#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a75 n ALA -1 N 0.00 -0.54 -3.82 0.00 0.00 -1.26 -4.60 120.51 110.28 2a75 n ALA -1 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 53.44 53.39 2a75 n ALA -1 Cb 0.00 -1.97 0.01 0.00 0.00 0.00 0.00 19.45 17.49 2a75 n ALA -1 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2a75 s SER 0 N -1.26 -0.05 -0.34 0.00 0.01 -1.24 -4.30 113.70 106.51 2a75 s SER 0 Ca 0.72 -0.46 -0.41 0.00 1.31 0.00 0.00 55.95 57.11 2a75 s SER 0 Cb -0.42 0.40 -0.18 0.00 0.21 0.00 0.00 66.02 66.03 2a75 s SER 0 CO 0.51 -0.77 1.32 -0.11 0.41 0.00 0.00 173.24 174.60 2a75 n LEU 1 N -0.64 0.83 -4.78 2.44 7.94 -0.97 -4.69 117.00 117.13 2a75 n LEU 1 Ca -0.04 1.06 -0.36 0.00 -1.11 0.00 0.00 56.01 55.57 2a75 n LEU 1 Cb 0.60 -0.80 -0.02 0.00 0.53 0.00 0.00 43.42 43.73 2a75 n LEU 1 CO 0.17 -0.98 0.77 0.00 -1.11 0.00 0.00 177.39 176.24 2a75 s ALA 2 N 2.06 2.90 0.30 1.96 0.00 -1.26 -4.92 121.76 122.80 2a75 s ALA 2 Ca 0.91 0.79 -0.28 0.00 0.00 0.00 0.00 51.96 53.38 2a75 s ALA 2 Cb -1.30 -3.33 -0.13 0.00 0.00 0.00 0.00 23.12 18.36 2a75 s ALA 2 CO 0.68 -0.52 1.11 -2.30 0.00 0.00 0.00 175.76 174.74 2a75 n PRO 3 N -0.71 1.61 0.00 0.00 -0.02 -1.26 -0.54 135.00 134.07 2a75 n PRO 3 Ca 0.08 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 2a75 n PRO 3 Cb 0.50 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 2a75 n PRO 3 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a75 n GLY 4 N 1.12 2.69 3.97 -1.23 0.00 -1.26 -4.08 105.19 106.40 2a75 n GLY 4 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 2a75 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2a75 s SER 5 N 0.26 5.61 0.20 1.61 0.01 0.30 -4.51 113.70 117.18 2a75 s SER 5 Ca 0.00 0.04 -0.22 0.00 1.31 0.00 0.00 55.95 57.08 2a75 s SER 5 Cb 0.00 -1.15 0.07 0.00 0.21 0.00 0.00 66.02 65.15 2a75 s SER 5 CO 0.00 -0.85 0.97 -0.94 0.41 0.00 0.00 173.24 172.82 2a75 s SER 6 N -4.31 -0.07 0.21 2.44 1.04 -1.17 -4.89 113.70 106.95 2a75 s SER 6 Ca 0.52 -0.63 -0.18 0.00 0.48 0.00 0.00 55.95 56.14 2a75 s SER 6 Cb -0.10 0.55 0.03 0.00 0.10 0.00 0.00 66.02 66.60 2a75 s SER 6 CO 0.37 -1.06 0.56 0.00 0.98 0.00 0.00 173.24 174.08 2a75 s ARG 7 N -2.68 1.44 0.08 4.02 1.70 -1.26 -0.82 118.95 121.43 2a75 s ARG 7 Ca 0.17 -0.87 0.05 0.00 -0.47 0.00 0.00 55.73 54.61 2a75 s ARG 7 Cb -0.03 0.54 -0.03 0.00 -0.57 0.00 0.00 34.95 34.86 2a75 s ARG 7 CO 0.05 -0.62 -0.13 0.14 -1.08 0.00 0.00 175.30 173.66 2a75 s VAL 8 N -3.88 1.09 -1.08 4.99 -7.23 -0.60 -4.97 120.40 108.72 2a75 s VAL 8 Ca 0.09 -1.39 -0.21 0.00 -1.81 0.00 0.00 61.98 58.67 2a75 s VAL 8 Cb -0.02 -1.15 0.07 0.00 0.56 0.00 0.00 36.38 35.85 2a75 s VAL 8 CO -0.02 -0.30 1.48 -0.70 -0.31 0.00 0.00 175.10 175.25 2a75 s GLU 9 N -1.99 3.71 0.04 4.82 2.12 -1.26 -0.52 118.70 125.62 2a75 s GLU 9 Ca -0.00 -1.49 -0.25 0.00 0.36 0.00 0.00 54.97 53.59 2a75 s GLU 9 Cb -0.08 -5.33 -0.17 0.00 0.26 0.00 0.00 34.13 28.80 2a75 s GLU 9 CO 0.02 -2.14 1.47 1.25 -0.54 0.00 0.00 175.26 175.32 2a75 h LEU 10 N 12.28 -0.14 -7.98 2.70 5.85 -1.65 -3.36 115.31 123.01 2a75 h LEU 10 Ca 0.26 -0.19 -0.73 0.00 0.84 0.00 0.00 57.88 58.06 2a75 h LEU 10 Cb 0.97 0.04 -0.29 0.00 0.37 0.00 0.00 40.66 41.75 2a75 h LEU 10 CO 1.39 0.11 -0.38 -0.36 -0.34 0.00 0.00 178.44 178.86 2a75 s PHE 11 N -5.23 3.40 -0.31 1.25 0.08 -0.91 -4.98 117.98 111.28 2a75 s PHE 11 Ca -0.15 -1.80 -0.16 0.00 0.12 0.00 0.00 56.93 54.94 2a75 s PHE 11 Cb 0.04 -3.47 -0.02 0.00 -0.57 0.00 0.00 43.02 38.99 2a75 s PHE 11 CO 0.64 -0.98 0.44 0.21 -0.10 0.00 0.00 175.22 175.42 2a75 s LYS 12 N 1.39 3.81 0.38 0.44 2.20 -1.26 -1.01 119.74 125.69 2a75 s LYS 12 Ca 0.05 -0.07 -0.25 0.00 -0.36 0.00 0.00 55.97 55.34 2a75 s LYS 12 Cb -0.26 -3.73 -0.12 0.00 -1.51 0.00 0.00 37.83 32.21 2a75 s LYS 12 CO -0.00 -0.46 0.95 2.89 -0.36 0.00 0.00 175.35 178.37 2a75 n ARG 13 N 5.52 1.24 -4.20 4.03 1.85 -1.26 -0.92 116.66 122.92 2a75 n ARG 13 Ca -0.07 0.44 -0.32 0.00 -1.00 0.00 0.00 57.85 56.90 2a75 n ARG 13 Cb 0.50 -1.91 -0.05 0.00 -1.05 0.00 0.00 32.46 29.95 2a75 n ARG 13 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2a75 n LYS 14 N 0.37 -2.40 0.03 2.89 5.02 0.09 -4.57 118.16 119.59 2a75 n LYS 14 Ca 0.10 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.68 2a75 n LYS 14 Cb 0.37 -4.53 0.00 0.00 -0.02 0.00 0.00 35.03 30.86 2a75 n LYS 14 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2a75 n ASN 15 N -2.79 -0.57 -4.70 4.39 2.85 -0.90 -4.97 115.26 108.58 2a75 n ASN 15 Ca -0.14 0.12 -0.42 0.00 -0.11 0.00 0.00 54.58 54.04 2a75 n ASN 15 Cb 0.60 0.94 -0.03 0.00 1.24 0.00 0.00 39.78 42.53 2a75 n ASN 15 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2a75 s SER 16 N -1.13 6.42 0.27 1.20 0.01 -0.10 -4.84 113.70 115.53 2a75 s SER 16 Ca 0.00 2.77 0.02 0.00 1.31 0.00 0.00 55.95 60.05 2a75 s SER 16 Cb 0.00 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.62 2a75 s SER 16 CO 0.00 -0.99 0.44 0.42 0.41 0.00 0.00 173.24 173.51 2a75 s THR 17 N 2.44 5.19 0.10 1.44 -4.23 -1.26 -3.64 115.64 115.67 2a75 s THR 17 Ca 0.80 -0.61 0.07 0.00 -1.18 0.00 0.00 61.69 60.77 2a75 s THR 17 Cb -0.46 -3.82 -0.03 0.00 1.34 0.00 0.00 72.50 69.52 2a75 s THR 17 CO 0.35 -0.36 -0.18 0.68 -0.54 0.00 0.00 174.62 174.57 2a75 s VAL 18 N -2.07 1.54 -1.13 2.29 -7.23 -0.56 -4.87 120.40 108.38 2a75 s VAL 18 Ca 0.37 -1.55 -0.22 0.00 -1.81 0.00 0.00 61.98 58.78 2a75 s VAL 18 Cb -0.10 -1.47 -0.00 0.00 0.56 0.00 0.00 36.38 35.37 2a75 s VAL 18 CO 0.32 -0.16 1.78 -2.16 -0.31 0.00 0.00 175.10 174.56 2a75 s PRO 19 N -2.04 3.17 0.16 4.82 0.04 -1.26 -0.68 135.00 139.21 2a75 s PRO 19 Ca 0.06 -1.22 -0.30 0.00 0.04 0.00 0.00 61.00 59.58 2a75 s PRO 19 Cb -0.09 -5.32 -0.08 0.00 0.04 0.00 0.00 34.50 29.06 2a75 s PRO 19 CO 0.04 -2.98 1.26 0.12 0.04 0.00 0.00 177.00 175.47 2a75 s PHE 20 N 7.58 3.36 -0.32 0.56 5.36 -0.01 -4.58 117.98 129.93 2a75 s PHE 20 Ca 0.60 1.28 -0.11 0.00 -0.96 0.00 0.00 56.93 57.74 2a75 s PHE 20 Cb -0.00 -3.51 -0.02 0.00 -0.34 0.00 0.00 43.02 39.15 2a75 s PHE 20 CO 0.04 -1.57 0.19 -2.00 -1.46 0.00 0.00 175.22 170.43 2a75 s GLU 21 N 0.21 3.46 0.89 10.12 2.12 -1.26 -0.14 118.70 134.09 2a75 s GLU 21 Ca 0.57 -0.65 -0.11 0.00 0.36 0.00 0.00 54.97 55.13 2a75 s GLU 21 Cb -0.34 -3.68 0.12 0.00 0.26 0.00 0.00 34.13 30.50 2a75 s GLU 21 CO 0.35 -0.41 1.09 -1.21 -0.54 0.00 0.00 175.26 174.54 2a75 s GLU 22 N 1.67 1.34 0.39 4.30 0.41 0.11 -4.85 118.70 122.07 2a75 s GLU 22 Ca 0.05 0.88 0.13 0.00 -0.41 0.00 0.00 54.97 55.63 2a75 s GLU 22 Cb -0.17 -1.81 0.96 0.00 -1.78 0.00 0.00 34.13 31.32 2a75 s GLU 22 CO 0.08 -2.20 1.89 0.77 -0.49 0.00 0.00 175.26 175.31 2a75 h SER 23 N -1.52 0.50 -0.03 -0.19 0.02 -1.98 0.23 113.55 110.59 2a75 h SER 23 Ca -0.49 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2a75 h SER 23 Cb 1.28 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2a75 h SER 23 CO 0.54 0.25 0.00 -0.46 -1.14 0.00 0.00 176.83 176.02 2a75 n ASN 24 N -4.52 0.33 0.00 3.07 0.23 -1.26 -4.88 115.26 108.22 2a75 n ASN 24 Ca 0.17 -1.38 0.00 0.00 -0.53 0.00 0.00 54.58 52.83 2a75 n ASN 24 Cb 0.53 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.22 2a75 n ASN 24 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2a75 n GLY 25 N 0.90 1.10 3.77 4.83 0.00 0.81 -5.04 105.19 111.57 2a75 n GLY 25 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2a75 n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a75 s THR 26 N -2.55 2.91 -0.18 2.61 2.01 -1.26 -4.67 115.64 114.52 2a75 s THR 26 Ca 0.00 0.92 -0.09 0.00 0.31 0.00 0.00 61.69 62.83 2a75 s THR 26 Cb 0.00 -3.58 -0.05 0.00 0.01 0.00 0.00 72.50 68.88 2a75 s THR 26 CO 0.00 0.22 0.14 -0.63 -0.69 0.00 0.00 174.62 173.66 2a75 s ILE 27 N -1.12 5.43 -0.09 1.82 -1.09 -1.26 0.05 121.20 124.95 2a75 s ILE 27 Ca 0.48 0.21 0.01 0.00 -2.23 0.00 0.00 60.65 59.11 2a75 s ILE 27 Cb -0.38 -3.46 0.02 0.00 -1.58 0.00 0.00 42.46 37.07 2a75 s ILE 27 CO 0.50 0.49 -0.09 -0.60 -1.23 0.00 0.00 174.94 174.01 2a75 s ARG 28 N -0.02 1.50 -0.33 2.79 3.52 0.80 -4.96 118.95 122.26 2a75 s ARG 28 Ca 0.10 -0.29 -0.29 0.00 -0.13 0.00 0.00 55.73 55.12 2a75 s ARG 28 Cb -0.11 -1.42 -0.01 0.00 -1.56 0.00 0.00 34.95 31.85 2a75 s ARG 28 CO -0.00 -0.13 1.67 -1.21 -0.81 0.00 0.00 175.30 174.82 2a75 s GLU 29 N 1.20 3.48 -0.08 5.12 0.41 -1.26 -0.83 118.70 126.75 2a75 s GLU 29 Ca -0.05 1.36 0.01 0.00 -0.41 0.00 0.00 54.97 55.88 2a75 s GLU 29 Cb -0.14 -4.12 -0.03 0.00 -1.78 0.00 0.00 34.13 28.06 2a75 s GLU 29 CO -0.02 -1.68 -0.09 0.50 -0.49 0.00 0.00 175.26 173.48 2a75 s ARG 30 N 5.29 2.84 0.42 1.61 3.52 0.15 -4.86 118.95 127.93 2a75 s ARG 30 Ca 0.74 -0.59 -0.24 0.00 -0.13 0.00 0.00 55.73 55.51 2a75 s ARG 30 Cb -0.21 -2.58 -0.08 0.00 -1.56 0.00 0.00 34.95 30.52 2a75 s ARG 30 CO 0.33 0.57 1.12 0.08 -0.81 0.00 0.00 175.30 176.59 2a75 s VAL 31 N -0.57 3.34 -0.15 7.11 1.01 -1.26 -1.49 120.40 128.39 2a75 s VAL 31 Ca 0.08 1.05 0.01 0.00 0.00 0.00 0.00 61.98 63.12 2a75 s VAL 31 Cb -0.12 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.72 2a75 s VAL 31 CO 0.02 0.03 -0.18 -0.69 0.00 0.00 0.00 175.10 174.27 2a75 s VAL 32 N -1.55 2.37 0.09 2.92 1.01 -1.24 -4.86 120.40 119.15 2a75 s VAL 32 Ca 0.60 -0.87 -0.31 0.00 0.00 0.00 0.00 61.98 61.39 2a75 s VAL 32 Cb -0.27 -1.98 -0.14 0.00 0.00 0.00 0.00 36.38 33.99 2a75 s VAL 32 CO 0.33 0.53 1.61 -0.74 0.00 0.00 0.00 175.10 176.83 2a75 h HIS 33 N 7.36 -0.96 -3.88 5.22 6.17 -1.06 0.30 115.15 128.30 2a75 h HIS 33 Ca -0.33 0.00 -0.21 0.00 0.71 0.00 0.00 60.37 60.54 2a75 h HIS 33 Cb 1.19 0.37 -0.24 0.00 2.52 0.00 0.00 27.41 31.25 2a75 h HIS 33 CO 0.49 -0.50 -0.71 -1.12 0.71 0.00 0.00 177.93 176.79 2a75 s SER 34 N -4.57 0.21 -0.16 3.26 0.01 -0.86 -2.68 113.70 108.91 2a75 s SER 34 Ca -0.17 -0.30 -0.01 0.00 1.31 0.00 0.00 55.95 56.78 2a75 s SER 34 Cb 0.06 0.05 -0.01 0.00 0.21 0.00 0.00 66.02 66.33 2a75 s SER 34 CO 0.63 -0.16 -0.11 -0.36 0.41 0.00 0.00 173.24 173.65 2a75 s PHE 35 N -0.84 2.86 0.34 2.43 0.40 -0.41 -0.75 117.98 122.00 2a75 s PHE 35 Ca -0.09 -0.77 0.06 0.00 -0.60 0.00 0.00 56.93 55.53 2a75 s PHE 35 Cb -0.06 -1.92 -0.03 0.00 0.51 0.00 0.00 43.02 41.52 2a75 s PHE 35 CO -0.00 -0.33 0.23 1.03 0.70 0.00 0.00 175.22 176.85 2a75 s ARG 36 N 0.69 1.76 -1.05 0.44 0.52 -0.69 -4.14 118.95 116.48 2a75 s ARG 36 Ca -0.05 -2.03 -0.12 0.00 -0.52 0.00 0.00 55.73 53.01 2a75 s ARG 36 Cb -0.15 0.10 -0.03 0.00 0.52 0.00 0.00 34.95 35.39 2a75 s ARG 36 CO 0.02 -0.59 0.83 -0.89 0.02 0.00 0.00 175.30 174.69 2a75 n ILE 37 N -0.67 -7.64 -2.53 1.52 2.08 -1.26 -0.26 119.36 110.60 2a75 n ILE 37 Ca 0.04 -1.02 -0.38 0.00 0.56 0.00 0.00 62.75 61.94 2a75 n ILE 37 Cb 0.63 -5.49 -0.04 0.00 -0.75 0.00 0.00 39.64 33.98 2a75 n ILE 37 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2a75 s PRO 38 N -4.96 4.42 -0.09 0.38 0.04 -1.26 -4.15 135.00 129.37 2a75 s PRO 38 Ca 0.40 1.63 -0.05 0.00 0.04 0.00 0.00 61.00 63.03 2a75 s PRO 38 Cb -0.10 -2.87 0.04 0.00 0.04 0.00 0.00 34.50 31.61 2a75 s PRO 38 CO 0.80 0.06 0.21 0.99 0.04 0.00 0.00 177.00 179.10 2a75 s THR 39 N -1.42 -0.03 -0.08 1.26 2.01 -0.58 -4.34 115.64 112.46 2a75 s THR 39 Ca 0.51 0.13 0.01 0.00 0.31 0.00 0.00 61.69 62.65 2a75 s THR 39 Cb -0.26 -0.32 0.02 0.00 0.01 0.00 0.00 72.50 71.94 2a75 s THR 39 CO 0.34 0.05 -0.10 -0.51 -0.69 0.00 0.00 174.62 173.71 2a75 s ILE 40 N 0.99 1.05 0.29 1.82 2.07 -1.26 0.24 121.20 126.41 2a75 s ILE 40 Ca -0.07 -0.38 0.02 0.00 -1.41 0.00 0.00 60.65 58.81 2a75 s ILE 40 Cb -0.09 -1.01 -0.05 0.00 0.13 0.00 0.00 42.46 41.44 2a75 s ILE 40 CO -0.06 0.35 0.10 0.68 -1.91 0.00 0.00 174.94 174.10 2a75 s VAL 41 N 1.10 0.66 -0.20 4.00 -7.23 -0.07 -4.65 120.40 114.00 2a75 s VAL 41 Ca -0.07 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.08 2a75 s VAL 41 Cb -0.14 -2.63 -0.01 0.00 0.56 0.00 0.00 36.38 34.16 2a75 s VAL 41 CO -0.01 0.00 -0.09 0.21 -0.31 0.00 0.00 175.10 174.90 2a75 s ASN 42 N -3.38 4.05 -0.32 4.85 2.47 -1.26 -0.84 114.94 120.51 2a75 s ASN 42 Ca 0.36 -0.42 0.03 0.00 0.42 0.00 0.00 52.86 53.25 2a75 s ASN 42 Cb 0.07 -1.67 0.09 0.00 -1.45 0.00 0.00 41.25 38.29 2a75 s ASN 42 CO 0.15 0.02 0.03 -0.69 -3.72 0.00 0.00 177.10 172.89 2a75 s VAL 43 N 1.21 2.05 -1.57 -5.21 1.01 0.05 -4.78 120.40 113.16 2a75 s VAL 43 Ca 0.02 -2.06 -0.14 0.00 0.00 0.00 0.00 61.98 59.80 2a75 s VAL 43 Cb -0.14 -2.45 0.10 0.00 0.00 0.00 0.00 36.38 33.88 2a75 s VAL 43 CO -0.03 -0.50 0.88 -0.67 0.00 0.00 0.00 175.10 174.78 2a75 n ASP 44 N 4.37 -3.89 0.00 3.32 2.03 -1.26 -0.52 116.55 120.60 2a75 n ASP 44 Ca -0.00 -0.87 0.00 0.00 0.52 0.00 0.00 54.79 54.44 2a75 n ASP 44 Cb 0.42 -3.50 0.00 0.00 -0.72 0.00 0.00 41.12 37.32 2a75 n ASP 44 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2a75 n GLY 45 N -1.61 0.89 3.49 0.27 0.00 -1.26 -5.04 105.19 101.93 2a75 n GLY 45 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 2a75 n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a75 s VAL 46 N -2.77 4.33 0.09 1.61 1.01 0.32 -4.79 120.40 120.19 2a75 s VAL 46 Ca 0.00 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.50 2a75 s VAL 46 Cb 0.00 -2.99 -0.06 0.00 0.00 0.00 0.00 36.38 33.34 2a75 s VAL 46 CO 0.00 0.39 1.11 -0.04 0.00 0.00 0.00 175.10 176.56 2a75 s MET 47 N 1.14 4.53 -0.12 2.72 -1.94 -0.33 -0.77 119.30 124.53 2a75 s MET 47 Ca 0.04 1.66 -0.00 0.00 -1.71 0.00 0.00 55.69 55.68 2a75 s MET 47 Cb -0.14 -3.35 0.02 0.00 2.01 0.00 0.00 34.83 33.37 2a75 s MET 47 CO 0.03 -0.07 -0.09 0.08 -0.01 0.00 0.00 175.02 174.95 2a75 s VAL 48 N 0.52 1.18 -0.17 -6.03 1.01 -0.02 -1.18 120.40 115.72 2a75 s VAL 48 Ca 0.53 -0.39 -0.05 0.00 0.00 0.00 0.00 61.98 62.07 2a75 s VAL 48 Cb -0.27 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 2a75 s VAL 48 CO 0.31 0.39 0.00 0.00 0.00 0.00 0.00 175.10 175.81 2a75 s ALA 49 N 1.65 3.16 -0.03 5.51 0.00 0.61 -0.89 121.76 131.76 2a75 s ALA 49 Ca 0.05 -0.81 0.06 0.00 0.00 0.00 0.00 51.96 51.26 2a75 s ALA 49 Cb -0.13 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.25 2a75 s ALA 49 CO -0.09 0.16 -0.20 0.42 0.00 0.00 0.00 175.76 176.05 2a75 s ILE 50 N 0.44 2.61 0.09 0.00 1.01 0.14 -1.17 121.20 124.31 2a75 s ILE 50 Ca -0.01 -0.94 -0.26 0.00 0.00 0.00 0.00 60.65 59.44 2a75 s ILE 50 Cb -0.14 -1.99 0.07 0.00 0.01 0.00 0.00 42.46 40.42 2a75 s ILE 50 CO 0.02 0.55 0.65 0.00 0.00 0.00 0.00 174.94 176.17 2a75 s ALA 51 N -0.71 -1.67 0.05 9.38 0.00 -0.58 -1.52 121.76 126.71 2a75 s ALA 51 Ca 0.11 0.76 -0.30 0.00 0.00 0.00 0.00 51.96 52.53 2a75 s ALA 51 Cb -0.10 0.59 -0.05 0.00 0.00 0.00 0.00 23.12 23.56 2a75 s ALA 51 CO 0.00 -0.65 1.09 -0.51 0.00 0.00 0.00 175.76 175.69 2a75 s ASP 52 N -2.31 7.23 -0.46 0.00 1.11 0.64 -0.21 116.67 122.68 2a75 s ASP 52 Ca -0.02 1.87 -0.10 0.00 0.18 0.00 0.00 52.55 54.48 2a75 s ASP 52 Cb -0.01 -2.58 0.10 0.00 1.07 0.00 0.00 42.92 41.50 2a75 s ASP 52 CO -0.07 -0.34 0.33 0.00 1.18 0.00 0.00 175.17 176.27 2a75 s ALA 53 N 0.85 3.39 -0.79 5.23 0.00 0.24 -1.71 121.76 128.96 2a75 s ALA 53 Ca 0.54 -2.35 -0.16 0.00 0.00 0.00 0.00 51.96 49.99 2a75 s ALA 53 Cb -0.26 -2.81 0.17 0.00 0.00 0.00 0.00 23.12 20.22 2a75 s ALA 53 CO 0.29 -1.80 0.84 1.03 0.00 0.00 0.00 175.76 176.13 2a75 s ARG 54 N 1.43 3.45 0.24 0.00 0.52 0.07 -2.01 118.95 122.66 2a75 s ARG 54 Ca 0.04 -1.99 -0.05 0.00 -0.52 0.00 0.00 55.73 53.22 2a75 s ARG 54 Cb -0.25 -4.53 0.46 0.00 0.52 0.00 0.00 34.95 31.15 2a75 s ARG 54 CO 0.01 -1.48 1.69 1.88 0.02 0.00 0.00 175.30 177.42 2a75 h TYR 55 N 8.43 0.29 0.00 -0.53 -1.99 -1.72 -2.26 116.97 119.20 2a75 h TYR 55 Ca 0.02 0.04 -0.20 0.00 2.00 0.00 0.00 58.73 60.59 2a75 h TYR 55 Cb 1.05 -0.01 -0.04 0.00 2.00 0.00 0.00 36.73 39.73 2a75 h TYR 55 CO 1.02 -0.08 -1.85 0.39 -0.00 0.00 0.00 178.16 177.64 2a75 n GLU 56 N -5.15 1.66 -3.86 4.88 -0.58 -1.26 -1.32 120.64 115.02 2a75 n GLU 56 Ca 0.14 -0.02 -0.08 0.00 -0.42 0.00 0.00 57.16 56.78 2a75 n GLU 56 Cb 0.46 -1.33 -0.03 0.00 -0.57 0.00 0.00 31.44 29.97 2a75 n GLU 56 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2a75 s THR 57 N -2.41 0.00 -1.77 2.62 -4.23 -1.26 -4.84 115.64 103.75 2a75 s THR 57 Ca -0.06 -1.02 0.26 0.00 -1.18 0.00 0.00 61.69 59.70 2a75 s THR 57 Cb 0.05 -1.97 0.28 0.00 1.34 0.00 0.00 72.50 72.20 2a75 s THR 57 CO 0.54 -0.01 1.58 -1.54 -0.54 0.00 0.00 174.62 174.65 2a75 n SER 58 N -0.44 1.03 -4.71 3.99 3.41 -1.26 -4.67 113.62 110.96 2a75 n SER 58 Ca -0.04 -0.90 -0.42 0.00 -0.26 0.00 0.00 58.87 57.24 2a75 n SER 58 Cb 0.60 0.13 -0.01 0.00 -0.26 0.00 0.00 64.21 64.67 2a75 n SER 58 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2a75 n PHE 59 N -0.63 2.43 -0.23 7.33 -0.00 -1.26 -4.90 117.46 120.19 2a75 n PHE 59 Ca 0.12 0.52 0.02 0.00 -0.00 0.00 0.00 57.45 58.12 2a75 n PHE 59 Cb 0.35 -2.44 0.25 0.00 -0.00 0.00 0.00 39.48 37.64 2a75 n PHE 59 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 2a75 h ASP 60 N 2.70 0.86 -1.64 -2.13 3.45 -1.99 -3.20 116.42 114.46 2a75 h ASP 60 Ca -0.47 -0.01 -0.77 0.00 0.43 0.00 0.00 57.03 56.21 2a75 h ASP 60 Cb 1.27 -0.20 -0.17 0.00 -0.56 0.00 0.00 39.33 39.66 2a75 h ASP 60 CO 0.63 0.60 1.81 0.59 -1.57 0.00 0.00 179.24 181.31 2a75 n ASN 61 N -4.44 5.31 -3.12 6.45 3.02 -1.26 -4.93 115.26 116.29 2a75 n ASN 61 Ca 0.10 -3.16 -0.16 0.00 -0.03 0.00 0.00 54.58 51.33 2a75 n ASN 61 Cb 0.08 -1.45 -0.04 0.00 -0.61 0.00 0.00 39.78 37.77 2a75 n ASN 61 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2a75 s SER 62 N 0.46 1.09 -0.25 6.41 1.04 -1.21 -4.89 113.70 116.35 2a75 s SER 62 Ca 0.38 -1.56 -0.29 0.00 0.48 0.00 0.00 55.95 54.96 2a75 s SER 62 Cb 0.09 0.68 -0.01 0.00 0.10 0.00 0.00 66.02 66.87 2a75 s SER 62 CO 0.02 -1.33 1.46 0.12 0.98 0.00 0.00 173.24 174.49 2a75 s PHE 63 N -2.92 2.39 -0.01 5.02 5.36 -1.21 -4.46 117.98 122.16 2a75 s PHE 63 Ca 0.31 0.70 -0.02 0.00 -0.96 0.00 0.00 56.93 56.97 2a75 s PHE 63 Cb -0.01 -3.92 -0.00 0.00 -0.34 0.00 0.00 43.02 38.75 2a75 s PHE 63 CO 0.22 -2.37 0.04 0.42 -1.46 0.00 0.00 175.22 172.07 2a75 s ILE 64 N 4.71 0.02 0.09 3.12 1.01 -1.09 -2.44 121.20 126.62 2a75 s ILE 64 Ca 0.64 -0.19 0.01 0.00 0.00 0.00 0.00 60.65 61.10 2a75 s ILE 64 Cb -0.21 -0.12 -0.04 0.00 0.01 0.00 0.00 42.46 42.09 2a75 s ILE 64 CO 0.26 -0.11 -0.04 -1.61 0.00 0.00 0.00 174.94 173.44 2a75 s GLU 65 N -0.31 0.79 -0.29 2.79 2.02 -0.85 -2.15 118.70 120.71 2a75 s GLU 65 Ca -0.04 -1.32 -0.23 0.00 0.02 0.00 0.00 54.97 53.40 2a75 s GLU 65 Cb -0.02 -0.04 -0.00 0.00 0.10 0.00 0.00 34.13 34.16 2a75 s GLU 65 CO -0.00 -0.08 0.79 0.99 0.02 0.00 0.00 175.26 176.98 2a75 s THR 66 N -3.75 4.81 0.18 3.63 2.01 -0.74 -0.60 115.64 121.19 2a75 s THR 66 Ca 0.12 1.25 0.02 0.00 0.31 0.00 0.00 61.69 63.40 2a75 s THR 66 Cb 0.06 -4.13 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 2a75 s THR 66 CO -0.05 -0.20 0.34 0.00 -0.69 0.00 0.00 174.62 174.01 2a75 s ALA 67 N 2.91 3.91 -0.01 7.40 0.00 0.70 -0.47 121.76 136.21 2a75 s ALA 67 Ca 0.32 -0.99 -0.01 0.00 0.00 0.00 0.00 51.96 51.29 2a75 s ALA 67 Cb -0.14 -1.85 0.00 0.00 0.00 0.00 0.00 23.12 21.13 2a75 s ALA 67 CO 0.11 0.44 0.02 0.08 0.00 0.00 0.00 175.76 176.41 2a75 s VAL 68 N -1.84 -0.00 -0.06 0.00 1.01 0.07 -1.53 120.40 118.05 2a75 s VAL 68 Ca 0.36 0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.39 2a75 s VAL 68 Cb -0.11 -0.04 0.00 0.00 0.00 0.00 0.00 36.38 36.24 2a75 s VAL 68 CO 0.29 0.01 -0.15 -0.54 0.00 0.00 0.00 175.10 174.70 2a75 s LYS 69 N 0.09 1.85 0.07 2.72 1.02 -0.32 -0.50 119.74 124.67 2a75 s LYS 69 Ca -0.01 -0.54 0.04 0.00 0.02 0.00 0.00 55.97 55.49 2a75 s LYS 69 Cb -0.01 -1.54 -0.03 0.00 -0.52 0.00 0.00 37.83 35.73 2a75 s LYS 69 CO -0.00 0.13 -0.12 1.52 -0.92 0.00 0.00 175.35 175.96 2a75 s TYR 70 N 0.36 1.04 -0.01 3.18 1.13 -0.13 -0.28 117.35 122.63 2a75 s TYR 70 Ca -0.10 -0.51 0.00 0.00 -1.41 0.00 0.00 57.07 55.05 2a75 s TYR 70 Cb -0.14 -0.59 0.01 0.00 -1.10 0.00 0.00 41.96 40.15 2a75 s TYR 70 CO 0.04 0.01 0.00 0.45 -2.51 0.00 0.00 175.55 173.54 2a75 s SER 71 N -1.84 0.17 0.00 -0.18 0.15 -0.32 -0.82 113.70 110.87 2a75 s SER 71 Ca -0.03 -0.00 0.22 0.00 0.70 0.00 0.00 55.95 56.84 2a75 s SER 71 Cb -0.09 -0.08 0.24 0.00 -1.71 0.00 0.00 66.02 64.39 2a75 s SER 71 CO 0.01 -0.05 1.24 1.33 1.20 0.00 0.00 173.24 176.97 2a75 n VAL 72 N 3.62 0.15 -1.95 4.45 0.24 -1.26 -1.18 118.33 122.40 2a75 n VAL 72 Ca -0.20 -0.57 -0.09 0.00 -2.04 0.00 0.00 64.34 61.43 2a75 n VAL 72 Cb 0.55 1.31 0.10 0.00 -1.47 0.00 0.00 33.84 34.32 2a75 n VAL 72 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2a75 n ASP 73 N 1.27 3.22 -3.23 -1.34 5.68 -1.26 -4.96 116.55 115.92 2a75 n ASP 73 Ca 0.14 -3.58 -0.23 0.00 -0.50 0.00 0.00 54.79 50.61 2a75 n ASP 73 Cb 0.55 -0.42 0.03 0.00 -1.14 0.00 0.00 41.12 40.14 2a75 n ASP 73 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2a75 n ASP 74 N -0.79 -5.53 0.00 -1.12 10.43 -1.26 -2.61 116.55 115.67 2a75 n ASP 74 Ca 0.30 -0.38 0.00 0.00 2.57 0.00 0.00 54.79 57.28 2a75 n ASP 74 Cb 0.86 -4.46 0.00 0.00 1.84 0.00 0.00 41.12 39.36 2a75 n ASP 74 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2a75 n GLY 75 N -1.52 0.57 0.09 0.44 0.00 -1.26 -4.96 105.19 98.56 2a75 n GLY 75 Ca -0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 2a75 n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 h ALA 76 N 0.00 0.16 -2.60 4.61 0.00 -1.92 -3.45 119.26 116.06 2a75 h ALA 76 Ca 0.00 -0.09 -0.27 0.00 0.00 0.00 0.00 54.91 54.55 2a75 h ALA 76 Cb 0.00 -0.05 -0.17 0.00 0.00 0.00 0.00 17.79 17.57 2a75 h ALA 76 CO 0.00 -0.26 -0.72 0.95 0.00 0.00 0.00 179.25 179.22 2a75 s THR 77 N -5.60 0.76 0.03 0.00 -4.23 -1.26 -5.10 115.64 100.24 2a75 s THR 77 Ca -0.14 -1.66 0.02 0.00 -1.18 0.00 0.00 61.69 58.73 2a75 s THR 77 Cb 0.06 -1.35 -0.02 0.00 1.34 0.00 0.00 72.50 72.53 2a75 s