#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mz5 s ALA 2 N 0.00 2.73 0.30 1.96 0.00 -1.26 -4.94 121.76 120.55 1mz5 s ALA 2 Ca 0.00 0.72 -0.30 0.00 0.00 0.00 0.00 51.96 52.38 1mz5 s ALA 2 Cb 0.00 -3.32 -0.12 0.00 0.00 0.00 0.00 23.12 19.68 1mz5 s ALA 2 CO 0.00 -0.68 1.48 -2.30 0.00 0.00 0.00 175.76 174.26 1mz5 n PRO 3 N -1.33 2.43 0.00 0.00 -0.02 -1.26 -1.18 135.00 133.64 1mz5 n PRO 3 Ca 0.11 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 1mz5 n PRO 3 Cb 0.52 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 1mz5 n PRO 3 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mz5 n GLY 4 N 1.71 3.37 3.96 -1.23 0.00 -1.26 -4.19 105.19 107.54 1mz5 n GLY 4 Ca 0.08 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 1mz5 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mz5 s SER 5 N -1.02 4.80 0.17 1.61 0.01 -0.32 -4.60 113.70 114.35 1mz5 s SER 5 Ca 0.00 0.09 -0.24 0.00 1.31 0.00 0.00 55.95 57.10 1mz5 s SER 5 Cb 0.00 -0.73 0.06 0.00 0.21 0.00 0.00 66.02 65.55 1mz5 s SER 5 CO 0.00 -1.54 0.89 -0.94 0.41 0.00 0.00 173.24 172.06 1mz5 s SER 6 N -4.55 -0.22 0.20 2.44 1.04 -1.12 -4.92 113.70 106.56 1mz5 s SER 6 Ca 0.61 -0.40 -0.14 0.00 0.48 0.00 0.00 55.95 56.50 1mz5 s SER 6 Cb -0.09 0.53 0.01 0.00 0.10 0.00 0.00 66.02 66.57 1mz5 s SER 6 CO 0.43 -0.97 0.46 0.00 0.98 0.00 0.00 173.24 174.13 1mz5 s ARG 7 N -3.42 1.38 0.07 4.02 1.70 -1.26 0.21 118.95 121.64 1mz5 s ARG 7 Ca 0.11 -1.04 0.03 0.00 -0.47 0.00 0.00 55.73 54.36 1mz5 s ARG 7 Cb -0.02 0.47 -0.03 0.00 -0.57 0.00 0.00 34.95 34.80 1mz5 s ARG 7 CO 0.02 -0.57 -0.10 0.14 -1.08 0.00 0.00 175.30 173.72 1mz5 s VAL 8 N -3.93 0.77 -1.09 4.99 -7.23 -0.81 -4.97 120.40 108.13 1mz5 s VAL 8 Ca 0.14 -1.34 -0.19 0.00 -1.81 0.00 0.00 61.98 58.78 1mz5 s VAL 8 Cb -0.00 -0.99 0.11 0.00 0.56 0.00 0.00 36.38 36.06 1mz5 s VAL 8 CO 0.01 -0.44 1.41 -0.70 -0.31 0.00 0.00 175.10 175.07 1mz5 s GLU 9 N -2.12 3.79 0.10 4.82 2.12 -1.26 -0.99 118.70 125.16 1mz5 s GLU 9 Ca -0.03 -1.82 -0.15 0.00 0.36 0.00 0.00 54.97 53.33 1mz5 s GLU 9 Cb -0.07 -5.20 -0.07 0.00 0.26 0.00 0.00 34.13 29.05 1mz5 s GLU 9 CO 0.00 -1.99 1.46 1.25 -0.54 0.00 0.00 175.26 175.44 1mz5 h LEU 10 N 11.35 0.71 -7.86 2.70 5.85 -1.78 -3.36 115.31 122.93 1mz5 h LEU 10 Ca 0.27 -0.43 -0.71 0.00 0.84 0.00 0.00 57.88 57.85 1mz5 h LEU 10 Cb 0.95 -0.20 -0.33 0.00 0.37 0.00 0.00 40.66 41.46 1mz5 h LEU 10 CO 1.30 0.98 -0.48 -0.36 -0.34 0.00 0.00 178.44 179.54 1mz5 s PHE 11 N -4.54 3.53 -0.31 1.25 0.08 -1.06 -5.00 117.98 111.93 1mz5 s PHE 11 Ca -0.13 -2.23 -0.13 0.00 0.12 0.00 0.00 56.93 54.56 1mz5 s PHE 11 Cb 0.09 -3.33 -0.03 0.00 -0.57 0.00 0.00 43.02 39.18 1mz5 s PHE 11 CO 0.81 -0.98 0.25 0.21 -0.10 0.00 0.00 175.22 175.42 1mz5 s LYS 12 N 1.18 3.73 0.39 0.44 2.20 -1.26 -1.36 119.74 125.05 1mz5 s LYS 12 Ca 0.08 -0.42 -0.23 0.00 -0.36 0.00 0.00 55.97 55.04 1mz5 s LYS 12 Cb -0.24 -3.74 -0.14 0.00 -1.51 0.00 0.00 37.83 32.21 1mz5 s LYS 12 CO -0.03 -0.34 0.46 2.89 -0.36 0.00 0.00 175.35 177.97 1mz5 n ARG 13 N 5.15 0.42 -4.36 4.03 1.85 -1.26 -0.34 116.66 122.16 1mz5 n ARG 13 Ca -0.12 0.15 -0.37 0.00 -1.00 0.00 0.00 57.85 56.51 1mz5 n ARG 13 Cb 0.51 -1.35 -0.08 0.00 -1.05 0.00 0.00 32.46 30.48 1mz5 n ARG 13 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1mz5 n LYS 14 N 0.81 -0.81 0.10 2.89 5.02 -0.14 -4.43 118.16 121.60 1mz5 n LYS 14 Ca 0.12 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.52 1mz5 n LYS 14 Cb 0.38 -4.09 0.00 0.00 -0.02 0.00 0.00 35.03 31.30 1mz5 n LYS 14 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1mz5 n ASN 15 N -2.50 -1.78 -4.74 4.39 2.85 -0.98 -4.96 115.26 107.53 1mz5 n ASN 15 Ca -0.06 0.38 -0.42 0.00 -0.11 0.00 0.00 54.58 54.38 1mz5 n ASN 15 Cb 0.53 1.94 -0.02 0.00 1.24 0.00 0.00 39.78 43.46 1mz5 n ASN 15 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1mz5 s SER 16 N -1.40 6.51 0.03 1.20 0.01 0.54 -4.84 113.70 115.75 1mz5 s SER 16 Ca 0.00 2.79 -0.00 0.00 1.31 0.00 0.00 55.95 60.04 1mz5 s SER 16 Cb 0.00 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 1mz5 s SER 16 CO 0.00 -0.83 0.17 -0.89 0.41 0.00 0.00 173.24 172.09 1mz5 s THR 17 N 0.34 5.21 0.07 1.44 2.01 -1.26 -3.40 115.64 120.05 1mz5 s THR 17 Ca 0.64 -0.38 0.06 0.00 0.31 0.00 0.00 61.69 62.33 1mz5 s THR 17 Cb -0.45 -3.49 -0.03 0.00 0.01 0.00 0.00 72.50 68.54 1mz5 s THR 17 CO 0.41 0.22 -0.17 0.68 -0.69 0.00 0.00 174.62 175.08 1mz5 s VAL 18 N -1.40 1.32 -1.09 3.82 -7.23 -0.90 -4.91 120.40 110.01 1mz5 s VAL 18 Ca 0.30 -1.33 -0.22 0.00 -1.81 0.00 0.00 61.98 58.93 1mz5 s VAL 18 Cb -0.13 -1.23 0.02 0.00 0.56 0.00 0.00 36.38 35.61 1mz5 s VAL 18 CO 0.23 -0.12 1.67 -2.16 -0.31 0.00 0.00 175.10 174.41 1mz5 s PRO 19 N -1.67 3.39 0.11 4.82 0.04 -1.26 -1.55 135.00 138.88 1mz5 s PRO 19 Ca 0.02 -1.21 -0.31 0.00 0.04 0.00 0.00 61.00 59.53 1mz5 s PRO 19 Cb -0.10 -5.34 -0.08 0.00 0.04 0.00 0.00 34.50 29.02 1mz5 s PRO 19 CO 0.03 -2.64 1.45 0.12 0.04 0.00 0.00 177.00 176.00 1mz5 s PHE 20 N 6.39 3.11 -0.41 0.56 5.36 0.57 -4.59 117.98 128.97 1mz5 s PHE 20 Ca 0.55 0.82 -0.16 0.00 -0.96 0.00 0.00 56.93 57.18 1mz5 s PHE 20 Cb -0.00 -3.76 0.02 0.00 -0.34 0.00 0.00 43.02 38.94 1mz5 s PHE 20 CO -0.01 -2.74 0.34 -2.00 -1.46 0.00 0.00 175.22 169.36 1mz5 s GLU 21 N 1.33 3.06 0.81 10.12 2.12 -1.26 -0.50 118.70 134.38 1mz5 s GLU 21 Ca 0.66 -0.89 -0.11 0.00 0.36 0.00 0.00 54.97 54.99 1mz5 s GLU 21 Cb -0.38 -3.96 0.08 0.00 0.26 0.00 0.00 34.13 30.13 1mz5 s GLU 21 CO 0.30 -0.76 1.12 -2.00 -0.54 0.00 0.00 175.26 173.39 1mz5 s GLU 22 N 1.84 1.88 0.64 4.30 2.56 0.23 -4.86 118.70 125.28 1mz5 s GLU 22 Ca 0.08 1.36 0.30 0.00 0.00 0.00 0.00 54.97 56.70 1mz5 s GLU 22 Cb -0.18 -1.84 1.60 0.00 2.00 0.00 0.00 34.13 35.71 1mz5 s GLU 22 CO 0.11 -1.96 1.93 1.03 -0.56 0.00 0.00 175.26 175.81 1mz5 h SER 23 N -1.23 0.00 -0.66 -1.70 0.87 -1.97 -0.77 113.55 108.09 1mz5 h SER 23 Ca -0.44 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 1mz5 h SER 23 Cb 1.25 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1mz5 h SER 23 CO 0.48 0.00 0.00 -0.46 -0.53 0.00 0.00 176.83 176.32 1mz5 n ASN 24 N -3.12 4.17 0.00 6.23 6.94 -1.26 -4.92 115.26 123.30 1mz5 n ASN 24 Ca 0.00 -2.22 0.00 0.00 -0.02 0.00 0.00 54.58 52.34 1mz5 n ASN 24 Cb 0.44 -0.52 0.00 0.00 -2.36 0.00 0.00 39.78 37.34 1mz5 n ASN 24 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1mz5 n GLY 25 N 1.35 3.06 3.77 4.83 0.00 -0.30 -5.03 105.19 112.87 1mz5 n GLY 25 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 1mz5 n GLY 25 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1mz5 s THR 26 N -2.42 2.17 -0.14 2.61 -1.32 -1.26 -4.64 115.64 110.65 1mz5 s THR 26 Ca 0.00 0.15 0.01 0.00 -1.21 0.00 0.00 61.69 60.65 1mz5 s THR 26 Cb 0.00 -3.09 -0.00 0.00 -1.51 0.00 0.00 72.50 67.90 1mz5 s THR 26 CO 0.00 0.02 -0.18 0.27 -2.21 0.00 0.00 174.62 172.52 1mz5 s ILE 27 N -1.21 2.45 0.03 5.08 -5.25 -1.26 0.74 121.20 121.79 1mz5 s ILE 27 Ca 0.60 -0.86 0.07 0.00 -0.99 0.00 0.00 60.65 59.48 1mz5 s ILE 27 Cb -0.43 -2.00 -0.02 0.00 2.95 0.00 0.00 42.46 42.96 1mz5 s ILE 27 CO 0.55 0.53 -0.20 -0.13 -1.79 0.00 0.00 174.94 173.90 1mz5 s ARG 28 N 0.66 1.42 -0.46 0.37 3.00 0.35 -4.93 118.95 119.35 1mz5 s ARG 28 Ca -0.09 -0.90 -0.29 0.00 0.00 0.00 0.00 55.73 54.45 1mz5 s ARG 28 Cb -0.16 -1.50 0.03 0.00 0.00 0.00 0.00 34.95 33.32 1mz5 s ARG 28 CO 0.02 0.39 1.14 -1.21 0.00 0.00 0.00 175.30 175.64 1mz5 s GLU 29 N -1.06 3.75 -0.11 3.54 0.41 -1.26 -0.31 118.70 123.66 1mz5 s GLU 29 Ca 0.07 0.61 0.01 0.00 -0.41 0.00 0.00 54.97 55.25 1mz5 s GLU 29 Cb -0.09 -3.90 -0.02 0.00 -1.78 0.00 0.00 34.13 28.35 1mz5 s GLU 29 CO 0.01 -1.35 -0.13 0.50 -0.49 0.00 0.00 175.26 173.81 1mz5 s ARG 30 N 4.41 3.13 0.60 1.61 3.52 -0.59 -4.88 118.95 126.75 1mz5 s ARG 30 Ca 0.48 -0.68 -0.17 0.00 -0.13 0.00 0.00 55.73 55.23 1mz5 s ARG 30 Cb -0.08 -2.57 -0.03 0.00 -1.56 0.00 0.00 34.95 30.71 1mz5 s ARG 30 CO 0.31 0.35 1.12 0.54 -0.81 0.00 0.00 175.30 176.80 1mz5 s VAL 31 N 0.01 3.22 -0.09 7.11 0.11 -1.26 -2.11 120.40 127.38 1mz5 s VAL 31 Ca -0.04 0.67 0.02 0.00 -2.93 0.00 0.00 61.98 59.69 1mz5 s VAL 31 Cb -0.14 -3.21 0.02 0.00 -1.53 0.00 0.00 36.38 31.52 1mz5 s VAL 31 CO 0.04 -0.26 -0.13 -0.69 -3.33 0.00 0.00 175.10 170.73 1mz5 s VAL 32 N -2.05 1.31 0.09 2.04 1.01 -1.22 -4.89 120.40 116.69 1mz5 s VAL 32 Ca 0.70 -0.54 -0.34 0.00 0.00 0.00 0.00 61.98 61.80 1mz5 s VAL 32 Cb -0.22 -1.21 -0.16 0.00 0.00 0.00 0.00 36.38 34.79 1mz5 s VAL 32 CO 0.34 0.40 1.59 -0.74 0.00 0.00 0.00 175.10 176.69 1mz5 h HIS 33 N 7.38 -1.17 -3.93 5.22 6.17 -0.85 -0.34 115.15 127.63 1mz5 h HIS 33 Ca -0.31 0.00 -0.26 0.00 0.71 0.00 0.00 60.37 60.52 1mz5 h HIS 33 Cb 1.17 0.45 -0.24 0.00 2.52 0.00 0.00 27.41 31.31 1mz5 h HIS 33 CO 0.48 -0.60 -0.73 -1.12 0.71 0.00 0.00 177.93 176.67 1mz5 s SER 34 N -4.44 0.57 -0.19 3.26 0.01 -0.88 -3.01 113.70 109.03 1mz5 s SER 34 Ca -0.18 -0.36 -0.01 0.00 1.31 0.00 0.00 55.95 56.71 1mz5 s SER 34 Cb 0.05 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.30 1mz5 s SER 34 CO 0.62 -0.13 -0.13 -0.36 0.41 0.00 0.00 173.24 173.65 1mz5 s PHE 35 N -0.92 2.85 0.28 2.43 0.40 -0.45 -0.92 117.98 121.65 1mz5 s PHE 35 Ca -0.07 -1.21 0.02 0.00 -0.60 0.00 0.00 56.93 55.07 1mz5 s PHE 35 Cb -0.07 -1.98 -0.06 0.00 0.51 0.00 0.00 43.02 41.42 1mz5 s PHE 35 CO -0.00 -0.62 0.07 1.03 0.70 0.00 0.00 175.22 176.40 1mz5 s ARG 36 N 1.24 1.48 -1.06 0.44 0.52 -0.95 -4.06 118.95 116.56 1mz5 s ARG 36 Ca 0.03 -1.80 -0.06 0.00 -0.52 0.00 0.00 55.73 53.38 1mz5 s ARG 36 Cb -0.14 -0.52 -0.06 0.00 0.52 0.00 0.00 34.95 34.74 1mz5 s ARG 36 CO -0.06 -0.23 0.93 -0.89 0.02 0.00 0.00 175.30 175.07 1mz5 n ILE 37 N -0.54 -8.92 -2.39 1.52 2.08 -1.26 -0.87 119.36 108.99 1mz5 n ILE 37 Ca -0.01 -1.28 -0.32 0.00 0.56 0.00 0.00 62.75 61.69 1mz5 n ILE 37 Cb 0.66 -6.39 -0.03 0.00 -0.75 0.00 0.00 39.64 33.13 1mz5 n ILE 37 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1mz5 s PRO 38 N -4.49 3.86 -0.13 0.38 0.04 -1.26 -4.10 135.00 129.30 1mz5 s PRO 38 Ca 0.42 1.03 -0.09 0.00 0.04 0.00 0.00 61.00 62.41 1mz5 s PRO 38 Cb -0.06 -2.12 0.05 0.00 0.04 0.00 0.00 34.50 32.41 1mz5 s PRO 38 CO 0.74 -0.35 0.33 0.99 0.04 0.00 0.00 177.00 178.75 1mz5 s THR 39 N -2.52 -0.02 -0.13 1.26 2.01 -0.48 -4.54 115.64 111.21 1mz5 s THR 39 Ca 0.60 0.08 0.01 0.00 0.31 0.00 0.00 61.69 62.70 1mz5 s THR 39 Cb -0.11 -0.48 0.02 0.00 0.01 0.00 0.00 72.50 71.93 1mz5 s THR 39 CO 0.30 0.03 -0.17 -0.51 -0.69 0.00 0.00 174.62 173.59 1mz5 s ILE 40 N 0.93 1.67 0.45 1.82 2.07 -1.26 0.23 121.20 127.12 1mz5 s ILE 40 Ca -0.06 -0.73 0.03 0.00 -1.41 0.00 0.00 60.65 58.48 1mz5 s ILE 40 Cb -0.07 -1.53 -0.02 0.00 0.13 0.00 0.00 42.46 40.97 1mz5 s ILE 40 CO -0.07 0.48 0.07 0.68 -1.91 0.00 0.00 174.94 174.19 1mz5 s VAL 41 N 1.14 0.90 -0.20 4.00 -7.23 0.80 -4.69 120.40 115.13 1mz5 s VAL 41 Ca -0.02 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.17 1mz5 s VAL 41 Cb -0.14 -2.31 0.03 0.00 0.56 0.00 0.00 36.38 34.52 1mz5 s VAL 41 CO -0.06 0.00 -0.17 0.21 -0.31 0.00 0.00 175.10 174.77 1mz5 s ASN 42 N -3.72 3.48 -0.35 4.85 2.47 -1.26 -1.00 114.94 119.41 1mz5 s ASN 42 Ca 0.17 -0.85 -0.04 0.00 0.42 0.00 0.00 52.86 52.57 1mz5 s ASN 42 Cb 0.03 -1.49 0.06 0.00 -1.45 0.00 0.00 41.25 38.40 1mz5 s ASN 42 CO 0.10 -0.05 0.10 -0.69 -3.72 0.00 0.00 177.10 172.83 1mz5 s VAL 43 N 1.24 3.35 -1.59 -5.21 1.01 0.35 -4.73 120.40 114.84 1mz5 s VAL 43 Ca 0.01 -1.49 -0.13 0.00 0.00 0.00 0.00 61.98 60.37 1mz5 s VAL 43 Cb -0.15 -3.02 0.10 0.00 0.00 0.00 0.00 36.38 33.31 1mz5 s VAL 43 CO -0.11 -0.30 0.78 -0.67 0.00 0.00 0.00 175.10 174.80 1mz5 n ASP 44 N 4.68 -3.14 0.00 3.32 -0.08 -1.26 0.80 116.55 120.87 1mz5 n ASP 44 Ca -0.10 -0.94 0.00 0.00 -1.51 0.00 0.00 54.79 52.24 1mz5 n ASP 44 Cb 0.43 -3.19 0.00 0.00 2.34 0.00 0.00 41.12 40.70 1mz5 n ASP 44 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1mz5 n GLY 45 N -1.60 0.97 3.52 0.27 0.00 -1.26 -5.02 105.19 102.07 1mz5 n GLY 45 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1mz5 n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mz5 s VAL 46 N -2.32 4.33 0.14 1.61 1.01 0.24 -4.80 120.40 120.60 1mz5 s VAL 46 Ca 0.00 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 1mz5 s VAL 46 Cb 0.00 -2.96 -0.07 0.00 0.00 0.00 0.00 36.38 33.34 1mz5 s VAL 46 CO 0.00 0.42 1.21 -0.04 0.00 0.00 0.00 175.10 176.69 1mz5 s MET 47 N 0.88 4.47 -0.14 2.72 -1.94 0.42 -0.49 119.30 125.21 1mz5 s MET 47 Ca 0.02 1.84 -0.00 0.00 -1.71 0.00 0.00 55.69 55.84 1mz5 s MET 47 Cb -0.14 -3.28 0.03 0.00 2.01 0.00 0.00 34.83 33.45 1mz5 s MET 47 CO 0.02 -0.16 -0.08 0.08 -0.01 0.00 0.00 175.02 174.88 1mz5 s VAL 48 N 0.38 1.14 -0.24 -6.03 1.01 -0.17 -0.34 120.40 116.14 1mz5 s VAL 48 Ca 0.55 -0.46 -0.05 0.00 0.00 0.00 0.00 61.98 62.02 1mz5 s VAL 48 Cb -0.32 -1.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 1mz5 s VAL 48 CO 0.34 0.30 0.00 0.00 0.00 0.00 0.00 175.10 175.73 1mz5 s ALA 49 N 1.65 2.93 -0.01 5.51 0.00 0.44 -0.14 121.76 132.14 1mz5 s ALA 49 Ca 0.03 -1.22 0.04 0.00 0.00 0.00 0.00 51.96 50.81 1mz5 s ALA 49 Cb -0.14 -1.87 -0.03 0.00 0.00 0.00 0.00 23.12 21.09 1mz5 s ALA 49 CO -0.08 -0.55 -0.11 0.99 0.00 0.00 0.00 175.76 176.00 1mz5 s THR 50 N 1.51 3.31 0.12 0.00 2.01 0.14 -0.86 115.64 121.86 1mz5 s THR 50 Ca 0.05 -0.81 -0.25 0.00 0.31 0.00 0.00 61.69 60.99 1mz5 s THR 50 Cb -0.15 -2.38 0.08 0.00 0.01 0.00 0.00 72.50 70.05 1mz5 s THR 50 CO -0.01 0.46 0.69 0.00 -0.69 0.00 0.00 174.62 175.08 1mz5 s ALA 51 N -0.89 -1.64 -0.01 7.40 0.00 -0.30 -1.38 121.76 124.93 1mz5 s ALA 51 Ca 0.14 0.58 -0.30 0.00 0.00 0.00 0.00 51.96 52.39 1mz5 s ALA 51 Cb -0.11 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.72 1mz5 s ALA 51 CO 0.04 -0.77 1.24 -0.51 0.00 0.00 0.00 175.76 175.77 1mz5 s ASP 52 N -2.69 7.02 -0.57 0.00 1.11 -0.05 -0.15 116.67 121.33 1mz5 s ASP 52 Ca 0.03 1.93 -0.19 0.00 0.18 0.00 0.00 52.55 54.50 1mz5 s ASP 52 Cb -0.01 -2.56 0.09 0.00 1.07 0.00 0.00 42.92 41.50 1mz5 s ASP 52 CO -0.11 -0.58 0.70 0.00 1.18 0.00 0.00 175.17 176.36 1mz5 s ALA 53 N 1.95 3.39 -0.76 5.23 0.00 0.13 -2.23 121.76 129.47 1mz5 s ALA 53 Ca 0.58 -2.08 -0.19 0.00 0.00 0.00 0.00 51.96 50.27 1mz5 s ALA 53 Cb -0.27 -3.50 0.12 0.00 0.00 0.00 0.00 23.12 19.47 1mz5 s ALA 53 CO 0.25 -2.28 0.92 1.03 0.00 0.00 0.00 175.76 175.68 1mz5 s ARG 54 N 2.74 3.32 0.21 0.00 0.52 -0.09 -2.23 118.95 123.42 1mz5 s ARG 54 Ca 0.13 -1.49 -0.10 0.00 -0.52 0.00 0.00 55.73 53.75 1mz5 s ARG 54 Cb -0.22 -4.51 0.17 0.00 0.52 0.00 0.00 34.95 30.90 1mz5 s ARG 54 CO 0.08 -1.66 1.88 1.88 0.02 0.00 0.00 175.30 177.50 1mz5 h TYR 55 N 9.00 1.00 0.00 -0.53 -1.99 -1.74 -2.27 116.97 120.43 1mz5 h TYR 55 Ca -0.09 0.02 -0.22 0.00 2.00 0.00 0.00 58.73 60.45 1mz5 h TYR 55 Cb 1.06 -0.34 -0.04 0.00 2.00 0.00 0.00 36.73 39.41 1mz5 h TYR 55 CO 1.01 0.64 -1.81 0.39 -0.00 0.00 0.00 178.16 178.39 1mz5 n GLU 56 N -4.52 2.00 -3.80 4.88 -0.58 -1.26 -1.08 120.64 116.26 1mz5 n GLU 56 Ca 0.08 -0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.73 1mz5 n GLU 56 Cb 0.02 -1.30 -0.04 0.00 -0.57 0.00 0.00 31.44 29.56 1mz5 n GLU 56 CO 0.00 0.00 0.00 -0.08 -0.48 0.00 0.00 177.13 176.57 1mz5 s THR 57 N -2.29 0.02 -1.50 2.62 -1.32 -1.25 -4.82 115.64 107.09 1mz5 s THR 57 Ca -0.06 -0.93 0.29 0.00 -1.21 0.00 0.00 61.69 59.78 1mz5 s THR 57 Cb 0.04 -1.77 0.45 0.00 -1.51 0.00 0.00 72.50 69.71 1mz5 s THR 57 CO 0.48 -0.07 1.91 -1.54 -2.21 0.00 0.00 174.62 173.19 1mz5 n SER 58 N -0.37 0.28 -4.76 8.08 3.41 -1.26 -4.61 113.62 114.38 1mz5 n SER 58 Ca -0.07 -0.35 -0.37 0.00 -0.26 0.00 0.00 58.87 57.81 1mz5 n SER 58 Cb 0.62 -0.16 0.01 0.00 -0.26 0.00 0.00 64.21 64.42 1mz5 n SER 58 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1mz5 s PHE 59 N -2.56 2.60 0.36 7.33 0.08 -1.26 -4.92 117.98 119.61 1mz5 s PHE 59 Ca 0.27 1.47 0.04 0.00 0.12 0.00 0.00 56.93 58.83 1mz5 s PHE 59 Cb 0.20 -3.56 0.70 0.00 -0.57 0.00 0.00 43.02 39.79 1mz5 s PHE 59 CO 0.48 -2.12 2.01 -0.44 -0.10 0.00 0.00 175.22 175.05 1mz5 h ASP 60 N 1.71 0.67 -2.09 1.36 3.45 -2.00 -3.21 116.42 116.31 1mz5 h ASP 60 Ca -0.50 -0.01 -0.78 0.00 0.43 0.00 0.00 57.03 56.17 1mz5 h ASP 60 Cb 1.27 -0.16 -0.28 0.00 -0.56 0.00 0.00 39.33 39.61 1mz5 h ASP 60 CO 0.59 0.47 1.00 0.59 -1.57 0.00 0.00 179.24 180.31 1mz5 n ASN 61 N -4.45 7.37 -2.25 6.45 3.02 -1.26 -4.92 115.26 119.21 1mz5 n ASN 61 Ca 0.07 -3.78 -0.10 0.00 -0.03 0.00 0.00 54.58 50.74 1mz5 n ASN 61 Cb 0.09 -1.09 -0.04 0.00 -0.61 0.00 0.00 39.78 38.13 1mz5 n ASN 61 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1mz5 n SER 62 N -0.34 0.09 -4.61 6.41 3.41 -1.21 -4.85 113.62 112.52 1mz5 n SER 62 Ca 0.51 -2.06 -0.43 0.00 -0.26 0.00 0.00 58.87 56.63 1mz5 n SER 62 Cb 0.25 0.71 -0.02 0.00 -0.26 0.00 0.00 64.21 64.89 1mz5 n SER 62 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1mz5 s PHE 63 N -2.54 2.26 0.01 7.33 5.36 -1.22 -4.41 117.98 124.78 1mz5 s PHE 63 Ca 0.16 0.67 0.02 0.00 -0.96 0.00 0.00 56.93 56.82 1mz5 s PHE 63 Cb 0.01 -4.19 -0.01 0.00 -0.34 0.00 0.00 43.02 38.48 1mz5 s PHE 63 CO 0.12 -2.28 -0.08 0.42 -1.46 0.00 0.00 175.22 171.94 1mz5 s ILE 64 N 5.61 0.58 0.19 3.12 1.01 -1.09 -2.52 121.20 128.10 1mz5 s ILE 64 Ca 0.66 -0.58 0.03 0.00 0.00 0.00 0.00 60.65 60.76 1mz5 s ILE 64 Cb -0.17 -0.54 -0.05 0.00 0.01 0.00 0.00 42.46 41.71 1mz5 s ILE 64 CO 0.31 -0.02 -0.03 -1.61 0.00 0.00 0.00 174.94 173.60 1mz5 s GLU 65 N -0.66 1.19 -0.37 2.79 2.02 -0.95 -2.02 118.70 120.70 1mz5 s GLU 65 Ca -0.01 -1.57 -0.22 0.00 0.02 0.00 0.00 54.97 53.18 1mz5 s GLU 65 Cb -0.05 -0.51 0.01 0.00 0.10 0.00 0.00 34.13 33.68 1mz5 s GLU 65 CO 0.00 -0.06 0.75 0.99 0.02 0.00 0.00 175.26 176.95 1mz5 s THR 66 N -3.47 4.76 0.28 3.63 2.01 -0.63 0.20 115.64 122.42 1mz5 s THR 66 Ca 0.24 0.76 -0.04 0.00 0.31 0.00 0.00 61.69 62.97 1mz5 s THR 66 Cb 0.05 -4.19 -0.05 0.00 0.01 0.00 0.00 72.50 68.32 1mz5 s THR 66 CO 0.05 -0.43 0.53 0.00 -0.69 0.00 0.00 174.62 174.08 1mz5 s ALA 67 N 3.02 3.66 0.00 7.40 0.00 0.79 -0.40 121.76 136.23 1mz5 s ALA 67 Ca 0.29 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.62 1mz5 s ALA 67 Cb -0.13 -2.23 -0.00 0.00 0.00 0.00 0.00 23.12 20.75 1mz5 s ALA 67 CO 0.17 0.23 -0.04 0.14 0.00 0.00 0.00 175.76 176.27 1mz5 s VAL 68 N -2.09 0.27 -0.03 0.00 -7.23 -0.22 -1.15 120.40 109.95 1mz5 s VAL 68 Ca 0.43 -0.23 0.06 0.00 -1.81 0.00 0.00 61.98 60.43 1mz5 s VAL 68 Cb -0.11 -0.25 -0.01 0.00 0.56 0.00 0.00 36.38 36.57 1mz5 s VAL 68 CO 0.31 0.02 -0.21 -0.54 -0.31 0.00 0.00 175.10 174.37 1mz5 s LYS 69 N -0.22 1.88 0.14 4.82 1.02 -0.04 -0.74 119.74 126.61 1mz5 s LYS 69 Ca -0.00 -0.76 0.04 0.00 0.02 0.00 0.00 55.97 55.27 1mz5 s LYS 69 Cb -0.02 -1.74 -0.04 0.00 -0.52 0.00 0.00 37.83 35.51 1mz5 s LYS 69 CO -0.00 0.41 -0.09 1.52 -0.92 0.00 0.00 175.35 176.27 1mz5 s TYR 70 N -0.35 1.23 -0.12 3.18 1.13 -0.60 -0.42 117.35 121.40 1mz5 s TYR 70 Ca 0.04 -0.78 -0.11 0.00 -1.41 0.00 0.00 57.07 54.81 1mz5 s TYR 70 Cb -0.10 -0.64 0.03 0.00 -1.10 0.00 0.00 41.96 40.16 1mz5 s TYR 70 CO 0.00 0.05 0.33 0.45 -2.51 0.00 0.00 175.55 173.87 1mz5 s SER 71 N -3.16 -0.35 0.00 -0.18 0.15 0.54 -1.77 113.70 108.93 1mz5 s SER 71 Ca 0.17 0.67 0.22 0.00 0.70 0.00 0.00 55.95 57.70 1mz5 s SER 71 Cb 0.03 0.67 0.28 0.00 -1.71 0.00 0.00 66.02 65.29 1mz5 s SER 71 CO 0.00 -0.12 1.27 1.33 1.20 0.00 0.00 173.24 176.93 1mz5 n VAL 72 N 2.97 0.25 -2.37 4.45 0.24 -1.26 -0.44 118.33 122.17 1mz5 n VAL 72 Ca -0.14 -0.63 -0.12 0.00 -2.04 0.00 0.00 64.34 61.42 1mz5 n VAL 72 Cb 0.58 1.21 0.04 0.00 -1.47 0.00 0.00 33.84 34.20 1mz5 n VAL 72 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1mz5 n ASP 73 N 1.31 3.25 -2.41 -1.34 5.68 -1.26 -4.96 116.55 116.82 1mz5 n ASP 73 Ca 0.15 -2.96 -0.16 0.00 -0.50 0.00 0.00 54.79 51.32 1mz5 n ASP 73 Cb 0.56 -0.41 -0.01 0.00 -1.14 0.00 0.00 41.12 40.13 1mz5 n ASP 73 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1mz5 n ASP 74 N -0.64 -4.79 0.00 -1.12 10.43 -1.26 -2.37 116.55 116.80 1mz5 n ASP 74 Ca 0.26 0.11 0.00 0.00 2.57 0.00 0.00 54.79 57.73 1mz5 n ASP 74 Cb 0.89 -4.03 0.00 0.00 1.84 0.00 0.00 41.12 39.82 1mz5 n ASP 74 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1mz5 n GLY 75 N -0.89 0.80 0.00 0.44 0.00 -1.26 -4.94 105.19 99.33 1mz5 n GLY 75 Ca -0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.96 1mz5 n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mz5 n ALA 76 N -1.52 2.26 -3.64 4.61 0.00 -1.00 -4.84 120.51 116.38 1mz5 n ALA 76 Ca 0.00 -0.11 -0.10 0.00 0.00 0.00 0.00 53.44 53.24 1mz5 n ALA 76 Cb 0.00 -1.43 -0.07 0.00 0.00 0.00 0.00 19.45 17.95 1mz5 n ALA 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1mz5 s THR 77 N -2.79 0.00 0.01 0.00 2.01 -1.26 -5.09 115.64 108.52 1mz5 s THR 77 Ca 0.19 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.20 1mz5 s THR 77 Cb 0.17 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.67 1mz5 s THR 77 CO 0.44 0.00 -0.04 0.26 -0.69 0.00 0.00 174.62 174.59 1mz5 s TRP 78 N 0.34 0.38 0.17 4.92 0.52 -1.26 -4.35 118.94 119.66 1mz5 s TRP 78 Ca 0.02 -0.25 0.05 0.00 0.02 0.00 0.00 56.10 55.95 1mz5 s TRP 78 Cb -0.05 -0.24 -0.04 0.00 -1.15 0.00 0.00 33.47 31.99 1mz5 s TRP 78 CO -0.06 -0.06 0.13 -0.80 0.02 0.00 0.00 176.95 176.19 1mz5 s ASN 79 N -0.69 5.46 -0.04 2.95 0.01 -0.73 -4.93 114.94 116.98 1mz5 s ASN 79 Ca -0.04 -0.16 0.05 0.00 -0.71 0.00 0.00 52.86 51.99 