 0.00 0.00 66.02 63.71 2aaz s SER 196 CO -0.11 -0.04 1.07 -0.76 0.41 0.00 0.00 173.24 173.81 2aaz s LEU 197 N 0.60 3.49 0.24 2.44 1.43 -1.26 -1.62 118.68 124.00 2aaz s LEU 197 Ca 0.32 1.86 -0.31 0.00 -1.03 0.00 0.00 54.13 54.96 2aaz s LEU 197 Cb -0.17 -4.54 -0.12 0.00 0.03 0.00 0.00 46.19 41.39 2aaz s LEU 197 CO 0.15 -1.24 1.64 -2.65 0.23 0.00 0.00 176.35 174.47 2aaz n PRO 198 N -2.08 2.65 -1.42 1.29 -0.02 -1.26 -4.84 135.00 129.33 2aaz n PRO 198 Ca 0.09 0.95 -0.36 0.00 -2.02 0.00 0.00 63.50 62.16 2aaz n PRO 198 Cb 0.53 -2.75 0.09 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 3.04 0.61 -0.30 0.52 -0.02 -1.26 -4.80 135.00 132.80 2aaz n PRO 199 Ca 0.13 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 2aaz n PRO 199 Cb 0.35 -2.31 0.13 0.00 -0.02 0.00 0.00 33.50 31.65 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 -0.13 1.14 0.00 3.55 0.00 -2.00 -2.70 119.26 119.12 2aaz h ALA 200 Ca -0.48 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 2aaz h ALA 200 Cb 1.33 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2aaz h ALA 200 CO 0.48 0.26 -0.00 0.38 0.00 0.00 0.00 179.25 180.37 2aaz h ASP 201 N 0.94 0.00 -1.42 0.00 3.04 -2.03 -3.35 116.42 113.60 2aaz h ASP 201 Ca 0.36 0.00 -0.22 0.00 -3.24 0.00 0.00 57.03 53.93 2aaz h ASP 201 Cb 0.15 0.00 -0.24 0.00 -1.04 0.00 0.00 39.33 38.21 2aaz h ASP 201 CO -0.17 0.00 -0.58 -0.94 -2.04 0.00 0.00 179.24 175.52 2aaz s SER 202 N -5.43 -0.40 0.00 4.15 1.04 -1.02 -5.01 113.70 107.03 2aaz s SER 202 Ca -0.05 -1.41 0.21 0.00 0.48 0.00 0.00 55.95 55.19 2aaz s SER 202 Cb 0.13 1.31 1.17 0.00 0.10 0.00 0.00 66.02 68.72 2aaz s SER 202 CO 0.45 -0.18 1.66 -0.81 0.98 0.00 0.00 173.24 175.35 2aaz n PRO 203 N 3.96 0.48 0.15 4.02 -0.04 -1.20 -3.16 135.00 139.22 2aaz n PRO 203 Ca 0.14 0.05 0.10 0.00 -0.04 0.00 0.00 63.50 63.75 2aaz n PRO 203 Cb 0.52 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.55 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 3.39 0.00 -1.43 0.55 0.00 -1.95 -3.47 103.07 100.16 2aaz h GLY 204 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 2aaz h GLY 204 CO 0.00 0.00 0.13 1.44 0.00 0.00 0.00 176.54 178.11 2aaz n SER 205 N -2.92 0.12 -4.77 0.19 7.64 -1.19 -4.98 113.62 107.71 2aaz n SER 205 Ca 0.01 0.44 -0.39 0.00 1.01 0.00 0.00 58.87 59.94 2aaz n SER 205 Cb 0.57 -1.45 -0.06 0.00 -1.01 0.00 0.00 64.21 62.26 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 -4.41 4.65 0.71 1.43 1.02 -1.26 -4.75 119.74 117.13 2aaz s LYS 206 Ca 0.67 1.29 -0.16 0.00 0.02 0.00 0.00 55.97 57.79 2aaz s LYS 206 Cb -0.24 -3.12 0.03 0.00 -0.52 0.00 0.00 37.83 33.98 2aaz s LYS 206 CO 0.58 0.47 1.24 -2.14 -0.92 0.00 0.00 175.35 174.58 2aaz s PRO 207 N -1.46 2.23 -0.12 -1.68 0.02 -1.26 -4.59 135.00 128.14 2aaz s PRO 207 Ca 0.42 1.89 -0.13 0.00 0.02 0.00 0.00 61.00 63.20 2aaz s PRO 207 Cb -0.22 -1.83 -0.05 0.00 0.02 0.00 0.00 34.50 32.42 2aaz s PRO 207 CO 0.27 -1.80 0.29 0.15 -0.33 0.00 0.00 177.00 175.59 2aaz s LYS 208 N -3.72 4.05 -0.19 5.54 1.02 -0.64 -0.30 119.74 125.51 2aaz s LYS 208 Ca 0.78 0.12 -0.06 0.00 0.02 0.00 0.00 55.97 56.83 2aaz s LYS 208 Cb -0.32 -3.35 -0.03 0.00 -0.52 0.00 0.00 37.83 33.61 2aaz s LYS 208 CO 0.44 0.42 0.02 -1.17 -0.92 0.00 0.00 175.35 174.13 2aaz s LEU 209 N -0.09 3.45 0.25 3.17 2.96 0.31 -0.53 118.68 128.21 2aaz s LEU 209 Ca 0.18 -0.09 0.10 0.00 -0.22 0.00 0.00 54.13 54.10 2aaz s LEU 209 Cb -0.14 -1.87 -0.05 0.00 0.50 0.00 0.00 46.19 44.64 2aaz s LEU 209 CO 0.06 0.12 -0.18 -0.44 -1.32 0.00 0.00 176.35 174.59 2aaz s SER 210 N 0.66 3.22 -0.05 3.68 0.01 0.41 0.29 113.70 121.93 2aaz s SER 210 Ca 0.01 -1.03 -0.02 0.00 1.31 0.00 0.00 55.95 56.21 2aaz s SER 210 Cb -0.14 -0.24 0.03 0.00 0.21 0.00 0.00 66.02 65.88 2aaz s SER 210 CO 0.02 -0.04 0.11 0.00 0.41 0.00 0.00 173.24 173.73 2aaz s LEU 212 N 0.97 2.33 -0.01 0.00 0.20 -0.13 0.08 118.68 122.12 2aaz s LEU 212 Ca -0.08 -0.50 0.08 0.00 0.69 0.00 0.00 54.13 54.32 2aaz s LEU 212 Cb -0.10 -1.51 -0.02 0.00 -0.43 