THR 77 CO 0.69 -0.66 -0.06 0.26 -0.54 0.00 0.00 174.62 174.31 2a75 s TRP 78 N -2.73 0.54 0.09 3.99 0.52 -1.26 -4.40 118.94 115.69 2a75 s TRP 78 Ca 0.05 -0.49 0.06 0.00 0.02 0.00 0.00 56.10 55.74 2a75 s TRP 78 Cb -0.01 -0.34 -0.04 0.00 -1.15 0.00 0.00 33.47 31.94 2a75 s TRP 78 CO -0.02 -0.11 -0.07 -0.80 0.02 0.00 0.00 176.95 175.97 2a75 s ASN 79 N -1.49 4.58 -0.05 2.95 0.01 0.00 -4.92 114.94 116.02 2a75 s ASN 79 Ca -0.11 -0.31 0.06 0.00 -0.71 0.00 0.00 52.86 51.79 2a75 s ASN 79 Cb -0.10 -0.95 -0.01 0.00 0.41 0.00 0.00 41.25 40.60 2a75 s ASN 79 CO -0.00 0.19 -0.24 -0.89 -1.51 0.00 0.00 177.10 174.65 2a75 s THR 80 N -1.21 1.93 0.18 1.60 2.01 -1.26 -0.96 115.64 117.93 2a75 s THR 80 Ca 0.22 -1.01 -0.04 0.00 0.31 0.00 0.00 61.69 61.17 2a75 s THR 80 Cb -0.11 -1.63 -0.03 0.00 0.01 0.00 0.00 72.50 70.73 2a75 s THR 80 CO 0.14 0.54 0.17 -1.10 -0.69 0.00 0.00 174.62 173.69 2a75 s GLN 81 N -0.22 1.15 -0.27 4.92 -0.21 0.34 -4.75 119.66 120.63 2a75 s GLN 81 Ca -0.01 -1.45 -0.03 0.00 0.02 0.00 0.00 55.36 53.88 2a75 s GLN 81 Cb -0.12 0.30 0.02 0.00 1.00 0.00 0.00 33.01 34.21 2a75 s GLN 81 CO 0.02 -0.39 -0.01 0.42 -2.12 0.00 0.00 175.29 173.22 2a75 s ILE 82 N -4.08 3.27 0.03 1.08 -1.09 -1.26 -0.75 121.20 118.41 2a75 s ILE 82 Ca 0.29 -0.91 -0.00 0.00 -2.23 0.00 0.00 60.65 57.79 2a75 s ILE 82 Cb 0.06 -2.68 -0.26 0.00 -1.58 0.00 0.00 42.46 37.99 2a75 s ILE 82 CO 0.07 0.15 0.97 0.00 -1.23 0.00 0.00 174.94 174.89 2a75 h ALA 83 N 8.09 0.29 -3.35 9.38 0.00 -1.08 -3.46 119.26 129.13 2a75 h ALA 83 Ca -0.32 -1.06 -0.42 0.00 0.00 0.00 0.00 54.91 53.11 2a75 h ALA 83 Cb 1.11 0.17 -0.36 0.00 0.00 0.00 0.00 17.79 18.71 2a75 h ALA 83 CO 0.58 1.16 -0.77 0.42 0.00 0.00 0.00 179.25 180.64 2a75 s ILE 84 N -2.64 0.46 0.40 0.00 1.01 -1.14 -4.92 121.20 114.37 2a75 s ILE 84 Ca -0.06 0.00 -0.07 0.00 0.00 0.00 0.00 60.65 60.52 2a75 s ILE 84 Cb 0.07 -0.55 -0.05 0.00 0.01 0.00 0.00 42.46 41.94 2a75 s ILE 84 CO 0.85 0.24 0.73 -0.54 0.00 0.00 0.00 174.94 176.22 2a75 s LYS 85 N 1.47 3.67 0.66 2.79 1.02 -1.26 -1.79 119.74 126.30 2a75 s LYS 85 Ca -0.02 0.27 -0.00 0.00 0.02 0.00 0.00 55.97 56.24 2a75 s LYS 85 Cb -0.13 -2.44 0.09 0.00 -0.52 0.00 0.00 37.83 34.83 2a75 s LYS 85 CO -0.03 -0.03 0.92 0.54 -0.92 0.00 0.00 175.35 175.83 2a75 s ASN 86 N -3.46 4.68 0.53 2.83 6.03 -1.26 -4.80 114.94 119.49 2a75 s ASN 86 Ca 0.48 -0.23 0.35 0.00 -1.03 0.00 0.00 52.86 52.43 2a75 s ASN 86 Cb -0.10 -0.33 1.62 0.00 -3.03 0.00 0.00 41.25 39.41 2a75 s ASN 86 CO 0.35 -1.61 2.04 0.77 -2.03 0.00 0.00 177.10 176.62 2a75 h SER 87 N -0.32 0.00 -1.11 3.54 4.64 -1.87 -3.46 113.55 114.96 2a75 h SER 87 Ca -0.38 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.59 2a75 h SER 87 Cb 1.28 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.26 2a75 h SER 87 CO 0.45 0.00 -0.34 0.54 -0.87 0.00 0.00 176.83 176.61 2a75 n ARG 88 N -2.91 -1.20 0.11 4.77 5.12 -1.26 -4.90 116.66 116.39 2a75 n ARG 88 Ca -0.00 1.04 -0.04 0.00 -1.93 0.00 0.00 57.85 56.92 2a75 n ARG 88 Cb 0.20 -5.30 0.06 0.00 -1.16 0.00 0.00 32.46 26.26 2a75 n ARG 88 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2a75 h ALA 89 N 0.16 0.73 -2.98 7.54 0.00 -1.90 -3.48 119.26 119.33 2a75 h ALA 89 Ca -0.36 -0.70 -0.07 0.00 0.00 0.00 0.00 54.91 53.79 2a75 h ALA 89 Cb 1.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2a75 h ALA 89 CO 0.50 0.95 0.15 -1.54 0.00 0.00 0.00 179.25 179.31 2a75 s SER 90 N -6.80 0.18 0.33 0.00 1.04 -1.25 -4.99 113.70 102.21 2a75 s SER 90 Ca -0.01 -1.16 0.24 0.00 0.48 0.00 0.00 55.95 55.50 2a75 s SER 90 Cb 0.12 0.79 1.19 0.00 0.10 0.00 0.00 66.02 68.21 2a75 s SER 90 CO 0.79 -1.55 1.73 0.77 0.98 0.00 0.00 173.24 175.96 2a75 h SER 91 N 2.04 0.00 -0.15 7.02 4.64 -1.93 -2.48 113.55 122.69 2a75 h SER 91 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2a75 h SER 91 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2a75 h SER 91 CO 0.38 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.67 2a75 n VAL 92 N -2.34 1.58 -1.75 0.95 0.24 -1.26 -3.36 118.33 112.40 2a75 n VAL 92 Ca -0.00 -1.57 -0.39 0.00 -2.04 0.00 0.00 64.34 60.34 2a75 n VAL 92 Cb 0.12 0.10 0.04 0.00 -1.47 0.00 0.00 33.84 32.63 2a75 n VAL 92 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2a75 n SER 93 N -0.52 2.74 -3.58 -1.34 7.64 -0.94 -4.30 113.62 113.32 2a75 n SER 93 Ca 0.13 0.99 -0.13 0.00 1.01 0.00 0.00 58.87 60.86 2a75 n SER 93 Cb 0.56 -1.58 -0.06 0.00 -1.01 0.00 0.00 64.21 62.12 2a75 n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2a75 s ARG 94 N -2.86 0.76 -0.10 1.43 1.70 -0.36 -2.69 118.95 116.83 2a75 s ARG 94 Ca 0.71 0.42 0.03 0.00 -0.47 0.00 0.00 55.73 56.42 2a75 s ARG 94 Cb -0.42 0.36 -0.00 0.00 -0.57 0.00 0.00 34.95 34.32 2a75 s ARG 94 CO 0.50 -0.19 -0.22 0.14 -1.08 0.00 0.00 175.30 174.45 2a75 s VAL 95 N -0.60 2.25 0.24 4.99 -7.23 -0.91 -0.86 120.40 118.28 2a75 s VAL 95 Ca -0.03 -0.96 -0.11 0.00 -1.81 0.00 0.00 61.98 59.08 2a75 s VAL 95 Cb -0.02 -1.87 -0.01 0.00 0.56 0.00 0.00 36.38 35.04 2a75 s VAL 95 CO 0.02 0.55 0.42 0.00 -0.31 0.00 0.00 175.10 175.79 2a75 s MET 96 N 0.29 1.50 -1.14 4.82 0.00 0.84 -4.16 119.30 121.46 2a75 s MET 96 Ca -0.16 -1.32 -0.07 0.00 0.00 0.00 0.00 55.69 54.14 2a75 s MET 96 Cb -0.17 0.44 -0.03 0.00 0.00 0.00 0.00 34.83 35.06 2a75 s MET 96 CO 0.08 -0.60 0.87 -0.25 0.00 0.00 0.00 175.02 175.12 2a75 n ASP 97 N -0.38 -4.64 -4.75 -1.18 9.92 -1.26 -1.02 116.55 113.24 2a75 n ASP 97 Ca -0.01 -0.77 -0.42 0.00 -0.53 0.00 0.00 54.79 53.06 2a75 n ASP 97 Cb 0.63 -4.65 -0.01 0.00 -0.64 0.00 0.00 41.12 36.45 2a75 n ASP 97 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2a75 n ALA 98 N -3.75 2.26 -3.60 2.24 0.00 -1.26 -4.50 120.51 111.90 2a75 n ALA 98 Ca -0.15 0.36 -0.28 0.00 0.00 0.00 0.00 53.44 53.37 2a75 n ALA 98 Cb 0.63 -2.41 -0.17 0.00 0.00 0.00 0.00 19.45 17.50 2a75 n ALA 98 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2a75 s THR 99 N -0.62 1.46 -0.03 0.00 2.01 -0.66 -1.47 115.64 116.32 2a75 s THR 99 Ca 0.58 -0.63 0.07 0.00 0.31 0.00 0.00 61.69 62.03 2a75 s THR 99 Cb -0.50 -1.33 -0.02 0.00 0.01 0.00 0.00 72.50 70.66 2a75 s THR 99 CO 0.57 0.43 -0.23 -0.69 -0.69 0.00 0.00 174.62 174.01 2a75 s VAL 100 N 0.92 1.85 -0.06 3.82 1.01 0.83 -1.18 120.40 127.59 2a75 s VAL 100 Ca -0.08 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 60.94 2a75 s VAL 100 Cb -0.15 -1.54 0.01 0.00 0.00 0.00 0.00 36.38 34.69 2a75 s VAL 100 CO -0.00 0.52 -0.14 -0.63 0.00 0.00 0.00 175.10 174.85 2a75 s ILE 101 N -0.44 1.26 -0.20 2.22 1.01 -0.28 0.29 121.20 125.06 2a75 s ILE 101 Ca 0.06 -0.57 -0.08 0.00 0.00 0.00 0.00 60.65 60.06 2a75 s ILE 101 Cb -0.10 -1.13 -0.04 0.00 0.01 0.00 0.00 42.46 41.20 2a75 s ILE 101 CO 0.00 0.38 0.07 -0.69 0.00 0.00 0.00 174.94 174.70 2a75 s VAL 102 N 0.50 4.76 -0.16 2.92 1.01 -1.26 -0.56 120.40 127.61 2a75 s VAL 102 Ca -0.13 -0.04 -0.03 0.00 0.00 0.00 0.00 61.98 61.78 2a75 s VAL 102 Cb -0.15 -3.16 0.05 0.00 0.00 0.00 0.00 36.38 33.12 2a75 s VAL 102 CO 0.04 0.43 0.05 -0.75 0.00 0.00 0.00 175.10 174.87 2a75 s LYS 103 N 0.66 0.38 7.37 2.72 2.20 -0.72 -4.65 119.74 127.70 2a75 s LYS 103 Ca 0.04 -0.18 0.00 0.00 -0.36 0.00 0.00 55.97 55.47 2a75 s LYS 103 Cb -0.13 -1.76 0.00 0.00 -1.51 0.00 0.00 37.83 34.43 2a75 s LYS 103 CO 0.02 -0.59 0.00 0.41 -0.36 0.00 0.00 175.35 174.83 2a75 n GLY 104 N 5.16 2.48 1.24 5.54 0.00 -1.26 -1.85 105.19 116.50 2a75 n GLY 104 Ca -0.08 -0.30 0.09 0.00 0.00 0.00 0.00 46.02 45.73 2a75 n GLY 104 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2a75 n ASN 105 N 7.05 4.10 -4.80 1.61 6.94 -1.26 -4.27 115.26 124.63 2a75 n ASN 105 Ca 0.00 -2.34 -0.30 0.00 -0.02 0.00 0.00 54.58 51.92 2a75 n ASN 105 Cb 0.00 -0.48 -0.06 0.00 -2.36 0.00 0.00 39.78 36.88 2a75 n ASN 105 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2a75 s LYS 106 N -1.63 2.97 -0.11 -3.83 -0.14 -0.77 -0.65 119.74 115.58 2a75 s LYS 106 Ca 0.43 -0.68 0.03 0.00 -1.36 0.00 0.00 55.97 54.39 2a75 s LYS 106 Cb 0.27 -2.76 0.01 0.00 -1.68 0.00 0.00 37.83 33.67 2a75 s LYS 106 CO 0.22 0.56 -0.20 -0.51 -0.76 0.00 0.00 175.35 174.66 2a75 s LEU 107 N -2.51 1.96 -0.27 3.17 1.43 -0.27 -1.76 118.68 120.43 2a75 s LEU 107 Ca 0.30 -0.51 -0.06 0.00 -1.03 0.00 0.00 54.13 52.83 2a75 s LEU 107 Cb -0.12 -1.27 -0.00 0.00 0.03 0.00 0.00 46.19 44.82 2a75 s LEU 107 CO 0.23 0.09 0.05 -0.31 0.23 0.00 0.00 176.35 176.64 2a75 s TYR 108 N 0.66 3.10 -0.17 0.29 2.02 0.28 -0.64 117.35 122.89 2a75 s TYR 108 Ca -0.12 -0.87 -0.00 0.00 -0.37 0.00 0.00 57.07 55.71 2a75 s TYR 108 Cb -0.16 -2.22 0.00 0.00 -0.40 0.00 0.00 41.96 39.18 2a75 s TYR 108 CO 0.03 -0.53 -0.14 0.42 -1.57 0.00 0.00 175.55 173.76 2a75 s ILE 109 N 1.52 2.66 -0.23 2.71 1.01 -0.01 -1.13 121.20 127.73 2a75 s ILE 109 Ca 0.04 -0.76 -0.06 0.00 0.00 0.00 0.00 60.65 59.87 2a75 s ILE 109 Cb -0.16 -2.14 -0.03 0.00 0.01 0.00 0.00 42.46 40.14 2a75 s ILE 109 CO 0.02 0.50 0.04 -0.22 0.00 0.00 0.00 174.94 175.28 2a75 s LEU 110 N 1.03 3.39 0.20 2.97 2.96 -0.32 -0.42 118.68 128.50 2a75 s LEU 110 Ca -0.01 -0.19 0.07 0.00 -0.22 0.00 0.00 54.13 53.78 2a75 s LEU 110 Cb -0.15 -1.89 -0.05 0.00 0.50 0.00 0.00 46.19 44.61 2a75 s LEU 110 CO -0.03 0.02 -0.11 0.68 -1.32 0.00 0.00 176.35 175.58 2a75 s VAL 111 N 1.29 1.54 -0.19 1.68 -7.23 0.06 -1.65 120.40 115.91 2a75 s VAL 111 Ca 0.04 -2.16 -0.13 0.00 -1.81 0.00 0.00 61.98 57.93 2a75 s VAL 111 Cb -0.15 -2.06 -0.05 0.00 0.56 0.00 0.00 36.38 34.69 2a75 s VAL 111 CO 0.02 -0.58 0.28 -0.83 -0.31 0.00 0.00 175.10 173.68 2a75 s GLY 112 N -3.29 2.13 -0.13 2.32 0.00 -0.19 -0.74 107.32 107.42 2a75 s GLY 112 Ca 0.22 -0.56 0.00 0.00 0.00 0.00 0.00 44.72 44.38 2a75 s GLY 112 CO 0.06 0.48 -0.14 -0.45 0.00 0.00 0.00 173.10 173.06 2a75 s SER 113 N 0.68 3.96 0.07 1.64 0.15 -0.03 -0.11 113.70 120.06 2a75 s SER 113 Ca 0.15 -0.34 0.06 0.00 0.70 0.00 0.00 55.95 56.52 2a75 s SER 113 Cb -0.13 -1.60 -0.03 0.00 -1.71 0.00 0.00 66.02 62.55 2a75 s SER 113 CO 0.04 0.16 -0.16 -0.36 1.20 0.00 0.00 173.24 174.13 2a75 s PHE 114 N 0.36 1.37 -0.27 3.44 0.40 -0.04 -0.98 117.98 122.26 2a75 s PHE 114 Ca -0.11 -0.42 -0.11 0.00 -0.60 0.00 0.00 56.93 55.69 2a75 s PHE 114 Cb -0.16 -0.78 -0.13 0.00 0.51 0.00 0.00 43.02 42.46 2a75 s PHE 114 CO 0.06 0.08 -0.33 0.09 0.70 0.00 0.00 175.22 175.82 2a75 n ASN 115 N 1.42 1.96 0.00 1.36 3.02 -1.02 -1.22 115.26 120.78 2a75 n ASN 115 Ca -0.20 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.59 2a75 n ASN 115 Cb 0.54 -0.73 0.00 0.00 -0.61 0.00 0.00 39.78 38.98 2a75 n ASN 115 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2a75 n LYS 116 N -4.04 0.00 -2.20 3.52 2.85 -1.26 -3.33 118.16 113.70 2a75 n LYS 116 Ca -0.53 -0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 56.35 2a75 n LYS 116 Cb 0.91 -0.32 -0.01 0.00 -0.65 0.00 0.00 35.03 34.96 2a75 n LYS 116 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 2a75 s THR 117 N 0.00 2.95 -1.26 0.58 -4.23 -1.26 -4.93 115.64 107.49 2a75 s THR 117 Ca 0.00 0.78 0.13 0.00 -1.18 0.00 0.00 61.69 61.42 2a75 s THR 117 Cb 0.00 -3.43 0.01 0.00 1.34 0.00 0.00 72.50 70.43 2a75 s THR 117 CO 0.00 0.05 0.77 0.54 -0.54 0.00 0.00 174.62 175.44 2a75 n ARG 118 N -0.16 1.75 -3.66 3.99 1.74 -1.26 -4.90 116.66 114.15 2a75 n ARG 118 Ca 0.05 -0.79 -0.22 0.00 -0.77 0.00 0.00 57.85 56.13 2a75 n ARG 118 Cb 0.46 -1.19 -0.03 0.00 -1.02 0.00 0.00 32.46 30.69 2a75 n ARG 118 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2a75 s ASN 119 N -1.56 4.91 0.39 0.55 4.22 -1.26 -4.82 114.94 117.37 2a75 s ASN 119 Ca 0.11 -0.88 -0.27 0.00 -2.14 0.00 0.00 52.86 49.69 2a75 s ASN 119 Cb 0.11 -0.35 -0.09 0.00 1.28 0.00 0.00 41.25 42.20 2a75 s ASN 119 CO 0.31 -0.75 1.33 -0.55 -2.04 0.00 0.00 177.10 175.39 2a75 s SER 120 N -4.15 6.40 0.29 3.54 0.15 -1.26 -4.92 113.70 113.75 2a75 s SER 120 Ca 0.45 2.71 0.04 0.00 0.70 0.00 0.00 55.95 59.85 2a75 s SER 120 Cb -0.02 -2.64 0.70 0.00 -1.71 0.00 0.00 66.02 62.34 2a75 s SER 120 CO 0.27 -0.80 1.76 4.11 1.20 0.00 0.00 173.24 179.78 2a75 h TRP 121 N 2.85 0.96 0.00 3.44 5.08 -1.99 0.20 115.95 126.49 2a75 h TRP 121 Ca -0.50 0.04 -0.00 0.00 1.08 0.00 0.00 58.89 59.51 2a75 h TRP 121 Cb 1.24 -0.28 -0.00 0.00 -3.00 0.00 0.00 29.16 27.12 2a75 h TRP 121 CO 0.54 0.19 -0.01 1.79 -1.28 0.00 0.00 178.44 179.66 2a75 h THR 122 N 0.69 0.03 -0.11 0.12 1.35 -1.93 -2.93 112.91 110.13 2a75 h THR 122 Ca 0.55 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 66.06 2a75 h THR 122 Cb 0.87 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.64 2a75 h THR 122 CO -0.40 0.01 0.00 0.00 -0.25 0.00 0.00 175.52 174.88 2a75 n GLN 123 N -3.11 2.10 -1.56 4.72 3.00 0.71 -4.28 117.38 118.96 2a75 n GLN 123 Ca -0.01 -1.61 -0.34 0.00 -0.01 0.00 0.00 57.00 55.03 2a75 n GLN 123 Cb 0.23 -1.47 0.08 0.00 0.00 0.00 0.00 30.24 29.08 2a75 n GLN 123 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 2a75 s HIS 124 N -1.89 2.17 0.26 1.08 3.76 -1.11 -4.93 115.29 114.64 2a75 s HIS 124 Ca 0.33 1.58 -0.01 0.00 -0.15 0.00 0.00 55.06 56.81 2a75 s HIS 124 Cb 0.20 -3.44 0.33 0.00 1.11 0.00 0.00 32.58 30.78 2a75 s HIS 124 CO 0.31 -2.44 1.71 0.00 -0.85 0.00 0.00 174.74 173.46 2a75 h ARG 125 N -0.07 0.65 0.00 1.40 3.08 -1.93 -3.47 114.38 114.04 2a75 h ARG 125 Ca -0.48 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 59.29 2a75 h ARG 125 Cb 1.29 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.28 2a75 h ARG 125 CO 0.51 0.79 0.01 -0.40 -1.07 0.00 0.00 179.97 179.81 2a75 n ASP 126 N -4.15 -0.56 -1.15 7.04 5.68 -1.26 -5.04 116.55 117.11 2a75 n ASP 126 Ca 0.01 -1.56 0.07 0.00 -0.50 0.00 0.00 54.79 52.81 2a75 n ASP 126 Cb 0.38 0.97 0.25 0.00 -1.14 0.00 0.00 41.12 41.59 2a75 n ASP 126 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2a75 n GLY 127 N -0.18 1.83 0.24 6.12 0.00 -1.26 -4.59 105.19 107.37 2a75 n GLY 127 Ca -0.01 -0.60 0.06 0.00 0.00 0.00 0.00 46.02 45.47 2a75 n GLY 127 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2a75 h SER 128 N 3.02 0.03 0.27 1.61 4.64 -1.97 -2.11 113.55 119.04 2a75 h SER 128 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2a75 h SER 128 Cb 0.99 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 2a75 h SER 128 CO 0.12 0.11 -0.07 -0.67 -0.87 0.00 0.00 176.83 175.45 2a75 n ASP 129 N -4.43 0.47 -4.58 4.97 2.03 -1.26 -4.92 116.55 108.84 2a75 n ASP 129 Ca -0.02 -0.73 -0.30 0.00 0.52 0.00 0.00 54.79 54.26 2a75 n ASP 129 Cb 0.17 -0.07 -0.10 0.00 -0.72 0.00 0.00 41.12 40.40 2a75 n ASP 129 CO 0.00 0.00 0.00 0.86 -1.92 0.00 0.00 177.20 176.14 2a75 s TRP 130 N -2.34 2.74 -0.13 -0.67 -0.00 -0.80 -2.42 118.94 115.32 2a75 s TRP 130 Ca 0.33 -0.15 -0.08 0.00 -0.00 0.00 0.00 56.10 56.20 2a75 s TRP 130 Cb 0.21 -1.44 0.05 0.00 -0.00 0.00 0.00 33.47 32.28 2a75 s TRP 130 CO 0.44 0.42 0.33 -1.21 -0.00 0.00 0.00 176.95 176.93 2a75 s GLU 131 N -2.17 0.32 -0.30 5.86 2.02 -0.15 -5.00 118.70 119.28 2a75 s GLU 131 Ca 0.21 0.61 -0.23 0.00 0.02 0.00 0.00 54.97 55.58 2a75 s GLU 131 Cb -0.11 -0.01 -0.00 0.00 0.10 0.00 0.00 34.13 34.11 2a75 s GLU 131 CO 0.13 -0.13 0.77 -1.25 0.02 0.00 0.00 175.26 174.80 2a75 s PRO 132 N 1.04 3.98 -0.15 0.39 0.04 -1.26 -0.85 135.00 138.19 2a75 s PRO 132 Ca -0.07 0.58 -0.03 0.00 0.04 0.00 0.00 61.00 61.52 2a75 s PRO 132 Cb -0.08 -3.72 -0.03 0.00 0.04 0.00 0.00 34.50 30.72 2a75 s PRO 132 CO -0.08 -0.64 -0.05 -0.51 0.04 0.00 0.00 177.00 175.76 2a75 s LEU 133 N 2.89 3.18 -0.17 -3.56 1.43 0.08 -0.85 118.68 121.68 2a75 s LEU 133 Ca 0.31 -0.15 -0.06 0.00 -1.03 0.00 0.00 54.13 53.21 2a75 s LEU 133 Cb -0.14 -1.76 -0.03 0.00 0.03 0.00 0.00 46.19 44.28 2a75 s LEU 133 CO 0.12 0.17 0.02 -0.22 0.23 0.00 0.00 176.35 176.67 2a75 s LEU 134 N 0.32 3.56 -0.06 1.79 2.96 0.32 -0.76 118.68 126.82 2a75 s LEU 134 Ca -0.05 -0.02 0.03 0.00 -0.22 0.00 0.00 54.13 53.87 2a75 s LEU 134 Cb -0.14 -1.88 0.01 0.00 0.50 0.00 0.00 46.19 44.67 2a75 s LEU 134 CO 0.03 0.16 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.40 2a75 s VAL 135 N 0.41 1.23 -0.18 1.68 1.01 0.44 -0.68 120.40 124.31 2a75 s VAL 135 Ca 0.00 -0.56 -0.06 0.00 0.00 0.00 0.00 61.98 61.35 2a75 s VAL 135 Cb -0.13 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 2a75 s VAL 135 CO 0.01 0.37 0.04 -0.69 0.00 0.00 0.00 175.10 174.83 2a75 s VAL 136 N 0.42 4.49 0.11 2.92 1.01 -1.26 -0.83 120.40 127.26 2a75 s VAL 136 Ca -0.11 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 61.80 2a75 s VAL 136 Cb -0.14 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 2a75 s VAL 136 CO 0.03 0.45 -0.06 -0.83 0.00 0.00 0.00 175.10 174.69 2a75 s GLY 137 N 0.54 1.82 -0.10 4.51 0.00 0.19 -0.22 107.32 114.05 2a75 s GLY 137 Ca 0.02 -1.23 0.02 0.00 0.00 0.00 0.00 44.72 43.52 2a75 s GLY 137 CO 0.01 -1.22 -0.14 1.85 0.00 0.00 0.00 173.10 173.61 2a75 s GLU 138 N -2.33 2.03 -0.21 2.90 2.12 0.25 -1.11 118.70 122.34 2a75 s GLU 138 Ca 0.23 -0.49 -0.13 0.00 0.36 0.00 0.00 54.97 54.94 2a75 s GLU 138 Cb -0.11 -1.75 -0.04 0.00 0.26 0.00 0.00 34.13 32.48 2a75 s GLU 138 CO 0.15 -0.07 0.28 0.08 -0.54 0.00 0.00 175.26 175.16 2a75 s VAL 139 N 1.01 5.29 -0.11 3.70 1.01 0.18 -1.59 120.40 129.88 2a75 s VAL 139 Ca -0.07 0.45 0.01 0.00 0.00 0.00 0.00 61.98 62.37 2a75 s VAL 139 Cb -0.15 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.64 2a75 s VAL 139 CO -0.01 0.31 -0.13 -0.89 0.00 0.00 0.00 175.10 174.38 2a75 s THR 140 N 1.07 1.37 0.29 3.92 2.01 -0.58 -4.87 115.64 118.86 2a75 s THR 140 Ca 0.13 -0.56 0.10 0.00 0.31 0.00 0.00 61.69 61.68 2a75 s THR 140 Cb -0.14 -1.28 -0.05 0.00 0.01 0.00 0.00 72.50 71.05 2a75 s THR 140 CO 0.06 0.42 -0.03 -1.59 -0.69 0.00 0.00 174.62 172.78 2a75 s LYS 141 N 1.12 2.13 0.02 4.92 -2.85 -1.26 -1.49 119.74 122.32 2a75 s LYS 141 Ca -0.04 -1.57 -0.27 0.00 -1.00 0.00 0.00 55.97 53.08 2a75 s LYS 141 Cb -0.14 -2.03 0.09 0.00 -2.06 0.00 0.00 37.83 33.68 2a75 s LYS 141 CO -0.03 0.29 0.77 -1.54 0.10 0.00 0.00 175.35 174.94 2a75 s SER 142 N -3.66 -0.48 -0.05 0.03 1.04 -0.11 -4.99 113.70 105.48 2a75 s SER 142 Ca 0.32 0.18 0.03 0.00 0.48 0.00 0.00 55.95 56.96 2a75 s SER 142 Cb -0.05 0.47 0.01 0.00 0.10 0.00 0.00 66.02 66.55 2a75 s SER 142 CO 0.19 -0.70 -0.13 0.00 0.98 0.00 0.00 173.24 173.58 2a75 s ALA 143 N -2.72 1.30 -0.09 5.32 0.00 -1.26 -0.75 121.76 123.56 2a75 s ALA 143 Ca -0.00 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 51.47 2a75 s ALA 143 Cb -0.01 -0.51 0.02 0.00 0.00 0.00 0.00 23.12 22.62 2a75 s ALA 143 CO -0.06 0.17 -0.10 0.00 0.00 0.00 0.00 175.76 175.78 2a75 s ALA 144 N 0.39 1.25 -1.20 0.00 0.00 -0.92 -4.84 121.76 116.44 2a75 s ALA 144 Ca -0.10 -0.45 -0.22 0.00 0.00 0.00 0.00 51.96 51.19 2a75 s ALA 144 Cb -0.13 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.28 2a75 s ALA 144 CO 0.03 -0.14 0.70 0.09 0.00 0.00 0.00 175.76 176.43 2a75 n ASN 145 N 4.36 -4.23 0.00 0.00 4.13 -1.26 -2.01 115.26 116.24 2a75 n ASN 145 Ca -0.18 -1.11 0.00 0.00 1.68 0.00 0.00 54.58 54.97 2a75 n ASN 145 Cb 0.51 -2.78 0.00 0.00 -1.54 0.00 0.00 39.78 35.97 2a75 n ASN 145 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2a75 n GLY 146 N -1.87 2.07 3.64 7.41 0.00 -1.26 -4.96 105.19 110.22 2a75 n GLY 146 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 2a75 n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a75 s LYS 147 N 0.00 4.13 -0.00 1.61 1.02 -0.85 -5.06 119.74 120.58 2a75 s LYS 147 Ca 0.00 0.33 -0.16 0.00 0.02 0.00 0.00 55.97 56.16 2a75 s LYS 147 Cb 0.00 -3.60 -0.06 0.00 -0.52 0.00 0.00 37.83 33.65 2a75 s LYS 147 CO 0.00 -0.23 0.44 0.99 -0.92 0.00 0.00 175.35 175.63 2a75 s THR 148 N 1.91 5.00 0.13 2.17 2.01 -1.26 -2.15 115.64 123.45 2a75 s THR 148 Ca 0.22 0.92 -0.04 0.00 0.31 0.00 0.00 61.69 63.10 2a75 s THR 148 Cb -0.15 -3.76 -0.03 0.00 0.01 0.00 0.00 72.50 68.57 2a75 s THR 148 CO 0.09 0.54 0.13 0.42 -0.69 0.00 0.00 174.62 175.11 2a75 s THR 149 N -0.84 0.10 0.15 -0.82 -4.23 0.07 -4.97 115.64 105.10 2a75 s THR 149 Ca 0.25 -1.70 -0.03 0.00 -1.18 0.00 0.00 61.69 59.02 2a75 s THR 149 Cb -0.17 -1.91 -0.03 0.00 1.34 0.00 0.00 72.50 71.73 2a75 s THR 149 CO 0.14 -0.45 0.14 0.00 -0.54 0.00 0.00 174.62 173.90 2a75 s ALA 150 N -4.01 0.66 0.04 3.99 0.00 -1.26 -0.93 121.76 120.25 2a75 s ALA 150 Ca 0.20 -1.34 -0.00 0.00 0.00 0.00 0.00 51.96 50.81 2a75 s ALA 150 Cb 0.06 0.95 -0.03 0.00 0.00 0.00 0.00 23.12 24.09 2a75 s ALA 150 CO -0.00 -0.55 -0.03 0.95 0.00 0.00 0.00 175.76 176.12 2a75 s THR 151 N -4.04 0.23 -0.08 0.00 -4.23 -0.56 -4.99 115.64 101.97 2a75 s THR 151 Ca 0.24 -1.56 -0.01 0.00 -1.18 0.00 0.00 61.69 59.18 2a75 s THR 151 Cb 0.06 -1.17 0.03 0.00 1.34 0.00 0.00 72.50 72.76 2a75 s THR 151 CO 0.03 -0.84 -0.01 -0.63 -0.54 0.00 0.00 174.62 172.63 2a75 s ILE 152 N -3.18 0.45 -0.14 2.99 1.01 -1.26 -1.53 121.20 119.54 2a75 s ILE 152 Ca 0.01 0.07 -0.07 0.00 0.00 0.00 0.00 60.65 60.66 2a75 s ILE 152 Cb 0.03 -0.59 -0.04 0.00 0.01 0.00 0.00 42.46 41.87 2a75 s ILE 152 CO -0.07 0.27 0.11 -0.94 0.00 0.00 0.00 174.94 174.31 2a75 s SER 153 N 1.92 6.09 -0.19 3.58 1.04 -0.62 -4.88 113.70 120.63 2a75 s SER 153 Ca 0.05 0.33 -0.06 0.00 0.48 0.00 0.00 55.95 56.75 2a75 s SER 153 Cb -0.12 -1.97 -0.03 0.00 0.10 0.00 0.00 66.02 63.99 2a75 s SER 153 CO -0.05 0.33 0.02 0.26 0.98 0.00 0.00 173.24 174.77 2a75 s TRP 154 N -0.56 3.10 0.99 5.02 0.52 -1.26 -0.59 118.94 126.16 2a75 s TRP 154 Ca 0.12 -0.25 -0.15 0.00 0.02 0.00 0.00 56.10 55.84 2a75 s TRP 154 Cb -0.12 -2.07 0.19 0.00 -1.15 0.00 0.00 33.47 30.33 2a75 s TRP 154 CO 0.02 -0.08 1.20 0.20 0.02 0.00 0.00 176.95 178.31 2a75 s GLY 155 N 0.71 1.65 0.38 0.98 0.00 0.69 -5.00 107.32 106.73 2a75 s GLY 155 Ca 0.01 -0.89 -0.25 0.00 0.00 0.00 0.00 44.72 43.59 2a75 s GLY 155 CO 0.02 -0.18 1.08 0.54 0.00 0.00 0.00 