1mz5 s ASN 79 Cb -0.05 -1.41 -0.01 0.00 0.41 0.00 0.00 41.25 40.20 1mz5 s ASN 79 CO -0.00 0.06 -0.19 -0.89 -1.51 0.00 0.00 177.10 174.57 1mz5 s THR 80 N -1.79 1.58 0.17 1.60 2.01 -1.26 -1.55 115.64 116.41 1mz5 s THR 80 Ca 0.31 -0.81 -0.03 0.00 0.31 0.00 0.00 61.69 61.47 1mz5 s THR 80 Cb -0.10 -1.35 -0.03 0.00 0.01 0.00 0.00 72.50 71.03 1mz5 s THR 80 CO 0.23 0.45 0.14 -1.10 -0.69 0.00 0.00 174.62 173.66 1mz5 s GLN 81 N -0.10 1.12 -0.35 4.92 -0.21 0.08 -4.77 119.66 120.35 1mz5 s GLN 81 Ca -0.01 -1.49 -0.07 0.00 0.02 0.00 0.00 55.36 53.81 1mz5 s GLN 81 Cb -0.11 0.29 0.05 0.00 1.00 0.00 0.00 33.01 34.23 1mz5 s GLN 81 CO 0.02 -0.36 0.13 0.42 -2.12 0.00 0.00 175.29 173.38 1mz5 s ILE 82 N -4.09 3.89 -0.08 1.08 -1.09 -1.26 -1.06 121.20 118.58 1mz5 s ILE 82 Ca 0.30 -1.17 0.13 0.00 -2.23 0.00 0.00 60.65 57.68 1mz5 s ILE 82 Cb 0.06 -3.23 -0.04 0.00 -1.58 0.00 0.00 42.46 37.67 1mz5 s ILE 82 CO 0.07 -0.24 1.29 0.00 -1.23 0.00 0.00 174.94 174.83 1mz5 h ALA 83 N 8.25 0.60 -3.07 9.38 0.00 -1.04 -3.44 119.26 129.94 1mz5 h ALA 83 Ca -0.23 -0.65 -0.27 0.00 0.00 0.00 0.00 54.91 53.76 1mz5 h ALA 83 Cb 1.08 -0.03 -0.34 0.00 0.00 0.00 0.00 17.79 18.50 1mz5 h ALA 83 CO 0.63 0.84 -0.61 0.42 0.00 0.00 0.00 179.25 180.54 1mz5 s ILE 84 N -2.89 -0.24 0.38 0.00 1.01 -1.18 -4.92 121.20 113.36 1mz5 s ILE 84 Ca 0.02 0.31 -0.10 0.00 0.00 0.00 0.00 60.65 60.88 1mz5 s ILE 84 Cb 0.08 -0.31 -0.06 0.00 0.01 0.00 0.00 42.46 42.17 1mz5 s ILE 84 CO 0.77 0.13 0.73 -0.54 0.00 0.00 0.00 174.94 176.03 1mz5 s LYS 85 N 2.09 3.78 0.75 2.79 1.02 -1.26 -1.61 119.74 127.30 1mz5 s LYS 85 Ca 0.00 0.42 -0.02 0.00 0.02 0.00 0.00 55.97 56.39 1mz5 s LYS 85 Cb -0.12 -2.44 0.14 0.00 -0.52 0.00 0.00 37.83 34.89 1mz5 s LYS 85 CO -0.06 0.02 1.03 0.54 -0.92 0.00 0.00 175.35 175.96 1mz5 s ASN 86 N -3.06 4.21 0.41 2.83 6.03 -1.26 -4.84 114.94 119.25 1mz5 s ASN 86 Ca 0.50 -0.31 0.29 0.00 -1.03 0.00 0.00 52.86 52.31 1mz5 s ASN 86 Cb -0.10 -0.03 1.23 0.00 -3.03 0.00 0.00 41.25 39.32 1mz5 s ASN 86 CO 0.30 -1.96 1.86 0.77 -2.03 0.00 0.00 177.10 176.03 1mz5 h SER 87 N -0.65 0.00 -1.59 3.54 4.64 -1.88 -3.47 113.55 114.14 1mz5 h SER 87 Ca -0.37 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.61 1mz5 h SER 87 Cb 1.26 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.28 1mz5 h SER 87 CO 0.40 0.00 -0.37 0.54 -0.87 0.00 0.00 176.83 176.53 1mz5 n ARG 88 N -2.64 -1.25 0.09 4.77 5.12 -1.26 -4.89 116.66 116.59 1mz5 n ARG 88 Ca 0.01 0.95 -0.13 0.00 -1.93 0.00 0.00 57.85 56.75 1mz5 n ARG 88 Cb 0.25 -5.28 -0.10 0.00 -1.16 0.00 0.00 32.46 26.17 1mz5 n ARG 88 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1mz5 h ALA 89 N 0.40 0.25 -3.51 7.54 0.00 -1.90 -3.48 119.26 118.56 1mz5 h ALA 89 Ca -0.37 -0.83 -0.18 0.00 0.00 0.00 0.00 54.91 53.53 1mz5 h ALA 89 Cb 1.19 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 1mz5 h ALA 89 CO 0.49 0.97 -0.10 -1.13 0.00 0.00 0.00 179.25 179.48 1mz5 n SER 90 N -3.57 -0.85 0.00 0.00 3.41 -1.24 -5.01 113.62 106.36 1mz5 n SER 90 Ca -0.06 -2.20 0.09 0.00 -0.26 0.00 0.00 58.87 56.44 1mz5 n SER 90 Cb 0.94 1.60 0.45 0.00 -0.26 0.00 0.00 64.21 66.94 1mz5 n SER 90 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1mz5 n SER 91 N -1.82 0.00 -0.15 4.04 3.41 -1.26 -2.54 113.62 115.29 1mz5 n SER 91 Ca 0.00 0.11 0.01 0.00 -0.26 0.00 0.00 58.87 58.74 1mz5 n SER 91 Cb 0.37 -0.33 0.04 0.00 -0.26 0.00 0.00 64.21 64.03 1mz5 n SER 91 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1mz5 n VAL 92 N -1.33 0.99 -1.78 -3.33 0.24 -1.26 -3.37 118.33 108.50 1mz5 n VAL 92 Ca 0.08 -1.00 -0.41 0.00 -2.04 0.00 0.00 64.34 60.97 1mz5 n VAL 92 Cb 0.16 0.50 -0.01 0.00 -1.47 0.00 0.00 33.84 33.02 1mz5 n VAL 92 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1mz5 s SER 93 N -0.99 6.34 -0.06 -1.34 0.01 -1.05 -4.34 113.70 112.26 1mz5 s SER 93 Ca 0.06 3.02 -0.15 0.00 1.31 0.00 0.00 55.95 60.18 1mz5 s SER 93 Cb 0.03 -2.65 0.03 0.00 0.21 0.00 0.00 66.02 63.64 1mz5 s SER 93 CO 0.04 -0.91 0.36 0.00 0.41 0.00 0.00 173.24 173.14 1mz5 s ARG 94 N -1.32 0.62 -0.08 12.44 1.70 0.05 -2.65 118.95 129.70 1mz5 s ARG 94 Ca 0.58 0.09 0.04 0.00 -0.47 0.00 0.00 55.73 55.97 1mz5 s ARG 94 Cb -0.47 0.28 -0.01 0.00 -0.57 0.00 0.00 34.95 34.18 1mz5 s ARG 94 CO 0.56 -0.15 -0.22 0.14 -1.08 0.00 0.00 175.30 174.56 1mz5 s VAL 95 N -0.79 2.33 0.13 4.99 -7.23 -0.86 -0.83 120.40 118.13 1mz5 s VAL 95 Ca -0.09 -0.95 -0.25 0.00 -1.81 0.00 0.00 61.98 58.88 1mz5 s VAL 95 Cb -0.04 -1.89 0.07 0.00 0.56 0.00 0.00 36.38 35.08 1mz5 s VAL 95 CO 0.03 0.56 0.80 0.00 -0.31 0.00 0.00 175.10 176.18 1mz5 s MET 96 N 0.02 1.20 -0.87 4.82 0.00 -0.63 -4.00 119.30 119.84 1mz5 s MET 96 Ca -0.08 -0.55 -0.02 0.00 0.00 0.00 0.00 55.69 55.04 1mz5 s MET 96 Cb -0.15 0.48 -0.03 0.00 0.00 0.00 0.00 34.83 35.14 1mz5 s MET 96 CO 0.05 -0.54 0.74 -0.25 0.00 0.00 0.00 175.02 175.03 1mz5 n ASP 97 N -0.37 -3.71 -4.73 -1.18 8.00 -1.26 -1.17 116.55 112.12 1mz5 n ASP 97 Ca -0.10 -0.51 -0.42 0.00 0.71 0.00 0.00 54.79 54.47 1mz5 n ASP 97 Cb 0.62 -4.10 -0.02 0.00 -0.02 0.00 0.00 41.12 37.60 1mz5 n ASP 97 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mz5 n ALA 98 N -3.14 2.37 -2.54 2.24 0.00 -1.26 -4.59 120.51 113.59 1mz5 n ALA 98 Ca -0.14 0.38 -0.31 0.00 0.00 0.00 0.00 53.44 53.37 1mz5 n ALA 98 Cb 0.61 -2.44 -0.16 0.00 0.00 0.00 0.00 19.45 17.46 1mz5 n ALA 98 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1mz5 s THR 99 N 0.14 2.07 -0.02 0.00 2.01 -0.34 -1.39 115.64 118.12 1mz5 s THR 99 Ca 0.66 -1.08 0.01 0.00 0.31 0.00 0.00 61.69 61.60 1mz5 s THR 99 Cb -0.52 -1.73 0.01 0.00 0.01 0.00 0.00 72.50 70.26 1mz5 s THR 99 CO 0.47 0.57 -0.05 -0.69 -0.69 0.00 0.00 174.62 174.24 1mz5 s VAL 100 N -0.37 0.43 -0.04 3.82 1.01 0.74 -0.84 120.40 125.14 1mz5 s VAL 100 Ca 0.03 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 61.88 1mz5 s VAL 100 Cb -0.12 -0.41 -0.00 0.00 0.00 0.00 0.00 36.38 35.85 1mz5 s VAL 100 CO 0.02 0.15 -0.17 -0.63 0.00 0.00 0.00 175.10 174.46 1mz5 s ILE 101 N 0.27 1.44 -0.20 2.22 1.01 -0.13 -0.06 121.20 125.75 1mz5 s ILE 101 Ca -0.03 -0.73 -0.06 0.00 0.00 0.00 0.00 60.65 59.83 1mz5 s ILE 101 Cb -0.07 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 1mz5 s ILE 101 CO -0.00 0.41 0.03 -0.69 0.00 0.00 0.00 174.94 174.69 1mz5 s VAL 102 N -0.04 4.26 -0.07 2.92 1.01 -1.26 -0.69 120.40 126.53 1mz5 s VAL 102 Ca -0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 61.98 61.73 1mz5 s VAL 102 Cb -0.11 -2.94 0.03 0.00 0.00 0.00 0.00 36.38 33.37 1mz5 s VAL 102 CO 0.02 0.42 0.03 -0.75 0.00 0.00 0.00 175.10 174.82 1mz5 s LYS 103 N 0.91 0.30 7.79 2.72 2.20 0.29 -4.57 119.74 129.38 1mz5 s LYS 103 Ca 0.02 0.17 0.00 0.00 -0.36 0.00 0.00 55.97 55.80 1mz5 s LYS 103 Cb -0.14 -0.93 0.00 0.00 -1.51 0.00 0.00 37.83 35.25 1mz5 s LYS 103 CO 0.02 -0.36 0.00 0.41 -0.36 0.00 0.00 175.35 175.06 1mz5 n GLY 104 N 5.21 3.31 1.60 5.54 0.00 -1.26 -0.73 105.19 118.86 1mz5 n GLY 104 Ca -0.06 -0.15 0.05 0.00 0.00 0.00 0.00 46.02 45.86 1mz5 n GLY 104 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1mz5 n ASN 105 N 5.41 4.69 -4.48 1.61 6.94 -1.26 -4.38 115.26 123.78 1mz5 n ASN 105 Ca 0.00 -2.74 -0.30 0.00 -0.02 0.00 0.00 54.58 51.52 1mz5 n ASN 105 Cb 0.00 -0.65 -0.12 0.00 -2.36 0.00 0.00 39.78 36.65 1mz5 n ASN 105 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1mz5 s LYS 106 N -2.38 1.95 -0.12 -3.83 1.02 0.09 -0.71 119.74 115.76 1mz5 s LYS 106 Ca 0.43 -1.07 0.01 0.00 0.02 0.00 0.00 55.97 55.36 1mz5 s LYS 106 Cb 0.33 -2.17 -0.01 0.00 -0.52 0.00 0.00 37.83 35.46 1mz5 s LYS 106 CO 0.12 0.51 -0.17 -0.51 -0.92 0.00 0.00 175.35 174.38 1mz5 s LEU 107 N -1.82 2.49 -0.27 3.17 1.02 0.27 -0.55 118.68 122.99 1mz5 s LEU 107 Ca 0.17 -0.41 -0.06 0.00 0.02 0.00 0.00 54.13 53.85 1mz5 s LEU 107 Cb -0.11 -1.54 -0.00 0.00 0.02 0.00 0.00 46.19 44.57 1mz5 s LEU 107 CO 0.08 0.17 0.05 -0.31 0.02 0.00 0.00 176.35 176.36 1mz5 s TYR 108 N 0.32 3.10 -0.20 0.29 2.02 0.13 -0.01 117.35 123.00 1mz5 s TYR 108 Ca -0.13 -0.89 -0.02 0.00 -0.37 0.00 0.00 57.07 55.66 1mz5 s TYR 108 Cb -0.17 -2.22 -0.00 0.00 -0.40 0.00 0.00 41.96 39.17 1mz5 s TYR 108 CO 0.07 -0.54 -0.09 0.42 -1.57 0.00 0.00 175.55 173.84 1mz5 s ILE 109 N 1.51 3.06 -0.18 2.71 1.01 0.32 -0.96 121.20 128.67 1mz5 s ILE 109 Ca 0.04 -0.61 -0.06 0.00 0.00 0.00 0.00 60.65 60.02 1mz5 s ILE 109 Cb -0.16 -2.36 -0.03 0.00 0.01 0.00 0.00 42.46 39.92 1mz5 s ILE 109 CO 0.01 0.46 0.02 -0.22 0.00 0.00 0.00 174.94 175.21 1mz5 s LEU 110 N 1.28 3.51 0.12 2.97 2.96 -0.02 -0.31 118.68 129.18 1mz5 s LEU 110 Ca 0.03 -0.05 0.03 0.00 -0.22 0.00 0.00 54.13 53.92 1mz5 s LEU 110 Cb -0.14 -1.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.63 1mz5 s LEU 110 CO -0.04 0.15 -0.09 0.68 -1.32 0.00 0.00 176.35 175.73 1mz5 s VAL 111 N 0.52 0.96 -0.04 1.68 -7.23 -0.16 -1.20 120.40 114.93 1mz5 s VAL 111 Ca 0.00 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.00 1mz5 s VAL 111 Cb -0.14 -1.76 -0.05 0.00 0.56 0.00 0.00 36.38 34.99 1mz5 s VAL 111 CO 0.02 -0.80 0.49 -0.83 -0.31 0.00 0.00 175.10 173.67 1mz5 s GLY 112 N -3.10 2.50 -0.10 2.32 0.00 -0.32 -0.79 107.32 107.84 1mz5 s GLY 112 Ca 0.14 -0.13 0.04 0.00 0.00 0.00 0.00 44.72 44.78 1mz5 s GLY 112 CO -0.02 0.54 -0.24 -0.45 0.00 0.00 0.00 173.10 172.94 1mz5 s SER 113 N -0.27 3.03 0.01 1.64 0.15 0.14 -1.60 113.70 116.80 1mz5 s SER 113 Ca 0.27 -0.54 0.03 0.00 0.70 0.00 0.00 55.95 56.40 1mz5 s SER 113 Cb -0.17 -1.34 -0.01 0.00 -1.71 0.00 0.00 66.02 62.79 1mz5 s SER 113 CO 0.14 0.16 -0.10 -0.36 1.20 0.00 0.00 173.24 174.28 1mz5 s PHE 114 N 0.31 0.85 -0.23 3.44 0.40 -0.01 -0.48 117.98 122.26 1mz5 s PHE 114 Ca -0.18 -0.25 -0.16 0.00 -0.60 0.00 0.00 56.93 55.75 1mz5 s PHE 114 Cb -0.18 -0.53 -0.11 0.00 0.51 0.00 0.00 43.02 42.72 1mz5 s PHE 114 CO 0.08 -0.01 -0.23 0.09 0.70 0.00 0.00 175.22 175.85 1mz5 n ASN 115 N 2.41 1.92 0.00 1.36 3.02 -1.12 -0.77 115.26 122.09 1mz5 n ASN 115 Ca -0.16 0.38 0.00 0.00 -0.03 0.00 0.00 54.58 54.77 1mz5 n ASN 115 Cb 0.56 -0.83 0.00 0.00 -0.61 0.00 0.00 39.78 38.90 1mz5 n ASN 115 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1mz5 n LYS 116 N -4.37 0.00 -1.68 3.52 2.85 -1.26 -2.93 118.16 114.29 1mz5 n LYS 116 Ca -0.37 -0.16 -0.32 0.00 -1.05 0.00 0.00 58.31 56.41 1mz5 n LYS 116 Cb 0.71 -0.29 0.05 0.00 -0.65 0.00 0.00 35.03 34.85 1mz5 n LYS 116 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1mz5 s THR 117 N 0.00 3.54 0.00 0.58 -4.23 -1.26 -4.93 115.64 109.33 1mz5 s THR 117 Ca 0.00 0.63 0.00 0.00 -1.18 0.00 0.00 61.69 61.14 1mz5 s THR 117 Cb 0.00 -3.18 0.00 0.00 1.34 0.00 0.00 72.50 70.66 1mz5 s THR 117 CO 0.00 -0.53 0.25 0.54 -0.54 0.00 0.00 174.62 174.35 1mz5 n ARG 118 N -2.70 2.87 -3.65 3.99 1.74 -1.26 -4.91 116.66 112.74 1mz5 n ARG 118 Ca 0.09 -0.25 -0.23 0.00 -0.77 0.00 0.00 57.85 56.69 1mz5 n ARG 118 Cb 0.53 -0.75 -0.01 0.00 -1.02 0.00 0.00 32.46 31.21 1mz5 n ARG 118 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1mz5 s ASN 119 N -0.48 4.85 0.42 0.55 4.22 -1.26 -4.86 114.94 118.38 1mz5 s ASN 119 Ca 0.00 -0.99 -0.22 0.00 -2.14 0.00 0.00 52.86 49.51 1mz5 s ASN 119 Cb 0.00 -0.01 -0.10 0.00 1.28 0.00 0.00 41.25 42.42 1mz5 s ASN 119 CO 0.00 -0.94 0.98 -0.94 -2.04 0.00 0.00 177.10 174.16 1mz5 s SER 120 N -4.26 6.83 0.29 3.54 1.04 -1.26 -4.92 113.70 114.96 1mz5 s SER 120 Ca 0.44 1.82 0.04 0.00 0.48 0.00 0.00 55.95 58.72 1mz5 s SER 120 Cb -0.03 -2.56 0.72 0.00 0.10 0.00 0.00 66.02 64.26 1mz5 s SER 120 CO 0.26 -0.43 1.69 4.11 0.98 0.00 0.00 173.24 179.85 1mz5 h TRP 121 N 2.10 0.64 0.00 5.02 5.08 -1.99 0.59 115.95 127.38 1mz5 h TRP 121 Ca -0.49 0.04 0.00 0.00 1.08 0.00 0.00 58.89 59.52 1mz5 h TRP 121 Cb 1.20 -0.14 0.00 0.00 -3.00 0.00 0.00 29.16 27.22 1mz5 h TRP 121 CO 0.60 -0.05 0.00 1.79 -1.28 0.00 0.00 178.44 179.50 1mz5 h THR 122 N 0.39 0.00 -0.02 0.12 1.35 -1.94 -2.34 112.91 110.48 1mz5 h THR 122 Ca 0.56 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 66.13 1mz5 h THR 122 Cb 1.06 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 1mz5 h THR 122 CO -0.53 0.00 -0.11 0.00 -0.25 0.00 0.00 175.52 174.63 1mz5 n GLN 123 N -2.96 1.53 -2.05 4.72 3.00 0.20 -4.38 117.38 117.45 1mz5 n GLN 123 Ca -0.01 -1.01 -0.37 0.00 -0.01 0.00 0.00 57.00 55.60 1mz5 n GLN 123 Cb 0.21 -1.48 0.02 0.00 0.00 0.00 0.00 30.24 28.99 1mz5 n GLN 123 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 1mz5 s HIS 124 N -2.17 2.51 0.14 1.08 3.76 -0.88 -4.93 115.29 114.80 1mz5 s HIS 124 Ca 0.31 1.49 -0.15 0.00 -0.15 0.00 0.00 55.06 56.56 1mz5 s HIS 124 Cb 0.20 -3.51 0.02 0.00 1.11 0.00 0.00 32.58 30.40 1mz5 s HIS 124 CO 0.40 -2.13 1.71 0.07 -0.85 0.00 0.00 174.74 173.93 1mz5 h ARG 125 N 1.32 0.66 0.00 1.40 -0.00 -1.93 -3.47 114.38 112.36 1mz5 h ARG 125 Ca -0.50 -0.11 0.00 0.00 -0.00 0.00 0.00 59.98 59.37 1mz5 h ARG 125 Cb 1.28 -0.11 0.00 0.00 -0.00 0.00 0.00 29.97 31.14 1mz5 h ARG 125 CO 0.57 0.58 0.00 -0.40 -0.00 0.00 0.00 179.97 180.72 1mz5 n ASP 126 N -4.63 0.00 -1.12 0.08 5.68 -1.26 -5.06 116.55 110.24 1mz5 n ASP 126 Ca 0.01 -0.70 0.09 0.00 -0.50 0.00 0.00 54.79 53.69 1mz5 n ASP 126 Cb 0.13 0.00 0.26 0.00 -1.14 0.00 0.00 41.12 40.37 1mz5 n ASP 126 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1mz5 n GLY 127 N 0.00 1.80 0.28 6.12 0.00 -1.26 -4.61 105.19 107.53 1mz5 n GLY 127 Ca 0.00 -0.63 0.14 0.00 0.00 0.00 0.00 46.02 45.53 1mz5 n GLY 127 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1mz5 h SER 128 N 3.30 0.00 0.03 1.61 4.64 -1.97 -1.15 113.55 120.01 1mz5 h SER 128 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1mz5 h SER 128 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1mz5 h SER 128 CO 0.05 0.06 -0.02 -0.67 -0.87 0.00 0.00 176.83 175.37 1mz5 n ASP 129 N -3.70 1.15 -4.42 4.97 2.03 -1.26 -4.97 116.55 110.34 1mz5 n ASP 129 Ca -0.02 -1.32 -0.30 0.00 0.52 0.00 0.00 54.79 53.67 1mz5 n ASP 129 Cb 0.16 0.01 -0.13 0.00 -0.72 0.00 0.00 41.12 40.43 1mz5 n ASP 129 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 1mz5 s TRP 130 N -2.06 2.45 -0.10 -0.67 -0.00 -0.44 -2.78 118.94 115.35 1mz5 s TRP 130 Ca 0.38 -0.32 -0.08 0.00 -0.00 0.00 0.00 56.10 56.08 1mz5 s TRP 130 Cb 0.21 -1.39 0.03 0.00 -0.00 0.00 0.00 33.47 32.32 1mz5 s TRP 130 CO 0.36 0.26 0.26 -1.21 -0.00 0.00 0.00 176.95 176.62 1mz5 s GLU 131 N -1.60 0.28 -0.35 5.86 2.02 0.37 -4.98 118.70 120.29 1mz5 s GLU 131 Ca 0.14 0.41 -0.21 0.00 0.02 0.00 0.00 54.97 55.34 1mz5 s GLU 131 Cb -0.10 0.07 0.00 0.00 0.10 0.00 0.00 34.13 34.20 1mz5 s GLU 131 CO 0.05 -0.07 0.66 -1.25 0.02 0.00 0.00 175.26 174.68 1mz5 s PRO 132 N 0.46 3.71 -0.14 0.39 0.04 -1.26 0.23 135.00 138.43 1mz5 s PRO 132 Ca -0.03 0.12 -0.06 0.00 0.04 0.00 0.00 61.00 61.08 1mz5 s PRO 132 Cb -0.04 -3.80 -0.04 0.00 0.04 0.00 0.00 34.50 30.66 1mz5 s PRO 132 CO -0.02 -0.75 0.06 -0.51 0.04 0.00 0.00 177.00 175.82 1mz5 s LEU 133 N 2.78 3.87 -0.16 -3.56 1.43 0.03 -1.81 118.68 121.26 1mz5 s LEU 133 Ca 0.26 0.19 -0.04 0.00 -1.03 0.00 0.00 54.13 53.51 1mz5 s LEU 133 Cb -0.14 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 1mz5 s LEU 133 CO 0.15 0.29 -0.04 -0.22 0.23 0.00 0.00 176.35 176.77 1mz5 s LEU 134 N -0.36 3.25 -0.04 1.79 2.96 0.42 -0.99 118.68 125.71 1mz5 s LEU 134 Ca 0.09 -0.13 0.03 0.00 -0.22 0.00 0.00 54.13 53.90 1mz5 s LEU 134 Cb -0.12 -1.78 0.01 0.00 0.50 0.00 0.00 46.19 44.79 1mz5 s LEU 134 CO 0.02 0.17 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.41 1mz5 s VAL 135 N 0.36 1.01 -0.18 1.68 1.01 0.57 -0.65 120.40 124.20 1mz5 s VAL 135 Ca -0.04 -0.46 -0.05 0.00 0.00 0.00 0.00 61.98 61.43 1mz5 s VAL 135 Cb -0.14 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.31 1mz5 s VAL 135 CO 0.03 0.31 -0.01 -0.69 0.00 0.00 0.00 175.10 174.74 1mz5 s VAL 136 N 0.32 3.96 0.11 2.92 1.01 -1.26 -0.52 120.40 126.94 1mz5 s VAL 136 Ca -0.07 -0.32 0.08 0.00 0.00 0.00 0.00 61.98 61.67 1mz5 s VAL 136 Cb -0.12 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1mz5 s VAL 136 CO 0.02 0.46 -0.12 -0.83 0.00 0.00 0.00 175.10 174.62 1mz5 s GLY 137 N 0.72 1.76 -0.12 4.51 0.00 0.99 -1.47 107.32 113.72 1mz5 s GLY 137 Ca -0.01 -1.28 0.01 0.00 0.00 0.00 0.00 44.72 43.44 1mz5 s GLY 137 CO 0.02 -1.26 -0.14 1.85 0.00 0.00 0.00 173.10 173.57 1mz5 s GLU 138 N -2.22 2.12 -0.11 2.90 2.12 -0.21 -0.57 118.70 122.73 1mz5 s GLU 138 Ca 0.21 -0.51 -0.15 0.00 0.36 0.00 0.00 54.97 54.87 1mz5 s GLU 138 Cb -0.11 -1.88 -0.05 0.00 0.26 0.00 0.00 34.13 32.35 1mz5 s GLU 138 CO 0.13 -0.13 0.36 0.08 -0.54 0.00 0.00 175.26 175.16 1mz5 s VAL 139 N 1.20 5.22 -0.17 3.70 1.01 0.11 -1.74 120.40 129.74 1mz5 s VAL 139 Ca -0.02 0.71 0.00 0.00 0.00 0.00 0.00 61.98 62.67 1mz5 s VAL 139 Cb -0.14 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.59 1mz5 s VAL 139 CO -0.05 0.42 -0.08 -0.89 0.00 0.00 0.00 175.10 174.50 1mz5 s THR 140 N 0.12 1.35 -0.42 3.92 2.01 -0.86 -4.86 115.64 116.88 1mz5 s THR 140 Ca 0.21 -0.72 -0.09 0.00 0.31 0.00 0.00 61.69 61.39 1mz5 s THR 140 Cb -0.14 -1.43 0.08 0.00 0.01 0.00 0.00 72.50 71.02 1mz5 s THR 140 CO 0.08 0.21 0.27 -0.54 -0.69 0.00 0.00 174.62 173.95 1mz5 s LYS 141 N 1.54 2.59 0.00 4.92 1.02 -1.26 -1.79 119.74 126.77 1mz5 s LYS 141 Ca 0.01 -1.49 0.00 0.00 0.02 0.00 0.00 55.97 54.51 1mz5 s LYS 141 Cb -0.15 -3.80 0.00 0.00 -0.52 0.00 0.00 37.83 33.36 1mz5 s LYS 141 CO -0.08 -0.98 0.00 -1.13 -0.92 0.00 0.00 175.35 172.24 1mz5 n SER 142 N 4.92 0.00 0.00 2.83 3.41 -0.56 -4.94 113.62 119.28 1mz5 n SER 142 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1mz5 n SER 142 Cb 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 1mz5 n SER 142 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mz5 n ALA 143 N -3.00 0.00 -4.02 7.33 0.00 -1.26 -2.95 120.51 116.61 1mz5 n ALA 143 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1mz5 n ALA 143 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 1mz5 n ALA 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mz5 s ALA 144 N -1.00 -2.66 -0.94 0.00 0.00 -0.38 -4.70 121.76 112.07 1mz5 s ALA 144 Ca 0.00 0.11 -0.14 0.00 0.00 0.00 0.00 51.96 51.92 1mz5 s ALA 144 Cb 0.00 0.93 -0.29 0.00 0.00 0.00 0.00 23.12 23.76 1mz5 s ALA 144 CO 0.00 -1.17 2.17 0.27 0.00 0.00 0.00 175.76 177.03 1mz5 n ASN 145 N -1.03 -0.93 0.00 0.00 2.04 -1.26 -1.03 115.26 113.05 1mz5 n ASN 145 Ca 0.05 -0.33 0.00 0.00 -0.44 0.00 0.00 54.58 53.87 1mz5 n ASN 145 Cb 0.58 -0.60 0.00 0.00 -2.53 0.00 0.00 39.78 37.23 1mz5 n ASN 145 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1mz5 n GLY 146 N 5.44 0.72 2.65 4.83 0.00 -1.26 -4.99 105.19 112.59 1mz5 n GLY 146 Ca 0.64 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.42 1mz5 n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mz5 s LYS 147 N -0.21 0.03 0.54 1.61 3.01 -0.20 -5.14 119.74 119.39 1mz5 s LYS 147 Ca 0.00 0.10 -0.21 0.00 -1.01 0.00 0.00 55.97 54.86 1mz5 s LYS 147 Cb 0.00 -1.34 -0.05 0.00 -1.01 0.00 0.00 37.83 35.43 1mz5 s LYS 147 CO 0.00 -0.56 1.21 0.99 0.51 0.00 0.00 175.35 177.51 1mz5 s THR 148 N 2.17 2.74 0.22 2.17 2.01 -1.26 -1.25 115.64 122.43 1mz5 s THR 148 Ca 0.03 0.50 0.00 0.00 0.31 0.00 0.00 61.69 62.54 1mz5 s THR 148 Cb -0.15 -3.23 -0.04 0.00 0.01 0.00 0.00 72.50 69.09 1mz5 s THR 148 CO -0.08 -0.05 0.10 0.42 -0.69 0.00 0.00 174.62 174.32 1mz5 s THR 149 N -1.54 0.28 0.02 -0.82 -4.23 -1.15 -4.81 115.64 103.39 1mz5 s THR 149 Ca 0.71 -1.99 -0.15 0.00 -1.18 0.00 0.00 61.69 59.08 1mz5 s THR 149 Cb -0.31 -2.49 0.02 0.00 1.34 0.00 0.00 72.50 71.06 1mz5 s THR 149 CO 0.36 -0.07 0.33 0.00 -0.54 0.00 0.00 174.62 174.69 1mz5 s ALA 150 N -3.95 -0.77 0.15 3.99 0.00 -1.26 -1.49 121.76 118.42 1mz5 s ALA 150 Ca 0.36 0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.52 1mz5 s ALA 150 Cb 0.07 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 1mz5 s ALA 150 CO 0.11 -0.37 -0.07 0.95 0.00 0.00 0.00 175.76 176.38 1mz5 s THR 151 N -2.14 1.01 -0.04 0.00 -4.23 -0.74 -5.01 115.64 104.50 1mz5 s THR 151 Ca -0.08 -2.03 0.01 0.00 -1.18 0.00 0.00 61.69 58.42 1mz5 s THR 151 Cb -0.02 -1.90 0.02 0.00 1.34 0.00 0.00 72.50 71.94 1mz5 s THR 151 CO -0.01 -0.70 -0.05 -0.63 -0.54 0.00 0.00 174.62 172.70 1mz5 s ILE 152 N -3.43 0.51 -0.12 2.99 1.01 -1.26 -2.04 121.20 118.87 1mz5 s ILE 152 Ca 0.18 -0.14 -0.00 0.00 0.00 0.00 0.00 60.65 60.69 1mz5 s ILE 152 Cb 0.04 -0.52 -0.02 0.00 0.01 0.00 0.00 42.46 41.97 1mz5 s ILE 152 CO 0.01 0.20 -0.11 -0.55 0.00 0.00 0.00 174.94 174.50 1mz5 s SER 153 N 0.71 4.25 -0.19 3.58 0.15 -0.71 -4.91 113.70 116.59 1mz5 s SER 153 Ca -0.09 -0.23 -0.05 0.00 0.70 0.00 0.00 55.95 56.28 1mz5 s SER 153 Cb -0.12 -1.48 -0.03 0.00 -1.71 0.00 0.00 66.02 62.68 1mz5 s SER 153 CO 0.00 0.22 -0.01 0.26 1.20 0.00 0.00 173.24 174.91 1mz5 s TRP 154 N 0.05 3.05 1.15 3.44 0.52 -1.26 -1.05 118.94 124.84 1mz5 s TRP 154 Ca -0.03 -0.39 -0.19 0.00 0.02 0.00 0.00 56.10 55.51 1mz5 s TRP 154 Cb -0.14 -2.05 0.27 0.00 -1.15 0.00 0.00 33.47 30.40 1mz5 s TRP 154 CO 0.04 -0.17 1.17 0.20 0.02 0.00 0.00 176.95 178.21 1mz5 s GLY 155 N 0.81 1.64 0.32 0.98 0.00 -0.54 -5.01 107.32 105.51 1mz5 s GLY 155 Ca 0.00 -1.06 -0.23 0.00 0.00 0.00 0.00 44.72 43.44 1mz5 s GLY 155 CO 0.02 -0.18 0.87 0.54 0.00 0.00 0.00 173.10 174.35 1mz5 s LYS 156 N -5.57 4.38 0.53 2.90 1.02 -1.26 -4.73 119.74 117.01 1mz5 s LYS 156 Ca 0.72 1.12 -0.22 0.00 0.02 0.00 0.00 55.97 57.61 1mz5 s LYS 156 Cb -0.07 -2.66 -0.05 0.00 -0.52 0.00 0.00 37.83 34.53 1mz5 s LYS 156 CO 0.55 0.23 1.32 -2.14 -0.92 0.00 0.00 175.35 174.39 1mz5 s PRO 157 N -2.35 3.25 -0.05 -1.68 0.02 -1.26 -4.71 135.00 128.21 1mz5 s PRO 157 Ca 0.51 2.13 0.05 0.00 0.02 0.00 0.00 61.00 63.71 1mz5 s PRO 157 Cb -0.15 -2.27 -0.00 0.00 0.02 0.00 0.00 34.50 32.09 1mz5 s PRO 157 CO 0.20 -1.07 -0.19 0.08 -0.33 0.00 0.00 177.00 175.69 1mz5 s VAL 158 N -1.36 1.62 0.11 3.83 1.01 0.17 -4.93 120.40 120.85 1mz5 s VAL 158 Ca 0.70 -0.82 -0.24 0.00 0.00 0.00 0.00 61.98 61.63 1mz5 s VAL 158 Cb -0.38 -1.39 -0.07 0.00 0.00 0.00 0.00 36.38 34.54 1mz5 s VAL 158 CO 0.45 0.46 0.71 -0.55 0.00 0.00 0.00 175.10 176.17 1mz5 s SER 159 N 0.03 7.25 0.00 3.32 0.15 -1.26 -0.44 113.70 122.75 1mz5 s SER 159 Ca -0.05 1.48 0.14 0.00 0.70 0.00 0.00 55.95 58.22 1mz5 s SER 159 Cb -0.13 -2.45 0.38 0.00 -1.71 0.00 0.00 66.02 62.11 1mz5 s SER 159 CO 0.03 0.17 1.31 0.18 1.20 0.00 0.00 173.24 176.14 1mz5 n LEU 160 N 1.97 3.15 -0.29 3.45 4.77 -0.75 -4.65 117.00 124.65 1mz5 n LEU 160 Ca -0.06 -1.94 0.00 0.00 -0.03 0.00 0.00 56.01 53.98 1mz5 n LEU 160 Cb 0.50 -0.28 0.13 0.00 -2.33 0.00 0.00 43.42 41.43 1mz5 n LEU 160 CO 0.45 0.78 1.17 0.50 -1.33 0.00 0.00 177.39 178.96 1mz5 h LYS 161 N 2.65 0.89 0.00 3.23 3.64 -1.92 -1.73 116.57 123.33 1mz5 h LYS 161 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1mz5 h LYS 161 Cb 0.79 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1mz5 h LYS 161 CO 0.00 0.59 0.02 -1.35 -2.27 0.00 0.00 179.45 176.44 1mz5 h PRO 162 N 0.92 0.00 -0.01 1.90 0.11 -1.98 -1.97 132.00 130.96 1mz5 h PRO 162 Ca 0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.47 1mz5 h PRO 162 Cb 0.