#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b7r s GLU 2 N 0.00 3.66 -0.51 0.54 2.56 -1.26 -4.97 118.70 118.73 3b7r s GLU 2 Ca 0.00 0.88 -0.00 0.00 0.00 0.00 0.00 54.97 55.85 3b7r s GLU 2 Cb 0.00 -3.97 0.13 0.00 2.00 0.00 0.00 34.13 32.29 3b7r s GLU 2 CO 0.00 -1.45 0.28 -1.50 -0.56 0.00 0.00 175.26 172.03 3b7r s ILE 3 N 5.02 3.12 0.33 -3.70 1.10 -1.26 -5.10 121.20 120.71 3b7r s ILE 3 Ca 0.57 -2.77 -0.09 0.00 -0.51 0.00 0.00 60.65 57.86 3b7r s ILE 3 Cb -0.12 -3.12 -0.06 0.00 0.15 0.00 0.00 42.46 39.31 3b7r s ILE 3 CO 0.31 -0.78 0.66 0.68 -2.11 0.00 0.00 174.94 173.70 3b7r s VAL 4 N 0.28 4.88 -0.46 4.00 -7.23 -1.26 -5.02 120.40 115.60 3b7r s VAL 4 Ca 0.14 0.41 -0.16 0.00 -1.81 0.00 0.00 61.98 60.57 3b7r s VAL 4 Cb -0.22 -3.71 0.06 0.00 0.56 0.00 0.00 36.38 33.07 3b7r s VAL 4 CO -0.03 -0.37 0.40 -0.62 -0.31 0.00 0.00 175.10 174.17 3b7r s ASP 5 N -3.00 6.15 0.00 4.85 -1.08 -1.26 -4.93 116.67 117.40 3b7r s ASP 5 Ca 0.48 -1.18 0.23 0.00 -0.52 0.00 0.00 52.55 51.56 3b7r s ASP 5 Cb -0.11 -2.19 1.25 0.00 -1.46 0.00 0.00 42.92 40.42 3b7r s ASP 5 CO 0.28 -0.63 1.76 0.35 0.52 0.00 0.00 175.17 177.45 3b7r n THR 6 N 5.24 0.17 1.13 1.71 -2.24 -1.26 -1.86 114.28 117.18 3b7r n THR 6 Ca -0.11 0.04 0.12 0.00 -2.27 0.00 0.00 64.05 61.83 3b7r n THR 6 Cb 0.45 -0.67 0.19 0.00 -2.10 0.00 0.00 70.33 68.20 3b7r n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3b7r s SER 8 N -2.42 3.81 0.00 0.00 0.15 -0.78 -4.91 113.70 109.55 3b7r s SER 8 Ca 0.23 -0.26 0.24 0.00 0.70 0.00 0.00 55.95 56.86 3b7r s SER 8 Cb 0.19 -0.77 0.32 0.00 -1.71 0.00 0.00 66.02 64.05 3b7r s SER 8 CO 0.51 0.33 1.30 0.18 1.20 0.00 0.00 173.24 176.76 3b7r n LEU 9 N 2.39 1.70 -4.80 3.45 4.77 -1.26 -4.88 117.00 118.36 3b7r n LEU 9 Ca -0.17 -0.58 -0.30 0.00 -0.03 0.00 0.00 56.01 54.93 3b7r n LEU 9 Cb 0.52 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 41.65 3b7r n LEU 9 CO 0.25 0.31 0.71 0.00 -1.33 0.00 0.00 177.39 177.33 3b7r s ALA 10 N -2.44 2.36 0.21 -1.18 0.00 -1.26 -4.75 121.76 114.69 3b7r s ALA 10 Ca 0.22 -0.09 -0.32 0.00 0.00 0.00 0.00 51.96 51.77 3b7r s ALA 10 Cb 0.19 -3.14 -0.14 0.00 0.00 0.00 0.00 23.12 20.03 3b7r s ALA 10 CO 0.53 -1.59 1.42 0.43 0.00 0.00 0.00 175.76 176.55 3b7r n SER 11 N -3.36 2.68 -4.73 0.00 7.64 0.10 -4.94 113.62 111.01 3b7r n SER 11 Ca 0.07 1.13 -0.29 0.00 1.01 0.00 0.00 58.87 60.79 3b7r n SER 11 Cb 0.55 -1.40 0.13 0.00 -1.01 0.00 0.00 64.21 62.48 3b7r n SER 11 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3b7r s PRO 12 N -0.09 1.18 0.54 1.43 0.04 -1.26 -4.80 135.00 132.05 3b7r s PRO 12 Ca 0.71 0.19 0.28 0.00 0.04 0.00 0.00 61.00 62.23 3b7r s PRO 12 Cb -0.68 -1.85 1.54 0.00 0.04 0.00 0.00 34.50 33.55 3b7r s PRO 12 CO 0.47 -2.15 2.11 0.00 0.04 0.00 0.00 177.00 177.48 3b7r h ALA 13 N -1.46 1.31 0.00 8.56 0.00 -1.92 -0.59 119.26 125.17 3b7r h ALA 13 Ca -0.49 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3b7r h ALA 13 Cb 1.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3b7r h ALA 13 CO 0.60 0.11 0.00 0.66 0.00 0.00 0.00 179.25 180.63 3b7r h SER 14 N 0.00 0.00 0.00 0.00 4.64 -1.97 -3.33 113.55 112.89 3b7r h SER 14 Ca -0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.97 3b7r h SER 14 Cb 0.27 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.31 3b7r h SER 14 CO 0.01 0.00 -2.11 0.52 -0.87 0.00 0.00 176.83 174.38 3b7r n VAL 15 N -2.39 1.52 -3.62 0.95 0.31 -0.27 -4.58 118.33 110.26 3b7r n VAL 15 Ca 0.02 -0.24 -0.12 0.00 -0.01 0.00 0.00 64.34 63.99 3b7r n VAL 15 Cb 0.25 -2.00 -0.05 0.00 -0.91 0.00 0.00 33.84 31.13 3b7r n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3b7r s ARG 17 N -3.20 0.87 -0.04 0.00 0.52 -0.19 -3.96 118.95 112.96 3b7r s ARG 17 Ca -0.01 -0.09 -0.30 0.00 -0.52 0.00 0.00 55.73 54.81 3b7r s ARG 17 Cb 0.01 -0.93 -0.05 0.00 0.52 0.00 0.00 34.95 34.50 3b7r s ARG 17 CO -0.08 -0.12 1.46 0.99 0.02 0.00 0.00 175.30 177.57 3b7r s THR 18 N 1.12 3.73 -0.17 0.02 2.01 -1.26 -0.65 115.64 120.45 3b7r s THR 18 Ca -0.08 1.03 0.14 0.00 0.31 0.00 0.00 61.69 63.09 3b7r s THR 18 Cb -0.14 -3.67 -0.24 0.00 0.01 0.00 0.00 72.50 68.47 3b7r s THR 18 CO -0.01 -0.04 0.18 0.29 -0.69 0.00 0.00 174.62 174.35 3b7r n LYS 19 N 6.02 0.68 -3.66 4.92 4.76 0.67 -4.23 118.16 127.33 3b7r n LYS 19 Ca 0.14 0.09 -0.15 0.00 -2.87 0.00 0.00 58.31 55.53 3b7r n LYS 19 Cb 0.43 -1.59 -0.08 0.00 -1.84 0.00 0.00 35.03 31.96 3b7r n LYS 19 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 3b7r s HIS 20 N -2.52 -0.48 -0.10 2.13 2.46 -1.19 -1.72 115.29 113.86 3b7r s HIS 20 Ca -0.12 0.95 0.03 0.00 0.47 0.00 0.00 55.06 56.39 3b7r s HIS 20 Cb 0.07 0.24 0.01 0.00 -0.13 0.00 0.00 32.58 32.76 3b7r s HIS 20 CO 0.80 -0.43 -0.20 -1.17 -2.47 0.00 0.00 174.74 171.27 3b7r s LEU 21 N -0.74 1.96 -0.32 8.88 2.96 -0.44 -0.69 118.68 130.28 3b7r s LEU 21 Ca -0.08 -0.50 -0.04 0.00 -0.22 0.00 0.00 54.13 53.29 3b7r s LEU 21 Cb -0.03 -1.26 0.05 0.00 0.50 0.00 0.00 46.19 45.44 3b7r s LEU 21 CO 0.05 0.10 0.06 -2.28 -1.32 0.00 0.00 176.35 172.95 3b7r s HIS 22 N 0.61 3.27 -0.25 5.38 5.65 -0.16 -1.02 115.29 128.77 3b7r s HIS 22 Ca -0.14 -1.68 -0.09 0.00 0.25 0.00 0.00 55.06 53.40 3b7r s HIS 22 Cb -0.17 -2.23 -0.04 0.00 -1.18 0.00 0.00 32.58 28.96 3b7r s HIS 22 CO 0.04 -0.78 0.13 -1.17 -0.65 0.00 0.00 174.74 172.32 3b7r s LEU 23 N 1.32 3.86 -0.17 8.88 2.96 -0.16 -1.05 118.68 134.32 3b7r s LEU 23 Ca -0.03 -0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.87 3b7r s LEU 23 Cb -0.20 -2.04 0.02 0.00 0.50 0.00 0.00 46.19 44.47 3b7r s LEU 23 CO 0.01 0.02 -0.19 -0.13 -1.32 0.00 0.00 176.35 174.73 3b7r s ARG 24 N 1.34 2.84 0.13 1.98 0.52 -0.56 -0.77 118.95 124.44 3b7r s ARG 24 Ca 0.06 -0.77 -0.09 0.00 -0.52 0.00 0.00 55.73 54.41 3b7r s ARG 24 Cb -0.15 -2.47 -0.00 0.00 0.52 0.00 0.00 34.95 32.85 3b7r s ARG 24 CO 0.06 -0.22 0.25 0.00 0.02 0.00 0.00 175.30 175.41 3b7r s SER 26 N -2.92 1.78 -0.42 0.00 0.15 0.31 -0.48 113.70 112.12 3b7r s SER 26 Ca 0.11 -0.28 -0.15 0.00 0.70 0.00 0.00 55.95 56.33 3b7r s SER 26 Cb 0.04 -0.37 0.03 0.00 -1.71 0.00 0.00 66.02 64.01 3b7r s SER 26 CO -0.05 0.15 0.32 -0.69 1.20 0.00 0.00 173.24 174.17 3b7r s VAL 27 N -0.09 5.25 -0.67 4.45 1.01 -0.25 -1.63 120.40 128.48 3b7r s VAL 27 Ca 0.00 -0.74 -0.13 0.00 0.00 0.00 0.00 61.98 61.11 3b7r s VAL 27 Cb -0.08 -3.98 0.17 0.00 0.00 0.00 0.00 36.38 32.49 3b7r s VAL 27 CO 0.01 -0.37 0.60 -0.62 0.00 0.00 0.00 175.10 174.71 3b7r s ASP 28 N 1.88 6.33 0.52 3.32 -1.08 0.10 -4.69 116.67 123.06 3b7r s ASP 28 Ca 0.05 -2.28 0.28 0.00 -0.52 0.00 0.00 52.55 50.08 3b7r s ASP 28 Cb -0.20 -2.16 1.45 0.00 -1.46 0.00 0.00 42.92 40.54 3b7r s ASP 28 CO 0.09 -0.68 2.06 -0.26 0.52 0.00 0.00 175.17 176.90 3b7r h PHE 29 N 8.22 0.00 -0.56 -5.34 0.04 -1.96 0.32 116.94 117.66 3b7r h PHE 29 Ca -0.09 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.59 3b7r h PHE 29 Cb 1.06 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.19 3b7r h PHE 29 CO 0.86 0.12 0.00 1.15 -0.60 0.00 0.00 178.31 179.83 3b7r h THR 30 N 0.00 1.26 -0.01 -1.55 2.02 -1.95 -3.21 112.91 109.46 3b7r h THR 30 Ca -0.00 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.08 3b7r h THR 30 Cb 0.37 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 3b7r h THR 30 CO 0.01 0.39 -0.70 0.54 0.37 0.00 0.00 175.52 176.14 3b7r n ARG 31 N -4.19 1.02 -3.86 6.66 1.74 -1.11 -4.99 116.66 111.93 3b7r n ARG 31 Ca 0.03 -0.38 -0.28 0.00 -0.77 0.00 0.00 57.85 56.45 3b7r n ARG 31 Cb 0.33 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 3b7r n ARG 31 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3b7r n ARG 32 N -0.88 -2.56 -4.08 5.56 1.74 0.07 -4.67 116.66 111.84 3b7r n ARG 32 Ca 0.05 0.42 -0.14 0.00 -0.77 0.00 0.00 57.85 57.42 3b7r n ARG 32 Cb 0.35 -4.34 -0.12 0.00 -1.02 0.00 0.00 32.46 27.33 3b7r n ARG 32 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3b7r s THR 33 N -3.77 0.59 -0.21 0.55 -4.23 -0.99 -3.25 115.64 104.32 3b7r s THR 33 Ca 0.18 -1.07 -0.06 0.00 -1.18 0.00 0.00 61.69 59.55 3b7r s THR 33 Cb -0.07 -0.64 -0.03 0.00 1.34 0.00 0.00 72.50 73.10 3b7r s THR 33 CO 0.88 -0.35 0.03 -0.22 -0.54 0.00 0.00 174.62 174.42 3b7r s LEU 34 N -1.55 3.39 0.06 4.79 0.20 -1.26 -0.72 118.68 123.59 3b7r s LEU 34 Ca -0.09 -0.16 0.09 0.00 0.69 0.00 0.00 54.13 54.66 3b7r s LEU 34 Cb -0.10 -1.87 -0.03 0.00 -0.43 0.00 0.00 46.19 43.76 3b7r s LEU 34 CO 0.01 0.05 -0.25 0.42 -0.29 0.00 0.00 176.35 176.29 3b7r s THR 35 N 1.10 2.29 -2.64 3.68 -4.23 -0.64 -1.00 115.64 114.19 3b7r s THR 35 Ca 0.03 -1.43 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 3b7r s THR 35 Cb -0.14 -1.93 0.00 0.00 1.34 0.00 0.00 72.50 71.76 3b7r s THR 35 CO 0.02 0.30 0.00 0.61 -0.54 0.00 0.00 174.62 175.01 3b7r n GLY 36 N 1.55 -0.60 3.12 3.99 0.00 -0.48 -0.53 105.19 112.23 3b7r n GLY 36 Ca -0.17 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 44.94 3b7r n GLY 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3b7r s THR 37 N -3.61 1.29 -0.33 2.61 -4.23 0.09 -1.14 115.64 110.31 3b7r s THR 37 Ca 0.00 -0.66 -0.02 0.00 -1.18 0.00 0.00 61.69 59.84 3b7r s THR 37 Cb 0.00 -1.11 0.07 0.00 1.34 0.00 0.00 72.50 72.80 3b7r s THR 37 CO 0.00 0.37 0.06 0.00 -0.54 0.00 0.00 174.62 174.52 3b7r s ALA 38 N -0.04 2.92 -0.50 3.99 0.00 0.06 -1.49 121.76 126.70 3b7r s ALA 38 Ca -0.01 -2.03 -0.21 0.00 0.00 0.00 0.00 51.96 49.71 3b7r s ALA 38 Cb -0.10 -2.09 0.04 0.00 0.00 0.00 0.00 23.12 20.98 3b7r s ALA 38 CO 0.01 -1.45 0.73 0.00 0.00 0.00 0.00 175.76 175.05 3b7r s ALA 39 N 1.20 3.31 -0.22 0.00 0.00 -0.21 -0.64 121.76 125.19 3b7r s ALA 39 Ca -0.00 -1.45 -0.12 0.00 0.00 0.00 0.00 51.96 50.38 3b7r s ALA 39 Cb -0.21 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.41 3b7r s ALA 39 CO -0.02 -2.07 0.24 -0.51 0.00 0.00 0.00 175.76 173.40 3b7r s LEU 40 N 3.09 4.13 -0.36 0.00 1.43 0.52 -0.99 118.68 126.50 3b7r s LEU 40 Ca 0.22 0.26 -0.22 0.00 -1.03 0.00 0.00 54.13 53.36 3b7r s LEU 40 Cb -0.16 -2.25 0.01 0.00 0.03 0.00 0.00 46.19 43.82 3b7r s LEU 40 CO 0.16 0.02 0.70 -0.89 0.23 0.00 0.00 176.35 176.57 3b7r s THR 41 N 1.12 4.82 -0.09 5.49 2.01 0.13 -0.82 115.64 128.30 3b7r s THR 41 Ca 0.12 0.71 0.04 0.00 0.31 0.00 0.00 61.69 62.87 3b7r s THR 41 Cb -0.14 -4.14 -0.01 0.00 0.01 0.00 0.00 72.50 68.22 3b7r s THR 41 CO 0.05 -0.38 -0.23 -0.69 -0.69 0.00 0.00 174.62 172.69 3b7r s VAL 42 N 2.89 2.22 -0.25 3.82 1.01 -0.20 -0.24 120.40 129.65 3b7r s VAL 42 Ca 0.28 -0.98 -0.08 0.00 0.00 0.00 0.00 61.98 61.19 3b7r s VAL 42 Cb -0.14 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 3b7r s VAL 42 CO 0.16 0.56 0.08 -1.58 0.00 0.00 0.00 175.10 174.32 3b7r s GLN 43 N 0.11 3.71 0.35 2.72 0.74 0.18 -1.53 119.66 125.94 3b7r s GLN 43 Ca -0.11 -0.45 -0.29 0.00 0.05 0.00 0.00 55.36 54.56 3b7r s GLN 43 Cb -0.16 -3.35 -0.11 0.00 1.10 0.00 0.00 33.01 30.49 3b7r s GLN 43 CO 0.06 -0.15 1.44 0.45 -0.55 0.00 0.00 175.29 176.54 3b7r s SER 44 N 1.53 6.50 0.00 6.67 0.15 -0.05 -1.02 113.70 127.47 3b7r s SER 44 Ca 0.06 2.91 0.16 0.00 0.70 0.00 0.00 55.95 59.77 3b7r s SER 44 Cb -0.15 -2.66 0.32 0.00 -1.71 0.00 0.00 66.02 61.82 3b7r s SER 44 CO 0.04 -0.76 1.23 0.00 1.20 0.00 0.00 173.24 174.95 3b7r n GLN 45 N 0.82 2.19 -4.18 5.44 1.13 0.02 -0.26 117.38 122.53 3b7r n GLN 45 Ca 0.02 -1.96 -0.17 0.00 -1.94 0.00 0.00 57.00 52.94 3b7r n GLN 45 Cb 0.40 -1.36 -0.11 0.00 0.11 0.00 0.00 30.24 29.28 3b7r n GLN 45 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3b7r s GLU 46 N -1.13 0.86 0.40 -1.09 2.02 -1.23 -4.82 118.70 113.71 3b7r s GLU 46 Ca 0.28 -1.08 -0.25 0.00 0.02 0.00 0.00 54.97 53.94 3b7r s GLU 46 Cb 0.16 -0.73 -0.08 0.00 0.10 0.00 0.00 34.13 33.57 3b7r s GLU 46 CO 0.22 0.14 1.17 0.34 0.02 0.00 0.00 175.26 177.15 3b7r s ASP 47 N -2.12 6.51 -1.32 -0.19 -1.08 -1.26 -2.77 116.67 114.44 3b7r s ASP 47 Ca 0.03 2.35 -0.06 0.00 -0.52 0.00 0.00 52.55 54.35 3b7r s ASP 47 Cb -0.07 -2.61 0.01 0.00 -1.46 0.00 0.00 42.92 38.79 3b7r s ASP 47 CO 0.02 -0.68 1.06 -3.20 0.52 0.00 0.00 175.17 172.88 3b7r n ASN 48 N 0.06 -4.23 -4.66 -0.34 5.15 -0.35 -4.92 115.26 105.97 3b7r n ASN 48 Ca 0.04 -0.62 -0.43 0.00 -0.60 0.00 0.00 54.58 52.97 3b7r n ASN 48 Cb 0.46 -4.86 -0.02 0.00 -0.53 0.00 0.00 39.78 34.84 3b7r n ASN 48 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3b7r s LEU 49 N -6.92 4.08 -0.00 1.20 2.96 -0.56 -4.74 118.68 114.69 3b7r s LEU 49 Ca 0.34 1.33 0.05 0.00 -0.22 0.00 0.00 54.13 55.63 3b7r s LEU 49 Cb -0.15 -3.53 -0.06 0.00 0.50 0.00 0.00 46.19 42.95 3b7r s LEU 49 CO 0.75 -0.69 0.20 0.54 -1.32 0.00 0.00 176.35 175.83 3b7r n ARG 50 N 6.37 3.99 -3.75 1.98 1.74 -1.26 -1.31 116.66 124.42 3b7r n ARG 50 Ca 0.12 -0.01 -0.10 0.00 -0.77 0.00 0.00 57.85 57.09 3b7r n ARG 50 Cb 0.46 -0.84 -0.05 0.00 -1.02 0.00 0.00 32.46 31.01 3b7r n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3b7r s SER 51 N -1.78 -0.19 0.19 0.55 1.04 -1.26 -0.78 113.70 111.47 3b7r s SER 51 Ca 0.01 -0.50 -0.14 0.00 0.48 0.00 0.00 55.95 55.79 3b7r s SER 51 Cb 0.04 0.52 0.01 0.00 0.10 0.00 0.00 66.02 66.69 3b7r s SER 51 CO 0.22 -0.96 0.44 -1.48 0.98 0.00 0.00 173.24 172.44 3b7r s LEU 52 N -2.87 0.40 -0.03 2.42 0.05 -0.84 -4.97 118.68 112.84 3b7r s LEU 52 Ca 0.09 -0.65 0.06 0.00 0.05 0.00 0.00 54.13 53.67 3b7r s LEU 52 Cb 0.01 1.79 -0.01 0.00 -2.05 0.00 0.00 46.19 45.93 3b7r s LEU 52 CO -0.05 -1.01 -0.20 -0.69 -0.55 0.00 0.00 176.35 173.85 3b7r s VAL 53 N -3.92 1.59 0.23 1.48 1.01 -1.26 -0.27 120.40 119.26 3b7r s VAL 53 Ca 0.13 -0.83 0.10 0.00 0.00 0.00 0.00 61.98 61.38 3b7r s VAL 53 Cb 0.00 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 3b7r s VAL 53 CO -0.01 0.45 -0.13 -0.76 0.00 0.00 0.00 175.10 174.66 3b7r s LEU 54 N -0.26 2.83 0.28 3.92 1.43 0.15 -0.72 118.68 126.31 3b7r s LEU 54 Ca 0.03 -0.76 -0.28 0.00 -1.03 0.00 0.00 54.13 52.08 3b7r s LEU 54 Cb -0.10 -1.44 -0.09 0.00 0.03 0.00 0.00 46.19 44.59 3b7r s LEU 54 CO 0.01 0.07 0.97 -1.81 0.23 0.00 0.00 176.35 175.81 3b7r s ASP 55 N -3.17 7.44 0.08 2.29 1.01 0.99 -0.53 116.67 124.78 3b7r s ASP 55 Ca 0.27 1.95 -0.06 0.00 0.71 0.00 0.00 52.55 55.42 3b7r s ASP 55 Cb -0.07 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.24 3b7r s ASP 55 CO 0.15 0.00 0.10 0.42 0.21 0.00 0.00 175.17 176.06 3b7r s THR 56 N -1.37 0.17 -0.22 -1.27 -4.23 -1.00 -2.61 115.64 105.11 3b7r s THR 56 Ca 0.46 -1.44 -0.04 0.00 -1.18 0.00 0.00 61.69 59.49 3b7r s THR 56 Cb -0.24 -1.43 0.12 0.00 1.34 0.00 0.00 72.50 72.29 3b7r s THR 56 CO 0.30 -0.78 0.38 -0.75 -0.54 0.00 0.00 174.62 173.23 3b7r s LYS 57 N -3.89 0.33 -1.50 3.99 2.20 -0.04 -0.97 119.74 119.86 3b7r s LYS 57 Ca 0.06 0.69 -0.06 0.00 -0.36 0.00 0.00 55.97 56.30 3b7r s LYS 57 Cb 0.06 -0.22 0.02 0.00 -1.51 0.00 0.00 37.83 36.18 3b7r s LYS 57 CO -0.10 -0.51 0.65 -0.25 -0.36 0.00 0.00 175.35 174.78 3b7r n ASP 58 N 5.37 -5.75 -4.87 1.43 8.00 -1.26 -4.21 116.55 115.26 3b7r n ASP 58 Ca -0.05 -0.34 -0.37 0.00 0.71 0.00 0.00 54.79 54.74 3b7r n ASP 58 Cb 0.50 -4.65 -0.06 0.00 -0.02 0.00 0.00 41.12 36.89 3b7r n ASP 58 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3b7r s LEU 59 N -6.73 4.41 -0.28 0.64 1.43 -1.26 -2.70 118.68 114.18 3b7r s LEU 59 Ca 0.35 0.58 -0.16 0.00 -1.03 0.00 0.00 54.13 53.87 3b7r s LEU 59 Cb -0.16 -2.24 -0.03 0.00 0.03 0.00 0.00 46.19 43.79 3b7r s LEU 59 CO 0.44 0.38 0.40 -0.89 0.23 0.00 0.00 176.35 176.91 3b7r s THR 60 N -1.07 5.14 -0.20 5.49 2.01 -0.24 -4.98 115.64 121.80 3b7r s THR 60 Ca 0.18 0.53 -0.17 0.00 0.31 0.00 0.00 61.69 62.54 3b7r s THR 60 Cb -0.13 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.59 3b7r s THR 60 CO 0.07 0.08 0.45 -0.63 -0.69 0.00 0.00 174.62 173.91 3b7r s ILE 61 N 2.13 5.16 -0.17 1.82 -1.09 -1.26 -1.42 121.20 126.37 3b7r s ILE 61 Ca 0.16 0.82 -0.21 0.00 -2.23 0.00 0.00 60.65 59.19 3b7r s ILE 61 Cb -0.16 -3.78 -0.22 0.00 -1.58 0.00 0.00 42.46 36.72 3b7r s ILE 61 CO 0.10 0.22 0.39 -0.08 -1.23 0.00 0.00 174.94 174.35 3b7r h GLU 62 N 7.38 0.06 -2.31 2.79 4.81 -1.24 -3.49 114.58 122.58 3b7r h GLU 62 Ca -0.35 -0.11 0.17 0.00 -0.13 0.00 0.00 59.36 58.94 3b7r h GLU 62 Cb 1.16 0.04 -0.09 0.00 0.63 0.00 0.00 28.75 30.49 3b7r h GLU 62 CO 0.73 1.05 0.49 -1.59 -0.73 0.00 0.00 179.01 178.96 3b7r s LYS 63 N -2.37 1.11 -0.07 1.92 -2.85 -1.22 -5.03 119.74 111.23 3b7r s LYS 63 Ca -0.25 -0.58 0.00 0.00 -1.00 0.00 0.00 55.97 54.14 3b7r s LYS 63 Cb 0.04 0.40 0.02 0.00 -2.06 0.00 0.00 37.83 36.23 3b7r s LYS 63 CO 0.65 -0.51 -0.06 0.08 0.10 0.00 0.00 175.35 175.62 3b7r s VAL 64 N -3.24 0.76 -0.09 1.79 1.01 -1.26 -1.09 120.40 118.29 3b7r s VAL 64 Ca 0.11 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 61.93 3b7r s VAL 64 Cb -0.01 -0.79 -0.00 0.00 0.00 0.00 0.00 36.38 35.58 3b7r s VAL 64 CO 0.00 0.30 -0.24 -0.69 0.00 0.00 0.00 175.10 174.47 3b7r s VAL 65 N 1.27 2.01 -0.02 2.92 1.01 -0.04 -0.64 120.40 126.92 3b7r s VAL 65 Ca -0.05 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 60.94 3b7r s VAL 65 Cb -0.14 -1.74 0.01 0.00 0.00 0.00 0.00 36.38 34.51 3b7r s VAL 65 CO -0.02 0.55 -0.03 -0.63 0.00 0.00 0.00 175.10 174.97 3b7r s ILE 66 N 0.30 0.29 -1.43 2.22 1.01 -0.67 -1.11 121.20 121.81 3b7r s ILE 66 Ca -0.17 -0.08 -0.10 0.00 0.00 0.00 0.00 60.65 60.31 3b7r s ILE 66 Cb -0.17 -0.30 0.06 0.00 0.01 0.00 0.00 42.46 42.05 3b7r s ILE 66 CO 0.08 0.12 0.67 0.59 0.00 0.00 0.00 174.94 176.41 3b7r n ASN 67 N 3.50 -4.64 0.00 3.58 3.02 -1.26 -2.11 115.26 117.34 3b7r n ASN 67 Ca -0.19 -0.48 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 3b7r n ASN 67 Cb 0.55 -3.77 0.00 0.00 -0.61 0.00 0.00 39.78 35.95 3b7r n ASN 67 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3b7r n GLY 68 N -1.42 0.51 3.19 7.41 0.00 -1.26 -5.01 105.19 108.61 3b7r n GLY 68 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 3b7r n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3b7r s GLN 69 N -0.40 0.99 0.37 1.61 -1.52 -0.90 -5.11 119.66 114.70 3b7r s GLN 69 Ca 0.00 -0.90 -0.27 0.00 -1.95 0.00 0.00 55.36 52.24 3b7r s GLN 69 Cb 0.00 -1.05 -0.09 0.00 -0.22 0.00 0.00 33.01 31.64 3b7r s GLN 69 CO 0.00 0.25 1.30 -1.21 -0.25 0.00 0.00 175.29 175.38 3b7r s GLU 70 N -1.43 4.16 0.32 2.91 2.02 -1.26 -1.67 118.70 123.74 3b7r s GLU 70 Ca 0.02 2.17 0.09 0.00 0.02 0.00 0.00 54.97 57.27 3b7r s GLU 70 Cb -0.09 -2.91 -0.06 0.00 0.10 0.00 0.00 34.13 31.17 3b7r s GLU 70 CO 0.02 -0.34 -0.10 0.14 0.02 0.00 0.00 175.26 175.00 3b7r s VAL 71 N -1.21 2.11 0.33 2.63 -7.23 0.19 -4.91 120.40 112.31 3b7r s VAL 71 Ca 0.53 -2.21 -0.27 0.00 -1.81 0.00 0.00 61.98 58.22 3b7r s VAL 71 Cb -0.39 -2.54 -0.09 0.00 0.56 0.00 0.00 36.38 33.92 3b7r s VAL 71 CO 0.50 -0.26 1.10 -0.54 -0.31 0.00 0.00 175.10 175.60 3b7r s LYS 72 N -3.63 4.42 0.20 4.82 3.01 -1.26 -4.55 119.74 122.75 3b7r s LYS 72 Ca 0.31 1.74 -0.09 0.00 -1.01 0.00 0.00 55.97 56.92 3b7r s LYS 72 Cb 0.02 -2.93 -0.01 0.00 -1.01 0.00 0.00 37.83 33.89 3b7r s LYS 72 CO 0.15 0.03 0.33 1.52 0.51 0.00 0.00 175.35 177.89 3b7r s TYR 73 N -1.34 0.52 -0.10 3.18 -0.85 -1.26 -1.25 117.35 116.25 3b7r s TYR 73 Ca 0.50 -0.85 -0.09 0.00 -0.52 0.00 0.00 57.07 56.11 3b7r s TYR 73 Cb -0.29 -0.05 0.03 0.00 0.38 0.00 0.00 41.96 42.03 3b7r s TYR 73 CO 0.37 -0.81 0.27 0.00 -1.52 0.00 0.00 175.55 173.86 3b7r s ALA 74 N -4.02 -0.67 -0.19 9.51 0.00 -0.23 -4.99 121.76 121.18 3b7r s ALA 74 Ca 0.23 0.78 -0.16 0.00 0.00 0.00 0.00 51.96 52.81 3b7r s ALA 74 Cb 0.02 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 3b7r s ALA 74 CO 0.06 -0.13 0.40 -0.51 0.00 0.00 0.00 175.76 175.57 3b7r s LEU 75 N 0.20 4.17 0.97 0.00 1.43 -1.26 -1.03 118.68 123.16 3b7r s LEU 75 Ca -0.00 0.54 -0.15 0.00 -1.03 0.00 0.00 54.13 53.48 3b7r s LEU 75 Cb -0.02 -2.52 0.18 0.00 0.03 0.00 0.00 46.19 43.86 3b7r s LEU 75 CO -0.00 -0.06 1.21 -0.83 0.23 0.00 0.00 176.35 176.90 3b7r s GLY 76 N 0.96 1.65 0.53 -3.19 0.00 0.59 -4.98 107.32 102.88 3b7r s GLY 76 Ca 0.19 -0.86 -0.20 0.00 0.00 0.00 0.00 44.72 43.85 3b7r s GLY 76 CO 0.08 -0.18 1.13 -1.83 0.00 0.00 0.00 173.10 172.29 3b7r s GLU 77 N -5.57 3.41 0.33 2.90 -1.05 -1.26 -4.44 118.70 113.02 3b7r s GLU 77 Ca 0.68 1.61 -0.29 0.00 -0.15 0.00 0.00 54.97 56.83 3b7r s GLU 77 Cb -0.09 -2.04 -0.11 0.00 -0.44 0.00 0.00 34.13 31.45 3b7r s GLU 77 CO 0.53 -0.80 1.52 0.50 0.95 0.00 0.00 175.26 177.96 3b7r s ARG 78 N -3.24 4.13 -0.72 -4.83 3.52 -1.26 -4.52 118.95 112.04 3b7r s ARG 78 Ca 0.72 2.54 0.04 0.00 -0.13 0.00 0.00 55.73 58.90 3b7r s ARG 78 Cb -0.24 -3.00 0.28 0.00 -1.56 0.00 0.00 34.95 30.43 3b7r s ARG 78 CO 0.27 -0.55 0.98 1.04 -0.81 0.00 0.00 175.30 176.22 3b7r n GLN 79 N 1.29 3.18 0.00 5.12 6.02 0.88 -4.99 117.38 128.90 3b7r n GLN 79 Ca 0.04 -4.71 0.00 0.00 -0.01 0.00 0.00 57.00 52.33 3b7r n GLN 79 Cb 0.39 -2.31 0.00 0.00 1.02 0.00 0.00 30.24 29.34 3b7r n GLN 79 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3b7r n SER 80 N 0.59 0.00 0.12 1.08 2.88 -1.26 -1.69 113.62 115.34 3b7r n SER 80 Ca 0.31 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.97 3b7r n SER 80 Cb 0.38 0.00 0.47 0.00 -0.75 0.00 0.00 64.21 64.31 3b7r n SER 80 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3b7r n TYR 81 N 14.00 0.77 0.31 0.66 4.11 -1.26 -2.11 117.16 133.65 3b7r n TYR 81 Ca 0.00 