0.00 0.00 46.19 44.13 2aaz s LEU 212 CO -0.04 0.11 -0.25 -0.32 -0.29 0.00 0.00 176.35 175.55 2aaz s MET 213 N 0.65 2.03 -0.15 1.98 -2.45 0.17 0.08 119.30 121.62 2aaz s MET 213 Ca -0.09 -0.93 -0.01 0.00 -1.25 0.00 0.00 55.69 53.41 2aaz s MET 213 Cb -0.16 -1.99 -0.01 0.00 1.25 0.00 0.00 34.83 33.92 2aaz s MET 213 CO 0.02 0.54 -0.11 -0.47 1.05 0.00 0.00 175.02 176.05 2aaz s TYR 214 N -0.62 2.86 -0.21 4.11 5.04 -0.44 -0.99 117.35 127.09 2aaz s TYR 214 Ca 0.10 -0.67 0.02 0.00 -2.44 0.00 0.00 57.07 54.08 2aaz s TYR 214 Cb -0.10 -1.89 0.04 0.00 0.35 0.00 0.00 41.96 40.36 2aaz s TYR 214 CO -0.01 -0.25 -0.16 -1.14 -1.34 0.00 0.00 175.55 172.66 2aaz s GLN 215 N 0.52 2.61 0.32 4.97 0.74 -0.20 -2.50 119.66 126.12 2aaz s GLN 215 Ca -0.08 -1.05 0.05 0.00 0.05 0.00 0.00 55.36 54.34 2aaz s GLN 215 Cb -0.15 -2.69 0.55 0.00 1.10 0.00 0.00 33.01 31.81 2aaz s GLN 215 CO 0.04 -0.38 1.80 0.07 -0.55 0.00 0.00 175.29 176.27 2aaz h ARG 216 N 7.87 0.42 -3.63 1.67 0.11 -1.66 0.32 114.38 119.47 2aaz h ARG 216 Ca -0.33 -0.13 -0.35 0.00 0.10 0.00 0.00 59.98 59.27 2aaz h ARG 216 Cb 1.10 -0.04 -0.35 0.00 1.11 0.00 0.00 29.97 31.79 2aaz h ARG 216 CO 0.55 0.58 -0.74 0.45 0.10 0.00 0.00 179.97 180.91 2aaz s SER 217 N -6.81 0.53 -0.22 0.08 0.15 -1.26 -0.34 113.70 105.83 2aaz s SER 217 Ca -0.06 -0.00 -0.01 0.00 0.70 0.00 0.00 55.95 56.57 2aaz s SER 217 Cb 0.15 -0.20 0.06 0.00 -1.71 0.00 0.00 66.02 64.32 2aaz s SER 217 CO 0.77 -0.13 0.01 0.00 1.20 0.00 0.00 173.24 175.09 2aaz s ASP 219 N 1.67 6.21 0.32 0.00 3.68 -1.26 -1.75 116.67 125.54 2aaz s ASP 219 Ca -0.02 -0.74 0.00 0.00 2.13 0.00 0.00 52.55 53.93 2aaz s ASP 219 Cb -0.18 -2.52 0.53 0.00 -1.45 0.00 0.00 42.92 39.30 2aaz s ASP 219 CO -0.09 -1.68 1.95 -0.07 0.13 0.00 0.00 175.17 175.41 2aaz h LEU 220 N 12.51 0.78 0.44 -1.34 4.07 -1.75 0.41 115.31 130.43 2aaz h LEU 220 Ca -0.22 -0.06 -0.02 0.00 0.08 0.00 0.00 57.88 57.66 2aaz h LEU 220 Cb 1.05 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.60 2aaz h LEU 220 CO 1.27 0.62 -0.21 1.23 -1.08 0.00 0.00 178.44 180.27 2aaz h GLY 221 N 0.94 -0.61 0.05 0.83 0.00 -1.90 -3.38 103.07 99.00 2aaz h GLY 221 Ca 0.23 0.23 -0.41 0.00 0.00 0.00 0.00 47.33 47.37 2aaz h GLY 221 CO -0.04 -0.22 -2.41 1.04 0.00 0.00 0.00 176.54 174.91 2aaz n LEU 222 N -5.25 2.50 -0.04 3.11 4.77 -1.20 -4.70 117.00 116.18 2aaz n LEU 222 Ca -0.11 0.10 -0.12 0.00 -0.03 0.00 0.00 56.01 55.85 2aaz n LEU 222 Cb 0.29 -0.89 -0.11 0.00 -2.33 0.00 0.00 43.42 40.38 2aaz n LEU 222 CO 0.32 0.76 0.41 1.23 -1.33 0.00 0.00 177.39 178.78 2aaz h GLY 223 N 0.62 -0.02 0.05 -0.72 0.00 -1.20 -3.37 103.07 98.42 2aaz h GLY 223 Ca -0.61 0.01 0.20 0.00 0.00 0.00 0.00 47.33 46.93 2aaz h GLY 223 CO -0.21 -0.01 0.54 -2.08 0.00 0.00 0.00 176.54 174.78 2aaz h VAL 224 N -0.88 0.64 -0.94 4.60 2.07 -1.42 0.91 116.25 121.23 2aaz h VAL 224 Ca -0.00 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.31 2aaz h VAL 224 Cb 0.77 -0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.43 2aaz h VAL 224 CO 0.00 0.12 0.62 -0.65 0.02 0.00 0.00 177.57 177.69 2aaz h PRO 225 N 0.65 1.22 -0.10 1.57 0.11 -1.76 0.32 132.00 134.00 2aaz h PRO 225 Ca 0.57 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.54 2aaz h PRO 225 Cb 0.94 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 31.77 2aaz h PRO 225 CO -0.42 0.81 -0.19 0.74 -0.21 0.00 0.00 178.00 178.73 2aaz h PHE 226 N 1.26 0.39 -0.77 0.65 -1.00 -1.06 -2.97 116.94 113.43 2aaz h PHE 226 Ca 0.35 -0.14 0.06 0.00 2.81 0.00 0.00 57.97 61.05 2aaz h PHE 226 Cb -0.11 -0.07 -0.06 0.00 3.61 0.00 0.00 35.95 39.32 2aaz h PHE 226 CO -0.00 0.80 0.46 -0.91 -1.61 0.00 0.00 178.31 177.05 2aaz h ASN 227 N -0.13 0.71 0.02 2.17 -0.26 -0.67 0.24 115.58 117.67 2aaz h ASN 227 Ca 0.01 0.02 -0.00 0.00 -0.56 0.00 0.00 56.30 55.76 2aaz h ASN 227 Cb 0.77 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.91 2aaz h ASN 227 CO 0.04 0.46 -0.01 0.40 -1.06 0.00 0.00 177.43 177.26 2aaz h ILE 228 N 0.85 1.06 -0.42 2.81 2.04 -1.00 -2.14 117.51 120.70 2aaz h ILE 228 Ca 0.34 -0.25 -0.12 0.00 1.00 0.00 0.00 64.86 65.83 2aaz h ILE 228 Cb 0.16 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 2aaz h ILE 228 CO -0.17 0.06 -0.23 0.00 0.00 0.00 0.00 178.15 177.81 2aaz h ALA 229 N 0.84 0.79 0.35 1.87 0.00 -1.32 -2.20 119.26 119.59 2aaz h ALA 229 Ca -0.00 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 2aaz h ALA 229 Cb 0.13 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2aaz h ALA 229 CO 0.01 0.65 -0.29 1.03 0.00 0.00 0.00 179.25 180.64 2aaz h SER 230 N 0.74 -0.78 0.58 0.00 0.87 -0.43 0.36 113.55 114.90 2aaz h SER 230 Ca 0.10 0.06 -0.08 0.00 -1.23 0.00 0.00 61.79 60.64 2aaz h SER 230 Cb 0.78 0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 2aaz h SER 230 CO 0.06 -0.44 -0.36 1.88 -0.53 0.00 0.00 176.83 177.45 2aaz h TYR 231 N -0.66 0.00 -0.37 2.24 0.05 -1.41 0.66 116.97 117.49 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 0.58 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.31 2aaz h TYR 231 CO -0.15 0.36 0.03 0.00 -1.05 0.00 0.00 178.16 177.34 2aaz h ALA 232 N 1.64 0.49 -0.59 3.88 0.00 -1.18 -1.56 119.26 121.94 2aaz h ALA 232 Ca -0.00 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 2aaz h ALA 232 Cb 0.75 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2aaz h ALA 232 CO 0.05 0.23 0.10 -0.07 0.00 0.00 0.00 179.25 179.56 2aaz h LEU 233 N 0.46 0.93 -0.76 0.00 3.38 -0.38 -1.58 115.31 117.36 2aaz h LEU 233 Ca 0.11 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.85 2aaz h LEU 233 Cb 0.42 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 2aaz h LEU 233 CO 0.01 0.95 0.48 0.25 0.09 0.00 0.00 178.44 180.23 2aaz h LEU 234 N 0.87 0.79 -0.76 1.67 5.85 -0.73 0.19 115.31 123.19 2aaz h LEU 234 Ca 0.18 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 2aaz h LEU 234 Cb 0.41 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 2aaz h LEU 234 CO 0.01 0.54 0.05 0.74 -0.34 0.00 0.00 178.44 179.44 2aaz h THR 235 N 0.93 1.26 -0.52 1.05 2.02 -0.97 0.23 112.91 116.90 2aaz h THR 235 Ca 0.31 -1.06 -0.03 0.00 0.77 0.00 0.00 66.41 66.40 2aaz h THR 235 Cb 0.02 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 2aaz h THR 235 CO -0.12 0.39 0.20 0.45 0.37 0.00 0.00 175.52 176.81 2aaz h HIS 236 N 0.92 0.81 0.21 3.16 3.86 -0.68 -0.27 115.15 123.17 2aaz h HIS 236 Ca 0.18 -0.07 -0.01 0.00 -1.16 0.00 0.00 60.37 59.31 2aaz h HIS 236 Cb 0.47 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.71 2aaz h HIS 236 CO 0.03 0.67 -0.10 0.52 0.86 0.00 0.00 177.93 179.91 2aaz h MET 237 N 0.71 -0.27 -0.58 2.45 2.07 -0.47 -2.06 114.93 116.78 2aaz h MET 237 Ca 0.17 0.02 -0.01 0.00 -2.07 0.00 0.00 59.70 57.81 2aaz h MET 237 Cb 0.22 0.06 -0.03 0.00 -1.87 0.00 0.00 31.60 29.98 2aaz h MET 237 CO -0.01 -0.16 0.33 0.82 1.07 0.00 0.00 176.91 178.95 2aaz h ILE 238 N -0.31 1.17 -0.74 -1.22 2.04 -0.87 -2.15 117.51 115.42 2aaz h ILE 238 Ca -0.03 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 2aaz h ILE 238 Cb 0.24 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.66 2aaz h ILE 238 CO 0.05 0.18 0.42 0.00 0.00 0.00 0.00 178.15 178.80 2aaz h ALA 239 N 1.57 0.95 -0.22 1.87 0.00 -0.72 -1.06 119.26 121.66 2aaz h ALA 239 Ca 0.21 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2aaz h ALA 239 Cb -0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2aaz h ALA 239 CO -0.04 0.45 0.09 1.25 0.00 0.00 0.00 179.25 181.00 2aaz h LEU 240 N 1.02 0.30 -1.29 0.00 5.85 -0.75 -0.88 115.31 119.57 2aaz h LEU 240 Ca 0.26 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.75 2aaz h LEU 240 Cb 0.02 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 2aaz h LEU 240 CO -0.04 0.39 -0.29 0.40 -0.34 0.00 0.00 178.44 178.55 2aaz h ILE 241 N 0.20 0.86 -0.41 4.05 1.08 -1.23 -3.15 117.51 118.91 2aaz h ILE 241 Ca 0.07 -1.16 0.00 0.00 -0.39 0.00 0.00 64.86 63.38 2aaz h ILE 241 Cb 0.18 1.70 0.00 0.00 -3.07 0.00 0.00 36.82 35.63 2aaz h ILE 241 CO -0.01 0.29 0.00 0.35 -0.69 0.00 0.00 