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.28 1mz5 h PRO 162 CO -0.17 0.00 -0.06 1.28 -0.21 0.00 0.00 178.00 178.83 1mz5 n LEU 163 N -3.01 1.46 -4.62 2.35 4.77 -0.65 -4.84 117.00 112.46 1mz5 n LEU 163 Ca -0.03 -0.47 -0.42 0.00 -0.03 0.00 0.00 56.01 55.07 1mz5 n LEU 163 Cb 0.08 -0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 1mz5 n LEU 163 CO 0.19 0.25 0.54 0.12 -1.33 0.00 0.00 177.39 177.16 1mz5 s PHE 164 N -2.12 3.23 0.71 -1.77 5.36 -0.74 -4.94 117.98 117.71 1mz5 s PHE 164 Ca 0.34 0.82 -0.15 0.00 -0.96 0.00 0.00 56.93 56.97 1mz5 s PHE 164 Cb 0.21 -3.11 0.03 0.00 -0.34 0.00 0.00 43.02 39.80 1mz5 s PHE 164 CO 0.38 -0.50 1.20 -2.14 -1.46 0.00 0.00 175.22 172.70 1mz5 s PRO 165 N 2.83 2.29 0.30 10.12 0.02 -1.26 -4.90 135.00 144.39 1mz5 s PRO 165 Ca 0.31 1.73 0.24 0.00 0.02 0.00 0.00 61.00 63.30 1mz5 s PRO 165 Cb -0.15 -1.85 0.37 0.00 0.02 0.00 0.00 34.50 32.89 1mz5 s PRO 165 CO 0.11 -1.71 1.49 0.00 -0.33 0.00 0.00 177.00 176.56 1mz5 h ALA 166 N -0.14 0.84 -2.53 -1.55 0.00 -1.93 -3.42 119.26 110.53 1mz5 h ALA 166 Ca -0.48 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 1mz5 h ALA 166 Cb 1.29 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.91 1mz5 h ALA 166 CO 0.51 0.00 -0.13 -1.83 0.00 0.00 0.00 179.25 177.79 1mz5 s GLU 167 N -3.21 0.89 -0.05 0.00 1.03 -1.26 -0.43 118.70 115.68 1mz5 s GLU 167 Ca 0.06 -0.38 0.01 0.00 0.03 0.00 0.00 54.97 54.70 1mz5 s GLU 167 Cb 0.09 0.40 0.02 0.00 -0.80 0.00 0.00 34.13 33.83 1mz5 s GLU 167 CO 0.69 -0.30 -0.07 -0.06 -1.33 0.00 0.00 175.26 174.18 1mz5 s PHE 168 N -2.45 1.00 -0.99 4.83 2.99 -0.21 -4.79 117.98 118.37 1mz5 s PHE 168 Ca -0.05 -0.33 -0.08 0.00 0.00 0.00 0.00 56.93 56.47 1mz5 s PHE 168 Cb -0.01 -0.81 0.07 0.00 0.00 0.00 0.00 43.02 42.27 1mz5 s PHE 168 CO -0.02 -0.22 0.30 -0.25 -0.00 0.00 0.00 175.22 175.03 1mz5 n ASP 169 N 3.95 -2.61 0.00 1.36 10.43 -1.26 0.36 116.55 128.78 1mz5 n ASP 169 Ca -0.24 -0.21 0.00 0.00 2.57 0.00 0.00 54.79 56.91 1mz5 n ASP 169 Cb 0.51 -2.24 0.00 0.00 1.84 0.00 0.00 41.12 41.23 1mz5 n ASP 169 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1mz5 n GLY 170 N -0.91 1.85 3.64 0.44 0.00 -1.26 -4.99 105.19 103.96 1mz5 n GLY 170 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1mz5 n GLY 170 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mz5 s ILE 171 N -3.39 4.25 -0.01 -0.61 1.01 1.15 -5.00 121.20 118.59 1mz5 s ILE 171 Ca 0.00 1.46 -0.30 0.00 0.00 0.00 0.00 60.65 61.81 1mz5 s ILE 171 Cb 0.00 -4.13 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 1mz5 s ILE 171 CO 0.00 -0.34 1.15 -0.76 0.00 0.00 0.00 174.94 174.99 1mz5 s LEU 172 N 3.94 4.32 0.45 2.97 1.43 -1.26 -1.04 118.68 129.50 1mz5 s LEU 172 Ca 0.54 1.83 -0.12 0.00 -1.03 0.00 0.00 54.13 55.36 1mz5 s LEU 172 Cb -0.18 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.41 1mz5 s LEU 172 CO 0.18 -0.48 0.84 0.42 0.23 0.00 0.00 176.35 177.55 1mz5 s THR 173 N 1.59 4.72 0.09 5.49 -4.23 0.43 -0.99 115.64 122.75 1mz5 s THR 173 Ca 0.56 0.77 0.00 0.00 -1.18 0.00 0.00 61.69 61.83 1mz5 s THR 173 Cb -0.25 -3.75 0.00 0.00 1.34 0.00 0.00 72.50 69.84 1mz5 s THR 173 CO 0.25 -0.62 0.00 1.17 -0.54 0.00 0.00 174.62 174.88 1mz5 n LYS 174 N -1.52 0.00 -3.79 3.99 4.81 -0.51 -4.59 118.16 116.56 1mz5 n LYS 174 Ca 0.04 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.38 1mz5 n LYS 174 Cb 0.54 -0.42 -0.05 0.00 0.02 0.00 0.00 35.03 35.12 1mz5 n LYS 174 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1mz5 s GLU 175 N -2.00 1.16 0.08 1.64 2.02 -1.07 -4.12 118.70 116.41 1mz5 s GLU 175 Ca 0.00 -0.93 -0.06 0.00 0.02 0.00 0.00 54.97 54.00 1mz5 s GLU 175 Cb 0.00 0.44 -0.01 0.00 0.10 0.00 0.00 34.13 34.66 1mz5 s GLU 175 CO 0.00 -0.45 0.13 -0.59 0.02 0.00 0.00 175.26 174.37 1mz5 s PHE 176 N -3.88 0.27 0.03 1.61 -0.12 -1.26 -1.65 117.98 112.98 1mz5 s PHE 176 Ca 0.09 -0.73 -0.13 0.00 -0.05 0.00 0.00 56.93 56.11 1mz5 s PHE 176 Cb 0.02 -0.16 0.02 0.00 -0.63 0.00 0.00 43.02 42.27 1mz5 s PHE 176 CO -0.05 -0.50 0.29 0.08 -0.05 0.00 0.00 175.22 174.98 1mz5 s VAL 177 N -3.88 0.08 0.97 -2.49 1.01 -0.36 -4.72 120.40 111.00 1mz5 s VAL 177 Ca 0.06 -0.65 -0.12 0.00 0.00 0.00 0.00 61.98 61.27 1mz5 s VAL 177 Cb 0.06 -0.84 0.10 0.00 0.00 0.00 0.00 36.38 35.69 1mz5 s VAL 177 CO -0.10 -0.36 0.65 0.61 0.00 0.00 0.00 175.10 175.90 1mz5 n GLY 178 N 0.79 -1.53 0.00 4.51 0.00 -1.26 0.30 105.19 108.00 1mz5 n GLY 178 Ca -0.19 -0.77 0.14 0.00 0.00 0.00 0.00 46.02 45.20 1mz5 n GLY 178 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mz5 n GLY 179 N 1.12 -1.31 0.26 -0.02 0.00 -0.19 -4.45 105.19 100.60 1mz5 n GLY 179 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1mz5 n GLY 179 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1mz5 n VAL 180 N -1.33 -0.98 0.00 1.61 0.31 -1.26 -3.57 118.33 113.10 1mz5 n VAL 180 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1mz5 n VAL 180 Cb 0.26 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.17 1mz5 n VAL 180 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1mz5 n GLY 181 N 1.52 -0.73 3.69 2.92 0.00 -0.48 -4.84 105.19 107.27 1mz5 n GLY 181 Ca 0.00 -2.15 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 1mz5 n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mz5 s ALA 182 N -2.00 3.39 0.00 4.61 0.00 -1.26 -0.18 121.76 126.31 1mz5 s ALA 182 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.13 1mz5 s ALA 182 Cb 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.95 1mz5 s ALA 182 CO 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 175.76 175.37 1mz5 n ALA 183 N 4.50 0.00 -2.45 0.00 0.00 0.92 -4.67 120.51 118.81 1mz5 n ALA 183 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.37 1mz5 n ALA 183 Cb 0.50 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.87 1mz5 n ALA 183 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1mz5 s ILE 184 N 1.63 0.08 -0.23 0.00 -4.36 -1.16 -4.69 121.20 112.46 1mz5 s ILE 184 Ca 0.00 -1.66 -0.12 0.00 -0.26 0.00 0.00 60.65 58.62 1mz5 s ILE 184 Cb 0.00 -1.98 -0.05 0.00 1.25 0.00 0.00 42.46 41.69 1mz5 s ILE 184 CO 0.00 -0.35 0.21 -0.69 0.24 0.00 0.00 174.94 174.35 1mz5 s VAL 185 N -4.02 5.33 0.89 8.37 1.01 -1.26 -0.44 120.40 130.29 1mz5 s VAL 185 Ca 0.22 0.29 -0.11 0.00 0.00 0.00 0.00 61.98 62.37 1mz5 s VAL 185 Cb 0.05 -3.55 0.13 0.00 0.00 0.00 0.00 36.38 33.01 1mz5 s VAL 185 CO 0.02 0.32 1.09 -0.83 0.00 0.00 0.00 175.10 175.70 1mz5 s GLY 186 N 1.06 1.62 0.55 4.51 0.00 0.38 -4.87 107.32 110.57 1mz5 s GLY 186 Ca 0.10 -0.03 0.30 0.00 0.00 0.00 0.00 44.72 45.09 1mz5 s GLY 186 CO 0.05 0.45 2.14 1.48 0.00 0.00 0.00 173.10 177.22 1mz5 h SER 187 N -1.55 0.00 -0.10 1.64 4.64 -1.99 0.26 113.55 116.46 1mz5 h SER 187 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1mz5 h SER 187 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1mz5 h SER 187 CO 0.54 0.07 0.00 -0.46 -0.87 0.00 0.00 176.83 176.11 1mz5 n ASN 188 N -3.60 0.64 0.00 4.97 0.23 -1.26 -4.90 115.26 111.34 1mz5 n ASN 188 Ca -0.02 -1.78 0.00 0.00 -0.53 0.00 0.00 54.58 52.25 1mz5 n ASN 188 Cb 0.19 -0.06 0.00 0.00 -2.08 0.00 0.00 39.78 37.83 1mz5 n ASN 188 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1mz5 n GLY 189 N 0.80 1.74 3.73 4.83 0.00 0.93 -5.04 105.19 112.18 1mz5 n GLY 189 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1mz5 n GLY 189 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mz5 n ASN 190 N 0.00 2.93 -4.69 1.61 4.13 -1.26 -4.66 115.26 113.32 1mz5 n ASN 190 Ca 0.00 1.12 -0.42 0.00 1.68 0.00 0.00 54.58 56.96 1mz5 n ASN 190 Cb 0.00 -1.55 -0.03 0.00 -1.54 0.00 0.00 39.78 36.66 1mz5 n ASN 190 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1mz5 s LEU 191 N -2.09 4.26 -0.22 3.41 1.43 0.32 -0.47 118.68 125.32 1mz5 s LEU 191 Ca 0.61 1.41 0.01 0.00 -1.03 0.00 0.00 54.13 55.13 1mz5 s LEU 191 Cb -0.48 -3.40 0.05 0.00 0.03 0.00 0.00 46.19 42.39 1mz5 s LEU 191 CO 0.58 -0.34 -0.08 -0.69 0.23 0.00 0.00 176.35 176.05 1mz5 s VAL 192 N 1.65 1.62 -0.19 -1.59 1.01 0.42 -1.31 120.40 122.00 1mz5 s VAL 192 Ca 0.45 -1.15 -0.05 0.00 0.00 0.00 0.00 61.98 61.23 1mz5 s VAL 192 Cb -0.18 -1.79 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 1mz5 s VAL 192 CO 0.19 0.02 -0.01 -0.31 0.00 0.00 0.00 175.10 174.99 1mz5 s TYR 193 N 1.38 3.03 0.14 5.22 4.12 -0.07 -2.99 117.35 128.19 1mz5 s TYR 193 Ca -0.04 -0.46 -0.27 0.00 0.02 0.00 0.00 57.07 56.32 1mz5 s TYR 193 Cb -0.18 -2.07 -0.07 0.00 -1.52 0.00 0.00 41.96 38.12 1mz5 s TYR 193 CO -0.07 -0.23 0.83 -1.25 0.02 0.00 0.00 175.55 174.85 1mz5 s PRO 194 N 0.94 4.62 0.15 -1.71 0.04 -1.26 0.72 135.00 138.50 1mz5 s PRO 194 Ca 0.01 1.23 0.05 0.00 0.04 0.00 0.00 61.00 62.33 1mz5 s PRO 194 Cb -0.14 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 1mz5 s PRO 194 CO 0.02 0.45 -0.11 0.14 0.04 0.00 0.00 177.00 177.54 1mz5 s VAL 195 N -0.76 1.27 -0.11 -0.36 -7.23 0.69 -1.02 120.40 112.88 1mz5 s VAL 195 Ca 0.39 -2.02 0.02 0.00 -1.81 0.00 0.00 61.98 58.55 1mz5 s VAL 195 Cb -0.23 -1.81 -0.01 0.00 0.56 0.00 0.00 36.38 34.89 1mz5 s VAL 195 CO 0.27 -0.67 -0.17 0.00 -0.31 0.00 0.00 175.10 174.22 1mz5 s GLN 196 N -3.54 3.19 -0.05 4.82 -2.07 0.15 -1.71 119.66 120.45 1mz5 s GLN 196 Ca 0.16 -0.75 0.05 0.00 -1.82 0.00 0.00 55.36 53.00 1mz5 s GLN 196 Cb 0.01 -2.50 -0.02 0.00 -1.09 0.00 0.00 33.01 29.41 1mz5 s GLN 196 CO 0.02 0.25 -0.20 0.42 -1.32 0.00 0.00 175.29 174.45 1mz5 s ILE 197 N 0.24 2.54 -0.17 3.63 -1.09 0.74 -1.22 121.20 125.86 1mz5 s ILE 197 Ca -0.11 -0.90 -0.04 0.00 -2.23 0.00 0.00 60.65 57.36 1mz5 s ILE 197 Cb -0.16 -1.96 -0.03 0.00 -1.58 0.00 0.00 42.46 38.73 1mz5 s ILE 197 CO 0.06 0.57 -0.02 0.00 -1.23 0.00 0.00 174.94 174.32 1mz5 s ALA 198 N -0.41 3.02 0.73 9.38 0.00 -0.66 -1.08 121.76 132.74 1mz5 s ALA 198 Ca 0.04 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 51.09 1mz5 s ALA 198 Cb -0.12 -1.63 0.12 0.00 0.00 0.00 0.00 23.12 21.49 1mz5 s ALA 198 CO 0.02 0.10 1.02 0.16 0.00 0.00 0.00 175.76 177.05 1mz5 s ASP 199 N 0.56 4.34 0.48 0.00 1.47 -0.46 -1.42 116.67 121.64 1mz5 s ASP 199 Ca -0.02 -0.12 0.15 0.00 1.18 0.00 0.00 52.55 53.73 1mz5 s ASP 199 Cb -0.14 -0.31 1.14 0.00 -0.34 0.00 0.00 42.92 43.27 1mz5 s ASP 199 CO 0.02 -1.87 2.07 0.24 0.68 0.00 0.00 175.17 176.32 1mz5 h MET 200 N -0.63 0.21 -0.34 2.11 2.86 -1.31 -1.02 114.93 116.81 1mz5 h MET 200 Ca -0.39 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.23 1mz5 h MET 200 Cb 1.27 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.88 1mz5 h MET 200 CO 0.44 0.14 0.00 0.41 1.06 0.00 0.00 176.91 178.96 1mz5 n GLY 201 N -1.53 0.32 2.11 8.32 0.00 -1.26 -4.88 105.19 108.28 1mz5 n GLY 201 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1mz5 n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mz5 n GLY 202 N 0.68 0.47 3.79 -0.02 0.00 -0.39 -5.03 105.19 104.70 1mz5 n GLY 202 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1mz5 n GLY 202 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mz5 s ARG 203 N -0.18 4.20 0.04 1.61 0.52 -1.26 -4.82 118.95 119.07 1mz5 s ARG 203 Ca 0.00 1.35 0.07 0.00 -0.52 0.00 0.00 55.73 56.63 1mz5 s ARG 203 Cb 0.00 -2.43 -0.03 0.00 0.52 0.00 0.00 34.95 33.01 1mz5 s ARG 203 CO 0.00 -0.08 -0.18 0.54 0.02 0.00 0.00 175.30 175.61 1mz5 s VAL 204 N -1.84 2.81 0.23 3.52 0.11 -1.26 -1.35 120.40 122.62 1mz5 s VAL 204 Ca 0.59 -1.16 -0.21 0.00 -2.93 0.00 0.00 61.98 58.27 1mz5 s VAL 204 Cb -0.17 -2.18 0.03 0.00 -1.53 0.00 0.00 36.38 32.53 1mz5 s VAL 204 CO 0.22 0.35 0.64 0.72 -3.33 0.00 0.00 175.10 173.70 1mz5 s PHE 205 N -0.92 -0.25 0.26 1.54 -0.12 -0.24 -0.90 117.98 117.35 1mz5 s PHE 205 Ca 0.15 -0.12 0.11 0.00 -0.05 0.00 0.00 56.93 57.02 1mz5 s PHE 205 Cb -0.10 0.59 -0.05 0.00 -0.63 0.00 0.00 43.02 42.83 1mz5 s PHE 205 CO 0.05 -1.07 -0.17 0.95 -0.05 0.00 0.00 175.22 174.93 1mz5 s THR 206 N -3.87 2.64 0.23 -4.49 -4.23 -1.26 -0.19 115.64 104.48 1mz5 s THR 206 Ca 0.08 -2.22 -0.12 0.00 -1.18 0.00 0.00 61.69 58.26 1mz5 s THR 206 Cb -0.04 -2.37 -0.01 0.00 1.34 0.00 0.00 72.50 71.43 1mz5 s THR 206 CO -0.00 -0.33 0.43 -0.54 -0.54 0.00 0.00 174.62 173.64 1mz5 s LYS 207 N -3.34 1.46 -0.19 3.99 1.02 -0.69 -1.71 119.74 120.28 1mz5 s LYS 207 Ca 0.28 -1.25 -0.09 0.00 0.02 0.00 0.00 55.97 54.93 1mz5 s LYS 207 Cb -0.06 0.44 -0.05 0.00 -0.52 0.00 0.00 37.83 37.65 1mz5 s LYS 207 CO 0.15 -0.59 0.11 0.42 -0.92 0.00 0.00 175.35 174.52 1mz5 s ILE 208 N -4.02 5.23 -0.15 2.17 -1.09 -1.26 -0.23 121.20 121.86 1mz5 s ILE 208 Ca 0.22 0.12 0.01 0.00 -2.23 0.00 0.00 60.65 58.78 1mz5 s ILE 208 Cb 0.00 -3.38 0.00 0.00 -1.58 0.00 0.00 42.46 37.51 1mz5 s ILE 208 CO 0.07 0.45 -0.18 -0.32 -1.23 0.00 0.00 174.94 173.73 1mz5 s MET 209 N 0.36 3.13 0.06 2.79 -2.45 0.22 -1.15 119.30 122.26 1mz5 s MET 209 Ca 0.07 -0.79 -0.02 0.00 -1.25 0.00 0.00 55.69 53.69 1mz5 s MET 209 Cb -0.11 -2.55 -0.04 0.00 1.25 0.00 0.00 34.83 33.38 1mz5 s MET 209 CO -0.01 -0.00 0.00 1.52 1.05 0.00 0.00 175.02 177.58 1mz5 s TYR 210 N 0.83 0.52 -0.07 4.11 1.13 -0.18 -0.89 117.35 122.79 1mz5 s TYR 210 Ca -0.06 -1.03 0.02 0.00 -1.41 0.00 0.00 57.07 54.59 1mz5 s TYR 210 Cb -0.15 -0.36 0.02 0.00 -1.10 0.00 0.00 41.96 40.36 1mz5 s TYR 210 CO -0.01 -0.41 -0.11 0.45 -2.51 0.00 0.00 175.55 172.95 1mz5 s SER 211 N -2.93 1.82 0.00 -0.18 0.15 -0.42 -1.39 113.70 110.75 1mz5 s SER 211 Ca 0.09 -0.30 0.27 0.00 0.70 0.00 0.00 55.95 56.71 1mz5 s SER 211 Cb 0.08 -0.82 0.91 0.00 -1.71 0.00 0.00 66.02 64.48 1mz5 s SER 211 CO -0.09 0.00 1.67 -0.62 1.20 0.00 0.00 173.24 175.40 1mz5 n GLU 212 N 4.03 1.76 -2.51 5.44 1.02 -1.26 -0.52 120.64 128.59 1mz5 n GLU 212 Ca -0.21 -1.11 -0.13 0.00 -0.02 0.00 0.00 57.16 55.69 1mz5 n GLU 212 Cb 0.51 -1.47 0.03 0.00 -0.02 0.00 0.00 31.44 30.49 1mz5 n GLU 212 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1mz5 n ASP 213 N 0.34 3.01 -2.86 1.62 3.85 -1.26 -4.91 116.55 116.35 1mz5 n ASP 213 Ca 0.18 -2.92 -0.20 0.00 -0.71 0.00 0.00 54.79 51.14 1mz5 n ASP 213 Cb 0.38 -0.45 0.01 0.00 -1.35 0.00 0.00 41.12 39.72 1mz5 n ASP 213 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 1mz5 n ASP 214 N -0.51 -4.91 0.00 -1.12 10.43 -1.26 -2.85 116.55 116.33 1mz5 n ASP 214 Ca 0.23 -0.14 0.00 0.00 2.57 0.00 0.00 54.79 57.45 1mz5 n ASP 214 Cb 0.83 -4.05 0.00 0.00 1.84 0.00 0.00 41.12 39.74 1mz5 n ASP 214 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1mz5 n GLY 215 N -1.17 0.72 0.16 0.44 0.00 -1.26 -4.96 105.19 99.12 1mz5 n GLY 215 Ca -0.12 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.75 1mz5 n GLY 215 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1mz5 h ASN 216 N 0.00 0.54 -4.10 1.61 -1.24 -1.95 -3.46 115.58 106.98 1mz5 h ASN 216 Ca 0.00 -0.62 -0.35 0.00 0.71 0.00 0.00 56.30 56.03 1mz5 h ASN 216 Cb 0.00 -0.16 -0.17 0.00 0.73 0.00 0.00 38.32 38.73 1mz5 h ASN 216 CO 0.00 1.07 -0.73 0.42 -1.29 0.00 0.00 177.43 176.90 1mz5 s THR 217 N -3.74 1.16 0.03 -3.57 -4.23 -1.26 -5.11 115.64 98.91 1mz5 s THR 217 Ca -0.13 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 1mz5 s THR 217 Cb 0.05 -1.60 -0.02 0.00 1.34 0.00 0.00 72.50 72.27 1mz5 s THR 217 CO 0.80 -0.58 -0.04 0.26 -0.54 0.00 0.00 174.62 174.52 1mz5 s TRP 218 N -2.68 0.34 0.02 3.99 0.52 -1.26 -4.34 118.94 115.53 1mz5 s TRP 218 Ca 0.11 -0.55 0.02 0.00 0.02 0.00 0.00 56.10 55.71 1mz5 s TRP 218 Cb -0.01 -0.23 -0.01 0.00 -1.15 0.00 0.00 33.47 32.06 1mz5 s TRP 218 CO 0.01 -0.18 -0.08 0.15 0.02 0.00 0.00 176.95 176.87 1mz5 s LYS 219 N -1.58 0.57 -0.27 4.98 -0.14 -0.48 -4.95 119.74 117.87 1mz5 s LYS 219 Ca -0.14 -0.51 -0.13 0.00 -1.36 0.00 0.00 55.97 53.83 1mz5 s LYS 219 Cb -0.09 -0.47 -0.04 0.00 -1.68 0.00 0.00 37.83 35.54 1mz5 s LYS 219 CO -0.01 0.11 0.30 -0.06 -0.76 0.00 0.00 175.35 174.93 1mz5 s PHE 220 N -0.73 3.24 0.79 3.18 0.40 -1.26 -1.01 117.98 122.60 1mz5 s PHE 220 Ca -0.03 0.31 -0.11 0.00 -0.60 0.00 0.00 56.93 56.50 1mz5 s PHE 220 Cb -0.06 -2.49 0.07 0.00 0.51 0.00 0.00 43.02 41.05 1mz5 s PHE 220 CO 0.00 -0.18 1.09 0.00 0.70 0.00 0.00 175.22 176.83 1mz5 s ALA 221 N 1.89 2.21 0.23 5.36 0.00 -0.30 -4.96 121.76 126.19 1mz5 s ALA 221 Ca 0.12 -0.06 0.05 0.00 0.00 0.00 0.00 51.96 52.07 1mz5 s ALA 221 Cb -0.16 -3.16 0.24 0.00 0.00 0.00 0.00 23.12 20.04 1mz5 s ALA 221 CO 0.10 -1.75 1.55 0.93 0.00 0.00 0.00 175.76 176.59 1mz5 h GLU 222 N -1.10 0.21 -7.57 0.00 5.08 -1.75 -3.44 114.58 106.01 1mz5 h GLU 222 Ca -0.46 -0.15 -0.45 0.00 -1.00 0.00 0.00 59.36 57.30 1mz5 h GLU 222 Cb 1.25 0.03 0.15 0.00 0.50 0.00 0.00 28.75 30.68 1mz5 h GLU 222 CO 0.57 0.77 0.31 0.20 -1.00 0.00 0.00 179.01 179.86 1mz5 s GLY 223 N -4.36 1.63 0.15 -3.84 0.00 -0.19 -4.98 107.32 95.73 1mz5 s GLY 223 Ca -0.04 -0.80 -0.25 0.00 0.00 0.00 0.00 44.72 43.64 1mz5 s GLY 223 CO 0.80 -0.12 0.81 1.09 0.00 0.00 0.00 173.10 175.67 1mz5 s ARG 224 N -5.49 1.26 0.88 2.90 1.70 -1.26 -4.58 118.95 114.37 1mz5 s ARG 224 Ca 0.68 -0.61 -0.13 0.00 -0.47 0.00 0.00 55.73 55.20 1mz5 s ARG 224 Cb -0.11 0.49 0.13 0.00 -0.57 0.00 0.00 34.95 34.89 1mz5 s ARG 224 CO 0.53 -0.57 1.19 -1.54 -1.08 0.00 0.00 175.30 173.83 1mz5 s SER 225 N -2.79 3.80 0.83 -2.89 1.04 -0.69 -4.87 113.70 108.12 1mz5 s SER 225 Ca 0.08 0.75 -0.11 0.00 0.48 0.00 0.00 55.95 57.15 1mz5 s SER 225 Cb -0.02 -1.18 0.09 0.00 0.10 0.00 0.00 66.02 65.01 1mz5 s SER 225 CO -0.03 -2.35 1.14 -0.54 0.98 0.00 0.00 173.24 172.44 1mz5 s LYS 226 N -5.52 1.69 0.60 4.02 1.02 -1.26 -4.61 119.74 115.67 1mz5 s LYS 226 Ca 0.65 1.45 -0.20 0.00 0.02 0.00 0.00 55.97 57.89 1mz5 s LYS 226 Cb -0.11 -1.81 -0.03 0.00 -0.52 0.00 0.00 37.83 35.36 1mz5 s LYS 226 CO 0.51 -2.12 1.32 -0.06 -0.92 0.00 0.00 175.35 174.08 1mz5 s PHE 227 N -2.61 2.19 0.00 3.18 0.40 -1.26 -3.38 117.98 116.51 1mz5 s PHE 227 Ca 0.66 1.44 0.00 0.00 -0.60 0.00 0.00 56.93 58.43 1mz5 s PHE 227 Cb -0.22 -3.73 0.00 0.00 0.51 0.00 0.00 43.02 39.58 1mz5 s PHE 227 CO 0.54 -2.86 0.00 0.41 0.70 0.00 0.00 175.22 174.01 1mz5 n GLY 228 N 0.79 0.39 3.83 4.36 0.00 -0.07 -5.00 105.19 109.49 1mz5 n GLY 228 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1mz5 n GLY 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mz5 s SER 230 N -0.77 1.28 -0.41 0.00 1.04 -0.13 -2.96 113.70 111.75 1mz5 s SER 230 Ca 0.19 -1.62 -0.10 0.00 0.48 0.00 0.00 55.95 54.89 1mz5 s SER 230 Cb -0.14 0.60 0.01 0.00 0.10 0.00 0.00 66.02 66.60 1mz5 s SER 230 CO 0.08 -1.17 0.24 -0.62 0.98 0.00 0.00 173.24 172.74 1mz5 n GLU 231 N -0.59 -0.71 -2.37 4.02 1.02 -1.26 -0.82 120.64 119.95 1mz5 n GLU 231 Ca 0.04 -0.19 -0.40 0.00 -0.02 0.00 0.00 57.16 56.60 1mz5 n GLU 231 Cb 0.62 -0.39 -0.03 0.00 -0.02 0.00 0.00 31.44 31.62 1mz5 n GLU 231 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1mz5 s PRO 232 N -5.26 4.44 0.02 3.49 0.04 -1.23 -3.79 135.00 132.71 1mz5 s PRO 232 Ca 0.14 1.89 0.05 0.00 0.04 0.00 0.00 61.00 63.12 1mz5 s PRO 232 Cb -0.08 -3.03 -0.03 0.00 0.04 0.00 0.00 34.50 31.40 1mz5 s PRO 232 CO 0.35 0.01 -0.14 0.00 0.04 0.00 0.00 177.00 177.26 1mz5 s ALA 233 N -1.23 2.76 0.06 8.56 0.00 -0.49 -4.21 121.76 127.20 1mz5 s ALA 233 Ca 0.49 -1.12 0.04 0.00 0.00 0.00 0.00 51.96 51.36 1mz5 s ALA 233 Cb -0.33 -0.89 -0.03 0.00 0.00 0.00 0.00 23.12 21.87 1mz5 s ALA 233 CO 0.42 0.59 -0.11 0.54 0.00 0.00 0.00 175.76 177.20 1mz5 s VAL 234 N -0.94 0.85 0.28 0.00 0.11 -1.26 -0.82 120.40 118.62 1mz5 s VAL 234 Ca 0.15 -1.19 -0.04 0.00 -2.93 0.00 0.00 61.98 57.98 1mz5 s VAL 234 Cb -0.11 -0.86 -0.01 0.00 -1.53 0.00 0.00 36.38 33.87 1mz5 s VAL 234 CO 0.06 -0.29 0.36 -1.48 -3.33 0.00 0.00 175.10 170.43 1mz5 s LEU 235 N -1.64 0.96 -0.11 2.54 0.05 -1.07 -4.67 118.68 114.73 1mz5 s LEU 235 Ca -0.05 -1.35 0.01 0.00 0.05 0.00 0.00 54.13 52.78 