0.29 0.15 0.00 -0.00 0.00 0.00 57.90 58.34 3b7r n TYR 81 Cb 0.00 -0.96 0.51 0.00 -0.00 0.00 0.00 39.34 38.89 3b7r n TYR 81 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.86 177.73 3b7r h LYS 82 N 0.00 0.00 0.00 -3.48 1.57 -1.68 -3.50 116.57 109.49 3b7r h LYS 82 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3b7r h LYS 82 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 3b7r h LYS 82 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 3b7r n GLY 83 N 0.38 -0.11 3.07 3.86 0.00 -0.89 -4.68 105.19 106.81 3b7r n GLY 83 Ca 0.02 -1.19 -0.27 0.00 0.00 0.00 0.00 46.02 44.58 3b7r n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3b7r s SER 84 N -4.00 2.20 0.30 1.61 0.01 -0.15 -0.08 113.70 113.59 3b7r s SER 84 Ca 0.00 -0.38 -0.29 0.00 1.31 0.00 0.00 55.95 56.59 3b7r s SER 84 Cb 0.00 -1.00 -0.10 0.00 0.21 0.00 0.00 66.02 65.13 3b7r s SER 84 CO 0.00 0.05 1.11 -2.16 0.41 0.00 0.00 173.24 172.65 3b7r s PRO 85 N 0.69 4.57 -0.30 12.44 0.04 -1.26 -2.37 135.00 148.80 3b7r s PRO 85 Ca -0.13 1.81 -0.02 0.00 0.04 0.00 0.00 61.00 62.69 3b7r s PRO 85 Cb -0.16 -3.11 0.05 0.00 0.04 0.00 0.00 34.50 31.32 3b7r s PRO 85 CO 0.04 0.14 0.01 1.41 0.04 0.00 0.00 177.00 178.63 3b7r s MET 86 N -1.58 2.43 -0.14 4.56 1.75 0.31 -0.30 119.30 126.33 3b7r s MET 86 Ca 0.46 -1.27 -0.16 0.00 -1.25 0.00 0.00 55.69 53.47 3b7r s MET 86 Cb -0.32 -3.19 -0.04 0.00 2.84 0.00 0.00 34.83 34.12 3b7r s MET 86 CO 0.41 -0.63 0.37 -2.00 -0.65 0.00 0.00 175.02 172.52 3b7r s GLU 87 N 1.26 4.28 -0.11 4.11 2.12 -0.19 -0.68 118.70 129.48 3b7r s GLU 87 Ca -0.05 0.25 0.01 0.00 0.36 0.00 0.00 54.97 55.54 3b7r s GLU 87 Cb -0.20 -3.42 -0.01 0.00 0.26 0.00 0.00 34.13 30.76 3b7r s GLU 87 CO -0.01 0.22 -0.15 0.42 -0.54 0.00 0.00 175.26 175.20 3b7r s ILE 88 N 0.48 2.85 -0.39 -3.70 1.01 0.63 -1.06 121.20 121.03 3b7r s ILE 88 Ca 0.21 -0.74 -0.20 0.00 0.00 0.00 0.00 60.65 59.91 3b7r s ILE 88 Cb -0.14 -2.17 0.01 0.00 0.01 0.00 0.00 42.46 40.17 3b7r s ILE 88 CO 0.07 0.54 0.63 -0.44 0.00 0.00 0.00 174.94 175.74 3b7r s SER 89 N 0.21 6.38 0.29 3.58 0.01 -0.38 -1.99 113.70 121.80 3b7r s SER 89 Ca -0.10 -0.06 -0.29 0.00 1.31 0.00 0.00 55.95 56.82 3b7r s SER 89 Cb -0.16 -2.32 -0.10 0.00 0.21 0.00 0.00 66.02 63.66 3b7r s SER 89 CO 0.06 -0.67 1.10 -0.76 0.41 0.00 0.00 173.24 173.38 3b7r s LEU 90 N 2.75 4.52 0.35 2.44 1.43 0.04 -4.37 118.68 125.83 3b7r s LEU 90 Ca 0.23 2.27 0.17 0.00 -1.03 0.00 0.00 54.13 55.78 3b7r s LEU 90 Cb -0.14 -3.66 0.53 0.00 0.03 0.00 0.00 46.19 42.94 3b7r s LEU 90 CO 0.17 -0.18 1.66 1.55 0.23 0.00 0.00 176.35 179.77 3b7r h PRO 91 N 3.71 0.00 -3.76 1.29 0.13 -1.96 -3.43 132.00 127.97 3b7r h PRO 91 Ca -0.47 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.32 3b7r h PRO 91 Cb 1.21 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 32.01 3b7r h PRO 91 CO 0.66 0.43 -0.75 0.42 -0.23 0.00 0.00 178.00 178.53 3b7r s ILE 92 N -3.45 0.19 0.28 -3.56 1.01 -1.26 -5.12 121.20 109.28 3b7r s ILE 92 Ca 0.01 0.06 -0.30 0.00 0.00 0.00 0.00 60.65 60.41 3b7r s ILE 92 Cb 0.10 -0.26 -0.11 0.00 0.01 0.00 0.00 42.46 42.20 3b7r s ILE 92 CO 0.70 0.13 1.56 0.00 0.00 0.00 0.00 174.94 177.34 3b7r s ALA 93 N 0.87 3.73 -0.03 9.38 0.00 -1.26 -4.89 121.76 129.55 3b7r s ALA 93 Ca -0.09 1.51 -0.07 0.00 0.00 0.00 0.00 51.96 53.32 3b7r s ALA 93 Cb -0.12 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 19.33 3b7r s ALA 93 CO -0.01 -0.92 0.23 -0.51 0.00 0.00 0.00 175.76 174.54 3b7r s LEU 94 N -0.39 4.38 0.68 0.00 1.43 -0.43 -4.83 118.68 119.53 3b7r s LEU 94 Ca 0.63 0.53 -0.11 0.00 -1.03 0.00 0.00 54.13 54.15 3b7r s LEU 94 Cb -0.46 -2.48 -0.00 0.00 0.03 0.00 0.00 46.19 43.27 3b7r s LEU 94 CO 0.46 0.31 1.06 -0.44 0.23 0.00 0.00 176.35 177.96 3b7r s SER 95 N -1.49 5.61 0.31 2.29 0.01 -1.26 -1.21 113.70 117.95 3b7r s SER 95 Ca 0.23 1.46 -0.30 0.00 1.31 0.00 0.00 55.95 58.66 3b7r s SER 95 Cb -0.13 -2.38 -0.11 0.00 0.21 0.00 0.00 66.02 63.61 3b7r s SER 95 CO 0.13 -1.28 1.60 1.17 0.41 0.00 0.00 173.24 175.27 3b7r n LYS 96 N -3.01 2.75 -0.72 12.44 4.81 -1.11 -1.68 118.16 131.64 3b7r n LYS 96 Ca 0.07 0.97 0.00 0.00 -0.87 0.00 0.00 58.31 58.48 3b7r n LYS 96 Cb 0.54 -2.76 0.00 0.00 0.02 0.00 0.00 35.03 32.83 3b7r n LYS 96 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3b7r n ASN 97 N 1.92 0.00 -4.77 3.14 3.02 0.64 -4.98 115.26 114.23 3b7r n ASN 97 Ca 0.07 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.22 3b7r n ASN 97 Cb 0.37 -0.73 -0.03 0.00 -0.61 0.00 0.00 39.78 38.79 3b7r n ASN 97 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3b7r s GLN 98 N -0.26 4.36 -0.07 3.52 0.74 -0.67 -4.69 119.66 122.59 3b7r s GLN 98 Ca 0.00 1.96 0.03 0.00 0.05 0.00 0.00 55.36 57.40 3b7r s GLN 98 Cb 0.00 -2.99 -0.02 0.00 1.10 0.00 0.00 33.01 31.10 3b7r s GLN 98 CO 0.00 -0.09 -0.13 -1.21 -0.55 0.00 0.00 175.29 173.30 3b7r s GLU 99 N -1.83 2.69 0.24 1.67 2.02 -1.26 -0.87 118.70 121.35 3b7r s GLU 99 Ca 0.50 -0.68 0.03 0.00 0.02 0.00 0.00 54.97 54.84 3b7r s GLU 99 Cb -0.34 -2.44 -0.05 0.00 0.10 0.00 0.00 34.13 31.39 3b7r s GLU 99 CO 0.44 0.55 0.03 0.96 0.02 0.00 0.00 175.26 177.26 3b7r s ILE 100 N -0.54 0.93 -0.17 -1.63 -4.36 -0.58 -4.97 121.20 109.88 3b7r s ILE 100 Ca 0.07 -2.02 -0.03 0.00 -0.26 0.00 0.00 60.65 58.42 3b7r s ILE 100 Cb -0.12 -2.45 -0.02 0.00 1.25 0.00 0.00 42.46 41.13 3b7r s ILE 100 CO 0.01 -0.23 -0.06 -0.69 0.24 0.00 0.00 174.94 174.22 3b7r s VAL 101 N -3.49 3.56 -0.26 8.37 1.01 -1.26 -1.03 120.40 127.30 3b7r s VAL 101 Ca 0.31 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 3b7r s VAL 101 Cb 0.07 -2.56 0.03 0.00 0.00 0.00 0.00 36.38 33.91 3b7r s VAL 101 CO 0.10 0.48 -0.04 -0.63 0.00 0.00 0.00 175.10 175.01 3b7r s ILE 102 N 0.67 3.00 -0.42 2.22 1.01 -0.00 -4.50 121.20 123.18 3b7r s ILE 102 Ca -0.03 -1.01 -0.13 0.00 0.00 0.00 0.00 60.65 59.47 3b7r s ILE 102 Cb -0.15 -2.54 0.04 0.00 0.01 0.00 0.00 42.46 39.82 3b7r s ILE 102 CO 0.02 0.17 0.29 -0.70 0.00 0.00 0.00 174.94 174.72 3b7r s GLU 103 N 1.34 2.90 -0.21 2.79 2.12 -0.27 -0.36 118.70 127.01 3b7r s GLU 103 Ca 0.00 -1.16 -0.08 0.00 0.36 0.00 0.00 54.97 54.09 3b7r s GLU 103 Cb -0.17 -3.93 -0.04 0.00 0.26 0.00 0.00 34.13 30.25 3b7r s GLU 103 CO -0.03 -0.82 0.09 0.42 -0.54 0.00 0.00 175.26 174.37 3b7r s ILE 104 N 1.61 4.86 -0.25 -3.70 1.01 0.19 -0.86 121.20 124.06 3b7r s ILE 104 Ca 0.04 -0.00 -0.16 0.00 0.00 0.00 0.00 60.65 60.52 3b7r s ILE 104 Cb -0.21 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.01 3b7r s ILE 104 CO 0.08 0.41 0.43 -0.44 0.00 0.00 0.00 174.94 175.42 3b7r s SER 105 N 0.73 6.36 0.21 3.58 0.01 -0.25 -0.76 113.70 123.59 3b7r s SER 105 Ca 0.05 0.42 -0.05 0.00 1.31 0.00 0.00 55.95 57.67 3b7r s SER 105 Cb -0.13 -2.24 -0.03 0.00 0.21 0.00 0.00 66.02 63.83 3b7r s SER 105 CO 0.02 -0.20 0.26 0.72 0.41 0.00 0.00 173.24 174.44 3b7r s PHE 106 N 2.03 0.85 -0.09 2.43 -0.71 -0.29 -0.64 117.98 121.55 3b7r s PHE 106 Ca 0.18 -1.13 -0.06 0.00 -1.04 0.00 0.00 56.93 54.88 3b7r s PHE 106 Cb -0.16 -0.28 0.03 0.00 -1.21 0.00 0.00 43.02 41.41 3b7r s PHE 106 CO 0.09 -0.76 0.22 -2.00 -1.34 0.00 0.00 175.22 171.43 3b7r s GLU 107 N -4.10 0.22 0.70 1.99 2.12 -0.51 -1.38 118.70 117.74 3b7r s GLU 107 Ca 0.32 0.40 -0.10 0.00 0.36 0.00 0.00 54.97 55.95 3b7r s GLU 107 Cb 0.04 0.01 0.03 0.00 0.26 0.00 0.00 34.13 34.47 3b7r s GLU 107 CO 0.10 -0.09 1.06 0.95 -0.54 0.00 0.00 175.26 176.74 3b7r s THR 108 N 0.63 3.17 0.13 -1.70 -4.23 -0.17 -1.08 115.64 112.39 3b7r s THR 108 Ca -0.04 0.23 -0.12 0.00 -1.18 0.00 0.00 61.69 60.57 3b7r s THR 108 Cb -0.06 -3.35 -0.07 0.00 1.34 0.00 0.00 72.50 70.37 3b7r s THR 108 CO -0.04 -0.43 0.49 -0.55 -0.54 0.00 0.00 174.62 173.56 3b7r s SER 109 N -4.40 6.74 0.56 3.99 0.15 -1.10 -4.54 113.70 115.10 3b7r s SER 109 Ca 0.58 0.96 0.28 0.00 0.70 0.00 0.00 55.95 58.47 3b7r s SER 109 Cb -0.11 -2.24 1.47 0.00 -1.71 0.00 0.00 66.02 63.43 3b7r s SER 109 CO 0.49 0.11 1.95 -0.65 1.20 0.00 0.00 173.24 176.34 3b7r h PRO 110 N 3.53 0.00 -0.24 5.44 0.11 -1.82 0.11 132.00 139.12 3b7r h PRO 110 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3b7r h PRO 110 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3b7r h PRO 110 CO 0.66 0.00 0.00 0.36 -0.21 0.00 0.00 178.00 178.81 3b7r n LYS 111 N -4.03 1.62 -1.57 1.05 2.85 -1.26 -4.93 118.16 111.90 3b7r n LYS 111 Ca 0.10 -0.96 -0.61 0.00 -1.05 0.00 0.00 58.31 55.79 3b7r n LYS 111 Cb 0.67 -1.25 -0.09 0.00 -0.65 0.00 0.00 35.03 33.71 3b7r n LYS 111 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 3b7r n SER 112 N 0.25 0.82 0.08 -5.58 2.88 0.02 -4.82 113.62 107.27 3b7r n SER 112 Ca 0.11 1.10 0.10 0.00 -1.33 0.00 0.00 58.87 58.85 3b7r n SER 112 Cb 0.24 -0.83 0.43 0.00 -0.75 0.00 0.00 64.21 63.30 3b7r n SER 112 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3b7r n SER 113 N 3.09 0.42 0.20 -3.46 3.41 -1.26 -2.26 113.62 113.77 3b7r n SER 113 Ca 0.26 0.60 0.10 0.00 -0.26 0.00 0.00 58.87 59.58 3b7r n SER 113 Cb -0.02 -0.69 0.14 0.00 -0.26 0.00 0.00 64.21 63.38 3b7r n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3b7r h ALA 114 N 2.36 0.93 -4.31 7.33 0.00 -1.82 -3.43 119.26 120.33 3b7r h ALA 114 Ca 0.00 -0.08 -0.70 0.00 0.00 0.00 0.00 54.91 54.13 3b7r h ALA 114 Cb 0.33 -0.01 -0.27 0.00 0.00 0.00 0.00 17.79 17.84 3b7r h ALA 114 CO 0.00 0.11 -0.88 -0.51 0.00 0.00 0.00 179.25 177.97 3b7r s LEU 115 N -6.23 2.18 -0.09 0.00 1.43 -0.96 -0.41 118.68 114.61 3b7r s LEU 115 Ca 0.06 -0.57 0.03 0.00 -1.03 0.00 0.00 54.13 52.62 3b7r s LEU 115 Cb 0.06 -1.30 0.01 0.00 0.03 0.00 0.00 46.19 44.98 3b7r s LEU 115 CO 0.69 0.26 -0.17 -1.58 0.23 0.00 0.00 176.35 175.78 3b7r s GLN 116 N -1.20 2.32 -0.23 1.70 0.74 -0.56 -4.56 119.66 117.86 3b7r s GLN 116 Ca 0.12 -0.61 -0.08 0.00 0.05 0.00 0.00 55.36 54.84 3b7r s GLN 116 Cb -0.10 -1.87 -0.03 0.00 1.10 0.00 0.00 33.01 32.10 3b7r s GLN 116 CO 0.02 0.03 0.08 -1.58 -0.55 0.00 0.00 175.29 173.29 3b7r s TRP 117 N 0.70 3.14 -0.11 1.67 0.52 -1.26 -2.02 118.94 121.57 3b7r s TRP 117 Ca -0.13 -0.22 -0.01 0.00 0.02 0.00 0.00 56.10 55.77 3b7r s TRP 117 Cb -0.16 -2.21 -0.02 0.00 -1.15 0.00 0.00 33.47 29.93 3b7r s TRP 117 CO 0.03 -0.19 -0.08 -0.51 0.02 0.00 0.00 176.95 176.21 3b7r s LEU 118 N 1.27 3.03 0.86 2.99 1.43 0.04 -5.01 118.68 123.29 3b7r s LEU 118 Ca 0.05 -0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 52.88 3b7r s LEU 118 Cb -0.15 -1.68 0.11 0.00 0.03 0.00 0.00 46.19 44.50 3b7r s LEU 118 CO 0.04 0.24 1.10 0.42 0.23 0.00 0.00 176.35 178.38 3b7r s THR 119 N -0.10 2.70 0.34 5.49 -4.23 -1.26 -1.93 115.64 116.64 3b7r s THR 119 Ca 0.00 0.23 0.11 0.00 -1.18 0.00 0.00 61.69 60.85 3b7r s THR 119 Cb -0.13 -2.88 0.33 0.00 1.34 0.00 0.00 72.50 71.15 3b7r s THR 119 CO 0.03 -0.30 1.75 -0.65 -0.54 0.00 0.00 174.62 174.91 3b7r h PRO 120 N -1.35 0.55 0.00 3.99 0.11 -1.88 -1.65 132.00 131.78 3b7r h PRO 120 Ca -0.49 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 3b7r h PRO 120 Cb 1.29 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3b7r h PRO 120 CO 0.58 0.36 -0.14 1.05 -0.21 0.00 0.00 178.00 179.65 3b7r h GLU 121 N 0.57 0.00 0.00 1.05 9.09 -1.87 -2.26 114.58 121.16 3b7r h GLU 121 Ca 0.62 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.03 3b7r h GLU 121 Cb 1.24 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.34 3b7r h GLU 121 CO -0.42 0.14 0.00 1.04 0.05 0.00 0.00 179.01 179.82 3b7r n GLN 122 N -3.32 0.54 -3.56 1.06 6.02 -0.62 -4.90 117.38 112.61 3b7r n GLN 122 Ca 0.00 0.01 -0.23 0.00 -0.01 0.00 0.00 57.00 56.77 3b7r n GLN 122 Cb 0.37 -1.50 -0.00 0.00 1.02 0.00 0.00 30.24 30.13 3b7r n GLN 122 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3b7r s THR 123 N -2.44 2.17 0.09 5.09 -4.23 -0.85 -4.88 115.64 110.59 3b7r s THR 123 Ca 0.32 -1.32 -0.14 0.00 -1.18 0.00 0.00 61.69 59.38 3b7r s THR 123 Cb 0.20 -2.48 -0.15 0.00 1.34 0.00 0.00 72.50 71.41 3b7r s THR 123 CO 0.42 0.00 1.31 0.28 -0.54 0.00 0.00 174.62 176.09 3b7r h SER 124 N 0.72 0.88 1.07 3.99 0.02 -1.90 -3.35 113.55 114.99 3b7r h SER 124 Ca -0.37 -0.61 -0.09 0.00 -0.84 0.00 0.00 61.79 59.89 3b7r h SER 124 Cb 1.29 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.55 3b7r h SER 124 CO 0.53 1.34 -0.97 1.23 -1.14 0.00 0.00 176.83 177.82 3b7r h GLY 125 N 0.48 0.00 0.00 -3.77 0.00 -1.92 -3.48 103.07 94.37 3b7r h GLY 125 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.30 3b7r h GLY 125 CO 0.14 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.96 3b7r n LYS 126 N -2.90 -0.37 -0.00 4.80 4.76 -1.23 -4.81 118.16 118.40 3b7r n LYS 126 Ca -0.03 0.09 0.03 0.00 -2.87 0.00 0.00 58.31 55.53 3b7r n LYS 126 Cb 0.70 -3.43 -0.04 0.00 -1.84 0.00 0.00 35.03 30.42 3b7r n LYS 126 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3b7r n GLU 127 N -1.83 3.99 -3.91 1.97 1.02 -1.26 -4.49 120.64 116.13 3b7r n GLU 127 Ca 0.00 -0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.02 3b7r n GLU 127 Cb 0.09 -0.86 -0.10 0.00 -0.02 0.00 0.00 31.44 30.55 3b7r n GLU 127 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3b7r s HIS 128 N -1.75 0.11 0.87 -0.32 3.76 -1.26 -4.94 115.29 111.77 3b7r s HIS 128 Ca 0.01 -0.26 -0.14 0.00 -0.15 0.00 0.00 55.06 54.52 3b7r s HIS 128 Cb 0.04 -0.10 0.20 0.00 1.11 0.00 0.00 32.58 33.84 3b7r s HIS 128 CO 0.25 -0.25 1.19 -0.35 -0.85 0.00 0.00 174.74 174.73 3b7r n PRO 129 N 1.53 -1.10 -3.62 8.40 -0.04 -1.26 -3.87 135.00 135.04 3b7r n PRO 129 Ca -0.23 -1.91 -0.15 0.00 -0.04 0.00 0.00 63.50 61.17 3b7r n PRO 129 Cb 0.55 -1.20 -0.07 0.00 -0.04 0.00 0.00 33.50 32.74 3b7r n PRO 129 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 3b7r s TYR 130 N -3.58 -0.68 -0.03 0.54 6.14 -0.81 -4.45 117.35 114.48 3b7r s TYR 130 Ca 0.68 1.54 0.03 0.00 0.64 0.00 0.00 57.07 59.96 3b7r s TYR 130 Cb -0.02 0.28 0.00 0.00 0.42 0.00 0.00 41.96 42.65 3b7r s TYR 130 CO 0.47 -0.42 -0.09 -1.17 0.64 0.00 0.00 175.55 174.98 3b7r s LEU 131 N -0.12 1.78 0.02 6.97 2.96 0.15 -0.78 118.68 129.66 3b7r s LEU 131 Ca -0.03 -0.20 0.00 0.00 -0.22 0.00 0.00 54.13 53.68 3b7r s LEU 131 Cb -0.03 -0.58 -0.02 0.00 0.50 0.00 0.00 46.19 46.06 3b7r s LEU 131 CO 0.03 0.07 -0.03 0.72 -1.32 0.00 0.00 176.35 175.82 3b7r s PHE 132 N 0.21 0.27 0.23 5.38 -0.12 -0.86 -0.88 117.98 122.21 3b7r s PHE 132 Ca -0.04 -0.53 0.05 0.00 -0.05 0.00 0.00 56.93 56.37 3b7r s PHE 132 Cb -0.09 -0.19 -0.03 0.00 -0.63 0.00 0.00 43.02 42.07 3b7r s PHE 132 CO 0.01 -0.19 0.30 -1.54 -0.05 0.00 0.00 175.22 173.75 3b7r s SER 133 N -1.46 6.08 -0.31 1.98 1.04 -0.47 -1.50 113.70 119.06 3b7r s SER 133 Ca -0.16 -0.01 0.03 0.00 0.48 0.00 0.00 55.95 56.29 3b7r s SER 133 Cb -0.10 -1.73 0.16 0.00 0.10 0.00 0.00 66.02 64.46 3b7r s SER 133 CO -0.01 -0.04 0.43 -1.58 0.98 0.00 0.00 173.24 173.02 3b7r s GLN 134 N -3.81 0.49 0.00 4.02 2.00 0.46 -4.78 119.66 118.03 3b7r s GLN 134 Ca 0.34 -0.02 0.07 0.00 -2.00 0.00 0.00 55.36 53.75 3b7r s GLN 134 Cb -0.09 -0.30 -0.24 0.00 0.80 0.00 0.00 33.01 33.18 3b7r s GLN 134 CO 0.28 -1.07 0.85 0.00 -0.50 0.00 0.00 175.29 174.84 3b7r s GLN 136 N -2.63 4.29 -0.16 0.00 0.74 -1.24 -0.44 119.66 120.22 3b7r s GLN 136 Ca -0.05 2.24 -0.18 0.00 0.05 0.00 0.00 55.36 57.42 3b7r s GLN 136 Cb 0.08 -3.14 -0.15 0.00 1.10 0.00 0.00 33.01 30.90 3b7r s GLN 136 CO 0.83 -0.41 0.26 0.00 -0.55 0.00 0.00 175.29 175.42 3b7r h ALA 137 N 5.45 0.10 -0.73 1.58 0.00 -1.95 -3.44 119.26 120.28 3b7r h ALA 137 Ca -0.45 -0.71 -0.50 0.00 0.00 0.00 0.00 54.91 53.25 3b7r h ALA 137 Cb 1.21 0.39 -0.42 0.00 0.00 0.00 0.00 17.79 18.97 3b7r h ALA 137 CO 0.80 0.37 -0.87 0.44 0.00 0.00 0.00 179.25 180.00 3b7r n ILE 138 N -4.57 2.32 0.87 0.00 -5.35 -1.11 -4.72 119.36 106.80 3b7r n ILE 138 Ca -0.17 -4.04 0.09 0.00 -0.27 0.00 0.00 62.75 58.37 3b7r n ILE 138 Cb 0.45 -0.76 -0.04 0.00 -1.74 0.00 0.00 39.64 37.55 3b7r n ILE 138 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 3b7r n HIS 139 N -0.68 0.00 0.07 4.28 8.25 0.41 -4.35 115.22 123.20 3b7r n HIS 139 Ca 0.38 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.89 3b7r n HIS 139 Cb 0.93 0.00 0.49 0.00 1.12 0.00 0.00 29.99 32.53 3b7r n HIS 139 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3b7r h ARG 141 N 0.39 0.00 -0.00 0.00 0.11 -1.76 0.44 114.38 113.56 3b7r h ARG 141 Ca 0.11 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.19 3b7r h ARG 141 Cb -0.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.06 3b7r h ARG 141 CO -0.02 0.00 -0.07 0.00 0.10 0.00 0.00 179.97 179.97 3b7r n ALA 142 N -2.07 2.68 -0.11 0.08 0.00 -0.18 -0.86 120.51 120.06 3b7r n ALA 142 Ca -0.02 -0.23 -0.22 0.00 0.00 0.00 0.00 53.44 52.97 3b7r n ALA 142 Cb 0.12 -1.38 -0.08 0.00 0.00 0.00 0.00 19.45 18.10 3b7r n ALA 142 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3b7r n ILE 143 N -1.04 1.21 -3.73 0.00 5.41 0.06 -4.72 119.36 116.56 3b7r n ILE 143 Ca 0.15 -0.34 -0.11 0.00 1.00 0.00 0.00 62.75 63.45 3b7r n ILE 143 Cb 0.26 -1.69 -0.07 0.00 -0.71 0.00 0.00 39.64 37.43 3b7r n ILE 143 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 3b7r s LEU 144 N -7.01 0.77 0.22 1.39 0.05 -0.68 -4.69 118.68 108.72 3b7r s LEU 144 Ca -0.30 -0.21 -0.30 0.00 0.05 0.00 0.00 54.13 53.36 3b7r s LEU 144 Cb 0.11 1.47 -0.09 0.00 -2.05 0.00 0.00 46.19 45.63 3b7r s LEU 144 CO 0.41 -0.67 1.28 -2.84 -0.55 0.00 0.00 176.35 173.98 3b7r s PRO 145 N -2.84 4.41 0.01 1.48 0.02 -1.26 -4.12 135.00 132.71 3b7r s PRO 145 Ca -0.03 2.04 -0.28 0.00 0.02 0.00 0.00 61.00 62.74 3b7r s PRO 145 Cb 0.00 -3.18 0.10 0.00 0.02 0.00 0.00 34.50 31.43 3b7r s PRO 145 CO -0.05 -0.20 0.94 0.00 -0.33 0.00 0.00 177.00 177.36 3b7r s GLN 147 N -3.08 2.97 -1.23 0.00 -0.21 -1.26 -0.00 119.66 116.85 3b7r s GLN 147 Ca 0.07 -0.34 -0.09 0.00 0.02 0.00 0.00 55.36 55.01 3b7r s GLN 147 Cb -0.01 -4.87 0.19 0.00 1.00 0.00 0.00 33.01 29.32 3b7r s GLN 147 CO -0.06 -2.71 1.72 -3.47 -2.12 0.00 0.00 175.29 168.65 3b7r n ASP 148 N 11.51 5.33 -3.76 5.90 2.03 -1.26 -4.82 116.55 131.48 3b7r n ASP 148 Ca 0.28 -3.13 -0.13 0.00 0.52 0.00 0.00 54.79 52.33 3b7r n ASP 148 Cb 0.49 -1.46 -0.11 0.00 -0.72 0.00 0.00 41.12 39.32 3b7r n ASP 148 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3b7r s THR 149 N 0.03 -0.01 -2.00 5.18 -1.32 -1.26 -4.62 115.64 111.64 3b7r s THR 149 Ca 0.38 0.03 0.21 0.00 -1.21 0.00 0.00 61.69 61.11 3b7r s THR 149 Cb 0.06 -0.43 0.60 0.00 -1.51 0.00 0.00 72.50 71.21 3b7r s THR 149 CO 0.02 0.01 1.71 -0.81 -2.21 0.00 0.00 174.62 173.34 3b7r n PRO 150 N 3.26 0.85 0.00 7.08 -0.04 -1.26 -2.86 135.00 142.03 3b7r n PRO 150 Ca -0.16 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.44 3b7r n PRO 150 Cb 0.57 -1.39 0.72 0.00 -0.04 0.00 0.00 33.50 33.36 3b7r n PRO 150 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3b7r n SER 151 N -0.89 0.00 -4.15 3.54 3.41 -1.08 -4.69 113.62 109.76 3b7r n SER 151 Ca 0.16 -0.20 -0.28 0.00 -0.26 0.00 0.00 58.87 58.28 3b7r n SER 151 Cb 0.07 -0.25 -0.16 0.00 -0.26 0.00 0.00 64.21 63.60 3b7r n SER 151 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3b7r s VAL 152 N -2.51 1.63 -0.04 -3.33 1.01 -1.14 -4.90 120.40 111.13 3b7r s VAL 152 Ca 0.28 -0.80 0.06 0.00 0.00 0.00 0.00 61.98 61.52 3b7r s VAL 152 Cb 0.19 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 35.14 3b7r s VAL 152 CO 0.42 0.46 -0.22 -0.54 0.00 0.00 0.00 175.10 175.22 3b7r s LYS 153 N 0.24 2.05 0.05 2.72 1.02 -1.26 -4.16 119.74 120.41 3b7r s LYS 153 Ca -0.11 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.10 3b7r s LYS 153 Cb -0.15 -1.84 -0.03 0.00 -0.52 0.00 0.00 37.83 35.29 3b7r s LYS 153 CO 0.05 0.39 -0.05 -0.48 -0.92 0.00 0.00 175.35 174.34 3b7r s LEU 154 N -0.26 2.40 0.59 3.17 2.34 0.33 -4.62 118.68 122.63 3b7r s LEU 154 Ca 0.01 -0.81 -0.02 0.00 0.06 0.00 0.00 54.13 53.37 3b7r s LEU 154 Cb -0.11 0.05 0.03 0.00 -0.56 0.00 0.00 46.19 45.60 3b7r s LEU 154 CO 0.01 -0.43 0.85 0.42 -1.06 0.00 0.00 176.35 176.14 3b7r s THR 155 N -2.87 2.84 0.03 5.48 -4.23 -0.70 -0.82 115.64 115.36 3b7r s THR 155 Ca 0.00 -0.43 -0.16 0.00 -1.18 0.00 0.00 61.69 59.92 3b7r s THR 155 Cb 0.00 -3.12 0.03 0.00 1.34 0.00 0.00 72.50 70.75 3b7r s THR 155 CO -0.05 -0.10 0.36 -0.72 -0.54 0.00 0.00 174.62 173.57 3b7r s TYR 156 N -2.92 -0.20 0.10 3.99 -0.85 -0.71 -1.33 117.35 115.44 3b7r s TYR 156 Ca 0.57 0.16 0.07 0.00 -0.52 0.00 0.00 57.07 57.35 3b7r s TYR 156 Cb -0.10 0.16 -0.03 0.00 0.38 0.00 0.00 41.96 42.36 3b7r s TYR 156 CO 0.41 -0.52 -0.18 0.95 -1.52 0.00 0.00 175.55 174.70 3b7r s THR 157 N -2.27 1.50 -0.09 -3.49 -4.23 -0.19 -0.38 115.64 106.49 3b7r s THR 157 Ca -0.07 -1.55 -0.14 0.00 -1.18 0.00 0.00 61.69 58.75 3b7r s THR 157 Cb -0.02 -1.45 0.03 0.00 1.34 0.00 0.00 72.50 72.40 3b7r s THR 157 CO -0.01 -0.19 0.35 0.00 -0.54 0.00 0.00 174.62 174.22 3b7r s ALA 158 N -1.46 -0.87 -0.07 3.99 0.00 -0.65 -0.99 121.76 121.71 3b7r s ALA 158 Ca 0.06 0.79 0.02 0.00 0.00 0.00 0.00 51.96 52.82 3b7r s ALA 158 Cb -0.09 -0.35 0.01 0.00 0.00 0.00 0.00 23.12 22.69 3b7r s ALA 158 CO 0.04 -0.20 -0.12 -1.21 0.00 0.00 0.00 175.76 174.27 3b7r s GLU 159 N -0.35 1.71 -0.13 0.00 8.01 0.05 -1.10 118.70 126.88 3b7r s GLU 159 Ca -0.05 -0.40 -0.01 0.00 0.01 0.00 0.00 54.97 54.53 3b7r s GLU 159 Cb -0.03 -1.46 0.03 0.00 -4.31 0.00 0.00 34.13 28.36 3b7r s GLU 159 CO 0.02 -0.02 -0.06 0.08 0.01 0.00 0.00 175.26 175.29 3b7r s VAL 160 N 0.82 1.01 -0.13 2.63 1.01 -0.26 -1.21 120.40 124.27 3b7r s VAL 160 Ca -0.11 -0.38 -0.17 0.00 0.00 0.00 0.00 61.98 61.31 3b7r s VAL 160 Cb -0.15 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 3b7r s VAL 160 CO 0.02 0.27 0.45 -0.55 0.00 0.00 0.00 175.10 175.29 3b7r s SER 161 N 1.70 6.63 0.07 3.32 0.15 0.37 -1.48 113.70 124.46 3b7r s SER 161 Ca 0.03 0.75 0.00 0.00 0.70 0.00 0.00 55.95 57.43 3b7r s SER 161 Cb -0.13 -2.27 -0.04 0.00 -1.71 0.00 0.00 66.02 61.87 3b7r s SER 161 CO -0.08 0.00 -0.05 0.68 1.20 0.00 0.00 173.24 175.00 3b7r s VAL 162 N 0.68 0.45 0.23 4.45 -7.23 -0.25 -1.09 120.40 117.63 3b7r s VAL 162 Ca 0.24 -1.81 -0.30 0.00 -1.81 0.00 0.00 61.98 58.29 3b7r s VAL 162 Cb -0.15 -1.52 -0.15 0.00 0.56 0.00 0.00 36.38 35.12 3b7r s VAL 162 CO 0.09 -0.90 1.08 -2.65 -0.31 0.00 0.00 175.10 172.41 3b7r n PRO 163 N 0.14 1.26 0.28 4.82 -0.02 -1.26 -0.12 135.00 140.10 3b7r n PRO 163 Ca -0.14 0.45 0.17 0.00 -2.02 0.00 0.00 63.50 61.95 3b7r n PRO 163 Cb 0.60 -1.88 0.80 0.00 -0.02 0.00 0.00 33.50 33.01 3b7r n PRO 163 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3b7r h LYS 164 N 2.69 0.00 0.00 -0.52 2.10 -1.51 -0.78 116.57 118.55 3b7r h LYS 164 Ca -0.41 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.24 3b7r h LYS 164 Cb 1.