173.10 174.56 2a75 s LYS 156 N -5.56 4.21 0.47 2.90 3.01 -1.26 -4.67 119.74 118.84 2a75 s LYS 156 Ca 0.69 1.62 -0.23 0.00 -1.01 0.00 0.00 55.97 57.04 2a75 s LYS 156 Cb -0.09 -2.67 -0.07 0.00 -1.01 0.00 0.00 37.83 33.99 2a75 s LYS 156 CO 0.53 -0.12 1.25 -2.14 0.51 0.00 0.00 175.35 175.38 2a75 s PRO 157 N -2.29 3.66 -0.10 -1.68 0.02 -1.26 -4.72 135.00 128.63 2a75 s PRO 157 Ca 0.56 1.99 0.04 0.00 0.02 0.00 0.00 61.00 63.60 2a75 s PRO 157 Cb -0.25 -2.47 0.00 0.00 0.02 0.00 0.00 34.50 31.80 2a75 s PRO 157 CO 0.32 -0.69 -0.22 0.08 -0.33 0.00 0.00 177.00 176.15 2a75 s VAL 158 N -1.41 1.96 0.15 3.83 1.01 0.15 -4.93 120.40 121.15 2a75 s VAL 158 Ca 0.64 -0.95 -0.28 0.00 0.00 0.00 0.00 61.98 61.38 2a75 s VAL 158 Cb -0.34 -1.70 -0.07 0.00 0.00 0.00 0.00 36.38 34.27 2a75 s VAL 158 CO 0.42 0.54 0.89 -0.55 0.00 0.00 0.00 175.10 176.39 2a75 s SER 159 N 0.46 7.48 -0.02 3.32 0.15 -1.26 -0.52 113.70 123.30 2a75 s SER 159 Ca -0.16 1.75 0.20 0.00 0.70 0.00 0.00 55.95 58.44 2a75 s SER 159 Cb -0.17 -2.56 0.62 0.00 -1.71 0.00 0.00 66.02 62.20 2a75 s SER 159 CO 0.07 0.06 1.52 0.18 1.20 0.00 0.00 173.24 176.27 2a75 n LEU 160 N 2.19 3.98 -0.31 3.45 4.77 -0.03 -4.57 117.00 126.48 2a75 n LEU 160 Ca -0.01 -2.10 0.06 0.00 -0.03 0.00 0.00 56.01 53.93 2a75 n LEU 160 Cb 0.49 -0.48 0.21 0.00 -2.33 0.00 0.00 43.42 41.31 2a75 n LEU 160 CO 0.49 0.92 1.15 0.50 -1.33 0.00 0.00 177.39 179.12 2a75 h LYS 161 N 3.93 0.76 0.00 3.23 3.64 -1.92 -1.44 116.57 124.77 2a75 h LYS 161 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2a75 h LYS 161 Cb 1.05 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 2a75 h LYS 161 CO 0.05 0.50 0.00 -1.35 -2.27 0.00 0.00 179.45 176.38 2a75 h PRO 162 N 0.78 0.00 -0.02 1.90 0.11 -1.98 -1.93 132.00 130.86 2a75 h PRO 162 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 2a75 h PRO 162 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 2a75 h PRO 162 CO -0.29 0.00 -0.05 1.28 -0.21 0.00 0.00 178.00 178.72 2a75 n LEU 163 N -2.58 2.04 -4.59 2.35 4.77 -0.55 -4.87 117.00 113.57 2a75 n LEU 163 Ca -0.01 -0.68 -0.42 0.00 -0.03 0.00 0.00 56.01 54.88 2a75 n LEU 163 Cb 0.14 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.16 2a75 n LEU 163 CO 0.18 0.34 0.51 0.12 -1.33 0.00 0.00 177.39 177.21 2a75 s PHE 164 N -2.07 3.16 0.57 -1.77 5.36 -0.73 -4.95 117.98 117.54 2a75 s PHE 164 Ca 0.32 0.58 -0.21 0.00 -0.96 0.00 0.00 56.93 56.66 2a75 s PHE 164 Cb 0.20 -3.24 -0.05 0.00 -0.34 0.00 0.00 43.02 39.59 2a75 s PHE 164 CO 0.35 -0.63 1.27 -2.30 -1.46 0.00 0.00 175.22 172.45 2a75 n PRO 165 N 6.21 1.45 0.12 10.12 -0.02 -1.26 -4.90 135.00 146.72 2a75 n PRO 165 Ca 0.02 0.54 0.13 0.00 -2.02 0.00 0.00 63.50 62.17 2a75 n PRO 165 Cb 0.48 -2.47 0.41 0.00 -0.02 0.00 0.00 33.50 31.90 2a75 n PRO 165 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a75 h ALA 166 N 1.13 1.00 -2.96 3.55 0.00 -1.94 -3.43 119.26 116.61 2a75 h ALA 166 Ca -0.50 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2a75 h ALA 166 Cb 1.32 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.99 2a75 h ALA 166 CO 0.55 0.00 0.23 -1.83 0.00 0.00 0.00 179.25 178.20 2a75 s GLU 167 N -3.16 1.28 -0.09 0.00 -1.05 -1.26 -1.39 118.70 113.03 2a75 s GLU 167 Ca 0.09 -0.49 -0.01 0.00 -0.15 0.00 0.00 54.97 54.41 2a75 s GLU 167 Cb 0.11 0.58 0.03 0.00 -0.44 0.00 0.00 34.13 34.41 2a75 s GLU 167 CO 0.57 -0.56 -0.01 -0.06 0.95 0.00 0.00 175.26 176.15 2a75 s PHE 168 N -3.72 0.84 -1.50 4.83 0.40 0.23 -4.83 117.98 114.23 2a75 s PHE 168 Ca 0.02 -0.33 -0.06 0.00 -0.60 0.00 0.00 56.93 55.96 2a75 s PHE 168 Cb -0.01 -0.90 0.05 0.00 0.51 0.00 0.00 43.02 42.67 2a75 s PHE 168 CO -0.12 -0.39 0.52 -0.25 0.70 0.00 0.00 175.22 175.68 2a75 n ASP 169 N 5.10 -1.23 0.00 1.36 8.00 -1.26 0.10 116.55 128.63 2a75 n ASP 169 Ca -0.08 -1.02 0.00 0.00 0.71 0.00 0.00 54.79 54.40 2a75 n ASP 169 Cb 0.50 -2.92 0.00 0.00 -0.02 0.00 0.00 41.12 38.68 2a75 n ASP 169 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a75 n GLY 170 N -1.85 2.79 3.67 0.44 0.00 -1.26 -4.96 105.19 104.02 2a75 n GLY 170 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 2a75 n GLY 170 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2a75 s ILE 171 N -0.84 3.31 -0.06 -0.61 1.01 0.28 -4.96 121.20 119.33 2a75 s ILE 171 Ca 0.00 0.46 -0.28 0.00 0.00 0.00 0.00 60.65 60.83 2a75 s ILE 171 Cb 0.00 -3.29 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 2a75 s ILE 171 CO 0.00 -0.03 0.89 -0.76 0.00 0.00 0.00 174.94 175.04 2a75 s LEU 172 N 3.90 4.30 0.46 2.97 1.43 -1.26 -0.60 118.68 129.88 2a75 s LEU 172 Ca 0.78 1.44 -0.09 0.00 -1.03 0.00 0.00 54.13 55.23 2a75 s LEU 172 Cb -0.37 -3.39 -0.05 0.00 0.03 0.00 0.00 46.19 42.40 2a75 s LEU 172 CO 0.34 -0.28 0.82 0.42 0.23 0.00 0.00 176.35 177.88 2a75 s THR 173 N 1.33 4.80 0.16 5.49 -4.23 -0.48 -1.84 115.64 120.86 2a75 s THR 173 Ca 0.46 0.56 0.00 0.00 -1.18 0.00 0.00 61.69 61.52 2a75 s THR 173 Cb -0.19 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 69.86 2a75 s THR 173 CO 0.21 -0.71 0.00 1.17 -0.54 0.00 0.00 174.62 174.75 2a75 n LYS 174 N -1.80 0.00 -4.07 3.99 4.81 -0.13 -4.49 118.16 116.46 2a75 n LYS 174 Ca 0.02 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.36 2a75 n LYS 174 Cb 0.54 -0.35 -0.07 0.00 0.02 0.00 0.00 35.03 35.17 2a75 n LYS 174 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2a75 s GLU 175 N -2.00 1.41 -0.03 1.64 2.02 -1.10 -4.05 118.70 116.60 2a75 s GLU 175 Ca 0.00 -1.39 -0.21 0.00 0.02 0.00 0.00 54.97 53.39 2a75 s GLU 175 Cb 0.00 0.39 0.04 0.00 0.10 0.00 0.00 34.13 34.66 2a75 s GLU 175 CO 0.00 -0.54 0.45 -0.59 0.02 0.00 0.00 175.26 174.60 2a75 s PHE 176 N -4.07 -0.36 0.06 1.61 -0.12 -1.26 -0.98 117.98 112.85 2a75 s PHE 176 Ca 0.29 0.59 -0.01 0.00 -0.05 0.00 0.00 56.93 57.75 2a75 s PHE 176 Cb 0.02 0.22 -0.04 0.00 -0.63 0.00 0.00 43.02 42.59 2a75 s PHE 176 CO 0.10 -0.47 -0.04 0.42 -0.05 0.00 0.00 175.22 175.18 2a75 s ILE 177 N -1.28 0.29 0.91 -4.49 1.01 -0.60 -4.71 121.20 112.33 2a75 s ILE 177 Ca -0.13 -1.83 -0.11 0.00 0.00 0.00 0.00 60.65 58.58 2a75 s ILE 177 Cb -0.03 -1.55 0.14 0.00 0.01 0.00 0.00 42.46 41.02 2a75 s ILE 177 CO 0.06 -0.98 1.09 -0.83 0.00 0.00 0.00 174.94 174.29 2a75 s GLY 178 N -2.94 1.62 0.08 6.18 0.00 -1.26 -0.88 107.32 110.12 2a75 s GLY 178 Ca 0.08 -0.03 0.14 0.00 0.00 0.00 0.00 44.72 44.91 2a75 s GLY 178 CO -0.09 0.46 1.44 0.61 0.00 0.00 0.00 173.10 175.53 2a75 n GLY 179 N -0.97 -0.95 0.00 0.20 0.00 0.03 -4.53 105.19 98.97 2a75 n GLY 179 Ca 0.07 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2a75 n GLY 179 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2a75 n VAL 180 N -1.73 -0.94 -0.90 1.61 0.31 -1.26 -3.75 118.33 111.67 2a75 n VAL 180 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2a75 n VAL 180 Cb 0.14 -0.74 0.00 0.00 -0.91 0.00 0.00 33.84 32.33 2a75 n VAL 180 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2a75 n GLY 181 N -0.42 -1.81 3.67 2.92 0.00 -0.54 -4.85 105.19 104.16 2a75 n GLY 181 Ca 0.00 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.73 2a75 n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 s ALA 182 N -1.77 3.60 0.00 4.61 0.00 -1.26 -0.12 121.76 126.81 2a75 s ALA 182 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.16 2a75 s ALA 182 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2a75 s ALA 182 CO 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 175.76 174.87 2a75 n ALA 183 N 5.86 0.00 -2.38 0.00 0.00 0.15 -4.62 120.51 119.52 2a75 n ALA 183 Ca 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.42 2a75 n ALA 183 Cb 0.47 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.83 2a75 n ALA 183 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2a75 s ILE 184 N 1.52 0.00 -0.21 0.00 -4.36 -1.19 -4.67 121.20 112.30 2a75 s ILE 184 Ca 0.00 -1.90 -0.04 0.00 -0.26 0.00 0.00 60.65 58.45 2a75 s ILE 184 Cb 0.00 -2.45 -0.02 0.00 1.25 0.00 0.00 42.46 41.24 2a75 s ILE 184 CO 0.00 0.00 -0.03 -0.69 0.24 0.00 0.00 174.94 174.46 2a75 s VAL 185 N -4.08 3.57 0.96 8.37 1.01 -1.26 -1.00 120.40 127.97 2a75 s VAL 185 Ca 0.36 -0.44 -0.13 0.00 0.00 0.00 0.00 61.98 61.78 2a75 s VAL 185 Cb 0.05 -2.61 0.17 0.00 0.00 0.00 0.00 36.38 33.99 2a75 s VAL 185 CO 0.13 0.43 1.13 0.00 0.00 0.00 0.00 175.10 176.78 2a75 s ALA 186 N 1.21 1.45 0.56 5.51 0.00 -0.09 -4.88 121.76 125.52 2a75 s ALA 186 Ca 0.03 -0.52 0.26 0.00 0.00 0.00 0.00 51.96 51.73 2a75 s ALA 186 Cb -0.14 -3.04 1.66 0.00 0.00 0.00 0.00 23.12 21.59 2a75 s ALA 186 CO -0.00 -2.55 2.22 0.66 0.00 0.00 0.00 175.76 176.08 2a75 h SER 187 N -1.70 0.00 -0.22 0.00 4.64 -2.00 -0.51 113.55 113.77 2a75 h SER 187 Ca -0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 2a75 h SER 187 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 2a75 h SER 187 CO 0.59 0.01 0.00 -0.46 -0.87 0.00 0.00 176.83 176.10 2a75 n ASN 188 N -4.00 1.22 0.00 4.97 0.23 -1.26 -4.89 115.26 111.53 2a75 n ASN 188 Ca -0.03 -1.95 0.00 0.00 -0.53 0.00 0.00 54.58 52.07 2a75 n ASN 188 Cb 0.10 -0.14 0.00 0.00 -2.08 0.00 0.00 39.78 37.65 2a75 n ASN 188 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2a75 n GLY 189 N 0.89 1.70 3.77 4.83 0.00 -0.20 -5.05 105.19 111.13 2a75 n GLY 189 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 2a75 n GLY 189 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2a75 s ASN 190 N -3.23 6.05 -0.16 1.61 -0.87 -1.26 -4.69 114.94 112.39 2a75 s ASN 190 Ca 0.00 2.73 -0.24 0.00 -1.57 0.00 0.00 52.86 53.78 2a75 s ASN 190 Cb 0.00 -2.64 -0.02 0.00 -0.02 0.00 0.00 41.25 38.57 2a75 s ASN 190 CO 0.00 -1.04 0.78 -0.76 -2.57 0.00 0.00 177.10 173.51 2a75 s LEU 191 N -2.68 4.19 -0.27 0.60 1.43 0.07 -0.91 118.68 121.11 2a75 s LEU 191 Ca 0.60 1.12 0.03 0.00 -1.03 0.00 0.00 54.13 54.85 2a75 s LEU 191 Cb -0.40 -3.15 0.06 0.00 0.03 0.00 0.00 46.19 42.73 2a75 s LEU 191 CO 0.50 -0.33 -0.09 -0.69 0.23 0.00 0.00 176.35 175.97 2a75 s VAL 192 N 1.89 2.26 -0.17 -1.59 1.01 -0.17 -0.80 120.40 122.85 2a75 s VAL 192 Ca 0.37 -1.64 -0.04 0.00 0.00 0.00 0.00 61.98 60.66 2a75 s VAL 192 Cb -0.17 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 2a75 s VAL 192 CO 0.13 -0.06 -0.02 -0.31 0.00 0.00 0.00 175.10 174.84 2a75 s TYR 193 N 1.11 3.06 0.09 5.22 4.12 -0.08 -3.17 117.35 127.70 2a75 s TYR 193 Ca -0.08 -0.26 -0.20 0.00 0.02 0.00 0.00 57.07 56.54 2a75 s TYR 193 Cb -0.20 -1.99 -0.07 0.00 -1.52 0.00 0.00 41.96 38.18 2a75 s TYR 193 CO -0.05 -0.03 0.61 -1.25 0.02 0.00 0.00 175.55 174.85 2a75 s PRO 194 N 0.45 4.27 0.11 -1.71 0.04 -1.26 -0.16 135.00 136.75 2a75 s PRO 194 Ca -0.02 0.81 0.07 0.00 0.04 0.00 0.00 61.00 61.90 2a75 s PRO 194 Cb -0.14 -3.25 -0.04 0.00 0.04 0.00 0.00 34.50 31.12 2a75 s PRO 194 CO 0.02 0.62 -0.16 0.14 0.04 0.00 0.00 177.00 177.66 2a75 s VAL 195 N -1.08 1.46 -0.17 -0.36 -7.23 0.32 -0.79 120.40 112.54 2a75 s VAL 195 Ca 0.30 -1.63 -0.04 0.00 -1.81 0.00 0.00 61.98 58.81 2a75 s VAL 195 Cb -0.20 -1.50 -0.02 0.00 0.56 0.00 0.00 36.38 35.22 2a75 s VAL 195 CO 0.20 -0.28 -0.03 0.00 -0.31 0.00 0.00 175.10 174.68 2a75 s GLN 196 N -2.32 3.61 -0.09 4.82 -2.07 -0.06 -1.41 119.66 122.13 2a75 s GLN 196 Ca 0.07 -0.54 0.02 0.00 -1.82 0.00 0.00 55.36 53.09 2a75 s GLN 196 Cb -0.07 -2.95 -0.02 0.00 -1.09 0.00 0.00 33.01 28.88 2a75 s GLN 196 CO 0.04 0.13 -0.16 0.42 -1.32 0.00 0.00 175.29 174.40 2a75 s ILE 197 N 0.65 2.88 -0.16 3.63 1.01 0.57 -1.56 121.20 128.22 2a75 s ILE 197 Ca -0.02 -0.75 -0.06 0.00 0.00 0.00 0.00 60.65 59.82 2a75 s ILE 197 Cb -0.14 -2.16 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 2a75 s ILE 197 CO 0.02 0.56 0.04 0.00 0.00 0.00 0.00 174.94 175.56 2a75 s ALA 198 N -0.12 3.33 0.76 9.38 0.00 -0.15 -1.48 121.76 133.47 2a75 s ALA 198 Ca -0.02 -0.76 -0.02 0.00 0.00 0.00 0.00 51.96 51.15 2a75 s ALA 198 Cb -0.14 -1.78 0.14 0.00 0.00 0.00 0.00 23.12 21.35 2a75 s ALA 198 CO 0.04 0.28 1.05 0.16 0.00 0.00 0.00 175.76 177.28 2a75 s ASP 199 N 0.08 4.12 0.20 0.00 1.47 0.59 -0.95 116.67 122.18 2a75 s ASP 199 Ca 0.04 -0.35 -0.11 0.00 1.18 0.00 0.00 52.55 53.31 2a75 s ASP 199 Cb -0.13 0.05 0.19 0.00 -0.34 0.00 0.00 42.92 42.69 2a75 s ASP 199 CO 0.01 -2.03 1.82 0.24 0.68 0.00 0.00 175.17 175.90 2a75 h MET 200 N -0.70 0.70 0.00 2.11 2.86 -1.59 0.17 114.93 118.48 2a75 h MET 200 Ca -0.36 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.23 2a75 h MET 200 Cb 1.26 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.76 2a75 h MET 200 CO 0.38 0.46 0.00 0.41 1.06 0.00 0.00 176.91 179.22 2a75 n GLY 201 N -1.28 -0.90 0.04 8.32 0.00 -1.26 -4.87 105.19 105.25 2a75 n GLY 201 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2a75 n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a75 n GLY 202 N 0.36 0.66 3.80 -0.02 0.00 0.05 -5.05 105.19 104.99 2a75 n GLY 202 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2a75 n GLY 202 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2a75 s ARG 203 N -0.98 3.56 0.10 1.61 0.52 -1.26 -4.72 118.95 117.78 2a75 s ARG 203 Ca 0.00 1.25 0.09 0.00 -0.52 0.00 0.00 55.73 56.55 2a75 s ARG 203 Cb 0.00 -2.07 -0.04 0.00 0.52 0.00 0.00 34.95 33.37 2a75 s ARG 203 CO 0.00 -0.61 -0.24 0.54 0.02 0.00 0.00 175.30 175.01 2a75 s VAL 204 N -2.28 1.97 0.22 3.52 0.11 -1.26 -0.30 120.40 122.39 2a75 s VAL 204 Ca 0.65 -1.58 -0.22 0.00 -2.93 0.00 0.00 61.98 57.90 2a75 s VAL 204 Cb -0.16 -1.75 0.04 0.00 -1.53 0.00 0.00 36.38 32.98 2a75 s VAL 204 CO 0.30 0.07 0.66 0.72 -3.33 0.00 0.00 175.10 173.51 2a75 s PHE 205 N -1.05 -0.34 0.28 1.54 -0.12 -0.55 -0.64 117.98 117.10 2a75 s PHE 205 Ca 0.10 -0.01 0.10 0.00 -0.05 0.00 0.00 56.93 57.08 2a75 s PHE 205 Cb -0.10 0.63 -0.05 0.00 -0.63 0.00 0.00 43.02 42.88 2a75 s PHE 205 CO 0.05 -1.06 -0.08 0.95 -0.05 0.00 0.00 175.22 175.03 2a75 s THR 206 N -3.84 3.02 0.27 -4.49 -4.23 -1.26 -0.32 115.64 104.79 2a75 s THR 206 Ca 0.07 -2.10 -0.13 0.00 -1.18 0.00 0.00 61.69 58.34 2a75 s THR 206 Cb -0.04 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.17 2a75 s THR 206 CO -0.02 -0.37 0.52 -0.54 -0.54 0.00 0.00 174.62 173.67 2a75 s LYS 207 N -3.62 1.65 -0.18 3.99 1.02 -0.50 -1.70 119.74 120.40 2a75 s LYS 207 Ca 0.31 -1.28 -0.06 0.00 0.02 0.00 0.00 55.97 54.96 2a75 s LYS 207 Cb -0.05 0.49 -0.03 0.00 -0.52 0.00 0.00 37.83 37.71 2a75 s LYS 207 CO 0.18 -0.70 0.03 0.42 -0.92 0.00 0.00 175.35 174.36 2a75 s ILE 208 N -3.83 4.43 -0.19 2.17 -1.09 -1.26 -0.53 121.20 120.91 2a75 s ILE 208 Ca 0.21 -0.16 -0.00 0.00 -2.23 0.00 0.00 60.65 58.47 2a75 s ILE 208 Cb -0.02 -2.99 0.01 0.00 -1.58 0.00 0.00 42.46 37.89 2a75 s ILE 208 CO 0.10 0.46 -0.15 -0.32 -1.23 0.00 0.00 174.94 173.80 2a75 s MET 209 N 0.49 3.13 0.18 2.79 -2.45 0.78 -1.10 119.30 123.12 2a75 s MET 209 Ca 0.01 -0.76 0.04 0.00 -1.25 0.00 0.00 55.69 53.73 2a75 s MET 209 Cb -0.13 -2.70 -0.05 0.00 1.25 0.00 0.00 34.83 33.20 2a75 s MET 209 CO 0.01 -0.16 -0.05 1.52 1.05 0.00 0.00 175.02 177.39 2a75 s TYR 210 N 1.25 1.38 -0.04 4.11 1.13 0.66 -0.90 117.35 124.94 2a75 s TYR 210 Ca 0.03 -0.85 0.02 0.00 -1.41 0.00 0.00 57.07 54.86 2a75 s TYR 210 Cb -0.14 -0.75 0.01 0.00 -1.10 0.00 0.00 41.96 39.98 2a75 s TYR 210 CO -0.08 0.00 -0.09 0.45 -2.51 0.00 0.00 175.55 173.32 2a75 s SER 211 N -3.22 1.33 0.00 -0.18 0.15 0.02 -0.18 113.70 111.61 2a75 s SER 211 Ca 0.22 -0.21 0.25 0.00 0.70 0.00 0.00 55.95 56.91 2a75 s SER 211 Cb 0.04 -0.49 0.34 0.00 -1.71 0.00 0.00 66.02 64.20 2a75 s SER 211 CO 0.04 0.03 1.34 -0.62 1.20 0.00 0.00 173.24 175.24 2a75 n GLU 212 N 3.59 2.22 -2.59 5.44 1.02 -1.26 -0.75 120.64 128.31 2a75 n GLU 212 Ca -0.21 -1.77 -0.10 0.00 -0.02 0.00 0.00 57.16 55.06 2a75 n GLU 212 Cb 0.53 -1.46 0.03 0.00 -0.02 0.00 0.00 31.44 30.52 2a75 n GLU 212 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2a75 n ASP 213 N 1.15 2.58 -3.65 1.62 3.85 -1.26 -4.91 116.55 115.93 2a75 n ASP 213 Ca 0.15 -2.75 -0.27 0.00 -0.71 0.00 0.00 54.79 51.21 2a75 n ASP 213 Cb 0.56 -0.46 0.04 0.00 -1.35 0.00 0.00 41.12 39.91 2a75 n ASP 213 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 2a75 n ASP 214 N -0.46 -5.46 0.00 -1.12 10.43 -1.26 -2.65 116.55 116.03 2a75 n ASP 214 Ca 0.19 -0.61 0.00 0.00 2.57 0.00 0.00 54.79 56.94 2a75 n ASP 214 Cb 0.82 -4.35 0.00 0.00 1.84 0.00 0.00 41.12 39.44 2a75 n ASP 214 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2a75 n GLY 215 N -1.74 0.75 0.15 0.44 0.00 -1.26 -4.95 105.19 98.58 2a75 n GLY 215 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 2a75 n GLY 215 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2a75 h ASN 216 N 0.00 0.47 -3.70 1.61 -1.24 -1.92 -3.45 115.58 107.35 2a75 h ASN 216 Ca 0.00 -0.53 -0.44 0.00 0.71 0.00 0.00 56.30 56.03 2a75 h ASN 216 Cb 0.00 -0.14 -0.17 0.00 0.73 0.00 0.00 38.32 38.75 2a75 h ASN 216 CO 0.00 0.91 -0.75 0.42 -1.29 0.00 0.00 177.43 176.72 2a75 s THR 217 N -4.11 1.55 0.02 -3.57 -4.23 -1.26 -5.10 115.64 98.94 2a75 s THR 217 Ca -0.14 -1.93 0.03 0.00 -1.18 0.00 0.00 61.69 58.48 2a75 s THR 217 Cb 0.05 -1.77 -0.02 0.00 1.34 0.00 0.00 72.50 72.11 2a75 s THR 217 CO 0.78 -0.47 -0.10 0.26 -0.54 0.00 0.00 174.62 174.55 2a75 s TRP 218 N -2.44 0.86 0.00 3.99 0.52 -1.26 -4.36 118.94 116.25 2a75 s TRP 218 Ca 0.15 -0.30 0.04 0.00 0.02 0.00 0.00 56.10 56.00 2a75 s TRP 218 Cb -0.03 -0.53 -0.01 0.00 -1.15 0.00 0.00 33.47 31.75 2a75 s TRP 218 CO 0.05 -0.01 -0.12 0.15 0.02 0.00 0.00 176.95 177.03 2a75 s LYS 219 N -0.89 0.96 -0.31 4.98 1.02 0.75 -4.95 119.74 121.31 2a75 s LYS 219 Ca -0.01 -0.50 -0.14 0.00 0.02 0.00 0.00 55.97 55.35 2a75 s LYS 219 Cb -0.06 -0.93 -0.03 0.00 -0.52 0.00 0.00 37.83 36.28 2a75 s LYS 219 CO 0.00 0.25 0.30 -0.06 -0.92 0.00 0.00 175.35 174.93 2a75 s PHE 220 N -0.40 3.22 0.73 3.18 0.40 -1.26 -0.25 117.98 123.61 2a75 s PHE 220 Ca 0.04 0.10 -0.13 0.00 -0.60 0.00 0.00 56.93 56.34 2a75 s PHE 220 Cb -0.05 -2.54 0.04 0.00 0.51 0.00 0.00 43.02 40.98 2a75 s PHE 220 CO -0.00 -0.29 1.13 0.00 0.70 0.00 0.00 175.22 176.75 2a75 s ALA 221 N 1.92 2.23 0.22 5.36 0.00 -0.26 -4.96 121.76 126.27 2a75 s ALA 221 Ca 0.10 0.53 -0.06 0.00 0.00 0.00 0.00 51.96 52.53 2a75 s ALA 221 Cb -0.16 -3.35 0.19 0.00 0.00 0.00 0.00 23.12 19.80 2a75 s ALA 221 CO 0.11 -1.69 1.74 0.93 0.00 0.00 0.00 175.76 176.84 2a75 h GLU 222 N -0.58 1.05 -7.33 0.00 5.08 -1.76 -3.43 114.58 107.61 2a75 h GLU 222 Ca -0.46 -0.25 -0.50 0.00 -1.00 0.00 0.00 59.36 57.15 2a75 h GLU 222 Cb 1.25 -0.14 0.13 0.00 0.50 0.00 0.00 28.75 30.50 2a75 h GLU 222 CO 0.51 0.94 0.30 0.20 -1.00 0.00 0.00 179.01 179.97 2a75 s GLY 223 N -3.53 1.65 0.22 -3.84 0.00 -0.36 -5.00 107.32 96.45 2a75 s GLY 223 Ca -0.11 0.08 -0.18 0.00 0.00 0.00 0.00 44.72 44.50 2a75 s GLY 223 CO 0.84 0.48 0.58 1.09 0.00 0.00 0.00 173.10 176.09 2a75 s ARG 224 N -4.96 1.50 0.76 2.90 1.70 -1.26 -4.54 118.95 115.06 2a75 s ARG 224 Ca 0.62 -0.91 -0.08 0.00 -0.47 0.00 0.00 55.73 54.89 2a75 s ARG 224 Cb -0.17 0.54 0.10 0.00 -0.57 0.00 0.00 34.95 34.86 2a75 s ARG 224 CO 0.56 -0.65 1.08 -1.54 -1.08 0.00 0.00 175.30 173.67 2a75 s SER 225 N -2.89 4.38 0.86 -2.89 1.04 -0.69 -4.87 113.70 108.63 2a75 s SER 225 Ca 0.11 0.29 -0.11 0.00 0.48 0.00 0.00 55.95 56.72 2a75 s SER 225 Cb -0.02 -0.76 0.11 0.00 0.10 0.00 0.00 66.02 65.44 2a75 s SER 225 CO 0.00 -1.89 1.10 -0.54 0.98 0.00 0.00 173.24 172.89 2a75 s LYS 226 N -5.37 1.55 0.73 4.02 1.02 -1.26 -4.62 119.74 115.80 2a75 s LYS 226 Ca 0.64 1.09 -0.14 0.00 0.02 0.00 0.00 55.97 57.58 2a75 s LYS 226 Cb -0.08 -1.82 0.04 0.00 -0.52 0.00 0.00 37.83 35.44 2a75 s LYS 226 CO 0.46 -2.12 1.16 -0.06 -0.92 0.00 0.00 175.35 173.88 2a75 s PHE 227 N -2.85 2.23 0.00 3.18 0.40 -1.26 -3.43 117.98 116.24 2a75 s PHE 227 Ca 0.63 1.60 0.00 0.00 -0.60 0.00 0.00 56.93 58.56 2a75 s PHE 227 Cb -0.19 -3.33 0.00 0.00 0.51 0.00 0.00 43.02 40.02 2a75 s PHE 227 CO 0.57 -2.26 0.00 0.41 0.70 0.00 0.00 175.22 174.64 2a75 n GLY 228 N -0.05 0.20 3.84 4.36 0.00 0.19 -4.99 105.19 108.74 2a75 n GLY 228 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 2a75 n GLY 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 n SER 230 N 2.17 -0.35 -3.24 0.00 3.41 0.44 -3.09 113.62 112.96 2a75 n SER 230 Ca -0.16 -1.92 -0.08 0.00 -0.26 0.00 0.00 58.87 56.45 2a75 n SER 230 Cb 0.53 0.78 0.00 0.00 -0.26 0.00 0.00 64.21 65.27 2a75 n SER 230 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2a75 n GLU 231 N -0.27 -0.57 -2.54 4.33 1.02 -1.26 -0.49 120.64 120.85 2a75 n GLU 231 Ca 0.03 -0.08 -0.36 0.00 -0.02 0.00 0.00 57.16 56.72 2a75 n GLU 231 Cb 0.26 -0.19 -0.04 0.00 -0.02 0.00 0.00 31.44 31.45 2a75 n GLU 231 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2a75 s PRO 232 N -3.93 4.14 -0.01 3.49 0.04 -1.25 -3.63 135.00 133.85 2a75 s PRO 232 Ca 0.05 1.50 0.07 0.00 0.04 0.00 0.00 61.00 62.66 2a75 s PRO 232 Cb -0.03 -2.51 -0.02 0.00 0.04 0.00 0.00 34.50 31.98 2a75 s PRO 232 CO 0.21 -0.16 -0.23 0.00 0.04 0.00 0.00 177.00 176.85 2a75 s ALA 233 N -1.68 1.94 0.04 8.56 0.00 -0.26 -4.23 121.76 126.13 2a75 s ALA 233 Ca 0.58 -1.02 0.05 0.00 0.00 0.00 0.00 51.96 51.57 2a75 s ALA 233 Cb -0.22 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.40 2a75 s ALA 233 CO 0.27 0.47 -0.15 0.54 0.00 0.00 0.00 175.76 176.89 2a75 s VAL 234 N -0.58 1.18 0.15 0.00 0.11 -1.26 -0.66 120.40 119.36 2a75 s VAL 234 Ca 0.09 -1.04 -0.05 0.00 -2.93 0.00 0.00 61.98 58.05 2a75 s VAL 234 Cb -0.09 -1.07 -0.02 0.00 -1.53 0.00 0.00 36.38 33.67 2a75 s VAL 234 CO -0.01 0.02 0.18 -1.48 -3.33 0.00 0.00 175.10 170.48 2a75 s LEU 235 N -1.17 1.32 -0.16 2.54 0.05 -0.92 -4.65 118.68 115.71 2a75 s LEU 235 Ca 0.02 -1.06 -0.03 0.00 0.05 0.00 0.00 54.13 53.11 2a75 s LEU 235 Cb -0.08 0.75 -0.03 0.00 -2.05 0.00 0.00 46.19 44.78 2a75 s LEU 235 CO 0.01 -0.82 -0.05 -0.70 -0.55 0.00 0.00 176.35 174.24 2a75 s GLU 236 N -4.02 3.63 -0.09 1.48 2.12 -1.26 -0.51 118.70 120.05 2a75 s GLU 236 Ca 0.22 -0.54 -0.01 0.00 0.36 0.00 0.00 54.97 55.00 2a75 s GLU 236 Cb 0.05 -2.89 0.03 0.00 0.26 0.00 0.00 34.13 31.58 2a75 s GLU 236 CO 0.02 0.22 -0.00 -0.46 -0.54 0.00 0.00 175.26 174.50 2a75 s TRP 237 N 0.40 0.80 -1.48 5.30 -0.11 0.80 -4.90 118.94 119.76 2a75 s TRP 237 Ca -0.05 -0.31 -0.03 0.00 1.22 0.00 0.00 56.10 56.93 2a75 s TRP 237 Cb -0.14 -0.88 0.00 0.00 -1.50 0.00 0.00 33.47 30.95 2a75 s TRP 237 CO 0.03 -0.38 0.18 0.39 -4.62 0.00 0.00 176.95 172.54 2a75 n GLU 238 N 5.11 -1.51 -0.79 5.86 1.02 -1.26 -0.93 120.64 128.14 2a75 n GLU 238 Ca -0.08 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 2a75 n GLU 238 Cb 0.50 -3.76 0.00 0.00 -0.02 0.00 0.00 31.44 28.16 2a75 n GLU 238 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2a75 n GLY 239 N -2.38 0.97 3.38 0.62 0.00 -1.26 -5.03 105.19 101.49 2a75 n GLY 239 Ca -0.30 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.45 2a75 n GLY 239 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a75 s LYS 240 N -0.18 1.38 0.05 1.61 1.02 -0.11 -4.69 119.74 118.82 2a75 s LYS 240 Ca 0.00 -1.39 -0.21 0.00 0.02 0.00 0.00 55.97 54.38 2a75 s LYS 240 Cb 0.00 -1.72 -0.06 0.00 -0.52 0.00 0.00 37.83 35.52 2a75 s LYS 240 CO 0.00 0.39 0.63 -0.51 -0.92 0.00 0.00 175.35 174.94 2a75 s LEU 241 N -2.34 4.48 -0.21 3.17 1.43 0.07 -0.14 118.68 125.13 2a75 s LEU 241 Ca 0.16 1.29 -0.00 0.00 -1.03 0.00 0.00 54.13 54.54 2a75 s LEU 241 Cb -0.09 -3.00 0.02 0.00 0.03 0.00 0.00 46.19 43.15 2a75 s LEU 241 CO 0.07 0.16 -0.13 -0.63 0.23 0.00 0.00 176.35 176.05 2a75 s ILE 242 N -0.57 2.52 -0.29 -0.59 1.01 0.33 -1.48 121.20 122.13 2a75 s ILE 242 Ca 0.32 -0.89 -0.07 0.00 0.00 0.00 0.00 60.65 60.00 2a75 s ILE 242 Cb -0.19 -2.15 0.00 0.00 0.01 0.00 0.00 42.46 40.12 2a75 s ILE 242 CO 0.20 0.41 0.09 -0.63 0.00 0.00 0.00 174.94 175.01 2a75 s ILE 243 N 1.33 4.10 -0.31 2.92 1.09 0.10 -2.15 121.20 128.28 2a75 s ILE 243 Ca 0.03 -0.59 -0.10 0.00 -1.10 0.00 0.00 60.65 58.90 2a75 s ILE 243 Cb -0.14 -3.09 -0.01 0.00 -1.06 0.00 0.00 42.46 38.16 2a75 s ILE 243 CO -0.09 0.11 0.15 0.21 -0.10 0.00 0.00 174.94 175.23 2a75 s ASN 244 N 1.53 5.56 -0.00 3.58 3.84 0.17 -0.88 114.94 128.74 2a75 s ASN 244 Ca 0.03 -0.52 -0.00 0.00 0.21 0.00 0.00 52.86 52.59 2a75 s ASN 244 Cb -0.17 -2.00 -0.04 0.00 -0.55 0.00 0.00 41.25 38.49 2a75 s ASN 244 CO 0.03 -0.19 0.08 0.20 -2.79 0.00 0.00 177.10 174.42 2a75 s ASN 245 N 1.62 5.64 0.26 -4.21 0.01 -0.81 -1.10 114.94 116.35 2a75 s ASN 245 Ca 0.05 0.13 -0.30 0.00 -0.71 0.00 0.00 52.86 52.03 2a75 s ASN 245 Cb -0.17 -1.61 -0.09 0.00 0.41 0.00 0.00 41.25 39.79 2a75 s ASN 245 CO 0.06 0.27 1.00 -0.60 -1.51 0.00 0.00 177.10 176.32 2a75 s ARG 246 N -1.74 4.76 -0.31 -0.60 3.52 0.36 -4.05 118.95 120.88 2a75 s ARG 246 Ca 0.23 1.60 -0.02 0.00 -0.13 0.00 0.00 55.73 57.40 2a75 s ARG 246 Cb -0.12 -3.21 0.11 0.00 -1.56 0.00 0.00 34.95 30.17 2a75 s ARG 246 CO 0.14 0.39 0.14 0.08 -0.81 0.00 0.00 175.30 175.23 2a75 s VAL 247 N -1.20 0.34 0.24 7.11 1.01 -1.26 -0.42 120.40 126.21 2a75 s VAL 247 Ca 0.43 -1.20 -0.31 0.00 0.00 0.00 0.00 61.98 60.91 2a75 s VAL 247 Cb -0.28 -1.27 -0.11 0.00 0.00 0.00 0.00 36.38 34.72 2a75 s VAL 247 CO 0.35 -0.76 1.59 -1.81 0.00 0.00 0.00 175.10 174.46 2a75 s ASP 248 N 1.70 6.47 0.00 3.32 -0.00 -1.26 -3.20 116.67 123.70 2a75 s ASP 248 Ca 0.11 2.81 0.00 0.00 -0.00 0.00 0.00 52.55 55.47 2a75 s ASP 248 Cb -0.18 -2.62 0.00 0.00 -0.00 0.00 0.00 42.92 40.12 2a75 s ASP 248 CO -0.26 -0.87 0.00 0.61 -0.00 0.00 0.00 175.17 174.66 2a75 n GLY 249 N 2.89 0.50 3.83 0.21 0.00 -0.14 -4.89 105.19 107.58 2a75 n GLY 249 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.06 2a75 n GLY 249 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2a75 s ASN 250 N -2.17 -0.03 0.56 1.61 3.04 -0.90 -4.50 114.94 112.56 2a75 s ASN 250 Ca 0.00 -0.94 -0.18 0.00 0.04 0.00 0.00 52.86 51.78 2a75 s ASN 250 Cb 0.00 0.73 -0.05 0.00 -1.54 0.00 0.00 41.25 40.39 2a75 s ASN 250 CO 0.00 -1.44 1.09 -0.13 -3.04 0.00 0.00 177.10 173.57 2a75 s ARG 251 N -2.46 3.36 0.02 0.43 0.52 -1.26 -4.55 118.95 115.00 2a75 s ARG 251 Ca 0.17 1.42 -0.30 0.00 -0.52 0.00 0.00 55.73 56.49 2a75 s ARG 251 Cb -0.04 -2.02 -0.06 0.00 0.52 0.00 0.00 34.95 33.34 2a75 s ARG 251 CO 0.09 -0.81 1.48 1.03 0.02 0.00 0.00 175.30 177.11 2a75 s ARG 252 N -3.59 4.26 0.05 3.54 0.52 -0.34 -4.79 118.95 118.59 2a75 s ARG 252 Ca 0.68 2.07 -0.21 0.00 -0.52 0.00 0.00 55.73 57.76 2a75 s ARG 252 Cb -0.20 -3.58 -0.06 0.00 0.52 0.00 0.00 34.95 31.63 2a75 s ARG 252 CO 0.30 -0.62 0.61 -0.51 0.02 0.00 0.00 175.30 175.09 2a75 s LEU 253 N 2.48 4.49 -0.05 2.53 1.43 -1.26 -0.38 118.68 127.91 2a75 s LEU 253 Ca 0.67 1.26 0.04 0.00 -1.03 0.00 0.00 54.13 55.07 2a75 s LEU 253 Cb -0.34 -2.96 -0.00 0.00 0.03 0.00 0.00 46.19 42.93 2a75 s LEU 253 CO 0.28 0.19 -0.17 -0.69 0.23 0.00 0.00 176.35 176.19 2a75 s VAL 254 N -0.69 1.41 0.23 -1.59 1.01 -1.26 -1.93 120.40 117.59 2a75 s VAL 254 Ca 0.31 -0.69 0.10 0.00 0.00 0.00 0.00 61.98 61.70 2a75 s VAL 254 Cb -0.19 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.91 2a75 s VAL 254 CO 0.19 0.41 -0.19 -0.31 0.00 0.00 0.00 175.10 175.20 2a75 s TYR 255 N 0.15 2.08 -0.00 5.22 1.51 -0.06 -0.61 117.35 125.64 2a75 s TYR 255 Ca -0.06 -0.41 0.06 0.00 -1.01 0.00 0.00 57.07 55.64 2a75 s TYR 255 Cb -0.12 -0.96 -0.02 0.00 -0.11 0.00 0.00 41.96 40.75 2a75 s TYR 255 CO 0.03 0.54 -0.18 -1.21 -1.11 0.00 0.00 175.55 173.62 2a75 s GLU 256 N -3.28 1.38 -0.05 -0.62 2.02 -0.20 0.02 118.70 117.97 2a75 s GLU 256 Ca 0.24 -0.67 -0.00 0.00 0.02 0.00 0.00 54.97 54.56 2a75 s GLU 256 Cb -0.05 -1.35 0.03 0.00 0.10 0.00 0.00 34.13 32.86 2a75 s GLU 256 CO 0.11 0.37 -0.00 0.45 0.02 0.00 0.00 175.26 176.20 2a75 s SER 257 N -0.55 0.99 0.00 -0.19 0.15 -0.55 -1.31 113.70 112.25 2a75 s SER 257 Ca 0.06 -0.06 0.26 0.00 0.70 0.00 0.00 55.95 56.92 2a75 s SER 257 Cb -0.07 -0.33 0.63 0.00 -1.71 0.00 0.00 66.02 64.53 2a75 s SER 257 CO -0.00 -0.14 1.49 -1.20 1.20 0.00 0.00 173.24 174.59 2a75 n SER 258 N 4.56 1.44 -2.61 5.45 7.64 -1.26 -0.75 113.62 128.09 2a75 n SER 258 Ca -0.17 -1.20 -0.22 0.00 1.01 0.00 0.00 58.87 58.29 2a75 n SER 258 Cb 0.50 0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.87 2a75 n SER 258 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2a75 n ASP 259 N -0.25 3.70 -3.84 6.43 3.85 -1.26 -4.92 116.55 120.26 2a75 n ASP 259 Ca 0.13 -3.43 -0.29 0.00 -0.71 0.00 0.00 54.79 50.49 2a75 n ASP 259 Cb 0.39 -0.50 0.04 0.00 -1.35 0.00 0.00 41.12 39.70 2a75 n ASP 259 CO 0.00 0.00 0.00 0.80 -1.01 0.00 0.00 177.20 176.99 2a75 n MET 260 N -0.32 -6.04 -0.91 0.11 0.00 -1.26 -1.97 117.12 106.74 2a75 n MET 260 Ca 0.30 0.65 0.00 0.00 -0.00 0.00 0.00 57.70 58.65 2a75 n MET 260 Cb 0.67 -5.57 0.00 0.00 0.00 0.00 0.00 33.22 28.32 2a75 n MET 260 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2a75 n GLY 261 N -1.76 0.95 0.21 -5.12 0.00 -1.26 -4.77 105.19 93.44 2a75 n GLY 261 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 2a75 n GLY 261 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2a75 h LYS 262 N 3.15 0.65 -4.91 1.61 3.64 -1.74 -0.96 116.57 118.02 2a75 h LYS 262 Ca 0.00 -0.16 -0.59 0.00 -1.27 0.00 0.00 60.65 58.63 2a75 h LYS 262 Cb 0.00 -0.08 -0.33 0.00 -0.41 0.00 0.00 32.23 31.40 2a75 h LYS 262 CO 0.00 0.68 -0.84 0.99 -2.27 0.00 0.00 179.45 178.01 2a75 s THR 263 N -5.27 1.56 -0.06 1.00 2.01 -1.26 -1.40 115.64 112.21 2a75 s THR 263 Ca -0.13 -0.73 0.03 0.00 0.31 0.00 0.00 61.69 61.17 2a75 s THR 263 Cb 0.10 -1.38 -0.02 0.00 0.01 0.00 0.00 72.50 71.21 2a75 s THR 263 CO 0.77 0.45 -0.15 0.26 -0.69 0.00 0.00 174.62 175.26 2a75 s TRP 264 N 0.54 2.70 -0.08 4.92 0.52 -1.26 -4.27 118.94 122.01 2a75 s TRP 264 Ca -0.16 -0.28 0.01 0.00 0.02 0.00 0.00 56.10 55.69 2a75 s TRP 264 Cb -0.17 -1.66 0.02 0.00 -1.15 0.00 0.00 33.47 30.51 2a75 s TRP 264 CO 0.06 0.09 -0.10 0.08 0.02 0.00 0.00 176.95 177.09 2a75 s VAL 265 N -0.50 1.09 0.35 4.03 1.01 -0.42 -4.97 120.40 120.98 2a75 s VAL 265 Ca 0.07 -0.41 -0.28 0.00 0.00 0.00 0.00 61.98 61.36 2a75 s VAL 265 Cb -0.12 -1.03 -0.11 0.00 0.00 0.00 0.00 36.38 35.12 2a75 s VAL 265 CO 0.02 0.36 1.41 -0.70 0.00 0.00 0.00 175.10 176.18 2a75 s GLU 266 N 1.04 4.22 -1.38 2.72 2.12 -1.26 -1.03 118.70 125.13 2a75 s GLU 266 Ca -0.07 2.41 -0.09 0.00 0.36 0.00 0.00 54.97 57.58 2a75 s GLU 266 Cb -0.15 -3.02 0.09 0.00 0.26 0.00 0.00 34.13 31.31 2a75 s GLU 266 CO -0.01 -0.38 2.30 0.00 -0.54 0.00 0.00 175.26 176.63 2a75 n ALA 267 N 0.71 6.30 0.27 6.30 0.00 0.22 -4.70 120.51 129.61 2a75 n ALA 267 Ca 0.01 -4.04 0.13 0.00 0.00 0.00 0.00 53.44 49.54 2a75 n ALA 267 Cb 0.40 -3.05 0.76 0.00 0.00 0.00 0.00 19.45 17.56 2a75 n ALA 267 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2a75 h LEU 268 N 7.18 0.00 -1.33 0.00 3.38 -1.89 -1.04 115.31 121.62 2a75 h LEU 268 Ca 0.61 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.58 2a75 h LEU 268 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2a75 h LEU 268 CO 1.64 0.10 0.00 0.61 0.09 0.00 0.00 178.44 180.88 2a75 n GLY 269 N -0.75 0.46 0.41 0.83 0.00 -1.26 -4.25 105.19 100.62 2a75 n GLY 269 Ca -0.02 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2a75 n GLY 269 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2a75 n THR 270 N 0.57 0.00 0.27 2.61 -2.24 -0.99 -4.75 114.28 109.75 2a75 n THR 270 Ca 0.17 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 62.00 2a75 n THR 270 Cb 0.42 -0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 2a75 n THR 270 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2a75 n LEU 271 N -1.33 0.27 -4.77 3.22 4.77 -1.09 -4.58 117.00 113.50 2a75 n LEU 271 Ca 0.00 -0.31 -0.41 0.00 -0.03 0.00 0.00 56.01 55.26 2a75 n LEU 271 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 2a75 n LEU 271 CO 0.00 0.07 1.02 -0.55 -1.33 0.00 0.00 177.39 176.60 2a75 s SER 272 N -2.36 6.68 0.00 -1.43 0.15 -0.43 -2.54 113.70 113.77 2a75 s SER 272 Ca 0.01 2.76 0.00 0.00 0.70 0.00 0.00 55.95 59.42 2a75 s SER 272 Cb 0.07 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2a75 s SER 272 CO 0.39 -0.62 0.00 1.41 1.20 0.00 0.00 173.24 175.63 2a75 n HIS 273 N 0.86 0.00 -0.02 3.44 8.25 0.48 -4.84 115.22 123.40 2a75 n HIS 273 Ca 0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.34 2a75 n HIS 273 Cb 0.41 -0.78 -0.09 0.00 1.12 0.00 0.00 29.99 30.65 2a75 n HIS 273 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2a75 h VAL 274 N 0.00 1.33 -2.56 1.59 2.07 -1.69 -3.43 116.25 113.57 2a75 h VAL 274 Ca 0.00 -1.01 -0.48 0.00 0.82 0.00 0.00 66.70 66.03 2a75 h VAL 274 Cb 0.12 1.95 -0.00 0.00 -1.52 0.00 0.00 31.29 31.83 2a75 h VAL 274 CO 0.00 0.27 -0.32 0.26 0.02 0.00 0.00 177.57 177.80 2a75 s TRP 275 N -4.54 3.48 0.35 1.57 0.51 -1.26 -1.21 118.94 117.83 2a75 s TRP 275 Ca -0.15 0.20 -0.08 0.00 -2.12 0.00 0.00 56.10 53.95 2a75 s TRP 275 Cb 0.03 -1.75 0.03 0.00 -0.81 0.00 0.00 33.47 30.97 2a75 s TRP 275 CO 0.69 0.31 0.59 -2.37 -0.51 0.00 0.00 176.95 175.65 2a75 n THR 276 N -1.39 0.00 0.86 2.01 5.66 -1.26 -1.20 114.28 118.96 2a75 n THR 276 Ca -0.06 -1.28 0.12 0.00 -3.05 0.00 0.00 64.05 59.77 2a75 n THR 276 Cb 0.56 0.97 0.20 0.00 -1.55 0.00 0.00 70.33 70.51 2a75 n THR 276 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 2a75 n ASN 277 N -1.57 0.56 -3.58 1.09 6.94 -1.26 -4.95 115.26 112.49 2a75 n ASN 277 Ca -0.04 -0.18 0.04 0.00 -0.02 0.00 0.00 54.58 54.38 2a75 n ASN 277 Cb 0.55 0.31 0.00 0.00 -2.36 0.00 0.00 39.78 38.27 2a75 n ASN 277 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2a75 s SER 278 N -3.37 -0.00 0.32 0.53 1.04 -1.26 -4.59 113.70 106.38 2a75 s SER 278 Ca 0.09 -0.00 0.04 0.00 0.48 0.00 0.00 55.95 56.56 2a75 s SER 278 Cb 0.16 0.00 0.64 0.00 0.10 0.00 0.00 66.02 66.92 2a75 s SER 278 CO 0.72 -0.00 1.88 -0.65 0.98 0.00 0.00 173.24 176.16 2a75 h PRO 279 N 2.00 0.87 -0.01 4.02 0.11 -1.83 -2.00 132.00 135.17 2a75 h PRO 279 Ca -0.33 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2a75 h PRO 279 Cb 1.19 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2a75 h PRO 279 CO 0.30 0.58 -0.39 0.25 -0.21 0.00 0.00 178.00 178.52 2a75 n THR 280 N -4.55 0.00 -0.90 -1.15 -2.24 -1.26 -4.69 114.28 99.49 2a75 n THR 280 Ca 0.16 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2a75 n THR 280 Cb 0.34 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 2a75 n THR 280 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2a75 n SER 281 N -0.76 -3.44 -1.32 3.42 7.64 -0.75 -4.85 113.62 113.55 2a75 n SER 281 Ca 0.10 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.94 2a75 n SER 281 Cb 0.36 -2.19 0.23 0.00 -1.01 0.00 0.00 64.21 61.60 2a75 n SER 281 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2a75 n ASN 282 N -0.45 3.29 -4.72 6.43 6.94 -1.26 -2.11 115.26 123.38 2a75 n ASN 282 Ca 0.00 -3.49 -0.24 0.00 -0.02 0.00 0.00 54.58 50.84 2a75 n ASN 282 Cb 0.22 -0.65 -0.07 0.00 -2.36 0.00 0.00 39.78 36.93 2a75 n ASN 282 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2a75 s GLN 283 N -3.11 2.29 0.23 -3.83 -1.52 -1.26 -4.66 119.66 107.80 2a75 s GLN 283 Ca 0.47 -1.66 -0.32 0.00 -1.95 0.00 0.00 55.36 51.90 2a75 s GLN 283 Cb 0.40 -2.09 -0.13 0.00 -0.22 0.00 0.00 33.01 30.97 2a75 s GLN 283 CO 0.05 0.04 1.44 0.94 -0.25 0.00 0.00 175.29 177.51 2a75 n GLN 284 N -1.16 2.07 -1.12 2.91 7.27 -1.26 -0.97 117.38 125.12 2a75 n GLN 284 Ca -0.02 0.74 -0.08 0.00 0.07 0.00 0.00 57.00 57.71 2a75 n GLN 284 Cb 0.62 -2.42 0.04 0.00 2.41 0.00 0.00 30.24 30.90 2a75 n GLN 284 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 2a75 n ASP 285 N 2.35 0.36 -4.05 1.69 2.03 -1.26 -4.79 116.55 112.88 2a75 n ASP 285 Ca 0.12 -1.32 -0.08 0.00 0.52 0.00 0.00 54.79 54.04 2a75 n ASP 285 Cb 0.31 -0.22 -0.10 0.00 -0.72 0.00 0.00 41.12 40.39 2a75 n ASP 285 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2a75 s GLN 287 N -3.42 3.10 0.03 0.00 -0.44 -1.26 -4.81 119.66 112.86 2a75 s GLN 287 Ca 0.02 1.69 0.02 0.00 -2.50 0.00 0.00 55.36 54.59 2a75 s GLN 287 Cb 0.04 -1.96 -0.02 0.00 -1.64 0.00 0.00 33.01 29.43 2a75 s GLN 287 CO -0.08 -1.07 -0.06 -1.12 0.50 0.00 0.00 175.29 173.46 2a75 s SER 288 N -1.77 0.65 0.22 6.67 0.01 -1.26 -4.49 113.70 113.72 2a75 s SER 288 Ca 0.74 -0.40 -0.10 0.00 1.31 0.00 0.00 55.95 57.50 2a75 s SER 288 Cb -0.27 0.02 -0.07 0.00 0.21 0.00 0.00 66.02 65.91 2a75 s SER 288 CO 0.31 -0.14 0.55 -0.94 0.41 0.00 0.00 173.24 173.43 2a75 s SER 289 N -1.11 6.65 -0.26 2.44 1.04 -1.23 -4.81 113.70 116.42 2a75 s SER 289 Ca -0.07 0.95 -0.01 0.00 0.48 0.00 0.00 55.95 57.29 2a75 s SER 289 Cb -0.07 -2.24 0.13 0.00 0.10 0.00 0.00 66.02 63.94 2a75 s SER 289 CO 0.00 -0.05 0.33 0.12 0.98 0.00 0.00 173.24 174.61 2a75 s PHE 290 N -1.78 -0.64 0.00 5.02 5.36 -1.25 -2.11 117.98 122.59 2a75 s PHE 290 Ca 0.46 0.32 0.03 0.00 -0.96 0.00 0.00 56.93 56.78 2a75 s PHE 290 Cb -0.12 -0.23 -0.01 0.00 -0.34 0.00 0.00 43.02 42.32 2a75 s PHE 290 CO 0.21 -0.80 -0.11 0.08 -1.46 0.00 0.00 175.22 173.14 2a75 s VAL 291 N 2.45 0.86 -0.08 3.12 1.01 -0.61 -4.60 120.40 122.54 2a75 s VAL 291 Ca 0.10 -0.56 -0.17 0.00 0.00 0.00 0.00 61.98 61.35 2a75 s VAL 291 Cb -0.14 -0.74 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 2a75 s VAL 291 CO -0.23 0.17 0.45 0.00 0.00 0.00 0.00 175.10 175.50 2a75 s ALA 292 N -0.39 3.54 0.18 5.51 0.00 -1.26 -0.34 121.76 129.01 2a75 s ALA 292 Ca 0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 51.96 51.77 2a75 s ALA 292 Cb -0.05 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 2a75 s ALA 292 CO -0.00 0.15 0.13 0.14 0.00 0.00 0.00 175.76 176.17 2a75 s VAL 293 N 0.10 0.03 -0.22 0.00 -7.23 -0.20 -4.99 120.40 107.90 2a75 s VAL 293 Ca 0.25 -1.92 0.01 0.00 -1.81 0.00 0.00 61.98 58.50 2a75 s VAL 293 Cb -0.16 -2.32 0.03 0.00 0.56 0.00 0.00 36.38 34.50 2a75 s VAL 293 CO 0.11 -0.16 -0.15 -0.89 -0.31 0.00 0.00 175.10 173.71 2a75 s THR 294 N -4.11 2.26 -0.11 5.32 2.01 -1.26 -0.41 115.64 119.34 2a75 s THR 294 Ca 0.33 -1.15 0.03 0.00 0.31 0.00 0.00 61.69 61.21 2a75 s THR 294 Cb 0.07 -2.10 0.01 0.00 0.01 0.00 0.00 72.50 70.48 2a75 s THR 294 CO 0.08 0.31 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.48 2a75 s ILE 295 N 1.24 1.92 -1.49 1.82 1.01 0.00 -4.70 121.20 121.01 2a75 s ILE 295 Ca 0.00 -0.92 -0.12 0.00 0.00 0.00 0.00 60.65 59.61 2a75 s ILE 295 Cb -0.16 -1.68 0.07 0.00 0.01 0.00 0.00 42.46 40.70 2a75 s ILE 295 CO -0.09 0.53 1.01 1.21 0.00 0.00 0.00 174.94 177.60 2a75 n GLU 296 N 3.80 -6.04 -0.92 2.79 4.07 -1.26 -0.98 120.64 122.11 2a75 n GLU 296 Ca -0.20 0.66 0.00 0.00 -0.06 0.00 0.00 57.16 57.56 2a75 n GLU 296 Cb 0.52 -5.59 0.00 0.00 -0.06 0.00 0.00 31.44 26.32 2a75 n GLU 296 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2a75 n GLY 297 N -1.75 0.91 3.37 8.31 0.00 -1.26 -4.95 105.19 109.82 2a75 n GLY 297 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2a75 n GLY 297 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2a75 s LYS 298 N -0.13 2.54 0.05 1.61 2.20 -0.15 -5.10 119.74 120.76 2a75 s LYS 298 Ca 0.00 -0.81 -0.30 0.00 -0.36 0.00 0.00 55.97 54.50 2a75 s LYS 298 Cb 0.00 -2.27 -0.05 0.00 -1.51 0.00 0.00 37.83 34.00 2a75 s LYS 298 CO 0.00 0.49 1.07 0.50 -0.36 0.00 0.00 175.35 177.05 2a75 s ARG 299 N -0.41 4.52 0.17 4.03 6.06 -1.26 -0.82 118.95 131.25 2a75 s ARG 299 Ca 0.04 1.58 -0.03 0.00 -2.50 0.00 0.00 55.73 54.82 2a75 s ARG 299 Cb -0.12 -3.40 -0.03 0.00 0.06 0.00 0.00 34.95 31.46 2a75 s ARG 299 CO 0.02 -0.10 0.16 0.14 -2.50 0.00 0.00 175.30 173.02 2a75 s VAL 300 N 0.85 0.05 -0.05 7.11 -7.23 0.45 -4.77 120.40 116.81 2a75 s VAL 300 Ca 0.54 -1.80 0.04 0.00 -1.81 0.00 0.00 61.98 58.95 2a75 s VAL 300 Cb -0.25 -2.17 -0.02 0.00 0.56 0.00 0.00 36.38 34.50 2a75 s VAL 300 CO 0.29 -0.24 -0.16 -0.04 -0.31 0.00 0.00 175.10 174.64 2a75 s MET 301 N -4.07 2.49 -0.07 4.82 1.00 0.10 -1.04 119.30 122.54 2a75 s MET 301 Ca 0.27 -0.73 0.01 0.00 0.00 0.00 0.00 55.69 55.24 2a75 s MET 301 Cb 0.06 -2.34 -0.03 0.00 0.00 0.00 0.00 34.83 32.52 2a75 s MET 301 CO 0.05 0.59 -0.06 -0.51 0.00 0.00 0.00 175.02 175.10 2a75 s LEU 302 N -0.66 3.22 -0.02 -0.03 1.43 0.54 -0.98 118.68 122.19 2a75 s LEU 302 Ca 0.10 -0.00 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 2a75 s LEU 302 Cb -0.11 -1.71 0.02 0.00 0.03 0.00 0.00 46.19 44.43 2a75 s LEU 302 CO 0.01 0.36 0.02 0.12 0.23 0.00 0.00 176.35 177.09 2a75 s PHE 303 N -0.82 0.06 -0.03 0.29 5.36 -0.64 -1.57 117.98 120.64 2a75 s PHE 303 Ca 0.13 0.09 0.07 0.00 -0.96 0.00 0.00 56.93 56.26 2a75 s PHE 303 Cb -0.11 -0.21 -0.02 0.00 -0.34 0.00 0.00 43.02 42.34 2a75 s PHE 303 CO 0.02 -0.08 -0.25 0.95 -1.46 0.00 0.00 175.22 174.41 2a75 s THR 304 N 0.85 2.17 -0.28 0.12 -4.23 -0.90 -0.93 115.64 112.44 2a75 s THR 304 Ca -0.07 -1.06 -0.24 0.00 -1.18 0.00 0.00 61.69 59.13 2a75 s THR 304 Cb -0.10 -1.76 0.12 0.00 1.34 0.00 0.00 72.50 72.09 2a75 s THR 304 CO -0.02 0.58 0.98 -2.28 -0.54 0.00 0.00 174.62 173.34 2a75 s HIS 305 N -0.59 -0.53 0.54 3.99 5.04 -0.83 -3.53 115.29 119.37 2a75 s HIS 305 Ca 0.09 1.27 -0.19 0.00 -1.54 0.00 0.00 55.06 54.70 2a75 s HIS 305 Cb -0.10 0.36 -0.06 0.00 0.04 0.00 0.00 32.58 32.81 2a75 s HIS 305 CO -0.01 -0.26 1.07 -2.14 -2.34 0.00 0.00 174.74 171.06 2a75 s PRO 306 N 0.35 3.53 0.31 2.88 0.02 -1.26 -1.06 135.00 139.77 2a75 s PRO 306 Ca 0.02 1.37 0.15 0.00 0.02 0.00 0.00 61.00 62.56 2a75 s PRO 306 Cb -0.05 -2.05 0.42 0.00 0.02 0.00 0.00 34.50 32.84 2a75 s PRO 306 CO -0.06 -0.66 1.61 -0.07 -0.33 0.00 0.00 177.00 177.49 2a75 h LEU 307 N 1.10 0.00 -1.28 -5.54 3.38 -0.39 -3.46 115.31 109.13 2a75 h LEU 307 Ca -0.49 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.06 2a75 h LEU 307 Cb 1.23 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.03 2a75 h LEU 307 CO 0.58 0.51 -0.77 -3.20 0.09 0.00 0.00 178.44 175.65 2a75 n ASN 308 N -3.51 -3.67 0.27 -0.43 5.15 -0.51 -4.05 115.26 108.50 2a75 n ASN 308 Ca 0.00 -0.73 0.11 0.00 -0.60 0.00 0.00 54.58 53.36 2a75 n ASN 308 Cb 0.61 -4.30 0.72 0.00 -0.53 0.00 0.00 39.78 36.28 2a75 n ASN 308 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2a75 h LEU 309 N -2.12 0.00 -0.51 1.20 3.38 -1.92 -1.48 115.31 113.87 2a75 h LEU 309 Ca -0.59 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.38 2a75 h LEU 309 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 2a75 h LEU 309 CO 0.60 0.07 0.00 0.11 0.09 0.00 0.00 178.44 179.31 2a75 h LYS 310 N 0.00 0.00 0.00 1.13 1.57 -1.91 -3.49 116.57 113.87 2a75 h LYS 310 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2a75 h LYS 310 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2a75 h LYS 310 CO 0.01 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.30 2a75 n GLY 311 N 0.69 -0.82 7.00 3.86 0.00 -0.56 -4.92 105.19 110.44 2a75 n GLY 311 Ca 0.03 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.36 2a75 n GLY 311 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a75 n ARG 312 N -0.90 0.00 -0.12 1.61 1.74 -1.26 -2.08 116.66 115.65 2a75 n ARG 312 Ca 0.00 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.19 2a75 n ARG 312 Cb 0.00 0.00 0.31 0.00 -1.02 0.00 0.00 32.46 31.75 2a75 n ARG 312 CO 0.00 0.00 0.00 -2.67 -1.52 0.00 0.00 177.63 173.44 2a75 n TRP 313 N 14.00 0.31 -0.18 -1.55 2.14 -1.26 -4.35 117.44 126.55 2a75 n TRP 313 Ca 0.00 -0.15 -0.05 0.00 2.07 0.00 0.00 57.50 59.36 2a75 n TRP 313 Cb 0.00 0.00 0.04 0.00 -0.81 0.00 0.00 31.31 30.54 2a75 n TRP 313 CO 0.00 0.00 0.00 0.52 2.07 0.00 0.00 177.69 180.28 2a75 h MET 314 N 2.85 0.61 -6.24 -2.67 0.00 -1.77 -3.47 114.93 104.25 2a75 h MET 314 Ca 0.00 -0.04 -0.45 0.00 0.00 0.00 0.00 