1mz5 s LEU 235 Cb -0.10 1.16 -0.02 0.00 -2.05 0.00 0.00 46.19 45.18 1mz5 s LEU 235 CO 0.01 -1.11 -0.13 -0.70 -0.55 0.00 0.00 176.35 173.87 1mz5 s GLU 236 N -3.63 3.21 -0.05 1.48 2.12 -1.26 -0.75 118.70 119.82 1mz5 s GLU 236 Ca 0.32 -0.69 -0.02 0.00 0.36 0.00 0.00 54.97 54.94 1mz5 s GLU 236 Cb 0.02 -2.58 0.03 0.00 0.26 0.00 0.00 34.13 31.86 1mz5 s GLU 236 CO 0.16 0.30 0.05 -0.46 -0.54 0.00 0.00 175.26 174.77 1mz5 s TRP 237 N 0.13 0.18 -1.39 5.30 -0.11 0.19 -4.89 118.94 118.35 1mz5 s TRP 237 Ca -0.06 0.14 -0.06 0.00 1.22 0.00 0.00 56.10 57.34 1mz5 s TRP 237 Cb -0.15 -0.55 0.00 0.00 -1.50 0.00 0.00 33.47 31.27 1mz5 s TRP 237 CO 0.05 -0.24 0.39 0.39 -4.62 0.00 0.00 176.95 172.92 1mz5 n GLU 238 N 5.27 -2.27 -1.00 5.86 1.02 -1.26 -0.92 120.64 127.35 1mz5 n GLU 238 Ca -0.04 0.31 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 1mz5 n GLU 238 Cb 0.50 -4.10 0.00 0.00 -0.02 0.00 0.00 31.44 27.82 1mz5 n GLU 238 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1mz5 n GLY 239 N -2.09 0.50 3.18 0.62 0.00 -1.26 -5.03 105.19 101.11 1mz5 n GLY 239 Ca -0.27 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.56 1mz5 n GLY 239 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mz5 s LYS 240 N -0.07 0.85 0.08 1.61 1.02 -0.09 -4.71 119.74 118.42 1mz5 s LYS 240 Ca 0.00 -1.00 -0.27 0.00 0.02 0.00 0.00 55.97 54.71 1mz5 s LYS 240 Cb 0.00 -0.84 -0.06 0.00 -0.52 0.00 0.00 37.83 36.41 1mz5 s LYS 240 CO 0.00 0.18 0.86 -0.51 -0.92 0.00 0.00 175.35 174.96 1mz5 s LEU 241 N -1.86 4.47 -0.21 3.17 1.43 0.11 0.55 118.68 126.34 1mz5 s LEU 241 Ca -0.00 1.62 -0.03 0.00 -1.03 0.00 0.00 54.13 54.69 1mz5 s LEU 241 Cb -0.09 -3.41 -0.00 0.00 0.03 0.00 0.00 46.19 42.72 1mz5 s LEU 241 CO 0.02 -0.03 -0.08 -0.63 0.23 0.00 0.00 176.35 175.86 1mz5 s ILE 242 N -0.02 3.05 -0.26 -0.59 1.01 0.07 -1.55 121.20 122.91 1mz5 s ILE 242 Ca 0.43 -0.61 -0.05 0.00 0.00 0.00 0.00 60.65 60.43 1mz5 s ILE 242 Cb -0.22 -2.36 0.01 0.00 0.01 0.00 0.00 42.46 39.90 1mz5 s ILE 242 CO 0.26 0.46 0.01 -0.63 0.00 0.00 0.00 174.94 175.04 1mz5 s ILE 243 N 1.38 3.52 -0.32 2.92 1.01 0.85 -2.58 121.20 127.98 1mz5 s ILE 243 Ca 0.05 -0.74 -0.08 0.00 0.00 0.00 0.00 60.65 59.88 1mz5 s ILE 243 Cb -0.14 -2.76 0.02 0.00 0.01 0.00 0.00 42.46 39.59 1mz5 s ILE 243 CO -0.05 0.19 0.12 0.21 0.00 0.00 0.00 174.94 175.41 1mz5 s ASN 244 N 1.44 5.34 -0.01 3.58 3.84 0.00 -0.71 114.94 128.42 1mz5 s ASN 244 Ca 0.03 -0.84 -0.01 0.00 0.21 0.00 0.00 52.86 52.24 1mz5 s ASN 244 Cb -0.16 -1.92 -0.04 0.00 -0.55 0.00 0.00 41.25 38.58 1mz5 s ASN 244 CO -0.01 -0.26 0.10 0.20 -2.79 0.00 0.00 177.10 174.35 1mz5 s ASN 245 N 1.50 5.85 0.28 -4.21 0.01 -0.49 -1.40 114.94 116.49 1mz5 s ASN 245 Ca 0.02 0.20 -0.29 0.00 -0.71 0.00 0.00 52.86 52.08 1mz5 s ASN 245 Cb -0.18 -1.73 -0.10 0.00 0.41 0.00 0.00 41.25 39.65 1mz5 s ASN 245 CO 0.04 0.28 1.19 -0.60 -1.51 0.00 0.00 177.10 176.50 1mz5 s ARG 246 N -1.73 4.52 -0.26 -0.60 3.52 0.00 -4.01 118.95 120.39 1mz5 s ARG 246 Ca 0.23 1.97 -0.04 0.00 -0.13 0.00 0.00 55.73 57.76 1mz5 s ARG 246 Cb -0.12 -3.15 0.10 0.00 -1.56 0.00 0.00 34.95 30.21 1mz5 s ARG 246 CO 0.14 0.02 0.16 0.08 -0.81 0.00 0.00 175.30 174.89 1mz5 s VAL 247 N -0.99 -0.14 0.23 7.11 1.01 -1.26 -0.96 120.40 125.39 1mz5 s VAL 247 Ca 0.47 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.59 1mz5 s VAL 247 Cb -0.35 -0.88 -0.09 0.00 0.00 0.00 0.00 36.38 35.06 1mz5 s VAL 247 CO 0.45 -0.57 1.26 -1.81 0.00 0.00 0.00 175.10 174.43 1mz5 s ASP 248 N 2.17 6.96 0.00 3.32 -0.00 -1.26 -3.31 116.67 124.55 1mz5 s ASP 248 Ca 0.08 2.40 0.00 0.00 -0.00 0.00 0.00 52.55 55.02 1mz5 s ASP 248 Cb -0.16 -2.62 0.00 0.00 -0.00 0.00 0.00 42.92 40.15 1mz5 s ASP 248 CO -0.29 -0.45 0.00 0.61 -0.00 0.00 0.00 175.17 175.04 1mz5 n GLY 249 N 1.92 0.55 3.82 0.21 0.00 -0.32 -4.91 105.19 106.45 1mz5 n GLY 249 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 1mz5 n GLY 249 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1mz5 s ASN 250 N -2.11 -0.08 0.61 1.61 3.04 -0.77 -4.55 114.94 112.70 1mz5 s ASN 250 Ca 0.00 -0.67 -0.18 0.00 0.04 0.00 0.00 52.86 52.06 1mz5 s ASN 250 Cb 0.00 0.58 -0.03 0.00 -1.54 0.00 0.00 41.25 40.27 1mz5 s ASN 250 CO 0.00 -1.13 1.15 -0.13 -3.04 0.00 0.00 177.10 173.96 1mz5 s ARG 251 N -2.73 2.96 -0.03 0.43 0.52 -1.26 -4.55 118.95 114.29 1mz5 s ARG 251 Ca 0.16 1.62 -0.30 0.00 -0.52 0.00 0.00 55.73 56.69 1mz5 s ARG 251 Cb -0.03 -1.95 -0.04 0.00 0.52 0.00 0.00 34.95 33.45 1mz5 s ARG 251 CO 0.06 -1.16 1.28 1.03 0.02 0.00 0.00 175.30 176.52 1mz5 s ARG 252 N -3.59 4.33 0.01 3.54 0.52 -0.53 -4.78 118.95 118.44 1mz5 s ARG 252 Ca 0.72 1.79 -0.19 0.00 -0.52 0.00 0.00 55.73 57.54 1mz5 s ARG 252 Cb -0.25 -3.55 -0.06 0.00 0.52 0.00 0.00 34.95 31.61 1mz5 s ARG 252 CO 0.35 -0.49 0.55 -0.51 0.02 0.00 0.00 175.30 175.22 1mz5 s LEU 253 N 2.25 4.45 -0.03 2.53 1.43 -1.26 0.06 118.68 128.11 1mz5 s LEU 253 Ca 0.59 1.14 0.05 0.00 -1.03 0.00 0.00 54.13 54.88 1mz5 s LEU 253 Cb -0.28 -2.85 -0.01 0.00 0.03 0.00 0.00 46.19 43.08 1mz5 s LEU 253 CO 0.24 0.18 -0.18 -0.69 0.23 0.00 0.00 176.35 176.13 1mz5 s VAL 254 N -0.53 1.45 0.19 -1.59 1.01 -1.26 -1.39 120.40 118.28 1mz5 s VAL 254 Ca 0.29 -0.75 0.08 0.00 0.00 0.00 0.00 61.98 61.60 1mz5 s VAL 254 Cb -0.18 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 1mz5 s VAL 254 CO 0.17 0.42 -0.15 -0.31 0.00 0.00 0.00 175.10 175.22 1mz5 s TYR 255 N -0.11 1.69 0.03 5.22 1.51 0.11 -0.43 117.35 125.37 1mz5 s TYR 255 Ca -0.01 -0.55 0.07 0.00 -1.01 0.00 0.00 57.07 55.58 1mz5 s TYR 255 Cb -0.10 -0.81 -0.02 0.00 -0.11 0.00 0.00 41.96 40.91 1mz5 s TYR 255 CO 0.01 0.32 -0.21 -1.21 -1.11 0.00 0.00 175.55 173.35 1mz5 s GLU 256 N -3.34 1.52 -0.05 -0.62 2.02 0.20 -0.10 118.70 118.33 1mz5 s GLU 256 Ca 0.19 -0.91 -0.01 0.00 0.02 0.00 0.00 54.97 54.27 1mz5 s GLU 256 Cb -0.02 -1.60 0.03 0.00 0.10 0.00 0.00 34.13 32.64 1mz5 s GLU 256 CO 0.06 0.42 -0.00 0.45 0.02 0.00 0.00 175.26 176.21 1mz5 s SER 257 N -1.00 1.17 0.00 -0.19 0.15 -0.60 -1.40 113.70 111.84 1mz5 s SER 257 Ca 0.08 -0.06 0.26 0.00 0.70 0.00 0.00 55.95 56.93 1mz5 s SER 257 Cb -0.09 -0.36 0.76 0.00 -1.71 0.00 0.00 66.02 64.62 1mz5 s SER 257 CO 0.01 -0.16 1.57 -1.20 1.20 0.00 0.00 173.24 174.66 1mz5 n SER 258 N 4.75 1.31 -2.58 5.45 7.64 -1.26 -0.71 113.62 128.22 1mz5 n SER 258 Ca -0.14 -1.15 -0.18 0.00 1.01 0.00 0.00 58.87 58.41 1mz5 n SER 258 Cb 0.50 0.12 0.01 0.00 -1.01 0.00 0.00 64.21 63.83 1mz5 n SER 258 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1mz5 n ASP 259 N -0.30 3.09 -3.87 6.43 3.85 -1.26 -4.95 116.55 119.55 1mz5 n ASP 259 Ca 0.14 -3.23 -0.29 0.00 -0.71 0.00 0.00 54.79 50.70 1mz5 n ASP 259 Cb 0.37 -0.50 0.03 0.00 -1.35 0.00 0.00 41.12 39.67 1mz5 n ASP 259 CO 0.00 0.00 0.00 0.80 -1.01 0.00 0.00 177.20 176.99 1mz5 n MET 260 N -0.27 -5.62 -0.39 0.11 0.00 -1.26 -2.12 117.12 107.57 1mz5 n MET 260 Ca 0.24 0.61 0.00 0.00 -0.00 0.00 0.00 57.70 58.56 1mz5 n MET 260 Cb 0.73 -5.48 0.00 0.00 0.00 0.00 0.00 33.22 28.48 1mz5 n MET 260 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1mz5 n GLY 261 N -1.70 1.53 0.34 -5.12 0.00 -1.26 -4.76 105.19 94.21 1mz5 n GLY 261 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1mz5 n GLY 261 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1mz5 h LYS 262 N 3.03 1.07 -4.14 1.61 3.64 -1.77 -0.48 116.57 119.53 1mz5 h LYS 262 Ca 0.00 -0.15 -0.41 0.00 -1.27 0.00 0.00 60.65 58.82 1mz5 h LYS 262 Cb 0.00 -0.20 -0.33 0.00 -0.41 0.00 0.00 32.23 31.29 1mz5 h LYS 262 CO 0.00 0.82 -0.78 -0.08 -2.27 0.00 0.00 179.45 177.15 1mz5 s THR 263 N -5.61 0.60 0.01 1.00 -1.32 -1.26 -1.79 115.64 107.27 1mz5 s THR 263 Ca -0.11 -0.18 0.02 0.00 -1.21 0.00 0.00 61.69 60.21 1mz5 s THR 263 Cb 0.16 -0.60 -0.04 0.00 -1.51 0.00 0.00 72.50 70.52 1mz5 s THR 263 CO 0.81 0.23 -0.02 0.26 -2.21 0.00 0.00 174.62 173.69 1mz5 s TRP 264 N 0.74 3.00 -0.03 9.09 0.52 -1.26 -4.25 118.94 126.75 1mz5 s TRP 264 Ca -0.11 0.03 0.00 0.00 0.02 0.00 0.00 56.10 56.04 1mz5 s TRP 264 Cb -0.13 -1.63 0.02 0.00 -1.15 0.00 0.00 33.47 30.58 1mz5 s TRP 264 CO 0.01 0.43 0.00 0.08 0.02 0.00 0.00 176.95 177.49 1mz5 s VAL 265 N -1.08 0.14 0.24 4.03 1.01 -0.49 -4.95 120.40 119.31 1mz5 s VAL 265 Ca 0.19 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.96 1mz5 s VAL 265 Cb -0.11 -0.23 -0.10 0.00 0.00 0.00 0.00 36.38 35.93 1mz5 s VAL 265 CO 0.10 0.13 1.44 -0.70 0.00 0.00 0.00 175.10 176.07 1mz5 s GLU 266 N 0.93 4.27 -1.48 2.72 2.12 -1.26 -0.62 118.70 125.37 1mz5 s GLU 266 Ca -0.09 2.29 -0.12 0.00 0.36 0.00 0.00 54.97 57.42 1mz5 s GLU 266 Cb -0.12 -3.11 -0.04 0.00 0.26 0.00 0.00 34.13 31.11 1mz5 s GLU 266 CO -0.02 -0.42 2.60 0.00 -0.54 0.00 0.00 175.26 176.89 1mz5 n ALA 267 N 2.39 6.48 0.20 6.30 0.00 0.42 -4.65 120.51 131.66 1mz5 n ALA 267 Ca 0.07 -3.53 0.06 0.00 0.00 0.00 0.00 53.44 50.04 1mz5 n ALA 267 Cb 0.40 -3.42 0.43 0.00 0.00 0.00 0.00 19.45 16.86 1mz5 n ALA 267 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1mz5 h LEU 268 N 8.45 0.00 -1.53 0.00 3.38 -1.89 -0.04 115.31 123.68 1mz5 h LEU 268 Ca 0.72 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.69 1mz5 h LEU 268 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1mz5 h LEU 268 CO 1.81 0.32 0.00 0.61 0.09 0.00 0.00 178.44 181.27 1mz5 n GLY 269 N -0.14 0.81 1.14 0.83 0.00 -1.26 -4.35 105.19 102.21 1mz5 n GLY 269 Ca -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1mz5 n GLY 269 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mz5 n THR 270 N 0.73 0.00 0.08 2.61 -2.24 -1.05 -4.80 114.28 109.61 1mz5 n THR 270 Ca 0.17 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.96 1mz5 n THR 270 Cb 0.41 -0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 68.59 1mz5 n THR 270 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1mz5 n LEU 271 N -1.87 0.08 -4.76 3.22 4.77 -1.04 -4.61 117.00 112.79 1mz5 n LEU 271 Ca 0.00 -0.27 -0.41 0.00 -0.03 0.00 0.00 56.01 55.30 1mz5 n LEU 271 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1mz5 n LEU 271 CO 0.00 0.02 1.10 -0.55 -1.33 0.00 0.00 177.39 176.63 1mz5 s SER 272 N -1.80 6.58 0.00 -1.43 0.15 -0.06 -2.39 113.70 114.75 1mz5 s SER 272 Ca 0.00 2.79 0.00 0.00 0.70 0.00 0.00 55.95 59.44 1mz5 s SER 272 Cb 0.02 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 1mz5 s SER 272 CO 0.13 -0.73 0.00 1.41 1.20 0.00 0.00 173.24 175.26 1mz5 n HIS 273 N 1.61 0.00 -0.07 3.44 8.25 0.11 -4.86 115.22 123.70 1mz5 n HIS 273 Ca 0.04 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.39 1mz5 n HIS 273 Cb 0.40 -0.84 -0.05 0.00 1.12 0.00 0.00 29.99 30.62 1mz5 n HIS 273 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1mz5 h VAL 274 N 0.00 1.25 -2.02 1.59 2.07 -1.68 -3.43 116.25 114.03 1mz5 h VAL 274 Ca 0.00 -0.85 -0.47 0.00 0.82 0.00 0.00 66.70 66.20 1mz5 h VAL 274 Cb 0.13 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1mz5 h VAL 274 CO 0.00 0.26 -0.44 0.26 0.02 0.00 0.00 177.57 177.67 1mz5 s TRP 275 N -5.02 3.16 0.01 1.57 0.51 -1.26 -1.38 118.94 116.52 1mz5 s TRP 275 Ca -0.14 -0.15 -0.00 0.00 -2.12 0.00 0.00 56.10 53.69 1mz5 s TRP 275 Cb 0.07 -1.68 0.00 0.00 -0.81 0.00 0.00 33.47 31.05 1mz5 s TRP 275 CO 0.73 0.30 0.01 -2.37 -0.51 0.00 0.00 176.95 175.11 1mz5 n THR 276 N -1.40 0.00 0.80 2.01 5.66 -1.26 -1.46 114.28 118.64 1mz5 n THR 276 Ca -0.05 -0.03 0.11 0.00 -3.05 0.00 0.00 64.05 61.03 1mz5 n THR 276 Cb 0.58 0.02 0.04 0.00 -1.55 0.00 0.00 70.33 69.42 1mz5 n THR 276 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1mz5 n ASN 277 N -1.59 0.68 0.00 1.09 6.94 -1.26 -4.94 115.26 116.18 1mz5 n ASN 277 Ca -0.00 -0.45 0.00 0.00 -0.02 0.00 0.00 54.58 54.11 1mz5 n ASN 277 Cb 0.01 0.74 0.00 0.00 -2.36 0.00 0.00 39.78 38.17 1mz5 n ASN 277 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1mz5 n SER 278 N -1.70 0.00 -0.34 0.53 3.41 -1.26 -4.65 113.62 109.61 1mz5 n SER 278 Ca 0.03 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.76 1mz5 n SER 278 Cb 0.38 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.64 1mz5 n SER 278 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1mz5 h PRO 279 N 0.00 0.78 -0.01 4.33 0.11 -1.81 -1.70 132.00 133.70 1mz5 h PRO 279 Ca 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1mz5 h PRO 279 Cb 0.00 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 30.93 1mz5 h PRO 279 CO 0.00 0.52 -0.23 0.25 -0.21 0.00 0.00 178.00 178.33 1mz5 n THR 280 N -4.69 0.00 -0.82 -1.15 -2.24 -1.26 -4.67 114.28 99.45 1mz5 n THR 280 Ca 0.21 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1mz5 n THR 280 Cb 0.51 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 1mz5 n THR 280 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1mz5 n SER 281 N -0.09 -1.96 -1.17 3.42 7.64 -0.64 -4.85 113.62 115.97 1mz5 n SER 281 Ca 0.13 0.00 0.08 0.00 1.01 0.00 0.00 58.87 60.09 1mz5 n SER 281 Cb 0.41 -1.83 0.29 0.00 -1.01 0.00 0.00 64.21 62.07 1mz5 n SER 281 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1mz5 n ASN 282 N -0.25 4.28 -4.95 6.43 6.94 -1.26 -1.84 115.26 124.62 1mz5 n ASN 282 Ca 0.00 -2.79 -0.20 0.00 -0.02 0.00 0.00 54.58 51.58 1mz5 n ASN 282 Cb 0.12 -0.54 -0.00 0.00 -2.36 0.00 0.00 39.78 37.00 1mz5 n ASN 282 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 1mz5 s GLN 283 N -2.43 2.59 0.51 -3.83 -1.52 -1.26 -4.62 119.66 109.11 1mz5 s GLN 283 Ca 0.44 -1.47 -0.21 0.00 -1.95 0.00 0.00 55.36 52.16 1mz5 s GLN 283 Cb 0.33 -2.53 -0.06 0.00 -0.22 0.00 0.00 33.01 30.52 1mz5 s GLN 283 CO 0.13 -0.34 1.16 1.14 -0.25 0.00 0.00 175.29 177.14 1mz5 s GLN 284 N -4.29 3.49 0.33 2.91 -2.07 -1.26 -1.18 119.66 117.58 1mz5 s GLN 284 Ca 0.51 1.73 -0.01 0.00 -1.82 0.00 0.00 55.36 55.77 1mz5 s GLN 284 Cb -0.06 -2.18 0.07 0.00 -1.09 0.00 0.00 33.01 29.75 1mz5 s GLN 284 CO 0.31 -0.77 0.45 -3.47 -1.32 0.00 0.00 175.29 170.49 1mz5 n ASP 285 N -0.97 0.55 -3.96 12.60 2.03 -1.26 -4.78 116.55 120.76 1mz5 n ASP 285 Ca 0.10 -1.48 -0.09 0.00 0.52 0.00 0.00 54.79 53.84 1mz5 n ASP 285 Cb 0.49 -0.30 -0.10 0.00 -0.72 0.00 0.00 41.12 40.50 1mz5 n ASP 285 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1mz5 s GLN 287 N -2.58 2.25 0.02 0.00 -0.44 -1.26 -4.79 119.66 112.86 1mz5 s GLN 287 Ca -0.05 1.90 0.01 0.00 -2.50 0.00 0.00 55.36 54.72 1mz5 s GLN 287 Cb -0.01 -1.83 -0.01 0.00 -1.64 0.00 0.00 33.01 29.51 1mz5 s GLN 287 CO -0.05 -1.78 -0.05 -1.12 0.50 0.00 0.00 175.29 172.79 1mz5 s SER 288 N -1.75 0.52 0.15 6.67 0.01 -1.26 -4.63 113.70 113.41 1mz5 s SER 288 Ca 0.78 -0.35 -0.06 0.00 1.31 0.00 0.00 55.95 57.63 1mz5 s SER 288 Cb -0.33 0.02 -0.06 0.00 0.21 0.00 0.00 66.02 65.86 1mz5 s SER 288 CO 0.43 -0.13 0.40 -0.94 0.41 0.00 0.00 173.24 173.41 1mz5 s SER 289 N -0.97 6.53 -0.22 2.44 1.04 -1.24 -4.76 113.70 116.51 1mz5 s SER 289 Ca -0.07 0.66 -0.03 0.00 0.48 0.00 0.00 55.95 56.98 1mz5 s SER 289 Cb -0.07 -2.12 0.10 0.00 0.10 0.00 0.00 66.02 64.04 1mz5 s SER 289 CO -0.00 0.05 0.24 0.12 0.98 0.00 0.00 173.24 174.63 1mz5 s PHE 290 N -1.65 -0.32 -0.02 5.02 5.36 -1.25 -1.89 117.98 123.24 1mz5 s PHE 290 Ca 0.41 0.14 0.01 0.00 -0.96 0.00 0.00 56.93 56.53 1mz5 s PHE 290 Cb -0.12 -0.38 0.01 0.00 -0.34 0.00 0.00 43.02 42.19 1mz5 s PHE 290 CO 0.23 -0.68 -0.01 0.08 -1.46 0.00 0.00 175.22 173.38 1mz5 s VAL 291 N 2.34 0.21 0.01 3.12 1.01 -0.28 -4.56 120.40 122.24 1mz5 s VAL 291 Ca 0.08 -0.02 -0.19 0.00 0.00 0.00 0.00 61.98 61.84 1mz5 s VAL 291 Cb -0.15 -0.24 -0.06 0.00 0.00 0.00 0.00 36.38 35.93 1mz5 s VAL 291 CO -0.17 0.11 0.56 0.00 0.00 0.00 0.00 175.10 175.60 1mz5 s ALA 292 N 0.49 3.54 0.23 5.51 0.00 -1.26 -0.07 121.76 130.19 1mz5 s ALA 292 Ca -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 51.96 51.87 1mz5 s ALA 292 Cb -0.08 -2.67 -0.03 0.00 0.00 0.00 0.00 23.12 20.35 1mz5 s ALA 292 CO -0.01 0.26 0.26 0.14 0.00 0.00 0.00 175.76 176.41 1mz5 s VAL 293 N -0.50 0.00 -0.14 0.00 -7.23 -0.65 -4.98 120.40 106.90 1mz5 s VAL 293 Ca 0.29 -1.82 0.01 0.00 -1.81 0.00 0.00 61.98 58.66 1mz5 s VAL 293 Cb -0.18 -2.43 0.02 0.00 0.56 0.00 0.00 36.38 34.34 1mz5 s VAL 293 CO 0.17 0.00 -0.17 -0.89 -0.31 0.00 0.00 175.10 173.90 1mz5 s THR 294 N -3.98 1.73 -0.10 5.32 2.01 -1.26 -0.80 115.64 118.56 1mz5 s THR 294 Ca 0.34 -0.75 0.02 0.00 0.31 0.00 0.00 61.69 61.61 1mz5 s THR 294 Cb 0.04 -1.58 0.01 0.00 0.01 0.00 0.00 72.50 70.99 1mz5 s THR 294 CO 0.13 0.48 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.77 1mz5 s ILE 295 N 1.19 1.44 -1.50 1.82 1.01 0.65 -4.73 121.20 121.08 1mz5 s ILE 295 Ca -0.00 -0.62 -0.10 0.00 0.00 0.00 0.00 60.65 59.93 1mz5 s ILE 295 Cb -0.14 -1.31 0.07 0.00 0.01 0.00 0.00 42.46 41.09 1mz5 s ILE 295 CO -0.07 0.43 0.78 1.21 0.00 0.00 0.00 174.94 177.29 1mz5 n GLU 296 N 4.12 -4.50 -0.64 2.79 4.07 -1.26 -0.80 120.64 124.41 1mz5 n GLU 296 Ca -0.19 0.52 0.00 0.00 -0.06 0.00 0.00 57.16 57.42 1mz5 n GLU 296 Cb 0.51 -5.17 0.00 0.00 -0.06 0.00 0.00 31.44 26.73 1mz5 n GLU 296 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1mz5 n GLY 297 N -1.67 1.61 3.45 8.31 0.00 -1.26 -4.98 105.19 110.66 1mz5 n GLY 297 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1mz5 n GLY 297 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mz5 s LYS 298 N -0.03 2.86 -0.00 1.61 2.20 0.02 -5.09 119.74 121.31 1mz5 s LYS 298 Ca 0.00 -0.67 -0.30 0.00 -0.36 0.00 0.00 55.97 54.64 1mz5 s LYS 298 Cb 0.00 -2.50 -0.04 0.00 -1.51 0.00 0.00 37.83 33.78 1mz5 s LYS 298 CO 0.00 0.48 1.10 0.50 -0.36 0.00 0.00 175.35 177.07 1mz5 s ARG 299 N -0.34 4.46 0.23 4.03 6.06 -1.26 -0.25 118.95 131.88 1mz5 s ARG 299 Ca 0.04 1.59 0.01 0.00 -2.50 0.00 0.00 55.73 54.87 1mz5 s ARG 299 Cb -0.13 -3.45 -0.04 0.00 0.06 0.00 0.00 34.95 31.40 1mz5 s ARG 299 CO 0.02 -0.23 0.17 0.14 -2.50 0.00 0.00 175.30 172.90 1mz5 s VAL 300 N 1.39 0.00 -0.06 7.11 -7.23 0.02 -4.82 120.40 116.82 1mz5 s VAL 300 Ca 0.55 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.76 1mz5 s VAL 300 Cb -0.24 -2.50 -0.02 0.00 0.56 0.00 0.00 36.38 34.18 1mz5 s VAL 300 CO 0.26 0.00 -0.18 -0.04 -0.31 0.00 0.00 175.10 174.83 1mz5 s MET 301 N -3.97 2.58 -0.12 4.82 -1.94 0.13 -1.64 119.30 119.18 1mz5 s MET 301 Ca 0.39 -0.78 -0.02 0.00 -1.71 0.00 0.00 55.69 53.57 1mz5 s MET 301 Cb 0.06 -2.32 -0.03 0.00 2.01 0.00 0.00 34.83 34.55 1mz5 s MET 301 CO 0.16 0.50 -0.02 -0.51 -0.01 0.00 0.00 175.02 175.14 1mz5 s LEU 302 N -0.43 3.40 -0.04 -0.03 1.43 0.89 -0.99 118.68 122.91 1mz5 s LEU 302 Ca 0.05 0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 1mz5 s LEU 302 Cb -0.12 -1.79 0.01 0.00 0.03 0.00 0.00 46.19 44.32 1mz5 s LEU 302 CO 0.02 0.28 -0.07 0.12 0.23 0.00 0.00 176.35 176.93 1mz5 s PHE 303 N -0.31 0.91 0.10 0.29 5.36 -0.34 -1.12 117.98 122.87 1mz5 s PHE 303 Ca 0.06 -0.26 0.10 0.00 -0.96 0.00 0.00 56.93 55.86 1mz5 s PHE 303 Cb -0.12 -0.72 -0.04 0.00 -0.34 0.00 0.00 43.02 41.80 1mz5 s PHE 303 CO 0.02 -0.17 -0.25 0.95 -1.46 0.00 0.00 175.22 174.31 1mz5 s THR 304 N 0.64 2.32 -0.28 0.12 -4.23 -0.79 -0.60 115.64 112.82 1mz5 s THR 304 Ca -0.10 -1.60 -0.26 0.00 -1.18 0.00 0.00 61.69 58.56 1mz5 s THR 304 Cb -0.13 -2.00 0.15 0.00 1.34 0.00 0.00 72.50 71.87 1mz5 s THR 304 CO 0.01 0.18 1.20 -2.28 -0.54 0.00 0.00 174.62 173.19 1mz5 s HIS 305 N -0.99 -0.29 0.57 3.99 5.04 -0.86 -3.64 115.29 119.11 1mz5 s HIS 305 Ca 0.14 0.68 -0.18 0.00 -1.54 0.00 0.00 55.06 54.16 1mz5 s HIS 305 Cb -0.10 0.42 -0.04 0.00 0.04 0.00 0.00 32.58 32.90 1mz5 s HIS 305 CO 0.05 -0.15 1.11 -2.14 -2.34 0.00 0.00 174.74 171.27 1mz5 s PRO 306 N -0.03 3.23 0.16 2.88 0.02 -1.26 -0.80 135.00 139.21 1mz5 s PRO 306 Ca 0.05 1.51 0.02 0.00 0.02 0.00 0.00 61.00 62.60 1mz5 s PRO 306 Cb -0.04 -2.00 -0.00 0.00 0.02 0.00 0.00 34.50 32.48 1mz5 s PRO 306 CO -0.09 -0.93 1.38 -0.07 -0.33 0.00 0.00 177.00 176.96 1mz5 h LEU 307 N 0.87 0.28 -1.64 -5.54 3.38 -0.32 -3.46 115.31 108.88 1mz5 h LEU 307 Ca -0.49 -0.22 -0.39 0.00 0.09 0.00 0.00 57.88 56.87 1mz5 h LEU 307 Cb 1.25 -0.09 0.09 0.00 0.09 0.00 0.00 40.66 42.01 1mz5 h LEU 307 CO 0.56 1.02 -0.80 -3.20 0.09 0.00 0.00 178.44 176.11 1mz5 n ASN 308 N -3.68 -1.95 0.27 -0.43 5.15 0.07 -4.10 115.26 110.59 1mz5 n ASN 308 Ca -0.04 -0.73 0.15 0.00 -0.60 0.00 0.00 54.58 53.36 1mz5 n ASN 308 Cb 0.80 -4.48 0.72 0.00 -0.53 0.00 0.00 39.78 36.30 1mz5 n ASN 308 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1mz5 h LEU 309 N -1.94 0.00 0.00 1.20 3.38 -1.92 -2.04 115.31 114.00 1mz5 h LEU 309 Ca -0.60 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.31 1mz5 h LEU 309 Cb 1.