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.67 3b7r h LYS 164 CO 0.65 0.06 0.00 -0.85 -2.00 0.00 0.00 179.45 177.31 3b7r n GLU 165 N -3.28 0.25 -3.66 0.07 0.00 -1.26 -4.83 120.64 107.92 3b7r n GLU 165 Ca -0.01 0.01 -0.21 0.00 0.00 0.00 0.00 57.16 56.96 3b7r n GLU 165 Cb 0.24 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.15 3b7r n GLU 165 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3b7r s LEU 166 N -2.74 3.49 -0.05 -1.84 1.43 -0.30 -4.78 118.68 113.89 3b7r s LEU 166 Ca 0.22 -0.62 0.05 0.00 -1.03 0.00 0.00 54.13 52.74 3b7r s LEU 166 Cb 0.19 -2.14 -0.00 0.00 0.03 0.00 0.00 46.19 44.26 3b7r s LEU 166 CO 0.47 -0.52 -0.19 -0.69 0.23 0.00 0.00 176.35 175.65 3b7r s VAL 167 N -2.39 1.61 -0.09 -1.59 1.01 -0.02 -4.90 120.40 114.03 3b7r s VAL 167 Ca 0.45 -0.81 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 3b7r s VAL 167 Cb -0.05 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 3b7r s VAL 167 CO 0.27 0.46 0.08 0.00 0.00 0.00 0.00 175.10 175.91 3b7r s ALA 168 N 0.06 3.61 0.09 5.51 0.00 -1.26 -1.39 121.76 128.38 3b7r s ALA 168 Ca -0.06 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.20 3b7r s ALA 168 Cb -0.13 -1.73 -0.03 0.00 0.00 0.00 0.00 23.12 21.22 3b7r s ALA 168 CO 0.03 0.62 -0.09 -0.51 0.00 0.00 0.00 175.76 175.80 3b7r s LEU 169 N -1.05 2.39 0.26 0.00 1.43 -0.30 -5.00 118.68 116.41 3b7r s LEU 169 Ca 0.15 -0.79 0.02 0.00 -1.03 0.00 0.00 54.13 52.49 3b7r s LEU 169 Cb -0.12 -0.26 -0.04 0.00 0.03 0.00 0.00 46.19 45.80 3b7r s LEU 169 CO 0.04 -0.27 0.19 -0.04 0.23 0.00 0.00 176.35 176.50 3b7r s MET 170 N -2.68 1.45 -1.40 1.70 -1.94 -1.26 -1.31 119.30 113.86 3b7r s MET 170 Ca 0.03 -1.80 -0.12 0.00 -1.71 0.00 0.00 55.69 52.09 3b7r s MET 170 Cb -0.03 0.24 -0.04 0.00 2.01 0.00 0.00 34.83 37.00 3b7r s MET 170 CO -0.00 -0.49 2.48 -1.13 -0.01 0.00 0.00 175.02 175.87 3b7r n SER 171 N -0.80 5.82 -3.72 3.03 3.41 -1.02 -4.72 113.62 115.61 3b7r n SER 171 Ca 0.04 -2.66 -0.02 0.00 -0.26 0.00 0.00 58.87 55.97 3b7r n SER 171 Cb 0.65 -1.50 -0.01 0.00 -0.26 0.00 0.00 64.21 63.08 3b7r n SER 171 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3b7r s ALA 172 N 2.99 -1.81 0.10 7.33 0.00 -1.14 -4.62 121.76 124.61 3b7r s ALA 172 Ca 0.56 0.29 -0.29 0.00 0.00 0.00 0.00 51.96 52.52 3b7r s ALA 172 Cb 0.15 0.56 -0.06 0.00 0.00 0.00 0.00 23.12 23.78 3b7r s ALA 172 CO -0.05 -1.04 0.94 0.42 0.00 0.00 0.00 175.76 176.02 3b7r s ILE 173 N -3.06 4.53 0.26 0.00 -1.09 -0.24 -4.86 121.20 116.74 3b7r s ILE 173 Ca 0.13 2.01 -0.30 0.00 -2.23 0.00 0.00 60.65 60.26 3b7r s ILE 173 Cb 0.00 -4.30 -0.10 0.00 -1.58 0.00 0.00 42.46 36.49 3b7r s ILE 173 CO 0.01 0.32 1.41 -0.13 -1.23 0.00 0.00 174.94 175.32 3b7r s ARG 174 N -0.01 4.29 -0.23 2.79 0.52 -1.26 -1.49 118.95 123.56 3b7r s ARG 174 Ca 0.46 2.27 0.14 0.00 -0.52 0.00 0.00 55.73 58.08 3b7r s ARG 174 Cb -0.23 -3.11 0.46 0.00 0.52 0.00 0.00 34.95 32.59 3b7r s ARG 174 CO 0.29 -0.38 1.17 -3.47 0.02 0.00 0.00 175.30 172.93 3b7r n ASP 175 N 2.16 2.96 0.00 0.23 2.03 0.57 -4.88 116.55 119.62 3b7r n ASP 175 Ca 0.06 -3.13 0.00 0.00 0.52 0.00 0.00 54.79 52.24 3b7r n ASP 175 Cb 0.41 -0.41 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 3b7r n ASP 175 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3b7r n GLY 176 N -0.62 0.74 3.19 0.27 0.00 -1.25 -4.62 105.19 102.90 3b7r n GLY 176 Ca 0.25 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.11 3b7r n GLY 176 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3b7r s GLU 177 N -1.48 0.58 0.08 1.61 -1.05 -1.26 -1.38 118.70 115.80 3b7r s GLU 177 Ca 0.00 -0.21 -0.12 0.00 -0.15 0.00 0.00 54.97 54.49 3b7r s GLU 177 Cb 0.00 0.25 0.01 0.00 -0.44 0.00 0.00 34.13 33.96 3b7r s GLU 177 CO 0.00 -0.15 0.27 0.95 0.95 0.00 0.00 175.26 177.29 3b7r s THR 178 N -1.21 0.10 0.49 1.83 -4.23 -0.20 -4.99 115.64 107.43 3b7r s THR 178 Ca -0.13 -0.86 -0.24 0.00 -1.18 0.00 0.00 61.69 59.28 3b7r s THR 178 Cb -0.06 -1.14 -0.07 0.00 1.34 0.00 0.00 72.50 72.57 3b7r s THR 178 CO 0.03 -0.48 1.38 -2.84 -0.54 0.00 0.00 174.62 172.17 3b7r s PRO 179 N -3.35 3.48 -0.30 3.99 0.02 -1.26 0.26 135.00 137.84 3b7r s PRO 179 Ca 0.01 2.30 -0.29 0.00 0.02 0.00 0.00 61.00 63.04 3b7r s PRO 179 Cb 0.02 -2.49 0.01 0.00 0.02 0.00 0.00 34.50 32.07 3b7r s PRO 179 CO -0.08 -0.94 1.09 0.34 -0.33 0.00 0.00 177.00 177.07 3b7r s ASP 180 N -0.74 6.95 0.51 2.53 -1.08 -0.54 -4.60 116.67 119.70 3b7r s ASP 180 Ca 0.65 1.13 0.25 0.00 -0.52 0.00 0.00 52.55 54.07 3b7r s ASP 180 Cb -0.41 -2.54 1.40 0.00 -1.46 0.00 0.00 42.92 39.90 3b7r s ASP 180 CO 0.51 -0.85 2.07 -0.65 0.52 0.00 0.00 175.17 176.77 3b7r h PRO 181 N 8.05 0.00 -0.00 4.34 0.11 -1.91 -2.04 132.00 140.55 3b7r h PRO 181 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 3b7r h PRO 181 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3b7r h PRO 181 CO 1.02 0.12 -0.12 -0.85 -0.21 0.00 0.00 178.00 177.96 3b7r n GLU 182 N -3.77 0.58 -3.11 1.05 0.28 -1.26 -4.71 120.64 109.71 3b7r n GLU 182 Ca -0.02 -0.20 0.03 0.00 -0.16 0.00 0.00 57.16 56.81 3b7r n GLU 182 Cb 0.23 -1.50 -0.00 0.00 1.43 0.00 0.00 31.44 31.60 3b7r n GLU 182 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 3b7r s ASP 183 N -2.55 -1.16 0.00 -1.84 3.68 -0.77 -5.04 116.67 108.98 3b7r s ASP 183 Ca 0.26 -0.20 0.00 0.00 2.13 0.00 0.00 52.55 54.75 3b7r s ASP 183 Cb 0.20 1.61 0.00 0.00 -1.45 0.00 0.00 42.92 43.27 3b7r s ASP 183 CO 0.49 -0.17 0.92 -2.65 0.13 0.00 0.00 175.17 173.89 3b7r n PRO 184 N 4.77 0.00 0.00 4.34 -0.02 -1.19 -0.98 135.00 141.92 3b7r n PRO 184 Ca 0.08 0.42 0.13 0.00 -2.02 0.00 0.00 63.50 62.11 3b7r n PRO 184 Cb 0.57 -1.51 0.79 0.00 -0.02 0.00 0.00 33.50 33.33 3b7r n PRO 184 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3b7r n SER 185 N -1.42 0.00 -4.32 2.55 3.41 -1.26 -4.88 113.62 107.70 3b7r n SER 185 Ca 0.00 -0.90 -0.17 0.00 -0.26 0.00 0.00 58.87 57.53 3b7r n SER 185 Cb 0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.86 3b7r n SER 185 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3b7r s ARG 186 N -2.00 1.26 0.07 4.33 0.52 -0.15 -1.42 118.95 121.56 3b7r s ARG 186 Ca 0.40 -1.55 0.09 0.00 -0.52 0.00 0.00 55.73 54.15 3b7r s ARG 186 Cb 0.18 -1.00 -0.03 0.00 0.52 0.00 0.00 34.95 34.62 3b7r s ARG 186 CO 0.31 0.16 -0.25 0.15 0.02 0.00 0.00 175.30 175.69 3b7r s LYS 187 N -3.64 1.53 -0.22 3.54 1.02 0.83 -1.47 119.74 121.34 3b7r s LYS 187 Ca 0.21 -1.14 -0.09 0.00 0.02 0.00 0.00 55.97 54.97 3b7r s LYS 187 Cb -0.00 -1.79 -0.04 0.00 -0.52 0.00 0.00 37.83 35.48 3b7r s LYS 187 CO 0.05 0.45 0.12 0.42 -0.92 0.00 0.00 175.35 175.47 3b7r s ILE 188 N -0.90 5.07 -0.11 2.17 1.01 0.14 -1.09 121.20 127.49 3b7r s ILE 188 Ca 0.11 0.07 -0.03 0.00 0.00 0.00 0.00 60.65 60.81 3b7r s ILE 188 Cb -0.10 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 39.00 3b7r s ILE 188 CO 0.03 0.38 -0.01 -0.31 0.00 0.00 0.00 174.94 175.04 3b7r s TYR 189 N 0.88 3.13 0.10 3.97 2.02 -0.55 -1.04 117.35 125.86 3b7r s TYR 189 Ca 0.06 0.07 0.09 0.00 -0.37 0.00 0.00 57.07 56.92 3b7r s TYR 189 Cb -0.13 -1.84 -0.04 0.00 -0.40 0.00 0.00 41.96 39.55 3b7r s TYR 189 CO 0.03 0.33 -0.21 0.15 -1.57 0.00 0.00 175.55 174.28 3b7r s LYS 190 N -0.51 1.76 -0.03 -0.62 1.02 -0.48 -1.10 119.74 119.79 3b7r s LYS 190 Ca 0.09 -1.17 -0.06 0.00 0.02 0.00 0.00 55.97 54.85 3b7r s LYS 190 Cb -0.12 -2.07 0.01 0.00 -0.52 0.00 0.00 37.83 35.13 3b7r s LYS 190 CO 0.02 0.49 0.14 -0.06 -0.92 0.00 0.00 175.35 175.02 3b7r s PHE 191 N -1.04 -0.06 -0.05 3.18 0.08 -0.26 -0.31 117.98 119.51 3b7r s PHE 191 Ca 0.16 0.14 -0.00 0.00 0.12 0.00 0.00 56.93 57.34 3b7r s PHE 191 Cb -0.10 0.00 0.03 0.00 -0.57 0.00 0.00 43.02 42.37 3b7r s PHE 191 CO 0.07 -0.18 -0.00 0.42 -0.10 0.00 0.00 175.22 175.43 3b7r s ILE 192 N -0.65 0.32 -0.36 0.64 1.01 -0.55 -1.64 121.20 119.97 3b7r s ILE 192 Ca -0.07 0.08 -0.00 0.00 0.00 0.00 0.00 60.65 60.66 3b7r s ILE 192 Cb -0.04 -0.44 0.09 0.00 0.01 0.00 0.00 42.46 42.08 3b7r s ILE 192 CO 0.01 0.22 0.11 -1.58 0.00 0.00 0.00 174.94 173.69 3b7r s GLN 193 N 1.51 1.92 0.00 2.79 2.00 0.49 -1.08 119.66 127.29 3b7r s GLN 193 Ca -0.02 -1.72 0.26 0.00 -2.00 0.00 0.00 55.36 51.87 3b7r s GLN 193 Cb -0.13 -3.36 0.65 0.00 0.80 0.00 0.00 33.01 30.96 3b7r s GLN 193 CO -0.03 -0.93 1.52 1.63 -0.50 0.00 0.00 175.29 176.98 3b7r n LYS 194 N 4.48 0.00 -3.57 1.67 5.02 -1.26 -1.73 118.16 122.78 3b7r n LYS 194 Ca -0.03 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.90 3b7r n LYS 194 Cb 0.42 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.85 3b7r n LYS 194 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3b7r s VAL 195 N -3.00 5.32 0.16 -0.18 1.01 -1.26 -4.92 120.40 117.52 3b7r s VAL 195 Ca 0.12 0.48 -0.31 0.00 0.00 0.00 0.00 61.98 62.26 3b7r s VAL 195 Cb 0.18 -3.60 -0.10 0.00 0.00 0.00 0.00 36.38 32.85 3b7r s VAL 195 CO 0.67 0.39 1.60 -2.84 0.00 0.00 0.00 175.10 174.91 3b7r s PRO 196 N 0.54 4.20 0.12 2.72 0.02 -1.26 -4.58 135.00 136.75 3b7r s PRO 196 Ca 0.15 2.39 0.06 0.00 0.02 0.00 0.00 61.00 63.61 3b7r s PRO 196 Cb -0.13 -3.21 -0.04 0.00 0.02 0.00 0.00 34.50 31.15 3b7r s PRO 196 CO 0.03 -0.64 -0.14 0.96 -0.33 0.00 0.00 177.00 176.88 3b7r s ILE 197 N 1.35 1.27 0.48 2.83 -4.36 -0.00 -4.75 121.20 118.02 3b7r s ILE 197 Ca 0.71 -1.69 -0.22 0.00 -0.26 0.00 0.00 60.65 59.20 3b7r s ILE 197 Cb -0.44 -1.49 -0.07 0.00 1.25 0.00 0.00 42.46 41.71 3b7r s ILE 197 CO 0.31 -0.43 1.13 -2.16 0.24 0.00 0.00 174.94 174.04 3b7r s PRO 198 N -2.64 3.68 0.55 0.37 0.04 -1.26 -0.52 135.00 135.22 3b7r s PRO 198 Ca 0.08 1.65 0.36 0.00 0.04 0.00 0.00 61.00 63.13 3b7r s PRO 198 Cb -0.05 -2.26 1.74 0.00 0.04 0.00 0.00 34.50 33.98 3b7r s PRO 198 CO 0.03 -0.59 2.08 0.00 0.04 0.00 0.00 177.00 178.56 3b7r n TYR 200 N -2.91 0.80 1.31 0.00 0.18 -1.26 -1.65 117.16 113.63 3b7r n TYR 200 Ca -0.01 0.37 0.13 0.00 1.88 0.00 0.00 57.90 60.28 3b7r n TYR 200 Cb 0.18 -1.10 0.41 0.00 -0.38 0.00 0.00 39.34 38.45 3b7r n TYR 200 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3b7r n LEU 201 N -2.28 1.17 -4.73 -3.48 4.77 -0.85 -3.61 117.00 107.98 3b7r n LEU 201 Ca -0.00 -0.33 -0.42 0.00 -0.03 0.00 0.00 56.01 55.23 3b7r n LEU 201 Cb 0.11 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.09 3b7r n LEU 201 CO 0.14 0.21 1.20 -0.63 -1.33 0.00 0.00 177.39 176.98 3b7r s ILE 202 N -2.36 2.50 -0.03 -0.08 1.01 -0.66 -4.38 121.20 117.20 3b7r s ILE 202 Ca 0.28 0.39 -0.17 0.00 0.00 0.00 0.00 60.65 61.15 3b7r s ILE 202 Cb 0.20 -3.25 0.03 0.00 0.01 0.00 0.00 42.46 39.45 3b7r s ILE 202 CO 0.47 0.05 0.37 0.00 0.00 0.00 0.00 174.94 175.82 3b7r s ALA 203 N 0.53 -0.93 -0.06 9.38 0.00 -1.26 -4.49 121.76 124.93 3b7r s ALA 203 Ca 0.65 0.53 -0.04 0.00 0.00 0.00 0.00 51.96 53.10 3b7r s ALA 203 Cb -0.44 0.00 0.02 0.00 0.00 0.00 0.00 23.12 22.70 3b7r s ALA 203 CO 0.38 -0.27 0.14 -1.17 0.00 0.00 0.00 175.76 174.85 3b7r s LEU 204 N -1.17 1.25 0.01 0.00 2.96 -1.26 -2.44 118.68 118.04 3b7r s LEU 204 Ca -0.12 0.28 0.03 0.00 -0.22 0.00 0.00 54.13 54.10 3b7r s LEU 204 Cb -0.04 0.43 -0.01 0.00 0.50 0.00 0.00 46.19 47.07 3b7r s LEU 204 CO 0.05 -0.08 -0.09 0.54 -1.32 0.00 0.00 176.35 175.45 3b7r s VAL 205 N 0.40 0.72 -0.05 1.68 0.11 -0.43 -1.36 120.40 121.47 3b7r s VAL 205 Ca -0.03 -0.59 -0.00 0.00 -2.93 0.00 0.00 61.98 58.43 3b7r s VAL 205 Cb -0.04 -0.64 0.03 0.00 -1.53 0.00 0.00 36.38 34.19 3b7r s VAL 205 CO -0.02 0.06 -0.00 -0.69 -3.33 0.00 0.00 175.10 171.12 3b7r s VAL 206 N -0.50 0.29 -0.02 2.04 1.01 -0.06 -1.15 120.40 122.00 3b7r s VAL 206 Ca 0.01 0.10 -0.13 0.00 0.00 0.00 0.00 61.98 61.96 3b7r s VAL 206 Cb -0.05 -0.42 0.04 0.00 0.00 0.00 0.00 36.38 35.95 3b7r s VAL 206 CO 0.00 0.21 0.61 0.61 0.00 0.00 0.00 175.10 176.53 3b7r n GLY 207 N 4.68 0.37 3.28 4.51 0.00 -0.48 -0.67 105.19 116.87 3b7r n GLY 207 Ca -0.15 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 3b7r n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b7r n ALA 208 N -2.07 4.26 -2.82 4.61 0.00 -1.26 -0.84 120.51 122.40 3b7r n ALA 208 Ca -0.05 -3.91 -0.36 0.00 0.00 0.00 0.00 53.44 49.12 3b7r n ALA 208 Cb 0.27 -3.51 -0.07 0.00 0.00 0.00 0.00 19.45 16.13 3b7r n ALA 208 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3b7r s LEU 209 N 3.19 4.10 0.31 0.00 1.43 -1.26 -4.25 118.68 122.21 3b7r s LEU 209 Ca 0.50 0.33 0.07 0.00 -1.03 0.00 0.00 54.13 54.00 3b7r s LEU 209 Cb 0.07 -2.07 -0.06 0.00 0.03 0.00 0.00 46.19 44.15 3b7r s LEU 209 CO 0.02 0.37 -0.04 -1.61 0.23 0.00 0.00 176.35 175.32 3b7r s GLU 210 N -1.16 1.65 0.08 1.70 2.02 0.28 -4.86 118.70 118.40 3b7r s GLU 210 Ca 0.17 -1.86 0.02 0.00 0.02 0.00 0.00 54.97 53.32 3b7r s GLU 210 Cb -0.12 -1.25 -0.04 0.00 0.10 0.00 0.00 34.13 32.83 3b7r s GLU 210 CO 0.06 0.02 -0.07 -1.54 0.02 0.00 0.00 175.26 173.74 3b7r s SER 211 N -3.50 1.08 -0.02 -0.19 1.04 -1.26 -2.06 113.70 108.79 3b7r s SER 211 Ca 0.31 -0.84 -0.01 0.00 0.48 0.00 0.00 55.95 55.89 3b7r s SER 211 Cb 0.05 0.07 0.02 0.00 0.10 0.00 0.00 66.02 66.26 3b7r s SER 211 CO 0.14 -0.36 0.04 -0.60 0.98 0.00 0.00 173.24 173.44 3b7r s ARG 212 N -3.03 0.01 0.18 4.02 3.52 -0.34 -4.97 118.95 118.34 3b7r s ARG 212 Ca 0.04 0.16 -0.30 0.00 -0.13 0.00 0.00 55.73 55.50 3b7r s ARG 212 Cb -0.00 -0.14 -0.08 0.00 -1.56 0.00 0.00 34.95 33.17 3b7r s ARG 212 CO -0.03 -0.10 1.16 -1.14 -0.81 0.00 0.00 175.30 174.38 3b7r s GLN 213 N 0.67 4.53 0.00 5.12 0.74 -1.26 -0.40 119.66 129.06 3b7r s GLN 213 Ca -0.05 1.81 0.00 0.00 0.05 0.00 0.00 55.36 57.16 3b7r s GLN 213 Cb -0.08 -3.26 0.00 0.00 1.10 0.00 0.00 33.01 30.78 3b7r s GLN 213 CO -0.02 -0.02 0.24 0.44 -0.55 0.00 0.00 175.29 175.38 3b7r n ILE 214 N 2.46 0.00 -3.87 -2.34 -5.35 -0.33 -4.93 119.36 105.00 3b7r n ILE 214 Ca 0.04 -0.30 -0.03 0.00 -0.27 0.00 0.00 62.75 62.19 3b7r n ILE 214 Cb 0.45 1.33 0.01 0.00 -1.74 0.00 0.00 39.64 39.70 3b7r n ILE 214 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3b7r s GLY 215 N -0.11 0.07 0.58 3.28 0.00 -1.11 -4.83 107.32 105.19 3b7r s GLY 215 Ca 0.00 -0.27 0.35 0.00 0.00 0.00 0.00 44.72 44.80 3b7r s GLY 215 CO 0.00 2.18 2.15 -0.56 0.00 0.00 0.00 173.10 176.87 3b7r h PRO 216 N 2.00 0.00 -0.05 2.90 0.13 -1.99 -3.06 132.00 131.93 3b7r h PRO 216 Ca -0.27 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.70 3b7r h PRO 216 Cb 1.22 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 32.02 3b7r h PRO 216 CO 0.35 0.05 -0.96 2.89 -0.23 0.00 0.00 178.00 180.10 3b7r n ARG 217 N -3.31 0.45 -3.68 0.86 1.85 -1.26 -5.06 116.66 106.50 3b7r n ARG 217 Ca -0.02 -2.36 -0.15 0.00 -1.00 0.00 0.00 57.85 54.32 3b7r n ARG 217 Cb 0.20 -0.42 -0.15 0.00 -1.05 0.00 0.00 32.46 31.04 3b7r n ARG 217 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 3b7r s THR 218 N -0.89 -0.27 -0.03 8.89 2.01 -1.16 -0.38 115.64 123.82 3b7r s THR 218 Ca 0.34 0.30 0.00 0.00 0.31 0.00 0.00 61.69 62.65 3b7r s THR 218 Cb 0.38 -0.34 -0.04 0.00 0.01 0.00 0.00 72.50 72.52 3b7r s THR 218 CO -0.14 0.13 0.01 -0.76 -0.69 0.00 0.00 174.62 173.17 3b7r s LEU 219 N 2.13 3.59 -0.08 4.42 1.02 -1.26 -1.19 118.68 127.31 3b7r s LEU 219 Ca 0.00 0.06 -0.11 0.00 0.02 0.00 0.00 54.13 54.10 3b7r s LEU 219 Cb -0.12 -2.00 -0.05 0.00 0.02 0.00 0.00 46.19 44.05 3b7r s LEU 219 CO -0.07 0.31 0.27 0.68 0.02 0.00 0.00 176.35 177.56 3b7r s VAL 220 N -1.04 5.28 -0.05 -1.59 -7.23 0.47 -1.35 120.40 114.88 3b7r s VAL 220 Ca 0.18 0.52 0.05 0.00 -1.81 0.00 0.00 61.98 60.92 3b7r s VAL 220 Cb -0.12 -3.57 -0.01 0.00 0.56 0.00 0.00 36.38 33.25 3b7r s VAL 220 CO 0.08 0.56 -0.21 0.26 -0.31 0.00 0.00 175.10 175.48 3b7r s TRP 221 N -0.74 2.08 0.20 2.82 0.52 0.57 -1.20 118.94 123.19 3b7r s TRP 221 Ca 0.18 -0.61 -0.22 0.00 0.02 0.00 0.00 56.10 55.47 3b7r s TRP 221 Cb -0.14 -1.38 0.07 0.00 -1.15 0.00 0.00 33.47 30.88 3b7r s TRP 221 CO 0.07 -0.19 1.01 -1.54 0.02 0.00 0.00 176.95 176.32 3b7r s SER 222 N -0.06 -0.03 0.73 2.95 1.04 -0.87 -1.01 113.70 116.44 3b7r s SER 222 Ca -0.04 -0.66 -0.15 0.00 0.48 0.00 0.00 55.95 55.58 3b7r s SER 222 Cb -0.13 0.53 0.04 0.00 0.10 0.00 0.00 66.02 66.56 3b7r s SER 222 CO 0.03 -1.03 1.18 -1.61 0.98 0.00 0.00 173.24 172.79 3b7r s GLU 223 N -2.39 2.21 0.36 4.02 2.02 -1.26 -0.56 118.70 123.10 3b7r s GLU 223 Ca 0.19 1.66 0.12 0.00 0.02 0.00 0.00 54.97 56.97 3b7r s GLU 223 Cb -0.03 -1.85 0.93 0.00 0.10 0.00 0.00 34.13 33.29 3b7r s GLU 223 CO 0.05 -1.76 1.80 -0.22 0.02 0.00 0.00 175.26 175.15 3b7r h LYS 224 N -0.33 0.55 0.00 1.61 3.64 -1.92 -1.56 116.57 118.56 3b7r h LYS 224 Ca -0.47 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.86 3b7r h LYS 224 Cb 1.28 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.98 3b7r h LYS 224 CO 0.50 0.36 -0.06 0.93 -2.27 0.00 0.00 179.45 178.91 3b7r h GLU 225 N 0.57 0.00 -0.01 1.90 3.07 -1.96 -2.84 114.58 115.31 3b7r h GLU 225 Ca 0.55 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.41 3b7r h GLU 225 Cb 1.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.04 3b7r h GLU 225 CO -0.30 0.06 -0.39 1.04 -1.40 0.00 0.00 179.01 178.02 3b7r n GLN 226 N -3.72 1.75 0.08 2.33 3.00 -0.60 -4.73 117.38 115.49 3b7r n GLN 226 Ca -0.02 -0.67 -0.13 0.00 -0.01 0.00 0.00 57.00 56.17 3b7r n GLN 226 Cb 0.16 -1.26 -0.07 0.00 0.00 0.00 0.00 30.24 29.07 3b7r n GLN 226 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 3b7r h VAL 227 N 1.47 0.93 -0.31 5.09 2.07 -1.38 -1.53 116.25 122.60 3b7r h VAL 227 Ca 0.00 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 3b7r h VAL 227 Cb 0.51 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 3b7r h VAL 227 CO 0.00 0.01 0.14 -0.08 0.02 0.00 0.00 177.57 177.66 3b7r h GLU 228 N -0.12 0.45 -0.54 1.57 4.81 -1.85 -1.78 114.58 117.12 3b7r h GLU 228 Ca -0.01 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 59.08 3b7r h GLU 228 Cb 0.09 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 3b7r h GLU 228 CO 0.02 0.43 0.05 -0.22 -0.73 0.00 0.00 179.01 178.56 3b7r h LYS 229 N 0.36 0.88 -0.49 1.92 3.64 -1.86 -2.85 116.57 118.18 3b7r h LYS 229 Ca 0.11 -0.23 -0.12 0.00 -1.27 0.00 0.00 60.65 59.13 3b7r h LYS 229 Cb 0.14 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3b7r h LYS 229 CO -0.01 0.85 -0.18 0.77 -2.27 0.00 0.00 179.45 178.61 3b7r h SER 230 N 0.83 0.99 -0.93 4.20 0.02 -1.02 -1.30 113.55 116.34 3b7r h SER 230 Ca 0.17 -0.38 0.05 0.00 -0.84 0.00 0.00 61.79 60.78 3b7r h SER 230 Cb 0.43 -0.27 -0.06 0.00 0.14 0.00 0.00 62.40 62.63 3b7r h SER 230 CO 0.01 1.15 0.60 0.00 -1.14 0.00 0.00 176.83 177.46 3b7r h ALA 231 N 0.88 1.26 -0.05 3.77 0.00 -1.14 -1.76 119.26 122.20 3b7r h ALA 231 Ca 0.12 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3b7r h ALA 231 Cb 0.75 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3b7r h ALA 231 CO 0.06 0.43 -0.13 -0.92 0.00 0.00 0.00 179.25 178.68 3b7r h TYR 232 N 1.13 0.23 -1.00 0.00 3.20 -1.37 -3.00 116.97 116.17 3b7r h TYR 232 Ca 0.39 -0.09 0.10 0.00 3.14 0.00 0.00 58.73 62.26 3b7r h TYR 232 Cb 0.07 -0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.23 3b7r h TYR 232 CO -0.01 0.74 0.64 1.49 -1.64 0.00 0.00 178.16 179.38 3b7r h GLU 233 N -0.34 1.04 -0.46 1.82 4.57 -0.85 -2.42 114.58 117.94 3b7r h GLU 233 Ca -0.00 -0.06 -0.09 0.00 -1.18 0.00 0.00 59.36 58.03 3b7r h GLU 233 Cb 0.74 -0.23 -0.05 0.00 -0.16 0.00 0.00 28.75 29.04 3b7r h GLU 233 CO 0.03 0.69 0.07 1.19 -1.18 0.00 0.00 179.01 179.81 3b7r n PHE 234 N -4.56 1.57 0.30 0.92 3.72 -0.70 -4.51 117.46 114.20 3b7r n PHE 234 Ca 0.17 -1.06 0.18 0.00 -0.05 0.00 0.00 57.45 56.70 3b7r n PHE 234 Cb 0.28 -0.48 0.90 0.00 -0.94 0.00 0.00 39.48 39.24 3b7r n PHE 234 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3b7r h SER 235 N 2.25 0.00 0.04 4.37 4.64 -1.28 -2.07 113.55 121.50 3b7r h SER 235 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3b7r h SER 235 Cb 1.