#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k5e s ILE 19 N 0.00 2.45 -0.22 -1.44 1.01 -0.11 -4.90 121.20 117.98 3k5e s ILE 19 Ca 0.00 0.11 -0.26 0.00 0.00 0.00 0.00 60.65 60.50 3k5e s ILE 19 Cb 0.00 -3.07 -0.00 0.00 0.01 0.00 0.00 42.46 39.40 3k5e s ILE 19 CO 0.00 0.00 0.87 -1.10 0.00 0.00 0.00 174.94 174.71 3k5e s GLN 20 N 2.19 4.23 -0.19 2.79 -0.21 -0.83 -4.63 119.66 123.01 3k5e s GLN 20 Ca 0.78 1.04 0.01 0.00 0.02 0.00 0.00 55.36 57.21 3k5e s GLN 20 Cb -0.46 -3.63 0.02 0.00 1.00 0.00 0.00 33.01 29.94 3k5e s GLN 20 CO 0.34 -0.49 -0.19 0.08 -2.12 0.00 0.00 175.29 172.92 3k5e s VAL 21 N 2.73 2.13 0.14 1.09 1.01 -1.26 -0.30 120.40 125.93 3k5e s VAL 21 Ca 0.37 -0.94 0.11 0.00 0.00 0.00 0.00 61.98 61.52 3k5e s VAL 21 Cb -0.16 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 3k5e s VAL 21 CO 0.08 0.51 -0.26 0.68 0.00 0.00 0.00 175.10 176.12 3k5e s VAL 22 N 1.29 2.34 -0.12 2.92 -7.23 -0.43 -0.56 120.40 118.61 3k5e s VAL 22 Ca 0.05 -1.76 -0.01 0.00 -1.81 0.00 0.00 61.98 58.44 3k5e s VAL 22 Cb -0.13 -2.05 -0.02 0.00 0.56 0.00 0.00 36.38 34.73 3k5e s VAL 22 CO -0.12 0.06 -0.09 -0.69 -0.31 0.00 0.00 175.10 173.95 3k5e s VAL 23 N -1.15 3.44 -0.18 1.32 1.01 -0.53 -0.90 120.40 123.42 3k5e s VAL 23 Ca 0.15 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.60 3k5e s VAL 23 Cb -0.10 -2.46 0.01 0.00 0.00 0.00 0.00 36.38 33.84 3k5e s VAL 23 CO 0.07 0.53 -0.17 -0.60 0.00 0.00 0.00 175.10 174.93 3k5e s ARG 24 N 0.11 3.09 -0.04 2.72 3.52 0.33 0.60 118.95 129.28 3k5e s ARG 24 Ca -0.04 -0.79 -0.19 0.00 -0.13 0.00 0.00 55.73 54.59 3k5e s ARG 24 Cb -0.14 -2.63 -0.05 0.00 -1.56 0.00 0.00 34.95 30.57 3k5e s ARG 24 CO 0.04 -0.14 0.52 0.00 -0.81 0.00 0.00 175.30 174.91 3k5e s ARG 26 N -0.11 3.67 0.56 0.00 1.70 -0.67 -3.62 118.95 120.47 3k5e s ARG 26 Ca 0.28 0.83 -0.01 0.00 -0.47 0.00 0.00 55.73 56.36 3k5e s ARG 26 Cb -0.17 -2.09 0.03 0.00 -0.57 0.00 0.00 34.95 32.15 3k5e s ARG 26 CO 0.14 -0.51 0.81 -1.25 -1.08 0.00 0.00 175.30 173.41 3k5e s PRO 27 N -4.81 2.64 0.33 3.89 0.05 -1.26 -4.21 135.00 131.64 3k5e s PRO 27 Ca 0.57 -0.53 -0.28 0.00 0.05 0.00 0.00 61.00 60.80 3k5e s PRO 27 Cb -0.11 -2.42 -0.10 0.00 0.05 0.00 0.00 34.50 31.92 3k5e s PRO 27 CO 0.47 -0.71 1.27 -0.06 0.05 0.00 0.00 177.00 178.02 3k5e s PHE 28 N -2.83 3.10 0.84 0.56 0.40 -1.26 -4.95 117.98 113.84 3k5e s PHE 28 Ca 0.55 1.46 -0.13 0.00 -0.60 0.00 0.00 56.93 58.22 3k5e s PHE 28 Cb -0.10 -3.61 0.10 0.00 0.51 0.00 0.00 43.02 39.91 3k5e s PHE 28 CO 0.40 -1.68 1.20 0.54 0.70 0.00 0.00 175.22 176.39 3k5e s ASN 29 N -0.59 4.24 0.47 1.36 2.20 -1.26 -4.94 114.94 116.42 3k5e s ASN 29 Ca 0.49 0.70 0.12 0.00 -0.94 0.00 0.00 52.86 53.23 3k5e s ASN 29 Cb -0.38 -1.12 1.08 0.00 -2.00 0.00 0.00 41.25 38.83 3k5e s ASN 29 CO 0.50 -2.07 2.09 0.25 -2.94 0.00 0.00 177.10 174.94 3k5e h LEU 30 N -1.17 0.23 -1.11 3.54 5.85 -2.01 -2.19 115.31 118.46 3k5e h LEU 30 Ca -0.46 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.17 3k5e h LEU 30 Cb 1.31 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 3k5e h LEU 30 CO 0.61 0.17 -0.43 0.00 -0.34 0.00 0.00 178.44 178.45 3k5e h ALA 31 N 1.85 1.21 0.00 1.25 0.00 -1.99 -2.40 119.26 119.19 3k5e h ALA 31 Ca 0.10 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.49 3k5e h ALA 31 Cb 0.05 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3k5e h ALA 31 CO -0.02 0.54 -0.60 0.93 0.00 0.00 0.00 179.25 180.09 3k5e h GLU 32 N 0.00 0.00 0.13 0.00 5.08 -1.77 -3.26 114.58 114.77 3k5e h GLU 32 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3k5e h GLU 32 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 3k5e h GLU 32 CO 0.06 0.60 -0.06 0.00 -1.00 0.00 0.00 179.01 178.61 3k5e h ARG 33 N 0.00 -0.17 -2.33 2.33 2.47 -1.40 0.26 114.38 115.54 3k5e h ARG 33 Ca -0.01 0.01 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 3k5e h ARG 33 Cb 1.26 0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 29.59 3k5e h ARG 33 CO 0.08 0.28 0.01 0.36 0.56 0.00 0.00 179.97 181.26 3k5e n LYS 34 N -4.93 0.94 -3.66 0.04 2.85 -0.92 -4.47 118.16 108.01 3k5e n LYS 34 Ca -0.08 -0.39 -0.18 0.00 -1.05 0.00 0.00 58.31 56.60 3k5e n LYS 34 Cb 0.27 -1.62 -0.16 0.00 -0.65 0.00 0.00 35.03 32.86 3k5e n LYS 34 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 3k5e s SER 36 N 2.33 0.94 0.11 -5.58 1.04 -1.25 -5.10 113.70 106.18 3k5e s SER 36 Ca 0.26 0.21 -0.13 0.00 0.48 0.00 0.00 55.95 56.78 3k5e s SER 36 Cb 0.13 0.11 -0.06 0.00 0.10 0.00 0.00 66.02 66.30 3k5e s SER 36 CO 0.00 -0.25 0.48 0.00 0.98 0.00 0.00 173.24 174.45 3k5e s ALA 37 N 2.25 3.64 -0.17 5.32 0.00 0.08 -5.08 121.76 127.80 3k5e s ALA 37 Ca 0.04 -0.22 -0.12 0.00 0.00 0.00 0.00 51.96 51.66 3k5e s ALA 37 Cb -0.12 -2.43 -0.05 0.00 0.00 0.00 0.00 23.12 20.52 3k5e s ALA 37 