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 1mz5 h LEU 309 CO 0.55 0.09 -0.64 0.11 0.09 0.00 0.00 178.44 178.64 1mz5 h LYS 310 N 0.00 0.00 0.00 1.13 1.57 -1.92 -3.49 116.57 113.87 1mz5 h LYS 310 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1mz5 h LYS 310 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1mz5 h LYS 310 CO 0.01 0.21 0.00 0.41 -0.57 0.00 0.00 179.45 179.51 1mz5 n GLY 311 N 1.21 -0.61 7.00 3.86 0.00 -0.77 -4.91 105.19 110.97 1mz5 n GLY 311 Ca -0.00 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1mz5 n GLY 311 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mz5 n ARG 312 N -0.66 0.00 -0.21 1.61 1.74 -1.26 -2.14 116.66 115.74 1mz5 n ARG 312 Ca 0.00 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.19 1mz5 n ARG 312 Cb 0.00 0.00 0.27 0.00 -1.02 0.00 0.00 32.46 31.71 1mz5 n ARG 312 CO 0.00 0.00 0.00 -2.67 -1.52 0.00 0.00 177.63 173.44 1mz5 n TRP 313 N 14.00 0.54 -0.25 -1.55 2.14 -1.26 -4.39 117.44 126.67 1mz5 n TRP 313 Ca 0.00 -0.27 -0.05 0.00 2.07 0.00 0.00 57.50 59.25 1mz5 n TRP 313 Cb 0.00 0.00 0.06 0.00 -0.81 0.00 0.00 31.31 30.56 1mz5 n TRP 313 CO 0.00 0.00 0.00 0.52 2.07 0.00 0.00 177.69 180.28 1mz5 h MET 314 N 3.54 0.88 -6.12 -2.67 0.00 -1.78 -3.47 114.93 105.32 1mz5 h MET 314 Ca 0.00 -0.05 -0.42 0.00 0.00 0.00 0.00 59.70 59.22 1mz5 h MET 314 Cb 0.79 -0.20 0.05 0.00 0.00 0.00 0.00 31.60 32.24 1mz5 h MET 314 CO 0.00 0.58 -0.84 0.54 0.00 0.00 0.00 176.91 177.19 1mz5 n ARG 315 N -4.62 -4.53 -1.79 1.72 1.74 -1.26 -3.28 116.66 104.63 1mz5 n ARG 315 Ca 0.06 0.60 -0.31 0.00 -0.77 0.00 0.00 57.85 57.43 1mz5 n ARG 315 Cb 0.04 -5.08 0.04 0.00 -1.02 0.00 0.00 32.46 26.43 1mz5 n ARG 315 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1mz5 s ASP 316 N -4.31 5.66 -0.80 0.55 1.47 -1.26 -0.86 116.67 117.11 1mz5 s ASP 316 Ca 0.03 1.35 -0.02 0.00 1.18 0.00 0.00 52.55 55.09 1mz5 s ASP 316 Cb -0.01 -2.26 -0.02 0.00 -0.34 0.00 0.00 42.92 40.29 1mz5 s ASP 316 CO 0.82 -1.23 0.74 0.54 0.68 0.00 0.00 175.17 176.72 1mz5 n ARG 317 N -2.97 -1.52 -2.20 2.11 1.74 -1.24 -0.75 116.66 111.84 1mz5 n ARG 317 Ca 0.07 1.31 -0.42 0.00 -0.77 0.00 0.00 57.85 58.03 1mz5 n ARG 317 Cb 0.55 -5.67 -0.03 0.00 -1.02 0.00 0.00 32.46 26.29 1mz5 n ARG 317 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1mz5 s LEU 318 N -4.30 4.29 0.29 0.55 2.96 -1.26 -1.06 118.68 120.14 1mz5 s LEU 318 Ca 0.12 2.08 0.08 0.00 -0.22 0.00 0.00 54.13 56.18 1mz5 s LEU 318 Cb -0.02 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.09 1mz5 s LEU 318 CO 0.73 -0.78 0.16 -1.00 -1.32 0.00 0.00 176.35 174.14 1mz5 s HIS 319 N 3.01 2.91 -0.09 5.38 3.76 0.02 -0.38 115.29 129.89 1mz5 s HIS 319 Ca 0.65 -0.22 0.03 0.00 -0.15 0.00 0.00 55.06 55.37 1mz5 s HIS 319 Cb -0.30 -1.47 0.01 0.00 1.11 0.00 0.00 32.58 31.92 1mz5 s HIS 319 CO 0.25 0.45 -0.19 -1.17 -0.85 0.00 0.00 174.74 173.23 1mz5 s LEU 320 N -3.84 1.89 0.22 0.89 2.96 -0.49 -2.02 118.68 118.29 1mz5 s LEU 320 Ca 0.35 -0.46 0.11 0.00 -0.22 0.00 0.00 54.13 53.91 1mz5 s LEU 320 Cb -0.06 -1.18 -0.05 0.00 0.50 0.00 0.00 46.19 45.40 1mz5 s LEU 320 CO 0.24 0.09 -0.22 0.26 -1.32 0.00 0.00 176.35 175.40 1mz5 s TRP 321 N 0.60 2.22 -0.05 5.38 0.51 0.23 -0.43 118.94 127.40 1mz5 s TRP 321 Ca -0.14 -0.37 0.02 0.00 -2.12 0.00 0.00 56.10 53.49 1mz5 s TRP 321 Cb -0.17 -1.05 0.01 0.00 -0.81 0.00 0.00 33.47 31.46 1mz5 s TRP 321 CO 0.05 0.55 -0.10 1.41 -0.51 0.00 0.00 176.95 178.35 1mz5 s MET 322 N -3.02 1.30 -0.02 4.98 -2.45 0.11 -1.19 119.30 119.00 1mz5 s MET 322 Ca 0.24 -0.34 -0.03 0.00 -1.25 0.00 0.00 55.69 54.31 1mz5 s MET 322 Cb -0.06 -1.14 0.00 0.00 1.25 0.00 0.00 34.83 34.88 1mz5 s MET 322 CO 0.11 0.05 0.08 -0.08 1.05 0.00 0.00 175.02 176.24 1mz5 s THR 323 N 0.50 0.02 -0.33 10.11 -1.32 -0.16 -0.60 115.64 123.86 1mz5 s THR 323 Ca -0.09 -0.20 0.09 0.00 -1.21 0.00 0.00 61.69 60.28 1mz5 s THR 323 Cb -0.13 -0.19 0.73 0.00 -1.51 0.00 0.00 72.50 71.41 1mz5 s THR 323 CO 0.02 -0.11 1.81 -0.90 -2.21 0.00 0.00 174.62 173.23 1mz5 n ASP 324 N 2.65 4.68 0.00 8.08 3.85 -1.16 0.22 116.55 134.87 1mz5 n ASP 324 Ca -0.15 -3.28 0.00 0.00 -0.71 0.00 0.00 54.79 50.65 1mz5 n ASP 324 Cb 0.58 -0.75 0.00 0.00 -1.35 0.00 0.00 41.12 39.60 1mz5 n ASP 324 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 1mz5 n ASN 325 N -0.28 -3.48 0.04 -1.12 4.05 -1.26 -4.74 115.26 108.46 1mz5 n ASN 325 Ca 0.42 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.45 1mz5 n ASN 325 Cb 1.40 -1.60 0.00 0.00 1.23 0.00 0.00 39.78 40.81 1mz5 n ASN 325 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1mz5 n GLN 326 N -1.48 0.00 -3.07 1.20 6.02 -1.26 -4.92 117.38 113.87 1mz5 n GLN 326 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.67 1mz5 n GLN 326 Cb 0.17 -0.08 -0.05 0.00 1.02 0.00 0.00 30.24 31.29 1mz5 n GLN 326 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1mz5 s ARG 327 N -1.37 3.93 -0.22 -1.09 3.00 -1.26 -4.82 118.95 117.12 1mz5 s ARG 327 Ca 0.00 0.60 -0.02 0.00 0.00 0.00 0.00 55.73 56.31 1mz5 s ARG 327 Cb 0.00 -2.43 0.07 0.00 0.00 0.00 0.00 34.95 32.59 1mz5 s ARG 327 CO 0.00 0.11 0.03 0.42 0.00 0.00 0.00 175.30 175.86 1mz5 s ILE 328 N -2.09 0.76 -0.17 1.52 1.01 -1.26 -2.96 121.20 118.01 1mz5 s ILE 328 Ca 0.53 -0.84 -0.08 0.00 0.00 0.00 0.00 60.65 60.27 1mz5 s ILE 328 Cb -0.10 -1.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.04 1mz5 s ILE 328 CO 0.21 -0.29 0.09 0.12 0.00 0.00 0.00 174.94 175.08 1mz5 s PHE 329 N 1.73 3.34 -0.59 3.97 5.36 0.24 -4.84 117.98 127.18 1mz5 s PHE 329 Ca 0.00 0.21 -0.21 0.00 -0.96 0.00 0.00 56.93 55.98 1mz5 s PHE 329 Cb -0.17 -2.06 0.07 0.00 -0.34 0.00 0.00 43.02 40.51 1mz5 s PHE 329 CO -0.11 0.29 0.82 0.34 -1.46 0.00 0.00 175.22 175.10 1mz5 s ASP 330 N 0.09 6.22 0.35 6.13 2.15 -1.26 -0.72 116.67 129.63 1mz5 s ASP 330 Ca 0.07 -0.96 0.06 0.00 0.43 0.00 0.00 52.55 52.15 1mz5 s ASP 330 Cb -0.12 -2.36 0.65 0.00 -0.30 0.00 0.00 42.92 40.78 1mz5 s ASP 330 CO 0.00 -1.20 1.87 0.58 -0.17 0.00 0.00 175.17 176.26 1mz5 h VAL 331 N 5.94 1.20 0.00 1.11 2.07 -1.10 -3.48 116.25 121.99 1mz5 h VAL 331 Ca -0.28 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.40 1mz5 h VAL 331 Cb 1.08 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1mz5 h VAL 331 CO 1.10 0.27 0.00 0.61 0.02 0.00 0.00 177.57 179.57 1mz5 n GLY 332 N -0.82 0.96 3.62 2.17 0.00 -1.19 -4.97 105.19 104.96 1mz5 n GLY 332 Ca 0.01 -1.93 -0.40 0.00 0.00 0.00 0.00 46.02 43.69 1mz5 n GLY 332 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1mz5 s GLN 333 N -1.91 4.08 0.10 1.61 0.74 -1.26 -1.39 119.66 121.62 1mz5 s GLN 333 Ca 0.00 0.47 0.21 0.00 0.05 0.00 0.00 55.36 56.09 1mz5 s GLN 333 Cb 0.00 -3.66 -0.12 0.00 1.10 0.00 0.00 33.01 30.33 1mz5 s GLN 333 CO 0.00 -0.41 0.82 0.44 -0.55 0.00 0.00 175.29 175.59 1mz5 n ILE 334 N 5.21 0.64 -1.65 -2.34 -5.35 0.48 -0.98 119.36 115.37 1mz5 n ILE 334 Ca -0.01 -0.58 -0.30 0.00 -0.27 0.00 0.00 62.75 61.58 1mz5 n ILE 334 Cb 0.49 -0.35 0.20 0.00 -1.74 0.00 0.00 39.64 38.24 1mz5 n ILE 334 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1mz5 s SER 335 N -5.26 2.46 -0.21 7.28 1.04 -1.19 -3.81 113.70 114.00 1mz5 s SER 335 Ca -0.03 0.41 -0.04 0.00 0.48 0.00 0.00 55.95 56.76 1mz5 s SER 335 Cb 0.10 -0.53 -0.02 0.00 0.10 0.00 0.00 66.02 65.67 1mz5 s SER 335 CO 0.82 -3.15 -0.02 -0.63 0.98 0.00 0.00 173.24 171.24 1mz5 s ILE 336 N -3.59 3.66 0.00 -1.02 1.01 -1.26 -0.80 121.20 119.19 1mz5 s ILE 336 Ca 0.73 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.97 1mz5 s ILE 336 Cb -0.06 -2.66 0.00 0.00 0.01 0.00 0.00 42.46 39.75 1mz5 s ILE 336 CO 0.54 0.42 0.00 0.61 0.00 0.00 0.00 174.94 176.51 1mz5 n GLY 337 N 4.53 3.14 1.92 6.18 0.00 -1.26 -1.89 105.19 117.80 1mz5 n GLY 337 Ca -0.18 -0.23 0.04 0.00 0.00 0.00 0.00 46.02 45.65 1mz5 n GLY 337 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mz5 n ASP 338 N 2.43 5.55 -4.72 1.61 5.75 -1.26 -4.57 116.55 121.34 1mz5 n ASP 338 Ca 0.00 -3.01 -0.35 0.00 -0.01 0.00 0.00 54.79 51.42 1mz5 n ASP 338 Cb 0.00 -0.70 0.10 0.00 -1.03 0.00 0.00 41.12 39.48 1mz5 n ASP 338 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 1mz5 s GLU 339 N -2.83 2.12 -0.03 0.11 -1.05 -0.79 -4.82 118.70 111.40 1mz5 s GLU 339 Ca 0.55 1.85 -0.30 0.00 -0.15 0.00 0.00 54.97 56.92 1mz5 s GLU 339 Cb 0.42 -1.82 -0.03 0.00 -0.44 0.00 0.00 34.13 32.27 1mz5 s GLU 339 CO 0.15 -1.87 1.05 -0.80 0.95 0.00 0.00 175.26 174.74 1mz5 s ASN 340 N -1.87 7.24 0.00 0.83 0.01 -1.26 -3.60 114.94 116.29 1mz5 s ASN 340 Ca 0.76 1.69 0.00 0.00 -0.71 0.00 0.00 52.86 54.61 1mz5 s ASN 340 Cb -0.31 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 38.78 1mz5 s ASN 340 CO 0.45 -0.39 0.00 -1.54 -1.51 0.00 0.00 177.10 174.11 1mz5 n SER 341 N 4.42 0.00 0.00 -1.22 3.41 -0.04 -0.95 113.62 119.23 1mz5 n SER 341 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 1mz5 n SER 341 Cb 0.49 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1mz5 n SER 341 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mz5 n GLY 342 N 5.00 0.22 3.77 5.00 0.00 -1.21 -4.33 105.19 113.65 1mz5 n GLY 342 Ca 0.00 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 45.01 1mz5 n GLY 342 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mz5 s TYR 343 N 0.00 2.62 0.26 1.61 1.51 -1.26 -4.75 117.35 117.35 1mz5 s TYR 343 Ca 0.00 1.54 -0.09 0.00 -1.01 0.00 0.00 57.07 57.51 1mz5 s TYR 343 Cb 0.00 -3.27 -0.01 0.00 -0.11 0.00 0.00 41.96 38.57 1mz5 s TYR 343 CO 0.00 -1.68 0.43 -1.54 -1.11 0.00 0.00 175.55 171.66 1mz5 s SER 344 N -2.00 0.15 -0.16 2.29 1.04 -1.26 -1.27 113.70 112.49 1mz5 s SER 344 Ca 0.71 -1.12 -0.20 0.00 0.48 0.00 0.00 55.95 55.83 1mz5 s SER 344 Cb -0.23 0.58 0.05 0.00 0.10 0.00 0.00 66.02 66.52 1mz5 s SER 344 CO 0.32 -1.14 0.53 -0.55 0.98 0.00 0.00 173.24 173.38 1mz5 s SER 345 N -3.09 -0.53 0.07 7.02 0.15 -0.45 -4.22 113.70 112.66 1mz5 s SER 345 Ca 0.26 0.92 0.06 0.00 0.70 0.00 0.00 55.95 57.90 1mz5 s SER 345 Cb 0.00 0.93 -0.03 0.00 -1.71 0.00 0.00 66.02 65.22 1mz5 s SER 345 CO 0.12 -0.28 -0.17 0.68 1.20 0.00 0.00 173.24 174.79 1mz5 s VAL 346 N -0.11 1.39 -0.13 4.45 -7.23 -1.26 -1.52 120.40 115.99 1mz5 s VAL 346 Ca -0.03 -1.29 -0.07 0.00 -1.81 0.00 0.00 61.98 58.78 1mz5 s VAL 346 Cb -0.03 -1.27 0.05 0.00 0.56 0.00 0.00 36.38 35.69 1mz5 s VAL 346 CO 0.02 -0.05 0.30 -0.22 -0.31 0.00 0.00 175.10 174.85 1mz5 s LEU 347 N -1.56 0.24 -0.26 1.32 2.96 -0.33 -4.93 118.68 116.12 1mz5 s LEU 347 Ca 0.03 0.65 -0.05 0.00 -0.22 0.00 0.00 54.13 54.54 1mz5 s LEU 347 Cb -0.09 0.95 0.01 0.00 0.50 0.00 0.00 46.19 47.55 1mz5 s LEU 347 CO 0.03 -0.17 0.01 -0.47 -1.32 0.00 0.00 176.35 174.42 1mz5 s TYR 348 N 1.30 3.08 -0.04 5.38 5.04 -1.26 -1.40 117.35 129.44 1mz5 s TYR 348 Ca -0.09 -1.08 -0.01 0.00 -2.44 0.00 0.00 57.07 53.45 1mz5 s TYR 348 Cb -0.10 -2.17 0.03 0.00 0.35 0.00 0.00 41.96 40.08 1mz5 s TYR 348 CO -0.10 -0.59 0.09 0.21 -1.34 0.00 0.00 175.55 173.82 1mz5 s LYS 349 N 1.46 0.03 -1.47 4.97 2.20 -0.13 -4.84 119.74 121.94 1mz5 s LYS 349 Ca 0.03 0.28 -0.05 0.00 -0.36 0.00 0.00 55.97 55.87 1mz5 s LYS 349 Cb -0.16 -0.21 0.04 0.00 -1.51 0.00 0.00 37.83 35.99 1mz5 s LYS 349 CO -0.01 -0.17 0.58 -0.25 -0.36 0.00 0.00 175.35 175.14 1mz5 n ASP 350 N 4.19 -1.47 -2.80 1.43 8.00 -1.26 -0.57 116.55 124.07 1mz5 n ASP 350 Ca -0.27 -0.97 -0.20 0.00 0.71 0.00 0.00 54.79 54.06 1mz5 n ASP 350 Cb 0.51 -3.17 0.01 0.00 -0.02 0.00 0.00 41.12 38.45 1mz5 n ASP 350 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1mz5 n ASP 351 N -2.91 -5.38 -4.06 -2.24 4.64 -1.26 -4.97 116.55 100.37 1mz5 n ASP 351 Ca -0.19 -0.15 -0.20 0.00 -1.38 0.00 0.00 54.79 52.87 1mz5 n ASP 351 Cb 0.63 -4.42 -0.15 0.00 -1.04 0.00 0.00 41.12 36.14 1mz5 n ASP 351 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 1mz5 s LYS 352 N -5.45 0.88 -0.10 -0.67 1.02 0.27 -5.15 119.74 110.54 1mz5 s LYS 352 Ca 0.18 -0.42 -0.02 0.00 0.02 0.00 0.00 55.97 55.73 1mz5 s LYS 352 Cb -0.08 -0.85 -0.03 0.00 -0.52 0.00 0.00 37.83 36.35 1mz5 s LYS 352 CO 0.22 0.23 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.69 1mz5 s LEU 353 N -0.35 3.39 0.09 3.17 2.96 -1.26 -0.96 118.68 125.73 1mz5 s LEU 353 Ca 0.04 0.04 -0.00 0.00 -0.22 0.00 0.00 54.13 53.98 1mz5 s LEU 353 Cb -0.05 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.83 1mz5 s LEU 353 CO -0.00 0.33 -0.01 -0.31 -1.32 0.00 0.00 176.35 175.04 1mz5 s TYR 354 N -0.57 0.75 0.03 5.38 1.51 -0.49 -0.47 117.35 123.48 1mz5 s TYR 354 Ca 0.09 -1.09 0.03 0.00 -1.01 0.00 0.00 57.07 55.09 1mz5 s TYR 354 Cb -0.12 -0.47 -0.02 0.00 -0.11 0.00 0.00 41.96 41.25 1mz5 s TYR 354 CO 0.02 -0.37 -0.10 0.45 -1.11 0.00 0.00 175.55 174.45 1mz5 s SER 355 N -3.00 1.10 -0.19 2.29 0.15 -0.63 -1.19 113.70 112.23 1mz5 s SER 355 Ca 0.15 -0.43 -0.00 0.00 0.70 0.00 0.00 55.95 56.36 1mz5 s SER 355 Cb 0.07 -0.03 0.01 0.00 -1.71 0.00 0.00 66.02 64.36 1mz5 s SER 355 CO -0.04 -0.07 -0.15 -0.22 1.20 0.00 0.00 173.24 173.95 1mz5 s LEU 356 N -1.17 2.35 0.10 3.45 0.20 -0.57 -0.18 118.68 122.86 1mz5 s LEU 356 Ca -0.04 -0.57 -0.11 0.00 0.69 0.00 0.00 54.13 54.10 1mz5 s LEU 356 Cb -0.08 -1.55 0.01 0.00 -0.43 0.00 0.00 46.19 44.14 1mz5 s LEU 356 CO 0.01 -0.00 0.26 -1.38 -0.29 0.00 0.00 176.35 174.95 1mz5 s HIS 357 N 1.32 0.02 0.51 5.38 -3.43 -0.58 -1.34 115.29 117.17 1mz5 s HIS 357 Ca 0.05 -0.40 -0.21 0.00 -0.80 0.00 0.00 55.06 53.70 1mz5 s HIS 357 Cb -0.13 0.05 -0.06 0.00 -1.43 0.00 0.00 32.58 31.00 1mz5 s HIS 357 CO -0.10 -0.59 1.16 -1.21 -2.00 0.00 0.00 174.74 172.01 1mz5 s GLU 358 N -3.72 3.52 0.02 -0.38 2.02 -0.40 -0.95 118.70 118.82 1mz5 s GLU 358 Ca 0.03 1.73 0.05 0.00 0.02 0.00 0.00 54.97 56.80 1mz5 s GLU 358 Cb 0.03 -2.21 -0.02 0.00 0.10 0.00 0.00 34.13 32.04 1mz5 s GLU 358 CO -0.11 -0.74 -0.15 0.96 0.02 0.00 0.00 175.26 175.24 1mz5 s ILE 359 N -1.63 1.20 -0.15 -1.63 -4.36 -0.27 -3.92 121.20 110.43 1mz5 s ILE 359 Ca 0.69 -0.91 -0.02 0.00 -0.26 0.00 0.00 60.65 60.15 1mz5 s ILE 359 Cb -0.27 -1.05 0.05 0.00 1.25 0.00 0.00 42.46 42.43 1mz5 s ILE 359 CO 0.32 0.13 0.01 0.21 0.24 0.00 0.00 174.94 175.85 1mz5 s ASN 360 N -0.90 2.50 -0.16 4.36 3.04 -0.13 -1.67 114.94 121.98 1mz5 s ASN 360 Ca 0.04 -0.57 0.01 0.00 0.04 0.00 0.00 52.86 52.38 1mz5 s ASN 360 Cb -0.07 -0.61 0.01 0.00 -1.54 0.00 0.00 41.25 39.03 1mz5 s ASN 360 CO 0.01 -0.25 -0.18 -0.89 -3.04 0.00 0.00 177.10 172.75 1mz5 s THR 361 N 1.85 2.37 -1.21 -5.21 2.01 -1.06 -4.24 115.64 110.15 1mz5 s THR 361 Ca 0.01 -0.86 0.00 0.00 0.31 0.00 0.00 61.69 61.15 1mz5 s THR 361 Cb -0.15 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.37 1mz5 s THR 361 CO -0.07 0.52 0.00 0.59 -0.69 0.00 0.00 174.62 174.97 1mz5 n ASN 362 N 4.28 -4.17 -1.45 3.53 3.02 -1.26 -1.73 115.26 117.48 1mz5 n ASN 362 Ca -0.20 0.18 -0.12 0.00 -0.03 0.00 0.00 54.58 54.41 1mz5 n ASN 362 Cb 0.51 -3.56 -0.00 0.00 -0.61 0.00 0.00 39.78 36.12 1mz5 n ASN 362 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1mz5 n ASP 363 N -1.70 -3.89 -4.25 6.41 8.00 -1.26 -5.00 116.55 114.86 1mz5 n ASP 363 Ca -0.16 -0.04 -0.33 0.00 0.71 0.00 0.00 54.79 54.97 1mz5 n ASP 363 Cb 0.61 -3.05 -0.15 0.00 -0.02 0.00 0.00 41.12 38.51 1mz5 n ASP 363 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1mz5 s VAL 364 N -2.65 2.64 -0.04 2.53 1.01 -0.70 -4.45 120.40 118.73 1mz5 s VAL 364 Ca 0.03 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.27 1mz5 s VAL 364 Cb -0.01 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 1mz5 s VAL 364 CO 0.04 0.51 -0.11 -0.31 0.00 0.00 0.00 175.10 175.23 1mz5 s TYR 365 N 0.97 2.80 0.32 5.22 1.51 -1.26 -2.56 117.35 124.34 1mz5 s TYR 365 Ca -0.02 -0.08 0.10 0.00 -1.01 0.00 0.00 57.07 56.05 1mz5 s TYR 365 Cb -0.15 -1.64 -0.06 0.00 -0.11 0.00 0.00 41.96 40.01 1mz5 s TYR 365 CO -0.03 0.27 -0.10 -1.12 -1.11 0.00 0.00 175.55 173.47 1mz5 s SER 366 N -0.93 3.83 -0.18 2.29 0.01 -0.67 -1.34 113.70 116.71 1mz5 s SER 366 Ca 0.13 -1.06 -0.04 0.00 1.31 0.00 0.00 55.95 56.29 1mz5 s SER 366 Cb -0.11 -0.41 -0.02 0.00 0.21 0.00 0.00 66.02 65.70 1mz5 s SER 366 CO 0.02 -0.12 -0.04 -0.76 0.41 0.00 0.00 173.24 172.76 1mz5 s LEU 367 N -3.60 3.09 0.04 2.44 1.43 -0.47 -1.11 118.68 120.50 1mz5 s LEU 367 Ca 0.32 -0.25 -0.04 0.00 -1.03 0.00 0.00 54.13 53.13 1mz5 s LEU 367 Cb -0.01 -1.76 -0.05 0.00 0.03 0.00 0.00 46.19 44.40 1mz5 s LEU 367 CO 0.17 0.09 0.26 0.68 0.23 0.00 0.00 176.35 177.78 1mz5 s VAL 368 N 0.86 5.31 -0.24 -1.59 -7.23 -0.12 -2.17 120.40 115.22 1mz5 s VAL 368 Ca -0.01 -0.03 -0.02 0.00 -1.81 0.00 0.00 61.98 60.12 1mz5 s VAL 368 Cb -0.15 -3.59 0.02 0.00 0.56 0.00 0.00 36.38 33.23 1mz5 s VAL 368 CO 0.01 0.25 -0.06 0.12 -0.31 0.00 0.00 175.10 175.11 1mz5 s PHE 369 N -1.42 3.04 -0.03 2.82 5.36 -0.16 -1.52 117.98 126.07 1mz5 s PHE 369 Ca 0.32 -1.45 0.06 0.00 -0.96 0.00 0.00 56.93 54.89 1mz5 s PHE 369 Cb -0.13 -2.07 -0.02 0.00 -0.34 0.00 0.00 43.02 40.46 1mz5 s PHE 369 CO 0.21 -0.70 -0.19 0.08 -1.46 0.00 0.00 175.22 173.15 1mz5 s VAL 370 N 1.35 2.62 -0.43 3.12 1.01 0.75 -1.92 120.40 126.91 1mz5 s VAL 370 Ca 0.01 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 60.97 1mz5 s VAL 370 Cb -0.16 -1.99 0.07 0.00 0.00 0.00 0.00 36.38 34.30 1mz5 s VAL 370 CO -0.04 0.57 0.30 -0.13 0.00 0.00 0.00 175.10 175.80 1mz5 s ARG 371 N -0.72 2.73 -1.41 2.72 0.52 0.13 -1.60 118.95 121.32 1mz5 s ARG 371 Ca 0.11 -1.40 -0.11 0.00 -0.52 0.00 0.00 55.73 53.81 1mz5 s ARG 371 Cb -0.10 -3.88 0.07 0.00 0.52 0.00 0.00 34.95 31.55 1mz5 s ARG 371 CO 0.00 -0.96 2.23 1.19 0.02 0.00 0.00 175.30 177.78 1mz5 n PHE 372 N 5.01 3.09 0.17 -0.53 0.99 0.38 -2.81 117.46 123.75 1mz5 n PHE 372 Ca -0.11 -2.92 -0.14 0.00 -0.00 0.00 0.00 57.45 54.29 1mz5 n PHE 372 Cb 0.43 -2.28 -0.08 0.00 -1.00 0.00 0.00 39.48 36.55 1mz5 n PHE 372 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1mz5 h ILE 373 N 3.64 0.70 -0.31 4.37 1.08 -1.83 -2.63 117.51 122.53 1mz5 h ILE 373 Ca 0.57 -0.49 -0.15 0.00 -0.39 0.00 0.00 64.86 64.40 1mz5 h ILE 373 Cb 0.55 0.95 -0.01 0.00 -3.07 0.00 0.00 36.82 35.25 1mz5 h ILE 373 CO 1.75 0.10 -0.42 1.23 -0.69 0.00 0.00 178.15 180.12 1mz5 h GLY 374 N -0.70 0.85 0.50 5.37 0.00 -1.81 -2.47 103.07 104.80 1mz5 h GLY 374 Ca -0.04 -0.88 0.03 0.00 0.00 0.00 0.00 47.33 46.43 1mz5 h GLY 374 CO 0.07 0.80 -0.22 0.83 0.00 0.00 0.00 176.54 178.02 1mz5 h GLU 375 N 0.63 -0.34 -0.79 4.80 3.07 -1.89 -1.34 114.58 118.72 1mz5 h GLU 375 Ca 0.05 0.02 0.02 0.00 -0.50 0.00 0.00 59.36 58.95 1mz5 h GLU 375 Cb 0.99 0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.93 1mz5 h GLU 375 CO 0.09 -0.23 0.52 1.25 -1.40 0.00 0.00 179.01 179.24 1mz5 h LEU 376 N -0.35 0.86 -0.31 1.33 5.85 -1.44 0.30 115.31 121.55 1mz5 h LEU 376 Ca 0.06 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1mz5 h LEU 376 Cb 0.43 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 1mz5 h LEU 376 CO -0.19 0.61 0.20 -0.61 -0.34 0.00 0.00 178.44 178.10 1mz5 h GLN 377 N 1.01 0.39 -0.44 1.25 4.15 -0.97 -0.41 115.11 120.09 1mz5 h GLN 377 Ca 0.30 -0.02 -0.11 0.00 0.77 0.00 0.00 58.65 59.59 1mz5 h GLN 377 Cb -0.03 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.56 1mz5 h GLN 377 CO -0.08 0.26 -0.16 1.25 -1.93 0.00 0.00 178.83 178.17 1mz5 h LEU 378 N 0.40 0.85 -0.44 -2.39 5.85 -0.40 -2.34 115.31 116.84 1mz5 h LEU 378 Ca 0.11 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 1mz5 h LEU 378 Cb -0.04 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 1mz5 h LEU 378 CO -0.03 1.00 0.27 0.24 -0.34 0.00 0.00 178.44 179.59 1mz5 h MET 379 N 0.75 0.59 -0.75 1.25 2.86 0.14 -1.36 114.93 118.41 1mz5 h MET 379 Ca 0.11 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.67 1mz5 h MET 379 Cb 0.68 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 1mz5 h MET 379 CO 0.05 0.42 0.33 0.87 1.06 0.00 0.00 176.91 179.64 1mz5 h LYS 380 N 0.59 1.10 -0.24 1.72 1.57 -1.04 0.53 116.57 120.80 1mz5 h LYS 380 Ca 0.16 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1mz5 h LYS 380 Cb -0.02 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1mz5 h LYS 380 CO -0.03 0.88 0.11 1.03 -0.57 0.00 0.00 179.45 180.87 1mz5 h SER 381 N 1.06 0.31 0.22 0.86 0.87 -0.94 -0.43 113.55 115.51 1mz5 h SER 381 Ca 0.25 -0.12 -0.10 0.00 -1.23 0.00 0.00 61.79 60.59 1mz5 h SER 381 Cb 0.17 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 1mz5 h SER 381 CO -0.03 0.35 -0.39 -0.37 -0.53 0.00 0.00 176.83 175.86 1mz5 h VAL 382 N 0.25 1.30 -0.73 2.23 -1.51 -0.91 -1.17 116.25 115.70 1mz5 h VAL 382 Ca 0.08 -1.47 -0.02 0.00 -1.23 0.00 0.00 66.70 64.07 1mz5 h VAL 382 Cb 0.12 1.65 -0.03 0.00 -2.13 0.00 0.00 31.29 30.90 1mz5 h VAL 382 CO -0.01 0.44 0.40 0.58 -1.23 0.00 0.00 177.57 177.75 1mz5 h VAL 383 N 0.20 1.23 -0.68 7.19 2.07 -0.67 -1.23 116.25 124.35 1mz5 h VAL 383 Ca 0.02 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 1mz5 h VAL 383 Cb 0.78 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 1mz5 h VAL 383 CO 0.06 0.25 0.33 0.03 0.02 0.00 0.00 177.57 178.26 1mz5 h ARG 384 N 1.01 0.98 -0.03 1.57 3.08 -0.61 -1.19 114.38 119.20 1mz5 h ARG 384 Ca 0.26 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 60.18 1mz5 h ARG 384 Cb 0.05 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 1mz5 h ARG 384 CO -0.04 0.78 -0.07 1.15 -1.07 0.00 0.00 179.97 180.72 1mz5 h THR 385 N 0.95 0.81 -0.65 2.04 2.02 -0.77 -1.72 112.91 115.59 1mz5 h THR 385 Ca 0.23 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.50 1mz5 h THR 385 Cb 0.12 0.81 -0.07 0.00 -1.74 0.00 0.00 68.15 67.27 1mz5 h THR 385 CO -0.03 0.00 0.30 -0.50 0.37 0.00 0.00 175.52 175.66 1mz5 h TRP 386 N -0.10 0.52 -0.31 3.16 6.55 -0.87 0.79 115.95 125.69 1mz5 h TRP 386 Ca 0.04 0.03 -0.07 0.00 0.95 0.00 0.00 58.89 59.84 1mz5 h TRP 386 Cb 0.16 -0.14 -0.01 0.00 -0.86 0.00 0.00 29.16 28.31 1mz5 h TRP 386 CO -0.15 0.18 -0.08 0.87 -1.05 0.00 0.00 178.44 178.21 1mz5 h LYS 387 N 0.51 0.61 -0.15 0.49 1.57 -1.08 -1.35 116.57 117.17 1mz5 h LYS 387 Ca 0.32 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 1mz5 h LYS 387 Cb 0.35 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1mz5 h LYS 387 CO -0.27 0.79 -0.01 0.93 -0.57 0.00 0.00 179.45 180.32 1mz5 h GLU 388 N 0.38 0.27 -0.59 3.15 5.08 -0.91 0.24 114.58 122.21 1mz5 h GLU 388 Ca 0.08 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1mz5 