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.91 3b7r h SER 235 CO 0.44 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.78 3b7r n GLU 236 N -2.85 0.90 0.10 4.77 1.02 -1.26 -4.39 120.64 118.93 3b7r n GLU 236 Ca -0.01 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.00 3b7r n GLU 236 Cb 0.14 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.01 3b7r n GLU 236 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3b7r h THR 237 N 0.00 0.39 -0.90 2.62 2.02 -1.74 -1.22 112.91 114.08 3b7r h THR 237 Ca 0.00 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.22 3b7r h THR 237 Cb 0.02 0.39 -0.06 0.00 -1.74 0.00 0.00 68.15 66.77 3b7r h THR 237 CO 0.00 0.00 0.58 -0.08 0.37 0.00 0.00 175.52 176.39 3b7r h GLU 238 N -0.47 1.06 -0.63 6.66 4.57 -1.85 0.42 114.58 124.34 3b7r h GLU 238 Ca 0.04 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 3b7r h GLU 238 Cb 0.51 -0.24 -0.03 0.00 -0.16 0.00 0.00 28.75 28.83 3b7r h GLU 238 CO -0.18 0.70 0.30 0.66 -1.18 0.00 0.00 179.01 179.31 3b7r h SER 239 N 1.10 0.80 -0.24 1.04 4.64 -1.70 -1.71 113.55 117.47 3b7r h SER 239 Ca 0.37 -0.08 -0.17 0.00 -0.47 0.00 0.00 61.79 61.44 3b7r h SER 239 Cb 0.05 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 61.93 3b7r h SER 239 CO -0.13 0.68 -0.48 0.24 -0.87 0.00 0.00 176.83 176.26 3b7r h MET 240 N 0.88 0.82 -0.83 4.77 2.86 -0.60 -2.39 114.93 120.44 3b7r h MET 240 Ca 0.22 -0.48 0.02 0.00 -2.06 0.00 0.00 59.70 57.40 3b7r h MET 240 Cb 0.09 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.75 3b7r h MET 240 CO -0.03 1.11 0.54 -0.07 1.06 0.00 0.00 176.91 179.53 3b7r h LEU 241 N 0.64 0.93 -0.83 1.22 3.38 -0.47 -0.39 115.31 119.79 3b7r h LEU 241 Ca 0.03 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 3b7r h LEU 241 Cb 1.07 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 3b7r h LEU 241 CO 0.11 0.66 0.04 0.11 0.09 0.00 0.00 178.44 179.45 3b7r h LYS 242 N 1.09 0.92 -0.26 1.13 1.57 -1.15 0.59 116.57 120.47 3b7r h LYS 242 Ca 0.31 -0.25 -0.10 0.00 -1.87 0.00 0.00 60.65 58.74 3b7r h LYS 242 Cb -0.09 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.11 3b7r h LYS 242 CO -0.08 0.88 -0.25 0.82 -0.57 0.00 0.00 179.45 180.26 3b7r h ILE 243 N 0.86 1.31 -0.78 1.86 2.04 -1.21 -2.40 117.51 119.19 3b7r h ILE 243 Ca 0.17 -1.41 0.05 0.00 1.00 0.00 0.00 64.86 64.67 3b7r h ILE 243 Cb 0.45 1.64 -0.05 0.00 -0.74 0.00 0.00 36.82 38.11 3b7r h ILE 243 CO 0.02 0.44 0.48 0.00 0.00 0.00 0.00 178.15 179.09 3b7r h ALA 244 N 0.69 1.04 -0.45 1.87 0.00 -0.73 -1.59 119.26 120.09 3b7r h ALA 244 Ca 0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3b7r h ALA 244 Cb 0.80 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3b7r h ALA 244 CO 0.06 0.24 0.15 0.93 0.00 0.00 0.00 179.25 180.63 3b7r h GLU 245 N 0.91 0.66 -0.74 0.00 5.08 -0.77 0.26 114.58 119.97 3b7r h GLU 245 Ca 0.33 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.55 3b7r h GLU 245 Cb 0.09 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 3b7r h GLU 245 CO -0.14 0.57 0.31 0.22 -1.00 0.00 0.00 179.01 178.97 3b7r h ASP 246 N 0.65 1.00 0.49 1.42 3.58 -0.80 -0.53 116.42 122.23 3b7r h ASP 246 Ca 0.15 -0.14 -0.30 0.00 0.42 0.00 0.00 57.03 57.16 3b7r h ASP 246 Cb 0.18 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 40.97 3b7r h ASP 246 CO -0.01 0.88 -1.46 -0.07 -2.88 0.00 0.00 179.24 175.70 3b7r h LEU 247 N 1.07 0.42 0.00 2.28 4.07 -0.87 -3.40 115.31 118.89 3b7r h LEU 247 Ca 0.25 -0.54 0.00 0.00 0.08 0.00 0.00 57.88 57.67 3b7r h LEU 247 Cb 0.18 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.78 3b7r h LEU 247 CO -0.02 1.44 -1.16 0.61 -1.08 0.00 0.00 178.44 178.23 3b7r n GLY 248 N 1.64 -0.35 0.01 0.83 0.00 0.88 -4.16 105.19 104.04 3b7r n GLY 248 Ca -0.14 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.59 3b7r n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b7r n GLY 249 N 1.63 -4.16 3.64 -0.02 0.00 -0.21 -4.78 105.19 101.30 3b7r n GLY 249 Ca -0.01 -2.10 -0.45 0.00 0.00 0.00 0.00 46.02 43.46 3b7r n GLY 249 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3b7r n PRO 250 N -0.02 1.74 -2.34 1.61 -0.02 -1.26 -4.32 135.00 130.39 3b7r n PRO 250 Ca 0.00 0.61 -0.43 0.00 -2.02 0.00 0.00 63.50 61.67 3b7r n PRO 250 Cb 0.00 -2.16 -0.02 0.00 -0.02 0.00 0.00 33.50 31.30 3b7r n PRO 250 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3b7r s TYR 251 N -0.56 2.68 -2.25 6.00 5.04 -1.26 -4.94 117.35 122.06 3b7r s TYR 251 Ca 0.64 0.85 0.21 0.00 -2.44 0.00 0.00 57.07 56.32 3b7r s TYR 251 Cb -0.68 -3.59 0.08 0.00 0.35 0.00 0.00 41.96 38.12 3b7r s TYR 251 CO 0.55 -2.13 1.09 1.33 -1.34 0.00 0.00 175.55 175.06 3b7r n VAL 252 N 5.37 0.00 1.19 3.14 0.24 -1.26 -4.54 118.33 122.47 3b7r n VAL 252 Ca 0.14 -0.38 0.13 0.00 -2.04 0.00 0.00 64.34 62.19 3b7r n VAL 252 Cb 0.44 1.34 0.26 0.00 -1.47 0.00 0.00 33.84 34.41 3b7r n VAL 252 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 3b7r n TRP 253 N 0.54 0.00 0.00 6.34 7.02 -1.26 -5.01 117.44 125.07 3b7r n TRP 253 Ca 0.10 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.58 3b7r n TRP 253 Cb 0.48 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.37 3b7r n TRP 253 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3b7r n GLY 254 N 1.29 2.16 3.89 6.99 0.00 -1.26 -4.76 105.19 113.50 3b7r n GLY 254 Ca 0.16 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 3b7r n GLY 254 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3b7r s GLN 255 N 0.00 3.64 -0.48 1.61 2.00 -1.26 -4.95 119.66 120.21 3b7r s GLN 255 Ca 0.00 -0.05 0.03 0.00 -2.00 0.00 0.00 55.36 53.35 3b7r s GLN 255 Cb 0.00 -2.84 0.13 0.00 0.80 0.00 0.00 33.01 31.10 3b7r s GLN 255 CO 0.00 0.46 0.23 -0.47 -0.50 0.00 0.00 175.29 175.02 3b7r s TYR 256 N -1.66 2.94 0.26 1.67 5.04 0.49 -4.24 117.35 121.85 3b7r s TYR 256 Ca 0.41 -2.97 0.03 0.00 -2.44 0.00 0.00 57.07 52.10 3b7r s TYR 256 Cb -0.12 -2.60 -0.03 0.00 0.35 0.00 0.00 41.96 39.55 3b7r s TYR 256 CO 0.24 -0.77 0.42 -0.51 -1.34 0.00 0.00 175.55 173.59 3b7r s ASP 257 N -0.02 6.32 -0.03 4.32 1.01 -0.85 -3.97 116.67 123.46 3b7r s ASP 257 Ca 0.16 0.23 0.07 0.00 0.71 0.00 0.00 52.55 53.73 3b7r s ASP 257 Cb -0.25 -1.93 -0.02 0.00 1.01 0.00 0.00 42.92 41.73 3b7r s ASP 257 CO -0.01 -0.13 -0.24 -0.76 0.21 0.00 0.00 175.17 174.24 3b7r s LEU 258 N -3.97 2.04 -0.14 1.23 1.43 -0.46 -1.56 118.68 117.25 3b7r s LEU 258 Ca 0.36 -0.44 0.02 0.00 -1.03 0.00 0.00 54.13 53.04 3b7r s LEU 258 Cb -0.10 -1.25 0.01 0.00 0.03 0.00 0.00 46.19 44.88 3b7r s LEU 258 CO 0.31 0.28 -0.22 -0.22 0.23 0.00 0.00 176.35 176.74 3b7r s LEU 259 N -0.48 2.13 -0.41 1.79 2.96 -0.14 -0.31 118.68 124.22 3b7r s LEU 259 Ca 0.07 -0.60 -0.14 0.00 -0.22 0.00 0.00 54.13 53.24 3b7r s LEU 259 Cb -0.10 -1.45 0.03 0.00 0.50 0.00 0.00 46.19 45.17 3b7r s LEU 259 CO -0.00 0.08 0.29 -0.69 -1.32 0.00 0.00 176.35 174.71 3b7r s VAL 260 N 0.80 5.11 0.95 1.68 1.01 -0.18 -0.53 120.40 129.24 3b7r s VAL 260 Ca -0.07 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.01 3b7r s VAL 260 Cb -0.16 -3.88 0.16 0.00 0.00 0.00 0.00 36.38 32.51 3b7r s VAL 260 CO -0.02 -0.33 1.17 -0.76 0.00 0.00 0.00 175.10 175.16 3b7r s LEU 261 N 1.65 2.00 1.00 3.92 1.43 -0.47 -4.59 118.68 123.62 3b7r s LEU 261 Ca 0.04 0.79 -0.12 0.00 -1.03 0.00 0.00 54.13 53.80 3b7r s LEU 261 Cb -0.20 -3.00 0.19 0.00 0.03 0.00 0.00 46.19 43.22 3b7r s LEU 261 CO 0.09 -2.74 1.10 -2.84 0.23 0.00 0.00 176.35 172.19 3b7r s PRO 262 N -5.43 0.39 0.53 1.29 0.02 -1.26 -3.98 135.00 126.56 3b7r s PRO 262 Ca 0.66 0.49 0.35 0.00 0.02 0.00 0.00 61.00 62.52 3b7r s PRO 262 Cb -0.12 -1.74 1.66 0.00 0.02 0.00 0.00 34.50 34.32 3b7r s PRO 262 CO 0.53 -2.75 2.05 -1.35 -0.33 0.00 0.00 177.00 175.15 3b7r h PRO 263 N -1.91 0.00 0.00 5.54 0.11 -1.89 -2.45 132.00 131.40 3b7r h PRO 263 Ca -0.55 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.56 3b7r h PRO 263 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 3b7r h PRO 263 CO 0.58 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.24 3b7r n SER 264 N -2.89 0.00 -4.68 -2.05 3.41 -1.26 -0.55 113.62 105.60 3b7r n SER 264 Ca -0.01 -1.27 -0.46 0.00 -0.26 0.00 0.00 58.87 56.88 3b7r n SER 264 Cb 0.19 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.10 3b7r n SER 264 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3b7r n PHE 265 N -0.85 2.39 0.30 7.33 7.35 -0.92 -4.69 117.46 128.36 3b7r n PHE 265 Ca 0.17 0.03 0.17 0.00 -0.76 0.00 0.00 57.45 57.06 3b7r n PHE 265 Cb 0.08 -2.65 0.73 0.00 0.35 0.00 0.00 39.48 37.99 3b7r n PHE 265 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 3b7r h PRO 266 N 8.08 0.00 -6.00 -7.13 0.13 -1.89 -3.24 132.00 121.95 3b7r h PRO 266 Ca -0.47 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.08 3b7r h PRO 266 Cb 1.25 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.28 3b7r h PRO 266 CO 0.93 0.00 -0.60 0.71 -0.23 0.00 0.00 178.00 178.81 3b7r s TYR 267 N -3.69 2.56 0.12 1.56 2.02 -1.26 -0.47 117.35 118.20 3b7r s TYR 267 Ca 0.01 -0.45 -0.15 0.00 -0.37 0.00 0.00 57.07 56.11 3b7r s TYR 267 Cb 0.09 -1.55 -0.02 0.00 -0.40 0.00 0.00 41.96 40.09 3b7r s TYR 267 CO 0.50 0.44 1.58 0.78 -1.57 0.00 0.00 175.55 177.28 3b7r h GLY 268 N 1.76 0.76 -3.25 0.71 0.00 -1.94 -3.35 103.07 97.76 3b7r h GLY 268 Ca -0.43 -0.55 -0.06 0.00 0.00 0.00 0.00 47.33 46.29 3b7r h GLY 268 CO 0.67 0.51 -0.06 -0.32 0.00 0.00 0.00 176.54 177.34 3b7r s GLY 269 N -3.30 -0.30 -0.08 4.60 0.00 -1.26 -1.22 107.32 105.77 3b7r s GLY 269 Ca -0.13 0.10 -0.03 0.00 0.00 0.00 0.00 44.72 44.66 3b7r s GLY 269 CO 0.79 -0.17 0.17 -0.29 0.00 0.00 0.00 173.10 173.61 3b7r s MET 270 N -3.42 0.12 -0.10 2.90 1.75 -0.02 -4.98 119.30 115.55 3b7r s MET 270 Ca 0.00 0.42 -0.00 0.00 -1.25 0.00 0.00 55.69 54.86 3b7r s MET 270 Cb 0.01 -0.17 0.06 0.00 2.84 0.00 0.00 34.83 37.57 3b7r s MET 270 CO -0.09 -0.17 2.04 -0.85 -0.65 0.00 0.00 175.02 175.30 3b7r n GLU 271 N 4.23 1.27 -1.69 4.11 0.00 -1.26 -1.42 120.64 125.88 3b7r n GLU 271 Ca -0.26 -0.50 -0.44 0.00 0.00 0.00 0.00 57.16 55.96 3b7r n GLU 271 Cb 0.52 -1.21 -0.04 0.00 0.00 0.00 0.00 31.44 30.71 3b7r n GLU 271 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3b7r n ASN 272 N 1.17 3.65 -4.75 -1.84 5.03 -1.26 -4.82 115.26 112.45 3b7r n ASN 272 Ca 0.10 1.02 -0.41 0.00 0.87 0.00 0.00 54.58 56.16 3b7r n ASN 272 Cb 0.53 -1.49 -0.02 0.00 -1.02 0.00 0.00 39.78 37.78 3b7r n ASN 272 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 3b7r s PRO 273 N 2.17 4.26 0.00 3.52 0.04 -1.26 -1.52 135.00 142.21 3b7r s PRO 273 Ca 0.82 2.32 0.00 0.00 0.04 0.00 0.00 61.00 64.17 3b7r s PRO 273 Cb -0.58 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 30.87 3b7r s PRO 273 CO 0.39 -0.41 0.00 0.00 0.04 0.00 0.00 177.00 177.02 3b7r n LEU 275 N 0.00 -3.13 -4.75 0.00 7.94 -0.58 -2.00 117.00 114.48 3b7r n LEU 275 Ca 0.00 -3.11 -0.41 0.00 -1.11 0.00 0.00 56.01 51.37 3b7r n LEU 275 Cb 0.00 0.77 -0.01 0.00 0.53 0.00 0.00 43.42 44.70 3b7r n LEU 275 CO 0.00 1.95 1.21 -0.89 -1.11 0.00 0.00 177.39 178.55 3b7r s THR 276 N 0.76 2.13 -0.16 1.96 2.01 -0.60 -4.07 115.64 117.67 3b7r s THR 276 Ca 0.31 0.11 -0.11 0.00 0.31 0.00 0.00 61.69 62.32 3b7r s THR 276 Cb 0.06 -3.07 -0.05 0.00 0.01 0.00 0.00 72.50 69.45 3b7r s THR 276 CO -0.11 0.02 0.20 -0.36 -0.69 0.00 0.00 174.62 173.68 3b7r s PHE 277 N -0.18 3.49 0.14 4.92 0.40 -0.51 -0.97 117.98 125.27 3b7r s PHE 277 Ca 0.61 0.50 0.05 0.00 -0.60 0.00 0.00 56.93 57.49 3b7r s PHE 277 Cb -0.47 -2.16 -0.04 0.00 0.51 0.00 0.00 43.02 40.86 3b7r s PHE 277 CO 0.50 0.41 -0.12 0.14 0.70 0.00 0.00 175.22 176.85 3b7r s VAL 278 N -0.06 1.26 0.34 -0.44 -7.23 0.31 -0.84 120.40 113.74 3b7r s VAL 278 Ca 0.13 -1.88 -0.27 0.00 -1.81 0.00 0.00 61.98 58.15 3b7r s VAL 278 Cb -0.12 -1.67 -0.09 0.00 0.56 0.00 0.00 36.38 35.05 3b7r s VAL 278 CO 0.02 -0.57 1.13 0.28 -0.31 0.00 0.00 175.10 175.64 3b7r s THR 279 N -2.70 3.37 -1.07 5.32 -1.32 -0.35 -1.37 115.64 117.53 3b7r s THR 279 Ca 0.13 1.26 0.15 0.00 -1.21 0.00 0.00 61.69 62.01 3b7r s THR 279 Cb -0.02 -3.75 0.15 0.00 -1.51 0.00 0.00 72.50 67.37 3b7r s THR 279 CO 0.02 0.20 1.47 -0.81 -2.21 0.00 0.00 174.62 173.29 3b7r n PRO 280 N 0.62 0.03 0.00 7.08 -0.04 -1.26 -2.21 135.00 139.23 3b7r n PRO 280 Ca 0.02 0.23 0.08 0.00 -0.04 0.00 0.00 63.50 63.78 3b7r n PRO 280 Cb 0.46 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.84 3b7r n PRO 280 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3b7r n THR 281 N -1.47 0.31 0.71 0.52 -2.24 -1.26 -1.96 114.28 108.89 3b7r n THR 281 Ca 0.04 0.08 0.12 0.00 -2.27 0.00 0.00 64.05 62.02 3b7r n THR 281 Cb 0.17 -0.83 0.48 0.00 -2.10 0.00 0.00 70.33 68.05 3b7r n THR 281 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3b7r n LEU 282 N -1.16 0.24 -3.61 3.22 4.77 -0.94 -4.50 117.00 115.03 3b7r n LEU 282 Ca 0.09 0.54 -0.41 0.00 -0.03 0.00 0.00 56.01 56.20 3b7r n LEU 282 Cb 0.09 -0.48 -0.01 0.00 -2.33 0.00 0.00 43.42 40.70 3b7r n LEU 282 CO 0.10 -0.18 2.69 0.18 -1.33 0.00 0.00 177.39 178.86 3b7r n LEU 283 N -1.74 7.52 0.23 2.23 4.77 -0.83 -4.63 117.00 124.56 3b7r n LEU 283 Ca 0.05 -4.42 0.13 0.00 -0.03 0.00 0.00 56.01 51.74 3b7r n LEU 283 Cb 0.30 -1.55 0.38 0.00 -2.33 0.00 0.00 43.42 40.21 3b7r n LEU 283 CO 0.23 1.57 0.84 0.00 -1.33 0.00 0.00 177.39 178.70 3b7r h ALA 284 N 5.47 0.97 0.00 -1.18 0.00 -1.88 -3.47 119.26 119.17 3b7r h ALA 284 Ca 0.64 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.48 3b7r h ALA 284 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3b7r h ALA 284 CO 1.75 0.10 0.00 0.41 0.00 0.00 0.00 179.25 181.51 3b7r n GLY 285 N 0.60 0.58 0.06 0.00 0.00 -1.26 -4.84 105.19 100.33 3b7r n GLY 285 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3b7r n GLY 285 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3b7r n ASP 286 N 0.00 0.20 -0.58 1.61 5.68 -1.26 -5.00 116.55 117.20 3b7r n ASP 286 Ca 0.00 -1.22 -0.08 0.00 -0.50 0.00 0.00 54.79 52.99 3b7r n ASP 286 Cb 0.00 -0.03 -0.03 0.00 -1.14 0.00 0.00 41.12 39.92 3b7r n ASP 286 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3b7r n LYS 287 N -0.06 -1.11 0.26 0.11 5.02 -1.26 -4.88 118.16 116.25 3b7r n LYS 287 Ca 0.00 0.69 0.16 0.00 -2.02 0.00 0.00 58.31 57.14 3b7r n LYS 287 Cb 0.50 -4.72 0.56 0.00 -0.02 0.00 0.00 35.03 31.35 3b7r n LYS 287 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3b7r h SER 288 N 0.00 0.00 -0.56 4.39 4.64 -1.91 -2.75 113.55 117.37 3b7r h SER 288 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 3b7r h SER 288 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 3b7r h SER 288 CO 0.23 0.01 0.00 0.18 -0.87 0.00 0.00 176.83 176.38 3b7r n LEU 289 N -3.11 5.57 0.00 5.97 4.77 -1.26 -4.62 117.00 124.32 3b7r n LEU 289 Ca 0.01 -2.83 0.15 0.00 -0.03 0.00 0.00 56.01 53.32 3b7r n LEU 289 Cb 0.36 -0.68 0.89 0.00 -2.33 0.00 0.00 43.42 41.66 3b7r n LEU 289 CO 0.29 0.62 1.07 -1.54 -1.33 0.00 0.00 177.39 176.50 3b7r n SER 290 N 0.62 0.00 0.28 -1.43 3.41 -1.04 -2.38 113.62 113.08 3b7r n SER 290 Ca 0.27 -0.84 0.14 0.00 -0.26 0.00 0.00 58.87 58.18 3b7r n SER 290 Cb 1.16 -0.04 0.83 0.00 -0.26 0.00 0.00 64.21 65.89 3b7r n SER 290 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3b7r h ASN 291 N 0.00 0.00 -0.80 4.04 -1.07 -1.86 -0.82 115.58 115.07 3b7r h ASN 291 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 56.30 56.35 3b7r h ASN 291 Cb 0.04 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.25 3b7r h ASN 291 CO 0.00 0.06 0.43 0.58 0.07 0.00 0.00 177.43 178.57 3b7r h VAL 292 N 0.00 1.24 -0.46 6.14 2.07 -1.87 0.03 116.25 123.40 3b7r h VAL 292 Ca -0.00 -0.63 -0.09 0.00 0.82 0.00 0.00 66.70 66.80 3b7r h VAL 292 Cb 0.18 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 3b7r h VAL 292 CO 0.01 0.28 -0.06 0.40 0.02 0.00 0.00 177.57 178.22 3b7r h ILE 293 N 1.14 1.27 -0.64 4.57 1.08 -1.37 -1.19 117.51 122.36 3b7r h ILE 293 Ca 0.28 -1.15 -0.03 0.00 -0.39 0.00 0.00 64.86 63.57 3b7r h ILE 293 Cb 0.05 1.08 -0.03 0.00 -3.07 0.00 0.00 36.82 34.86 3b7r h ILE 293 CO -0.04 0.40 0.28 0.00 -0.69 0.00 0.00 178.15 178.09 3b7r h ALA 294 N 0.89 1.27 0.30 1.87 0.00 -1.07 0.50 119.26 123.02 3b7r h ALA 294 Ca 0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3b7r h ALA 294 Cb 0.59 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3b7r h ALA 294 CO 0.04 0.54 -0.14 1.25 0.00 0.00 0.00 179.25 180.94 3b7r h HIS 295 N 0.92 -0.37 -0.54 0.00 -0.00 -0.69 -1.23 115.15 113.24 3b7r h HIS 295 Ca 0.22 -0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.54 3b7r h HIS 295 Cb 0.15 0.12 -0.02 0.00 -0.00 0.00 0.00 27.41 27.66 3b7r h HIS 295 CO 0.01 -0.20 0.18 0.93 -0.00 0.00 0.00 177.93 178.85 3b7r h GLU 296 N -0.44 0.84 -0.35 5.26 4.39 -0.74 -2.01 114.58 121.52 3b7r h GLU 296 Ca -0.04 -0.17 0.06 0.00 0.34 0.00 0.00 59.36 59.55 3b7r h GLU 296 Cb 0.34 -0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 28.81 3b7r h GLU 296 CO 0.07 0.76 0.02 0.82 -1.16 0.00 0.00 179.01 179.51 3b7r h ILE 297 N 0.75 0.76 -0.32 3.13 2.04 -0.90 -2.37 117.51 120.60 3b7r h ILE 297 Ca 0.18 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 66.00 3b7r h ILE 297 Cb 0.26 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3b7r h ILE 297 CO -0.01 0.02 0.21 0.28 0.00 0.00 0.00 178.15 178.66 3b7r h SER 298 N 0.12 0.36 0.32 1.72 0.02 -0.53 -0.80 113.55 114.76 3b7r h SER 298 Ca 0.17 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3b7r h SER 298 Cb 0.22 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.67 3b7r h SER 298 CO -0.27 0.26 0.00 0.45 -1.14 0.00 0.00 176.83 176.13 3b7r h HIS 299 N 0.42 0.00 0.00 3.45 3.86 -0.85 -1.91 115.15 120.13 3b7r h HIS 299 Ca 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 3b7r h HIS 299 Cb -0.04 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.43 3b7r h HIS 299 CO -0.00 0.00 0.00 0.77 0.86 0.00 0.00 177.93 179.56 3b7r h SER 300 N 0.00 0.00 0.00 2.45 0.02 -1.19 -1.02 113.55 113.81 3b7r h SER 300 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3b7r h SER 300 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3b7r h SER 300 CO 0.00 0.00 -0.32 0.79 -1.14 0.00 0.00 176.83 176.16 3b7r n TRP 301 N -2.51 0.00 -2.82 3.45 8.01 -0.77 -4.08 117.44 118.72 3b7r n TRP 301 Ca -0.01 0.00 -0.43 0.00 -1.31 0.00 0.00 57.50 55.75 3b7r n TRP 301 Cb 0.08 -0.16 -0.04 0.00 -2.01 0.00 0.00 31.31 29.18 3b7r n TRP 301 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.69 177.63 3b7r s THR 302 N -1.93 4.27 0.00 -0.99 -4.23 -0.90 -1.92 115.64 109.94 3b7r s THR 302 Ca -0.09 -0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.31 3b7r s THR 302 Cb 0.01 -4.67 0.00 0.00 1.34 0.00 0.00 72.50 69.18 3b7r s THR 302 CO 0.14 -1.41 0.00 0.61 -0.54 0.00 0.00 174.62 173.41 3b7r n GLY 303 N 5.28 3.20 0.09 3.99 0.00 0.22 -4.21 105.19 113.75 3b7r n GLY 303 Ca -0.02 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.08 3b7r n GLY 303 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3b7r h ASN 304 N 0.00 0.11 0.00 1.61 4.21 -1.27 -3.33 115.58 116.90 3b7r h ASN 304 Ca 0.00 -0.18 -0.04 0.00 1.21 0.00 0.00 56.30 57.29 3b7r h ASN 304 Cb 0.00 -0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.16 3b7r h ASN 304 CO 0.00 1.15 -0.88 0.18 -1.29 0.00 0.00 177.43 176.60 3b7r n LEU 305 N -3.22 1.88 -4.63 1.61 4.77 -0.98 -4.85 117.00 111.58 3b7r n LEU 305 Ca -0.14 0.48 -0.38 0.00 -0.03 0.00 0.00 56.01 55.93 3b7r n LEU 305 Cb 1.03 -0.82 -0.09 0.00 -2.33 0.00 0.00 43.42 41.21 3b7r n LEU 305 CO 0.46 -0.29 0.01 0.54 -1.33 0.00 0.00 177.39 176.78 3b7r s VAL 306 N -2.55 5.23 0.01 4.08 0.11 -0.81 -1.00 120.40 125.47 3b7r s VAL 306 Ca -0.23 0.49 0.07 0.00 -2.93 0.00 0.00 61.98 59.38 3b7r s VAL 306 Cb 0.04 -3.65 -0.02 0.00 -1.53 0.00 0.00 36.38 31.21 3b7r s VAL 306 CO 0.35 0.22 -0.22 -0.89 -3.33 0.00 0.00 175.10 171.22 3b7r s THR 307 N 1.69 1.78 0.22 5.04 2.01 -0.75 0.69 115.64 126.32 3b7r s THR 307 Ca 0.14 -1.07 -0.32 0.00 0.31 0.00 0.00 61.69 60.74 3b7r s THR 307 Cb -0.15 -1.50 -0.12 0.00 0.01 0.00 0.00 72.50 70.73 3b7r s THR 307 CO 0.09 0.40 1.67 -0.46 -0.69 0.00 0.00 174.62 175.62 3b7r n ASN 308 N 2.24 3.80 0.05 3.53 2.04 -1.26 -0.49 115.26 125.17 3b7r n ASN 308 Ca -0.16 1.08 -0.04 0.00 -0.44 0.00 0.00 54.58 55.02 3b7r n ASN 308 Cb 0.53 -1.55 0.18 0.00 -2.53 0.00 0.00 39.78 36.40 3b7r n ASN 308 CO 0.00 0.00 0.00 0.50 -0.44 0.00 0.00 177.26 177.32 3b7r h LYS 309 N 6.17 0.38 -4.23 -3.83 3.64 -1.12 -3.40 116.57 114.18 3b7r h LYS 309 Ca -0.44 -0.18 -0.17 0.00 -1.27 0.00 0.00 60.65 58.59 3b7r h LYS 309 Cb 1.22 -0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.90 3b7r h LYS 309 CO 0.91 0.72 -0.46 0.95 -2.27 0.00 0.00 179.45 179.30 3b7r s THR 310 N -4.22 0.03 -1.01 1.00 -4.23 -1.26 -2.65 115.64 103.30 3b7r s THR 310 Ca -0.06 -1.74 0.19 0.00 -1.18 0.00 0.00 61.69 58.90 3b7r s THR 310 Cb 0.13 -2.25 0.16 0.00 1.34 0.00 0.00 72.50 71.89 3b7r s THR 310 CO 0.79 -0.12 1.61 0.79 -0.54 0.00 0.00 174.62 177.14 3b7r n TRP 311 N -0.26 0.00 0.26 3.99 7.02 -1.26 -1.77 117.44 125.42 3b7r n TRP 311 Ca -0.02 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.59 3b7r n TRP 311 Cb 0.64 -0.49 0.73 0.00 -2.42 0.00 0.00 31.31 29.77 3b7r n TRP 311 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3b7r