CO -0.05 0.49 0.23 -3.38 0.00 0.00 0.00 175.76 173.05 3k5e s HIS 38 N -1.39 3.45 0.06 0.00 -3.43 -1.26 -4.97 115.29 107.75 3k5e s HIS 38 Ca 0.34 0.50 -0.30 0.00 -0.80 0.00 0.00 55.06 54.80 3k5e s HIS 38 Cb -0.15 -2.25 -0.05 0.00 -1.43 0.00 0.00 32.58 28.69 3k5e s HIS 38 CO 0.18 0.29 1.16 0.45 -2.00 0.00 0.00 174.74 174.82 3k5e s SER 39 N 0.33 7.14 0.00 7.38 0.15 -1.26 -4.41 113.70 123.03 3k5e s SER 39 Ca 0.13 1.97 0.25 0.00 0.70 0.00 0.00 55.95 59.00 3k5e s SER 39 Cb -0.12 -2.58 0.62 0.00 -1.71 0.00 0.00 66.02 62.23 3k5e s SER 39 CO 0.02 -0.42 1.50 2.30 1.20 0.00 0.00 173.24 177.84 3k5e n ILE 40 N 3.77 0.08 -4.41 6.45 -5.35 -0.17 -4.90 119.36 114.84 3k5e n ILE 40 Ca 0.08 -0.41 -0.33 0.00 -0.27 0.00 0.00 62.75 61.81 3k5e n ILE 40 Cb 0.47 0.91 -0.15 0.00 -1.74 0.00 0.00 39.64 39.13 3k5e n ILE 40 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 3k5e s VAL 41 N -1.92 2.79 -0.20 7.28 1.01 -1.26 -0.45 120.40 127.66 3k5e s VAL 41 Ca 0.34 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 3k5e s VAL 41 Cb 0.20 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.38 3k5e s VAL 41 CO 0.31 0.50 -0.07 -1.61 0.00 0.00 0.00 175.10 174.23 3k5e s GLU 42 N 0.91 3.36 -0.12 2.72 2.02 0.37 -4.98 118.70 122.98 3k5e s GLU 42 Ca -0.03 -0.65 -0.05 0.00 0.02 0.00 0.00 54.97 54.27 3k5e s GLU 42 Cb -0.15 -2.91 -0.04 0.00 0.10 0.00 0.00 34.13 31.14 3k5e s GLU 42 CO -0.01 -0.11 0.04 0.00 0.02 0.00 0.00 175.26 175.20 3k5e s ASP 44 N -0.47 3.84 0.30 0.00 2.15 -0.21 -4.94 116.67 117.34 3k5e s ASP 44 Ca 0.09 -2.47 -0.00 0.00 0.43 0.00 0.00 52.55 50.60 3k5e s ASP 44 Cb -0.12 -1.10 0.50 0.00 -0.30 0.00 0.00 42.92 41.90 3k5e s ASP 44 CO 0.02 -0.29 1.94 -0.65 -0.17 0.00 0.00 175.17 176.02 3k5e h PRO 45 N 6.98 1.03 0.00 4.34 0.11 -1.82 0.54 132.00 143.19 3k5e h PRO 45 Ca -0.04 -0.06 -0.14 0.00 0.11 0.00 0.00 66.00 65.87 3k5e h PRO 45 Cb 0.94 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.80 3k5e h PRO 45 CO 0.50 0.68 -0.68 -0.24 -0.21 0.00 0.00 178.00 178.06 3k5e h VAL 46 N 1.06 1.37 -0.00 3.15 3.04 -1.95 -1.96 116.25 120.96 3k5e h VAL 46 Ca 0.35 -2.42 0.00 0.00 -1.01 0.00 0.00 66.70 63.62 3k5e h VAL 46 Cb 0.05 2.35 0.00 0.00 -2.01 0.00 0.00 31.29 31.68 3k5e h VAL 46 CO -0.11 0.66 -0.28 0.54 -1.01 0.00 0.00 177.57 177.38 3k5e n ARG 47 N -3.56 0.56 -3.79 4.17 1.74 -0.87 -4.97 116.66 109.95 3k5e n ARG 47 Ca -0.00 -0.30 -0.26 0.00 -0.77 0.00 0.00 57.85 56.52 3k5e n ARG 47 Cb 0.71 -1.49 0.04 0.00 -1.02 0.00 0.00 32.46 30.69 3k5e n ARG 47 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3k5e n LYS 48 N -0.96 -5.88 -4.16 5.56 4.76 0.18 -4.89 118.16 112.76 3k5e n LYS 48 Ca 0.11 0.66 -0.16 0.00 -2.87 0.00 0.00 58.31 56.04 3k5e n LYS 48 Cb 0.33 -5.51 -0.12 0.00 -1.84 0.00 0.00 35.03 27.89 3k5e n LYS 48 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3k5e s GLU 49 N -6.36 0.70 -0.04 1.97 2.12 -0.77 -0.86 118.70 115.46 3k5e s GLU 49 Ca 0.46 -0.79 0.07 0.00 0.36 0.00 0.00 54.97 55.07 3k5e s GLU 49 Cb -0.23 -0.61 -0.02 0.00 0.26 0.00 0.00 34.13 33.54 3k5e s GLU 49 CO 0.80 0.14 -0.25 0.54 -0.54 0.00 0.00 175.26 175.95 3k5e s VAL 50 N -1.17 2.12 -0.07 3.70 0.11 0.54 -1.05 120.40 124.58 3k5e s VAL 50 Ca -0.04 -1.06 0.02 0.00 -2.93 0.00 0.00 61.98 57.96 3k5e s VAL 50 Cb -0.09 -1.75 0.01 0.00 -1.53 0.00 0.00 36.38 33.02 3k5e s VAL 50 CO 0.01 0.58 -0.12 -0.55 -3.33 0.00 0.00 175.10 171.69 3k5e s SER 51 N -0.39 1.81 -0.10 3.54 0.15 0.38 -1.34 113.70 117.76 3k5e s SER 51 Ca 0.03 -0.30 0.01 0.00 0.70 0.00 0.00 55.95 56.40 3k5e s SER 51 Cb -0.12 -0.83 -0.02 0.00 -1.71 0.00 0.00 66.02 63.34 3k5e s SER 51 CO 0.01 0.02 -0.13 -0.69 1.20 0.00 0.00 173.24 173.65 3k5e s VAL 52 N 0.77 3.12 -0.25 4.45 1.01 0.84 -0.48 120.40 129.85 3k5e s VAL 52 Ca -0.13 -0.67 -0.21 0.00 0.00 0.00 0.00 61.98 60.98 3k5e s VAL 52 Cb -0.15 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 3k5e s VAL 52 CO 0.03 0.55 0.67 -0.60 0.00 0.00 0.00 175.10 175.74 3k5e s ARG 53 N -0.14 4.12 -0.16 2.72 3.52 0.41 0.08 118.95 129.50 3k5e s ARG 53 Ca -0.01 0.61 0.19 0.00 -0.13 0.00 0.00 55.73 56.39 3k5e s ARG 53 Cb -0.14 -3.65 -0.27 0.00 -1.56 0.00 0.00 34.95 29.34 3k5e s ARG 53 CO 0.03 -0.44 0.18 0.25 -0.81 0.00 0.00 175.30 174.52 3k5e n THR 54 N 5.21 1.10 -4.23 4.11 -2.24 -0.87 -4.95 114.28 112.41 3k5e n THR 54 Ca 0.01 -0.78 -0.14 0.00 -2.27 0.00 0.00 64.05 60.87 3k5e n THR 54 Cb 0.49 -0.38 -0.10 0.00 -2.10 0.00 0.00 70.33 68.24 3k5e n THR 54 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3k5e s GLY 55 N -5.27 1.62 0.03 3.38 0.00 -1.24 -5.01 107.32 100.84 3k5e s GLY 55 Ca -0.09 -1.77 -0.13 0.00 0.00 0.00 0.00 44.72 42.73 3k5e s GLY 55 CO 0.85 -1.45 0.28 -0.32 0.00 0.00 0.00 173.10 172.46 3k5e s GLY 56 N -3.22 -0.09 0.00 0.20 0.00 -1.26 -3.76 107.32 