h GLU 388 Cb 0.57 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1mz5 h GLU 388 CO 0.03 0.51 0.09 1.49 -1.00 0.00 0.00 179.01 180.13 1mz5 h GLU 389 N 0.00 0.98 -0.78 2.33 4.57 -0.86 -1.29 114.58 119.54 1mz5 h GLU 389 Ca 0.04 -0.26 -0.04 0.00 -1.18 0.00 0.00 59.36 57.92 1mz5 h GLU 389 Cb 0.39 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 1mz5 h GLU 389 CO 0.01 0.93 0.32 -0.44 -1.18 0.00 0.00 179.01 178.65 1mz5 h ASP 390 N 0.88 1.06 -0.02 1.04 3.32 -1.08 -0.96 116.42 120.66 1mz5 h ASP 390 Ca 0.18 -0.17 -0.16 0.00 0.02 0.00 0.00 57.03 56.91 1mz5 h ASP 390 Cb 0.42 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1mz5 h ASP 390 CO 0.01 0.93 -0.51 0.78 -1.72 0.00 0.00 179.24 178.74 1mz5 h ASN 391 N 1.12 0.65 0.10 6.45 -0.26 -0.37 0.42 115.58 123.69 1mz5 h ASN 391 Ca 0.26 -0.33 -0.01 0.00 -0.56 0.00 0.00 56.30 55.66 1mz5 h ASN 391 Cb 0.20 -0.18 0.00 0.00 -1.06 0.00 0.00 38.32 37.27 1mz5 h ASN 391 CO -0.02 1.04 -0.05 -0.74 -1.06 0.00 0.00 177.43 176.60 1mz5 h HIS 392 N 0.46 -0.13 -0.85 1.19 -0.00 -1.03 -0.99 115.15 113.80 1mz5 h HIS 392 Ca 0.02 -0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.36 1mz5 h HIS 392 Cb 1.05 0.04 -0.04 0.00 -0.00 0.00 0.00 27.41 28.47 1mz5 h HIS 392 CO 0.05 0.13 0.43 -0.07 -0.00 0.00 0.00 177.93 178.46 1mz5 h LEU 393 N -0.38 1.10 -0.56 0.26 3.38 -1.10 -1.46 115.31 116.54 1mz5 h LEU 393 Ca -0.01 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1mz5 h LEU 393 Cb 0.32 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1mz5 h LEU 393 CO 0.02 0.91 0.00 0.00 0.09 0.00 0.00 178.44 179.47 1mz5 n ALA 394 N -2.41 1.65 1.06 1.53 0.00 0.13 -2.76 120.51 119.70 1mz5 n ALA 394 Ca 0.08 0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.70 1mz5 n ALA 394 Cb 0.13 -1.35 0.08 0.00 0.00 0.00 0.00 19.45 18.30 1mz5 n ALA 394 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1mz5 n SER 395 N -2.08 1.84 -4.75 0.00 7.64 -0.39 -4.80 113.62 111.08 1mz5 n SER 395 Ca 0.02 -1.40 -0.41 0.00 1.01 0.00 0.00 58.87 58.09 1mz5 n SER 395 Cb 0.21 0.40 -0.02 0.00 -1.01 0.00 0.00 64.21 63.79 1mz5 n SER 395 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1mz5 s ILE 396 N -2.47 2.84 -0.60 0.44 1.01 -1.11 -4.97 121.20 116.34 1mz5 s ILE 396 Ca 0.20 0.76 -0.23 0.00 0.00 0.00 0.00 60.65 61.37 1mz5 s ILE 396 Cb 0.18 -3.48 0.05 0.00 0.01 0.00 0.00 42.46 39.22 1mz5 s ILE 396 CO 0.56 0.14 0.95 0.00 0.00 0.00 0.00 174.94 176.58 1mz5 s THR 398 N 3.99 5.03 0.27 0.00 -4.23 -1.26 -4.90 115.64 114.54 1mz5 s THR 398 Ca 0.26 -0.19 -0.30 0.00 -1.18 0.00 0.00 61.69 60.28 1mz5 s THR 398 Cb -0.15 -3.86 -0.11 0.00 1.34 0.00 0.00 72.50 69.72 1mz5 s THR 398 CO 0.15 -0.67 1.61 -2.84 -0.54 0.00 0.00 174.62 172.32 1mz5 s PRO 399 N -4.47 4.14 0.17 3.99 0.02 -1.26 0.61 135.00 138.20 1mz5 s PRO 399 Ca 0.43 2.56 -0.30 0.00 0.02 0.00 0.00 61.00 63.70 1mz5 s PRO 399 Cb -0.10 -3.04 -0.08 0.00 0.02 0.00 0.00 34.50 31.29 1mz5 s PRO 399 CO 0.39 -0.64 1.33 0.08 -0.33 0.00 0.00 177.00 177.84 1mz5 s VAL 400 N 0.25 3.26 0.01 3.83 1.01 -1.26 -3.73 120.40 123.76 1mz5 s VAL 400 Ca 0.65 0.99 -0.08 0.00 0.00 0.00 0.00 61.98 63.54 1mz5 s VAL 400 Cb -0.48 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 1mz5 s VAL 400 CO 0.44 0.12 0.29 -0.69 0.00 0.00 0.00 175.10 175.27 1mz5 s VAL 401 N 0.45 5.26 0.25 2.92 1.01 -1.26 -4.95 120.40 124.08 1mz5 s VAL 401 Ca 0.59 0.29 -0.31 0.00 0.00 0.00 0.00 61.98 62.56 1mz5 s VAL 401 Cb -0.36 -3.58 -0.13 0.00 0.00 0.00 0.00 36.38 32.31 1mz5 s VAL 401 CO 0.35 0.40 1.39 -2.65 0.00 0.00 0.00 175.10 174.60 1mz5 n PRO 402 N 1.25 2.06 0.00 2.72 -0.02 -1.26 -5.12 135.00 134.62 1mz5 n PRO 402 Ca -0.12 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1mz5 n PRO 402 Cb 0.53 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1mz5 n PRO 402 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mz5 n ALA 403 N 1.70 2.68 0.31 3.55 0.00 -1.26 -5.29 120.51 122.20 1mz5 n ALA 403 Ca 0.11 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.74 1mz5 n ALA 403 Cb 0.32 0.00 0.98 0.00 0.00 0.00 0.00 19.45 20.75 1mz5 n ALA 403 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1mz5 h GLY 410 N 0.00 0.00 -3.70 0.00 0.00 -2.04 -3.58 103.07 93.75 1mz5 h GLY 410 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 1mz5 h GLY 410 CO 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 176.54 175.82 1mz5 n GLY 412 N 0.55 -0.51 3.61 0.00 0.00 0.20 -4.72 105.19 104.32 1mz5 n GLY 412 Ca -0.16 -1.76 -0.39 0.00 0.00 0.00 0.00 46.02 43.71 1mz5 n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mz5 n ALA 413 N -3.00 0.22 -1.74 4.61 0.00 -1.26 -4.60 120.51 114.74 1mz5 n ALA 413 Ca 0.00 0.10 -0.38 0.00 0.00 0.00 0.00 53.44 53.16 1mz5 n ALA 413 Cb 0.00 -2.10 0.05 0.00 0.00 0.00 0.00 19.45 17.40 1mz5 n ALA 413 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mz5 s ALA 414 N -1.42 2.70 0.02 0.00 0.00 -1.26 -4.61 121.76 117.18 1mz5 s ALA 414 Ca 0.70 1.30 -0.33 0.00 0.00 0.00 0.00 51.96 53.63 1mz5 s ALA 414 Cb -0.47 -3.56 -0.11 0.00 0.00 0.00 0.00 23.12 18.98 1mz5 s ALA 414 CO 0.51 -1.43 1.85 0.28 0.00 0.00 0.00 175.76 176.97 1mz5 n VAL 415 N -1.28 0.49 -1.83 0.00 0.31 -1.26 -4.87 118.33 109.89 1mz5 n VAL 415 Ca 0.12 -0.09 -0.42 0.00 -0.01 0.00 0.00 64.34 63.94 1mz5 n VAL 415 Cb 0.46 -1.97 -0.03 0.00 -0.91 0.00 0.00 33.84 31.39 1mz5 n VAL 415 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1mz5 s PRO 416 N 3.38 4.17 -0.00 5.55 0.02 -1.26 -4.58 135.00 142.28 1mz5 s PRO 416 Ca 0.87 2.46 0.02 0.00 0.02 0.00 0.00 61.00 64.38 1mz5 s PRO 416 Cb -0.59 -3.49 -0.03 0.00 0.02 0.00 0.00 34.50 30.40 1mz5 s PRO 416 CO 0.44 -0.76 0.05 0.25 -0.33 0.00 0.00 177.00 176.65 1mz5 n THR 417 N 4.57 0.00 -1.90 0.99 -2.24 -1.26 -4.86 114.28 109.58 1mz5 n THR 417 Ca 0.16 -0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.46 1mz5 n THR 417 Cb 0.39 0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 69.05 1mz5 n THR 417 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mz5 s ALA 418 N -2.13 3.78 0.00 6.98 0.00 -1.26 -1.57 121.76 127.56 1mz5 s ALA 418 Ca -0.01 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.32 1mz5 s ALA 418 Cb 0.01 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1mz5 s ALA 418 CO 0.09 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.39 1mz5 n GLY 419 N 3.84 0.80 3.61 0.00 0.00 -1.26 -4.93 105.19 107.25 1mz5 n GLY 419 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1mz5 n GLY 419 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mz5 s LEU 420 N 0.00 3.65 -0.24 0.99 0.20 -0.61 -0.66 118.68 122.01 1mz5 s LEU 420 Ca 0.00 0.85 -0.14 0.00 0.69 0.00 0.00 54.13 55.53 1mz5 s LEU 420 Cb 0.00 -3.54 -0.17 0.00 -0.43 0.00 0.00 46.19 42.05 1mz5 s LEU 420 CO 0.00 -1.35 -0.07 0.52 -0.29 0.00 0.00 176.35 175.16 1mz5 n VAL 421 N 6.89 1.56 -4.10 1.68 0.31 0.14 -4.69 118.33 120.10 1mz5 n VAL 421 Ca 0.16 -0.32 -0.08 0.00 -0.01 0.00 0.00 64.34 64.09 1mz5 n VAL 421 Cb 0.48 -1.86 -0.10 0.00 -0.91 0.00 0.00 33.84 31.45 1mz5 n VAL 421 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1mz5 s GLY 422 N -5.43 0.53 -0.23 2.92 0.00 -1.10 -4.59 107.32 99.43 1mz5 s GLY 422 Ca -0.33 -1.23 -0.09 0.00 0.00 0.00 0.00 44.72 43.06 1mz5 s GLY 422 CO 0.57 -1.34 0.51 -0.12 0.00 0.00 0.00 173.10 172.71 1mz5 s PHE 423 N -3.85 -0.91 -0.23 1.90 5.99 -1.26 -0.85 117.98 118.76 1mz5 s PHE 423 Ca 0.08 1.73 -0.02 0.00 0.00 0.00 0.00 56.93 58.73 1mz5 s PHE 423 Cb 0.07 0.45 0.02 0.00 0.00 0.00 0.00 43.02 43.56 1mz5 s PHE 423 CO -0.09 -0.50 -0.08 -0.51 -0.00 0.00 0.00 175.22 174.04 1mz5 s LEU 424 N 2.26 2.96 0.00 6.12 1.43 0.07 0.55 118.68 132.07 1mz5 s LEU 424 Ca -0.06 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.32 1mz5 s LEU 424 Cb -0.10 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.47 1mz5 s LEU 424 CO -0.15 -0.08 0.00 -0.24 0.23 0.00 0.00 176.35 176.11 1mz5 n SER 425 N 4.69 0.00 -0.06 2.29 2.88 -1.26 -0.95 113.62 121.21 1mz5 n SER 425 Ca -0.18 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.24 1mz5 n SER 425 Cb 0.48 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.88 1mz5 n SER 425 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 1mz5 h HIS 426 N 0.00 0.42 -2.84 0.66 2.76 -1.90 -3.23 115.15 111.01 1mz5 h HIS 426 Ca 0.00 -0.12 -0.53 0.00 -2.20 0.00 0.00 60.37 57.53 1mz5 h HIS 426 Cb 0.00 -0.09 0.03 0.00 1.55 0.00 0.00 27.41 28.90 1mz5 h HIS 426 CO 0.00 0.72 0.86 -1.12 -1.30 0.00 0.00 177.93 177.09 1mz5 s SER 427 N -6.08 6.65 -0.18 3.26 0.01 -1.26 -4.61 113.70 111.49 1mz5 s SER 427 Ca -0.14 2.51 -0.35 0.00 1.31 0.00 0.00 55.95 59.29 1mz5 s SER 427 Cb 0.05 -2.59 0.14 0.00 0.21 0.00 0.00 66.02 63.83 1mz5 s SER 427 CO 0.75 -0.79 1.19 0.00 0.41 0.00 0.00 173.24 174.79 1mz5 s ALA 428 N 1.40 -2.05 0.00 1.44 0.00 -1.26 -2.28 121.76 119.01 1mz5 s ALA 428 Ca 0.69 1.56 0.00 0.00 0.00 0.00 0.00 51.96 54.22 1mz5 s ALA 428 Cb -0.41 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.59 1mz5 s ALA 428 CO 0.31 -0.59 0.00 0.27 0.00 0.00 0.00 175.76 175.75 1mz5 n ASN 429 N -0.08 0.00 0.00 0.00 0.23 -0.18 -5.01 115.26 110.22 1mz5 n ASN 429 Ca -0.00 -0.76 0.08 0.00 -0.53 0.00 0.00 54.58 53.37 1mz5 n ASN 429 Cb 0.58 0.00 0.35 0.00 -2.08 0.00 0.00 39.78 38.63 1mz5 n ASN 429 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1mz5 n GLY 430 N 0.00 -1.05 0.00 4.83 0.00 -1.26 -3.63 105.19 104.07 1mz5 n GLY 430 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1mz5 n GLY 430 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mz5 n SER 431 N -1.49 0.07 -3.81 1.61 3.41 -1.26 -4.18 113.62 107.97 1mz5 n SER 431 Ca 0.04 -0.33 -0.15 0.00 -0.26 0.00 0.00 58.87 58.17 1mz5 n SER 431 Cb 0.19 0.35 -0.16 0.00 -0.26 0.00 0.00 64.21 64.33 1mz5 n SER 431 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1mz5 s VAL 432 N -0.35 0.01 -0.24 -3.33 1.01 -1.24 -1.24 120.40 115.02 1mz5 s VAL 432 Ca 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 1mz5 s VAL 432 Cb 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 36.38 36.27 1mz5 s VAL 432 CO 0.00 0.08 -0.01 0.86 0.00 0.00 0.00 175.10 176.03 1mz5 s TRP 433 N 0.79 3.03 0.09 5.22 -0.11 -0.31 -1.01 118.94 126.63 1mz5 s TRP 433 Ca -0.07 -1.00 -0.27 0.00 1.22 0.00 0.00 56.10 55.99 1mz5 s TRP 433 Cb -0.10 -2.14 -0.06 0.00 -1.50 0.00 0.00 33.47 29.67 1mz5 s TRP 433 CO -0.02 -0.56 0.84 -1.21 -4.62 0.00 0.00 176.95 171.38 1mz5 s GLU 434 N 1.47 4.59 -0.07 5.86 2.02 -0.97 -1.59 118.70 130.01 1mz5 s GLU 434 Ca 0.04 1.22 -0.30 0.00 0.02 0.00 0.00 54.97 55.96 1mz5 s GLU 434 Cb -0.15 -3.36 -0.06 0.00 0.10 0.00 0.00 34.13 30.67 1mz5 s GLU 434 CO -0.02 0.30 1.73 0.34 0.02 0.00 0.00 175.26 177.63 1mz5 s ASP 435 N -0.18 6.53 0.53 -0.19 2.15 -1.26 -4.23 116.67 120.02 1mz5 s ASP 435 Ca 0.41 2.20 0.22 0.00 0.43 0.00 0.00 52.55 55.81 1mz5 s ASP 435 Cb -0.22 -2.53 1.36 0.00 -0.30 0.00 0.00 42.92 41.23 1mz5 s ASP 435 CO 0.26 -1.04 2.07 0.58 -0.17 0.00 0.00 175.17 176.87 1mz5 h VAL 436 N 5.74 0.83 -0.12 1.11 2.07 -0.28 -0.33 116.25 125.28 1mz5 h VAL 436 Ca -0.40 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1mz5 h VAL 436 Cb 1.19 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1mz5 h VAL 436 CO 0.96 0.00 0.00 -1.22 0.02 0.00 0.00 177.57 177.33 1mz5 n TYR 437 N -4.41 0.15 -2.20 1.57 4.02 -1.26 -4.92 117.16 110.12 1mz5 n TYR 437 Ca 0.04 -0.08 -0.19 0.00 -0.01 0.00 0.00 57.90 57.66 1mz5 n TYR 437 Cb 0.36 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.65 1mz5 n TYR 437 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1mz5 n ARG 438 N -0.09 -1.48 -0.03 -0.72 1.74 -0.13 -4.88 116.66 111.06 1mz5 n ARG 438 Ca 0.14 0.98 -0.07 0.00 -0.77 0.00 0.00 57.85 58.12 1mz5 n ARG 438 Cb 0.21 -5.48 -0.02 0.00 -1.02 0.00 0.00 32.46 26.14 1mz5 n ARG 438 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1mz5 s VAL 440 N -2.15 0.59 0.68 0.00 1.01 -1.26 -4.92 120.40 114.35 1mz5 s VAL 440 Ca -0.10 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 60.79 1mz5 s VAL 440 Cb 0.04 -1.32 -0.00 0.00 0.00 0.00 0.00 36.38 35.10 1mz5 s VAL 440 CO 0.13 -0.50 1.06 -1.81 0.00 0.00 0.00 175.10 173.98 1mz5 s ASP 441 N 1.79 5.61 -0.01 3.32 1.01 -1.26 -4.34 116.67 122.79 1mz5 s ASP 441 Ca 0.05 1.43 -0.03 0.00 0.71 0.00 0.00 52.55 54.71 1mz5 s ASP 441 Cb -0.17 -2.34 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 1mz5 s ASP 441 CO -0.21 -1.27 0.20 0.00 0.21 0.00 0.00 175.17 174.10 1mz5 s ALA 442 N -3.16 3.94 0.02 5.23 0.00 -0.62 -4.56 121.76 122.60 1mz5 s ALA 442 Ca 0.57 -0.73 -0.20 0.00 0.00 0.00 0.00 51.96 51.60 1mz5 s ALA 442 Cb -0.12 -1.91 -0.06 0.00 0.00 0.00 0.00 23.12 21.02 1mz5 s ALA 442 CO 0.54 0.73 0.59 -0.80 0.00 0.00 0.00 175.76 176.82 1mz5 s ASN 443 N -1.90 7.01 0.11 0.00 0.01 0.63 -1.16 114.94 119.63 1mz5 s ASN 443 Ca 0.27 1.20 0.10 0.00 -0.71 0.00 0.00 52.86 53.71 1mz5 s ASN 443 Cb -0.13 -2.36 -0.04 0.00 0.41 0.00 0.00 41.25 39.13 1mz5 s ASN 443 CO 0.18 0.16 -0.24 -0.69 -1.51 0.00 0.00 177.10 175.00 1mz5 s VAL 444 N -0.49 2.00 0.02 1.60 1.01 -0.37 -0.33 120.40 123.84 1mz5 s VAL 444 Ca 0.30 -1.61 -0.11 0.00 0.00 0.00 0.00 61.98 60.57 1mz5 s VAL 444 Cb -0.19 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.42 1mz5 s VAL 444 CO 0.18 0.06 0.22 0.00 0.00 0.00 0.00 175.10 175.55 1mz5 s ALA 445 N -1.07 -0.48 -1.31 5.51 0.00 -0.69 -4.32 121.76 119.40 1mz5 s ALA 445 Ca 0.10 -0.06 -0.06 0.00 0.00 0.00 0.00 51.96 51.95 1mz5 s ALA 445 Cb -0.10 0.18 -0.00 0.00 0.00 0.00 0.00 23.12 23.20 1mz5 s ALA 445 CO 0.05 -0.29 0.58 0.09 0.00 0.00 0.00 175.76 176.19 1mz5 n ASN 446 N 1.05 -1.85 -4.21 0.00 3.02 -1.26 -2.02 115.26 110.00 1mz5 n ASN 446 Ca -0.21 -0.96 -0.18 0.00 -0.03 0.00 0.00 54.58 53.20 1mz5 n ASN 446 Cb 0.57 -3.39 -0.11 0.00 -0.61 0.00 0.00 39.78 36.24 1mz5 n ASN 446 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mz5 s ALA 447 N -3.76 1.34 0.02 5.41 0.00 -1.26 -0.97 121.76 122.54 1mz5 s ALA 447 Ca 0.13 -1.18 0.05 0.00 0.00 0.00 0.00 51.96 50.95 1mz5 s ALA 447 Cb -0.05 -0.07 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 1mz5 s ALA 447 CO 0.86 0.10 -0.14 -1.83 0.00 0.00 0.00 175.76 174.75 1mz5 s GLU 448 N -2.38 1.01 0.31 0.00 -1.05 -0.41 -4.79 118.70 111.39 1mz5 s GLU 448 Ca 0.05 -0.69 -0.29 0.00 -0.15 0.00 0.00 54.97 53.89 1mz5 s GLU 448 Cb -0.06 -1.02 -0.10 0.00 -0.44 0.00 0.00 34.13 32.51 1mz5 s GLU 448 CO 0.02 0.26 1.21 1.03 0.95 0.00 0.00 175.26 178.73 1mz5 s ARG 449 N -0.90 4.48 0.21 -4.83 0.52 -1.26 -0.89 118.95 116.28 1mz5 s ARG 449 Ca 0.03 2.02 0.01 0.00 -0.52 0.00 0.00 55.73 57.27 1mz5 s ARG 449 Cb -0.07 -3.12 -0.05 0.00 0.52 0.00 0.00 34.95 32.23 1mz5 s ARG 449 CO 0.01 -0.01 0.06 0.14 0.02 0.00 0.00 175.30 175.52 1mz5 s VAL 450 N -1.16 0.52 -0.15 3.52 -7.23 -0.50 -4.85 120.40 110.55 1mz5 s VAL 450 Ca 0.47 -1.99 -0.37 0.00 -1.81 0.00 0.00 61.98 58.29 1mz5 s VAL 450 Cb -0.36 -2.39 -0.14 0.00 0.56 0.00 0.00 36.38 34.05 1mz5 s VAL 450 CO 0.47 -0.21 1.80 -2.65 -0.31 0.00 0.00 175.10 174.20 1mz5 n PRO 451 N -0.34 1.71 -1.13 4.82 -0.02 -1.26 -1.74 135.00 137.04 1mz5 n PRO 451 Ca -0.03 0.63 -0.05 0.00 -2.02 0.00 0.00 63.50 62.04 1mz5 n PRO 451 Cb 0.65 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 1mz5 n PRO 451 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1mz5 n ASN 452 N 5.86 -4.36 0.00 2.55 3.02 -1.26 -4.85 115.26 116.21 1mz5 n ASN 452 Ca 0.24 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.90 1mz5 n ASN 452 Cb 0.22 -2.27 0.00 0.00 -0.61 0.00 0.00 39.78 37.12 1mz5 n ASN 452 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mz5 n GLY 453 N -1.35 -0.71 2.92 7.41 0.00 -0.71 -1.57 105.19 111.17 1mz5 n GLY 453 Ca -0.05 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.47 1mz5 n GLY 453 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mz5 s LEU 454 N 0.00 2.08 -0.17 0.99 2.01 -0.48 -1.41 118.68 121.70 1mz5 s LEU 454 Ca 0.00 -0.18 -0.04 0.00 0.01 0.00 0.00 54.13 53.92 1mz5 s LEU 454 Cb 0.00 0.01 -0.03 0.00 0.01 0.00 0.00 46.19 46.18 1mz5 s LEU 454 CO 0.00 -0.09 -0.03 -0.75 1.01 0.00 0.00 176.35 176.49 1mz5 s LYS 455 N -0.50 3.66 -0.14 1.70 2.20 -0.07 -0.54 119.74 126.05 1mz5 s LYS 455 Ca -0.05 -0.52 -0.07 0.00 -0.36 0.00 0.00 55.97 54.97 1mz5 s LYS 455 Cb -0.03 -2.96 -0.04 0.00 -1.51 0.00 0.00 37.83 33.28 1mz5 s LYS 455 CO -0.00 0.18 0.12 -0.06 -0.36 0.00 0.00 175.35 175.23 1mz5 s PHE 456 N 0.53 3.49 -0.26 4.03 0.40 0.12 -1.29 117.98 125.00 1mz5 s PHE 456 Ca -0.02 0.42 -0.02 0.00 -0.60 0.00 0.00 56.93 56.71 1mz5 s PHE 456 Cb -0.14 -1.99 0.15 0.00 0.51 0.00 0.00 43.02 41.55 1mz5 s PHE 456 CO 0.02 0.57 0.45 1.21 0.70 0.00 0.00 175.22 178.18 1mz5 s ASN 457 N -0.60 -0.30 0.00 1.36 3.84 -0.14 -3.95 114.94 115.15 1mz5 s ASN 457 Ca 0.12 0.39 0.00 0.00 0.21 0.00 0.00 52.86 53.58 1mz5 s ASN 457 Cb -0.12 1.46 0.00 0.00 -0.55 0.00 0.00 41.25 42.05 1mz5 s ASN 457 CO 0.02 -0.29 0.00 0.61 -2.79 0.00 0.00 177.10 174.65 1mz5 n GLY 458 N 5.39 3.99 3.69 1.21 0.00 -1.26 -4.66 105.19 113.54 1mz5 n GLY 458 Ca -0.02 -1.63 -0.44 0.00 0.00 0.00 0.00 46.02 43.93 1mz5 n GLY 458 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1mz5 n VAL 459 N -1.83 0.04 -1.10 1.61 0.31 -1.26 -0.75 118.33 115.35 1mz5 n VAL 459 Ca 0.00 -0.01 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 1mz5 n VAL 459 Cb 0.00 -1.76 -0.02 0.00 -0.91 0.00 0.00 33.84 31.15 1mz5 n VAL 459 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1mz5 n GLY 460 N 3.72 0.63 3.68 2.92 0.00 0.13 -4.83 105.19 111.45 1mz5 n GLY 460 Ca 0.17 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 1mz5 n GLY 460 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mz5 s GLY 461 N -2.47 1.52 0.00 -0.02 0.00 0.07 -4.20 107.32 102.23 1mz5 s GLY 461 Ca 0.00 1.22 0.00 0.00 0.00 0.00 0.00 44.72 45.94 1mz5 s GLY 461 CO 0.00 2.97 0.00 0.61 0.00 0.00 0.00 173.10 176.68 1mz5 n GLY 462 N 4.07 -2.35 3.01 0.20 0.00 -0.86 -1.05 105.19 108.21 1mz5 n GLY 462 Ca 0.16 -1.35 -0.15 0.00 0.00 0.00 0.00 46.02 44.68 1mz5 n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mz5 s ALA 463 N -1.72 0.56 -0.20 4.61 0.00 0.48 -1.71 121.76 123.79 1mz5 s ALA 463 Ca 0.00 -0.48 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 1mz5 s ALA 463 Cb 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 1mz5 s ALA 463 CO 0.00 0.08 -0.07 0.08 0.00 0.00 0.00 175.76 175.84 1mz5 s VAL 464 N -0.63 3.22 -0.41 0.00 1.01 0.55 -1.88 120.40 122.27 1mz5 s VAL 464 Ca -0.02 -0.56 -0.05 0.00 0.00 0.00 0.00 61.98 61.35 1mz5 s VAL 464 Cb -0.05 -2.44 0.09 0.00 0.00 0.00 0.00 36.38 33.98 1mz5 s VAL 464 CO 0.00 0.45 0.21 0.86 0.00 0.00 0.00 175.10 176.63 1mz5 s TRP 465 N 1.21 3.46 0.35 5.22 -0.11 -0.36 -0.27 118.94 128.44 1mz5 s TRP 465 Ca 0.02 -2.02 -0.28 0.00 1.22 0.00 0.00 56.10 55.04 1mz5 s TRP 465 Cb -0.14 -3.05 -0.11 0.00 -1.50 0.00 0.00 33.47 28.67 1mz5 s TRP 465 CO -0.02 -0.92 1.42 -2.14 -4.62 0.00 0.00 176.95 170.66 1mz5 s PRO 466 N 1.27 4.21 0.00 5.86 0.02 -1.26 -1.17 135.00 143.92 1mz5 s PRO 466 Ca 0.05 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.49 1mz5 s PRO 466 Cb -0.23 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.27 1mz5 s PRO 466 CO -0.02 -0.40 0.00 0.28 -0.33 0.00 0.00 177.00 176.54 1mz5 n VAL 467 N 0.74 0.00 0.27 3.83 0.31 0.32 -4.54 118.33 119.27 1mz5 n VAL 467 Ca 0.01 0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.46 1mz5 n VAL 467 Cb 0.40 -0.05 0.77 0.00 -0.91 0.00 0.00 33.84 34.05 1mz5 n VAL 467 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1mz5 h ALA 468 N 0.47 1.68 0.00 3.52 0.00 -0.61 -0.21 119.26 124.10 1mz5 h ALA 468 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1mz5 h ALA 468 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1mz5 h ALA 468 CO 0.00 0.04 0.00 0.54 0.00 0.00 0.00 179.25 179.83 1mz5 n ARG 469 N -4.10 0.04 0.28 0.00 1.74 -0.91 -0.77 116.66 112.93 1mz5 n ARG 469 Ca -0.03 0.42 0.16 0.00 -0.77 0.00 0.00 57.85 57.63 1mz5 n ARG 469 Cb 0.11 -1.59 0.92 0.00 -1.02 0.00 0.00 32.46 30.88 1mz5 n ARG 469 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1mz5 h GLN 470 N 0.00 0.00 0.00 5.56 4.20 -1.26 -3.48 115.11 120.12 1mz5 h GLN 470 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1mz5 h GLN 470 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1mz5 h GLN 470 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 1mz5 n GLY 471 N -1.32 0.93 0.15 3.46 0.00 0.05 -4.53 105.19 103.94 1mz5 n GLY 471 Ca -0.02 -1.21 -0.12 0.00 0.00 0.00 0.00 46.02 44.67 1mz5 n GLY 471 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1mz5 h GLN 472 N 0.00 -0.26 -5.21 1.61 4.15 -1.87 -3.40 115.11 110.12 1mz5 h GLN 472 Ca 0.00 0.02 -0.64 0.00 0.77 0.00 0.00 58.65 58.80 1mz5 h GLN 472 Cb 0.00 0.06 -0.15 0.00 0.21 0.00 0.00 27.48 27.60 1mz5 h GLN 472 CO 0.00 0.13 -0.10 0.99 -1.93 0.00 0.00 178.83 177.92 1mz5 s THR 473 N -4.01 5.07 -0.80 2.39 2.01 -1.26 -4.58 115.64 114.46 1mz5 s THR 473 Ca -0.14 0.45 -0.06 0.00 0.31 0.00 0.00 61.69 62.25 1mz5 s THR 473 Cb 0.01 -3.88 0.20 0.00 0.01 0.00 0.00 72.50 68.85 1mz5 s THR 473 CO 0.52 -0.08 0.69 -0.13 -0.69 0.00 0.00 174.62 174.93 1mz5 s ARG 474 N 2.28 3.21 0.47 4.92 0.52 -0.48 -4.78 118.95 125.08 1mz5 s ARG 474 Ca 0.18 -2.78 0.26 0.00 -0.52 0.00 0.00 55.73 52.87 1mz5 s ARG 474 Cb -0.16 -4.07 0.76 0.00 0.52 