h ASP 312 N 0.00 0.00 -0.38 -0.99 5.19 -1.97 -2.75 116.42 115.52 3b7r h ASP 312 Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 3b7r h ASP 312 Cb 0.32 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.82 3b7r h ASP 312 CO 0.00 0.11 0.01 1.41 -3.12 0.00 0.00 179.24 177.66 3b7r n HIS 313 N -3.61 1.35 -0.30 4.55 8.25 -0.73 -2.76 115.22 121.97 3b7r n HIS 313 Ca -0.02 -0.89 0.21 0.00 -0.26 0.00 0.00 57.72 56.76 3b7r n HIS 313 Cb 0.24 -0.40 0.49 0.00 1.12 0.00 0.00 29.99 31.44 3b7r n HIS 313 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3b7r h PHE 314 N 2.39 0.66 -0.78 4.41 3.57 -1.59 -0.25 116.94 125.35 3b7r h PHE 314 Ca 0.03 0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.75 3b7r h PHE 314 Cb 1.66 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 40.16 3b7r h PHE 314 CO 0.73 0.11 0.54 0.11 -2.23 0.00 0.00 178.31 177.57 3b7r h TRP 315 N 0.44 0.20 -0.20 0.41 5.08 -1.83 -1.15 115.95 118.90 3b7r h TRP 315 Ca 0.55 0.01 0.00 0.00 1.08 0.00 0.00 58.89 60.53 3b7r h TRP 315 Cb 1.35 -0.06 -0.01 0.00 -3.00 0.00 0.00 29.16 27.43 3b7r h TRP 315 CO -0.00 0.06 0.13 -0.07 -1.28 0.00 0.00 178.44 177.28 3b7r h LEU 316 N 0.16 0.23 0.33 0.11 3.38 -1.37 0.49 115.31 118.65 3b7r h LEU 316 Ca 0.38 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.33 3b7r h LEU 316 Cb 1.27 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 3b7r h LEU 316 CO -0.06 0.17 -0.21 0.78 0.09 0.00 0.00 178.44 179.21 3b7r h ASN 317 N 0.27 -0.52 0.16 -0.43 4.21 -1.40 -3.17 115.58 114.71 3b7r h ASN 317 Ca 0.07 0.03 -0.26 0.00 1.21 0.00 0.00 56.30 57.36 3b7r h ASN 317 Cb -0.03 0.16 0.02 0.00 -1.12 0.00 0.00 38.32 37.35 3b7r h ASN 317 CO -0.02 -0.33 -1.21 -0.33 -1.29 0.00 0.00 177.43 174.25 3b7r h GLU 318 N -0.52 0.35 -0.64 0.81 4.39 -1.12 -2.90 114.58 114.94 3b7r h GLU 318 Ca -0.03 -0.59 0.04 0.00 0.34 0.00 0.00 59.36 59.11 3b7r h GLU 318 Cb 0.43 0.22 -0.04 0.00 -0.10 0.00 0.00 28.75 29.26 3b7r h GLU 318 CO 0.03 1.28 0.38 0.78 -1.16 0.00 0.00 179.01 180.33 3b7r h GLY 319 N -0.05 0.93 1.45 -3.84 0.00 0.04 -0.64 103.07 100.96 3b7r h GLY 319 Ca -0.23 -0.28 -0.11 0.00 0.00 0.00 0.00 47.33 46.71 3b7r h GLY 319 CO 0.15 0.22 -0.26 0.45 0.00 0.00 0.00 176.54 177.11 3b7r h HIS 320 N 0.74 0.71 -0.38 5.60 3.86 -1.67 -1.11 115.15 122.91 3b7r h HIS 320 Ca 0.27 -0.16 -0.16 0.00 -1.16 0.00 0.00 60.37 59.15 3b7r h HIS 320 Cb 0.07 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 3b7r h HIS 320 CO -0.06 0.82 -0.41 1.15 0.86 0.00 0.00 177.93 180.30 3b7r h THR 321 N 0.55 1.27 -0.80 2.45 2.02 -1.24 -1.22 112.91 115.94 3b7r h THR 321 Ca 0.07 -1.58 -0.04 0.00 0.77 0.00 0.00 66.41 65.64 3b7r h THR 321 Cb 0.73 1.41 -0.04 0.00 -1.74 0.00 0.00 68.15 68.51 3b7r h THR 321 CO 0.06 0.53 0.36 0.58 0.37 0.00 0.00 175.52 177.41 3b7r h VAL 322 N 0.76 1.26 0.16 3.16 2.07 -0.97 0.14 116.25 122.82 3b7r h VAL 322 Ca 0.06 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 3b7r h VAL 322 Cb 1.00 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 3b7r h VAL 322 CO 0.10 0.32 -0.08 0.22 0.02 0.00 0.00 177.57 178.15 3b7r h TYR 323 N 1.15 -0.20 -0.48 1.57 3.20 -0.94 0.31 116.97 121.58 3b7r h TYR 323 Ca 0.27 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 3b7r h TYR 323 Cb 0.16 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 3b7r h TYR 323 CO 0.02 -0.07 0.28 1.25 -1.64 0.00 0.00 178.16 178.00 3b7r h LEU 324 N -0.28 0.59 -0.27 2.82 6.46 -1.12 -2.41 115.31 121.11 3b7r h LEU 324 Ca -0.02 -0.08 0.06 0.00 -0.12 0.00 0.00 57.88 57.73 3b7r h LEU 324 Cb 0.22 -0.15 -0.07 0.00 -0.73 0.00 0.00 40.66 39.93 3b7r h LEU 324 CO 0.04 0.50 -0.19 -0.08 -0.62 0.00 0.00 178.44 178.08 3b7r h GLU 325 N 0.64 -0.17 0.00 1.25 4.81 -0.59 -1.13 114.58 119.40 3b7r h GLU 325 Ca 0.17 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.36 3b7r h GLU 325 Cb 0.02 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3b7r h GLU 325 CO -0.03 -0.11 -0.26 0.00 -0.73 0.00 0.00 179.01 177.88 3b7r h ARG 326 N -0.18 0.00 -0.24 1.92 3.08 -0.80 -1.30 114.38 116.87 3b7r h ARG 326 Ca 0.15 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.05 3b7r h ARG 326 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 3b7r h ARG 326 CO -0.38 0.26 -0.46 0.45 -1.07 0.00 0.00 179.97 178.77 3b7r h HIS 327 N 0.00 0.75 -0.02 3.04 3.86 -0.86 -1.13 115.15 120.78 3b7r h HIS 327 Ca -0.00 -0.24 -0.00 0.00 -1.16 0.00 0.00 60.37 58.97 3b7r h HIS 327 Cb 0.55 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.87 3b7r h HIS 327 CO 0.00 0.96 0.01 0.82 0.86 0.00 0.00 177.93 180.59 3b7r h ILE 328 N 0.49 1.05 -0.26 2.45 2.04 -0.23 0.02 117.51 123.08 3b7r h ILE 328 Ca 0.03 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.71 3b7r h ILE 328 Cb 0.99 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 3b7r h ILE 328 CO 0.09 0.04 0.05 0.00 0.00 0.00 0.00 178.15 178.34 3b7r h GLY 330 N 0.60 0.94 1.12 0.00 0.00 -0.92 0.42 103.07 105.22 3b7r h GLY 330 Ca 0.09 -0.85 -0.11 0.00 0.00 0.00 0.00 47.33 46.46 3b7r h GLY 330 CO -0.00 0.77 -0.08 3.21 0.00 0.00 0.00 176.54 180.44 3b7r h ARG 331 N 0.74 1.03 -0.12 4.80 2.47 -0.50 0.33 114.38 123.12 3b7r h ARG 331 Ca 0.09 -0.36 -0.23 0.00 -1.26 0.00 0.00 59.98 58.22 3b7r h ARG 331 Cb 0.82 -0.07 0.01 0.00 -1.65 0.00 0.00 29.97 29.07 3b7r h ARG 331 CO 0.07 1.05 -0.82 -0.07 0.56 0.00 0.00 179.97 180.77 3b7r h LEU 332 N 0.92 0.90 -0.39 3.04 4.07 -1.12 -3.39 115.31 119.34 3b7r h LEU 332 Ca 0.15 -0.61 0.00 0.00 0.08 0.00 0.00 57.88 57.50 3b7r h LEU 332 Cb 0.64 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.12 3b7r h LEU 332 CO 0.04 1.41 0.00 0.49 -1.08 0.00 0.00 178.44 179.30 3b7r n PHE 333 N -3.91 0.00 0.00 1.13 3.72 0.12 -5.10 117.46 113.42 3b7r n PHE 333 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 3b7r n PHE 333 Cb 0.77 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.31 3b7r n PHE 333 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3b7r n GLY 334 N 0.32 2.76 0.27 1.37 0.00 0.12 -4.59 105.19 105.44 3b7r n GLY 334 Ca 0.00 -1.86 -0.01 0.00 0.00 0.00 0.00 46.02 44.15 3b7r n GLY 334 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3b7r h GLU 335 N 0.00 0.54 -0.54 1.61 4.57 -1.93 -1.75 114.58 117.07 3b7r h GLU 335 Ca 0.00 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.04 3b7r h GLU 335 Cb 0.00 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 3b7r h GLU 335 CO 0.00 0.59 0.27 0.87 -1.18 0.00 0.00 179.01 179.56 3b7r h LYS 336 N 0.51 0.76 -0.27 1.92 1.57 -1.93 -0.35 116.57 118.78 3b7r h LYS 336 Ca 0.11 -0.09 -0.19 0.00 -1.87 0.00 0.00 60.65 58.61 3b7r h LYS 336 Cb 0.38 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3b7r h LYS 336 CO 0.02 0.58 -0.57 0.35 -0.57 0.00 0.00 179.45 179.25 3b7r h PHE 337 N 0.76 1.10 -0.62 -1.35 3.57 -1.60 -0.97 116.94 117.83 3b7r h PHE 337 Ca 0.19 -0.40 0.05 0.00 3.53 0.00 0.00 57.97 61.34 3b7r h PHE 337 Cb 0.06 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 38.55 3b7r h PHE 337 CO 0.01 1.24 0.34 -0.09 -2.23 0.00 0.00 178.31 177.57 3b7r h ARG 338 N 0.64 0.61 -0.59 1.11 2.43 -0.75 -0.79 114.38 117.05 3b7r h ARG 338 Ca 0.00 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.06 3b7r h ARG 338 Cb 1.19 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.57 3b7r h ARG 338 CO 0.13 0.41 0.05 0.45 -1.51 0.00 0.00 179.97 179.50 3b7r h HIS 339 N 0.63 1.05 -0.04 2.20 3.86 -0.90 -0.12 115.15 121.83 3b7r h HIS 339 Ca 0.27 -0.15 0.01 0.00 -1.16 0.00 0.00 60.37 59.35 3b7r h HIS 339 Cb 0.16 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.33 3b7r h HIS 339 CO -0.09 0.91 -0.03 0.35 0.86 0.00 0.00 177.93 179.93 3b7r h PHE 340 N 0.91 -0.07 -0.88 2.45 3.57 -0.85 0.29 116.94 122.36 3b7r h PHE 340 Ca 0.18 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 3b7r h PHE 340 Cb 0.46 0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.19 3b7r h PHE 340 CO 0.03 -0.05 0.50 -0.91 -2.23 0.00 0.00 178.31 175.65 3b7r h ASN 341 N -0.04 1.08 -0.43 0.41 -0.26 -0.89 -1.59 115.58 113.87 3b7r h ASN 341 Ca 0.03 -0.09 -0.02 0.00 -0.56 0.00 0.00 56.30 55.67 3b7r h ASN 341 Cb 0.07 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 37.04 3b7r h ASN 341 CO -0.06 0.85 0.21 0.00 -1.06 0.00 0.00 177.43 177.37 3b7r h ALA 342 N 1.27 0.55 -0.24 -0.83 0.00 -0.78 -1.93 119.26 117.31 3b7r h ALA 342 Ca 0.31 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 3b7r h ALA 342 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3b7r h ALA 342 CO -0.05 0.12 -0.46 1.25 0.00 0.00 0.00 179.25 180.10 3b7r h LEU 343 N 0.55 0.68 -0.68 0.00 5.85 -0.73 -2.02 115.31 118.97 3b7r h LEU 343 Ca 0.15 -0.33 0.10 0.00 0.84 0.00 0.00 57.88 58.64 3b7r h LEU 343 Cb 0.12 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 40.88 3b7r h LEU 343 CO -0.02 1.04 0.31 1.23 -0.34 0.00 0.00 178.44 180.66 3b7r h GLY 344 N 1.00 1.00 1.12 3.75 0.00 -1.16 -2.42 103.07 106.37 3b7r h GLY 344 Ca 0.03 -0.18 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 3b7r h GLY 344 CO 0.09 0.02 0.29 -1.33 0.00 0.00 0.00 176.54 175.61 3b7r h GLY 345 N 0.52 1.20 0.91 4.60 0.00 -0.77 -0.72 103.07 108.81 3b7r h GLY 345 Ca 0.34 -0.65 0.02 0.00 0.00 0.00 0.00 47.33 47.04 3b7r h GLY 345 CO -0.29 0.61 0.35 -0.25 0.00 0.00 0.00 176.54 176.96 3b7r h TRP 346 N 1.09 0.66 -0.98 5.60 2.91 -0.95 -0.31 115.95 123.96 3b7r h TRP 346 Ca 0.25 0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.33 3b7r h TRP 346 Cb 0.22 -0.22 -0.06 0.00 -0.51 0.00 0.00 29.16 28.59 3b7r h TRP 346 CO 0.02 0.39 0.64 0.78 -1.03 0.00 0.00 178.44 179.24 3b7r h GLY 347 N 0.70 1.45 1.49 2.65 0.00 -0.89 0.24 103.07 108.71 3b7r h GLY 347 Ca 0.22 -0.48 -0.10 0.00 0.00 0.00 0.00 47.33 46.96 3b7r h GLY 347 CO -0.09 0.40 -0.25 0.83 0.00 0.00 0.00 176.54 177.44 3b7r h GLU 348 N 1.22 0.59 -0.70 4.80 4.39 -0.64 -1.73 114.58 122.51 3b7r h GLU 348 Ca 0.40 -0.23 -0.07 0.00 0.34 0.00 0.00 59.36 59.80 3b7r h GLU 348 Cb 0.04 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 3b7r h GLU 348 CO -0.14 0.79 0.17 1.25 -1.16 0.00 0.00 179.01 179.92 3b7r h LEU 349 N 0.51 1.05 -0.35 1.33 5.85 -0.22 -1.09 115.31 122.41 3b7r h LEU 349 Ca 0.07 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.62 3b7r h LEU 349 Cb 0.70 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 3b7r h LEU 349 CO 0.05 1.01 0.06 1.56 -0.34 0.00 0.00 178.44 180.78 3b7r h GLN 350 N 1.06 0.17 -0.33 1.25 4.20 -0.69 -0.79 115.11 119.99 3b7r h GLN 350 Ca 0.22 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.93 3b7r h GLN 350 Cb 0.36 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 3b7r h GLN 350 CO 0.00 0.12 0.19 -0.91 -0.67 0.00 0.00 178.83 177.56 3b7r h ASN 351 N 0.18 0.32 -0.52 1.46 2.35 -0.93 -1.40 115.58 117.03 3b7r h ASN 351 Ca 0.16 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.89 3b7r h ASN 351 Cb 0.19 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 3b7r h ASN 351 CO -0.22 0.23 0.23 0.28 -1.65 0.00 0.00 177.43 176.30 3b7r h SER 352 N 0.40 0.71 -0.51 5.81 0.02 -0.91 -0.62 113.55 118.44 3b7r h SER 352 Ca 0.13 -0.15 -0.08 0.00 -0.84 0.00 0.00 61.79 60.84 3b7r h SER 352 Cb -0.00 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 3b7r h SER 352 CO -0.06 0.66 0.01 0.58 -1.14 0.00 0.00 176.83 176.89 3b7r h VAL 353 N 0.70 1.26 -0.57 2.27 2.07 -1.06 -0.90 116.25 120.03 3b7r h VAL 353 Ca 0.18 -1.07 -0.06 0.00 0.82 0.00 0.00 66.70 66.57 3b7r h VAL 353 Cb 0.16 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 3b7r h VAL 353 CO -0.02 0.39 0.12 0.50 0.02 0.00 0.00 177.57 178.58 3b7r h LYS 354 N 0.87 0.92 0.01 1.57 3.64 -1.03 0.11 116.57 122.66 3b7r h LYS 354 Ca 0.16 -0.23 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3b7r h LYS 354 Cb 0.49 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 3b7r h LYS 354 CO 0.02 0.86 -0.00 1.15 -2.27 0.00 0.00 179.45 179.21 3b7r h THR 355 N 0.82 1.11 -0.02 1.00 2.02 -0.84 -3.19 112.91 113.81 3b7r h THR 355 Ca 0.18 -0.36 -0.21 0.00 0.77 0.00 0.00 66.41 66.78 3b7r h THR 355 Cb 0.37 1.36 -0.00 0.00 -1.74 0.00 0.00 68.15 68.14 3b7r h THR 355 CO 0.01 0.09 -0.87 -0.26 0.37 0.00 0.00 175.52 174.86 3b7r h PHE 356 N -0.17 0.49 0.00 3.16 0.04 -1.17 -3.50 116.94 115.79 3b7r h PHE 356 Ca -0.00 -0.26 0.00 0.00 2.80 0.00 0.00 57.97 60.51 3b7r h PHE 356 Cb 0.16 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.25 3b7r h PHE 356 CO -0.02 1.06 0.00 0.41 -0.60 0.00 0.00 178.31 179.15 3b7r n GLY 357 N 0.83 2.42 0.21 -1.45 0.00 0.37 -4.66 105.19 102.91 3b7r n GLY 357 Ca -0.05 -1.67 0.15 0.00 0.00 0.00 0.00 46.02 44.45 3b7r n GLY 357 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3b7r h GLU 358 N 0.00 0.00 -0.35 1.61 4.11 -1.87 -1.86 114.58 116.22 3b7r h GLU 358 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3b7r h GLU 358 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3b7r h GLU 358 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 179.01 179.33 3b7r n THR 359 N -2.61 0.56 -2.27 -1.06 -2.24 -1.26 -1.73 114.28 103.67 3b7r n THR 359 Ca 0.01 -0.78 -0.41 0.00 -2.27 0.00 0.00 64.05 60.60 3b7r n THR 359 Cb 0.22 0.90 -0.03 0.00 -2.10 0.00 0.00 70.33 69.31 3b7r n THR 359 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3b7r s HIS 360 N -1.27 3.29 0.55 4.78 2.46 -0.70 -4.85 115.29 119.55 3b7r s HIS 360 Ca 0.32 1.41 0.23 0.00 0.47 0.00 0.00 55.06 57.50 3b7r s HIS 360 Cb 0.19 -3.53 1.45 0.00 -0.13 0.00 0.00 32.58 30.56 3b7r s HIS 360 CO 0.26 -1.48 2.11 -1.00 -2.47 0.00 0.00 174.74 172.15 3b7r h PRO 361 N 4.42 0.00 0.00 2.88 0.13 -1.95 -1.67 132.00 135.81 3b7r h PRO 361 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3b7r h PRO 361 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3b7r h PRO 361 CO 0.71 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.67 3b7r n PHE 362 N -4.25 0.00 1.35 1.56 3.72 -1.26 -2.55 117.46 116.02 3b7r n PHE 362 Ca 0.02 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.55 3b7r n PHE 362 Cb 0.29 -0.33 0.41 0.00 -0.94 0.00 0.00 39.48 38.92 3b7r n PHE 362 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3b7r n THR 363 N -1.33 0.02 -2.39 4.37 -2.24 -0.63 -4.84 114.28 107.25 3b7r n THR 363 Ca 0.09 -0.32 -0.33 0.00 -2.27 0.00 0.00 64.05 61.22 3b7r n THR 363 Cb 0.19 0.73 -0.02 0.00 -2.10 0.00 0.00 70.33 69.12 3b7r n THR 363 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3b7r s LYS 364 N -1.98 3.72 -0.04 -0.78 1.02 -1.06 -4.05 119.74 116.59 3b7r s LYS 364 Ca 0.35 1.21 -0.26 0.00 0.02 0.00 0.00 55.97 57.29 3b7r s LYS 364 Cb 0.21 -2.09 -0.21 0.00 -0.52 0.00 0.00 37.83 35.21 3b7r s LYS 364 CO 0.32 -0.48 1.21 1.25 -0.92 0.00 0.00 175.35 176.73 3b7r h LEU 365 N 1.12 -0.00 -9.02 3.17 5.85 -1.75 -3.40 115.31 111.27 3b7r h LEU 365 Ca -0.48 -0.55 -0.62 0.00 0.84 0.00 0.00 57.88 57.07 3b7r h LEU 365 Cb 1.21 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 42.09 3b7r h LEU 365 CO 0.59 0.55 -0.41 -0.69 -0.34 0.00 0.00 178.44 178.14 3b7r s VAL 366 N -4.00 5.28 0.28 1.05 1.01 -0.41 -4.53 120.40 119.08 3b7r s VAL 366 Ca -0.16 0.34 0.09 0.00 0.00 0.00 0.00 61.98 62.25 3b7r s VAL 366 Cb 0.01 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 3b7r s VAL 366 CO 0.68 0.27 0.04 0.68 0.00 0.00 0.00 175.10 176.77 3b7r s VAL 367 N 1.48 3.43 -0.39 2.92 -7.23 -1.11 -4.81 120.40 114.69 3b7r s VAL 367 Ca 0.11 -1.83 -0.05 0.00 -1.81 0.00 0.00 61.98 58.40 3b7r s VAL 367 Cb -0.15 -2.92 0.09 0.00 0.56 0.00 0.00 36.38 33.96 3b7r s VAL 367 CO 0.08 -0.33 0.18 -0.62 -0.31 0.00 0.00 175.10 174.10 3b7r s ASP 368 N -3.72 5.33 -0.14 4.85 2.15 -1.26 -4.53 116.67 119.35 3b7r s ASP 368 Ca 0.33 -1.67 0.13 0.00 0.43 0.00 0.00 52.55 51.77 3b7r s ASP 368 Cb -0.06 -1.87 0.60 0.00 -0.30 0.00 0.00 42.92 41.30 3b7r s ASP 368 CO 0.21 -0.48 1.45 0.18 -0.17 0.00 0.00 175.17 176.36 3b7r n LEU 369 N 4.73 4.24 -4.68 -1.34 4.77 -1.26 -4.80 117.00 118.66 3b7r n LEU 369 Ca -0.08 -2.15 -0.49 0.00 -0.03 0.00 0.00 56.01 53.27 3b7r n LEU 369 Cb 0.42 -0.58 -0.05 0.00 -2.33 0.00 0.00 43.42 40.89 3b7r n LEU 369 CO 0.34 0.60 1.47 0.41 -1.33 0.00 0.00 177.39 178.88 3b7r n THR 370 N 0.66 0.54 -1.69 -5.08 -1.04 -1.26 -1.70 114.28 104.72 3b7r n THR 370 Ca 0.21 -0.10 -0.18 0.00 -2.04 0.00 0.00 64.05 61.94 3b7r n THR 370 Cb 0.85 -1.83 -0.07 0.00 -1.82 0.00 0.00 70.33 67.47 3b7r n THR 370 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3b7r n ASP 371 N 6.44 -4.91 -4.38 8.00 8.00 -1.26 -4.98 116.55 123.46 3b7r n ASP 371 Ca 0.23 0.38 -0.33 0.00 0.71 0.00 0.00 54.79 55.78 3b7r n ASP 371 Cb 0.29 -4.34 -0.14 0.00 -0.02 0.00 0.00 41.12 36.90 3b7r n ASP 371 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3b7r s ILE 372 N -2.62 3.16 -0.01 0.53 -1.09 -0.69 -5.09 121.20 115.40 3b7r s ILE 372 Ca 0.00 -0.62 -0.30 0.00 -2.23 0.00 0.00 60.65 57.50 3b7r s ILE 372 Cb 0.00 -2.34 -0.06 0.00 -1.58 0.00 0.00 42.46 38.47 3b7r s ILE 372 CO 0.00 0.52 1.66 -0.62 -1.23 0.00 0.00 174.94 175.27 3b7r s ASP 373 N 0.41 6.65 0.44 3.58 -1.08 -1.26 -4.88 116.67 120.53 3b7r s ASP 373 Ca -0.09 2.32 0.18 0.00 -0.52 0.00 0.00 52.55 54.44 3b7r s ASP 373 Cb -0.16 -2.54 1.12 0.00 -1.46 0.00 0.00 42.92 39.88 3b7r s ASP 373 CO 0.05 -0.91 1.92 -0.65 0.52 0.00 0.00 175.17 176.10 3b7r h PRO 374 N 9.23 0.33 0.00 4.34 0.11 -1.98 -0.03 132.00 143.99 3b7r h PRO 374 Ca -0.41 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 3b7r h PRO 374 Cb 1.19 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 3b7r h PRO 374 CO 0.94 0.22 -0.14 -0.44 -0.21 0.00 0.00 178.00 178.37 3b7r h ASP 375 N 0.34 0.00 0.25 -2.05 3.32 -1.97 -0.67 116.42 115.64 3b7r h ASP 375 Ca 0.36 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.17 3b7r h ASP 375 Cb 0.93 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.49 3b7r h ASP 375 CO -0.10 0.14 -1.01 0.58 -1.72 0.00 0.00 179.24 177.12 3b7r h VAL 376 N 0.00 1.36 0.00 -1.35 2.07 -1.40 -3.30 116.25 113.64 3b7r h VAL 376 Ca -0.00 -2.43 -0.06 0.00 0.82 0.00 0.00 66.70 65.02 3b7r h VAL 376 Cb 0.25 2.46 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 3b7r h VAL 376 CO 0.02 0.73 -0.31 0.00 0.02 0.00 0.00 177.57 178.03 3b7r h ALA 377 N 0.60 0.82 -2.26 1.67 0.00 -1.20 -3.47 119.26 115.42 3b7r h ALA 377 Ca -0.11 -0.28 -0.59 0.00 0.00 0.00 0.00 54.91 53.93 3b7r h ALA 377 Cb 1.66 -0.05 0.08 0.00 0.00 0.00 0.00 17.79 19.48 3b7r h ALA 377 CO 0.18 0.39 0.60 0.98 0.00 0.00 0.00 179.25 181.40 3b7r n TYR 378 N -3.21 2.09 -3.73 0.00 9.36 -0.28 -4.96 117.16 116.44 3b7r n TYR 378 Ca 0.02 0.44 -0.05 0.00 3.32 0.00 0.00 57.90 61.63 3b7r n TYR 378 Cb 0.63 -2.45 0.02 0.00 -0.63 0.00 0.00 39.34 36.91 3b7r n TYR 378 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 3b7r n SER 379 N 2.29 -1.71 0.00 2.98 3.41 -1.26 -5.02 113.62 114.31 3b7r n SER 379 Ca 0.13 -2.07 0.10 0.00 -0.26 0.00 0.00 58.87 56.76 3b7r n SER 379 Cb 0.30 2.82 0.47 0.00 -0.26 0.00 0.00 64.21 67.55 3b7r n SER 379 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3b7r n SER 380 N -1.33 0.00 0.18 4.04 7.64 -1.26 -4.20 113.62 118.69 3b7r n SER 380 Ca -0.05 0.36 -0.14 0.00 1.01 0.00 0.00 58.87 60.05 3b7r n SER 380 Cb 0.49 -0.44 -0.07 0.00 -1.01 0.00 0.00 64.21 63.18 3b7r n SER 380 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3b7r h VAL 381 N 0.00 0.42 -0.11 0.44 2.07 -1.94 -0.57 116.25 116.55 3b7r h VAL 381 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 3b7r h VAL 381 Cb 0.32 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 3b7r h VAL 381 CO 0.00 0.00 0.08 1.55 0.02 0.00 0.00 177.57 179.22 3b7r h PRO 382 N -0.57 0.09 0.56 1.57 0.13 -1.89 0.12 132.00 132.02 3b7r h PRO 382 Ca -0.01 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.09 3b7r h PRO 382 Cb 0.53 -0.02 0.01 0.00 0.13 0.00 0.00 31.00 31.64 3b7r h PRO 382 CO -0.07 0.06 -0.27 1.88 -0.23 0.00 0.00 178.00 179.38 3b7r h TYR 383 N 0.10 -0.70 0.04 1.56 -1.99 -1.71 -2.85 116.97 111.42 3b7r h TYR 383 Ca 0.05 -0.02 -0.35 0.00 2.00 0.00 0.00 58.73 60.41 3b7r h TYR 383 Cb 0.07 0.23 -0.05 0.00 2.00 0.00 0.00 36.73 38.98 3b7r h TYR 383 CO -0.00 -0.39 -2.06 0.39 -0.00 0.00 0.00 178.16 176.10 3b7r n GLU 384 N -5.30 0.69 -0.08 4.88 -0.58 -0.26 -1.34 120.64 118.64 3b7r n GLU 384 Ca -0.11 0.21 -0.07 0.00 -0.42 0.00 0.00 57.16 56.77 3b7r n GLU 384 Cb 0.32 -1.67 0.11 0.00 -0.57 0.00 0.00 31.44 29.64 3b7r n GLU 384 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 3b7r h LYS 385 N 0.02 0.75 -0.14 3.49 3.64 -0.95 -0.18 116.57 123.21 3b7r h LYS 385 Ca -0.43 -0.28 -0.01 0.00 -1.27 0.00 0.00 60.65 58.66 3b7r h LYS 385 Cb 2.04 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.81 3b7r h LYS 385 CO 0.04 0.88 0.05 0.78 -2.27 0.00 0.00 179.45 178.94 3b7r h GLY 386 N 0.97 0.22 1.01 5.01 0.00 -1.50 -1.85 103.07 106.93 3b7r h GLY 386 Ca 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 3b7r h GLY 386 CO 0.05 0.11 0.40 -2.75 0.00 0.00 0.00 176.54 174.36 3b7r h PHE 387 N 0.06 1.02 -0.70 5.60 3.57 -1.18 -2.62 116.94 122.69 3b7r h PHE 387 Ca 0.05 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 3b7r h PHE 387 Cb 0.18 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 3b7r h PHE 387 CO -0.01 0.72 0.30 0.00 -2.23 0.00 