178.15 178.09 2aaz n THR 242 N -3.68 0.63 -3.43 -0.27 -2.24 -0.42 -4.97 114.28 99.89 2aaz n THR 242 Ca -0.01 -0.81 -0.24 0.00 -2.27 0.00 0.00 64.05 60.72 2aaz n THR 242 Cb 0.40 0.84 0.06 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 1.27 -6.10 -4.65 3.42 10.43 -0.53 -4.80 116.55 115.59 2aaz n ASP 243 Ca 0.18 -0.47 -0.25 0.00 2.57 0.00 0.00 54.79 56.81 2aaz n ASP 243 Cb 0.55 -4.85 -0.09 0.00 1.84 0.00 0.00 41.12 38.57 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 -3.26 2.37 -0.25 -3.53 -4.23 -0.45 -4.47 115.64 101.81 2aaz s THR 244 Ca 0.50 -1.92 -0.07 0.00 -1.18 0.00 0.00 61.69 59.02 2aaz s THR 244 Cb -0.22 -2.89 -0.02 0.00 1.34 0.00 0.00 72.50 70.71 2aaz s THR 244 CO 0.62 -0.10 0.06 -0.70 -0.54 0.00 0.00 174.62 173.95 2aaz s GLU 245 N -3.76 3.55 0.23 3.99 2.56 0.59 -4.45 118.70 121.41 2aaz s GLU 245 Ca 0.36 -0.54 -0.32 0.00 0.00 0.00 0.00 54.97 54.48 2aaz s GLU 245 Cb 0.04 -3.29 -0.13 0.00 2.00 0.00 0.00 34.13 32.74 2aaz s GLU 245 CO 0.20 -0.22 1.45 -0.35 -0.56 0.00 0.00 175.26 175.78 2aaz n PRO 246 N 4.90 2.11 0.03 4.30 -0.04 -1.26 -0.53 135.00 144.51 2aaz n PRO 246 Ca -0.16 0.75 -0.01 0.00 -0.04 0.00 0.00 63.50 64.05 2aaz n PRO 246 Cb 0.51 -2.44 -0.00 0.00 -0.04 0.00 0.00 33.50 31.53 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 -3.82 0.54 -0.00 0.15 -3.83 115.22 110.43 2aaz n HIS 247 Ca 0.12 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.18 2aaz n HIS 247 Cb 0.31 -0.04 -0.10 0.00 -0.12 0.00 0.00 29.99 30.05 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 -1.79 0.47 -0.11 1.57 2.12 -1.23 -0.46 118.70 119.26 2aaz s GLU 248 Ca -0.02 -0.15 0.02 0.00 0.36 0.00 0.00 54.97 55.18 2aaz s GLU 248 Cb 0.00 0.20 0.01 0.00 0.26 0.00 0.00 34.13 34.61 2aaz s GLU 248 CO 0.03 -0.11 -0.19 0.12 -0.54 0.00 0.00 175.26 174.57 2aaz s PHE 249 N -0.96 2.26 -0.06 5.30 5.36 -0.23 -1.01 117.98 128.64 2aaz s PHE 249 Ca -0.10 -1.04 0.05 0.00 -0.96 0.00 0.00 56.93 54.87 2aaz s PHE 249 Cb -0.05 -1.57 -0.01 0.00 -0.34 0.00 0.00 43.02 41.04 2aaz s PHE 249 CO 0.02 -0.49 -0.22 0.42 -1.46 0.00 0.00 175.22 173.49 2aaz s ILE 250 N 0.76 2.34 -0.20 3.12 1.09 0.11 -0.74 121.20 127.69 2aaz s ILE 250 Ca -0.10 -0.97 0.01 0.00 -1.10 0.00 0.00 60.65 58.49 2aaz s ILE 250 Cb -0.16 -1.87 0.04 0.00 -1.06 0.00 0.00 42.46 39.41 2aaz s ILE 250 CO 0.01 0.57 -0.09 -0.22 -0.10 0.00 0.00 174.94 175.11 2aaz s LEU 251 N -0.24 2.20 -0.18 2.97 2.96 -0.21 -0.65 118.68 125.53 2aaz s LEU 251 Ca -0.01 -0.88 -0.08 0.00 -0.22 0.00 0.00 54.13 52.95 2aaz s LEU 251 Cb -0.13 -1.18 -0.04 0.00 0.50 0.00 0.00 46.19 45.34 2aaz s LEU 251 CO 0.03 -0.16 0.08 -1.58 -1.32 0.00 0.00 176.35 173.40 2aaz s GLN 252 N 1.43 3.98 0.11 1.98 2.00 -0.16 -1.14 119.66 127.86 2aaz s GLN 252 Ca -0.01 -0.30 0.05 0.00 -2.00 0.00 0.00 55.36 53.10 2aaz s GLN 252 Cb -0.16 -3.26 -0.04 0.00 0.80 0.00 0.00 33.01 30.35 2aaz s GLN 252 CO -0.08 0.32 0.02 -1.64 -0.50 0.00 0.00 175.29 173.41 2aaz s MET 253 N 0.25 2.59 0.00 1.67 -1.94 -1.26 -1.03 119.30 119.59 2aaz s MET 253 Ca 0.05 -0.86 0.00 0.00 -1.71 0.00 0.00 55.69 53.17 2aaz s MET 253 Cb -0.12 -2.55 0.00 0.00 2.01 0.00 0.00 34.83 34.18 2aaz s MET 253 CO -0.00 0.53 0.00 0.41 -0.01 0.00 0.00 175.02 175.94 2aaz n GLY 254 N 0.39 -0.01 3.53 -0.03 0.00 0.10 -3.66 105.19 105.51 2aaz n GLY 254 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.78 6.24 -0.30 1.61 3.68 0.54 -1.16 116.67 126.50 2aaz s ASP 255 Ca 0.00 -0.80 -0.16 0.00 2.13 0.00 0.00 52.55 53.72 2aaz s ASP 255 Cb 0.00 -2.53 -0.02 0.00 -1.45 0.00 0.00 42.92 38.92 2aaz s ASP 255 CO 0.00 -1.67 0.42 0.00 0.13 0.00 0.00 175.17 174.05 2aaz s ALA 256 N 5.14 3.53 0.10 3.66 0.00 -0.62 -0.86 121.76 132.71 2aaz s ALA 256 Ca 0.34 -0.93 -0.00 0.00 0.00 0.00 0.00 51.96 51.37 2aaz s ALA 256 Cb -0.08 -2.82 -0.04 0.00 0.00 0.00 0.00 23.12 20.17 2aaz s ALA 256 CO 0.09 -0.89 0.00 -3.38 0.00 0.00 0.00 175.76 171.58 2aaz s HIS 257 N 2.16 0.76 -0.17 0.00 -0.00 -0.72 -1.29 115.29 116.03 2aaz s HIS 257 Ca 0.16 -1.11 0.01 0.00 -0.00 0.00 0.00 55.06 54.11 2aaz s HIS 257 Cb -0.16 -0.47 0.03 0.00 -0.00 0.00 0.00 32.58 31.98 2aaz s HIS 257 CO 0.11 -0.39 -0.13 0.08 -0.00 0.00 0.00 174.74 174.41 2aaz s VAL 258 N -3.91 1.64 0.58 -5.38 1.01 -0.36 -1.76 120.40 112.23 2aaz s VAL 258 Ca 0.16 -0.79 -0.20 0.00 0.00 0.00 0.00 61.98 61.15 2aaz s VAL 258 Cb 0.07 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 2aaz s VAL 258 CO -0.04 0.36 1.28 -0.31 0.00 0.00 0.00 175.10 176.40 2aaz s TYR 259 N 1.44 2.30 0.26 5.22 1.51 -1.26 -1.64 117.35 125.17 2aaz s TYR 259 Ca 0.03 1.46 -0.01 0.00 -1.01 0.00 0.00 57.07 57.53 2aaz s TYR 259 Cb -0.14 -3.65 0.51 0.00 -0.11 0.00 0.00 41.96 38.56 2aaz s TYR 259 CO -0.10 -2.62 1.78 0.00 -1.11 0.00 0.00 175.55 173.50 2aaz h ARG 260 N 1.09 0.68 -0.06 -0.62 2.47 -1.59 -0.16 114.38 116.18 2aaz h ARG 260 Ca -0.51 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.17 2aaz h ARG 260 Cb 1.31 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.47 2aaz h ARG 260 CO 0.56 0.45 0.00 -0.40 0.56 0.00 0.00 179.97 181.14 2aaz n ASP 261 N -4.81 0.38 -0.00 7.04 5.75 -1.26 -3.06 116.55 120.58 2aaz n ASP 261 Ca 0.16 -1.87 0.07 0.00 -0.01 0.00 0.00 54.79 53.14 2aaz n ASP 261 Cb 0.39 -0.04 -0.10 0.00 -1.03 0.00 0.00 41.12 40.34 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 -0.35 0.00 0.02 2.11 8.25 -0.08 -4.67 115.22 120.49 2aaz n HIS 262 Ca 0.05 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.39 2aaz n HIS 262 Cb 0.08 -0.22 -0.06 0.00 1.12 0.00 0.00 29.99 30.91 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 0.19 -0.39 1.59 2.07 -1.45 -0.56 116.25 117.70 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 0.53 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2aaz h VAL 263 CO 0.00 0.00 0.15 -0.33 0.02 0.00 0.00 177.57 177.41 2aaz h GLU 264 N -0.49 0.58 -0.82 1.57 4.39 -1.84 -2.00 114.58 115.96 2aaz h GLU 264 Ca 0.07 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2aaz h GLU 264 Cb 0.61 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 29.13 2aaz h GLU 264 CO -0.35 0.55 0.52 -1.35 -1.16 0.00 0.00 179.01 177.22 2aaz h PRO 265 N 0.48 1.10 -0.08 2.33 0.11 -1.78 -2.52 132.00 131.64 2aaz h PRO 265 Ca 0.13 -0.08 -0.10 0.00 0.11 0.00 0.00 66.00 66.06 2aaz h PRO 265 Cb 0.19 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 2aaz h PRO 265 CO -0.01 0.75 -0.39 -0.07 -0.21 0.00 0.00 178.00 178.07 2aaz h LEU 266 N 1.13 0.18 -1.57 2.35 3.38 -0.86 -2.71 115.31 117.21 2aaz h LEU 266 Ca 0.30 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.21 2aaz h LEU 266 Cb -0.09 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2aaz h LEU 266 CO -0.06 0.56 0.30 0.11 0.09 0.00 0.00 178.44 179.44 2aaz h LYS 267 N 0.14 0.57 -0.49 1.13 1.57 -0.91 0.14 116.57 118.73 2aaz h LYS 267 Ca 0.01 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.65 2aaz h LYS 267 Cb 0.76 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 2aaz h LYS 267 CO 0.06 0.38 -0.13 1.15 -0.57 0.00 0.00 179.45 180.33 2aaz h THR 268 N 0.59 1.27 -0.32 -0.16 2.02 -1.44 -3.00 112.91 111.87 2aaz h THR 268 Ca 0.17 -1.27 -0.10 0.00 0.77 0.00 0.00 66.41 65.98 2aaz h THR 268 Cb -0.02 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 2aaz h THR 268 CO -0.04 0.44 -0.22 -0.61 0.37 0.00 0.00 175.52 175.46 2aaz h GLN 269 N 0.80 0.61 0.00 6.66 4.15 -1.00 -2.90 115.11 123.43 2aaz h GLN 269 Ca 0.12 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.31 2aaz h GLN 269 Cb 0.69 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.34 2aaz h GLN 269 CO 0.05 0.79 0.00 -0.07 -1.93 0.00 0.00 178.83 177.67 2aaz h LEU 270 N 0.54 0.00 0.00 -2.39 3.38 -0.65 -1.40 115.31 114.79 2aaz h LEU 270 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2aaz h LEU 270 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 2aaz h LEU 270 CO 0.05 0.00 -0.08 -0.62 0.09 0.00 0.00 178.44 177.88 2aaz n GLU 271 N -3.04 0.06 -3.43 1.13 1.02 -1.09 -4.88 120.64 110.41 2aaz n GLU 271 Ca -0.02 0.04 -0.37 