59.70 59.21 2a75 h MET 314 Cb 0.63 -0.14 0.01 0.00 0.00 0.00 0.00 31.60 32.10 2a75 h MET 314 CO 0.00 0.41 -0.85 0.54 0.00 0.00 0.00 176.91 177.01 2a75 n ARG 315 N -4.79 -4.33 -1.58 1.72 1.74 -1.26 -3.42 116.66 104.74 2a75 n ARG 315 Ca 0.04 0.54 -0.31 0.00 -0.77 0.00 0.00 57.85 57.35 2a75 n ARG 315 Cb 0.08 -4.95 0.05 0.00 -1.02 0.00 0.00 32.46 26.62 2a75 n ARG 315 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2a75 s ASP 316 N -4.35 5.39 -0.66 0.55 1.47 -1.26 -1.26 116.67 116.54 2a75 s ASP 316 Ca 0.01 1.63 -0.00 0.00 1.18 0.00 0.00 52.55 55.37 2a75 s ASP 316 Cb -0.01 -2.50 -0.00 0.00 -0.34 0.00 0.00 42.92 40.07 2a75 s ASP 316 CO 0.84 -1.44 0.62 0.54 0.68 0.00 0.00 175.17 176.42 2a75 n ARG 317 N -3.10 -1.21 -2.25 2.11 1.74 -1.24 -1.43 116.66 111.29 2a75 n ARG 317 Ca 0.08 1.33 -0.42 0.00 -0.77 0.00 0.00 57.85 58.06 2a75 n ARG 317 Cb 0.53 -5.23 -0.03 0.00 -1.02 0.00 0.00 32.46 26.72 2a75 n ARG 317 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2a75 s LEU 318 N -3.84 4.31 0.26 0.55 2.96 -1.26 -0.51 118.68 121.15 2a75 s LEU 318 Ca 0.03 2.07 0.10 0.00 -0.22 0.00 0.00 54.13 56.10 2a75 s LEU 318 Cb -0.00 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.08 2a75 s LEU 318 CO 0.65 -0.70 -0.03 -1.00 -1.32 0.00 0.00 176.35 173.95 2a75 s HIS 319 N 2.41 2.65 -0.09 5.38 3.76 -0.22 -0.54 115.29 128.64 2a75 s HIS 319 Ca 0.63 -0.23 0.03 0.00 -0.15 0.00 0.00 55.06 55.34 2a75 s HIS 319 Cb -0.30 -1.18 0.01 0.00 1.11 0.00 0.00 32.58 32.21 2a75 s HIS 319 CO 0.26 0.62 -0.18 -1.17 -0.85 0.00 0.00 174.74 173.42 2a75 s LEU 320 N -3.57 1.87 0.14 0.89 2.96 -0.50 -1.96 118.68 118.51 2a75 s LEU 320 Ca 0.31 -0.44 0.10 0.00 -0.22 0.00 0.00 54.13 53.88 2a75 s LEU 320 Cb -0.06 -1.14 -0.04 0.00 0.50 0.00 0.00 46.19 45.45 2a75 s LEU 320 CO 0.19 0.09 -0.22 0.26 -1.32 0.00 0.00 176.35 175.36 2a75 s TRP 321 N 0.54 2.43 -0.06 5.38 0.51 -0.11 -0.17 118.94 127.46 2a75 s TRP 321 Ca -0.16 -0.32 0.01 0.00 -2.12 0.00 0.00 56.10 53.52 2a75 s TRP 321 Cb -0.17 -1.28 0.02 0.00 -0.81 0.00 0.00 33.47 31.23 2a75 s TRP 321 CO 0.06 0.39 -0.09 1.41 -0.51 0.00 0.00 176.95 178.21 2a75 s MET 322 N -2.22 1.33 0.02 4.98 -2.45 0.07 -1.62 119.30 119.41 2a75 s MET 322 Ca 0.17 -0.27 0.00 0.00 -1.25 0.00 0.00 55.69 54.35 2a75 s MET 322 Cb -0.10 -1.19 -0.02 0.00 1.25 0.00 0.00 34.83 34.77 2a75 s MET 322 CO 0.09 -0.04 -0.03 -0.08 1.05 0.00 0.00 175.02 176.00 2a75 s THR 323 N 0.87 0.18 -0.27 10.11 -1.32 -0.15 -0.85 115.64 124.21 2a75 s THR 323 Ca -0.11 -0.79 0.11 0.00 -1.21 0.00 0.00 61.69 59.68 2a75 s THR 323 Cb -0.15 -0.29 0.56 0.00 -1.51 0.00 0.00 72.50 71.11 2a75 s THR 323 CO 0.01 -0.39 1.53 -0.90 -2.21 0.00 0.00 174.62 172.66 2a75 n ASP 324 N 1.82 3.31 0.00 8.08 3.85 -1.15 0.02 116.55 132.48 2a75 n ASP 324 Ca -0.22 -3.46 0.00 0.00 -0.71 0.00 0.00 54.79 50.41 2a75 n ASP 324 Cb 0.56 -0.64 0.00 0.00 -1.35 0.00 0.00 41.12 39.69 2a75 n ASP 324 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 2a75 n ASN 325 N -0.83 -3.40 0.06 -1.12 4.05 -1.26 -4.71 115.26 108.05 2a75 n ASN 325 Ca 0.33 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.36 2a75 n ASN 325 Cb 1.09 -1.47 0.00 0.00 1.23 0.00 0.00 39.78 40.63 2a75 n ASN 325 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2a75 n GLN 326 N -1.62 0.00 -3.42 1.20 6.02 -1.26 -4.92 117.38 113.37 2a75 n GLN 326 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.70 2a75 n GLN 326 Cb 0.15 -0.16 -0.03 0.00 1.02 0.00 0.00 30.24 31.21 2a75 n GLN 326 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2a75 s ARG 327 N -1.63 3.62 -0.19 -1.09 3.00 -1.26 -4.82 118.95 116.58 2a75 s ARG 327 Ca 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 55.73 55.66 2a75 s ARG 327 Cb 0.00 -2.69 0.06 0.00 0.00 0.00 0.00 34.95 32.32 2a75 s ARG 327 CO 0.00 0.26 0.04 0.42 0.00 0.00 0.00 175.30 176.02 2a75 s ILE 328 N -2.01 0.52 -0.19 1.52 1.01 -1.26 -2.94 121.20 117.85 2a75 s ILE 328 Ca 0.43 -0.56 -0.09 0.00 0.00 0.00 0.00 60.65 60.43 2a75 s ILE 328 Cb -0.11 -1.03 -0.05 0.00 0.01 0.00 0.00 42.46 41.28 2a75 s ILE 328 CO 0.29 -0.21 0.12 0.12 0.00 0.00 0.00 174.94 175.26 2a75 s PHE 329 N 1.86 3.38 -0.52 3.97 5.36 -0.03 -4.82 117.98 127.18 2a75 s PHE 329 Ca -0.01 0.28 -0.22 0.00 -0.96 0.00 0.00 56.93 56.02 2a75 s PHE 329 Cb -0.17 -2.13 0.05 0.00 -0.34 0.00 0.00 43.02 40.42 2a75 s PHE 329 CO -0.08 0.28 0.80 0.34 -1.46 0.00 0.00 175.22 175.10 2a75 s ASP 330 N 0.31 6.30 0.36 6.13 -1.08 -1.26 -0.75 116.67 126.68 2a75 s ASP 330 Ca 0.07 -0.54 0.10 0.00 -0.52 0.00 0.00 52.55 51.66 2a75 s ASP 330 Cb -0.11 -2.38 0.70 0.00 -1.46 0.00 0.00 42.92 39.67 2a75 s ASP 330 CO -0.01 -1.07 1.84 0.58 0.52 0.00 0.00 175.17 177.03 2a75 h VAL 331 N 5.95 1.24 0.00 1.11 2.07 -0.90 -3.49 116.25 122.23 2a75 h VAL 331 Ca -0.26 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.14 2a75 h VAL 331 Cb 1.08 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 2a75 h VAL 331 CO 1.03 0.33 0.00 0.61 0.02 0.00 0.00 177.57 179.56 2a75 n GLY 332 N -0.58 0.88 3.70 2.17 0.00 -1.15 -4.97 105.19 105.23 2a75 n GLY 332 Ca -0.01 -2.03 -0.39 0.00 0.00 0.00 0.00 46.02 43.59 2a75 n GLY 332 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2a75 s GLN 333 N -1.28 4.33 -0.02 1.61 0.74 -1.26 -1.41 119.66 122.37 2a75 s GLN 333 Ca 0.00 0.66 0.21 0.00 0.05 0.00 0.00 55.36 56.28 2a75 s GLN 333 Cb 0.00 -3.49 -0.29 0.00 1.10 0.00 0.00 33.01 30.33 2a75 s GLN 333 CO 0.00 -0.02 0.68 0.44 -0.55 0.00 0.00 175.29 175.84 2a75 n ILE 334 N 4.09 0.00 -1.94 -2.34 -5.35 0.30 -2.30 119.36 111.82 2a75 n ILE 334 Ca -0.03 -0.26 -0.29 0.00 -0.27 0.00 0.00 62.75 61.90 2a75 n ILE 334 Cb 0.51 0.48 0.15 0.00 -1.74 0.00 0.00 39.64 39.03 2a75 n ILE 334 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2a75 s SER 335 N -3.79 3.67 -0.21 7.28 1.04 -1.22 -3.81 113.70 116.65 2a75 s SER 335 Ca -0.00 0.44 -0.05 0.00 0.48 0.00 0.00 55.95 56.82 2a75 s SER 335 Cb 0.15 -0.67 -0.02 0.00 0.10 0.00 0.00 66.02 65.58 2a75 s SER 335 CO 0.89 -2.40 0.01 -0.63 0.98 0.00 0.00 173.24 172.09 2a75 s ILE 336 N -3.75 3.97 0.00 -1.02 1.01 -1.26 -2.60 121.20 117.54 2a75 s ILE 336 Ca 0.69 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 61.04 2a75 s ILE 336 Cb -0.07 -2.81 0.00 0.00 0.01 0.00 0.00 42.46 39.60 2a75 s ILE 336 CO 0.51 0.41 0.00 0.61 0.00 0.00 0.00 174.94 176.47 2a75 n GLY 337 N 4.44 2.99 1.71 6.18 0.00 -1.26 -2.38 105.19 116.87 2a75 n GLY 337 Ca -0.17 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.47 2a75 n GLY 337 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2a75 n ASP 338 N 1.70 3.62 -4.73 1.61 5.75 -1.26 -4.23 116.55 119.00 2a75 n ASP 338 Ca 0.00 -3.52 -0.34 0.00 -0.01 0.00 0.00 54.79 50.92 2a75 n ASP 338 Cb 0.00 -0.72 0.08 0.00 -1.03 0.00 0.00 41.12 39.45 2a75 n ASP 338 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 2a75 s GLU 339 N -3.17 2.30 0.02 0.11 -1.05 -1.00 -4.80 118.70 111.10 2a75 s GLU 339 Ca 0.51 1.66 -0.28 0.00 -0.15 0.00 0.00 54.97 56.71 2a75 s GLU 339 Cb 0.43 -1.86 -0.04 0.00 -0.44 0.00 0.00 34.13 32.22 2a75 s GLU 339 CO 0.08 -1.69 0.90 -0.80 0.95 0.00 0.00 175.26 174.69 2a75 s ASN 340 N -2.18 7.31 0.00 0.83 0.01 -1.26 -3.62 114.94 116.03 2a75 s ASN 340 Ca 0.72 1.57 0.00 0.00 -0.71 0.00 0.00 52.86 54.45 2a75 s ASN 340 Cb -0.27 -2.53 0.00 0.00 0.41 0.00 0.00 41.25 38.86 2a75 s ASN 340 CO 0.44 -0.15 0.00 -1.54 -1.51 0.00 0.00 177.10 174.34 2a75 n SER 341 N 3.48 0.00 0.00 -1.22 3.41 -0.39 -0.95 113.62 117.96 2a75 n SER 341 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 2a75 n SER 341 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 2a75 n SER 341 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2a75 n GLY 342 N 5.00 -0.18 3.75 5.00 0.00 -1.24 -4.27 105.19 113.26 2a75 n GLY 342 Ca 0.00 -0.58 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 2a75 n GLY 342 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2a75 s TYR 343 N -2.26 2.36 0.21 1.61 1.51 -1.26 -4.73 117.35 114.79 2a75 s TYR 343 Ca 0.00 1.53 -0.10 0.00 -1.01 0.00 0.00 57.07 57.49 2a75 s TYR 343 Cb 0.00 -3.45 -0.01 0.00 -0.11 0.00 0.00 41.96 38.39 2a75 s TYR 343 CO 0.00 -2.23 0.37 -1.54 -1.11 0.00 0.00 175.55 171.04 2a75 s SER 344 N -1.74 -0.02 -0.03 2.29 1.04 -1.26 -2.04 113.70 111.93 2a75 s SER 344 Ca 0.76 -0.95 -0.08 0.00 0.48 0.00 0.00 55.95 56.16 2a75 s SER 344 Cb -0.29 0.51 0.01 0.00 0.10 0.00 0.00 66.02 66.35 2a75 s SER 344 CO 0.35 -1.01 0.19 -0.55 0.98 0.00 0.00 173.24 173.20 2a75 s SER 345 N -3.01 -0.10 0.03 7.02 0.15 -0.16 -3.99 113.70 113.63 2a75 s SER 345 Ca 0.22 0.08 0.04 0.00 0.70 0.00 0.00 55.95 56.99 2a75 s SER 345 Cb 0.02 0.31 -0.02 0.00 -1.71 0.00 0.00 66.02 64.61 2a75 s SER 345 CO 0.06 -0.26 -0.13 0.54 1.20 0.00 0.00 173.24 174.64 2a75 s VAL 346 N -0.79 1.02 -0.05 4.45 0.11 -1.26 -1.76 120.40 122.12 2a75 s VAL 346 Ca -0.09 -0.89 -0.04 0.00 -2.93 0.00 0.00 61.98 58.04 2a75 s VAL 346 Cb -0.05 -0.92 0.02 0.00 -1.53 0.00 0.00 36.38 33.90 2a75 s VAL 346 CO 0.01 0.03 0.13 -0.22 -3.33 0.00 0.00 175.10 171.73 2a75 s LEU 347 N -0.98 1.20 -0.22 2.54 2.96 0.02 -4.91 118.68 119.29 2a75 s LEU 347 Ca 0.01 0.27 0.01 0.00 -0.22 0.00 0.00 54.13 54.20 2a75 s LEU 347 Cb -0.07 0.39 0.03 0.00 0.50 0.00 0.00 46.19 47.04 2a75 s LEU 347 CO 0.01 -0.09 -0.14 -0.47 -1.32 0.00 0.00 176.35 174.34 2a75 s TYR 348 N 0.52 3.00 -0.06 5.38 5.04 -1.26 -0.31 117.35 129.66 2a75 s TYR 348 Ca -0.04 -1.85 -0.03 0.00 -2.44 0.00 0.00 57.07 52.72 2a75 s TYR 348 Cb -0.05 -1.95 0.04 0.00 0.35 0.00 0.00 41.96 40.34 2a75 s TYR 348 CO -0.02 -0.81 0.12 0.21 -1.34 0.00 0.00 175.55 173.71 2a75 s LYS 349 N 1.24 0.03 -1.39 4.97 2.20 -0.16 -4.90 119.74 121.72 2a75 s LYS 349 Ca -0.01 0.43 -0.03 0.00 -0.36 0.00 0.00 55.97 56.00 2a75 s LYS 349 Cb -0.16 -0.28 0.02 0.00 -1.51 0.00 0.00 37.83 35.90 2a75 s LYS 349 CO -0.09 -0.25 0.64 -0.25 -0.36 0.00 0.00 175.35 175.05 2a75 n ASP 350 N 4.82 -1.45 -1.97 1.43 8.00 -1.26 -1.67 116.55 124.44 2a75 n ASP 350 Ca -0.14 -0.89 -0.19 0.00 0.71 0.00 0.00 54.79 54.27 2a75 n ASP 350 Cb 0.50 -3.61 -0.03 0.00 -0.02 0.00 0.00 41.12 37.96 2a75 n ASP 350 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2a75 n ASP 351 N -2.98 -5.51 -4.09 -2.24 4.64 -1.26 -5.00 116.55 100.10 2a75 n ASP 351 Ca -0.24 0.15 -0.20 0.00 -1.38 0.00 0.00 54.79 53.13 2a75 n ASP 351 Cb 0.65 -4.61 -0.14 0.00 -1.04 0.00 0.00 41.12 35.98 2a75 n ASP 351 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 2a75 s LYS 352 N -4.52 0.91 -0.08 -0.67 -0.14 -0.67 -5.15 119.74 109.43 2a75 s LYS 352 Ca 0.00 -0.55 -0.00 0.00 -1.36 0.00 0.00 55.97 54.06 2a75 s LYS 352 Cb 0.00 -0.88 -0.03 0.00 -1.68 0.00 0.00 37.83 35.24 2a75 s LYS 352 CO 0.00 0.23 -0.04 -1.17 -0.76 0.00 0.00 175.35 173.61 2a75 s LEU 353 N -0.64 3.33 0.09 3.17 2.96 -1.26 -0.99 118.68 125.34 2a75 s LEU 353 Ca 0.03 0.04 -0.02 0.00 -0.22 0.00 0.00 54.13 53.96 2a75 s LEU 353 Cb -0.06 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 2a75 s LEU 353 CO 0.00 0.37 0.04 -0.31 -1.32 0.00 0.00 176.35 175.13 2a75 s TYR 354 N -0.82 0.60 0.02 5.38 1.51 0.58 -1.13 117.35 123.48 2a75 s TYR 354 Ca 0.12 -1.06 -0.00 0.00 -1.01 0.00 0.00 57.07 55.12 2a75 s TYR 354 Cb -0.11 -0.37 -0.02 0.00 -0.11 0.00 0.00 41.96 41.35 2a75 s TYR 354 CO 0.02 -0.47 -0.03 0.45 -1.11 0.00 0.00 175.55 174.41 2a75 s SER 355 N -2.96 0.22 -0.16 2.29 0.15 -0.53 -0.80 113.70 111.91 2a75 s SER 355 Ca 0.14 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.33 2a75 s SER 355 Cb 0.07 0.09 0.03 0.00 -1.71 0.00 0.00 66.02 64.51 2a75 s SER 355 CO -0.05 -0.28 -0.10 -0.22 1.20 0.00 0.00 173.24 173.79 2a75 s LEU 356 N -1.35 1.76 0.12 3.45 0.20 -0.72 0.15 118.68 122.29 2a75 s LEU 356 Ca -0.15 -0.62 -0.10 0.00 0.69 0.00 0.00 54.13 53.95 2a75 s LEU 356 Cb -0.09 -1.07 0.00 0.00 -0.43 0.00 0.00 46.19 44.60 2a75 s LEU 356 CO -0.01 -0.12 0.27 -1.38 -0.29 0.00 0.00 176.35 174.82 2a75 s HIS 357 N 1.53 0.16 0.49 5.38 -3.43 -0.72 -0.99 115.29 117.72 2a75 s HIS 357 Ca 0.02 -0.55 -0.19 0.00 -0.80 0.00 0.00 55.06 53.54 2a75 s HIS 357 Cb -0.14 0.01 -0.08 0.00 -1.43 0.00 0.00 32.58 30.94 2a75 s HIS 357 CO -0.09 -0.64 1.01 -1.21 -2.00 0.00 0.00 174.74 171.80 2a75 s GLU 358 N -3.89 3.87 -0.01 -0.38 2.02 -0.87 -0.55 118.70 118.89 2a75 s GLU 358 Ca 0.09 1.19 0.02 0.00 0.02 0.00 0.00 54.97 56.29 2a75 s GLU 358 Cb 0.04 -2.12 -0.00 0.00 0.10 0.00 0.00 34.13 32.15 2a75 s GLU 358 CO -0.07 -0.35 -0.07 0.96 0.02 0.00 0.00 175.26 175.75 2a75 s ILE 359 N -2.24 0.53 -0.08 -1.63 -4.36 -0.84 -3.68 121.20 108.90 2a75 s ILE 359 Ca 0.64 -0.28 -0.01 0.00 -0.26 0.00 0.00 60.65 60.74 2a75 s ILE 359 Cb -0.13 -0.45 0.03 0.00 1.25 0.00 0.00 42.46 43.15 2a75 s ILE 359 CO 0.23 0.15 -0.03 0.21 0.24 0.00 0.00 174.94 175.74 2a75 s ASN 360 N -0.12 1.64 -0.12 4.36 3.04 -0.12 -2.00 114.94 121.62 2a75 s ASN 360 Ca 0.02 -0.16 -0.01 0.00 0.04 0.00 0.00 52.86 52.76 2a75 s ASN 360 Cb -0.03 -0.56 0.03 0.00 -1.54 0.00 0.00 41.25 39.15 2a75 s ASN 360 CO -0.00 -0.14 -0.07 -0.89 -3.04 0.00 0.00 177.10 172.96 2a75 s THR 361 N 1.68 0.99 -1.45 -5.21 2.01 -1.00 -4.10 115.64 108.56 2a75 s THR 361 Ca 0.02 -0.30 -0.04 0.00 0.31 0.00 0.00 61.69 61.67 2a75 s THR 361 Cb -0.13 -1.04 0.02 0.00 0.01 0.00 0.00 72.50 71.36 2a75 s THR 361 CO -0.05 0.34 0.40 0.59 -0.69 0.00 0.00 174.62 175.21 2a75 n ASN 362 N 4.95 -5.17 -3.59 3.53 3.02 -1.26 -1.75 115.26 114.99 2a75 n ASN 362 Ca -0.12 -0.20 -0.24 0.00 -0.03 0.00 0.00 54.58 53.98 2a75 n ASN 362 Cb 0.50 -4.24 0.07 0.00 -0.61 0.00 0.00 39.78 35.50 2a75 n ASN 362 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2a75 n ASP 363 N -2.29 -6.30 -4.06 6.41 8.00 -1.26 -4.99 116.55 112.05 2a75 n ASP 363 Ca -0.11 -0.54 -0.30 0.00 0.71 0.00 0.00 54.79 54.54 2a75 n ASP 363 Cb 0.61 -4.97 -0.16 0.00 -0.02 0.00 0.00 41.12 36.58 2a75 n ASP 363 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2a75 s VAL 364 N -3.31 1.66 -0.11 2.53 1.01 -0.72 -4.58 120.40 116.89 2a75 s VAL 364 Ca 0.58 -0.72 -0.02 0.00 0.00 0.00 0.00 61.98 61.83 2a75 s VAL 364 Cb -0.26 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 2a75 s VAL 364 CO 0.72 0.47 -0.03 -0.31 0.00 0.00 0.00 175.10 175.95 2a75 s TYR 365 N 1.21 3.04 0.37 5.22 1.51 -1.26 -2.36 117.35 125.08 2a75 s TYR 365 Ca -0.01 -0.03 0.08 0.00 -1.01 0.00 0.00 57.07 56.11 2a75 s TYR 365 Cb -0.14 -1.83 -0.06 0.00 -0.11 0.00 0.00 41.96 39.82 2a75 s TYR 365 CO -0.07 0.25 0.03 -1.12 -1.11 0.00 0.00 175.55 173.53 2a75 s SER 366 N -0.40 4.09 -0.16 2.29 0.01 -0.85 -1.29 113.70 117.39 2a75 s SER 366 Ca 0.07 -1.13 0.02 0.00 1.31 0.00 0.00 55.95 56.22 2a75 s SER 366 Cb -0.12 -0.46 0.01 0.00 0.21 0.00 0.00 66.02 65.66 2a75 s SER 366 CO 0.02 -0.34 -0.21 -0.76 0.41 0.00 0.00 173.24 172.36 2a75 s LEU 367 N -3.74 2.12 0.06 2.44 1.43 -0.18 -1.99 118.68 118.83 2a75 s LEU 367 Ca 0.36 -0.62 -0.03 0.00 -1.03 0.00 0.00 54.13 52.81 2a75 s LEU 367 Cb 0.03 -1.46 -0.05 0.00 0.03 0.00 0.00 46.19 44.75 2a75 s LEU 367 CO 0.19 0.05 0.27 0.68 0.23 0.00 0.00 176.35 177.77 2a75 s VAL 368 N 1.00 5.31 -0.29 -1.59 -7.23 0.28 -1.68 120.40 116.20 2a75 s VAL 368 Ca -0.02 -0.13 -0.05 0.00 -1.81 0.00 0.00 61.98 59.97 2a75 s VAL 368 Cb -0.15 -3.60 0.02 0.00 0.56 0.00 0.00 36.38 33.21 2a75 s VAL 368 CO -0.06 0.18 0.04 0.12 -0.31 0.00 0.00 175.10 175.07 2a75 s PHE 369 N -1.49 3.14 -0.12 2.82 5.36 0.32 -1.75 117.98 126.27 2a75 s PHE 369 Ca 0.34 -1.23 -0.03 0.00 -0.96 0.00 0.00 56.93 55.05 2a75 s PHE 369 Cb -0.13 -2.20 -0.03 0.00 -0.34 0.00 0.00 43.02 40.33 2a75 s PHE 369 CO 0.23 -0.65 -0.03 0.08 -1.46 0.00 0.00 175.22 173.40 2a75 s VAL 370 N 1.43 3.98 -0.49 3.12 1.01 0.12 -1.56 120.40 128.02 2a75 s VAL 370 Ca 0.01 -0.35 -0.15 0.00 0.00 0.00 0.00 61.98 61.49 2a75 s VAL 370 Cb -0.17 -2.71 0.09 0.00 0.00 0.00 0.00 36.38 33.58 2a75 s VAL 370 CO 0.00 0.54 0.42 -0.13 0.00 0.00 0.00 175.10 175.93 2a75 s ARG 371 N -0.15 2.97 -1.41 2.72 0.52 -0.00 -1.45 118.95 122.16 2a75 s ARG 371 Ca 0.03 -1.43 -0.12 0.00 -0.52 0.00 0.00 55.73 53.69 2a75 s ARG 371 Cb -0.13 -4.16 0.07 0.00 0.52 0.00 0.00 34.95 31.25 2a75 s ARG 371 CO 0.02 -1.09 2.19 1.28 0.02 0.00 0.00 175.30 177.72 2a75 n LEU 372 N 5.21 7.03 0.01 2.53 4.77 -0.29 -3.02 117.00 133.24 2a75 n LEU 372 Ca -0.13 -4.37 -0.10 0.00 -0.03 0.00 0.00 56.01 51.38 2a75 n LEU 372 Cb 0.43 -1.58 -0.08 0.00 -2.33 0.00 0.00 43.42 39.86 2a75 n LEU 372 CO 0.49 1.34 0.37 0.40 -1.33 0.00 0.00 177.39 178.65 2a75 h ILE 373 N 3.75 0.99 -0.60 -0.08 2.04 -1.82 -2.15 117.51 119.64 2a75 h ILE 373 Ca 0.55 -1.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 2a75 h ILE 373 Cb 0.59 1.73 -0.03 0.00 -0.74 0.00 0.00 36.82 38.37 2a75 h ILE 373 CO 1.77 0.28 0.27 1.23 0.00 0.00 0.00 178.15 181.71 2a75 h GLY 374 N -0.88 0.92 0.96 5.37 0.00 -1.79 -2.64 103.07 105.01 2a75 h GLY 374 Ca -0.01 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 46.82 2a75 h GLY 374 CO 0.02 0.42 0.09 0.83 0.00 0.00 0.00 176.54 177.90 2a75 h GLU 375 N 0.85 0.74 -0.49 4.80 3.07 -1.88 -2.74 114.58 118.94 2a75 h GLU 375 Ca 0.21 -0.19 -0.04 0.00 -0.50 0.00 0.00 59.36 58.83 2a75 h GLU 375 Cb 0.12 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 2a75 h GLU 375 CO -0.02 0.75 0.13 1.25 -1.40 0.00 0.00 179.01 179.72 2a75 h LEU 376 N 0.61 0.68 -0.41 1.33 5.85 -1.16 -0.84 115.31 121.36 2a75 h LEU 376 Ca 0.14 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2a75 h LEU 376 Cb 0.36 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 2a75 h LEU 376 CO 0.01 0.66 0.22 -0.61 -0.34 0.00 0.00 178.44 178.38 2a75 h GLN 377 N 0.71 0.58 -0.40 1.25 4.15 -1.33 -0.10 115.11 119.98 2a75 h GLN 377 Ca 0.16 -0.07 -0.04 0.00 0.77 0.00 0.00 58.65 59.47 2a75 h GLN 377 Cb 0.25 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 2a75 h GLN 377 CO -0.00 0.47 0.08 1.25 -1.93 0.00 0.00 178.83 178.70 2a75 h LEU 378 N 0.53 0.62 -0.42 -2.39 5.85 -1.18 -2.02 115.31 116.31 2a75 h LEU 378 Ca 0.14 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.67 2a75 h LEU 378 Cb 0.07 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 2a75 h LEU 378 CO -0.02 0.70 0.17 0.24 -0.34 0.00 0.00 178.44 179.19 2a75 h MET 379 N 0.51 0.34 -0.86 1.25 2.86 -0.83 -0.77 114.93 117.43 2a75 h MET 379 Ca 0.12 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 2a75 h MET 379 Cb 0.33 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.88 2a75 h MET 379 CO 0.00 0.23 0.48 0.87 1.06 0.00 0.00 176.91 179.56 2a75 h LYS 380 N 0.35 1.19 -0.28 1.72 1.57 -0.89 0.41 116.57 120.64 2a75 h LYS 380 Ca 0.19 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2a75 h LYS 380 Cb 0.14 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2a75 h LYS 380 CO -0.17 0.86 0.17 1.03 -0.57 0.00 0.00 179.45 180.77 2a75 h SER 381 N 1.20 0.34 -0.39 0.86 0.87 -0.69 -0.30 113.55 115.44 2a75 h SER 381 Ca 0.30 -0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.79 2a75 h SER 381 Cb 0.01 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 61.86 2a75 h SER 381 CO -0.05 0.29 0.15 0.58 -0.53 0.00 0.00 176.83 177.27 2a75 h VAL 382 N 0.36 1.19 -0.69 2.23 2.07 -0.78 -0.21 116.25 120.42 2a75 h VAL 382 Ca 0.10 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 2a75 h VAL 382 Cb 0.01 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2a75 h VAL 382 CO -0.02 0.22 0.35 0.58 0.02 0.00 0.00 177.57 178.72 2a75 h VAL 383 N 0.48 1.22 -0.60 2.57 2.07 -0.68 -0.36 116.25 120.94 2a75 h VAL 383 Ca 0.13 -0.58 -0.06 0.00 0.82 0.00 0.00 66.70 67.01 2a75 h VAL 383 Cb 0.19 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 2a75 h VAL 383 CO -0.01 0.25 0.12 0.03 0.02 0.00 0.00 177.57 177.97 2a75 h ARG 384 N 0.97 0.96 -0.30 1.57 3.08 -0.55 -0.74 114.38 119.38 2a75 h ARG 384 Ca 0.24 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2a75 h ARG 384 Cb 0.07 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 2a75 h ARG 384 CO -0.03 0.87 0.17 1.15 -1.07 0.00 0.00 179.97 181.06 2a75 h THR 385 N 0.91 1.11 -0.04 2.04 2.02 -0.00 -0.57 112.91 118.38 2a75 h THR 385 Ca 0.19 -0.27 0.01 0.00 0.77 0.00 0.00 66.41 67.11 2a75 h THR 385 Cb 0.37 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 2a75 h THR 385 CO 0.01 0.11 -0.02 -0.50 0.37 0.00 0.00 175.52 175.49 2a75 h TRP 386 N 0.37 -0.04 -0.04 3.16 6.55 -0.66 -0.99 115.95 124.31 2a75 h TRP 386 Ca 0.11 0.00 -0.00 0.00 0.95 0.00 0.00 58.89 59.95 2a75 h TRP 386 Cb 0.02 0.02 -0.00 0.00 -0.86 0.00 0.00 29.16 28.35 2a75 h TRP 386 CO -0.04 -0.03 0.02 0.87 -1.05 0.00 0.00 178.44 178.21 2a75 h LYS 387 N -0.01 0.05 -0.73 0.49 1.57 -1.07 -1.21 116.57 115.67 2a75 h LYS 387 Ca 0.02 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.83 2a75 h LYS 387 Cb 0.05 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.30 2a75 h LYS 387 CO -0.05 0.09 0.46 0.93 -0.57 0.00 0.00 179.45 180.31 2a75 h GLU 388 N -0.01 0.87 -0.19 3.15 5.08 -0.94 0.12 114.58 122.66 2a75 h GLU 388 Ca 0.01 -0.05 -0.21 0.00 -1.00 0.00 0.00 59.36 58.11 2a75 h GLU 388 Cb 0.06 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.12 2a75 h GLU 388 CO -0.00 0.57 -0.72 1.49 -1.00 0.00 0.00 179.01 179.35 2a75 h GLU 389 N 0.89 0.81 -0.38 2.33 4.57 -1.14 -1.77 114.58 119.89 2a75 h GLU 389 Ca 0.29 -0.62 -0.02 0.00 -1.18 0.00 0.00 59.36 57.83 2a75 h GLU 389 Cb 0.02 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 2a75 h GLU 389 CO -0.11 1.23 0.16 -0.44 -1.18 0.00 0.00 179.01 178.67 2a75 h ASP 390 N 0.57 0.52 -0.71 1.04 3.32 -0.98 -0.96 116.42 119.22 2a75 h ASP 390 Ca -0.04 -0.16 -0.06 0.00 0.02 0.00 0.00 57.03 56.79 2a75 h ASP 390 Cb 1.34 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.73 2a75 h ASP 390 CO 0.15 0.54 0.20 0.78 -1.72 0.00 0.00 179.24 179.19 