0.00 178.31 177.09 3b7r h ALA 388 N 1.21 1.20 -0.27 2.41 0.00 -0.82 -0.06 119.26 122.92 3b7r h ALA 388 Ca 0.26 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3b7r h ALA 388 Cb 0.04 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3b7r h ALA 388 CO -0.04 0.59 0.17 1.25 0.00 0.00 0.00 179.25 181.22 3b7r h LEU 389 N 1.01 0.28 -0.70 0.00 5.85 -1.13 -0.40 115.31 120.21 3b7r h LEU 389 Ca 0.24 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.91 3b7r h LEU 389 Cb 0.16 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 3b7r h LEU 389 CO -0.02 0.20 0.26 -0.07 -0.34 0.00 0.00 178.44 178.47 3b7r h LEU 390 N 0.34 0.99 -0.37 2.25 3.38 -1.06 -0.91 115.31 119.94 3b7r h LEU 390 Ca 0.10 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.76 3b7r h LEU 390 Cb -0.02 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3b7r h LEU 390 CO -0.04 0.90 -0.28 0.15 0.09 0.00 0.00 178.44 179.26 3b7r h PHE 391 N 1.01 1.00 -0.09 1.13 3.57 -0.84 0.12 116.94 122.84 3b7r h PHE 391 Ca 0.23 -0.28 0.03 0.00 3.53 0.00 0.00 57.97 61.48 3b7r h PHE 391 Cb 0.24 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 3b7r h PHE 391 CO 0.02 1.07 -0.09 -0.92 -2.23 0.00 0.00 178.31 176.16 3b7r h TYR 392 N 0.65 -0.21 -0.78 0.41 3.20 -1.03 -1.19 116.97 118.02 3b7r h TYR 392 Ca 0.07 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 3b7r h TYR 392 Cb 0.86 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 39.20 3b7r h TYR 392 CO 0.06 -0.14 0.44 -0.07 -1.64 0.00 0.00 178.16 176.82 3b7r h LEU 393 N -0.11 0.97 -0.43 2.82 3.38 -1.00 -0.34 115.31 120.59 3b7r h LEU 393 Ca 0.07 -0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.03 3b7r h LEU 393 Cb 0.20 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.64 3b7r h LEU 393 CO -0.16 0.78 0.00 -0.08 0.09 0.00 0.00 178.44 179.07 3b7r h GLU 394 N 1.08 0.11 -0.37 1.13 4.81 -0.42 0.26 114.58 121.17 3b7r h GLU 394 Ca 0.28 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.39 3b7r h GLU 394 Cb 0.02 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 3b7r h GLU 394 CO -0.05 0.07 -0.20 1.96 -0.73 0.00 0.00 179.01 180.06 3b7r h GLN 395 N 0.11 0.72 -0.36 1.92 4.20 -0.78 0.67 115.11 121.60 3b7r h GLN 395 Ca 0.22 -0.28 -0.11 0.00 0.06 0.00 0.00 58.65 58.54 3b7r h GLN 395 Cb 0.31 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 3b7r h GLN 395 CO -0.36 0.87 -0.23 1.25 -0.67 0.00 0.00 178.83 179.70 3b7r h LEU 396 N 0.64 0.72 -2.02 1.46 5.85 -0.50 -3.31 115.31 118.14 3b7r h LEU 396 Ca 0.09 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3b7r h LEU 396 Cb 0.69 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.52 3b7r h LEU 396 CO 0.05 0.93 0.00 0.18 -0.34 0.00 0.00 178.44 179.26 3b7r n LEU 397 N -4.11 3.04 0.00 2.25 4.77 0.03 -4.93 117.00 118.04 3b7r n LEU 397 Ca 0.00 -1.25 0.00 0.00 -0.03 0.00 0.00 56.01 54.73 3b7r n LEU 397 Cb 0.43 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 3b7r n LEU 397 CO 0.44 0.63 0.00 0.61 -1.33 0.00 0.00 177.39 177.74 3b7r n GLY 398 N 1.41 1.13 0.00 -0.72 0.00 -1.13 -4.89 105.19 100.99 3b7r n GLY 398 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3b7r n GLY 398 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b7r n GLY 399 N -0.36 1.38 0.26 -0.02 0.00 0.21 -4.70 105.19 101.98 3b7r n GLY 399 Ca 0.00 -2.20 0.01 0.00 0.00 0.00 0.00 46.02 43.83 3b7r n GLY 399 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3b7r h PRO 400 N 0.00 0.41 -0.14 1.61 0.13 -1.99 -1.09 132.00 130.93 3b7r h PRO 400 Ca 0.00 -0.09 -0.01 0.00 -0.87 0.00 0.00 66.00 65.03 3b7r h PRO 400 Cb 0.00 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.06 3b7r h PRO 400 CO 0.00 0.48 0.03 0.93 -0.23 0.00 0.00 178.00 179.21 3b7r h GLU 401 N 0.40 0.23 -0.49 0.86 5.08 -1.97 0.22 114.58 118.91 3b7r h GLU 401 Ca 0.09 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3b7r h GLU 401 Cb 0.34 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3b7r h GLU 401 CO 0.01 0.39 0.25 0.82 -1.00 0.00 0.00 179.01 179.49 3b7r h ILE 402 N 0.03 1.18 0.00 3.13 2.04 -1.80 -2.43 117.51 119.66 3b7r h ILE 402 Ca 0.04 -0.49 -0.13 0.00 1.00 0.00 0.00 64.86 65.29 3b7r h ILE 402 Cb 0.27 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 3b7r h ILE 402 CO 0.00 0.20 -0.60 0.15 0.00 0.00 0.00 178.15 177.90 3b7r h PHE 403 N 0.65 0.00 -0.10 1.37 3.57 -1.01 -2.48 116.94 118.94 3b7r h PHE 403 Ca 0.17 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.59 3b7r h PHE 403 Cb 0.08 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 3b7r h PHE 403 CO -0.01 0.60 -0.31 -0.07 -2.23 0.00 0.00 178.31 176.29 3b7r h LEU 404 N 0.00 0.18 -0.54 0.59 3.38 -0.83 -1.21 115.31 116.89 3b7r h LEU 404 Ca -0.01 -0.06 0.06 0.00 0.09 0.00 0.00 57.88 57.96 3b7r h LEU 404 Cb 1.12 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.77 3b7r h LEU 404 CO 0.08 0.49 0.26 1.23 0.09 0.00 0.00 178.44 180.59 3b7r h GLY 405 N 1.04 0.76 0.98 0.83 0.00 -0.96 -1.86 103.07 103.85 3b7r h GLY 405 Ca 0.02 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.18 3b7r h GLY 405 CO 0.05 0.08 0.22 -2.75 0.00 0.00 0.00 176.54 174.14 3b7r h PHE 406 N 0.49 0.50 -0.42 5.60 3.57 -1.31 -2.26 116.94 123.12 3b7r h PHE 406 Ca 0.25 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.76 3b7r h PHE 406 Cb 0.20 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.74 3b7r h PHE 406 CO -0.12 0.37 0.24 1.25 -2.23 0.00 0.00 178.31 177.82 3b7r h LEU 407 N 0.49 0.39 -0.67 0.59 5.85 -1.04 0.12 115.31 121.04 3b7r h LEU 407 Ca 0.13 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 3b7r h LEU 407 Cb 0.01 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 3b7r h LEU 407 CO -0.02 0.28 0.18 0.50 -0.34 0.00 0.00 178.44 179.04 3b7r h LYS 408 N 0.49 1.06 -0.34 1.25 3.64 -1.30 -1.74 116.57 119.63 3b7r h LYS 408 Ca 0.17 -0.24 -0.11 0.00 -1.27 0.00 0.00 60.65 59.20 3b7r h LYS 408 Cb 0.01 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 3b7r h LYS 408 CO -0.08 0.94 -0.23 0.00 -2.27 0.00 0.00 179.45 177.81 3b7r h ALA 409 N 1.08 0.96 -0.13 5.00 0.00 -0.91 -1.58 119.26 123.68 3b7r h ALA 409 Ca 0.21 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3b7r h ALA 409 Cb 0.34 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3b7r h ALA 409 CO -0.00 0.61 0.09 -0.92 0.00 0.00 0.00 179.25 179.02 3b7r h TYR 410 N 0.59 0.17 -0.36 0.00 3.20 -0.60 0.15 116.97 120.12 3b7r h TYR 410 Ca 0.08 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.97 3b7r h TYR 410 Cb 0.71 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 3b7r h TYR 410 CO 0.03 0.12 0.21 0.28 -1.64 0.00 0.00 178.16 177.16 3b7r h VAL 411 N 0.17 1.03 -0.17 1.81 2.07 -1.19 -2.12 116.25 117.86 3b7r h VAL 411 Ca 0.05 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.42 3b7r h VAL 411 Cb -0.00 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 3b7r h VAL 411 CO -0.01 0.08 0.11 -0.33 0.02 0.00 0.00 177.57 177.44 3b7r h GLU 412 N 0.43 0.22 -0.57 1.57 5.08 -1.03 -1.19 114.58 119.09 3b7r h GLU 412 Ca 0.14 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.54 3b7r h GLU 412 Cb 0.01 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.16 3b7r h GLU 412 CO -0.07 0.16 0.30 -0.22 -1.00 0.00 0.00 179.01 178.18 3b7r h LYS 413 N 0.22 0.56 -0.40 2.33 1.63 -0.49 -3.21 116.57 117.21 3b7r h LYS 413 Ca 0.06 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 3b7r h LYS 413 Cb -0.02 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 31.49 3b7r h LYS 413 CO -0.01 0.37 0.00 1.19 -3.45 0.00 0.00 179.45 177.55 3b7r n PHE 414 N -4.84 0.87 -1.72 1.91 3.72 -0.81 -5.01 117.46 111.57 3b7r n PHE 414 Ca 0.06 -0.64 -0.43 0.00 -0.05 0.00 0.00 57.45 56.39 3b7r n PHE 414 Cb 0.14 -0.17 -0.02 0.00 -0.94 0.00 0.00 39.48 38.50 3b7r n PHE 414 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3b7r n SER 415 N 0.38 3.50 -0.17 4.37 7.64 -0.46 -1.68 113.62 127.20 3b7r n SER 415 Ca 0.18 1.14 -0.02 0.00 1.01 0.00 0.00 58.87 61.18 3b7r n SER 415 Cb 0.68 -1.53 -0.01 0.00 -1.01 0.00 0.00 64.21 62.34 3b7r n SER 415 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3b7r n TYR 416 N 2.23 0.00 -4.54 1.43 4.02 -0.17 -4.95 117.16 115.18 3b7r n TYR 416 Ca 0.10 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.72 3b7r n TYR 416 Cb 0.35 -0.97 -0.10 0.00 -0.02 0.00 0.00 39.34 38.60 3b7r n TYR 416 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3b7r s LYS 417 N -1.27 1.95 -0.08 -0.72 -0.14 -0.68 -5.00 119.74 113.81 3b7r s LYS 417 Ca 0.00 -2.02 0.03 0.00 -1.36 0.00 0.00 55.97 52.62 3b7r s LYS 417 Cb 0.00 -1.71 0.01 0.00 -1.68 0.00 0.00 37.83 34.45 3b7r s LYS 417 CO 0.00 0.01 -0.17 -1.12 -0.76 0.00 0.00 175.35 173.30 3b7r s SER 418 N -3.70 2.39 0.10 2.83 0.01 -1.26 -1.81 113.70 112.26 3b7r s SER 418 Ca 0.35 -0.42 0.01 0.00 1.31 0.00 0.00 55.95 57.20 3b7r s SER 418 Cb 0.07 -1.10 -0.04 0.00 0.21 0.00 0.00 66.02 65.16 3b7r s SER 418 CO 0.18 0.09 -0.05 0.27 0.41 0.00 0.00 173.24 174.13 3b7r s ILE 419 N 0.55 0.64 0.38 1.44 -4.36 0.36 -4.67 121.20 115.54 3b7r s ILE 419 Ca -0.16 -1.93 0.07 0.00 -0.26 0.00 0.00 60.65 58.38 3b7r s ILE 419 Cb -0.17 -1.73 -0.01 0.00 1.25 0.00 0.00 42.46 41.80 3b7r s ILE 419 CO 0.06 -0.83 0.43 0.42 0.24 0.00 0.00 174.94 175.25 3b7r s THR 420 N -3.66 3.31 0.28 8.37 -4.23 -1.26 -0.59 115.64 117.85 3b7r s THR 420 Ca 0.13 -1.18 0.02 0.00 -1.18 0.00 0.00 61.69 59.48 3b7r s THR 420 Cb 0.06 -3.14 0.27 0.00 1.34 0.00 0.00 72.50 71.02 3b7r s THR 420 CO -0.04 -0.08 1.75 0.74 -0.54 0.00 0.00 174.62 176.45 3b7r h THR 421 N 0.95 0.66 -0.37 3.99 2.02 -1.97 -1.34 112.91 116.84 3b7r h THR 421 Ca -0.43 -0.20 -0.07 0.00 0.77 0.00 0.00 66.41 66.48 3b7r h THR 421 Cb 1.26 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 3b7r h THR 421 CO 0.53 0.11 -0.05 0.44 0.37 0.00 0.00 175.52 176.92 3b7r h ASP 422 N 0.59 0.58 -0.73 4.18 3.45 -1.99 -0.52 116.42 121.99 3b7r h ASP 422 Ca 0.51 -0.14 -0.02 0.00 0.43 0.00 0.00 57.03 57.82 3b7r h ASP 422 Cb 0.82 -0.16 -0.03 0.00 -0.56 0.00 0.00 39.33 39.40 3b7r h ASP 422 CO -0.41 0.69 0.39 0.44 -1.57 0.00 0.00 179.24 178.78 3b7r h ASP 423 N 0.57 0.91 -0.23 6.45 3.32 -1.66 -1.16 116.42 124.62 3b7r h ASP 423 Ca 0.11 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 3b7r h ASP 423 Cb 0.44 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 3b7r h ASP 423 CO 0.02 0.75 0.11 -0.25 -1.72 0.00 0.00 179.24 178.16 3b7r h TRP 424 N 1.00 0.33 -0.59 4.55 7.01 -0.84 -1.98 115.95 125.44 3b7r h TRP 424 Ca 0.25 -0.01 -0.10 0.00 2.11 0.00 0.00 58.89 61.14 3b7r h TRP 424 Cb 0.05 -0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 26.98 3b7r h TRP 424 CO -0.00 0.32 -0.02 -0.22 -2.79 0.00 0.00 178.44 175.73 3b7r h LYS 425 N 0.25 1.04 -0.67 2.65 3.64 -0.96 -0.53 116.57 121.99 3b7r h LYS 425 Ca 0.08 -0.33 -0.03 0.00 -1.27 0.00 0.00 60.65 59.09 3b7r h LYS 425 Cb 0.11 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 3b7r h LYS 425 CO -0.01 1.02 0.28 -0.44 -2.27 0.00 0.00 179.45 178.03 3b7r h ASP 426 N 0.94 0.91 -0.27 4.20 3.32 -1.16 -1.48 116.42 122.88 3b7r h ASP 426 Ca 0.17 -0.16 -0.17 0.00 0.02 0.00 0.00 57.03 56.89 3b7r h ASP 426 Cb 0.57 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 3b7r h ASP 426 CO 0.03 0.82 -0.47 0.15 -1.72 0.00 0.00 179.24 178.05 3b7r h PHE 427 N 0.94 1.04 -0.55 4.55 3.57 -1.00 -2.03 116.94 123.46 3b7r h PHE 427 Ca 0.22 -0.34 0.07 0.00 3.53 0.00 0.00 57.97 61.46 3b7r h PHE 427 Cb 0.18 -0.21 -0.06 0.00 2.79 0.00 0.00 35.95 38.65 3b7r h PHE 427 CO 0.01 1.15 0.21 1.25 -2.23 0.00 0.00 178.31 178.70 3b7r h LEU 428 N 0.67 0.23 -0.90 0.59 5.85 -0.71 0.12 115.31 121.15 3b7r h LEU 428 Ca 0.04 0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.75 3b7r h LEU 428 Cb 1.06 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 3b7r h LEU 428 CO 0.11 0.15 0.01 1.88 -0.34 0.00 0.00 178.44 180.25 3b7r h TYR 429 N 0.40 0.88 -0.12 1.25 -1.99 -1.21 -1.10 116.97 115.09 3b7r h TYR 429 Ca 0.26 -0.12 -0.07 0.00 2.00 0.00 0.00 58.73 60.81 3b7r h TYR 429 Cb 0.29 -0.24 -0.00 0.00 2.00 0.00 0.00 36.73 38.77 3b7r h TYR 429 CO -0.16 0.80 -0.19 1.03 -0.00 0.00 0.00 178.16 179.65 3b7r h SER 430 N 0.77 0.36 -0.51 3.88 0.87 -0.74 -2.07 113.55 116.11 3b7r h SER 430 Ca 0.15 -0.53 -0.02 0.00 -1.23 0.00 0.00 61.79 60.16 3b7r h SER 430 Cb 0.45 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 3b7r h SER 430 CO 0.02 0.83 0.23 0.22 -0.53 0.00 0.00 176.83 177.60 3b7r h TYR 431 N -0.09 0.74 -0.93 2.24 3.20 -0.68 -2.80 116.97 118.66 3b7r h TYR 431 Ca 0.01 -0.04 -0.58 0.00 3.14 0.00 0.00 58.73 61.26 3b7r h TYR 431 Cb 0.75 -0.23 -0.28 0.00 1.54 0.00 0.00 36.73 38.52 3b7r h TYR 431 CO 0.10 0.59 0.74 1.19 -1.64 0.00 0.00 178.16 179.14 3b7r n PHE 432 N -4.58 2.96 -0.28 -3.82 3.72 -0.43 -4.73 117.46 110.31 3b7r n PHE 432 Ca 0.02 -2.45 0.19 0.00 -0.05 0.00 0.00 57.45 55.16 3b7r n PHE 432 Cb 0.13 -1.20 0.49 0.00 -0.94 0.00 0.00 39.48 37.95 3b7r n PHE 432 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 3b7r h LYS 433 N 1.54 0.44 -0.00 -1.08 2.10 -1.09 0.11 116.57 118.58 3b7r h LYS 433 Ca 0.58 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 59.20 3b7r h LYS 433 Cb 1.58 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 32.81 3b7r h LYS 433 CO 1.31 0.29 -0.02 -0.25 -2.00 0.00 0.00 179.45 178.78 3b7r n ASP 434 N -4.56 0.21 -0.78 7.07 8.00 -1.26 -3.03 116.55 122.21 3b7r n ASP 434 Ca 0.21 -0.67 0.05 0.00 0.71 0.00 0.00 54.79 55.09 3b7r n ASP 434 Cb 0.73 -0.11 0.18 0.00 -0.02 0.00 0.00 41.12 41.90 3b7r n ASP 434 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3b7r n LYS 435 N -1.00 1.39 0.07 -1.24 5.02 0.37 -4.82 118.16 117.95 3b7r n LYS 435 Ca 0.18 -3.13 0.05 0.00 -2.02 0.00 0.00 58.31 53.39 3b7r n LYS 435 Cb 0.21 -1.39 0.48 0.00 -0.02 0.00 0.00 35.03 34.31 3b7r n LYS 435 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 3b7r h VAL 436 N 1.96 1.08 -0.73 -0.18 -1.51 -1.44 -1.50 116.25 113.92 3b7r h VAL 436 Ca -0.03 -0.14 -0.04 0.00 -1.23 0.00 0.00 66.70 65.25 3b7r h VAL 436 Cb 1.15 0.64 -0.03 0.00 -2.13 0.00 0.00 31.29 30.92 3b7r h VAL 436 CO 0.03 0.08 0.29 0.44 -1.23 0.00 0.00 177.57 177.18 3b7r h ASP 437 N 0.41 1.01 -0.08 4.19 3.45 -1.88 0.16 116.42 123.68 3b7r h ASP 437 Ca 0.11 -0.17 -0.01 0.00 0.43 0.00 0.00 57.03 57.39 3b7r h ASP 437 Cb -0.04 -0.26 -0.00 0.00 -0.56 0.00 0.00 39.33 38.46 3b7r h ASP 437 CO -0.02 0.91 0.03 0.58 -1.57 0.00 0.00 179.24 179.16 3b7r h VAL 438 N 1.05 1.16 -0.86 -1.35 2.07 -1.69 -2.87 116.25 113.76 3b7r h VAL 438 Ca 0.24 -0.48 0.13 0.00 0.82 0.00 0.00 66.70 67.42 3b7r h VAL 438 Cb 0.22 1.34 -0.07 0.00 -1.52 0.00 0.00 31.29 31.26 3b7r h VAL 438 CO -0.02 0.14 0.56 -0.07 0.02 0.00 0.00 177.57 178.20 3b7r h LEU 439 N -0.05 0.63 -0.04 2.57 3.38 -0.96 -1.61 115.31 119.22 3b7r h LEU 439 Ca 0.03 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3b7r h LEU 439 Cb 0.19 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3b7r h LEU 439 CO -0.00 0.33 0.00 0.59 0.09 0.00 0.00 178.44 179.45 3b7r n ASN 440 N -4.54 0.09 0.20 -0.43 5.03 0.53 -1.76 115.26 114.38 3b7r n ASN 440 Ca 0.16 0.51 0.14 0.00 0.87 0.00 0.00 54.58 56.26 3b7r n ASN 440 Cb 0.45 -0.54 0.42 0.00 -1.02 0.00 0.00 39.78 39.09 3b7r n ASN 440 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 3b7r h GLN 441 N 0.00 0.00 -6.74 3.52 4.20 -1.20 -3.45 115.11 111.44 3b7r h GLN 441 Ca 0.00 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.21 3b7r h GLN 441 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 3b7r h GLN 441 CO 0.00 0.00 0.44 0.14 -0.67 0.00 0.00 178.83 178.74 3b7r s VAL 442 N -3.34 3.79 -1.21 -0.54 -7.23 -0.72 -4.94 120.40 106.21 3b7r s VAL 442 Ca 0.06 1.71 -0.18 0.00 -1.81 0.00 0.00 61.98 61.76 3b7r s VAL 442 Cb 0.08 -4.09 0.10 0.00 0.56 0.00 0.00 36.38 33.03 3b7r s VAL 442 CO 0.57 0.37 1.57 -0.62 -0.31 0.00 0.00 175.10 176.68 3b7r s ASP 443 N -0.71 6.85 0.21 4.85 -1.08 -1.26 -4.82 116.67 120.71 3b7r s ASP 443 Ca 0.45 -2.44 -0.09 0.00 -0.52 0.00 0.00 52.55 49.94 3b7r s ASP 443 Cb -0.29 -2.52 0.21 0.00 -1.46 0.00 0.00 42.92 38.86 3b7r s ASP 443 CO 0.37 -1.09 1.86 -0.50 0.52 0.00 0.00 175.17 176.33 3b7r h TRP 444 N 7.84 0.89 -0.81 -5.34 4.06 -1.93 -1.58 115.95 119.08 3b7r h TRP 444 Ca 0.36 0.02 0.02 0.00 2.06 0.00 0.00 58.89 61.36 3b7r h TRP 444 Cb 0.90 -0.29 -0.05 0.00 -1.00 0.00 0.00 29.16 28.72 3b7r h TRP 444 CO 1.30 0.51 0.53 -0.97 -3.56 0.00 0.00 178.44 176.25 3b7r h ASN 445 N 0.93 0.88 -0.04 -3.49 -0.73 -1.99 -0.39 115.58 110.76 3b7r h ASN 445 Ca 0.30 -0.01 -0.03 0.00 1.87 0.00 0.00 56.30 58.43 3b7r h ASN 445 Cb 0.01 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 38.39 3b7r h ASN 445 CO -0.11 0.62 -0.09 0.00 -0.37 0.00 0.00 177.43 177.48 3b7r h ALA 446 N 1.33 0.06 -0.66 1.57 0.00 -1.86 -1.35 119.26 118.35 3b7r h ALA 446 Ca 0.32 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.91 3b7r h ALA 446 Cb -0.04 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3b7r h ALA 446 CO -0.10 -0.07 0.42 -1.49 0.00 0.00 0.00 179.25 178.01 3b7r h TRP 447 N -0.42 0.79 0.09 0.00 4.06 -1.10 -2.49 115.95 116.89 3b7r h TRP 447 Ca -0.00 0.02 -0.33 0.00 2.06 0.00 0.00 58.89 60.64 3b7r h TRP 447 Cb 0.70 -0.26 -0.02 0.00 -1.00 0.00 0.00 29.16 28.58 3b7r h TRP 447 CO 0.13 0.47 -1.79 -0.07 -3.56 0.00 0.00 178.44 173.62 3b7r h LEU 448 N 0.83 0.31 -0.10 -4.49 3.38 -1.15 -3.39 115.31 110.70 3b7r h LEU 448 Ca 0.26 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.63 3b7r h LEU 448 Cb -0.02 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3b7r h LEU 448 CO -0.09 1.53 0.00 -1.22 0.09 0.00 0.00 178.44 178.75 3b7r n TYR 449 N -3.37 0.00 -3.83 1.13 4.01 -0.52 -1.28 117.16 113.30 3b7r n TYR 449 Ca -0.24 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.19 3b7r n TYR 449 Cb 1.05 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 40.04 3b7r n TYR 449 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 3b7r s SER 450 N -0.74 6.41 0.88 7.72 0.01 -0.94 -4.91 113.70 122.14 3b7r s SER 450 Ca 0.00 0.40 -0.12 0.00 1.31 0.00 0.00 55.95 57.54 3b7r s SER 450 Cb 0.00 -2.01 0.12 0.00 0.21 0.00 0.00 66.02 64.33 3b7r s SER 450 CO 0.00 0.14 1.13 -2.16 0.41 0.00 0.00 173.24 172.76 3b7r s PRO 451 N -2.47 1.42 0.38 12.44 0.04 -1.26 -4.31 135.00 141.24 3b7r s PRO 451 Ca 0.36 0.37 0.00 0.00 0.04 0.00 0.00 61.00 61.77 3b7r s PRO 451 Cb -0.13 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.55 3b7r s PRO 451 CO 0.26 -2.02 0.00 0.41 0.04 0.00 0.00 177.00 175.69 3b7r n GLY 452 N -2.23 -2.22 3.74 0.56 0.00 -0.70 -4.89 105.19 99.45 3b7r n GLY 452 Ca 0.07 -1.77 -0.36 0.00 0.00 0.00 0.00 46.02 43.95 3b7r n GLY 452 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3b7r s LEU 453 N 0.00 3.63 0.85 0.99 1.43 -1.26 -4.90 118.68 119.41 3b7r s LEU 453 Ca 0.00 2.48 -0.13 0.00 -1.03 0.00 0.00 54.13 55.45 3b7r s LEU 453 Cb 0.00 -4.61 0.08 0.00 0.03 0.00 0.00 46.19 41.69 3b7r s LEU 453 CO 0.00 -1.76 1.02 -2.65 0.23 0.00 0.00 176.35 173.19 3b7r n PRO 454 N -1.73 -0.03 0.26 1.29 -0.02 -1.26 -4.90 135.00 128.61 3b7r n PRO 454 Ca 0.14 0.07 0.17 0.00 -2.02 0.00 0.00 63.50 61.86 3b7r n PRO 454 Cb 0.49 -2.29 0.70 0.00 -0.02 0.00 0.00 33.50 32.38 3b7r n PRO 454 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3b7r h PRO 455 N -1.18 0.00 -3.61 0.52 0.13 -1.93 -3.42 132.00 122.51 3b7r h PRO 455 Ca -0.45 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.44 3b7r h PRO 455 Cb 1.29 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.13 3b7r h PRO 455 CO 0.43 0.00 -0.69 -1.50 -0.23 0.00 0.00 178.00 176.01 3b7r s ILE 456 N -3.65 -0.01 -0.16 -3.56 2.07 -1.26 -5.14 121.20 109.47 3b7r s ILE 456 Ca 0.01 0.05 -0.14 0.00 -1.41 0.00 0.00 60.65 59.17 3b7r s ILE 456 Cb 0.09 -0.07 -0.05 0.00 0.13 0.00 0.00 42.46 42.57 3b7r s ILE 456 CO 0.51 0.02 0.28 -0.75 -1.91 0.00 0.00 174.94 173.09 3b7r s LYS 457 N 0.28 4.25 1.22 3.50 2.20 -1.26 -5.02 119.74 124.90 3b7r s LYS 457 Ca -0.02 0.07 -0.14 0.00 -0.36 0.00 0.00 55.97 55.52 3b7r s LYS 457 Cb -0.03 -3.43 0.31 0.00 -1.51 0.00 0.00 37.83 33.17 3b7r s LYS 457 CO -0.01 0.24 1.01 -2.14 -0.36 0.00 0.00 175.35 174.09 3b7r s PRO 458 N 0.47 -1.33 -0.03 4.03 0.02 -1.26 -5.00 135.00 131.89 3b7r s PRO 458 Ca 0.16 0.74 -0.23 0.00 0.02 0.00 0.00 61.00 61.69 3b7r s PRO 458 Cb -0.13 -1.51 -0.04 0.00 0.02 0.00 0.00 34.50 32.84 3b7r s PRO 458 CO 0.03 -3.97 0.69 -0.80 -0.33 0.00 0.00 177.00 172.62 3b7r s ASN 459 N -2.52 7.03 -0.07 2.53 0.01 -1.26 -5.07 114.94 115.58 3b7r s ASN 459 Ca 0.69 1.23 0.03 0.00 -0.71 0.00 0.00 52.86 54.09 3b7r s ASN 459 Cb -0.24 -2.41 0.01 0.00 0.41 0.00 0.00 41.25 39.01 3b7r s ASN 459 CO 0.65 -0.04 -0.15 -0.31 -1.51 0.00 0.00 177.10 175.74 3b7r s TYR 460 N 0.41 1.69 0.28 2.20 1.51 -1.26 -5.10 117.35 117.08 3b7r s TYR 460 Ca 0.36 -0.63 -0.30 0.00 -1.01 0.00 0.00 57.07 55.48 3b7r s TYR 460 Cb -0.18 -1.20 -0.11 0.00 -0.11 0.00 0.00 41.96 40.35 3b7r s TYR 460 CO 0.19 -0.30 1.62 0.34 -1.11 0.00 0.00 175.55 176.29 3b7r s ASP 461 N 0.56 6.37 0.00 2.29 2.15 -1.26 -4.94 116.67 121.83 3b7r s ASP 461 Ca -0.15 2.94 0.18 0.00 0.43 0.00 0.00 52.55 55.95 3b7r s ASP 461 Cb -0.16 -2.63 0.10 0.00 -0.30 0.00 0.00 42.92 39.93 3b7r s ASP 461 CO 0.05 -0.93 1.03 0.23 -0.17 0.00 0.00 175.17 175.38 3b7r n MET 462 N 2.53 1.57 -0.15 4.34 2.81 -1.26 -4.47 117.12 122.49 3b7r n MET 462 Ca 0.10 -1.37 -0.06 0.00 -1.81 0.00 0.00 57.70 54.56 3b7r n MET 462 Cb 0.37 -1.34 0.00 0.00 -0.71 0.00 0.00 33.22 31.54 3b7r n MET 462 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 3b7r h THR 463 N 3.09 0.24 0.00 2.03 2.02 -1.92 -0.11 112.91 118.26 3b7r h THR 463 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3b7r h THR 463 Cb 0.71 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.36 3b7r h THR 463 CO 0.00 0.00 -0.23 -0.07 0.37 0.00 0.00 175.52 175.59 3b7r h LEU 464 N -0.19 0.00 0.09 2.58 3.38 -1.87 -3.30 115.31 116.00 3b7r h LEU 464 Ca 0.20 -0.04 -0.28 0.00 0.09 0.00 0.00 57.88 57.86 3b7r h LEU 464 Cb 0.