0.00 0.00 34.95 32.01 1mz5 s ARG 474 CO 0.12 -1.24 1.76 0.00 0.02 0.00 0.00 175.30 175.96 1mz5 h ARG 475 N 6.92 0.00 -0.60 3.54 3.08 -1.86 -1.44 114.38 124.02 1mz5 h ARG 475 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1mz5 h ARG 475 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.98 1mz5 h ARG 475 CO 0.79 0.07 0.00 0.66 -1.07 0.00 0.00 179.97 180.42 1mz5 n TYR 476 N -3.14 1.41 -0.25 3.04 0.53 -1.26 -4.52 117.16 112.97 1mz5 n TYR 476 Ca 0.02 -0.63 0.33 0.00 -1.02 0.00 0.00 57.90 56.60 1mz5 n TYR 476 Cb 0.45 -0.24 0.72 0.00 -1.03 0.00 0.00 39.34 39.24 1mz5 n TYR 476 CO 0.00 0.00 0.00 0.37 -1.02 0.00 0.00 176.86 176.21 1mz5 h GLN 477 N 3.80 0.00 -0.35 -0.72 5.75 -1.59 -0.68 115.11 121.32 1mz5 h GLN 477 Ca 0.00 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.57 1mz5 h GLN 477 Cb 1.43 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.96 1mz5 h GLN 477 CO 0.23 0.00 0.24 0.27 -2.65 0.00 0.00 178.83 176.92 1mz5 h PHE 478 N 0.00 0.16 0.00 3.99 -0.00 -1.79 -2.76 116.94 116.54 1mz5 h PHE 478 Ca 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.48 1mz5 h PHE 478 Cb 2.20 -0.05 0.00 0.00 -0.00 0.00 0.00 35.95 38.10 1mz5 h PHE 478 CO 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 178.31 178.40 1mz5 h ALA 479 N 1.82 1.00 0.00 12.09 0.00 -1.23 -1.12 119.26 131.82 1mz5 h ALA 479 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1mz5 h ALA 479 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1mz5 h ALA 479 CO -0.02 0.00 0.00 -0.91 0.00 0.00 0.00 179.25 178.32 1mz5 h ASN 480 N 0.00 0.00 0.00 0.00 2.35 -1.70 -3.22 115.58 113.01 1mz5 h ASN 480 Ca 0.00 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.45 1mz5 h ASN 480 Cb 0.12 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.44 1mz5 h ASN 480 CO 0.00 0.00 -2.10 0.00 -1.65 0.00 0.00 177.43 173.68 1mz5 n TYR 481 N -2.48 0.00 -3.59 1.19 9.36 -0.47 -4.20 117.16 116.98 1mz5 n TYR 481 Ca 0.02 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.12 1mz5 n TYR 481 Cb 0.29 -0.74 -0.06 0.00 -0.63 0.00 0.00 39.34 38.20 1mz5 n TYR 481 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 1mz5 s ARG 482 N -2.38 0.73 0.24 2.98 1.70 -0.96 -4.28 118.95 116.97 1mz5 s ARG 482 Ca -0.26 0.43 -0.21 0.00 -0.47 0.00 0.00 55.73 55.21 1mz5 s ARG 482 Cb 0.07 0.35 0.04 0.00 -0.57 0.00 0.00 34.95 34.83 1mz5 s ARG 482 CO 0.43 -0.18 0.66 -0.59 -1.08 0.00 0.00 175.30 174.55 1mz5 s PHE 483 N -0.55 -0.28 -0.07 5.89 -0.12 -0.01 -3.89 117.98 118.95 1mz5 s PHE 483 Ca -0.03 -0.09 0.01 0.00 -0.05 0.00 0.00 56.93 56.77 1mz5 s PHE 483 Cb -0.02 0.62 0.02 0.00 -0.63 0.00 0.00 43.02 43.01 1mz5 s PHE 483 CO 0.02 -1.09 -0.07 0.99 -0.05 0.00 0.00 175.22 175.01 1mz5 s THR 484 N -3.87 0.86 -0.13 -4.49 2.01 -0.81 -1.18 115.64 108.04 1mz5 s THR 484 Ca 0.08 -0.26 0.03 0.00 0.31 0.00 0.00 61.69 61.84 1mz5 s THR 484 Cb -0.04 -0.86 0.01 0.00 0.01 0.00 0.00 72.50 71.62 1mz5 s THR 484 CO 0.00 0.31 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.82 1mz5 s LEU 485 N 1.18 2.01 0.06 4.42 2.96 -0.22 -0.89 118.68 128.20 1mz5 s LEU 485 Ca -0.06 -0.55 0.09 0.00 -0.22 0.00 0.00 54.13 53.39 1mz5 s LEU 485 Cb -0.14 -1.35 -0.03 0.00 0.50 0.00 0.00 46.19 45.17 1mz5 s LEU 485 CO -0.02 0.08 -0.25 -0.69 -1.32 0.00 0.00 176.35 174.15 1mz5 s VAL 486 N 0.78 2.03 0.02 1.68 1.01 0.10 -0.00 120.40 126.02 1mz5 s VAL 486 Ca -0.09 -1.43 -0.28 0.00 0.00 0.00 0.00 61.98 60.19 1mz5 s VAL 486 Cb -0.16 -1.76 0.08 0.00 0.00 0.00 0.00 36.38 34.55 1mz5 s VAL 486 CO -0.00 0.26 0.73 0.00 0.00 0.00 0.00 175.10 176.08 1mz5 s ALA 487 N -0.87 -1.74 -0.17 5.51 0.00 0.26 -0.67 121.76 124.08 1mz5 s ALA 487 Ca 0.11 0.99 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 1mz5 s ALA 487 Cb -0.10 0.31 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 1mz5 s ALA 487 CO 0.03 -0.57 -0.03 0.99 0.00 0.00 0.00 175.76 176.18 1mz5 s THR 488 N -2.47 3.89 0.11 0.00 2.01 -0.82 0.78 115.64 119.14 1mz5 s THR 488 Ca -0.02 -0.35 0.04 0.00 0.31 0.00 0.00 61.69 61.67 1mz5 s THR 488 Cb -0.01 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.74 1mz5 s THR 488 CO -0.03 0.47 -0.11 0.68 -0.69 0.00 0.00 174.62 174.94 1mz5 s VAL 489 N 0.59 1.04 0.06 3.82 -7.23 0.38 -0.86 120.40 118.21 1mz5 s VAL 489 Ca -0.02 -1.70 0.06 0.00 -1.81 0.00 0.00 61.98 58.51 1mz5 s VAL 489 Cb -0.14 -1.45 -0.03 0.00 0.56 0.00 0.00 36.38 35.32 1mz5 s VAL 489 CO 0.02 -0.55 -0.17 0.42 -0.31 0.00 0.00 175.10 174.52 1mz5 s THR 490 N -2.48 1.34 -0.23 5.32 -4.23 -0.81 0.18 115.64 114.74 1mz5 s THR 490 Ca 0.07 -1.25 -0.15 0.00 -1.18 0.00 0.00 61.69 59.18 1mz5 s THR 490 Cb -0.03 -1.22 -0.04 0.00 1.34 0.00 0.00 72.50 72.55 1mz5 s THR 490 CO 0.01 -0.05 0.39 -0.63 -0.54 0.00 0.00 174.62 173.79 1mz5 s ILE 491 N -1.04 5.19 -0.08 2.99 1.01 -1.26 -2.49 121.20 125.52 1mz5 s ILE 491 Ca 0.03 0.65 0.02 0.00 0.00 0.00 0.00 60.65 61.35 1mz5 s ILE 491 Cb -0.09 -3.71 -0.25 0.00 0.01 0.00 0.00 42.46 38.42 1mz5 s ILE 491 CO 0.02 0.21 0.53 0.44 0.00 0.00 0.00 174.94 176.15 1mz5 h ASP 492 N 7.68 0.23 -3.92 3.58 3.32 -0.95 0.27 116.42 126.63 1mz5 h ASP 492 Ca -0.34 -0.50 -0.20 0.00 0.02 0.00 0.00 57.03 56.01 1mz5 h ASP 492 Cb 1.16 -0.07 -0.26 0.00 0.22 0.00 0.00 39.33 40.37 1mz5 h ASP 492 CO 0.69 1.45 -0.59 -1.61 -1.72 0.00 0.00 179.24 177.46 1mz5 s GLU 493 N -2.58 0.16 0.34 3.56 2.02 -1.09 -4.76 118.70 116.35 1mz5 s GLU 493 Ca -0.14 0.07 -0.29 0.00 0.02 0.00 0.00 54.97 54.64 1mz5 s GLU 493 Cb 0.07 0.07 -0.12 0.00 0.10 0.00 0.00 34.13 34.26 1mz5 s GLU 493 CO 0.80 -0.02 1.46 1.28 0.02 0.00 0.00 175.26 178.80 1mz5 n LEU 494 N 2.84 4.32 -4.90 1.80 4.32 -1.26 -4.58 117.00 119.54 1mz5 n LEU 494 Ca -0.14 1.20 -0.29 0.00 -0.02 0.00 0.00 56.01 56.77 1mz5 n LEU 494 Cb 0.59 -1.57 0.02 0.00 -1.62 0.00 0.00 43.42 40.83 1mz5 n LEU 494 CO 0.22 -0.03 0.58 -2.16 -1.22 0.00 0.00 177.39 174.79 1mz5 s PRO 495 N -1.64 3.31 0.06 3.23 0.04 -1.26 -5.00 135.00 133.74 1mz5 s PRO 495 Ca 0.57 0.33 -0.23 0.00 0.04 0.00 0.00 61.00 61.71 1mz5 s PRO 495 Cb -0.51 -2.22 -0.16 0.00 0.04 0.00 0.00 34.50 31.65 1mz5 s PRO 495 CO 0.60 -0.54 1.60 -0.22 0.04 0.00 0.00 177.00 178.47 1mz5 h LYS 496 N -0.14 0.04 0.00 4.56 3.64 -1.95 -3.38 116.57 119.34 1mz5 h LYS 496 Ca -0.45 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1mz5 h LYS 496 Cb 1.22 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1mz5 h LYS 496 CO 0.62 0.18 0.00 0.41 -2.27 0.00 0.00 179.45 178.39 1mz5 n GLY 497 N -0.68 0.88 3.44 5.01 0.00 -1.26 -4.67 105.19 107.90 1mz5 n GLY 497 Ca -0.07 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 1mz5 n GLY 497 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mz5 s THR 498 N 0.36 2.78 0.02 2.61 2.01 -1.26 0.01 115.64 122.16 1mz5 s THR 498 Ca 0.00 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.10 1mz5 s THR 498 Cb 0.00 -2.08 -0.02 0.00 0.01 0.00 0.00 72.50 70.41 1mz5 s THR 498 CO 0.00 0.53 -0.04 -0.55 -0.69 0.00 0.00 174.62 173.87 1mz5 s SER 499 N -0.86 0.37 0.42 3.53 0.15 -0.13 -4.98 113.70 112.20 1mz5 s SER 499 Ca 0.12 -0.44 -0.21 0.00 0.70 0.00 0.00 55.95 56.12 1mz5 s SER 499 Cb -0.10 0.07 -0.11 0.00 -1.71 0.00 0.00 66.02 64.17 1mz5 s SER 499 CO 0.01 -0.23 0.94 -2.16 1.20 0.00 0.00 173.24 173.00 1mz5 s PRO 500 N -1.28 4.21 0.00 5.44 0.05 -1.26 -1.15 135.00 141.01 1mz5 s PRO 500 Ca -0.12 1.09 0.00 0.00 0.05 0.00 0.00 61.00 62.02 1mz5 s PRO 500 Cb -0.09 -2.20 0.00 0.00 0.05 0.00 0.00 34.50 32.27 1mz5 s PRO 500 CO -0.01 -0.02 0.00 -0.11 0.05 0.00 0.00 177.00 176.91 1mz5 n LEU 501 N -0.63 0.15 -3.63 -3.56 7.94 -0.84 -4.07 117.00 112.36 1mz5 n LEU 501 Ca 0.07 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.85 1mz5 n LEU 501 Cb 0.54 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.42 1mz5 n LEU 501 CO 0.37 -0.09 0.47 -0.22 -1.11 0.00 0.00 177.39 176.80 1mz5 s LEU 502 N -5.66 -0.73 0.00 -1.96 2.96 -1.03 -0.35 118.68 111.91 1mz5 s LEU 502 Ca 0.00 1.35 0.00 0.00 -0.22 0.00 0.00 54.13 55.26 1mz5 s LEU 502 Cb 0.00 2.34 0.00 0.00 0.50 0.00 0.00 46.19 49.03 1mz5 s LEU 502 CO 0.00 -0.23 0.00 0.61 -1.32 0.00 0.00 176.35 175.41 1mz5 n GLY 503 N 2.95 -1.36 3.23 7.98 0.00 -0.35 -0.68 105.19 116.95 1mz5 n GLY 503 Ca -0.15 -0.97 -0.35 0.00 0.00 0.00 0.00 46.02 44.55 1mz5 n GLY 503 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mz5 s ALA 504 N -1.43 2.74 0.36 4.61 0.00 0.48 -0.42 121.76 128.10 1mz5 s ALA 504 Ca 0.00 -1.41 0.01 0.00 0.00 0.00 0.00 51.96 50.56 1mz5 s ALA 504 Cb 0.00 -1.72 -0.03 0.00 0.00 0.00 0.00 23.12 21.37 1mz5 s ALA 504 CO 0.00 -0.75 0.56 0.20 0.00 0.00 0.00 175.76 175.77 1mz5 s GLY 505 N 1.37 1.37 0.08 0.00 0.00 -0.36 -0.59 107.32 109.19 1mz5 s GLY 505 Ca 0.01 -0.94 0.08 0.00 0.00 0.00 0.00 44.72 43.87 1mz5 s GLY 505 CO -0.04 -0.87 -0.15 1.08 0.00 0.00 0.00 173.10 173.12 1mz5 s LEU 506 N -4.34 2.78 0.61 0.66 1.43 0.28 -1.27 118.68 118.84 1mz5 s LEU 506 Ca 0.41 -0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 52.87 1mz5 s LEU 506 Cb -0.10 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.48 1mz5 s LEU 506 CO 0.36 0.21 1.27 -1.61 0.23 0.00 0.00 176.35 176.81 1mz5 s GLU 507 N -1.89 2.79 0.00 1.70 0.41 -0.49 -4.65 118.70 116.57 1mz5 s GLU 507 Ca 0.18 1.99 0.00 0.00 -0.41 0.00 0.00 54.97 56.73 1mz5 s GLU 507 Cb -0.11 -1.93 0.00 0.00 -1.78 0.00 0.00 34.13 30.31 1mz5 s GLU 507 CO 0.09 -1.39 0.00 0.41 -0.49 0.00 0.00 175.26 173.88 1mz5 n GLY 508 N 0.73 2.41 3.76 -1.39 0.00 -1.26 -4.97 105.19 104.47 1mz5 n GLY 508 Ca 0.14 -2.15 -0.37 0.00 0.00 0.00 0.00 46.02 43.64 1mz5 n GLY 508 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1mz5 s PRO 509 N -1.89 3.54 0.05 1.61 0.04 -1.26 -4.68 135.00 132.41 1mz5 s PRO 509 Ca 0.00 1.88 0.00 0.00 0.04 0.00 0.00 61.00 62.92 1mz5 s PRO 509 Cb 0.00 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.22 1mz5 s PRO 509 CO 0.00 -0.76 0.00 0.41 0.04 0.00 0.00 177.00 176.69 1mz5 n GLY 510 N 0.50 -1.87 2.03 0.56 0.00 -1.26 -4.60 105.19 100.56 1mz5 n GLY 510 Ca 0.09 -2.00 0.01 0.00 0.00 0.00 0.00 46.02 44.12 1mz5 n GLY 510 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mz5 n ASP 511 N 0.00 1.47 -4.79 1.61 3.85 -1.26 -5.09 116.55 112.34 1mz5 n ASP 511 Ca 0.00 -2.20 -0.35 0.00 -0.71 0.00 0.00 54.79 51.52 1mz5 n ASP 511 Cb 0.00 -0.39 -0.04 0.00 -1.35 0.00 0.00 41.12 39.34 1mz5 n ASP 511 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1mz5 s ALA 512 N -1.94 3.03 0.09 2.12 0.00 -1.26 -4.95 121.76 118.85 1mz5 s ALA 512 Ca 0.32 0.63 0.09 0.00 0.00 0.00 0.00 51.96 53.00 1mz5 s ALA 512 Cb 0.36 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 1mz5 s ALA 512 CO -0.10 -0.17 -0.24 0.15 0.00 0.00 0.00 175.76 175.40 1mz5 s LYS 513 N -2.73 1.39 -0.14 0.00 1.02 -1.26 -0.56 119.74 117.47 1mz5 s LYS 513 Ca 0.60 -1.17 -0.25 0.00 0.02 0.00 0.00 55.97 55.18 1mz5 s LYS 513 Cb -0.19 -1.68 -0.22 0.00 -0.52 0.00 0.00 37.83 35.22 1mz5 s LYS 513 CO 0.24 0.41 0.64 1.25 -0.92 0.00 0.00 175.35 176.97 1mz5 h LEU 514 N 4.31 0.00 -7.25 3.17 5.85 -1.13 -3.36 115.31 116.90 1mz5 h LEU 514 Ca -0.47 -0.84 -0.10 0.00 0.84 0.00 0.00 57.88 57.31 1mz5 h LEU 514 Cb 1.17 0.00 -0.22 0.00 0.37 0.00 0.00 40.66 41.98 1mz5 h LEU 514 CO 0.41 0.95 -0.11 -0.22 -0.34 0.00 0.00 178.44 179.13 1mz5 s LEU 515 N -8.25 0.14 0.00 2.25 2.96 -1.22 -0.96 118.68 113.59 1mz5 s LEU 515 Ca -0.17 0.74 -0.19 0.00 -0.22 0.00 0.00 54.13 54.30 1mz5 s LEU 515 Cb -0.02 1.75 0.06 0.00 0.50 0.00 0.00 46.19 48.48 1mz5 s LEU 515 CO 0.59 -0.31 0.86 0.61 -1.32 0.00 0.00 176.35 176.78 1mz5 n GLY 516 N 2.13 0.40 3.00 7.98 0.00 -0.75 -0.38 105.19 117.56 1mz5 n GLY 516 Ca -0.16 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.73 1mz5 n GLY 516 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mz5 s LEU 517 N 0.00 0.74 0.34 0.99 2.96 0.14 -0.11 118.68 123.74 1mz5 s LEU 517 Ca 0.20 0.39 0.04 0.00 -0.22 0.00 0.00 54.13 54.54 1mz5 s LEU 517 Cb -0.01 0.54 -0.06 0.00 0.50 0.00 0.00 46.19 47.16 1mz5 s LEU 517 CO 0.00 -0.14 0.06 -0.44 -1.32 0.00 0.00 176.35 174.52 1mz5 s SER 518 N 0.98 2.48 0.06 3.68 0.01 0.83 -1.98 113.70 119.76 1mz5 s SER 518 Ca -0.07 -1.41 -0.00 0.00 1.31 0.00 0.00 55.95 55.78 1mz5 s SER 518 Cb -0.09 -0.03 -0.04 0.00 0.21 0.00 0.00 66.02 66.07 1mz5 s SER 518 CO -0.06 -0.63 -0.04 -0.72 0.41 0.00 0.00 173.24 172.20 1mz5 s TYR 519 N -3.27 0.60 0.38 2.43 -0.85 -0.30 -0.64 117.35 115.70 1mz5 s TYR 519 Ca 0.35 -0.98 0.04 0.00 -0.52 0.00 0.00 57.07 55.96 1mz5 s TYR 519 Cb 0.08 -0.41 -0.03 0.00 0.38 0.00 0.00 41.96 41.99 1mz5 s TYR 519 CO 0.15 -0.30 0.14 0.16 -1.52 0.00 0.00 175.55 174.18 1mz5 s ASP 520 N -2.81 2.45 0.04 -0.18 1.47 -0.44 -0.95 116.67 116.24 1mz5 s ASP 520 Ca 0.06 -1.64 0.18 0.00 1.18 0.00 0.00 52.55 52.33 1mz5 s ASP 520 Cb 0.06 0.45 0.77 0.00 -0.34 0.00 0.00 42.92 43.85 1mz5 s ASP 520 CO -0.08 -0.92 1.58 2.29 0.68 0.00 0.00 175.17 178.72 1mz5 n LYS 521 N -0.81 0.03 -0.27 2.11 2.85 0.10 -1.78 118.16 120.39 1mz5 n LYS 521 Ca -0.03 0.23 0.11 0.00 -1.05 0.00 0.00 58.31 57.56 1mz5 n LYS 521 Cb 0.65 -1.55 0.27 0.00 -0.65 0.00 0.00 35.03 33.75 1mz5 n LYS 521 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1mz5 n ASN 522 N -1.61 3.23 -2.92 -5.58 3.02 -1.26 -4.93 115.26 105.22 1mz5 n ASN 522 Ca 0.04 -1.97 -0.19 0.00 -0.03 0.00 0.00 54.58 52.43 1mz5 n ASN 522 Cb 0.21 -0.35 0.06 0.00 -0.61 0.00 0.00 39.78 39.09 1mz5 n ASN 522 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1mz5 n ARG 523 N 1.29 -6.20 -4.34 3.52 1.74 -0.73 -4.97 116.66 106.95 1mz5 n ARG 523 Ca 0.20 0.65 -0.24 0.00 -0.77 0.00 0.00 57.85 57.69 1mz5 n ARG 523 Cb 0.53 -5.14 -0.08 0.00 -1.02 0.00 0.00 32.46 26.74 1mz5 n ARG 523 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1mz5 s GLN 524 N -5.99 2.08 0.37 5.56 -0.21 -1.26 -2.11 119.66 118.10 1mz5 s GLN 524 Ca 0.44 -1.49 -0.18 0.00 0.02 0.00 0.00 55.36 54.15 1mz5 s GLN 524 Cb -0.19 -2.05 -0.10 0.00 1.00 0.00 0.00 33.01 31.67 1mz5 s GLN 524 CO 0.57 0.37 0.83 -1.58 -2.12 0.00 0.00 175.29 173.36 1mz5 s TRP 525 N -2.27 3.35 -0.43 0.91 0.52 -0.73 -1.32 118.94 118.97 1mz5 s TRP 525 Ca 0.30 1.40 0.02 0.00 0.02 0.00 0.00 56.10 57.84 1mz5 s TRP 525 Cb -0.06 -2.68 0.15 0.00 -1.15 0.00 0.00 33.47 29.73 1mz5 s TRP 525 CO 0.18 0.01 0.29 1.03 0.02 0.00 0.00 176.95 178.47 1mz5 s ARG 526 N -3.05 1.06 0.33 4.98 0.52 0.19 -1.31 118.95 121.66 1mz5 s ARG 526 Ca 0.57 -1.97 -0.28 0.00 -0.52 0.00 0.00 55.73 53.54 1mz5 s ARG 526 Cb -0.10 -1.84 -0.09 0.00 0.52 0.00 0.00 34.95 33.44 1mz5 s ARG 526 CO 0.16 -1.26 1.12 -1.25 0.02 0.00 0.00 175.30 174.08 1mz5 s PRO 527 N 0.29 4.44 -0.25 3.54 0.04 -1.26 -0.12 135.00 141.67 1mz5 s PRO 527 Ca 0.23 1.79 -0.03 0.00 0.04 0.00 0.00 61.00 63.04 1mz5 s PRO 527 Cb -0.13 -2.98 0.02 0.00 0.04 0.00 0.00 34.50 31.45 1mz5 s PRO 527 CO -0.08 0.03 -0.04 -0.51 0.04 0.00 0.00 177.00 176.45 1mz5 s LEU 528 N -1.86 3.24 -0.66 -3.56 1.43 0.84 -4.59 118.68 113.52 1mz5 s LEU 528 Ca 0.49 -0.76 -0.06 0.00 -1.03 0.00 0.00 54.13 52.77 1mz5 s LEU 528 Cb -0.31 -1.71 0.17 0.00 0.03 0.00 0.00 46.19 44.37 1mz5 s LEU 528 CO 0.39 -0.12 0.51 -0.31 0.23 0.00 0.00 176.35 177.05 1mz5 s TYR 529 N 1.38 3.50 0.00 0.29 1.51 -1.26 -1.81 117.35 120.96 1mz5 s TYR 529 Ca 0.02 -2.47 0.00 0.00 -1.01 0.00 0.00 57.07 53.61 1mz5 s TYR 529 Cb -0.16 -3.38 0.00 0.00 -0.11 0.00 0.00 41.96 38.31 1mz5 s TYR 529 CO -0.03 -0.89 0.00 0.41 -1.11 0.00 0.00 175.55 173.93 1mz5 n GLY 530 N 3.73 2.70 0.58 0.71 0.00 -0.13 -2.94 105.19 109.84 1mz5 n GLY 530 Ca 0.08 -0.32 0.12 0.00 0.00 0.00 0.00 46.02 45.90 1mz5 n GLY 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mz5 n ALA 531 N 10.63 3.04 -1.75 4.61 0.00 -1.26 -4.63 120.51 131.15 1mz5 n ALA 531 Ca 0.00 -0.59 -0.39 0.00 0.00 0.00 0.00 53.44 52.46 1mz5 n ALA 531 Cb 0.00 -0.91 0.04 0.00 0.00 0.00 0.00 19.45 18.59 1mz5 n ALA 531 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mz5 n ALA 532 N 0.28 1.66 -1.82 0.00 0.00 -1.15 -4.94 120.51 114.54 1mz5 n ALA 532 Ca 0.12 0.13 -0.41 0.00 0.00 0.00 0.00 53.44 53.28 1mz5 n ALA 532 Cb 0.47 -2.37 -0.02 0.00 0.00 0.00 0.00 19.45 17.53 1mz5 n ALA 532 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1mz5 s PRO 533 N -2.88 4.20 0.55 0.00 0.04 -1.26 -4.58 135.00 131.07 1mz5 s PRO 533 Ca 0.71 2.43 -0.20 0.00 0.04 0.00 0.00 61.00 63.98 1mz5 s PRO 533 Cb -0.42 -3.07 -0.05 0.00 0.04 0.00 0.00 34.50 31.00 1mz5 s PRO 533 CO 0.50 -0.53 1.22 0.00 0.04 0.00 0.00 177.00 178.23 1mz5 s ALA 534 N 0.04 2.71 -0.03 8.56 0.00 -1.26 -4.96 121.76 126.82 1mz5 s ALA 534 Ca 0.62 1.05 0.02 0.00 0.00 0.00 0.00 51.96 53.64 1mz5 s ALA 534 Cb -0.45 -3.45 0.01 0.00 0.00 0.00 0.00 23.12 19.23 1mz5 s ALA 534 CO 0.45 -1.07 -0.07 -1.54 0.00 0.00 0.00 175.76 173.53 1mz5 s SER 535 N -1.42 1.01 0.68 0.00 1.04 -1.26 -5.10 113.70 108.65 1mz5 s SER 535 Ca 0.73 -0.15 -0.15 0.00 0.48 0.00 0.00 55.95 56.85 1mz5 s SER 535 Cb -0.32 -0.31 0.01 0.00 0.10 0.00 0.00 66.02 65.50 1mz5 s SER 535 CO 0.36 0.03 1.15 -2.84 0.98 0.00 0.00 173.24 172.92 1mz5 s PRO 536 N 0.34 2.58 0.04 4.02 0.02 -1.26 -4.62 135.00 136.12 1mz5 s PRO 536 Ca -0.05 1.56 -0.19 0.00 0.02 0.00 0.00 61.00 62.34 1mz5 s PRO 536 Cb -0.09 -1.91 0.04 0.00 0.02 0.00 0.00 34.50 32.56 1mz5 s PRO 536 CO 0.00 -1.45 0.43 -0.08 -0.33 0.00 0.00 177.00 175.57 1mz5 s THR 537 N -2.15 0.05 0.00 0.99 -1.32 -0.43 -4.99 115.64 107.80 1mz5 s THR 537 Ca 0.70 -0.42 0.00 0.00 -1.21 0.00 0.00 61.69 60.76 1mz5 s THR 537 Cb -0.24 -0.93 0.00 0.00 -1.51 0.00 0.00 72.50 69.81 1mz5 s THR 537 CO 0.42 -0.23 0.00 0.61 -2.21 0.00 0.00 174.62 173.21 1mz5 n GLY 538 N 0.56 -0.23 3.33 6.08 0.00 -1.26 -1.77 105.19 111.90 1mz5 n GLY 538 Ca -0.19 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.67 1mz5 n GLY 538 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1mz5 s SER 539 N -4.00 -0.45 0.21 1.61 0.15 -1.26 -4.52 113.70 105.45 1mz5 s SER 539 Ca 0.00 0.85 -0.00 0.00 0.70 0.00 0.00 55.95 57.50 1mz5 s SER 539 Cb 0.00 0.87 -0.04 0.00 -1.71 0.00 0.00 66.02 65.13 1mz5 s SER 539 CO 0.00 -0.16 0.12 -1.66 1.20 0.00 0.00 173.24 172.74 1mz5 s TRP 540 N 0.18 1.26 0.03 3.44 1.48 -0.90 -4.96 118.94 119.47 1mz5 s TRP 540 Ca -0.00 -1.32 0.07 0.00 -1.06 0.00 0.00 56.10 53.79 1mz5 s TRP 540 Cb -0.03 -0.65 -0.02 0.00 -1.16 0.00 0.00 33.47 31.60 1mz5 s TRP 540 CO 0.01 -0.55 -0.21 -1.21 -4.06 0.00 0.00 176.95 170.93 1mz5 s GLU 541 N -4.12 1.46 0.45 3.25 0.41 -1.26 -4.87 118.70 114.02 1mz5 s GLU 541 Ca 0.38 -0.89 -0.24 0.00 -0.41 0.00 0.00 54.97 53.81 1mz5 s GLU 541 Cb 0.07 -1.53 -0.09 0.00 -1.78 0.00 0.00 34.13 30.80 1mz5 s GLU 541 CO 0.12 0.40 1.11 1.28 -0.49 0.00 0.00 175.26 177.68 1mz5 n LEU 542 N 2.02 3.44 0.00 1.80 4.77 -1.26 -2.70 117.00 125.07 1mz5 n LEU 542 Ca -0.17 1.