2a75 h ASN 391 N 0.47 1.07 0.27 6.45 2.35 -0.80 -0.76 115.58 124.62 2a75 h ASN 391 Ca 0.13 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 2a75 h ASN 391 Cb 0.18 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.27 2a75 h ASN 391 CO -0.01 1.01 -0.13 -0.74 -1.65 0.00 0.00 177.43 175.91 2a75 h HIS 392 N 1.08 -0.33 -0.24 1.19 -0.00 -1.10 -1.86 115.15 113.89 2a75 h HIS 392 Ca 0.23 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.60 2a75 h HIS 392 Cb 0.34 0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.85 2a75 h HIS 392 CO 0.03 -0.13 0.15 -0.07 -0.00 0.00 0.00 177.93 177.90 2a75 h LEU 393 N -0.46 0.25 -1.81 0.26 3.38 -1.09 -2.19 115.31 113.66 2a75 h LEU 393 Ca -0.04 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2a75 h LEU 393 Cb 0.35 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2a75 h LEU 393 CO 0.06 0.18 0.00 0.00 0.09 0.00 0.00 178.44 178.77 2a75 h ALA 394 N 1.10 1.00 -0.01 1.53 0.00 -1.09 -2.20 119.26 119.59 2a75 h ALA 394 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2a75 h ALA 394 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2a75 h ALA 394 CO -0.03 0.00 -0.50 0.43 0.00 0.00 0.00 179.25 179.15 2a75 n SER 395 N -2.67 1.19 -4.75 0.00 7.64 -0.70 -4.74 113.62 109.59 2a75 n SER 395 Ca -0.01 -0.95 -0.41 0.00 1.01 0.00 0.00 58.87 58.50 2a75 n SER 395 Cb 0.13 0.41 -0.02 0.00 -1.01 0.00 0.00 64.21 63.72 2a75 n SER 395 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2a75 s ILE 396 N -2.69 2.34 -0.58 0.44 1.01 -0.83 -4.94 121.20 115.96 2a75 s ILE 396 Ca 0.17 0.29 -0.20 0.00 0.00 0.00 0.00 60.65 60.92 2a75 s ILE 396 Cb 0.18 -3.19 0.09 0.00 0.01 0.00 0.00 42.46 39.55 2a75 s ILE 396 CO 0.63 0.05 0.74 0.00 0.00 0.00 0.00 174.94 176.36 2a75 s THR 398 N 2.93 3.88 0.45 0.00 -4.23 -1.26 -4.86 115.64 112.55 2a75 s THR 398 Ca 0.14 0.54 -0.25 0.00 -1.18 0.00 0.00 61.69 60.95 2a75 s THR 398 Cb -0.22 -3.60 -0.08 0.00 1.34 0.00 0.00 72.50 69.95 2a75 s THR 398 CO 0.08 -0.77 1.36 -2.84 -0.54 0.00 0.00 174.62 171.92 2a75 s PRO 399 N -5.26 3.69 0.63 3.99 0.02 -1.26 -0.52 135.00 136.29 2a75 s PRO 399 Ca 0.57 2.26 -0.17 0.00 0.02 0.00 0.00 61.00 63.68 2a75 s PRO 399 Cb -0.11 -2.60 -0.01 0.00 0.02 0.00 0.00 34.50 31.79 2a75 s PRO 399 CO 0.52 -0.76 1.15 0.14 -0.33 0.00 0.00 177.00 177.72 2a75 s VAL 400 N -1.26 2.91 0.28 3.83 -7.23 -1.26 -3.56 120.40 114.11 2a75 s VAL 400 Ca 0.62 0.49 0.10 0.00 -1.81 0.00 0.00 61.98 61.38 2a75 s VAL 400 Cb -0.40 -3.09 -0.05 0.00 0.56 0.00 0.00 36.38 33.40 2a75 s VAL 400 CO 0.51 -0.20 -0.16 0.68 -0.31 0.00 0.00 175.10 175.63 2a75 s VAL 401 N -1.97 2.25 0.64 1.32 -7.23 -1.26 -4.93 120.40 109.21 2a75 s VAL 401 Ca 0.72 -2.31 0.19 0.00 -1.81 0.00 0.00 61.98 58.77 2a75 s VAL 401 Cb -0.25 -2.36 0.24 0.00 0.56 0.00 0.00 36.38 34.57 2a75 s VAL 401 CO 0.37 -0.37 1.46 -0.65 -0.31 0.00 0.00 175.10 175.60 2a75 h PRO 402 N 2.25 0.00 -1.88 4.82 0.11 -2.06 -2.12 132.00 133.12 2a75 h PRO 402 Ca -0.40 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.17 2a75 h PRO 402 Cb 1.25 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.95 2a75 h PRO 402 CO 0.63 0.00 -0.84 0.00 -0.21 0.00 0.00 178.00 177.58 2a75 n ALA 403 N -1.94 4.10 -3.13 -0.75 0.00 -1.26 -5.07 120.51 112.47 2a75 n ALA 403 Ca 0.07 -4.16 -0.08 0.00 0.00 0.00 0.00 53.44 49.27 2a75 n ALA 403 Cb 0.93 -0.75 0.02 0.00 0.00 0.00 0.00 19.45 19.65 2a75 n ALA 403 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2a75 n THR 404 N -0.18 0.00 0.00 0.00 -1.04 -0.80 -5.13 114.28 107.13 2a75 n THR 404 Ca 0.29 -0.63 0.00 0.00 -2.04 0.00 0.00 64.05 61.67 2a75 n THR 404 Cb 0.56 -0.75 0.00 0.00 -1.82 0.00 0.00 70.33 68.32 2a75 n THR 404 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2a75 n PRO 405 N -1.31 0.00 0.00 -2.82 -0.04 -1.26 -5.04 135.00 124.53 2a75 n PRO 405 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2a75 n PRO 405 Cb 0.19 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.65 2a75 n PRO 405 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2a75 n LYS 408 N 0.00 0.00 -0.75 0.54 4.81 -1.26 -4.93 118.16 116.57 2a75 n LYS 408 Ca 0.00 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.48 2a75 n LYS 408 Cb 0.00 0.00 0.32 0.00 0.02 0.00 0.00 35.03 35.37 2a75 n LYS 408 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2a75 n GLY 409 N -1.28 2.80 2.26 3.14 0.00 -1.26 -4.85 105.19 106.00 2a75 n GLY 409 Ca 0.00 -0.76 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 2a75 n GLY 409 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a75 n GLY 410 N 0.43 0.34 3.51 -0.02 0.00 -1.26 -5.05 105.19 103.15 2a75 n GLY 410 Ca 0.24 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 2a75 n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 n GLY 412 N 0.75 -0.55 3.73 0.00 0.00 0.32 -4.79 105.19 104.65 2a75 n GLY 412 Ca -0.15 -1.68 -0.35 0.00 0.00 0.00 0.00 46.02 43.85 2a75 n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 s ALA 413 N -3.80 2.22 0.53 4.61 0.00 -1.26 -4.55 121.76 119.51 2a75 s ALA 413 Ca 0.00 0.90 -0.20 0.00 0.00 0.00 0.00 51.96 52.65 2a75 s ALA 413 Cb 0.00 -3.46 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 2a75 s ALA 413 CO 0.00 -1.71 1.16 0.00 0.00 0.00 0.00 175.76 175.21 2a75 s ALA 414 N -1.91 2.76 0.24 0.00 0.00 -1.26 -4.54 121.76 117.05 2a75 s ALA 414 Ca 0.75 0.91 -0.31 0.00 0.00 0.00 0.00 51.96 53.31 2a75 s ALA 414 Cb -0.29 -3.39 -0.11 0.00 0.00 0.00 0.00 23.12 19.32 2a75 s ALA 414 CO 0.43 -0.83 1.65 0.08 0.00 0.00 0.00 175.76 177.09 2a75 s VAL 415 N -1.65 2.13 0.17 0.00 1.01 -1.26 -4.91 120.40 115.89 2a75 s VAL 415 Ca 0.71 0.10 -0.31 0.00 0.00 0.00 0.00 61.98 62.47 2a75 s VAL 415 Cb -0.27 -3.06 -0.09 0.00 0.00 0.00 0.00 36.38 32.96 2a75 s VAL 415 CO 0.31 0.01 1.42 -2.16 0.00 0.00 0.00 175.10 174.68 2a75 s PRO 416 N 0.46 4.30 0.00 2.72 0.04 -1.26 -4.51 135.00 136.75 2a75 s PRO 416 Ca 0.69 2.17 0.00 0.00 0.04 0.00 0.00 61.00 63.90 2a75 s PRO 416 Cb -0.48 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 30.87 2a75 s PRO 416 CO 0.39 -0.43 0.00 0.25 0.04 0.00 0.00 177.00 177.24 2a75 n THR 417 N 3.40 0.00 -2.34 1.26 -2.24 -1.26 -4.83 114.28 108.26 2a75 n THR 417 Ca 0.10 -0.19 -0.42 0.00 -2.27 0.00 0.00 64.05 61.27 2a75 n THR 417 Cb 0.41 0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 69.30 2a75 n THR 417 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2a75 s ALA 418 N -1.38 3.51 0.00 6.98 0.00 -1.26 -2.11 121.76 127.50 2a75 s ALA 418 Ca 0.00 0.80 0.00 0.00 0.00 0.00 0.00 51.96 52.76 2a75 s ALA 418 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2a75 s ALA 418 CO 0.00 -0.74 0.00 0.41 0.00 0.00 0.00 175.76 175.43 2a75 n GLY 419 N 3.45 0.76 3.61 0.00 0.00 -1.26 -4.93 105.19 106.81 2a75 n GLY 419 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2a75 n GLY 419 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2a75 s LEU 420 N 0.00 3.69 -0.23 0.99 0.20 -0.90 -1.10 118.68 121.34 2a75 s LEU 420 Ca 0.00 1.02 -0.06 0.00 0.69 0.00 0.00 54.13 55.78 2a75 s LEU 420 Cb 0.00 -3.54 -0.18 0.00 -0.43 0.00 0.00 46.19 42.04 2a75 s LEU 420 CO 0.00 -1.33 -0.08 0.52 -0.29 0.00 0.00 176.35 175.18 2a75 n VAL 421 N 6.78 1.57 -3.97 1.68 0.31 0.77 -4.76 118.33 120.72 2a75 n VAL 421 Ca 0.16 -0.49 -0.08 0.00 -0.01 0.00 0.00 64.34 63.92 2a75 n VAL 421 Cb 0.47 -1.67 -0.08 0.00 -0.91 0.00 0.00 33.84 31.65 2a75 n VAL 421 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2a75 s GLY 422 N -5.89 0.34 -0.25 2.92 0.00 -1.09 -4.69 107.32 98.66 2a75 s GLY 422 Ca -0.32 -0.91 -0.09 0.00 0.00 0.00 0.00 44.72 43.39 2a75 s GLY 422 CO 0.61 -1.02 0.54 -0.12 0.00 0.00 0.00 173.10 173.11 2a75 s PHE 423 N -3.91 -1.05 -0.27 1.90 5.99 -1.26 -1.55 117.98 117.83 2a75 s PHE 423 Ca 0.09 1.91 -0.07 0.00 0.00 0.00 0.00 56.93 58.86 2a75 s PHE 423 Cb 0.06 0.55 -0.02 0.00 0.00 0.00 0.00 43.02 43.61 2a75 s PHE 423 CO -0.08 -0.56 0.08 -0.51 -0.00 0.00 0.00 175.22 174.14 2a75 s LEU 424 N 2.64 3.60 0.00 6.12 1.43 -0.32 0.61 118.68 132.75 2a75 s LEU 424 Ca -0.04 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 52.68 2a75 s LEU 424 Cb -0.11 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.19 2a75 s LEU 424 CO -0.16 -0.09 0.00 -0.24 0.23 0.00 0.00 176.35 176.09 2a75 n SER 425 N 4.91 0.00 0.05 2.29 2.88 -1.26 -1.00 113.62 121.49 2a75 n SER 425 Ca -0.16 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.26 2a75 n SER 425 Cb 0.50 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.87 2a75 n SER 425 CO 0.00 0.00 0.00 -0.74 -1.23 0.00 0.00 175.04 173.07 2a75 h HIS 426 N 0.00 -0.15 -2.18 0.66 2.76 -1.90 -3.03 115.15 111.31 2a75 h HIS 426 Ca 0.00 -0.00 -0.58 0.00 -2.20 0.00 0.00 60.37 57.58 2a75 h HIS 426 Cb 0.00 0.05 0.03 0.00 1.55 0.00 0.00 27.41 29.03 2a75 h HIS 426 CO 0.00 0.24 1.10 0.45 -1.30 0.00 0.00 177.93 178.41 2a75 n SER 427 N -4.98 3.63 -3.58 3.26 2.88 -1.26 -4.52 113.62 109.07 2a75 n SER 427 Ca -0.09 0.97 -0.05 0.00 -1.33 0.00 0.00 58.87 58.37 2a75 n SER 427 Cb 0.24 -1.43 -0.02 0.00 -0.75 0.00 0.00 64.21 62.25 2a75 n SER 427 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2a75 s ALA 428 N 3.64 -2.01 0.00 -1.46 0.00 -1.26 -2.29 121.76 118.39 2a75 s ALA 428 Ca 0.89 1.38 0.00 0.00 0.00 0.00 0.00 51.96 54.23 2a75 s ALA 428 Cb -0.61 0.06 0.00 0.00 0.00 0.00 0.00 23.12 22.57 2a75 s ALA 428 CO 0.46 -0.65 0.00 0.27 0.00 0.00 0.00 175.76 175.84 2a75 n ASN 429 N -0.16 0.00 0.04 0.00 0.23 -0.64 -5.01 115.26 109.73 2a75 n ASN 429 Ca -0.02 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.14 2a75 n ASN 429 Cb 0.59 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 38.37 2a75 n ASN 429 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2a75 n GLY 430 N 2.68 -1.30 0.01 4.83 0.00 -1.26 -4.48 105.19 105.67 2a75 n GLY 430 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2a75 n GLY 430 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2a75 n SER 431 N -2.07 4.46 -4.02 1.61 2.88 -1.26 -4.42 113.62 110.80 2a75 n SER 431 Ca 0.02 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.34 2a75 n SER 431 Cb 0.45 0.85 -0.16 0.00 -0.75 0.00 0.00 64.21 64.60 2a75 n SER 431 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2a75 s VAL 432 N -2.11 0.97 -0.31 2.46 1.01 -1.26 -1.04 120.40 120.12 2a75 s VAL 432 Ca -0.01 -0.43 -0.08 0.00 0.00 0.00 0.00 61.98 61.46 2a75 s VAL 432 Cb 0.01 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.53 2a75 s VAL 432 CO 0.09 0.30 0.11 0.86 0.00 0.00 0.00 175.10 176.47 2a75 s TRP 433 N 0.36 3.17 0.24 5.22 -0.11 -0.07 -1.61 118.94 126.14 2a75 s TRP 433 Ca -0.07 -0.84 -0.30 0.00 1.22 0.00 0.00 56.10 56.11 2a75 s TRP 433 Cb -0.12 -2.30 -0.09 0.00 -1.50 0.00 0.00 33.47 29.46 2a75 s TRP 433 CO 0.02 -0.54 1.03 -1.21 -4.62 0.00 0.00 176.95 171.62 2a75 s GLU 434 N 1.54 4.73 -0.09 5.86 2.02 -0.97 -1.45 118.70 130.34 2a75 s GLU 434 Ca 0.03 1.65 -0.30 0.00 0.02 0.00 0.00 54.97 56.38 2a75 s GLU 434 Cb -0.17 -3.24 -0.03 0.00 0.10 0.00 0.00 34.13 30.79 2a75 s GLU 434 CO 0.04 0.32 1.23 0.34 0.02 0.00 0.00 175.26 177.21 2a75 s ASP 435 N -0.88 7.01 0.54 -0.19 2.15 -1.26 -4.23 116.67 119.80 2a75 s ASP 435 Ca 0.44 1.78 0.20 0.00 0.43 0.00 0.00 52.55 55.40 2a75 s ASP 435 Cb -0.29 -2.55 1.40 0.00 -0.30 0.00 0.00 42.92 41.18 2a75 s ASP 435 CO 0.36 -0.65 2.14 0.58 -0.17 0.00 0.00 175.17 177.44 2a75 h VAL 436 N 5.18 0.85 -0.19 1.11 2.07 -0.21 0.77 116.25 125.84 2a75 h VAL 436 Ca -0.32 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.20 2a75 h VAL 436 Cb 1.14 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 2a75 h VAL 436 CO 0.91 0.00 0.00 -1.22 0.02 0.00 0.00 177.57 177.28 2a75 n TYR 437 N -4.36 0.24 -1.79 1.57 4.02 -1.26 -4.92 117.16 110.66 2a75 n TYR 437 Ca -0.01 -0.12 -0.18 0.00 -0.01 0.00 0.00 57.90 57.57 2a75 n TYR 437 Cb 0.17 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.43 2a75 n TYR 437 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2a75 n ARG 438 N 0.22 -1.34 -0.07 -0.72 1.74 0.26 -4.90 116.66 111.86 2a75 n ARG 438 Ca 0.14 1.07 -0.11 0.00 -0.77 0.00 0.00 57.85 58.18 2a75 n ARG 438 Cb 0.28 -5.43 -0.04 0.00 -1.02 0.00 0.00 32.46 26.25 2a75 n ARG 438 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2a75 s VAL 440 N -2.55 1.46 0.70 0.00 1.01 -1.26 -4.90 120.40 114.86 2a75 s VAL 440 Ca -0.23 -1.47 -0.11 0.00 0.00 0.00 0.00 61.98 60.17 2a75 s VAL 440 Cb 0.05 -1.91 0.01 0.00 0.00 0.00 0.00 36.38 34.54 2a75 s VAL 440 CO 0.32 -0.37 1.09 -1.81 0.00 0.00 0.00 175.10 174.33 2a75 s ASP 441 N 1.38 5.53 0.02 3.32 1.01 -1.26 -4.33 116.67 122.34 2a75 s ASP 441 Ca 0.02 1.20 0.01 0.00 0.71 0.00 0.00 52.55 54.48 2a75 s ASP 441 Cb -0.18 -2.03 -0.04 0.00 1.01 0.00 0.00 42.92 41.67 2a75 s ASP 441 CO -0.12 -1.30 0.08 0.00 0.21 0.00 0.00 175.17 174.05 2a75 s ALA 442 N -3.31 3.59 -0.04 5.23 0.00 -0.53 -4.54 121.76 122.15 2a75 s ALA 442 Ca 0.58 -0.91 -0.15 0.00 0.00 0.00 0.00 51.96 51.48 2a75 s ALA 442 Cb -0.11 -1.54 -0.05 0.00 0.00 0.00 0.00 23.12 21.41 2a75 s ALA 442 CO 0.52 0.71 0.39 -0.80 0.00 0.00 0.00 175.76 176.59 2a75 s ASN 443 N -1.96 6.73 0.13 0.00 0.01 0.12 -0.89 114.94 119.09 2a75 s ASN 443 Ca 0.25 0.87 0.11 0.00 -0.71 0.00 0.00 52.86 53.37 2a75 s ASN 443 Cb -0.12 -2.24 -0.04 0.00 0.41 0.00 0.00 41.25 39.26 2a75 s ASN 443 CO 0.17 0.26 -0.26 -0.69 -1.51 0.00 0.00 177.10 175.07 2a75 s VAL 444 N -0.67 2.18 -0.01 1.60 1.01 -0.20 -0.74 120.40 123.57 2a75 s VAL 444 Ca 0.23 -1.75 -0.06 0.00 0.00 0.00 0.00 61.98 60.40 2a75 s VAL 444 Cb -0.16 -1.94 0.00 0.00 0.00 0.00 0.00 36.38 34.28 2a75 s VAL 444 CO 0.11 0.05 0.11 0.00 0.00 0.00 0.00 175.10 175.38 2a75 s ALA 445 N -1.12 -0.27 -1.26 5.51 0.00 -0.68 -4.53 121.76 119.40 2a75 s ALA 445 Ca 0.13 -0.09 -0.29 0.00 0.00 0.00 0.00 51.96 51.71 2a75 s ALA 445 Cb -0.10 0.05 0.04 0.00 0.00 0.00 0.00 23.12 23.11 2a75 s ALA 445 CO 0.06 -0.17 0.59 0.09 0.00 0.00 0.00 175.76 176.33 2a75 n ASN 446 N 1.78 -3.44 -4.28 0.00 3.02 -1.26 -1.81 115.26 109.27 2a75 n ASN 446 Ca -0.21 -1.29 -0.18 0.00 -0.03 0.00 0.00 54.58 52.87 2a75 n ASN 446 Cb 0.56 -1.75 -0.11 0.00 -0.61 0.00 0.00 39.78 37.88 2a75 n ASN 446 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2a75 s ALA 447 N -3.65 1.69 -0.02 5.41 0.00 -1.26 -1.41 121.76 122.53 2a75 s ALA 447 Ca 0.42 -1.44 0.03 0.00 0.00 0.00 0.00 51.96 50.97 2a75 s ALA 447 Cb -0.23 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 22.81 2a75 s ALA 447 CO 0.97 0.09 -0.10 -2.00 0.00 0.00 0.00 175.76 174.72 2a75 s GLU 448 N -3.07 0.88 0.36 0.00 2.12 -0.12 -4.94 118.70 113.93 2a75 s GLU 448 Ca 0.14 -0.33 -0.27 0.00 0.36 0.00 0.00 54.97 54.87 2a75 s GLU 448 Cb -0.03 -0.84 -0.09 0.00 0.26 0.00 0.00 34.13 33.43 2a75 s GLU 448 CO 0.04 0.17 1.17 1.03 -0.54 0.00 0.00 175.26 177.13 2a75 s ARG 449 N -0.04 4.26 0.12 4.30 0.52 -1.26 -0.80 118.95 126.05 2a75 s ARG 449 Ca 0.01 1.89 -0.01 0.00 -0.52 0.00 0.00 55.73 57.10 2a75 s ARG 449 Cb -0.06 -2.87 -0.04 0.00 0.52 0.00 0.00 34.95 32.50 2a75 s ARG 449 CO -0.00 -0.16 0.05 0.14 0.02 0.00 0.00 175.30 175.35 2a75 s VAL 450 N -1.31 0.12 0.12 3.52 -7.23 -0.74 -4.82 120.40 110.06 2a75 s VAL 450 Ca 0.52 -1.90 -0.34 0.00 -1.81 0.00 0.00 61.98 58.45 2a75 s VAL 450 Cb -0.32 -1.98 -0.14 0.00 0.56 0.00 0.00 36.38 34.50 2a75 s VAL 450 CO 0.42 -0.53 1.61 -2.65 -0.31 0.00 0.00 175.10 173.63 2a75 n PRO 451 N -0.07 2.11 -1.35 4.82 -0.02 -1.26 -1.96 135.00 137.27 2a75 n PRO 451 Ca -0.06 0.76 -0.12 0.00 -2.02 0.00 0.00 63.50 62.06 2a75 n PRO 451 Cb 0.63 -2.54 -0.05 0.00 -0.02 0.00 0.00 33.50 31.53 2a75 n PRO 451 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2a75 n ASN 452 N 3.80 -5.12 0.00 2.55 3.02 -1.26 -4.85 115.26 113.40 2a75 n ASN 452 Ca 0.18 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 55.02 2a75 n ASN 452 Cb 0.28 -3.67 0.00 0.00 -0.61 0.00 0.00 39.78 35.78 2a75 n ASN 452 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2a75 n GLY 453 N -0.62 -0.67 2.98 7.41 0.00 -0.83 -1.60 105.19 111.87 2a75 n GLY 453 Ca -0.12 -0.50 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 2a75 n GLY 453 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a75 s LEU 454 N 0.00 2.14 -0.16 0.99 1.43 -0.26 -1.79 118.68 121.03 2a75 s LEU 454 Ca 0.00 -0.32 -0.04 0.00 -1.03 0.00 0.00 54.13 52.75 2a75 s LEU 454 Cb 0.00 -0.11 -0.03 0.00 0.03 0.00 0.00 46.19 46.09 2a75 s LEU 454 CO 0.00 -0.12 -0.04 -0.75 0.23 0.00 0.00 176.35 175.68 2a75 s LYS 455 N -0.87 3.64 -0.12 1.70 2.20 0.02 -0.71 119.74 125.60 2a75 s LYS 455 Ca -0.06 -0.53 -0.09 0.00 -0.36 0.00 0.00 55.97 54.93 2a75 s LYS 455 Cb -0.06 -2.93 -0.04 0.00 -1.51 0.00 0.00 37.83 33.29 2a75 s LYS 455 CO -0.00 0.19 0.18 -0.06 -0.36 0.00 0.00 175.35 175.30 2a75 s PHE 456 N 0.49 3.58 -0.28 4.03 0.40 0.01 -0.94 117.98 125.27 2a75 s PHE 456 Ca -0.03 0.56 -0.03 0.00 -0.60 0.00 0.00 56.93 56.83 2a75 s PHE 456 Cb -0.14 -2.03 0.17 0.00 0.51 0.00 0.00 43.02 41.52 2a75 s PHE 456 CO 0.03 0.65 0.55 1.21 0.70 0.00 0.00 175.22 178.35 2a75 s ASN 457 N -0.79 -0.94 0.00 1.36 3.84 -0.50 -3.97 114.94 113.95 2a75 s ASN 457 Ca 0.15 0.81 0.00 0.00 0.21 0.00 0.00 52.86 54.03 2a75 s ASN 457 Cb -0.12 1.91 0.00 0.00 -0.55 0.00 0.00 41.25 42.48 2a75 s ASN 457 CO 0.04 -0.26 0.00 0.61 -2.79 0.00 0.00 177.10 174.70 2a75 n GLY 458 N 5.42 3.44 3.70 1.21 0.00 -1.26 -4.66 105.19 113.04 2a75 n GLY 458 Ca -0.03 -1.73 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 2a75 n GLY 458 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a75 s VAL 459 N -2.04 2.82 -0.94 1.61 1.01 -1.26 -1.42 120.40 120.17 2a75 s VAL 459 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.39 2a75 s VAL 459 Cb 0.00 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 33.12 2a75 s VAL 459 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.72 2a75 n GLY 460 N 3.95 1.03 3.70 4.51 0.00 0.11 -4.81 105.19 113.68 2a75 n GLY 460 Ca 0.15 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2a75 n GLY 460 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2a75 s GLY 461 N -2.67 1.32 0.00 -0.02 0.00 -0.51 -4.05 107.32 101.39 2a75 s GLY 461 Ca 0.00 1.48 0.00 0.00 0.00 0.00 0.00 44.72 46.20 2a75 s GLY 461 CO 0.00 3.06 0.00 0.61 0.00 0.00 0.00 173.10 176.77 2a75 n GLY 462 N 4.15 -0.80 2.99 0.20 0.00 -0.75 -1.95 105.19 109.04 2a75 n GLY 462 Ca 0.17 -1.40 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 2a75 n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 s ALA 463 N -1.01 0.39 -0.22 4.61 0.00 0.87 -1.69 121.76 124.71 2a75 s ALA 463 Ca 0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 2a75 s ALA 463 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.12 2a75 s ALA 463 CO 0.00 0.00 -0.06 0.08 0.00 0.00 0.00 175.76 175.78 2a75 s VAL 464 N -0.81 3.16 -0.50 0.00 1.01 0.08 -0.69 120.40 122.65 2a75 s VAL 464 Ca -0.06 -0.62 -0.09 0.00 0.00 0.00 0.00 61.98 61.21 2a75 s VAL 464 Cb -0.06 -2.45 0.13 0.00 0.00 0.00 0.00 36.38 33.99 2a75 s VAL 464 CO -0.00 0.40 0.37 0.86 0.00 0.00 0.00 175.10 176.73 2a75 s TRP 465 N 1.44 3.44 0.31 5.22 -0.11 -0.53 -0.70 118.94 128.01 2a75 s TRP 465 Ca 0.05 -1.93 -0.30 0.00 1.22 0.00 0.00 56.10 55.15 2a75 s TRP 465 Cb -0.14 -3.50 -0.12 0.00 -1.50 0.00 0.00 33.47 28.21 2a75 s TRP 465 CO -0.05 -0.99 1.54 -0.35 -4.62 0.00 0.00 176.95 172.49 2a75 n PRO 466 N 4.79 2.62 0.00 5.86 -0.04 -1.26 -1.16 135.00 145.80 2a75 n PRO 466 Ca -0.06 0.93 0.00 0.00 -0.04 0.00 0.00 63.50 64.33 2a75 n PRO 466 Cb 0.41 -2.68 0.00 0.00 -0.04 0.00 0.00 33.50 31.19 2a75 n PRO 466 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2a75 n VAL 467 N 1.65 0.00 0.25 0.52 0.31 -0.36 -4.57 118.33 116.13 2a75 n VAL 467 Ca 0.07 0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.52 2a75 n VAL 467 Cb 0.37 -0.03 0.75 0.00 -0.91 0.00 0.00 33.84 34.02 2a75 n VAL 467 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2a75 h ALA 468 N 0.56 1.85 0.00 3.52 0.00 -0.70 -0.68 119.26 123.80 2a75 h ALA 468 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2a75 h ALA 468 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2a75 h ALA 468 CO 0.00 -0.06 0.00 0.54 0.00 0.00 0.00 179.25 179.73 2a75 n ARG 469 N -4.24 0.35 0.20 0.00 1.74 -0.71 -1.35 116.66 112.65 2a75 n ARG 469 Ca -0.02 0.03 0.15 0.00 -0.77 0.00 0.00 57.85 57.24 2a75 n ARG 469 Cb 0.13 -1.50 0.56 0.00 -1.02 0.00 0.00 32.46 30.63 2a75 n ARG 469 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2a75 h GLN 470 N 0.00 0.00 0.00 5.56 4.20 -1.36 -3.48 115.11 120.03 2a75 h GLN 470 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2a75 h GLN 470 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 2a75 h GLN 470 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 2a75 n GLY 471 N 0.16 1.28 0.13 3.46 0.00 -0.46 -4.50 105.19 105.26 2a75 n GLY 471 Ca 0.02 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 45.02 2a75 n GLY 471 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2a75 h GLN 472 N 0.00 -0.22 -4.81 1.61 4.15 -1.88 -3.41 115.11 110.56 2a75 h GLN 472 Ca 0.00 0.01 -0.67 0.00 0.77 0.00 0.00 58.65 58.76 2a75 h GLN 472 Cb 0.00 0.05 -0.18 0.00 0.21 0.00 0.00 27.48 27.56 2a75 h GLN 472 CO 0.00 0.18 -0.38 0.99 -1.93 0.00 0.00 178.83 177.69 2a75 s THR 473 N -4.18 5.22 -0.89 2.39 2.01 -1.26 -4.57 115.64 114.36 2a75 s THR 473 Ca -0.14 -0.14 -0.10 0.00 0.31 0.00 0.00 61.69 61.61 2a75 s THR 473 Cb 0.02 -3.79 0.23 0.00 0.01 0.00 0.00 72.50 68.96 2a75 s THR 473 CO 0.56 -0.09 0.83 -0.13 -0.69 0.00 0.00 174.62 175.11 2a75 s ARG 474 N 1.87 3.63 0.32 4.92 0.52 -0.35 -4.79 118.95 125.07 2a75 s ARG 474 Ca 0.09 -2.75 0.26 0.00 -0.52 0.00 0.00 55.73 52.80 2a75 s ARG 474 Cb -0.17 -4.35 1.07 0.00 0.52 0.00 0.00 