0.00 -0.02 0.00 0.00 57.16 56.79 2aaz n GLU 271 Cb 0.10 -1.56 -0.06 0.00 -0.02 0.00 0.00 31.44 29.90 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 3.97 -0.15 3.49 0.52 -0.53 -5.07 118.95 118.16 2aaz s ARG 272 Ca 0.13 0.46 -0.19 0.00 -0.52 0.00 0.00 55.73 55.61 2aaz s ARG 272 Cb 0.17 -3.11 -0.04 0.00 0.52 0.00 0.00 34.95 32.50 2aaz s ARG 272 CO 0.57 0.60 0.52 -2.00 0.02 0.00 0.00 175.30 175.02 2aaz s GLU 273 N -1.45 4.29 0.66 3.54 2.12 -1.26 -4.96 118.70 121.64 2aaz s GLU 273 Ca 0.30 0.49 -0.18 0.00 0.36 0.00 0.00 54.97 55.95 2aaz s GLU 273 Cb -0.16 -3.49 -0.00 0.00 0.26 0.00 0.00 34.13 30.74 2aaz s GLU 273 CO 0.17 0.02 1.27 -2.30 -0.54 0.00 0.00 175.26 173.87 2aaz n PRO 274 N 4.15 1.00 -4.08 4.30 -0.02 -1.26 -4.87 135.00 134.22 2aaz n PRO 274 Ca -0.05 0.40 -0.24 0.00 -2.02 0.00 0.00 63.50 61.59 2aaz n PRO 274 Cb 0.51 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.44 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 -3.42 3.00 0.34 -0.52 3.00 -1.26 -5.04 118.95 115.05 2aaz s ARG 275 Ca 0.82 -0.93 -0.28 0.00 0.00 0.00 0.00 55.73 55.34 2aaz s ARG 275 Cb -0.37 -2.65 -0.12 0.00 0.00 0.00 0.00 34.95 31.80 2aaz s ARG 275 CO 0.42 0.44 1.34 -0.25 0.00 0.00 0.00 175.30 177.25 2aaz n ASP 276 N -0.84 2.96 -4.73 0.23 8.00 -1.26 -4.81 116.55 116.11 2aaz n ASP 276 Ca -0.08 1.21 -0.36 0.00 0.71 0.00 0.00 54.79 56.27 2aaz n ASP 276 Cb 0.56 -1.51 0.07 0.00 -0.02 0.00 0.00 41.12 40.23 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 -1.02 2.09 0.96 1.24 0.08 -1.26 -4.74 117.98 115.33 2aaz s PHE 277 Ca 0.56 1.52 -0.15 0.00 0.12 0.00 0.00 56.93 58.98 2aaz s PHE 277 Cb -0.55 -3.62 0.18 0.00 -0.57 0.00 0.00 43.02 38.45 2aaz s PHE 277 CO 0.62 -2.79 1.21 -1.25 -0.10 0.00 0.00 175.22 172.91 2aaz s PRO 278 N -3.51 0.70 0.16 0.24 0.04 -1.25 -4.84 135.00 126.54 2aaz s PRO 278 Ca 0.80 -0.07 0.10 0.00 0.04 0.00 0.00 61.00 61.87 2aaz s PRO 278 Cb -0.35 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 2aaz s PRO 278 CO 0.40 -2.43 -0.21 0.15 0.04 0.00 0.00 177.00 174.95 2aaz s LYS 279 N -5.59 1.62 -0.12 4.56 1.02 -0.20 -1.49 119.74 119.55 2aaz s LYS 279 Ca 0.69 -1.36 -0.03 0.00 0.02 0.00 0.00 55.97 55.28 2aaz s LYS 279 Cb -0.09 -1.97 -0.03 0.00 -0.52 0.00 0.00 37.83 35.22 2aaz s LYS 279 CO 0.53 0.44 -0.00 -1.17 -0.92 0.00 0.00 175.35 174.23 2aaz s LEU 280 N -2.40 3.52 0.08 3.17 2.96 0.79 -1.00 118.68 125.81 2aaz s LEU 280 Ca 0.19 0.06 0.03 0.00 -0.22 0.00 0.00 54.13 54.18 2aaz s LEU 280 Cb -0.09 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.73 2aaz s LEU 280 CO 0.10 0.29 -0.10 -0.54 -1.32 0.00 0.00 176.35 174.78 2aaz s LYS 281 N -0.32 0.77 -0.15 1.98 -0.14 0.25 -4.83 119.74 117.30 2aaz s LYS 281 Ca 0.07 -1.07 -0.08 0.00 -1.36 0.00 0.00 55.97 53.53 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 0.13 -1.58 -0.76 0.00 0.00 175.35 173.23 2aaz s TRP 282 N -2.23 3.49 -0.67 3.18 0.52 -1.26 -0.74 118.94 121.23 2aaz s TRP 282 Ca 0.02 0.42 0.25 0.00 0.02 0.00 0.00 56.10 56.81 2aaz s TRP 282 Cb -0.04 -2.02 0.87 0.00 -1.15 0.00 0.00 33.47 31.13 2aaz s TRP 282 CO -0.00 0.53 1.76 0.00 0.02 0.00 0.00 176.95 179.26 2aaz n ALA 283 N 2.63 2.11 -2.29 0.98 0.00 -0.13 -4.85 120.51 118.96 2aaz n ALA 283 Ca -0.18 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.11 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 -3.16 1.34 0.61 0.00 0.52 -1.26 -5.05 118.95 111.96 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 -0.15 0.03 0.00 0.52 0.00 0.00 34.95 35.47 2aaz s ARG 284 CO 0.54 -0.30 0.90 -1.54 0.02 0.00 0.00 175.30 174.91 2aaz s SER 285 N -3.27 5.25 0.20 0.23 1.04 -1.26 -4.90 113.70 110.99 2aaz s SER 285 Ca 0.37 0.42 -0.11 0.00 0.48 0.00 0.00 55.95 57.11 2aaz s SER 285 Cb 0.08 -1.28 0.20 0.00 0.10 0.00 0.00 66.02 65.11 2aaz s SER 285 CO 0.12 -1.25 1.79 0.50 0.98 0.00 0.00 173.24 175.39 2aaz h LYS 286 N -0.23 0.56 -0.75 4.02 3.64 -1.98 -0.59 116.57 121.24 2aaz h LYS 286 Ca -0.44 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 