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3b7r h LEU 464 CO -0.58 0.02 -1.39 0.74 0.09 0.00 0.00 178.44 177.32 3b7r h THR 465 N 0.00 1.30 -0.65 0.22 2.02 -1.44 -3.40 112.91 110.96 3b7r h THR 465 Ca 0.00 -2.96 0.13 0.00 0.77 0.00 0.00 66.41 64.35 3b7r h THR 465 Cb 0.86 2.78 -0.10 0.00 -1.74 0.00 0.00 68.15 69.96 3b7r h THR 465 CO 0.00 0.83 0.12 0.78 0.37 0.00 0.00 175.52 177.62 3b7r h ASN 466 N 0.05 -0.05 -0.57 4.18 -0.26 -1.17 -0.86 115.58 116.89 3b7r h ASN 466 Ca -0.18 0.13 0.03 0.00 -0.56 0.00 0.00 56.30 55.72 3b7r h ASN 466 Cb 1.96 0.19 -0.03 0.00 -1.06 0.00 0.00 38.32 39.38 3b7r h ASN 466 CO 0.16 -0.03 0.38 0.00 -1.06 0.00 0.00 177.43 176.87 3b7r h ALA 467 N 1.54 1.71 -0.05 -0.83 0.00 -1.81 -0.14 119.26 119.69 3b7r h ALA 467 Ca 0.35 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 3b7r h ALA 467 Cb 0.56 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 3b7r h ALA 467 CO -0.46 0.23 -0.01 0.00 0.00 0.00 0.00 179.25 179.00 3b7r h ILE 469 N -0.24 1.15 -0.28 0.00 2.04 -1.27 -1.55 117.51 117.35 3b7r h ILE 469 Ca 0.01 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.50 3b7r h ILE 469 Cb 0.39 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 3b7r h ILE 469 CO 0.00 0.15 0.19 0.00 0.00 0.00 0.00 178.15 178.49 3b7r h ALA 470 N 1.09 0.36 -0.45 1.87 0.00 -1.00 -0.01 119.26 121.12 3b7r h ALA 470 Ca 0.15 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 3b7r h ALA 470 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3b7r h ALA 470 CO -0.02 -0.18 -0.20 1.25 0.00 0.00 0.00 179.25 180.10 3b7r h LEU 471 N 0.38 0.90 -0.58 0.00 5.85 -1.26 -1.49 115.31 119.11 3b7r h LEU 471 Ca 0.11 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 3b7r h LEU 471 Cb -0.04 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 3b7r h LEU 471 CO -0.03 1.08 0.34 -1.28 -0.34 0.00 0.00 178.44 178.21 3b7r h SER 472 N 0.77 0.71 -0.44 1.25 0.87 -0.93 -2.20 113.55 113.58 3b7r h SER 472 Ca 0.11 -0.07 -0.08 0.00 -1.23 0.00 0.00 61.79 60.51 3b7r h SER 472 Cb 0.75 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 3b7r h SER 472 CO 0.06 0.58 -0.01 1.56 -0.53 0.00 0.00 176.83 178.49 3b7r h GLN 473 N 0.79 0.85 -0.44 2.24 1.08 -0.84 -0.58 115.11 118.21 3b7r h GLN 473 Ca 0.21 -0.24 0.03 0.00 -1.45 0.00 0.00 58.65 57.20 3b7r h GLN 473 Cb 0.01 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.31 3b7r h GLN 473 CO -0.04 0.86 0.22 0.00 -0.95 0.00 0.00 178.83 178.92 3b7r h ARG 474 N 0.79 0.44 -0.33 1.46 3.08 -0.93 -1.15 114.38 117.74 3b7r h ARG 474 Ca 0.15 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.13 3b7r h ARG 474 Cb 0.48 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 3b7r h ARG 474 CO 0.02 0.29 0.03 -1.49 -1.07 0.00 0.00 179.97 177.75 3b7r h TRP 475 N 0.45 0.60 -0.58 3.04 4.06 -0.89 -1.46 115.95 121.17 3b7r h TRP 475 Ca 0.19 -0.09 -0.08 0.00 2.06 0.00 0.00 58.89 60.96 3b7r h TRP 475 Cb 0.08 -0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 28.06 3b7r h TRP 475 CO -0.10 0.65 0.05 0.82 -3.56 0.00 0.00 178.44 176.31 3b7r h ILE 476 N 0.38 1.25 -0.00 1.49 2.04 -0.93 -2.80 117.51 118.94 3b7r h ILE 476 Ca 0.10 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 64.92 3b7r h ILE 476 Cb 0.39 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 3b7r h ILE 476 CO 0.01 0.38 -0.26 0.35 0.00 0.00 0.00 178.15 178.63 3b7r n THR 477 N -4.21 0.00 -1.92 -0.27 -2.24 -0.45 -4.90 114.28 100.29 3b7r n THR 477 Ca 0.03 -0.01 -0.41 0.00 -2.27 0.00 0.00 64.05 61.40 3b7r n THR 477 Cb 0.30 -0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.43 3b7r n THR 477 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3b7r s ALA 478 N -2.96 3.62 0.53 6.98 0.00 -0.55 -5.04 121.76 124.33 3b7r s ALA 478 Ca 0.14 1.43 0.09 0.00 0.00 0.00 0.00 51.96 53.62 3b7r s ALA 478 Cb 0.18 -3.58 0.06 0.00 0.00 0.00 0.00 23.12 19.79 3b7r s ALA 478 CO 0.61 -0.86 0.71 0.15 0.00 0.00 0.00 175.76 176.37 3b7r s LYS 479 N -1.13 2.45 0.26 0.00 -0.14 -1.26 -4.99 119.74 114.94 3b7r s LYS 479 Ca 0.56 -1.55 -0.01 0.00 -1.36 0.00 0.00 55.97 53.62 3b7r s LYS 479 Cb -0.44 -2.65 0.57 0.00 -1.68 0.00 0.00 37.83 33.63 3b7r s LYS 479 CO 0.51 -0.68 1.72 1.49 -0.76 0.00 0.00 175.35 177.64 3b7r h GLU 480 N 0.34 0.43 0.00 1.68 4.81 -2.01 -0.60 114.58 119.23 3b7r h GLU 480 Ca -0.33 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 3b7r h GLU 480 Cb 1.29 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.57 3b7r h GLU 480 CO 0.43 0.28 0.00 -0.40 -0.73 0.00 0.00 179.01 178.59 3b7r n ASP 481 N -5.01 0.00 0.02 1.04 3.85 -1.26 -2.25 116.55 112.94 3b7r n ASP 481 Ca 0.18 0.17 0.11 0.00 -0.71 0.00 0.00 54.79 54.54 3b7r n ASP 481 Cb 0.51 -0.35 0.03 0.00 -1.35 0.00 0.00 41.12 39.95 3b7r n ASP 481 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 3b7r n ASP 482 N -1.35 0.62 0.11 -1.12 8.00 -0.24 -4.42 116.55 118.16 3b7r n ASP 482 Ca 0.07 -0.26 0.05 0.00 0.71 0.00 0.00 54.79 55.35 3b7r n ASP 482 Cb 0.16 0.79 0.48 0.00 -0.02 0.00 0.00 41.12 42.52 3b7r n ASP 482 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3b7r h LEU 483 N 0.00 0.25 -1.64 0.64 3.38 -1.44 -2.23 115.31 114.27 3b7r h LEU 483 Ca 0.00 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 3b7r h LEU 483 Cb 0.70 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3b7r h LEU 483 CO 0.00 0.25 -0.20 -1.13 0.09 0.00 0.00 178.44 177.46 3b7r h ASN 484 N 0.29 0.00 0.27 -0.43 -1.24 -1.79 -2.81 115.58 109.88 3b7r h ASN 484 Ca 0.07 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.05 3b7r h ASN 484 Cb 0.09 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.14 3b7r h ASN 484 CO -0.01 0.20 -0.16 0.77 -1.29 0.00 0.00 177.43 176.94 3b7r h SER 485 N 0.00 0.00 -4.11 1.15 4.64 -1.70 -3.44 113.55 110.10 3b7r h SER 485 Ca -0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 3b7r h SER 485 Cb 0.37 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.49 3b7r h SER 485 CO 0.03 0.16 0.38 -0.36 -0.87 0.00 0.00 176.83 176.17 3b7r s PHE 486 N -4.40 3.05 -0.01 4.77 0.08 -1.06 -5.04 117.98 115.38 3b7r s PHE 486 Ca -0.03 1.56 -0.28 0.00 0.12 0.00 0.00 56.93 58.29 3b7r s PHE 486 Cb 0.14 -3.02 0.09 0.00 -0.57 0.00 0.00 43.02 39.67 3b7r s PHE 486 CO 0.64 -0.79 0.77 1.21 -0.10 0.00 0.00 175.22 176.95 3b7r s ASN 487 N -2.24 -0.51 0.53 1.36 3.84 -1.26 -4.98 114.94 111.68 3b7r s ASN 487 Ca 0.65 0.31 0.36 0.00 0.21 0.00 0.00 52.86 54.40 3b7r s ASN 487 Cb -0.15 0.47 1.53 0.00 -0.55 0.00 0.00 41.25 42.55 3b7r s ASN 487 CO 0.23 -0.65 1.79 0.00 -2.79 0.00 0.00 177.10 175.68 3b7r h ALA 488 N 2.43 3.10 0.00 1.71 0.00 -1.95 -0.27 119.26 124.28 3b7r h ALA 488 Ca -0.26 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3b7r h ALA 488 Cb 1.21 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3b7r h ALA 488 CO 0.35 -1.46 0.00 1.79 0.00 0.00 0.00 179.25 179.93 3b7r h THR 489 N 0.03 0.00 -0.26 0.00 1.35 -1.96 -2.21 112.91 109.86 3b7r h THR 489 Ca 0.59 -0.13 0.07 0.00 -0.55 0.00 0.00 66.41 66.40 3b7r h THR 489 Cb 2.31 0.95 -0.01 0.00 -1.73 0.00 0.00 68.15 69.67 3b7r h THR 489 CO -0.03 0.00 0.18 0.44 -0.25 0.00 0.00 175.52 175.86 3b7r h ASP 490 N 0.00 0.00 0.13 5.36 3.32 -1.45 -2.37 116.42 121.42 3b7r h ASP 490 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3b7r h ASP 490 Cb 0.15 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3b7r h ASP 490 CO 0.00 0.00 -0.35 0.18 -1.72 0.00 0.00 179.24 177.36 3b7r n LEU 491 N -4.46 1.42 -0.27 1.55 4.77 -0.83 -4.65 117.00 114.53 3b7r n LEU 491 Ca 0.03 -0.46 0.05 0.00 -0.03 0.00 0.00 56.01 55.60 3b7r n LEU 491 Cb 0.34 -0.07 0.14 0.00 -2.33 0.00 0.00 43.42 41.50 3b7r n LEU 491 CO 0.35 0.27 0.78 0.50 -1.33 0.00 0.00 177.39 177.95 3b7r h LYS 492 N 1.69 0.05 -0.55 3.23 3.64 -1.53 -1.39 116.57 121.71 3b7r h LYS 492 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3b7r h LYS 492 Cb 0.60 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 3b7r h LYS 492 CO 0.00 0.03 0.00 -0.25 -2.27 0.00 0.00 179.45 176.96 3b7r n ASP 493 N -5.42 4.90 -4.69 4.20 8.00 -1.26 -4.93 116.55 117.34 3b7r n ASP 493 Ca 0.13 -2.67 -0.35 0.00 0.71 0.00 0.00 54.79 52.61 3b7r n ASP 493 Cb 0.46 -0.59 -0.09 0.00 -0.02 0.00 0.00 41.12 40.88 3b7r n ASP 493 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3b7r s LEU 494 N -2.26 4.01 0.98 0.64 1.43 -0.53 -5.09 118.68 117.86 3b7r s LEU 494 Ca 0.50 0.17 -0.14 0.00 -1.03 0.00 0.00 54.13 53.63 3b7r s LEU 494 Cb 0.35 -2.02 0.18 0.00 0.03 0.00 0.00 46.19 44.73 3b7r s LEU 494 CO 0.19 0.20 1.14 -0.94 0.23 0.00 0.00 176.35 177.18 3b7r s SER 495 N 0.22 2.90 0.32 2.29 1.04 -1.26 -4.79 113.70 114.42 3b7r s SER 495 Ca 0.06 0.88 -0.00 0.00 0.48 0.00 0.00 55.95 57.37 3b7r s SER 495 Cb -0.12 -1.37 0.51 0.00 0.10 0.00 0.00 66.02 65.15 3b7r s SER 495 CO -0.00 -2.92 1.97 0.77 0.98 0.00 0.00 173.24 174.03 3b7r h SER 496 N -1.75 0.85 -0.43 7.02 4.64 -1.98 0.33 113.55 122.22 3b7r h SER 496 Ca -0.50 -0.04 -0.07 0.00 -0.47 0.00 0.00 61.79 60.72 3b7r h SER 496 Cb 1.32 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 3b7r h SER 496 CO 0.55 0.64 0.03 0.45 -0.87 0.00 0.00 176.83 177.63 3b7r h HIS 497 N 0.98 0.85 -0.09 4.77 3.86 -1.95 -1.42 115.15 122.16 3b7r h HIS 497 Ca 0.26 -0.11 -0.17 0.00 -1.16 0.00 0.00 60.37 59.19 3b7r h HIS 497 Cb -0.07 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.16 3b7r h HIS 497 CO 0.00 0.77 -0.66 1.96 0.86 0.00 0.00 177.93 180.86 3b7r h GLN 498 N 0.76 0.37 -0.37 2.45 4.20 -1.63 -1.46 115.11 119.44 3b7r h GLN 498 Ca 0.15 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.58 3b7r h GLN 498 Cb 0.42 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 3b7r h GLN 498 CO 0.01 0.90 0.22 1.25 -0.67 0.00 0.00 178.83 180.55 3b7r h LEU 499 N 0.27 0.45 -0.48 1.46 5.85 -0.69 0.57 115.31 122.74 3b7r h LEU 499 Ca -0.02 -0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.69 3b7r h LEU 499 Cb 1.21 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.08 3b7r h LEU 499 CO 0.11 0.38 0.22 -1.13 -0.34 0.00 0.00 178.44 177.68 3b7r h ASN 500 N 0.48 0.30 -0.19 1.25 -1.24 -1.16 -1.69 115.58 113.33 3b7r h ASN 500 Ca 0.13 0.03 -0.13 0.00 0.71 0.00 0.00 56.30 57.05 3b7r h ASN 500 Cb 0.02 -0.02 -0.01 0.00 0.73 0.00 0.00 38.32 39.04 3b7r h ASN 500 CO -0.02 0.21 -0.33 -0.08 -1.29 0.00 0.00 177.43 175.92 3b7r h GLU 501 N 0.44 0.70 -0.49 6.67 4.57 -0.97 0.62 114.58 126.13 3b7r h GLU 501 Ca 0.22 -0.33 0.10 0.00 -1.18 0.00 0.00 59.36 58.16 3b7r h GLU 501 Cb 0.15 -0.01 -0.09 0.00 -0.16 0.00 0.00 28.75 28.64 3b7r h GLU 501 CO -0.17 0.94 -0.13 0.35 -1.18 0.00 0.00 179.01 178.82 3b7r h PHE 502 N 0.59 -0.28 -0.68 0.92 3.57 -0.62 -0.48 116.94 119.98 3b7r h PHE 502 Ca 0.06 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 3b7r h PHE 502 Cb 0.85 0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 3b7r h PHE 502 CO 0.04 -0.22 0.22 -0.07 -2.23 0.00 0.00 178.31 176.05 3b7r h LEU 503 N -0.01 0.98 -0.70 0.59 3.38 -0.81 -1.41 115.31 117.33 3b7r h LEU 503 Ca 0.23 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 3b7r h LEU 503 Cb 0.36 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3b7r h LEU 503 CO -0.51 0.93 0.24 0.00 0.09 0.00 0.00 178.44 179.19 3b7r h ALA 504 N 1.09 0.92 -0.43 1.53 0.00 -0.59 0.84 119.26 122.63 3b7r h ALA 504 Ca 0.22 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3b7r h ALA 504 Cb 0.29 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3b7r h ALA 504 CO -0.01 0.58 0.22 1.96 0.00 0.00 0.00 179.25 182.00 3b7r h GLN 505 N 1.02 0.61 -0.44 0.00 1.08 -0.94 -2.08 115.11 114.37 3b7r h GLN 505 Ca 0.23 -0.08 -0.14 0.00 -1.45 0.00 0.00 58.65 57.21 3b7r h GLN 505 Cb 0.28 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 3b7r h GLN 505 CO -0.01 0.51 -0.26 1.15 -0.95 0.00 0.00 178.83 179.27 3b7r h THR 506 N 0.56 1.27 -0.03 -0.54 2.02 -0.94 -2.96 112.91 112.28 3b7r h THR 506 Ca 0.15 -1.42 -0.04 0.00 0.77 0.00 0.00 66.41 65.87 3b7r h THR 506 Cb 0.09 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 3b7r h THR 506 CO -0.02 0.49 -0.17 0.25 0.37 0.00 0.00 175.52 176.43 3b7r h LEU 507 N 0.81 0.05 -2.60 2.58 5.85 -0.65 -0.92 115.31 120.42 3b7r h LEU 507 Ca 0.10 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3b7r h LEU 507 Cb 0.83 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.85 3b7r h LEU 507 CO 0.07 0.23 -0.01 1.56 -0.34 0.00 0.00 178.44 179.95 3b7r h GLN 508 N 0.05 0.00 -0.44 1.25 4.20 -1.20 -1.91 115.11 117.06 3b7r h GLN 508 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3b7r h GLN 508 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 3b7r h GLN 508 CO 0.02 0.01 0.00 0.54 -0.67 0.00 0.00 178.83 178.73 3b7r n ARG 509 N -3.57 2.89 -2.17 1.46 3.00 -0.37 -5.03 116.66 112.87 3b7r n ARG 509 Ca -0.03 -2.27 -0.36 0.00 -0.01 0.00 0.00 57.85 55.19 3b7r n ARG 509 Cb 0.09 -1.40 0.01 0.00 0.00 0.00 0.00 32.46 31.16 3b7r n ARG 509 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3b7r s ALA 510 N -1.16 2.70 0.55 7.54 0.00 -0.72 -4.39 121.76 126.28 3b7r s ALA 510 Ca 0.31 0.92 -0.16 0.00 0.00 0.00 0.00 51.96 53.03 3b7r s ALA 510 Cb 0.17 -3.40 -0.06 0.00 0.00 0.00 0.00 23.12 19.83 3b7r s ALA 510 CO 0.19 -0.89 1.02 -1.25 0.00 0.00 0.00 175.76 174.83 3b7r s PRO 511 N -3.19 3.68 0.32 0.00 0.04 -1.26 -5.07 135.00 129.52 3b7r s PRO 511 Ca 0.73 1.05 0.05 0.00 0.04 0.00 0.00 61.00 62.87 3b7r s PRO 511 Cb -0.27 -2.09 -0.02 0.00 0.04 0.00 0.00 34.50 32.16 3b7r s PRO 511 CO 0.31 -0.50 0.46 -0.51 0.04 0.00 0.00 177.00 176.80 3b7r s LEU 512 N -4.29 4.04 0.53 -3.56 1.02 -1.26 -5.02 118.68 110.15 3b7r s LEU 512 Ca 0.61 -0.02 -0.22 0.00 0.02 0.00 0.00 54.13 54.51 3b7r s LEU 512 Cb -0.12 -2.86 -0.05 0.00 0.02 0.00 0.00 46.19 43.17 3b7r s LEU 512 CO 0.34 -0.35 1.36 -2.65 0.02 0.00 0.00 176.35 175.08 3b7r n PRO 513 N -1.63 1.76 -0.37 1.29 -0.02 -1.26 -4.74 135.00 130.04 3b7r n PRO 513 Ca -0.03 0.64 0.03 0.00 -2.02 0.00 0.00 63.50 62.13 3b7r n PRO 513 Cb 0.58 -2.57 0.18 0.00 -0.02 0.00 0.00 33.50 31.67 3b7r n PRO 513 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3b7r h LEU 514 N 1.55 1.02 -1.37 2.45 5.85 -1.98 -1.12 115.31 121.71 3b7r h LEU 514 Ca -0.51 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.19 3b7r h LEU 514 Cb 1.30 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 3b7r h LEU 514 CO 0.57 0.63 -0.04 1.23 -0.34 0.00 0.00 178.44 180.50 3b7r h GLY 515 N 1.15 0.39 0.95 3.75 0.00 -1.94 -0.51 103.07 106.86 3b7r h GLY 515 Ca 0.44 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.55 3b7r h GLY 515 CO -0.19 0.21 0.09 0.45 0.00 0.00 0.00 176.54 177.10 3b7r h HIS 516 N 0.35 0.22 -0.58 5.60 3.86 -1.57 -1.62 115.15 121.41 3b7r h HIS 516 Ca 0.08 -0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.20 3b7r h HIS 516 Cb 0.31 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 3b7r h HIS 516 CO 0.01 0.20 0.01 0.82 0.86 0.00 0.00 177.93 179.83 3b7r h ILE 517 N 0.17 1.26 -0.68 2.45 1.08 -1.09 0.19 117.51 120.89 3b7r h ILE 517 Ca 0.06 -1.10 -0.00 0.00 -0.39 0.00 0.00 64.86 63.43 3b7r h ILE 517 Cb 0.05 0.80 -0.03 0.00 -3.07 0.00 0.00 36.82 34.57 3b7r h ILE 517 CO -0.01 0.40 0.41 0.11 -0.69 0.00 0.00 178.15 178.37 3b7r h LYS 518 N 0.91 0.93 -0.67 2.37 1.57 -1.11 -2.06 116.57 118.51 3b7r h LYS 518 Ca 0.17 -0.08 -0.06 0.00 -1.87 0.00 0.00 60.65 58.81 3b7r h LYS 518 Cb 0.51 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 3b7r h LYS 518 CO 0.02 0.66 0.20 -0.09 -0.57 0.00 0.00 179.45 179.67 3b7r h ARG 519 N 0.93 1.03 -0.72 3.15 9.65 -0.85 -1.40 114.38 126.18 3b7r h ARG 519 Ca 0.25 -0.22 0.03 0.00 -1.10 0.00 0.00 59.98 58.94 3b7r h ARG 519 Cb -0.03 -0.15 -0.05 0.00 -1.39 0.00 0.00 29.97 28.35 3b7r h ARG 519 CO -0.05 0.89 0.45 0.52 2.80 0.00 0.00 179.97 184.59 3b7r h MET 520 N 0.99 0.85 -0.69 0.20 2.86 -0.44 -1.02 114.93 117.69 3b7r h MET 520 Ca 0.22 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.76 3b7r h MET 520 Cb 0.30 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.74 3b7r h MET 520 CO -0.01 0.56 0.23 0.37 1.06 0.00 0.00 176.91 179.13 3b7r h GLN 521 N 0.88 1.05 -0.53 1.72 5.75 -0.99 0.11 115.11 123.10 3b7r h GLN 521 Ca 0.29 -0.21 -0.06 0.00 -0.15 0.00 0.00 58.65 58.52 3b7r h GLN 521 Cb 0.03 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.40 3b7r h GLN 521 CO -0.12 0.89 0.08 1.49 -2.65 0.00 0.00 178.83 178.52 3b7r h GLU 522 N 1.01 0.89 0.00 1.69 4.81 -0.37 -0.58 114.58 122.03 3b7r h GLU 522 Ca 0.23 -0.24 -0.24 0.00 -0.13 0.00 0.00 59.36 58.98 3b7r h GLU 522 Cb 0.27 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 3b7r h GLU 522 CO -0.01 0.86 -2.08 1.33 -0.73 0.00 0.00 179.01 178.38 3b7r n VAL 523 N -4.37 1.03 0.28 0.32 0.24 -0.47 -4.57 118.33 110.80 3b7r n VAL 523 Ca 0.02 -0.74 0.06 0.00 -2.04 0.00 0.00 64.34 61.64 3b7r n VAL 523 Cb 0.26 -0.43 -0.09 0.00 -1.47 0.00 0.00 33.84 32.11 3b7r n VAL 523 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 3b7r n TYR 524 N -2.67 0.00 -4.04 6.34 4.01 0.02 -3.32 117.16 117.50 3b7r n TYR 524 Ca -0.21 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.26 3b7r n TYR 524 Cb 0.96 -0.16 -0.04 0.00 -0.31 0.00 0.00 39.34 39.79 3b7r n TYR 524 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3b7r n ASN 525 N -1.65 -0.30 0.31 7.72 4.05 -0.23 -4.85 115.26 120.30 3b7r n ASN 525 Ca -0.00 -1.06 0.19 0.00 0.45 0.00 0.00 54.58 54.16 3b7r n ASN 525 Cb 0.28 -2.77 0.98 0.00 1.23 0.00 0.00 39.78 39.50 3b7r n ASN 525 CO 0.00 0.00 0.00 -0.26 -3.05 0.00 0.00 177.26 173.95 3b7r h PHE 526 N -1.80 0.00 -0.03 1.20 0.04 -1.80 -2.22 116.94 112.33 3b7r h PHE 526 Ca -0.63 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.15 3b7r h PHE 526 Cb 1.38 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.53 3b7r h PHE 526 CO 0.50 0.03 0.03 -0.91 -0.60 0.00 0.00 178.31 177.36 3b7r h ASN 527 N 0.00 0.00 1.03 2.17 -0.26 -1.90 -2.23 115.58 114.39 3b7r h ASN 527 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 3b7r h ASN 527 Cb 0.17 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.43 3b7r h ASN 527 CO 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 176.37 3b7r n ALA 528 N -2.43 2.11 -2.68 -0.83 0.00 -0.84 -4.83 120.51 111.01 3b7r n ALA 528 Ca -0.02 -0.04 -0.42 0.00 0.00 0.00 0.00 53.44 52.96 3b7r n ALA 528 Cb 0.12 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.12 3b7r n ALA 528 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3b7r s ILE 529 N -3.08 4.84 -0.63 0.00 1.01 -0.84 -4.92 121.20 117.57 3b7r s ILE 529 Ca 0.10 1.87 0.23 0.00 0.00 0.00 0.00 60.65 62.85 3b7r s ILE 529 Cb 0.14 -4.24 -0.14 0.00 0.01 0.00 0.00 42.46 38.23 3b7r s ILE 529 CO 0.49 0.03 0.98 0.59 0.00 0.00 0.00 174.94 177.02 3b7r n ASN 530 N 4.99 0.61 -4.66 3.58 3.02 -1.26 -4.64 115.26 116.90 3b7r n ASN 530 Ca 0.07 -0.31 -0.57 0.00 -0.03 0.00 0.00 54.58 53.73 3b7r n ASN 530 Cb 0.49 0.91 -0.08 0.00 -0.61 0.00 0.00 39.78 40.49 3b7r n ASN 530 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3b7r n ASN 531 N -1.90 2.24 -0.12 6.41 2.85 -1.26 -4.85 115.26 118.63 3b7r n ASN 531 Ca 0.02 0.99 -0.07 0.00 -0.11 0.00 0.00 54.58 55.41 3b7r n ASN 531 Cb 0.43 -1.13 0.10 0.00 1.24 0.00 0.00 39.78 40.42 3b7r n ASN 531 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 3b7r h SER 532 N 7.82 0.82 -0.23 1.20 4.64 -1.91 0.13 113.55 126.02 3b7r h SER 532 Ca -0.42 -0.25 -0.00 0.00 -0.47 0.00 0.00 61.79 60.64 3b7r h SER 532 Cb 1.33 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 3b7r h SER 532 CO 0.98 0.95 0.13 -0.33 -0.87 0.00 0.00 176.83 177.68 3b7r h GLU 533 N 0.75 0.33 -0.12 4.77 4.39 -1.89 -0.84 114.58 121.97 3b7r h GLU 533 Ca 0.12 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.76 3b7r h GLU 533 Cb 0.61 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.19 3b7r h GLU 533 CO 0.04 0.30 -0.02 0.82 -1.16 0.00 0.00 179.01 178.99 3b7r h ILE 534 N 0.27 1.28 -0.66 3.13 2.04 -1.87 -2.74 117.51 118.95 3b7r h ILE 534 Ca 0.08 -0.92 -0.06 0.00 1.00 0.00 0.00 64.86 64.97 3b7r h ILE 534 Cb 0.07 1.