34.95 32.01 2a75 s ARG 474 CO 0.11 -1.26 1.77 0.00 0.02 0.00 0.00 175.30 175.94 2a75 h ARG 475 N 7.24 0.00 -0.37 3.54 3.08 -1.86 -2.49 114.38 123.51 2a75 h ARG 475 Ca 0.12 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.09 2a75 h ARG 475 Cb 0.97 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.97 2a75 h ARG 475 CO 0.83 0.00 0.03 0.66 -1.07 0.00 0.00 179.97 180.42 2a75 n TYR 476 N -2.42 1.27 0.09 3.04 0.53 -1.26 -4.62 117.16 113.79 2a75 n TYR 476 Ca 0.02 -1.08 0.17 0.00 -1.02 0.00 0.00 57.90 55.98 2a75 n TYR 476 Cb 0.25 -0.42 0.68 0.00 -1.03 0.00 0.00 39.34 38.82 2a75 n TYR 476 CO 0.00 0.00 0.00 0.37 -1.02 0.00 0.00 176.86 176.21 2a75 h GLN 477 N 1.85 0.00 -0.46 -0.72 5.75 -1.78 -1.39 115.11 118.36 2a75 h GLN 477 Ca 0.09 0.00 0.13 0.00 -0.15 0.00 0.00 58.65 58.73 2a75 h GLN 477 Cb 1.66 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 30.20 2a75 h GLN 477 CO 0.36 0.00 0.36 0.27 -2.65 0.00 0.00 178.83 177.17 2a75 h PHE 478 N 0.00 0.00 -0.04 3.99 -0.00 -1.81 -2.56 116.94 116.53 2a75 h PHE 478 Ca 0.17 0.00 0.01 0.00 -0.00 0.00 0.00 57.97 58.15 2a75 h PHE 478 Cb 0.69 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.64 2a75 h PHE 478 CO 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 178.31 178.35 2a75 h ALA 479 N 1.71 1.63 0.00 12.09 0.00 -1.38 0.97 119.26 134.27 2a75 h ALA 479 Ca 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2a75 h ALA 479 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2a75 h ALA 479 CO -0.00 -0.06 0.00 -0.91 0.00 0.00 0.00 179.25 178.28 2a75 h ASN 480 N 0.00 0.00 0.00 0.00 2.35 -1.67 -3.17 115.58 113.10 2a75 h ASN 480 Ca 0.02 0.00 -0.38 0.00 -0.55 0.00 0.00 56.30 55.38 2a75 h ASN 480 Cb 0.09 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.40 2a75 h ASN 480 CO -0.00 0.00 -2.38 0.00 -1.65 0.00 0.00 177.43 173.40 2a75 n TYR 481 N -2.50 0.00 -3.57 1.19 9.36 0.25 -4.30 117.16 117.58 2a75 n TYR 481 Ca 0.01 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.13 2a75 n TYR 481 Cb 0.23 -0.92 -0.05 0.00 -0.63 0.00 0.00 39.34 37.97 2a75 n TYR 481 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 2a75 s ARG 482 N -2.47 0.60 -0.00 2.98 1.70 -0.68 -4.20 118.95 116.87 2a75 s ARG 482 Ca -0.33 0.09 -0.29 0.00 -0.47 0.00 0.00 55.73 54.73 2a75 s ARG 482 Cb 0.10 0.28 0.10 0.00 -0.57 0.00 0.00 34.95 34.86 2a75 s ARG 482 CO 0.51 -0.20 1.00 -0.59 -1.08 0.00 0.00 175.30 174.94 2a75 s PHE 483 N -1.33 -0.23 -0.06 5.89 -0.12 0.61 -3.99 117.98 118.74 2a75 s PHE 483 Ca -0.01 0.08 0.01 0.00 -0.05 0.00 0.00 56.93 56.97 2a75 s PHE 483 Cb -0.01 0.56 0.02 0.00 -0.63 0.00 0.00 43.02 42.96 2a75 s PHE 483 CO 0.00 -0.52 -0.09 0.99 -0.05 0.00 0.00 175.22 175.55 2a75 s THR 484 N -2.97 0.93 -0.11 -4.49 2.01 -0.85 -1.21 115.64 108.95 2a75 s THR 484 Ca 0.08 -0.34 0.03 0.00 0.31 0.00 0.00 61.69 61.77 2a75 s THR 484 Cb -0.01 -0.89 -0.00 0.00 0.01 0.00 0.00 72.50 71.61 2a75 s THR 484 CO -0.05 0.32 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.76 2a75 s LEU 485 N 0.89 2.27 0.07 4.42 2.96 -0.42 -0.83 118.68 128.04 2a75 s LEU 485 Ca -0.11 -0.49 0.07 0.00 -0.22 0.00 0.00 54.13 53.38 2a75 s LEU 485 Cb -0.15 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.05 2a75 s LEU 485 CO 0.01 0.16 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.33 2a75 s VAL 486 N 0.32 1.46 0.02 1.68 1.01 0.27 -0.55 120.40 124.61 2a75 s VAL 486 Ca -0.16 -1.31 -0.28 0.00 0.00 0.00 0.00 61.98 60.24 2a75 s VAL 486 Cb -0.17 -1.32 0.09 0.00 0.00 0.00 0.00 36.38 34.97 2a75 s VAL 486 CO 0.08 -0.02 0.78 0.00 0.00 0.00 0.00 175.10 175.94 2a75 s ALA 487 N -1.04 -1.76 -0.15 5.51 0.00 -0.43 -0.38 121.76 123.50 2a75 s ALA 487 Ca 0.04 0.98 -0.05 0.00 0.00 0.00 0.00 51.96 52.92 2a75 s ALA 487 Cb -0.09 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 2a75 s ALA 487 CO 0.03 -0.61 0.02 0.99 0.00 0.00 0.00 175.76 176.19 2a75 s THR 488 N -2.75 4.45 0.10 0.00 2.01 -0.63 -0.57 115.64 118.25 2a75 s THR 488 Ca 0.00 -0.17 0.03 0.00 0.31 0.00 0.00 61.69 61.87 2a75 s THR 488 Cb -0.01 -2.96 -0.04 0.00 0.01 0.00 0.00 72.50 69.50 2a75 s THR 488 CO -0.06 0.50 -0.09 0.68 -0.69 0.00 0.00 174.62 174.97 2a75 s VAL 489 N 0.07 0.84 -0.01 3.82 -7.23 -0.19 -0.94 120.40 116.77 2a75 s VAL 489 Ca 0.03 -1.75 0.01 0.00 -1.81 0.00 0.00 61.98 58.46 2a75 s VAL 489 Cb -0.13 -1.48 0.00 0.00 0.56 0.00 0.00 36.38 35.34 2a75 s VAL 489 CO 0.02 -0.69 -0.03 0.42 -0.31 0.00 0.00 175.10 174.51 2a75 s THR 490 N -2.90 0.28 -0.24 5.32 -4.23 -0.36 -1.05 115.64 112.45 2a75 s THR 490 Ca 0.08 -0.13 -0.17 0.00 -1.18 0.00 0.00 61.69 60.30 2a75 s THR 490 Cb 0.00 -0.26 -0.03 0.00 1.34 0.00 0.00 72.50 73.55 2a75 s THR 490 CO -0.02 0.09 0.45 -0.63 -0.54 0.00 0.00 174.62 173.97 2a75 s ILE 491 N 0.07 5.13 -0.08 2.99 -1.09 -1.26 -1.09 121.20 125.88 2a75 s ILE 491 Ca -0.00 0.76 0.06 0.00 -2.23 0.00 0.00 60.65 59.24 2a75 s ILE 491 Cb -0.03 -3.77 -0.24 0.00 -1.58 0.00 0.00 42.46 36.84 2a75 s ILE 491 CO -0.00 0.16 0.53 0.47 -1.23 0.00 0.00 174.94 174.87 2a75 n ASP 492 N 5.11 1.29 -3.81 3.58 8.00 0.24 -0.57 116.55 130.39 2a75 n ASP 492 Ca -0.06 0.32 -0.12 0.00 0.71 0.00 0.00 54.79 55.64 2a75 n ASP 492 Cb 0.50 -0.31 -0.11 0.00 -0.02 0.00 0.00 41.12 41.19 2a75 n ASP 492 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2a75 s GLU 493 N -2.58 0.36 0.39 -1.24 2.02 -1.15 -4.76 118.70 111.75 2a75 s GLU 493 Ca -0.11 0.09 -0.27 0.00 0.02 0.00 0.00 54.97 54.70 2a75 s GLU 493 Cb 0.07 0.17 -0.09 0.00 0.10 0.00 0.00 34.13 34.38 2a75 s GLU 493 CO 0.80 -0.07 1.36 -0.51 0.02 0.00 0.00 175.26 176.87 2a75 s LEU 494 N -0.40 4.26 0.64 1.80 1.43 -1.26 -4.62 118.68 120.54 2a75 s LEU 494 Ca -0.05 2.79 -0.11 0.00 -1.03 0.00 0.00 54.13 55.73 2a75 s LEU 494 Cb -0.03 -3.81 -0.02 0.00 0.03 0.00 0.00 46.19 42.36 2a75 s LEU 494 CO 0.01 -0.85 1.04 -2.16 0.23 0.00 0.00 176.35 174.62 2a75 s PRO 495 N -2.16 3.32 0.07 1.29 0.04 -1.26 -4.99 135.00 131.31 2a75 s PRO 495 Ca 0.55 0.60 -0.17 0.00 0.04 0.00 0.00 61.00 62.03 2a75 s PRO 495 Cb -0.41 -2.08 -0.11 0.00 0.04 0.00 0.00 34.50 31.94 2a75 s PRO 495 CO 0.54 -0.72 1.38 -0.22 0.04 0.00 0.00 177.00 178.01 2a75 h LYS 496 N -0.41 0.57 0.00 4.56 3.64 -1.96 -3.37 116.57 119.59 2a75 h LYS 496 Ca -0.44 -0.31 0.00 0.00 -1.27 0.00 0.00 60.65 58.63 2a75 h LYS 496 Cb 1.21 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2a75 h LYS 496 CO 0.63 0.90 0.00 0.41 -2.27 0.00 0.00 179.45 179.12 2a75 n GLY 497 N 0.21 1.31 3.37 5.01 0.00 -1.26 -4.71 105.19 109.12 2a75 n GLY 497 Ca -0.05 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 2a75 n GLY 497 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a75 s THR 498 N 0.68 2.19 0.00 2.61 2.01 -1.26 -0.91 115.64 120.96 2a75 s THR 498 Ca 0.00 -1.65 -0.10 0.00 0.31 0.00 0.00 61.69 60.25 2a75 s THR 498 Cb 0.00 -1.92 0.01 0.00 0.01 0.00 0.00 72.50 70.60 2a75 s THR 498 CO 0.00 0.15 0.20 -0.55 -0.69 0.00 0.00 174.62 173.72 2a75 s SER 499 N -1.85 -0.04 0.46 3.53 0.15 -0.49 -4.98 113.70 110.48 2a75 s SER 499 Ca 0.13 -0.14 -0.22 0.00 0.70 0.00 0.00 55.95 56.43 2a75 s SER 499 Cb -0.10 0.25 -0.09 0.00 -1.71 0.00 0.00 66.02 64.37 2a75 s SER 499 CO 0.05 -0.42 1.05 -2.84 1.20 0.00 0.00 173.24 172.28 2a75 s PRO 500 N -1.50 3.91 0.00 5.44 0.02 -1.26 -1.43 135.00 140.18 2a75 s PRO 500 Ca -0.13 1.43 0.00 0.00 0.02 0.00 0.00 61.00 62.32 2a75 s PRO 500 Cb -0.06 -2.25 0.00 0.00 0.02 0.00 0.00 34.50 32.20 2a75 s PRO 500 CO 0.02 -0.35 0.00 -0.11 -0.33 0.00 0.00 177.00 176.23 2a75 n LEU 501 N -0.65 0.40 -3.63 -5.54 7.94 -0.46 -4.13 117.00 110.93 2a75 n LEU 501 Ca 0.08 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.86 2a75 n LEU 501 Cb 0.51 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.39 2a75 n LEU 501 CO 0.42 -0.08 0.50 -0.22 -1.11 0.00 0.00 177.39 176.90 2a75 s LEU 502 N -5.34 -0.69 0.00 -1.96 2.96 -1.01 -0.14 118.68 112.51 2a75 s LEU 502 Ca 0.00 1.29 0.00 0.00 -0.22 0.00 0.00 54.13 55.20 2a75 s LEU 502 Cb 0.00 2.29 0.00 0.00 0.50 0.00 0.00 46.19 48.98 2a75 s LEU 502 CO 0.00 -0.22 0.00 0.61 -1.32 0.00 0.00 176.35 175.42 2a75 n GLY 503 N 2.76 -1.46 3.10 7.98 0.00 -0.86 0.15 105.19 116.86 2a75 n GLY 503 Ca -0.14 -1.02 -0.33 0.00 0.00 0.00 0.00 46.02 44.54 2a75 n GLY 503 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 s ALA 504 N -1.47 2.43 0.41 4.61 0.00 0.14 -0.77 121.76 127.11 2a75 s ALA 504 Ca 0.00 -1.45 -0.11 0.00 0.00 0.00 0.00 51.96 50.40 2a75 s ALA 504 Cb 0.00 -1.35 -0.07 0.00 0.00 0.00 0.00 23.12 21.70 2a75 s ALA 504 CO 0.00 -0.71 0.78 0.20 0.00 0.00 0.00 175.76 176.03 2a75 s GLY 505 N 1.21 1.96 -0.01 0.00 0.00 0.44 -0.75 107.32 110.16 2a75 s GLY 505 Ca -0.01 -0.17 0.01 0.00 0.00 0.00 0.00 44.72 44.55 2a75 s GLY 505 CO -0.10 0.02 -0.01 1.08 0.00 0.00 0.00 173.10 174.10 2a75 s LEU 506 N -3.85 3.47 0.52 0.66 1.43 -0.73 -1.10 118.68 119.08 2a75 s LEU 506 Ca 0.52 -0.02 -0.21 0.00 -1.03 0.00 0.00 54.13 53.39 2a75 s LEU 506 Cb -0.10 -1.98 -0.06 0.00 0.03 0.00 0.00 46.19 44.08 2a75 s LEU 506 CO 0.31 0.29 1.23 -1.61 0.23 0.00 0.00 176.35 176.80 2a75 s GLU 507 N -1.50 3.35 0.00 1.70 0.41 -0.52 -4.67 118.70 117.47 2a75 s GLU 507 Ca 0.19 1.91 0.00 0.00 -0.41 0.00 0.00 54.97 56.66 2a75 s GLU 507 Cb -0.11 -2.21 0.00 0.00 -1.78 0.00 0.00 34.13 30.02 2a75 s GLU 507 CO 0.09 -0.92 0.00 0.41 -0.49 0.00 0.00 175.26 174.35 2a75 n GLY 508 N 0.53 2.76 3.68 -1.39 0.00 -1.26 -4.97 105.19 104.53 2a75 n GLY 508 Ca 0.10 -2.07 -0.31 0.00 0.00 0.00 0.00 46.02 43.75 2a75 n GLY 508 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2a75 s PRO 509 N -2.43 1.09 2.01 1.61 0.04 -1.26 -4.68 135.00 131.38 2a75 s PRO 509 Ca 0.00 1.49 0.00 0.00 0.04 0.00 0.00 61.00 62.53 2a75 s PRO 509 Cb 0.00 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.80 2a75 s PRO 509 CO 0.00 -2.56 0.00 0.41 0.04 0.00 0.00 177.00 174.89 2a75 n GLY 510 N 0.06 -1.46 2.25 0.56 0.00 -1.26 -4.41 105.19 100.93 2a75 n GLY 510 Ca 0.11 -1.30 -0.17 0.00 0.00 0.00 0.00 46.02 44.66 2a75 n GLY 510 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2a75 n ASP 511 N -0.05 0.60 -4.77 1.61 -0.08 -1.26 -5.11 116.55 107.49 2a75 n ASP 511 Ca 0.00 -3.05 -0.38 0.00 -1.51 0.00 0.00 54.79 49.85 2a75 n ASP 511 Cb 0.00 -0.42 -0.01 0.00 2.34 0.00 0.00 41.12 43.03 2a75 n ASP 511 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2a75 s ALA 512 N -2.24 3.03 0.12 -1.67 0.00 -1.26 -4.96 121.76 114.77 2a75 s ALA 512 Ca 0.38 0.99 0.11 0.00 0.00 0.00 0.00 51.96 53.44 2a75 s ALA 512 Cb 0.35 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 2a75 s ALA 512 CO -0.07 -0.68 -0.27 0.15 0.00 0.00 0.00 175.76 174.89 2a75 s LYS 513 N -2.58 1.45 -0.16 0.00 -0.14 -1.26 -1.78 119.74 115.27 2a75 s LYS 513 Ca 0.62 -1.32 -0.26 0.00 -1.36 0.00 0.00 55.97 53.65 2a75 s LYS 513 Cb -0.30 -1.91 -0.24 0.00 -1.68 0.00 0.00 37.83 33.69 2a75 s LYS 513 CO 0.37 0.46 0.59 1.25 -0.76 0.00 0.00 175.35 177.26 2a75 h LEU 514 N 3.98 0.03 -7.11 3.17 5.85 -1.24 -3.37 115.31 116.64 2a75 h LEU 514 Ca -0.50 -0.84 -0.07 0.00 0.84 0.00 0.00 57.88 57.31 2a75 h LEU 514 Cb 1.17 -0.01 -0.21 0.00 0.37 0.00 0.00 40.66 41.97 2a75 h LEU 514 CO 0.40 1.19 0.03 -0.22 -0.34 0.00 0.00 178.44 179.50 2a75 s LEU 515 N -8.07 -0.36 0.00 2.25 2.96 -1.24 -0.60 118.68 113.62 2a75 s LEU 515 Ca -0.22 1.10 -0.26 0.00 -0.22 0.00 0.00 54.13 54.53 2a75 s LEU 515 Cb 0.00 2.16 0.08 0.00 0.50 0.00 0.00 46.19 48.93 2a75 s LEU 515 CO 0.67 -0.29 1.17 0.61 -1.32 0.00 0.00 176.35 177.18 2a75 n GLY 516 N 2.36 0.23 2.80 7.98 0.00 -0.76 -0.68 105.19 117.12 2a75 n GLY 516 Ca -0.15 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.71 2a75 n GLY 516 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2a75 s LEU 517 N 0.00 1.32 0.46 0.99 2.96 0.12 0.11 118.68 124.65 2a75 s LEU 517 Ca 0.28 0.02 0.03 0.00 -0.22 0.00 0.00 54.13 54.24 2a75 s LEU 517 Cb -0.01 -0.06 -0.02 0.00 0.50 0.00 0.00 46.19 46.60 2a75 s LEU 517 CO -0.01 -0.09 0.06 -0.44 -1.32 0.00 0.00 176.35 174.54 2a75 s SER 518 N 0.79 3.51 0.04 3.68 0.01 0.06 -1.36 113.70 120.44 2a75 s SER 518 Ca -0.07 -1.63 -0.05 0.00 1.31 0.00 0.00 55.95 55.51 2a75 s SER 518 Cb -0.10 0.43 -0.01 0.00 0.21 0.00 0.00 66.02 66.55 2a75 s SER 518 CO -0.02 -0.85 0.09 -0.72 0.41 0.00 0.00 173.24 172.15 2a75 s TYR 519 N -3.02 0.23 0.41 2.43 -0.85 -0.51 -0.51 117.35 115.54 2a75 s TYR 519 Ca 0.16 -0.57 0.03 0.00 -0.52 0.00 0.00 57.07 56.18 2a75 s TYR 519 Cb 0.03 -0.16 -0.03 0.00 0.38 0.00 0.00 41.96 42.18 2a75 s TYR 519 CO 0.09 -0.37 0.09 0.16 -1.52 0.00 0.00 175.55 174.00 2a75 s ASP 520 N -2.24 2.99 0.30 -0.18 1.47 -0.61 -1.39 116.67 117.00 2a75 s ASP 520 Ca -0.03 -1.62 0.24 0.00 1.18 0.00 0.00 52.55 52.31 2a75 s ASP 520 Cb -0.00 0.40 1.08 0.00 -0.34 0.00 0.00 42.92 44.06 2a75 s ASP 520 CO -0.05 -0.86 1.71 2.29 0.68 0.00 0.00 175.17 178.94 2a75 n LYS 521 N -0.94 0.19 -0.16 2.11 2.85 -0.08 -1.22 118.16 120.90 2a75 n LYS 521 Ca -0.08 0.51 0.08 0.00 -1.05 0.00 0.00 58.31 57.77 2a75 n LYS 521 Cb 0.66 -1.93 0.25 0.00 -0.65 0.00 0.00 35.03 33.36 2a75 n LYS 521 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2a75 n ASN 522 N -2.29 2.06 -2.69 -5.58 3.02 -1.26 -4.91 115.26 103.61 2a75 n ASN 522 Ca 0.01 -1.90 -0.19 0.00 -0.03 0.00 0.00 54.58 52.47 2a75 n ASN 522 Cb 0.17 -0.21 0.04 0.00 -0.61 0.00 0.00 39.78 39.17 2a75 n ASN 522 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2a75 n ARG 523 N 0.60 -4.83 -4.28 3.52 1.74 -0.36 -4.95 116.66 108.10 2a75 n ARG 523 Ca 0.15 0.74 -0.23 0.00 -0.77 0.00 0.00 57.85 57.73 2a75 n ARG 523 Cb 0.35 -5.29 -0.07 0.00 -1.02 0.00 0.00 32.46 26.43 2a75 n ARG 523 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2a75 s GLN 524 N -5.67 2.33 0.28 5.56 -0.21 -1.26 -1.58 119.66 119.11 2a75 s GLN 524 Ca 0.32 -1.39 -0.10 0.00 0.02 0.00 0.00 55.36 54.21 2a75 s GLN 524 Cb -0.14 -2.19 -0.07 0.00 1.00 0.00 0.00 33.01 31.61 2a75 s GLN 524 CO 0.40 0.37 0.62 -1.58 -2.12 0.00 0.00 175.29 172.98 2a75 s TRP 525 N -2.29 3.42 -0.46 0.91 0.52 -0.15 -1.58 118.94 119.32 2a75 s TRP 525 Ca 0.31 0.94 0.03 0.00 0.02 0.00 0.00 56.10 57.40 2a75 s TRP 525 Cb -0.07 -2.33 0.15 0.00 -1.15 0.00 0.00 33.47 30.08 2a75 s TRP 525 CO 0.20 0.17 0.30 1.03 0.02 0.00 0.00 176.95 178.67 2a75 s ARG 526 N -3.08 1.29 0.40 4.98 0.52 0.33 -1.11 118.95 122.28 2a75 s ARG 526 Ca 0.49 -2.16 -0.25 0.00 -0.52 0.00 0.00 55.73 53.29 2a75 s ARG 526 Cb -0.11 -2.16 -0.08 0.00 0.52 0.00 0.00 34.95 33.12 2a75 s ARG 526 CO 0.23 -1.24 1.18 -1.25 0.02 0.00 0.00 175.30 174.23 2a75 s PRO 527 N 0.08 4.05 -0.25 3.54 0.04 -1.26 -0.76 135.00 140.44 2a75 s PRO 527 Ca 0.23 1.85 -0.02 0.00 0.04 0.00 0.00 61.00 63.10 2a75 s PRO 527 Cb -0.14 -2.67 0.02 0.00 0.04 0.00 0.00 34.50 31.75 2a75 s PRO 527 CO -0.07 -0.33 -0.06 -0.51 0.04 0.00 0.00 177.00 176.07 2a75 s LEU 528 N -2.50 3.18 -0.73 -3.56 1.43 0.12 -4.52 118.68 112.10 2a75 s LEU 528 Ca 0.57 -0.84 -0.03 0.00 -1.03 0.00 0.00 54.13 52.80 2a75 s LEU 528 Cb -0.31 -1.67 0.18 0.00 0.03 0.00 0.00 46.19 44.43 2a75 s LEU 528 CO 0.39 -0.12 0.57 -0.31 0.23 0.00 0.00 176.35 177.11 2a75 s TYR 529 N 1.34 3.58 0.00 0.29 1.51 -1.26 -1.82 117.35 120.98 2a75 s TYR 529 Ca 0.01 -2.79 0.00 0.00 -1.01 0.00 0.00 57.07 53.27 2a75 s TYR 529 Cb -0.16 -3.24 0.00 0.00 -0.11 0.00 0.00 41.96 38.44 2a75 s TYR 529 CO -0.04 -0.81 0.00 0.41 -1.11 0.00 0.00 175.55 174.00 2a75 n GLY 530 N 3.09 2.52 0.25 0.71 0.00 0.23 -2.34 105.19 109.65 2a75 n GLY 530 Ca 0.13 -0.46 0.13 0.00 0.00 0.00 0.00 46.02 45.83 2a75 n GLY 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 n ALA 531 N 9.01 2.61 -1.76 4.61 0.00 -1.26 -4.68 120.51 129.04 2a75 n ALA 531 Ca 0.00 -0.32 -0.39 0.00 0.00 0.00 0.00 53.44 52.74 2a75 n ALA 531 Cb 0.00 -1.29 0.02 0.00 0.00 0.00 0.00 19.45 18.17 2a75 n ALA 531 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2a75 s ALA 532 N -1.96 3.00 0.25 0.00 0.00 -0.99 -4.92 121.76 117.14 2a75 s ALA 532 Ca 0.39 1.26 -0.31 0.00 0.00 0.00 0.00 51.96 53.29 2a75 s ALA 532 Cb 0.19 -3.52 -0.12 0.00 0.00 0.00 0.00 23.12 19.67 2a75 s ALA 532 CO 0.31 -1.10 1.64 -2.30 0.00 0.00 0.00 175.76 174.31 2a75 n PRO 533 N -0.58 2.68 -2.79 0.00 -0.02 -1.26 -4.61 135.00 128.42 2a75 n PRO 533 Ca 0.08 0.96 -0.42 0.00 -2.02 0.00 0.00 63.50 62.10 2a75 n PRO 533 Cb 0.45 -2.76 -0.03 0.00 -0.02 0.00 0.00 33.50 31.13 2a75 n PRO 533 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2a75 s ALA 534 N 0.49 3.30 -0.06 3.55 0.00 -1.26 -4.94 121.76 122.84 2a75 s ALA 534 Ca 0.69 0.36 0.05 0.00 0.00 0.00 0.00 51.96 53.06 2a75 s ALA 534 Cb -0.52 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.31 2a75 s ALA 534 CO 0.42 -0.36 -0.22 -1.54 0.00 0.00 0.00 175.76 174.05 2a75 s SER 535 N 1.01 3.29 0.45 0.00 1.04 -1.26 -5.06 113.70 113.17 2a75 s SER 535 Ca 0.47 -0.45 -0.25 0.00 0.48 0.00 0.00 55.95 56.19 2a75 s SER 535 Cb -0.19 -0.91 -0.08 0.00 0.10 0.00 0.00 66.02 64.94 2a75 s SER 535 CO 0.22 0.25 1.42 -2.84 0.98 0.00 0.00 173.24 173.26 2a75 s PRO 536 N -0.20 3.70 0.02 4.02 0.02 -1.26 -4.54 135.00 136.76 2a75 s PRO 536 Ca -0.02 2.40 -0.17 0.00 0.02 0.00 0.00 61.00 63.23 2a75 s PRO 536 Cb -0.13 -2.66 0.03 0.00 0.02 0.00 0.00 34.50 31.75 2a75 s PRO 536 CO 0.03 -0.80 0.36 -0.08 -0.33 0.00 0.00 177.00 176.19 2a75 s THR 537 N -1.21 0.06 0.00 0.99 -1.32 -0.27 -4.96 115.64 108.93 2a75 s THR 537 Ca 0.61 -0.50 0.00 0.00 -1.21 0.00 0.00 61.69 60.59 2a75 s THR 537 Cb -0.43 -0.84 0.00 0.00 -1.51 0.00 0.00 72.50 69.72 2a75 s THR 537 CO 0.56 -0.27 0.00 0.61 -2.21 0.00 0.00 174.62 173.30 2a75 n GLY 538 N 0.81 -0.21 3.53 6.08 0.00 -1.26 -0.97 105.19 113.17 2a75 n GLY 538 Ca -0.20 -1.04 -0.14 0.00 0.00 0.00 0.00 46.02 44.64 2a75 n GLY 538 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2a75 s SER 539 N -4.00 -0.65 0.21 1.61 0.15 -1.26 -4.54 113.70 105.21 2a75 s SER 539 Ca 0.00 1.17 -0.04 0.00 0.70 0.00 0.00 55.95 57.77 2a75 s SER 539 Cb 0.00 1.16 -0.03 0.00 -1.71 0.00 0.00 66.02 65.44 2a75 s SER 539 CO 0.00 -0.29 0.22 -1.66 1.20 0.00 0.00 173.24 172.71 2a75 s TRP 540 N 0.05 0.91 0.08 3.44 1.48 -0.62 -4.96 118.94 119.34 2a75 s TRP 540 Ca -0.02 -1.18 0.06 0.00 -1.06 0.00 0.00 56.10 53.89 2a75 s TRP 540 Cb -0.04 -0.34 -0.03 0.00 -1.16 0.00 0.00 33.47 31.90 2a75 s TRP 540 CO 0.02 -0.73 -0.15 -1.83 -4.06 0.00 0.00 176.95 170.21 2a75 s GLU 541 N -4.11 0.89 0.69 3.25 -1.05 -1.26 -4.85 118.70 112.27 2a75 s GLU 541 Ca 0.33 -1.03 -0.16 0.00 -0.15 0.00 0.00 54.97 53.96 2a75 s GLU 541 Cb 0.05 -0.91 0.02 0.00 -0.44 0.00 0.00 34.13 32.85 2a75 s GLU 541 CO 0.10 0.20 1.24 -0.51 0.95 0.00 0.00 175.26 177.24 2a75 s LEU 542 N -1.89 3.43 0.00 1.83 1.43 -1.26 -3.15 118.68 119.07 2a75 s LEU 542 Ca 0.01 2.47 0.00 0.00 -1.03 0.00 0.00 54.13 55.58 2a75 s LEU 542 Cb -0.09 -4.60 0.00 0.00 0.03 0.00 0.00 46.19 41.53 2a75 s LEU 542 CO 0.03 -2.16 0.00 1.41 0.23 0.00 0.00 176.35 175.86 2a75 n HIS 543 N -2.37 0.00 -3.55 0.29 8.25 0.26 -4.97 115.22 113.13 2a75 n HIS 543 Ca 0.14 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.24 2a75 n HIS 543 Cb 0.49 -0.98 -0.06 0.00 1.12 0.00 0.00 29.99 30.56 2a75 n HIS 543 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2a75 s LYS 544 N -0.54 3.83 0.10 -0.41 2.20 -1.19 -4.91 119.74 118.82 2a75 s LYS 544 Ca 0.00 0.29 -0.29 0.00 -0.36 0.00 0.00 55.97 55.61 2a75 s LYS 544 Cb 0.00 -3.13 -0.06 0.00 -1.51 0.00 0.00 37.83 33.13 2a75 s LYS 544 CO 0.00 0.65 0.93 0.15 -0.36 0.00 0.00 175.35 176.72 2a75 s LYS 545 N -1.38 4.66 0.11 4.03 1.02 -1.26 -4.37 119.74 122.55 2a75 s LYS 545 Ca 0.27 1.39 0.06 0.00 0.02 0.00 0.00 55.97 57.71 2a75 s LYS 545 Cb -0.15 -3.37 -0.03 0.00 -0.52 0.00 0.00 37.83 33.75 2a75 s LYS 545 CO 0.14 0.23 -0.16 0.71 -0.92 0.00 0.00 175.35 175.35 2a75 s TYR 546 N -0.01 1.48 -0.20 3.18 1.51 -0.22 -4.97 117.35 118.12 2a75 s TYR 546 Ca 0.45 -0.49 -0.09 0.00 -1.01 0.00 0.00 57.07 55.94 2a75 s TYR 546 Cb -0.23 -0.79 -0.05 0.00 -0.11 0.00 0.00 41.96 40.78 2a75 s TYR 546 CO 0.29 0.15 0.10 -1.58 -1.11 0.00 0.00 175.55 173.40 2a75 s HIS 547 N -1.64 3.31 -0.08 2.71 2.46 -1.26 -1.02 115.29 119.77 2a75 s HIS 547 Ca 0.06 0.17 0.05 0.00 0.47 0.00 0.00 55.06 55.80 2a75 s HIS 547 Cb -0.08 -2.15 -0.00 0.00 -0.13 0.00 0.00 32.58 30.22 2a75 s HIS 547 CO 0.03 0.17 -0.24 0.08 -2.47 0.00 0.00 174.74 172.31 2a75 s VAL 548 N 0.53 1.98 -0.04 0.89 1.01 0.26 -0.27 120.40 124.77 2a75 s VAL 548 Ca 0.06 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 61.06 2a75 s VAL 548 Cb -0.12 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.57 2a75 s VAL 548 CO 0.00 0.55 -0.09 -0.69 0.00 0.00 0.00 175.10 174.87 2a75 s VAL 549 N 0.13 0.81 -0.16 2.92 1.01 -0.39 -1.32 120.40 123.40 2a75 s VAL 549 Ca -0.12 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 2a75 s VAL 549 Cb -0.16 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.46 2a75 s VAL 549 CO 0.06 0.27 -0.13 -0.76 0.00 0.00 0.00 175.10 174.55 2a75 s LEU 550 N 0.58 2.61 0.03 3.92 1.43 0.28 0.11 118.68 127.64 2a75 s LEU 550 Ca -0.10 -0.42 0.09 0.00 -1.03 0.00 0.00 54.13 52.67 2a75 s LEU 550 Cb -0.13 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.46 2a75 s LEU 550 CO 0.01 0.08 -0.25 0.42 0.23 0.00 0.00 176.35 176.84 2a75 s THR 551 N 0.84 2.05 -0.12 5.49 -4.23 -0.20 -1.30 115.64 118.17 2a75 s THR 551 Ca -0.04 -1.31 -0.05 0.00 -1.18 0.00 0.00 61.69 59.11 2a75 s THR 551 Cb -0.15 -1.75 0.06 0.00 1.34 0.00 0.00 72.50 72.00 2a75 s THR 551 CO 0.00 0.38 0.24 -0.32 -0.54 0.00 0.00 174.62 174.38 2a75 s MET 552 N -1.12 0.13 -0.04 3.99 0.00 -0.35 -1.30 119.30 120.61 2a75 s MET 552 Ca 0.11 0.67 -0.30 0.00 0.00 0.00 0.00 55.69 56.17 2a75 s MET 552 Cb -0.10 -0.09 0.08 0.00 0.00 0.00 0.00 34.83 34.72 2a75 s MET 552 CO 0.01 -0.27 