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.84 1mz5 n LEU 542 Cb 0.53 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 1mz5 n LEU 542 CO 0.23 -1.19 0.00 1.41 -1.33 0.00 0.00 177.39 176.51 1mz5 n HIS 543 N -0.60 0.00 -3.62 -1.77 8.25 0.95 -4.96 115.22 113.47 1mz5 n HIS 543 Ca 0.09 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.19 1mz5 n HIS 543 Cb 0.41 -1.23 -0.06 0.00 1.12 0.00 0.00 29.99 30.24 1mz5 n HIS 543 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1mz5 s LYS 544 N -1.12 3.74 0.01 -0.41 2.20 -1.10 -4.92 119.74 118.15 1mz5 s LYS 544 Ca 0.00 0.17 -0.30 0.00 -0.36 0.00 0.00 55.97 55.48 1mz5 s LYS 544 Cb 0.00 -3.10 -0.03 0.00 -1.51 0.00 0.00 37.83 33.19 1mz5 s LYS 544 CO 0.00 0.64 1.02 -1.59 -0.36 0.00 0.00 175.35 175.06 1mz5 s LYS 545 N -1.54 4.53 0.03 4.03 -2.85 -1.26 -4.29 119.74 118.39 1mz5 s LYS 545 Ca 0.27 1.48 0.08 0.00 -1.00 0.00 0.00 55.97 56.80 1mz5 s LYS 545 Cb -0.14 -3.44 -0.02 0.00 -2.06 0.00 0.00 37.83 32.16 1mz5 s LYS 545 CO 0.15 -0.10 -0.23 0.71 0.10 0.00 0.00 175.35 175.98 1mz5 s TYR 546 N 1.07 2.00 -0.25 1.78 1.51 0.13 -4.96 117.35 118.63 1mz5 s TYR 546 Ca 0.53 -0.39 -0.13 0.00 -1.01 0.00 0.00 57.07 56.07 1mz5 s TYR 546 Cb -0.22 -1.22 -0.04 0.00 -0.11 0.00 0.00 41.96 40.36 1mz5 s TYR 546 CO 0.28 0.07 0.29 -1.58 -1.11 0.00 0.00 175.55 173.50 1mz5 s HIS 547 N -0.73 3.29 -0.10 2.71 5.65 -1.26 -0.47 115.29 124.39 1mz5 s HIS 547 Ca 0.09 0.36 0.01 0.00 0.25 0.00 0.00 55.06 55.78 1mz5 s HIS 547 Cb -0.09 -2.44 -0.02 0.00 -1.18 0.00 0.00 32.58 28.85 1mz5 s HIS 547 CO 0.01 -0.08 -0.14 0.08 -0.65 0.00 0.00 174.74 173.96 1mz5 s VAL 548 N 1.55 2.99 -0.04 0.89 1.01 0.23 -0.76 120.40 126.27 1mz5 s VAL 548 Ca 0.13 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.41 1mz5 s VAL 548 Cb -0.15 -2.22 0.02 0.00 0.00 0.00 0.00 36.38 34.03 1mz5 s VAL 548 CO 0.08 0.55 -0.04 -0.69 0.00 0.00 0.00 175.10 175.00 1mz5 s VAL 549 N -0.03 0.47 -0.10 2.92 1.01 -0.51 -0.57 120.40 123.59 1mz5 s VAL 549 Ca -0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 61.98 61.83 1mz5 s VAL 549 Cb -0.14 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 1mz5 s VAL 549 CO 0.04 0.20 -0.05 -0.76 0.00 0.00 0.00 175.10 174.53 1mz5 s LEU 550 N 0.81 3.24 -0.11 3.92 1.43 1.00 -0.71 118.68 128.26 1mz5 s LEU 550 Ca -0.10 -0.04 0.02 0.00 -1.03 0.00 0.00 54.13 52.98 1mz5 s LEU 550 Cb -0.13 -1.74 0.01 0.00 0.03 0.00 0.00 46.19 44.36 1mz5 s LEU 550 CO -0.00 0.29 -0.16 -0.89 0.23 0.00 0.00 176.35 175.82 1mz5 s THR 551 N -0.39 1.56 -0.07 5.49 2.01 -0.54 -1.06 115.64 122.64 1mz5 s THR 551 Ca 0.06 -0.69 -0.01 0.00 0.31 0.00 0.00 61.69 61.36 1mz5 s THR 551 Cb -0.12 -1.41 0.03 0.00 0.01 0.00 0.00 72.50 71.00 1mz5 s THR 551 CO 0.02 0.45 0.01 -0.32 -0.69 0.00 0.00 174.62 174.09 1mz5 s MET 552 N 0.87 0.56 0.07 4.92 0.00 -0.33 -1.19 119.30 124.21 1mz5 s MET 552 Ca -0.09 0.13 -0.26 0.00 0.00 0.00 0.00 55.69 55.47 1mz5 s MET 552 Cb -0.15 -0.94 0.07 0.00 0.00 0.00 0.00 34.83 33.81 1mz5 s MET 552 CO 0.00 -0.30 0.62 0.00 0.00 0.00 0.00 175.02 175.34 1mz5 s ALA 553 N 1.98 -1.64 -1.40 4.11 0.00 -0.68 -0.83 121.76 123.29 1mz5 s ALA 553 Ca 0.05 0.82 -0.12 0.00 0.00 0.00 0.00 51.96 52.71 1mz5 s ALA 553 Cb -0.12 0.49 0.09 0.00 0.00 0.00 0.00 23.12 23.58 1mz5 s ALA 553 CO -0.05 -0.59 0.61 -0.25 0.00 0.00 0.00 175.76 175.49 1mz5 n ASP 554 N 0.20 -3.74 -0.44 0.00 10.43 -1.26 0.06 116.55 121.80 1mz5 n ASP 554 Ca -0.18 -0.57 -0.06 0.00 2.57 0.00 0.00 54.79 56.55 1mz5 n ASP 554 Cb 0.61 -3.08 -0.02 0.00 1.84 0.00 0.00 41.12 40.47 1mz5 n ASP 554 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1mz5 n ARG 555 N -3.98 -1.49 -4.22 -1.24 1.74 -1.26 -4.97 116.66 101.25 1mz5 n ARG 555 Ca 0.01 0.64 -0.29 0.00 -0.77 0.00 0.00 57.85 57.44 1mz5 n ARG 555 Cb 0.53 -4.86 -0.09 0.00 -1.02 0.00 0.00 32.46 27.01 1mz5 n ARG 555 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1mz5 s GLN 556 N -2.24 2.20 0.00 5.56 -0.21 0.11 0.85 119.66 125.93 1mz5 s GLN 556 Ca 0.00 -1.05 0.04 0.00 0.02 0.00 0.00 55.36 54.37 1mz5 s GLN 556 Cb 0.00 -2.32 -0.01 0.00 1.00 0.00 0.00 33.01 31.68 1mz5 s GLN 556 CO 0.00 0.49 -0.12 0.20 -2.12 0.00 0.00 175.29 173.75 1mz5 s GLY 557 N -2.40 0.61 0.08 3.09 0.00 -0.35 -1.69 107.32 106.66 1mz5 s GLY 557 Ca 0.23 -0.57 0.05 0.00 0.00 0.00 0.00 44.72 44.43 1mz5 s GLY 557 CO 0.15 -0.50 -0.14 -0.56 0.00 0.00 0.00 173.10 172.06 1mz5 s SER 558 N -0.47 1.70 -0.08 1.64 0.01 -0.33 -0.62 113.70 115.54 1mz5 s SER 558 Ca 0.04 -0.67 0.03 0.00 1.31 0.00 0.00 55.95 56.65 1mz5 s SER 558 Cb -0.05 -0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.14 1mz5 s SER 558 CO -0.00 -0.11 -0.16 -0.69 0.41 0.00 0.00 173.24 172.69 1mz5 s VAL 559 N -1.53 1.49 -0.07 3.43 1.01 -1.26 -1.47 120.40 121.99 1mz5 s VAL 559 Ca 0.00 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.34 1mz5 s VAL 559 Cb -0.08 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 1mz5 s VAL 559 CO 0.02 0.43 -0.15 -0.31 0.00 0.00 0.00 175.10 175.10 1mz5 s TYR 560 N 0.63 2.70 -0.09 5.22 1.51 0.11 -0.59 117.35 126.84 1mz5 s TYR 560 Ca -0.14 -0.31 0.04 0.00 -1.01 0.00 0.00 57.07 55.65 1mz5 s TYR 560 Cb -0.16 -1.67 -0.00 0.00 -0.11 0.00 0.00 41.96 40.01 1mz5 s TYR 560 CO 0.04 0.07 -0.24 0.08 -1.11 0.00 0.00 175.55 174.39 1mz5 s VAL 561 N -0.44 2.02 -1.44 0.71 1.01 -0.21 -1.43 120.40 120.61 1mz5 s VAL 561 Ca 0.05 -1.01 -0.12 0.00 0.00 0.00 0.00 61.98 60.91 1mz5 s VAL 561 Cb -0.12 -1.74 0.08 0.00 0.00 0.00 0.00 36.38 34.61 1mz5 s VAL 561 CO 0.02 0.55 0.68 0.47 0.00 0.00 0.00 175.10 176.82 1mz5 n ASP 562 N 3.41 -4.18 0.00 3.32 8.00 0.06 -1.87 116.55 125.29 1mz5 n ASP 562 Ca -0.19 -0.58 0.00 0.00 0.71 0.00 0.00 54.79 54.73 1mz5 n ASP 562 Cb 0.53 -3.41 0.00 0.00 -0.02 0.00 0.00 41.12 38.22 1mz5 n ASP 562 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mz5 n GLY 563 N -1.38 0.69 3.29 0.44 0.00 -1.26 -4.99 105.19 101.99 1mz5 n GLY 563 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1mz5 n GLY 563 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1mz5 s GLN 564 N -0.07 1.99 0.40 1.61 -1.52 -0.78 -4.87 119.66 116.41 1mz5 s GLN 564 Ca 0.00 -0.91 -0.24 0.00 -1.95 0.00 0.00 55.36 52.26 1mz5 s GLN 564 Cb 0.00 -1.95 -0.09 0.00 -0.22 0.00 0.00 33.01 30.76 1mz5 s GLN 564 CO 0.00 0.53 1.05 -1.25 -0.25 0.00 0.00 175.29 175.37 1mz5 s PRO 565 N -0.64 4.17 0.39 2.91 0.04 -1.26 -1.05 135.00 139.56 1mz5 s PRO 565 Ca 0.10 1.51 -0.05 0.00 0.04 0.00 0.00 61.00 62.60 1mz5 s PRO 565 Cb -0.10 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.85 1mz5 s PRO 565 CO -0.01 -0.13 0.68 -0.51 0.04 0.00 0.00 177.00 177.07 1mz5 s LEU 566 N -2.62 3.85 0.36 -3.56 1.43 0.24 -4.89 118.68 113.49 1mz5 s LEU 566 Ca 0.58 0.82 -0.24 0.00 -1.03 0.00 0.00 54.13 54.25 1mz5 s LEU 566 Cb -0.22 -3.71 -0.14 0.00 0.03 0.00 0.00 46.19 42.15 1mz5 s LEU 566 CO 0.28 -0.39 0.58 0.00 0.23 0.00 0.00 176.35 177.04 1mz5 n ALA 567 N -1.65 -1.63 -0.21 4.21 0.00 -1.26 -2.15 120.51 117.81 1mz5 n ALA 567 Ca -0.01 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1mz5 n ALA 567 Cb 0.55 -1.76 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1mz5 n ALA 567 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mz5 n GLY 568 N 1.77 1.48 3.77 0.00 0.00 -1.26 -4.96 105.19 105.99 1mz5 n GLY 568 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1mz5 n GLY 568 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mz5 s SER 569 N -3.15 5.83 0.00 1.61 0.01 -0.92 -1.86 113.70 115.22 1mz5 s SER 569 Ca 0.00 2.33 0.00 0.00 1.31 0.00 0.00 55.95 59.59 1mz5 s SER 569 Cb 0.00 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.63 1mz5 s SER 569 CO 0.00 -1.15 0.00 0.61 0.41 0.00 0.00 173.24 173.11 1mz5 n GLY 570 N 0.40 1.55 3.76 3.44 0.00 0.21 -4.96 105.19 109.59 1mz5 n GLY 570 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1mz5 n GLY 570 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mz5 s ASN 571 N -3.05 5.83 0.19 1.61 0.01 -0.78 -4.55 114.94 114.20 1mz5 s ASN 571 Ca 0.00 2.69 -0.32 0.00 -0.71 0.00 0.00 52.86 54.52 1mz5 s ASN 571 Cb 0.00 -2.63 -0.11 0.00 0.41 0.00 0.00 41.25 38.92 1mz5 s ASN 571 CO 0.00 -1.18 1.65 -0.89 -1.51 0.00 0.00 177.10 175.17 1mz5 s THR 572 N -1.31 2.31 -0.04 1.60 2.01 -1.26 -1.21 115.64 117.73 1mz5 s THR 572 Ca 0.64 0.22 0.13 0.00 0.31 0.00 0.00 61.69 62.99 1mz5 s THR 572 Cb -0.38 -3.14 -0.20 0.00 0.01 0.00 0.00 72.50 68.79 1mz5 s THR 572 CO 0.48 0.02 0.25 1.33 -0.69 0.00 0.00 174.62 176.01 1mz5 n VAL 573 N 3.98 0.15 -4.05 3.82 0.24 0.25 -4.70 118.33 118.02 1mz5 n VAL 573 Ca 0.15 -0.35 -0.13 0.00 -2.04 0.00 0.00 64.34 61.97 1mz5 n VAL 573 Cb 0.37 0.04 -0.12 0.00 -1.47 0.00 0.00 33.84 32.66 1mz5 n VAL 573 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1mz5 s VAL 574 N -2.83 0.38 0.03 3.34 0.11 -1.19 -4.30 120.40 115.93 1mz5 s VAL 574 Ca -0.05 -0.75 0.04 0.00 -2.93 0.00 0.00 61.98 58.29 1mz5 s VAL 574 Cb 0.08 -0.43 -0.04 0.00 -1.53 0.00 0.00 36.38 34.46 1mz5 s VAL 574 CO 0.56 -0.25 -0.05 -0.13 -3.33 0.00 0.00 175.10 171.90 1mz5 s ARG 575 N -1.07 2.55 0.03 1.54 3.00 -1.26 -4.93 118.95 118.82 1mz5 s ARG 575 Ca -0.07 -0.75 0.00 0.00 0.00 0.00 0.00 55.73 54.91 1mz5 s ARG 575 Cb -0.07 -2.52 0.00 0.00 0.00 0.00 0.00 34.95 32.36 1mz5 s ARG 575 CO -0.00 0.59 0.00 0.41 0.00 0.00 0.00 175.30 176.30 1mz5 n GLY 576 N 1.30 -3.63 0.11 -3.53 0.00 -1.26 -4.73 105.19 93.46 1mz5 n GLY 576 Ca -0.14 -2.01 0.12 0.00 0.00 0.00 0.00 46.02 43.99 1mz5 n GLY 576 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mz5 h ALA 577 N 0.00 0.55 -2.28 4.61 0.00 -2.08 -3.46 119.26 116.59 1mz5 h ALA 577 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1mz5 h ALA 577 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1mz5 h ALA 577 CO 0.00 0.00 0.82 0.99 0.00 0.00 0.00 179.25 181.06 1mz5 s THR 578 N -3.32 4.04 0.30 0.00 2.01 -1.26 -4.98 115.64 112.42 1mz5 s THR 578 Ca 0.01 1.36 -0.29 0.00 0.31 0.00 0.00 61.69 63.07 1mz5 s THR 578 Cb 0.10 -3.87 -0.13 0.00 0.01 0.00 0.00 72.50 68.60 1mz5 s THR 578 CO 0.77 -0.04 1.28 0.18 -0.69 0.00 0.00 174.62 176.12 1mz5 n LEU 579 N 5.78 3.07 -4.47 4.42 4.77 -1.26 -4.97 117.00 124.34 1mz5 n LEU 579 Ca 0.13 1.18 -0.32 0.00 -0.03 0.00 0.00 56.01 56.97 1mz5 n LEU 579 Cb 0.45 -1.43 0.15 0.00 -2.33 0.00 0.00 43.42 40.26 1mz5 n LEU 579 CO 0.57 -0.65 0.12 -2.65 -1.33 0.00 0.00 177.39 173.45 1mz5 n PRO 580 N 1.10 -0.64 -3.62 3.23 -0.02 -1.26 -4.98 135.00 128.81 1mz5 n PRO 580 Ca 0.08 -0.14 -0.27 0.00 -2.02 0.00 0.00 63.50 61.15 1mz5 n PRO 580 Cb 0.34 -2.01 -0.10 0.00 -0.02 0.00 0.00 33.50 31.70 1mz5 n PRO 580 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1mz5 n ASP 581 N -2.43 1.80 -4.72 2.55 2.03 -1.26 -4.80 116.55 109.72 1mz5 n ASP 581 Ca 0.07 -2.94 -0.42 0.00 0.52 0.00 0.00 54.79 52.02 1mz5 n ASP 581 Cb 0.54 -0.67 -0.03 0.00 -0.72 0.00 0.00 41.12 40.24 1mz5 n ASP 581 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1mz5 s ILE 582 N -1.11 2.71 -0.04 5.18 1.01 -1.26 -1.40 121.20 126.28 1mz5 s ILE 582 Ca 0.30 0.51 -0.15 0.00 0.00 0.00 0.00 60.65 61.32 1mz5 s ILE 582 Cb 0.03 -3.33 -0.31 0.00 0.01 0.00 0.00 42.46 38.86 1mz5 s ILE 582 CO -0.15 0.04 0.74 0.77 0.00 0.00 0.00 174.94 176.34 1mz5 h SER 583 N 6.77 0.60 -5.51 3.58 4.64 -1.45 -0.51 113.55 121.67 1mz5 h SER 583 Ca -0.43 -0.92 0.23 0.00 -0.47 0.00 0.00 61.79 60.21 1mz5 h SER 583 Cb 1.21 -0.20 -0.09 0.00 -0.31 0.00 0.00 62.40 63.01 1mz5 h SER 583 CO 0.91 1.69 0.62 -1.38 -0.87 0.00 0.00 176.83 177.80 1mz5 s HIS 584 N -2.54 -0.08 -0.10 4.77 -3.43 -1.24 -0.52 115.29 112.14 1mz5 s HIS 584 Ca -0.15 -0.15 -0.05 0.00 -0.80 0.00 0.00 55.06 53.91 1mz5 s HIS 584 Cb 0.04 0.61 -0.04 0.00 -1.43 0.00 0.00 32.58 31.76 1mz5 s HIS 584 CO 0.85 -0.62 0.10 -0.06 -2.00 0.00 0.00 174.74 173.00 1mz5 s PHE 585 N -2.90 3.45 0.05 0.38 0.40 -0.32 -1.22 117.98 117.82 1mz5 s PHE 585 Ca 0.14 0.41 0.05 0.00 -0.60 0.00 0.00 56.93 56.93 1mz5 s PHE 585 Cb 0.01 -1.88 -0.04 0.00 0.51 0.00 0.00 43.02 41.62 1mz5 s PHE 585 CO 0.00 0.65 -0.10 1.52 0.70 0.00 0.00 175.22 177.99 1mz5 s TYR 586 N -0.99 2.77 -0.10 0.36 -0.85 0.44 -1.22 117.35 117.76 1mz5 s TYR 586 Ca 0.15 -0.12 -0.00 0.00 -0.52 0.00 0.00 57.07 56.57 1mz5 s TYR 586 Cb -0.12 -1.52 0.02 0.00 0.38 0.00 0.00 41.96 40.73 1mz5 s TYR 586 CO 0.04 0.37 -0.07 0.42 -1.52 0.00 0.00 175.55 174.79 1mz5 s ILE 587 N -1.06 0.91 0.00 -3.49 1.01 -0.79 -1.22 121.20 116.57 1mz5 s ILE 587 Ca 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.60 1mz5 s ILE 587 Cb -0.11 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.42 1mz5 s ILE 587 CO 0.09 0.34 0.00 0.61 0.00 0.00 0.00 174.94 175.99 1mz5 n GLY 588 N 4.86 -0.09 2.36 6.18 0.00 0.52 -0.38 105.19 118.64 1mz5 n GLY 588 Ca -0.13 -1.04 -0.26 0.00 0.00 0.00 0.00 46.02 44.59 1mz5 n GLY 588 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mz5 n GLY 589 N 0.00 4.11 2.52 -0.02 0.00 -0.22 -3.82 105.19 107.76 1mz5 n GLY 589 Ca 0.00 -2.35 -0.03 0.00 0.00 0.00 0.00 46.02 43.64 1mz5 n GLY 589 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mz5 n PRO 590 N 1.11 0.42 0.00 1.61 -0.04 -1.24 -3.84 135.00 133.02 1mz5 n PRO 590 Ca 0.27 -0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1mz5 n PRO 590 Cb 0.45 -1.72 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 1mz5 n PRO 590 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1mz5 n GLY 594 N 3.15 0.27 3.70 0.55 0.00 -1.26 -4.92 105.19 106.68 1mz5 n GLY 594 Ca 0.09 0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.96 1mz5 n GLY 594 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mz5 n ALA 595 N 2.82 1.14 -0.77 4.61 0.00 -1.26 -4.83 120.51 122.22 1mz5 n ALA 595 Ca 0.00 0.13 -0.07 0.00 0.00 0.00 0.00 53.44 53.50 1mz5 n ALA 595 Cb 0.00 -2.27 -0.07 0.00 0.00 0.00 0.00 19.45 17.11 1mz5 n ALA 595 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1mz5 n PRO 596 N -0.75 1.52 -1.51 0.00 -0.04 -1.26 -4.93 135.00 128.03 1mz5 n PRO 596 Ca 0.10 -0.59 -0.52 0.00 -0.04 0.00 0.00 63.50 62.45 1mz5 n PRO 596 Cb 0.44 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.34 1mz5 n PRO 596 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1mz5 n THR 597 N 1.85 0.83 -3.36 0.52 -1.04 -1.26 -4.64 114.28 107.19 1mz5 n THR 597 Ca 0.22 -0.21 -0.26 0.00 -2.04 0.00 0.00 64.05 61.76 1mz5 n THR 597 Cb 0.69 -0.35 -0.09 0.00 -1.82 0.00 0.00 70.33 68.75 1mz5 n THR 597 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1mz5 s ASP 598 N -0.23 1.37 -0.35 8.00 -1.08 -1.26 -0.69 116.67 122.42 1mz5 s ASP 598 Ca 0.77 -2.87 -0.28 0.00 -0.52 0.00 0.00 52.55 49.65 1mz5 s ASP 598 Cb -1.02 -0.26 0.02 0.00 -1.46 0.00 0.00 42.92 40.20 1mz5 s ASP 598 CO 0.55 -0.18 1.04 -0.44 0.52 0.00 0.00 175.17 176.65 1mz5 s SER 599 N 0.24 6.81 -1.07 -0.34 0.01 -1.26 -4.93 113.70 113.15 1mz5 s SER 599 Ca 0.31 0.83 -0.15 0.00 1.31 0.00 0.00 55.95 58.25 1mz5 s SER 599 Cb 0.01 -2.52 0.17 0.00 0.21 0.00 0.00 66.02 63.88 1mz5 s SER 599 CO -0.17 -0.92 1.26 -0.13 0.41 0.00 0.00 173.24 173.69 1mz5 s ARG 600 N 3.70 3.89 0.16 12.44 1.81 -1.26 -4.64 118.95 135.05 1mz5 s ARG 600 Ca 0.43 -2.31 -0.01 0.00 -1.72 0.00 0.00 55.73 52.13 1mz5 s ARG 600 Cb -0.11 -4.94 -0.04 0.00 -0.45 0.00 0.00 34.95 29.41 1mz5 s ARG 600 CO 0.19 -1.70 0.08 0.14 -0.68 0.00 0.00 175.30 173.32 1mz5 s VAL 601 N 1.71 0.14 -0.08 3.52 -7.23 -1.25 -0.22 120.40 116.98 1mz5 s VAL 601 Ca 0.37 -1.95 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 1mz5 s VAL 601 Cb -0.04 -2.23 0.02 0.00 0.56 0.00 0.00 36.38 34.68 1mz5 s VAL 601 CO -0.05 -0.29 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.48 1mz5 s THR 602 N -4.04 0.99 -0.03 5.32 2.01 -1.04 -0.70 115.64 118.14 1mz5 s THR 602 Ca 0.30 -0.34 0.03 0.00 0.31 0.00 0.00 61.69 61.99 1mz5 s THR 602 Cb 0.07 -0.95 -0.00 0.00 0.01 0.00 0.00 72.50 71.63 1mz5 s THR 602 CO 0.06 0.34 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.50 1mz5 s VAL 603 N 1.10 1.13 0.10 3.82 1.01 0.30 -1.92 120.40 125.94 1mz5 s VAL 603 Ca -0.07 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 61.40 1mz5 s VAL 603 Cb -0.14 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 1mz5 s VAL 603 CO -0.01 0.34 -0.11 0.42 0.00 0.00 0.00 175.10 175.74 1mz5 s THR 604 N 0.10 1.00 -0.90 3.92 -4.23 -0.04 -1.38 115.64 114.10 1mz5 s THR 604 Ca -0.03 -1.66 -0.06 0.00 -1.18 0.00 0.00 61.69 58.75 1mz5 s THR 604 Cb -0.10 -1.40 -0.01 0.00 1.34 0.00 0.00 72.50 72.33 1mz5 s THR 604 CO 0.01 -0.55 0.74 0.59 -0.54 0.00 0.00 174.62 174.88 1mz5 n ASN 605 N 0.53 -6.47 -4.64 3.99 5.03 -0.61 -1.94 115.26 111.16 1mz5 n ASN 605 Ca -0.16 -0.58 -0.40 0.00 0.87 0.00 0.00 54.58 54.32 1mz5 n ASN 605 Cb 0.58 -4.14 -0.07 0.00 -1.02 0.00 0.00 39.78 35.13 1mz5 n ASN 605 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1mz5 s ILE 606 N -3.17 5.04 -0.06 2.41 1.01 -0.13 -4.28 121.20 122.02 1mz5 s ILE 606 Ca 0.19 1.04 0.05 0.00 0.00 0.00 0.00 60.65 61.93 1mz5 s ILE 606 Cb -0.05 -3.89 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 1mz5 s ILE 606 CO 0.80 0.10 -0.21 -0.69 0.00 0.00 0.00 174.94 174.94 1mz5 s VAL 607 N 2.12 2.43 -0.14 2.92 1.01 0.15 -0.75 120.40 128.14 1mz5 s VAL 607 Ca 0.25 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.31 1mz5 s VAL 607 Cb -0.16 -1.91 0.01 0.00 0.00 0.00 0.00 36.38 34.33 1mz5 s VAL 607 CO 0.09 0.57 -0.20 -0.22 0.00 0.00 0.00 175.10 175.35 1mz5 s LEU 608 N -0.33 2.01 0.10 3.92 2.96 -0.03 -0.72 118.68 126.60 1mz5 s LEU 608 Ca 0.02 -0.57 0.09 0.00 -0.22 0.00 0.00 54.13 53.44 1mz5 s LEU 608 Cb -0.13 -1.37 -0.04 0.00 0.50 0.00 0.00 46.19 45.16 1mz5 s LEU 608 CO 0.02 0.05 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.61 1mz5 s TYR 609 N 0.97 2.53 -0.28 5.38 1.51 -0.06 0.24 117.35 127.63 1mz5 s TYR 609 Ca -0.04 -0.27 0.02 0.00 -1.01 0.00 0.00 57.07 55.77 1mz5 s TYR 609 Cb -0.15 -1.36 0.41 0.00 -0.11 0.00 0.00 41.96 40.75 1mz5 s TYR 609 CO -0.04 0.36 1.59 0.27 -1.11 0.00 0.00 175.55 176.62 1mz5 n ASN 610 N 0.92 3.60 -3.75 2.29 0.23 0.16 -1.93 115.26 116.79 1mz5 n ASN 610 Ca -0.16 -3.01 -0.08 0.00 -0.53 0.00 0.00 54.58 50.80 1mz5 n ASN 610 Cb 0.53 -0.72 -0.02 0.00 -2.08 0.00 0.00 39.78 37.48 1mz5 n ASN 610 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1mz5 s ARG 611 N -2.05 1.65 -0.50 -3.83 1.70 -1.26 -4.78 118.95 109.88 1mz5 s ARG 611 Ca 0.35 -0.86 -0.23 0.00 -0.47 0.00 0.00 55.73 54.52 1mz5 s ARG 611 Cb 0.30 0.60 0.04 0.00 -0.57 0.00 0.00 34.95 35.31 1mz5 s ARG 611 CO 0.06 -0.75 0.85 0.50 -1.08 0.00 0.00 175.30 174.89 1mz5 s ARG 612 N -3.88 3.36 0.39 3.89 3.52 -1.26 -2.82 118.95 122.16 1mz5 s ARG 612 Ca 0.09 -0.21 -0.27 0.00 -0.13 0.00 0.00 55.73 55.21 1mz5 s ARG 612 Cb -0.05 -4.00 -0.11 0.00 -1.56 0.00 0.00 34.95 29.24 1mz5 s ARG 612 CO 0.02 -1.29 1.32 1.28 -0.81 0.00 0.00 175.30 175.82 1mz5 n LEU 613 N 7.02 4.08 -4.91 -0.88 4.77 -1.26 -5.01 117.00 120.81 1mz5 n LEU 613 Ca 0.02 1.16 -0.30 0.00 -0.03 0.00 0.00 56.01 56.86 1mz5 n LEU 613 Cb 0.48 -1.52 0.16 0.00 -2.33 0.00 0.00 43.42 40.21 1mz5 n LEU 613 CO 0.61 -0.44 0.85 0.54 -1.33 0.00 0.00 177.39 177.62 1mz5 s ASN 614 N -0.40 3.39 0.31 -1.43 2.20 -1.26 -4.80 114.94 112.95 1mz5 s ASN 614 Ca 0.58 0.41 0.00 0.00 -0.94 0.00 0.00 52.86 52.91 1mz5 s ASN 614 Cb -0.52 -0.56 0.52 0.00 -2.00 0.00 0.00 41.25 38.68 1mz5 s ASN 614 CO 0.60 -2.57 1.95 0.77 -2.94 0.00 0.00 177.10 174.91 1mz5 h SER 615 N -1.53 0.89 1.32 3.54 4.64 -1.99 -0.49 113.55 119.94 1mz5 h SER 615 Ca -0.45 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 60.73 1mz5 h SER 615 Cb 1.26 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 63.12 1mz5 h SER 615 CO 0.45 0.61 -0.64 0.77 -0.87 0.00 0.00 176.83 177.16 1mz5 h SER 616 N 1.04 0.00 -0.44 4.97 4.64 -1.99 -1.93 113.55 119.84 1mz5 h SER 616 Ca 0.33 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.60 1mz5 h SER 616 Cb 0.03 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.11 1mz5 h SER 616 CO -0.10 0.64 0.07 -0.33 -0.87 0.00 0.00 176.83 176.23 1mz5 h GLU 617 N 0.00 0.73 -0.78 4.77 5.08 -1.78 -0.60 114.58 122.01 1mz5 h GLU 617 Ca -0.01 -0.20 0.04 0.00 -1.00 0.00 0.00 59.36 58.19 1mz5 h GLU 617 Cb 1.47 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.58 1mz5 h GLU 617 CO 0.08 0.76 0.49 0.82 -1.00 0.00 0.00 179.01 180.16 1mz5 h ILE 618 N 0.59 1.09 -0.27 3.13 2.04 -0.95 -1.64 117.51 121.49 1mz5 h ILE 618 Ca 0.13 -0.32 -0.10 0.00 1.00 0.00 0.00 64.86 65.57 1mz5 h ILE 618 Cb 0.39 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 1mz5 h ILE 618 CO 0.01 0.17 -0.25 -0.09 0.00 0.00 0.00 178.15 177.99 1mz5 h ARG 619 N 0.93 0.53 -0.24 2.37 2.43 -1.02 0.10 114.38 119.49 1mz5 h ARG 619 Ca 0.32 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 1mz5 h ARG 619 Cb 0.06 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1mz5 h ARG 619 CO -0.13 0.74 0.12 1.15 -1.51 0.00 0.00 179.97 180.34 1mz5 h THR 620 N 0.47 1.14 -0.58 0.20 2.02 -0.65 0.14 112.91 115.65 1mz5 h THR 620 Ca 0.07 -0.41 -0.04 0.00 0.77 0.00 0.00 66.41 66.80 1mz5 h THR 620 Cb 0.69 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 1mz5 h THR 620 CO 0.05 0.14 0.19 -0.07 0.37 0.00 0.00 175.52 176.20 1mz5 h LEU 621 N 0.26 0.84 -0.46 2.58 3.38 -0.75 -1.07 115.31 120.09 1mz5 h LEU 621 Ca 0.08 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.89 1mz5 h LEU 621 Cb 0.12 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1mz5 h LEU 621 CO -0.01 0.82 0.22 0.15 0.09 0.00 0.00 178.44 179.71 1mz5 h PHE 622 N 0.82 0.41 0.00 1.13 3.57 -0.33 -2.35 116.94 120.19 1mz5 h PHE 622 Ca 0.19 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 1mz5 h PHE 622 Cb 0.27 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 1mz5 h PHE 622 CO 0.02 0.19 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.17 1mz5 h LEU 623 N 0.44 0.00 -3.24 0.59 3.38 -0.31 -3.14 115.31 113.02 1mz5 h LEU 623 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1mz5 h LEU 623 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1mz5 h LEU 623 CO -0.16 0.05 0.00 -1.54 0.09 0.00 0.00 178.44 176.89 1mz5 n SER 624 N -3.16 4.03 0.27 -0.43 3.41 -0.44 -4.73 113.62 112.57 1mz5 n SER 624 Ca 0.01 -2.86 0.13 0.00 -0.26 0.00 0.00 58.87 55.89 1mz5 n SER 624 Cb 0.35 -0.52 0.78 0.00 -0.26 0.00 0.00 64.21 64.56 1mz5 n SER 624 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 1mz5 h GLN 625 N 2.19 0.00 -0.14 4.33 3.07 -1.41 0.79 115.11 123.94 1mz5 h GLN 625 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1mz5 h GLN 625 Cb 1.42 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.98 1mz5 h GLN 625 CO 0.23 0.08 0.00 -0.25 0.09 0.00 0.00 178.83 178.98 1mz5 n ASP 626 N -3.80 1.38 -0.01 0.06 8.00 -1.26 -3.89 116.55 117.03 1mz5 n ASP 626 Ca -0.02 -1.67 0.08 0.00 0.71 0.00 0.00 54.79 53.88 1mz5 n ASP 626 Cb 0.18 -0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 41.07 1mz5 n ASP 626 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1mz5 n MET 627 N 0.13 0.78 0.00 -1.24 2.81 0.27 -4.70 117.12 115.17 1mz5 n MET 627 Ca 0.16 -0.11 0.12 0.00 -1.81 0.00 0.00 57.70 56.05 1mz5 n MET 627 Cb 0.28 -1.33 0.15 0.00 -0.71 0.00 0.00 33.22 31.61 1mz5 n MET 627 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 1mz5 n ILE 628 N -1.90 0.00 -1.73 2.02 -5.35 -1.21 -4.98 119.36 106.21 1mz5 n ILE 628 Ca -0.02 -0.02 -0.34 0.00 -0.27 0.00 0.00 62.75 62.10 1mz5 n ILE 628 Cb 0.37 0.51 0.06 0.00 -1.74 0.00 0.00 39.64 38.83 1mz5 n ILE 628 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1mz5 s GLY 629 N -2.93 2.39 0.00 3.28 0.00 -1.26 -4.93 107.32 103.86 1mz5 s GLY 629 Ca 0.12 0.79 0.29 0.00 0.00 0.00 0.00 44.72 45.92 1mz5 s GLY 629 CO 0.72 1.17 1.95 -1.30 0.00 0.00 0.00 173.10 175.65 1mz5 n THR 630 N -2.26 0.00 0.00 0.90 -2.24 -1.26 -5.02 114.28 104.40 1mz5 n THR 630 Ca 0.12 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1mz5 n THR 630 Cb 0.51 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 1mz5 n THR 630 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60