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 3b7r h ILE 534 CO -0.01 0.26 0.19 -0.09 0.00 0.00 0.00 178.15 178.50 3b7r h ARG 535 N -0.07 1.04 -0.30 2.37 2.43 -0.95 -1.15 114.38 117.75 3b7r h ARG 535 Ca 0.03 -0.23 0.07 0.00 -0.81 0.00 0.00 59.98 59.04 3b7r h ARG 535 Cb 0.42 -0.15 -0.08 0.00 -0.42 0.00 0.00 29.97 29.75 3b7r h ARG 535 CO 0.01 0.92 -0.22 0.35 -1.51 0.00 0.00 179.97 179.52 3b7r h PHE 536 N 0.97 -0.57 -0.29 2.20 3.57 -1.11 0.06 116.94 121.77 3b7r h PHE 536 Ca 0.21 0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.61 3b7r h PHE 536 Cb 0.32 0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 3b7r h PHE 536 CO 0.02 -0.30 -0.42 0.00 -2.23 0.00 0.00 178.31 175.39 3b7r h ARG 537 N -0.19 0.70 -0.40 1.11 3.08 -1.13 -1.06 114.38 116.48 3b7r h ARG 537 Ca 0.16 -0.37 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 3b7r h ARG 537 Cb 0.44 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 3b7r h ARG 537 CO -0.42 0.98 0.20 2.35 -1.07 0.00 0.00 179.97 182.01 3b7r h TRP 538 N 0.57 0.57 -0.29 3.04 -0.00 -1.02 -0.84 115.95 117.98 3b7r h TRP 538 Ca 0.04 -0.02 -0.13 0.00 -0.00 0.00 0.00 58.89 58.78 3b7r h TRP 538 Cb 0.96 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.16 29.93 3b7r h TRP 538 CO 0.05 0.47 -0.36 -0.07 -0.00 0.00 0.00 178.44 178.52 3b7r h LEU 539 N 0.51 0.70 -0.48 0.65 3.38 -0.78 -0.48 115.31 118.80 3b7r h LEU 539 Ca 0.14 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.83 3b7r h LEU 539 Cb 0.11 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3b7r h LEU 539 CO -0.02 0.99 0.30 0.03 0.09 0.00 0.00 178.44 179.84 3b7r h ARG 540 N 0.55 0.58 -0.75 1.13 3.08 -1.00 -0.46 114.38 117.51 3b7r h ARG 540 Ca 0.05 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 3b7r h ARG 540 Cb 0.88 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.76 3b7r h ARG 540 CO 0.08 0.39 0.40 1.25 -1.07 0.00 0.00 179.97 181.01 3b7r h LEU 541 N 0.60 0.96 -0.41 3.04 5.85 -0.72 -0.34 115.31 124.29 3b7r h LEU 541 Ca 0.19 -0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 3b7r h LEU 541 Cb -0.01 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 3b7r h LEU 541 CO -0.07 0.79 0.05 0.00 -0.34 0.00 0.00 178.44 178.88 3b7r h ILE 543 N 0.53 1.32 0.00 0.00 1.08 -0.91 -1.57 117.51 117.95 3b7r h ILE 543 Ca 0.12 -1.57 -0.04 0.00 -0.39 0.00 0.00 64.86 62.98 3b7r h ILE 543 Cb 0.39 1.76 -0.01 0.00 -3.07 0.00 0.00 36.82 35.89 3b7r h ILE 543 CO 0.01 0.49 -0.18 1.56 -0.69 0.00 0.00 178.15 179.35 3b7r h GLN 544 N 0.37 0.00 -0.41 2.37 4.20 -1.07 -1.09 115.11 119.48 3b7r h GLN 544 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3b7r h GLN 544 Cb 0.96 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.74 3b7r h GLN 544 CO 0.08 0.18 0.00 0.43 -0.67 0.00 0.00 178.83 178.85 3b7r n SER 545 N -3.75 2.44 -1.86 1.46 7.64 -0.66 -4.48 113.62 114.40 3b7r n SER 545 Ca -0.02 -1.95 -0.12 0.00 1.01 0.00 0.00 58.87 57.79 3b7r n SER 545 Cb 0.29 -0.27 0.03 0.00 -1.01 0.00 0.00 64.21 63.24 3b7r n SER 545 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3b7r n LYS 546 N 0.83 -3.13 -2.97 1.43 4.76 -0.41 -4.35 118.16 114.32 3b7r n LYS 546 Ca 0.16 0.48 -0.43 0.00 -2.87 0.00 0.00 58.31 55.65 3b7r n LYS 546 Cb 0.40 -4.44 -0.05 0.00 -1.84 0.00 0.00 35.03 29.10 3b7r n LYS 546 CO 0.00 0.00 0.00 -0.46 -1.37 0.00 0.00 177.40 175.57 3b7r s TRP 547 N -2.96 2.92 0.47 2.13 -0.00 -0.64 -4.92 118.94 115.93 3b7r s TRP 547 Ca 0.21 -0.12 0.15 0.00 -0.00 0.00 0.00 56.10 56.34 3b7r s TRP 547 Cb -0.09 -3.80 1.10 0.00 -0.00 0.00 0.00 33.47 30.67 3b7r s TRP 547 CO 0.26 -1.16 2.04 0.93 -0.00 0.00 0.00 176.95 179.01 3b7r h GLU 548 N 9.13 0.00 0.00 5.86 5.08 -1.94 -1.89 114.58 130.82 3b7r h GLU 548 Ca -0.26 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.08 3b7r h GLU 548 Cb 1.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 3b7r h GLU 548 CO 1.02 0.13 -0.11 -0.44 -1.00 0.00 0.00 179.01 178.61 3b7r h ASP 549 N 0.00 0.00 1.00 1.42 5.19 -1.97 -1.71 116.42 120.34 3b7r h ASP 549 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3b7r h ASP 549 Cb 0.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.74 3b7r h ASP 549 CO 0.02 0.11 0.00 0.00 -3.12 0.00 0.00 179.24 176.24 3b7r n ALA 550 N -2.41 2.07 0.13 3.45 0.00 -0.71 -4.14 120.51 118.90 3b7r n ALA 550 Ca -0.02 -0.04 -0.13 0.00 0.00 0.00 0.00 53.44 53.25 3b7r n ALA 550 Cb 0.19 -1.41 -0.06 0.00 0.00 0.00 0.00 19.45 18.17 3b7r n ALA 550 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3b7r h ILE 551 N 0.00 0.58 -0.01 0.00 2.04 -1.43 -0.30 117.51 118.39 3b7r h ILE 551 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 3b7r h ILE 551 Cb 0.50 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 3b7r h ILE 551 CO 0.00 0.00 -0.20 1.55 0.00 0.00 0.00 178.15 179.50 3b7r h PRO 552 N -0.40 0.02 -0.15 2.37 0.13 -1.78 -0.89 132.00 131.30 3b7r h PRO 552 Ca 0.01 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.11 3b7r h PRO 552 Cb 0.39 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.51 3b7r h PRO 552 CO -0.07 0.22 -0.03 -0.07 -0.23 0.00 0.00 178.00 177.82 3b7r h LEU 553 N 0.02 0.28 -0.69 1.56 3.38 -1.66 -1.16 115.31 117.03 3b7r h LEU 553 Ca 0.00 -0.35 -0.07 0.00 0.09 0.00 0.00 57.88 57.55 3b7r h LEU 553 Cb 0.36 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 3b7r h LEU 553 CO 0.03 0.56 0.16 0.00 0.09 0.00 0.00 178.44 179.28 3b7r h ALA 554 N 0.72 0.91 -0.47 1.53 0.00 -0.84 -1.49 119.26 119.62 3b7r h ALA 554 Ca 0.04 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3b7r h ALA 554 Cb 0.44 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3b7r h ALA 554 CO 0.01 0.64 0.18 -0.07 0.00 0.00 0.00 179.25 180.01 3b7r h LEU 555 N 1.04 0.66 0.03 0.00 3.38 -1.16 -0.72 115.31 118.54 3b7r h LEU 555 Ca 0.22 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.02 3b7r h LEU 555 Cb 0.38 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3b7r h LEU 555 CO 0.00 0.66 -0.13 0.50 0.09 0.00 0.00 178.44 179.56 3b7r h LYS 556 N 0.62 -0.23 -0.53 1.13 3.64 -1.10 -2.18 116.57 117.93 3b7r h LYS 556 Ca 0.16 0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.48 3b7r h LYS 556 Cb 0.22 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 3b7r h LYS 556 CO -0.01 -0.15 0.05 1.98 -2.27 0.00 0.00 179.45 179.04 3b7r h MET 557 N -0.23 0.86 -0.02 1.90 4.05 -1.11 0.31 114.93 120.69 3b7r h MET 557 Ca 0.04 -0.22 -0.04 0.00 -0.28 0.00 0.00 59.70 59.20 3b7r h MET 557 Cb 0.28 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 30.97 3b7r h MET 557 CO -0.11 0.83 -0.16 0.00 0.23 0.00 0.00 176.91 177.70 3b7r h ALA 558 N 1.24 1.70 0.00 0.39 0.00 -0.84 -3.20 119.26 118.55 3b7r h ALA 558 Ca 0.16 -0.16 -0.29 0.00 0.00 0.00 0.00 54.91 54.62 3b7r h ALA 558 Cb 0.42 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 3b7r h ALA 558 CO 0.01 0.22 -2.10 0.25 0.00 0.00 0.00 179.25 177.64 3b7r n THR 559 N -4.34 1.10 0.38 0.00 -2.24 -0.85 -4.51 114.28 103.83 3b7r n THR 559 Ca -0.02 -0.64 0.14 0.00 -2.27 0.00 0.00 64.05 61.26 3b7r n THR 559 Cb 0.23 -0.68 0.43 0.00 -2.10 0.00 0.00 70.33 68.21 3b7r n THR 559 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3b7r h GLU 560 N 0.00 0.00 -4.88 -0.78 5.08 -0.99 -3.43 114.58 109.58 3b7r h GLU 560 Ca -0.43 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 57.57 3b7r h GLU 560 Cb 1.93 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 31.04 3b7r h GLU 560 CO 0.01 0.00 -0.60 1.14 -1.00 0.00 0.00 179.01 178.56 3b7r s GLN 561 N -3.32 1.45 -0.03 2.33 1.03 -1.21 -4.84 119.66 115.06 3b7r s GLN 561 Ca 0.06 -1.79 0.06 0.00 0.04 0.00 0.00 55.36 53.73 3b7r s GLN 561 Cb 0.09 -0.21 0.10 0.00 0.03 0.00 0.00 33.01 33.02 3b7r s GLN 561 CO 0.56 -0.33 1.05 0.41 -2.54 0.00 0.00 175.29 174.44 3b7r n GLY 562 N -0.49 1.52 3.67 2.60 0.00 0.29 -4.68 105.19 108.10 3b7r n GLY 562 Ca 0.00 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 3b7r n GLY 562 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3b7r s ARG 563 N -0.65 4.18 0.46 1.61 3.52 -1.22 -4.29 118.95 122.56 3b7r s ARG 563 Ca 0.10 2.27 0.11 0.00 -0.13 0.00 0.00 55.73 58.08 3b7r s ARG 563 Cb 0.10 -3.89 1.04 0.00 -1.56 0.00 0.00 34.95 30.63 3b7r s ARG 563 CO -0.01 -0.82 2.10 0.52 -0.81 0.00 0.00 175.30 176.28 3b7r h MET 564 N 9.30 0.30 -1.01 5.12 2.86 -1.02 -0.16 114.93 130.31 3b7r h MET 564 Ca -0.41 -0.02 0.24 0.00 -2.06 0.00 0.00 59.70 57.45 3b7r h MET 564 Cb 1.19 -0.07 -0.12 0.00 0.06 0.00 0.00 31.60 32.67 3b7r h MET 564 CO 0.94 0.20 0.61 -0.22 1.06 0.00 0.00 176.91 179.50 3b7r h LYS 565 N 0.31 0.57 0.00 1.72 3.64 -1.89 -0.95 116.57 119.97 3b7r h LYS 565 Ca 0.08 -0.03 -0.41 0.00 -1.27 0.00 0.00 60.65 59.02 3b7r h LYS 565 Cb -0.03 -0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 31.60 3b7r h LYS 565 CO -0.02 0.38 -2.26 1.19 -2.27 0.00 0.00 179.45 176.47 3b7r n PHE 566 N -4.82 0.25 -0.13 1.91 3.72 -0.60 -4.44 117.46 113.35 3b7r n PHE 566 Ca 0.26 0.10 -0.08 0.00 -0.05 0.00 0.00 57.45 57.68 3b7r n PHE 566 Cb 0.73 -1.03 -0.00 0.00 -0.94 0.00 0.00 39.48 38.24 3b7r n PHE 566 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 3b7r h THR 567 N -0.90 1.13 0.51 4.37 2.02 -1.00 -2.53 112.91 116.51 3b7r h THR 567 Ca -0.62 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.22 3b7r h THR 567 Cb 1.58 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 3b7r h THR 567 CO -0.35 0.13 -0.24 0.03 0.37 0.00 0.00 175.52 175.46 3b7r h ARG 568 N 0.52 -0.65 -0.07 6.66 3.08 -1.40 -2.01 114.38 120.49 3b7r h ARG 568 Ca 0.14 0.04 -0.08 0.00 0.07 0.00 0.00 59.98 60.16 3b7r h ARG 568 Cb 0.01 0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3b7r h ARG 568 CO -0.03 -0.43 -0.32 -1.35 -1.07 0.00 0.00 179.97 176.78 3b7r h PRO 569 N -0.70 0.14 -0.31 0.04 0.11 -1.75 -1.04 132.00 128.49 3b7r h PRO 569 Ca -0.07 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.95 3b7r h PRO 569 Cb 0.53 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 3b7r h PRO 569 CO 0.11 0.45 0.03 -0.07 -0.21 0.00 0.00 178.00 178.31 3b7r h LEU 570 N 0.12 0.52 -0.62 2.35 3.38 -1.39 0.13 115.31 119.80 3b7r h LEU 570 Ca 0.02 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.61 3b7r h LEU 570 Cb 0.63 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 3b7r h LEU 570 CO 0.05 0.68 0.02 -0.26 0.09 0.00 0.00 178.44 179.01 3b7r h PHE 571 N 0.35 1.17 -0.59 1.13 0.04 -1.19 -0.69 116.94 117.17 3b7r h PHE 571 Ca 0.09 -0.20 -0.07 0.00 2.80 0.00 0.00 57.97 60.60 3b7r h PHE 571 Cb 0.39 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 3b7r h PHE 571 CO 0.03 1.02 0.11 -0.22 -0.60 0.00 0.00 178.31 178.65 3b7r h LYS 572 N 0.98 0.97 -0.41 1.51 3.64 -1.02 -0.18 116.57 122.07 3b7r h LYS 572 Ca 0.18 -0.25 -0.04 0.00 -1.27 0.00 0.00 60.65 59.26 3b7r h LYS 572 Cb 0.54 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 3b7r h LYS 572 CO 0.03 0.91 0.10 -0.44 -2.27 0.00 0.00 179.45 177.78 3b7r h ASP 573 N 0.87 0.62 -0.50 4.20 5.19 -0.58 -1.60 116.42 124.62 3b7r h ASP 573 Ca 0.18 -0.23 -0.02 0.00 -0.62 0.00 0.00 57.03 56.34 3b7r h ASP 573 Cb 0.41 -0.16 -0.03 0.00 0.18 0.00 0.00 39.33 39.73 3b7r h ASP 573 CO 0.01 0.69 0.24 -0.07 -3.12 0.00 0.00 179.24 176.99 3b7r h LEU 574 N 0.53 0.68 -0.97 1.55 3.38 -0.97 -1.90 115.31 117.61 3b7r h LEU 574 Ca 0.13 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 3b7r h LEU 574 Cb 0.31 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3b7r h LEU 574 CO 0.00 0.60 -0.38 0.00 0.09 0.00 0.00 178.44 178.75 3b7r h ALA 575 N 1.51 1.13 0.00 1.53 0.00 -0.75 -3.01 119.26 119.68 3b7r h ALA 575 Ca 0.19 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3b7r h ALA 575 Cb 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3b7r h ALA 575 CO -0.02 0.57 -0.15 0.00 0.00 0.00 0.00 179.25 179.65 3b7r n ALA 576 N -2.48 2.55 -2.56 0.00 0.00 -0.63 -4.54 120.51 112.86 3b7r n ALA 576 Ca -0.01 -0.13 -0.42 0.00 0.00 0.00 0.00 53.44 52.88 3b7r n ALA 576 Cb 0.46 -1.38 -0.07 0.00 0.00 0.00 0.00 19.45 18.46 3b7r n ALA 576 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3b7r s PHE 577 N -3.06 3.15 0.43 0.00 5.36 -0.80 -4.96 117.98 118.09 3b7r s PHE 577 Ca 0.11 0.28 0.16 0.00 -0.96 0.00 0.00 56.93 56.53 3b7r s PHE 577 Cb 0.16 -3.11 1.06 0.00 -0.34 0.00 0.00 43.02 40.79 3b7r s PHE 577 CO 0.60 -0.63 1.91 0.38 -1.46 0.00 0.00 175.22 176.02 3b7r h ASP 578 N 8.49 0.39 0.40 6.13 -0.00 -1.84 -1.15 116.42 128.85 3b7r h ASP 578 Ca -0.27 0.03 -0.06 0.00 -0.00 0.00 0.00 57.03 56.73 3b7r h ASP 578 Cb 1.11 -0.05 -0.01 0.00 -0.00 0.00 0.00 39.33 40.38 3b7r h ASP 578 CO 0.83 0.20 -0.30 0.11 -0.00 0.00 0.00 179.24 180.07 3b7r h LYS 579 N 0.41 0.00 -0.01 4.15 1.79 -1.93 -3.08 116.57 117.90 3b7r h LYS 579 Ca 0.39 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.86 3b7r h LYS 579 Cb 0.91 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.56 3b7r h LYS 579 CO -0.13 0.30 -0.24 -1.13 -1.08 0.00 0.00 179.45 177.18 3b7r n SER 580 N -3.97 1.53 0.05 0.86 3.41 -0.69 -4.74 113.62 110.07 3b7r n SER 580 Ca -0.02 -1.27 -0.11 0.00 -0.26 0.00 0.00 58.87 57.22 3b7r n SER 580 Cb 0.37 0.41 -0.05 0.00 -0.26 0.00 0.00 64.21 64.68 3b7r n SER 580 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 3b7r h HIS 581 N 1.65 -0.35 -0.44 7.33 6.17 -1.12 0.20 115.15 128.60 3b7r h HIS 581 Ca 0.00 0.01 -0.09 0.00 0.71 0.00 0.00 60.37 61.00 3b7r h HIS 581 Cb 0.47 0.16 -0.02 0.00 2.52 0.00 0.00 27.41 30.54 3b7r h HIS 581 CO 0.00 -0.20 -0.11 -0.44 0.71 0.00 0.00 177.93 177.89 3b7r h ASP 582 N -0.22 0.77 0.16 3.26 3.32 -1.85 -2.28 116.42 119.58 3b7r h ASP 582 Ca 0.05 -0.23 -0.13 0.00 0.02 0.00 0.00 57.03 56.74 3b7r h ASP 582 Cb 0.29 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3b7r h ASP 582 CO -0.14 0.90 -0.48 -0.61 -1.72 0.00 0.00 179.24 177.19 3b7r h GLN 583 N 0.71 0.37 -0.38 3.56 4.15 -1.77 -1.24 115.11 120.51 3b7r h GLN 583 Ca 0.12 -0.21 -0.00 0.00 0.77 0.00 0.00 58.65 59.33 3b7r h GLN 583 Cb 0.59 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.27 3b7r h GLN 583 CO 0.04 0.78 0.22 0.00 -1.93 0.00 0.00 178.83 177.94 3b7r h ALA 584 N 1.19 0.49 -0.42 3.38 0.00 -0.69 0.11 119.26 123.32 3b7r h ALA 584 Ca 0.02 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3b7r h ALA 584 Cb 0.96 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 3b7r h ALA 584 CO 0.08 -0.00 0.03 0.28 0.00 0.00 0.00 179.25 179.64 3b7r h VAL 585 N 0.50 1.25 -0.58 0.00 2.07 -1.27 -1.68 116.25 116.54 3b7r h VAL 585 Ca 0.14 -0.96 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 3b7r h VAL 585 Cb 0.03 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 3b7r h VAL 585 CO -0.02 0.33 0.33 0.03 0.02 0.00 0.00 177.57 178.26 3b7r h ARG 586 N 0.56 0.80 -0.35 1.57 3.08 -1.12 -0.04 114.38 118.88 3b7r h ARG 586 Ca 0.12 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 3b7r h ARG 586 Cb 0.44 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 3b7r h ARG 586 CO 0.02 0.59 0.08 1.15 -1.07 0.00 0.00 179.97 180.74 3b7r h THR 587 N 0.78 1.22 -0.07 2.04 2.02 -0.86 -0.55 112.91 117.49 3b7r h THR 587 Ca 0.21 -0.76 0.01 0.00 0.77 0.00 0.00 66.41 66.63 3b7r h THR 587 Cb 0.01 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 3b7r h THR 587 CO -0.04 0.26 0.02 0.22 0.37 0.00 0.00 175.52 176.35 3b7r h TYR 588 N 0.40 0.04 -0.89 3.16 3.20 -1.01 -1.67 116.97 120.20 3b7r h TYR 588 Ca 0.11 0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.06 3b7r h TYR 588 Cb 0.31 -0.01 -0.07 0.00 1.54 0.00 0.00 36.73 38.50 3b7r h TYR 588 CO 0.02 0.02 0.55 1.96 -1.64 0.00 0.00 178.16 179.07 3b7r h GLN 589 N 0.06 0.94 -0.03 1.82 1.08 -0.77 0.80 115.11 119.00 3b7r h GLN 589 Ca 0.03 -0.06 -0.11 0.00 -1.45 0.00 0.00 58.65 57.06 3b7r h GLN 589 Cb 0.02 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.22 3b7r h GLN 589 CO -0.03 0.62 -0.49 0.93 -0.95 0.00 0.00 178.83 178.91 3b7r h GLU 590 N 0.97 0.09 0.00 1.46 5.08 -0.81 -3.22 114.58 118.14 3b7r h GLU 590 Ca 0.40 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 3b7r h GLU 590 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3b7r h GLU 590 CO -0.20 0.56 -1.38 0.72 -1.00 0.00 0.00 179.01 177.71 3b7r n HIS 591 N -3.96 0.33 -0.28 4.33 8.25 -0.65 -4.60 115.22 118.63 3b7r n HIS 591 Ca -0.02 0.10 0.04 0.00 -0.26 0.00 0.00 57.72 57.58 3b7r n HIS 591 Cb 0.52 -0.56 0.19 0.00 1.12 0.00 0.00 29.99 31.25 3b7r n HIS 591 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3b7r h LYS 592 N 0.00 0.63 0.00 -0.41 3.64 -0.89 -0.16 116.57 119.37 3b7r h LYS 592 Ca 0.00 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 3b7r h LYS 592 Cb 0.88 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.56 3b7r h LYS 592 CO 0.00 0.41 -0.07 0.00 -2.27 0.00 0.00 179.45 177.52 3b7r h ALA 593 N 1.50 1.11 -0.44 5.00 0.00 -1.81 -2.27 119.26 122.34 3b7r h ALA 593 Ca 0.41 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3b7r h ALA 593 Cb 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3b7r h ALA 593 CO -0.31 0.09 0.00 -1.13 0.00 0.00 0.00 179.25 177.90 3b7r n SER 594 N -3.33 3.58 -4.94 0.00 3.41 -0.11 -4.99 113.62 107.24 3b7r n SER 594 Ca -0.01 -2.26 -0.25 0.00 -0.26 0.00 0.00 58.87 56.09 3b7r n SER 594 Cb 0.25 -0.39 0.02 0.00 -0.26 0.00 0.00 64.21 63.83 3b7r n SER 594 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3b7r s MET 595 N -1.48 3.01 0.31 4.33 1.00 -0.86 -5.05 119.30 120.57 3b7r s MET 595 Ca 0.35 -0.27 -0.30 0.00 0.00 0.00 0.00 55.69 55.48 3b7r s MET 595 Cb 0.22 -2.43 -0.12 0.00 0.00 0.00 0.00 34.83 32.50 3b7r s MET 595 CO 0.19 -0.45 1.55 1.58 0.00 0.00 0.00 175.02 177.88 3b7r n HIS 596 N -2.30 2.80 -0.26 -0.03 -0.00 -1.26 -4.84 115.22 109.33 3b7r n HIS 596 Ca 0.03 0.32 0.05 0.00 -0.00 0.00 0.00 57.72 58.11 3b7r n HIS 596 Cb 0.58 -2.56 0.27 0.00 -0.00 0.00 0.00 29.99 28.27 3b7r n HIS 596 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3b7r h PRO 597 N 4.26 0.92 -0.06 1.57 0.13 -1.89 0.28 132.00 137.21 3b7r h PRO 597 Ca -0.48 -0.06 -0.08 0.00 -0.87 0.00 0.00 66.00 64.52 3b7r h PRO 597 Cb 1.23 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3b7r h PRO 597 CO 0.75 0.61 -0.29 0.28 -0.23 0.00 0.00 178.00 179.12 3b7r h VAL 598 N 0.95 1.44 -0.85 1.56 2.07 -1.91 -2.25 116.25 117.27 3b7r h VAL 598 Ca 0.36 -1.73 0.09 0.00 0.82 0.00 0.00 66.70 66.25 3b7r h VAL 598 Cb 0.20 2.38 -0.07 0.00 -1.52 0.00 0.00 31.29 32.27 3b7r h VAL 598 CO -0.13 0.49 0.49 0.74 0.02 0.00 0.00 177.57 179.19 3b7r h THR 599 N -0.22 0.93 -0.53 2.57 2.02 -1.89 -0.56 112.91 115.24 3b7r h THR 599 Ca -0.02 -0.29 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 3b7r h THR 599 Cb 0.95 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 3b7r h THR 599 CO 0.06 0.15 0.17 0.00 0.37 0.00 0.00 175.52 176.28 3b7r h ALA 600 N 1.45 0.69 -0.43 6.16 0.00 -0.92 -0.45 119.26 125.75 3b7r h ALA 600 Ca 0.40 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 3b7r h ALA 600 Cb 0.34 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3b7r h ALA 600 CO -0.24 0.34 0.20 1.98 0.00 0.00 0.00 179.25 181.53 3b7r h MET 601 N 0.72 0.63 -0.03 0.00 -1.53 -0.75 -1.66 114.93 112.31 3b7r h MET 601 Ca 0.17 -0.10 -0.25 0.00 -3.44 0.00 0.00 59.70 56.08 3b7r h MET 601 Cb 0.26 -0.11 0.02 0.00 -0.55 0.00 0.00 31.60 31.22 3b7r h MET 601 CO -0.01 0.55 -0.96 -0.07 0.14 0.00 0.00 176.91 176.57 3b7r h LEU 602 N 0.55 0.90 -0.67 3.39 3.38 -0.80 -1.75 115.31 120.31 3b7r h LEU 602 Ca 0.15 -0.72 -0.02 0.00 0.09 0.00 0.00 57.88 57.38 3b7r h LEU 602 Cb 0.14 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3b7r h LEU 602 CO -0.02 1.49 0.35 0.58 0.09 0.00 0.00 178.44 180.94 3b7r h VAL 603 N 0.40 1.22 -0.50 1.22 2.07 -1.09 0.32 116.25 119.88 3b7r h VAL 603 Ca -0.11 -0.56 0.08 0.00 0.82 0.00 0.00 66.70 66.92 3b7r h VAL 603 Cb 1.61 0.36 -0.06 0.00 -1.52 0.00 0.00 31.29 31.68 3b7r h VAL 603 CO 0.19 0.24 0.14 1.23 0.02 0.00 0.00 177.57 179.39 3b7r h GLY 604 N 0.92 0.63 0.97 2.17 0.00 -1.15 0.01 103.07 106.63 3b7r h GLY 604 Ca 0.23 -0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.46 3b7r h GLY 604 CO -0.03 -0.03 0.12 0.50 0.00 0.00 0.00 176.54 177.09 3b7r h LYS 605 N 0.29 0.76 -0.79 4.80 1.57 -0.83 -0.93 116.57 121.44 3b7r h LYS 605 Ca 0.25 -0.18 0.04 0.00 -1.87 0.00 0.00 60.65 58.89 3b7r h LYS 605 Cb 0.30 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.46 3b7r h LYS 605 CO -0.29 0.74 0.50 -0.44 -0.57 0.00 0.00 179.45 179.38 3b7r h ASP 606 N 0.64 0.80 0.33 0.86 3.32 -0.40 -2.43 116.42 119.55 3b7r h ASP 606 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3b7r h ASP 606 Cb 0.31 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3b7r h ASP 606 CO 0.00 0.54 -0.10 0.18 -1.72 0.00 0.00 179.24 178.14 3b7r n LEU 607 N -4.62 0.50 -3.88 1.55 4.77 -0.06 -4.94 117.00 110.31 3b7r n LEU 607 Ca 0.10 -0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.78 3b7r n LEU 607 Cb 0.12 -0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.07 3b7r n LEU 607 CO 0.32 0.09 0.08 0.29 -1.33 0.00 0.00 177.39 176.85 3b7r n LYS 608 N -0.91 -5.49 -2.13 3.23 5.02 -0.45 -5.02 118.16 112.41 3b7r n LYS 608 Ca 0.15 0.60 -0.28 0.00 -2.02 0.00 0.00 58.31 56.77 3b7r n LYS 608 Cb 0.27 -5.45 0.15 0.00 -0.02 0.00 0.00 35.03 29.99 3b7r n LYS 608 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3b7r s VAL 609 N -3.36 2.06 0.00 -0.18 -7.23 -0.63 -5.04 120.40 106.02 3b7r s VAL 609 Ca 0.56 -0.19 0.00 0.00 -1.81 0.00 0.00 61.98 60.55 3b7r s VAL 609 Cb -0.28 -2.87 0.00 0.00 0.56 0.00 0.00 36.38 33.78 3b7r s VAL 609 CO 0.83 0.00 0.00 0.47 -0.31 0.00 0.00 175.10 176.09