0.72 0.00 0.00 0.00 0.00 175.02 175.49 2a75 s ALA 553 N 2.20 -1.77 -1.30 4.11 0.00 -1.01 -0.28 121.76 123.70 2a75 s ALA 553 Ca -0.00 1.25 -0.08 0.00 0.00 0.00 0.00 51.96 53.12 2a75 s ALA 553 Cb -0.12 0.02 0.06 0.00 0.00 0.00 0.00 23.12 23.08 2a75 s ALA 553 CO -0.08 -0.42 0.48 -0.25 0.00 0.00 0.00 175.76 175.49 2a75 n ASP 554 N 0.70 -3.94 -0.20 0.00 8.00 -1.26 -0.58 116.55 119.28 2a75 n ASP 554 Ca -0.17 -0.35 -0.03 0.00 0.71 0.00 0.00 54.79 54.95 2a75 n ASP 554 Cb 0.58 -3.25 -0.01 0.00 -0.02 0.00 0.00 41.12 38.42 2a75 n ASP 554 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2a75 n ARG 555 N -3.72 -1.56 -4.23 -1.24 1.74 -1.26 -4.98 116.66 101.41 2a75 n ARG 555 Ca -0.03 0.51 -0.35 0.00 -0.77 0.00 0.00 57.85 57.22 2a75 n ARG 555 Cb 0.55 -4.73 -0.08 0.00 -1.02 0.00 0.00 32.46 27.18 2a75 n ARG 555 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2a75 s GLN 556 N -1.90 3.05 -0.03 5.56 -0.21 0.26 0.29 119.66 126.68 2a75 s GLN 556 Ca 0.00 -0.40 0.06 0.00 0.02 0.00 0.00 55.36 55.04 2a75 s GLN 556 Cb 0.00 -2.86 -0.01 0.00 1.00 0.00 0.00 33.01 31.14 2a75 s GLN 556 CO 0.00 0.70 -0.20 0.20 -2.12 0.00 0.00 175.29 173.86 2a75 s GLY 557 N -1.16 1.03 0.07 3.09 0.00 -0.67 -2.41 107.32 107.27 2a75 s GLY 557 Ca 0.16 -0.86 0.04 0.00 0.00 0.00 0.00 44.72 44.06 2a75 s GLY 557 CO 0.06 -0.62 -0.11 -0.56 0.00 0.00 0.00 173.10 171.87 2a75 s SER 558 N -0.29 1.42 -0.10 1.64 0.01 -0.42 -1.11 113.70 114.85 2a75 s SER 558 Ca 0.03 -0.67 0.01 0.00 1.31 0.00 0.00 55.95 56.62 2a75 s SER 558 Cb -0.10 -0.01 0.02 0.00 0.21 0.00 0.00 66.02 66.14 2a75 s SER 558 CO 0.01 -0.17 -0.10 -0.69 0.41 0.00 0.00 173.24 172.70 2a75 s VAL 559 N -1.71 1.08 -0.05 3.43 1.01 -1.26 -1.03 120.40 121.88 2a75 s VAL 559 Ca -0.01 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.63 2a75 s VAL 559 Cb -0.08 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 2a75 s VAL 559 CO 0.01 0.36 -0.12 -0.31 0.00 0.00 0.00 175.10 175.04 2a75 s TYR 560 N 1.29 2.76 -0.11 5.22 1.51 0.12 -0.40 117.35 127.74 2a75 s TYR 560 Ca -0.03 -0.11 0.01 0.00 -1.01 0.00 0.00 57.07 55.94 2a75 s TYR 560 Cb -0.14 -1.64 0.02 0.00 -0.11 0.00 0.00 41.96 40.08 2a75 s TYR 560 CO -0.04 0.23 -0.15 0.08 -1.11 0.00 0.00 175.55 174.57 2a75 s VAL 561 N -0.77 1.49 -1.50 0.71 1.01 -0.57 -1.26 120.40 119.50 2a75 s VAL 561 Ca 0.12 -0.63 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 2a75 s VAL 561 Cb -0.11 -1.37 0.07 0.00 0.00 0.00 0.00 36.38 34.98 2a75 s VAL 561 CO 0.01 0.44 0.93 0.47 0.00 0.00 0.00 175.10 176.95 2a75 n ASP 562 N 4.28 -4.11 0.00 3.32 8.00 0.63 -2.15 116.55 126.52 2a75 n ASP 562 Ca -0.19 -0.80 0.00 0.00 0.71 0.00 0.00 54.79 54.52 2a75 n ASP 562 Cb 0.51 -3.87 0.00 0.00 -0.02 0.00 0.00 41.12 37.74 2a75 n ASP 562 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a75 n GLY 563 N -1.68 1.16 3.30 0.44 0.00 -1.26 -5.02 105.19 102.13 2a75 n GLY 563 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 2a75 n GLY 563 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2a75 s GLN 564 N -0.07 2.33 0.37 1.61 -1.52 -0.91 -4.92 119.66 116.54 2a75 s GLN 564 Ca 0.00 -0.91 -0.27 0.00 -1.95 0.00 0.00 55.36 52.23 2a75 s GLN 564 Cb 0.00 -2.11 -0.09 0.00 -0.22 0.00 0.00 33.01 30.59 2a75 s GLN 564 CO 0.00 0.48 1.26 -1.25 -0.25 0.00 0.00 175.29 175.53 2a75 s PRO 565 N -0.42 4.16 0.41 2.91 0.04 -1.26 -1.51 135.00 139.33 2a75 s PRO 565 Ca 0.04 2.07 -0.17 0.00 0.04 0.00 0.00 61.00 62.99 2a75 s PRO 565 Cb -0.12 -2.87 -0.09 0.00 0.04 0.00 0.00 34.50 31.47 2a75 s PRO 565 CO 0.01 -0.30 0.87 -0.51 0.04 0.00 0.00 177.00 177.11 2a75 s LEU 566 N -2.17 3.89 0.36 -3.56 1.43 0.47 -4.90 118.68 114.19 2a75 s LEU 566 Ca 0.53 1.46 -0.26 0.00 -1.03 0.00 0.00 54.13 54.84 2a75 s LEU 566 Cb -0.36 -4.32 -0.12 0.00 0.03 0.00 0.00 46.19 41.41 2a75 s LEU 566 CO 0.47 -0.37 0.98 0.00 0.23 0.00 0.00 176.35 177.66 2a75 n ALA 567 N -0.88 -0.08 -0.06 4.21 0.00 -1.26 -2.03 120.51 120.42 2a75 n ALA 567 Ca 0.05 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2a75 n ALA 567 Cb 0.54 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.95 2a75 n ALA 567 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a75 n GLY 568 N 1.23 0.96 3.79 0.00 0.00 -1.26 -4.96 105.19 104.95 2a75 n GLY 568 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 2a75 n GLY 568 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2a75 s SER 569 N -2.73 5.35 0.00 1.61 0.01 -0.86 -4.12 113.70 112.96 2a75 s SER 569 Ca 0.00 1.82 0.00 0.00 1.31 0.00 0.00 55.95 59.08 2a75 s SER 569 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 2a75 s SER 569 CO 0.00 -1.46 0.00 0.61 0.41 0.00 0.00 173.24 172.80 2a75 n GLY 570 N -1.10 0.75 3.96 3.44 0.00 -0.27 -4.97 105.19 106.99 2a75 n GLY 570 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 2a75 n GLY 570 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2a75 s ASN 571 N -2.50 5.24 0.09 1.61 0.01 -1.25 -4.79 114.94 113.36 2a75 s ASN 571 Ca 0.00 -0.69 -0.31 0.00 -0.71 0.00 0.00 52.86 51.15 2a75 s ASN 571 Cb 0.00 -0.36 -0.08 0.00 0.41 0.00 0.00 41.25 41.22 2a75 s ASN 571 CO 0.00 -0.86 1.60 -0.89 -1.51 0.00 0.00 177.10 175.45 2a75 s THR 572 N -2.49 3.00 -0.98 1.60 2.01 -1.26 -1.68 115.64 115.84 2a75 s THR 572 Ca 0.52 0.54 0.15 0.00 0.31 0.00 0.00 61.69 63.20 2a75 s THR 572 Cb -0.06 -3.35 -0.10 0.00 0.01 0.00 0.00 72.50 69.01 2a75 s THR 572 CO 0.31 0.01 0.70 1.33 -0.69 0.00 0.00 174.62 176.28 2a75 n VAL 573 N 4.51 0.00 -3.72 3.82 0.24 0.14 -4.86 118.33 118.47 2a75 n VAL 573 Ca 0.15 -0.23 -0.22 0.00 -2.04 0.00 0.00 64.34 62.00 2a75 n VAL 573 Cb 0.40 1.07 -0.18 0.00 -1.47 0.00 0.00 33.84 33.67 2a75 n VAL 573 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2a75 s VAL 574 N -2.15 0.13 0.11 3.34 0.11 -1.22 -4.27 120.40 116.44 2a75 s VAL 574 Ca 0.08 0.25 -0.06 0.00 -2.93 0.00 0.00 61.98 59.32 2a75 s VAL 574 Cb 0.12 -0.36 -0.05 0.00 -1.53 0.00 0.00 36.38 34.55 2a75 s VAL 574 CO 0.51 0.20 0.37 -0.13 -3.33 0.00 0.00 175.10 172.72 2a75 s ARG 575 N 2.07 3.65 0.00 1.54 1.81 -1.26 -4.95 118.95 121.81 2a75 s ARG 575 Ca 0.05 -0.02 0.00 0.00 -1.72 0.00 0.00 55.73 54.04 2a75 s ARG 575 Cb -0.12 -2.92 0.00 0.00 -0.45 0.00 0.00 34.95 31.46 2a75 s ARG 575 CO -0.04 0.52 0.00 0.41 -0.68 0.00 0.00 175.30 175.51 2a75 n GLY 576 N 0.45 1.14 0.01 -3.53 0.00 -1.26 -4.81 105.19 97.19 2a75 n GLY 576 Ca -0.05 -2.17 0.08 0.00 0.00 0.00 0.00 46.02 43.87 2a75 n GLY 576 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 n ALA 577 N 0.13 2.80 -2.69 4.61 0.00 -1.26 -4.96 120.51 119.14 2a75 n ALA 577 Ca 0.00 -0.39 -0.42 0.00 0.00 0.00 0.00 53.44 52.63 2a75 n ALA 577 Cb 0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 2a75 n ALA 577 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2a75 s THR 578 N -3.02 4.80 0.41 0.00 2.01 -1.26 -5.01 115.64 113.57 2a75 s THR 578 Ca -0.04 2.02 -0.25 0.00 0.31 0.00 0.00 61.69 63.73 2a75 s THR 578 Cb 0.10 -4.30 -0.11 0.00 0.01 0.00 0.00 72.50 68.21 2a75 s THR 578 CO 0.66 0.13 1.12 0.18 -0.69 0.00 0.00 174.62 176.03 2a75 n LEU 579 N 4.10 3.15 -4.58 4.42 4.77 -1.26 -4.97 117.00 122.63 2a75 n LEU 579 Ca 0.07 1.08 -0.30 0.00 -0.03 0.00 0.00 56.01 56.83 2a75 n LEU 579 Cb 0.50 -1.41 0.23 0.00 -2.33 0.00 0.00 43.42 40.41 2a75 n LEU 579 CO 0.52 -1.10 0.60 -2.16 -1.33 0.00 0.00 177.39 173.92 2a75 s PRO 580 N -2.05 -1.00 -0.42 3.23 0.04 -1.26 -5.01 135.00 128.54 2a75 s PRO 580 Ca 0.62 0.11 0.02 0.00 0.04 0.00 0.00 61.00 61.79 2a75 s PRO 580 Cb -0.55 -1.61 0.15 0.00 0.04 0.00 0.00 34.50 32.54 2a75 s PRO 580 CO 0.58 -3.60 0.29 0.34 0.04 0.00 0.00 177.00 174.65 2a75 s ASP 581 N -3.68 2.50 0.08 6.66 2.15 -1.26 -4.83 116.67 118.29 2a75 s ASP 581 Ca 0.69 -2.76 -0.31 0.00 0.43 0.00 0.00 52.55 50.60 2a75 s ASP 581 Cb -0.13 -0.59 -0.08 0.00 -0.30 0.00 0.00 42.92 41.83 2a75 s ASP 581 CO 0.57 -0.22 1.50 -0.63 -0.17 0.00 0.00 175.17 176.22 2a75 s ILE 582 N 0.33 3.19 0.04 4.11 1.01 -1.26 -1.44 121.20 127.19 2a75 s ILE 582 Ca 0.25 0.75 -0.14 0.00 0.00 0.00 0.00 60.65 61.51 2a75 s ILE 582 Cb -0.10 -3.48 -0.34 0.00 0.01 0.00 0.00 42.46 38.56 2a75 s ILE 582 CO -0.10 0.03 1.04 0.77 0.00 0.00 0.00 174.94 176.68 2a75 h SER 583 N 7.50 0.81 -5.25 3.58 4.64 -1.38 -0.44 113.55 123.00 2a75 h SER 583 Ca -0.41 -0.84 0.30 0.00 -0.47 0.00 0.00 61.79 60.37 2a75 h SER 583 Cb 1.20 -0.26 -0.14 0.00 -0.31 0.00 0.00 62.40 62.88 2a75 h SER 583 CO 0.90 1.65 0.83 -1.38 -0.87 0.00 0.00 176.83 177.96 2a75 s HIS 584 N -2.68 -0.07 -0.11 4.77 -3.43 -1.25 -1.23 115.29 111.30 2a75 s HIS 584 Ca -0.08 -0.02 -0.08 0.00 -0.80 0.00 0.00 55.06 54.08 2a75 s HIS 584 Cb 0.05 0.54 -0.04 0.00 -1.43 0.00 0.00 32.58 31.69 2a75 s HIS 584 CO 0.94 -0.25 0.18 -0.06 -2.00 0.00 0.00 174.74 173.55 2a75 s PHE 585 N -2.41 3.60 0.02 0.38 0.40 -0.31 -0.42 117.98 119.23 2a75 s PHE 585 Ca 0.13 0.58 0.04 0.00 -0.60 0.00 0.00 56.93 57.07 2a75 s PHE 585 Cb 0.03 -2.01 -0.03 0.00 0.51 0.00 0.00 43.02 41.51 2a75 s PHE 585 CO -0.04 0.68 -0.06 1.52 0.70 0.00 0.00 175.22 178.02 2a75 s TYR 586 N -0.90 2.89 -0.13 0.36 -0.85 0.05 -1.46 117.35 117.31 2a75 s TYR 586 Ca 0.16 -0.04 -0.00 0.00 -0.52 0.00 0.00 57.07 56.66 2a75 s TYR 586 Cb -0.13 -1.59 0.03 0.00 0.38 0.00 0.00 41.96 40.65 2a75 s TYR 586 CO 0.05 0.39 -0.10 0.42 -1.52 0.00 0.00 175.55 174.79 2a75 s ILE 587 N -1.05 1.26 0.00 -3.49 1.01 0.13 -2.03 121.20 117.04 2a75 s ILE 587 Ca 0.18 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.37 2a75 s ILE 587 Cb -0.11 -1.25 0.00 0.00 0.01 0.00 0.00 42.46 41.11 2a75 s ILE 587 CO 0.09 0.39 0.00 0.61 0.00 0.00 0.00 174.94 176.03 2a75 n GLY 588 N 4.87 0.17 2.70 6.18 0.00 0.80 -0.09 105.19 119.81 2a75 n GLY 588 Ca -0.14 -1.05 -0.24 0.00 0.00 0.00 0.00 46.02 44.59 2a75 n GLY 588 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a75 n GLY 589 N 0.00 4.98 3.76 -0.02 0.00 -0.82 -3.75 105.19 109.34 2a75 n GLY 589 Ca 0.00 -2.44 -0.34 0.00 0.00 0.00 0.00 46.02 43.24 2a75 n GLY 589 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2a75 s PRO 590 N -3.15 2.78 -0.29 1.61 0.04 -1.23 -4.05 135.00 130.71 2a75 s PRO 590 Ca 0.46 1.49 -0.30 0.00 0.04 0.00 0.00 61.00 62.69 2a75 s PRO 590 Cb 0.30 -1.94 0.19 0.00 0.04 0.00 0.00 34.50 33.09 2a75 s PRO 590 CO -0.12 -1.28 1.36 -0.98 0.04 0.00 0.00 177.00 176.02 2a75 s ARG 591 N -3.93 0.05 0.00 4.56 1.04 -1.26 -4.95 118.95 114.46 2a75 s ARG 591 Ca 0.69 0.01 0.01 0.00 -1.04 0.00 0.00 55.73 55.40 2a75 s ARG 591 Cb -0.22 0.02 0.01 0.00 -2.04 0.00 0.00 34.95 32.72 2a75 s ARG 591 CO 0.40 -0.02 0.77 -1.13 -0.04 0.00 0.00 175.30 175.28 2a75 n SER 592 N 0.47 1.55 -3.19 -2.89 3.41 -1.26 -4.62 113.62 107.09 2a75 n SER 592 Ca 0.01 -1.51 -0.05 0.00 -0.26 0.00 0.00 58.87 57.06 2a75 n SER 592 Cb 0.59 -0.01 0.02 0.00 -0.26 0.00 0.00 64.21 64.55 2a75 n SER 592 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2a75 s LYS 593 N -0.52 1.62 2.83 4.33 -2.85 -1.26 -5.15 119.74 118.75 2a75 s LYS 593 Ca 0.01 -1.05 0.00 0.00 -1.00 0.00 0.00 55.97 53.93 2a75 s LYS 593 Cb 0.01 0.45 0.00 0.00 -2.06 0.00 0.00 37.83 36.23 2a75 s LYS 593 CO 0.01 -0.76 0.00 0.41 0.10 0.00 0.00 175.35 175.11 2a75 n GLY 594 N -0.66 -0.17 3.60 0.59 0.00 -1.26 -4.80 105.19 102.49 2a75 n GLY 594 Ca -0.05 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 2a75 n GLY 594 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a75 n ALA 595 N 3.19 0.05 -1.96 4.61 0.00 -1.26 -4.82 120.51 120.32 2a75 n ALA 595 Ca 0.00 0.32 -0.42 0.00 0.00 0.00 0.00 53.44 53.34 2a75 n ALA 595 Cb 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.39 2a75 n ALA 595 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2a75 n PRO 596 N 0.50 3.18 -1.80 0.00 -0.04 -1.26 -4.95 135.00 130.63 2a75 n PRO 596 Ca 0.09 -2.96 -0.41 0.00 -0.04 0.00 0.00 63.50 60.18 2a75 n PRO 596 Cb 0.35 -3.13 -0.01 0.00 -0.04 0.00 0.00 33.50 30.67 2a75 n PRO 596 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2a75 s THR 597 N 2.04 2.07 -0.41 0.52 2.01 -1.26 -4.73 115.64 115.88 2a75 s THR 597 Ca 0.45 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.55 2a75 s THR 597 Cb 0.12 -3.04 0.17 0.00 0.01 0.00 0.00 72.50 69.76 2a75 s THR 597 CO -0.05 0.02 0.36 -0.62 -0.69 0.00 0.00 174.62 173.63 2a75 s ASP 598 N -0.00 1.36 -0.36 3.53 -1.08 -1.26 0.08 116.67 118.94 2a75 s ASP 598 Ca 0.55 -2.62 -0.27 0.00 -0.52 0.00 0.00 52.55 49.68 2a75 s ASP 598 Cb -0.47 -0.08 0.02 0.00 -1.46 0.00 0.00 42.92 40.93 2a75 s ASP 598 CO 0.59 -0.19 1.01 -0.44 0.52 0.00 0.00 175.17 176.66 2a75 s SER 599 N 0.47 6.77 -1.20 -0.34 0.01 -1.26 -4.90 113.70 113.24 2a75 s SER 599 Ca 0.28 0.75 -0.15 0.00 1.31 0.00 0.00 55.95 58.14 2a75 s SER 599 Cb -0.03 -2.51 0.14 0.00 0.21 0.00 0.00 66.02 63.83 2a75 s SER 599 CO -0.13 -0.92 1.48 -0.13 0.41 0.00 0.00 173.24 173.95 2a75 s ARG 600 N 3.67 4.02 0.21 12.44 1.81 -1.26 -4.60 118.95 135.24 2a75 s ARG 600 Ca 0.42 -2.35 0.02 0.00 -1.72 0.00 0.00 55.73 52.10 2a75 s ARG 600 Cb -0.11 -5.17 -0.05 0.00 -0.45 0.00 0.00 34.95 29.17 2a75 s ARG 600 CO 0.19 -1.89 0.04 0.14 -0.68 0.00 0.00 175.30 173.10 2a75 s VAL 601 N 2.34 0.66 -0.10 3.52 -7.23 -1.25 -0.59 120.40 117.75 2a75 s VAL 601 Ca 0.45 -1.99 0.02 0.00 -1.81 0.00 0.00 61.98 58.64 2a75 s VAL 601 Cb -0.01 -2.32 0.01 0.00 0.56 0.00 0.00 36.38 34.62 2a75 s VAL 601 CO 0.01 -0.30 -0.14 -0.89 -0.31 0.00 0.00 175.10 173.47 2a75 s THR 602 N -3.68 1.39 -0.01 5.32 2.01 -0.25 -0.81 115.64 119.61 2a75 s THR 602 Ca 0.29 -0.59 0.05 0.00 0.31 0.00 0.00 61.69 61.75 2a75 s THR 602 Cb 0.07 -1.27 -0.01 0.00 0.01 0.00 0.00 72.50 71.29 2a75 s THR 602 CO 0.08 0.42 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.57 2a75 s VAL 603 N 0.90 1.34 0.05 3.82 1.01 0.11 -1.22 120.40 126.40 2a75 s VAL 603 Ca -0.09 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.17 2a75 s VAL 603 Cb -0.15 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 2a75 s VAL 603 CO 0.00 0.38 -0.04 0.42 0.00 0.00 0.00 175.10 175.86 2a75 s THR 604 N -0.39 0.30 -0.79 3.92 -4.23 -0.11 -1.10 115.64 113.24 2a75 s THR 604 Ca 0.06 -1.41 -0.00 0.00 -1.18 0.00 0.00 61.69 59.16 2a75 s THR 604 Cb -0.07 -0.98 0.00 0.00 1.34 0.00 0.00 72.50 72.80 2a75 s THR 604 CO -0.01 -0.72 0.64 0.59 -0.54 0.00 0.00 174.62 174.59 2a75 n ASN 605 N 0.80 -6.13 -4.61 3.99 5.03 -0.63 -1.60 115.26 112.10 2a75 n ASN 605 Ca -0.18 -0.57 -0.40 0.00 0.87 0.00 0.00 54.58 54.29 2a75 n ASN 605 Cb 0.58 -3.25 -0.07 0.00 -1.02 0.00 0.00 39.78 36.02 2a75 n ASN 605 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2a75 s VAL 606 N -2.98 5.05 -0.04 2.41 1.01 -0.17 -4.03 120.40 121.64 2a75 s VAL 606 Ca 0.00 0.88 0.05 0.00 0.00 0.00 0.00 61.98 62.92 2a75 s VAL 606 Cb -0.00 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 2a75 s VAL 606 CO 0.83 0.06 -0.19 -0.69 0.00 0.00 0.00 175.10 175.12 2a75 s VAL 607 N 2.34 2.67 -0.12 2.92 1.01 0.49 -1.18 120.40 128.53 2a75 s VAL 607 Ca 0.22 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.35 2a75 s VAL 607 Cb -0.16 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.23 2a75 s VAL 607 CO 0.09 0.58 -0.18 -0.22 0.00 0.00 0.00 175.10 175.38 2a75 s LEU 608 N -0.63 1.87 0.15 3.92 2.96 -0.59 -0.57 118.68 125.79 2a75 s LEU 608 Ca 0.10 -0.49 0.09 0.00 -0.22 0.00 0.00 54.13 53.60 2a75 s LEU 608 Cb -0.11 -1.22 -0.04 0.00 0.50 0.00 0.00 46.19 45.32 2a75 s LEU 608 CO 0.00 0.04 -0.16 -0.31 -1.32 0.00 0.00 176.35 174.60 2a75 s TYR 609 N 0.92 2.53 -0.37 5.38 1.51 -0.01 -0.16 117.35 127.15 2a75 s TYR 609 Ca -0.07 -0.26 0.03 0.00 -1.01 0.00 0.00 57.07 55.76 2a75 s TYR 609 Cb -0.15 -1.29 0.54 0.00 -0.11 0.00 0.00 41.96 40.94 2a75 s TYR 609 CO -0.02 0.45 1.76 0.27 -1.11 0.00 0.00 175.55 176.90 2a75 n ASN 610 N 0.44 3.74 -3.76 2.29 0.23 -0.26 -2.01 115.26 115.94 2a75 n ASN 610 Ca -0.13 -3.31 -0.08 0.00 -0.53 0.00 0.00 54.58 50.52 2a75 n ASN 610 Cb 0.54 -0.78 -0.02 0.00 -2.08 0.00 0.00 39.78 37.44 2a75 n ASN 610 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2a75 s ARG 611 N -2.69 1.66 -0.34 -3.83 1.70 -1.26 -4.72 118.95 109.47 2a75 s ARG 611 Ca 0.46 -0.87 -0.24 0.00 -0.47 0.00 0.00 55.73 54.62 2a75 s ARG 611 Cb 0.39 0.60 0.01 0.00 -0.57 0.00 0.00 34.95 35.38 2a75 s ARG 611 CO 0.09 -0.76 0.81 0.50 -1.08 0.00 0.00 175.30 174.86 2a75 s ARG 612 N -3.88 3.85 0.48 3.89 3.52 -1.26 -2.87 118.95 122.67 2a75 s ARG 612 Ca 0.09 0.46 -0.24 0.00 -0.13 0.00 0.00 55.73 55.91 2a75 s ARG 612 Cb -0.05 -3.78 -0.07 0.00 -1.56 0.00 0.00 34.95 29.49 2a75 s ARG 612 CO 0.02 -0.81 1.33 -0.51 -0.81 0.00 0.00 175.30 174.53 2a75 s LEU 613 N 3.12 4.03 0.78 -0.88 1.43 -1.26 -5.01 118.68 120.89 2a75 s LEU 613 Ca 0.33 2.71 -0.09 0.00 -1.03 0.00 0.00 54.13 56.04 2a75 s LEU 613 Cb -0.13 -4.09 0.09 0.00 0.03 0.00 0.00 46.19 42.09 2a75 s LEU 613 CO 0.16 -1.20 1.11 0.54 0.23 0.00 0.00 176.35 177.19 2a75 s ASN 614 N -0.85 4.41 0.26 2.29 2.20 -1.26 -4.81 114.94 117.18 2a75 s ASN 614 Ca 0.64 0.45 -0.03 0.00 -0.94 0.00 0.00 52.86 52.99 2a75 s ASN 614 Cb -0.39 -0.94 0.44 0.00 -2.00 0.00 0.00 41.25 38.36 2a75 s ASN 614 CO 0.48 -1.89 1.83 0.77 -2.94 0.00 0.00 177.10 175.35 2a75 h SER 615 N -0.89 0.81 -0.65 3.54 4.64 -2.00 -1.13 113.55 117.87 2a75 h SER 615 Ca -0.44 0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 60.86 2a75 h SER 615 Cb 1.30 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 63.24 2a75 h SER 615 CO 0.57 0.47 0.17 -1.28 -0.87 0.00 0.00 176.83 175.89 2a75 h SER 616 N 0.92 0.98 -0.49 4.97 0.87 -2.00 -2.08 113.55 116.72 2a75 h SER 616 Ca 0.43 -0.23 -0.11 0.00 -1.23 0.00 0.00 61.79 60.65 2a75 h SER 616 Cb 0.35 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2a75 h SER 616 CO -0.24 0.95 -0.11 -0.33 -0.53 0.00 0.00 176.83 176.58 2a75 h GLU 617 N 0.96 0.97 -0.61 2.24 5.08 -1.70 -1.30 114.58 120.21 2a75 h GLU 617 Ca 0.21 -0.35 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 2a75 h GLU 617 Cb 0.34 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 2a75 h GLU 617 CO -0.00 1.02 0.30 0.82 -1.00 0.00 0.00 179.01 180.15 2a75 h ILE 618 N 0.86 1.21 -0.60 3.13 2.04 -1.10 -1.44 117.51 121.62 2a75 h ILE 618 Ca 0.14 -0.57 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 2a75 h ILE 618 Cb 0.66 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 2a75 h ILE 618 CO 0.05 0.24 0.30 -0.09 0.00 0.00 0.00 178.15 178.64 2a75 h ARG 619 N 0.83 0.85 -0.36 2.37 2.43 -1.15 -1.22 114.38 118.13 2a75 h ARG 619 Ca 0.21 -0.12 0.03 0.00 -0.81 0.00 0.00 59.98 59.30 2a75 h ARG 619 Cb 0.10 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 2a75 h ARG 619 CO -0.03 0.68 0.15 1.15 -1.51 0.00 0.00 179.97 180.41 2a75 h THR 620 N 0.82 0.94 -0.67 0.20 2.02 -0.87 0.06 112.91 115.40 2a75 h THR 620 Ca 0.21 -0.11 -0.04 0.00 0.77 0.00 0.00 66.41 67.23 2a75 h THR 620 Cb 0.09 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 2a75 h THR 620 CO -0.03 0.06 0.25 -0.07 0.37 0.00 0.00 175.52 176.10 2a75 h LEU 621 N 0.32 0.95 -0.76 2.58 3.38 -1.02 -0.52 115.31 120.23 2a75 h LEU 621 Ca 0.16 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.97 2a75 h LEU 621 Cb 0.10 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 2a75 h LEU 621 CO -0.14 0.88 0.49 0.15 0.09 0.00 0.00 178.44 179.91 2a75 h PHE 622 N 0.96 0.93 0.00 1.13 3.57 -0.73 -2.38 116.94 120.42 2a75 h PHE 622 Ca 0.22 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.74 2a75 h PHE 622 Cb 0.24 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.67 2a75 h PHE 622 CO 0.02 0.55 0.00 -0.07 -2.23 0.00 0.00 178.31 176.58 2a75 h LEU 623 N 0.98 0.00 -3.23 0.59 3.38 -0.55 -3.30 115.31 113.17 2a75 h LEU 623 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2a75 h LEU 623 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2a75 h LEU 623 CO -0.09 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.90 2a75 n SER 624 N -2.83 3.87 -0.31 -0.43 3.41 -0.24 -4.65 113.62 112.43 2a75 n SER 624 Ca 0.04 -2.91 0.18 0.00 -0.26 0.00 0.00 58.87 55.92 2a75 n SER 624 Cb 0.46 -0.52 0.43 0.00 -0.26 0.00 0.00 64.21 64.32 2a75 n SER 624 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2a75 h GLN 625 N 1.93 0.54 -0.00 4.33 4.20 -1.55 0.23 115.11 124.78 2a75 h GLN 625 Ca 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2a75 h GLN 625 Cb 1.40 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.06 2a75 h GLN 625 CO 0.21 0.35 -0.01 -0.25 -0.67 0.00 0.00 178.83 178.46 2a75 n ASP 626 N -4.65 0.20 -0.00 1.46 8.00 -1.26 -4.04 116.55 116.26 2a75 n ASP 626 Ca 0.23 -0.85 0.07 0.00 0.71 0.00 0.00 54.79 54.95 2a75 n ASP 626 Cb 0.69 -0.06 -0.10 0.00 -0.02 0.00 0.00 41.12 41.64 2a75 n ASP 626 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2a75 n MET 627 N -0.93 1.24 0.01 -1.24 2.81 0.06 -4.69 117.12 114.39 2a75 n MET 627 Ca 0.21 -0.08 0.12 0.00 -1.81 0.00 0.00 57.70 56.13 2a75 n MET 627 Cb 0.18 -1.25 0.14 0.00 -0.71 0.00 0.00 33.22 31.57 2a75 n MET 627 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 2a75 n ILE 628 N -1.73 0.08 -1.64 2.02 -5.35 -1.20 -4.98 119.36 106.56 2a75 n ILE 628 Ca -0.01 -0.08 -0.35 0.00 -0.27 0.00 0.00 62.75 62.04 2a75 n ILE 628 Cb 0.30 0.30 0.07 0.00 -1.74 0.00 0.00 39.64 38.58 2a75 n ILE 628 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2a75 s GLY 629 N -3.22 2.49 0.00 3.28 0.00 -1.26 -4.92 107.32 103.69 2a75 s GLY 629 Ca 0.08 0.93 0.28 0.00 0.00 0.00 0.00 44.72 46.01 2a75 s GLY 629 CO 0.75 1.33 1.76 -1.30 0.00 0.00 0.00 173.10 175.63 2a75 n THR 630 N -2.32 0.00 0.82 0.90 -2.24 -1.26 -5.03 114.28 105.15 2a75 n THR 630 Ca 0.14 -0.11 0.07 0.00 -2.27 0.00 0.00 64.05 61.87 2a75 n THR 630 Cb 0.50 0.14 0.39 0.00 -2.10 0.00 0.00 70.33 69.26 2a75 n THR 630 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83