2aaz h LYS 286 Cb 1.29 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.95 2aaz h LYS 286 CO 0.58 0.37 0.44 0.93 -2.27 0.00 0.00 179.45 179.50 2aaz h GLU 287 N 0.58 1.03 -0.28 1.90 3.07 -1.94 0.35 114.58 119.29 2aaz h GLU 287 Ca 0.27 -0.10 -0.06 0.00 -0.50 0.00 0.00 59.36 58.97 2aaz h GLU 287 Cb 0.19 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 2aaz h GLU 287 CO -0.18 0.74 -0.04 0.93 -1.40 0.00 0.00 179.01 179.06 2aaz h GLU 288 N 1.03 0.52 -0.64 2.33 5.08 -1.79 -2.98 114.58 118.13 2aaz h GLU 288 Ca 0.27 -0.19 -0.09 0.00 -1.00 0.00 0.00 59.36 58.35 2aaz h GLU 288 Cb -0.01 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 2aaz h GLU 288 CO -0.05 0.71 0.04 0.82 -1.00 0.00 0.00 179.01 179.53 2aaz h ILE 289 N 0.29 1.27 0.00 3.13 2.04 -0.91 -3.47 117.51 119.85 2aaz h ILE 289 Ca 0.07 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.82 2aaz h ILE 289 Cb 0.50 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2aaz h ILE 289 CO 0.02 0.41 0.00 0.61 0.00 0.00 0.00 178.15 179.19 2aaz n GLY 290 N -0.48 2.24 1.26 5.37 0.00 0.12 -4.04 105.19 109.67 2aaz n GLY 290 Ca 0.04 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 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 4.52 -0.30 0.32 1.61 5.68 -1.26 -4.88 116.55 122.24 2aaz n ASP 291 Ca 0.00 -1.85 0.20 0.00 -0.50 0.00 0.00 54.79 52.64 2aaz n ASP 291 Cb 0.00 0.68 1.11 0.00 -1.14 0.00 0.00 41.12 41.78 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 1.42 0.14 -0.14 2.12 6.09 -1.94 -0.76 117.51 124.43 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 0.47 0.97 0.00 0.00 0.47 0.00 0.00 36.82 38.73 2aaz h ILE 292 CO 0.13 0.00 0.00 0.47 -3.07 0.00 0.00 178.15 175.68 2aaz n ASP 293 N -3.27 2.18 -1.31 2.19 8.00 -1.26 -4.24 116.55 118.83 2aaz n ASP 293 Ca -0.03 -1.75 0.12 0.00 0.71 0.00 0.00 54.79 53.84 2aaz n ASP 293 Cb 0.11 -0.09 0.30 0.00 -0.02 0.00 0.00 41.12 41.42 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 1.25 2.31 3.82 0.44 0.00 -0.29 -4.99 105.19 107.74 2aaz n GLY 294 Ca 0.17 -0.79 -0.33 0.00 0.00 0.00 0.00 46.02 45.08 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 3.30 0.09 1.61 0.40 -1.26 -4.78 117.98 116.22 2aaz s PHE 295 Ca 0.47 1.61 0.05 0.00 -0.60 0.00 0.00 56.93 58.45 2aaz s PHE 295 Cb 0.25 -2.86 -0.03 0.00 0.51 0.00 0.00 43.02 40.89 2aaz s PHE 295 CO 0.33 -0.15 -0.12 0.15 0.70 0.00 0.00 175.22 176.13 2aaz s LYS 296 N -3.20 0.88 0.22 0.44 1.02 -1.26 -5.05 119.74 112.79 2aaz s LYS 296 Ca 0.62 -1.10 -0.09 0.00 0.02 0.00 0.00 55.97 55.42 2aaz s LYS 296 Cb -0.09 -0.72 0.34 0.00 -0.52 0.00 0.00 37.83 36.83 2aaz s LYS 296 CO 0.14 0.14 1.69 0.28 -0.92 0.00 0.00 175.35 176.67 2aaz h VAL 297 N 3.81 0.57 0.00 3.17 2.07 -1.98 0.65 116.25 124.54 2aaz h VAL 297 Ca -0.39 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2aaz h VAL 297 Cb 1.19 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 2aaz h VAL 297 CO 0.48 0.04 0.00 -1.84 0.02 0.00 0.00 177.57 176.27 2aaz n GLU 298 N -5.17 0.02 0.20 1.57 0.00 -1.26 -2.00 120.64 113.99 2aaz n GLU 298 Ca 0.10 0.36 0.08 0.00 0.00 0.00 0.00 57.16 57.70 2aaz n GLU 298 Cb 0.37 -1.50 0.27 0.00 0.00 0.00 0.00 31.44 30.58 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 -2.73 -1.84 3.32 -1.26 -3.43 116.42 110.48 2aaz h ASP 299 Ca 0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 2aaz h ASP 299 Cb 0.09 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.52 2aaz h ASP 299 CO 0.00 0.27 0.73 -0.36 -1.72 0.00 0.00 179.24 178.16 2aaz s PHE 300 N -3.34 2.58 -0.51 4.55 0.40 -0.85 -0.95 117.98 119.86 2aaz s PHE 300 Ca 0.03 -0.22 -0.13 0.00 -0.60 0.00 0.00 56.93 56.01 2aaz s PHE 300 Cb 0.08 -4.36 0.13 0.00 0.51 0.00 0.00 43.02 39.38 2aaz s PHE 300 CO 0.68 -1.70 0.44 0.08 0.70 0.00 0.00 175.22 175.41 2aaz s VAL 301 N 4.58 4.80 -0.31 -0.44 1.01 0.08 -4.98 120.40 125.13 2aaz s VAL 301 Ca 0.29 -1.63 -0.16 0.00 0.00 0.00 0.00 61.98 60.48 2aaz s VAL 301 Cb -0.13 -4.11 -0.02 0.00 0.00 0.00 0.00 36.38 32.13 2aaz s VAL 301 CO 0.15 -0.83 0.40 -0.69 0.00 0.00 0.00 175.10 174.12 2aaz s VAL 302 N 1.48 5.14 0.08 2.92 1.01 -1.26 -0.58 120.40 129.19 2aaz s VAL 302 Ca 0.04 0.34 0.08 0.00 0.00 0.00 0.00 61.98 62.44 2aaz s VAL 302 Cb -0.28 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 2aaz s VAL 302 CO 0.01 -0.01 -0.17 -1.83 0.00 0.00 0.00 175.10 173.10 2aaz s GLU 303 N 2.12 1.95 0.00 2.72 -1.05 -0.17 -4.64 118.70 119.63 2aaz s GLU 303 Ca 0.15 -1.07 0.00 0.00 -0.15 0.00 0.00 54.97 53.90 2aaz s GLU 303 Cb -0.16 -2.17 0.00 0.00 -0.44 0.00 0.00 34.13 31.36 2aaz s GLU 303 CO 0.11 0.51 0.00 0.41 0.95 0.00 0.00 175.26 177.24 2aaz n GLY 304 N 1.12 0.47 3.64 -3.83 0.00 -1.26 -1.03 105.19 104.30 2aaz n GLY 304 Ca -0.16 -0.59 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 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 2.95 -0.52 1.61 6.04 -1.26 -4.34 117.35 119.83 2aaz s TYR 305 Ca 0.00 1.06 0.06 0.00 0.04 0.00 0.00 57.07 58.23 2aaz s TYR 305 Cb 0.00 -3.74 0.22 0.00 -1.04 0.00 0.00 41.96 37.40 2aaz s TYR 305 CO 0.00 -1.22 0.54 1.63 -1.54 0.00 0.00 175.55 174.96 2aaz n LYS 306 N 6.98 1.27 -2.22 4.97 5.02 -1.26 -5.07 118.16 127.85 2aaz n LYS 306 Ca 0.13 -3.82 -0.28 0.00 -2.02 0.00 0.00 58.31 52.32 2aaz n LYS 306 Cb 0.47 -1.78 0.03 0.00 -0.02 0.00 0.00 35.03 33.73 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 -1.30 2.98 0.44 1.97 0.04 -1.26 -4.73 135.00 133.14 2aaz s PRO 307 Ca 0.34 0.19 -0.07 0.00 0.04 0.00 0.00 61.00 61.50 2aaz s PRO 307 Cb 0.10 -2.19 0.10 0.00 0.04 0.00 0.00 34.50 32.55 2aaz s PRO 307 CO -0.11 -0.77 0.60 0.91 0.04 0.00 0.00 177.00 177.67 2aaz n TRP 308 N -2.70 -3.95 -0.86 0.56 7.02 0.00 -4.88 117.44 112.62 2aaz n TRP 308 Ca 0.05 -0.56 -0.30 0.00 -1.02 0.00 0.00 57.50 55.67 2aaz n TRP 308 Cb 0.57 -0.47 0.17 0.00 -2.42 0.00 0.00 31.31 29.16 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 -4.30 1.64 0.63 6.99 0.00 -1.26 -2.74 107.32 108.27 2aaz s GLY 309 Ca 0.35 0.22 -0.15 0.00 0.00 0.00 0.00 44.72 45.13 2aaz s GLY 309 CO 0.24 0.71 1.09 -1.59 0.00 0.00 0.00 173.10 173.55 2aaz s LYS 310 N -4.71 3.04 -0.18 2.90 -2.85 -1.26 -2.91 119.74 113.76 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 -0.21 -1.99 0.04 0.00 -2.06 0.00 0.00 37.83 33.61 2aaz s LYS 310 CO 0.59 -1.05 -0.07 0.42 0.10 0.00 0.00 175.35 175.34 2aaz s ILE 311 N -2.40 1.35 0.08 3.79 1.01 -1.26 -4.88 121.20 118.88 2aaz s ILE 311 Ca 0.65 -0.83 -0.31 0.00 0.00 0.00 0.00 60.65 60.17 2aaz s ILE 311 Cb -0.18 -1.50 -0.07 0.00 0.01 0.00 0.00 42.46 40.72 2aaz s ILE 311 CO 0.40 0.12 1.32 -1.81 0.00 0.00 0.00 174.94 174.97 2aaz s ASP 312 N 1.52 6.92 -0.08 3.58 1.01 -1.26 -5.02 116.67 123.34 2aaz s ASP 312 Ca -0.01 2.18 -0.04 0.00 0.71 0.00 0.00 52.55 55.40 2aaz s ASP 312 Cb -0.16 -2.58 0.04 0.00 1.01 0.00 0.00 42.92 41.23 2aaz s ASP 312 CO -0.08 -0.60 0.18 -0.04 0.21 0.00 0.00 175.17 174.84 2aaz s MET 313 N 1.31 0.12 0.21 8.23 -1.94 -1.26 -4.89 119.30 121.09 2aaz s MET 313 Ca 0.62 0.45 -0.27 0.00 -1.71 0.00 0.00 55.69 54.78 2aaz s MET 313 Cb -0.33 -0.16 -0.09 0.00 2.01 0.00 0.00 34.83 36.26 2aaz s MET 313 CO 0.29 -0.18 0.86 0.21 -0.01 0.00 0.00 175.02 176.19 2aaz s LYS 314 N 1.36 4.70 -0.01 2.03 2.20 -1.26 -5.04 119.74 123.71 2aaz s LYS 314 Ca -0.08 1.32 -0.17 0.00 -0.36 0.00 0.00 55.97 56.68 2aaz s LYS 314 Cb -0.11 -3.22 -0.06 0.00 -1.51 0.00 0.00 37.83 32.93 2aaz s LYS 314 CO -0.07 0.52 0.49 1.41 -0.36 0.00 0.00 175.35 177.34 2aaz s MET 315 N -1.26 4.15 -0.30 4.03 -2.45 -1.26 -4.97 119.30 117.24 2aaz s MET 315 Ca 0.39 0.55 -0.15 0.00 -1.25 0.00 0.00 55.69 55.23 2aaz s MET 315 Cb -0.24 -3.29 -0.03 0.00 1.25 0.00 0.00 34.83 32.52 2aaz s MET 315 CO 0.29 0.51 0.39 -1.12 1.05 0.00 0.00 175.02 176.13 2aaz s SER 316 N -0.56 6.24 0.00 1.11 0.01 -1.26 -5.17 113.70 114.08 2aaz s SER 316 Ca 0.26 0.12 0.16 0.00 1.31 0.00 0.00 55.95 57.81 2aaz s SER 316 Cb -0.17 -2.21 0.97 0.00 0.21 0.00 0.00 66.02 64.82 2aaz s SER 316 CO 0.15 -0.26 1.38 0.00 0.41 0.00 0.00 173.24 174.92