99.18 3k5e s GLY 56 Ca 0.39 0.03 0.00 0.00 0.00 0.00 0.00 44.72 45.14 3k5e s GLY 56 CO 0.14 -0.17 0.00 1.34 0.00 0.00 0.00 173.10 174.41 3k5e n ASP 59 N 0.82 0.00 -3.38 1.64 2.03 -1.26 -4.84 116.55 111.56 3k5e n ASP 59 Ca -0.20 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.13 3k5e n ASP 59 Cb 0.58 -0.08 -0.04 0.00 -0.72 0.00 0.00 41.12 40.87 3k5e n ASP 59 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3k5e s LYS 60 N 0.00 0.29 0.35 -0.67 2.20 -1.26 -5.18 119.74 115.47 3k5e s LYS 60 Ca 0.00 0.71 -0.14 0.00 -0.36 0.00 0.00 55.97 56.18 3k5e s LYS 60 Cb 0.00 0.43 0.04 0.00 -1.51 0.00 0.00 37.83 36.78 3k5e s LYS 60 CO 0.00 -0.12 0.71 -1.54 -0.36 0.00 0.00 175.35 174.04 3k5e s SER 61 N 2.49 0.11 0.08 1.43 1.04 -1.26 -5.07 113.70 112.52 3k5e s SER 61 Ca -0.02 -1.10 0.06 0.00 0.48 0.00 0.00 55.95 55.37 3k5e s SER 61 Cb -0.06 0.78 -0.04 0.00 0.10 0.00 0.00 66.02 66.80 3k5e s SER 61 CO -0.17 -1.54 -0.11 -0.55 0.98 0.00 0.00 173.24 171.86 3k5e s SER 62 N -3.07 4.35 0.09 7.02 0.15 -1.25 -5.01 113.70 115.97 3k5e s SER 62 Ca 0.18 -0.35 0.03 0.00 0.70 0.00 0.00 55.95 56.50 3k5e s SER 62 Cb -0.04 -0.84 -0.03 0.00 -1.71 0.00 0.00 66.02 63.39 3k5e s SER 62 CO 0.12 0.21 -0.09 -0.13 1.20 0.00 0.00 173.24 174.54 3k5e s ARG 63 N -1.97 0.78 -0.05 5.44 0.52 -1.26 -2.04 118.95 120.36 3k5e s ARG 63 Ca 0.20 -1.10 0.03 0.00 -0.52 0.00 0.00 55.73 54.34 3k5e s ARG 63 Cb -0.11 -0.45 -0.03 0.00 0.52 0.00 0.00 34.95 34.88 3k5e s ARG 63 CO 0.12 0.06 -0.14 0.21 0.02 0.00 0.00 175.30 175.57 3k5e s LYS 64 N -2.67 2.54 -0.03 3.54 2.47 0.11 -4.93 119.74 120.77 3k5e s LYS 64 Ca 0.03 -0.69 0.03 0.00 -1.56 0.00 0.00 55.97 53.78 3k5e s LYS 64 Cb -0.03 -2.39 0.00 0.00 -1.46 0.00 0.00 37.83 33.95 3k5e s LYS 64 CO -0.01 0.61 -0.09 0.99 0.16 0.00 0.00 175.35 177.01 3k5e s THR 65 N -0.70 0.83 -0.00 3.43 2.01 -1.26 -0.11 115.64 119.83 3k5e s THR 65 Ca 0.11 -0.38 -0.00 0.00 0.31 0.00 0.00 61.69 61.72 3k5e s THR 65 Cb -0.11 -0.74 0.00 0.00 0.01 0.00 0.00 72.50 71.67 3k5e s THR 65 CO 0.01 0.26 0.01 -0.31 -0.69 0.00 0.00 174.62 173.89 3k5e s TYR 66 N 0.21 -0.01 -0.19 4.92 1.51 -0.45 -5.00 117.35 118.35 3k5e s TYR 66 Ca -0.04 0.03 -0.09 0.00 -1.01 0.00 0.00 57.07 55.96 3k5e s TYR 66 Cb -0.09 -0.01 -0.05 0.00 -0.11 0.00 0.00 41.96 41.70 3k5e s TYR 66 CO 0.01 -0.01 0.11 0.99 -1.11 0.00 0.00 175.55 175.53 3k5e s THR 67 N 0.07 5.19 0.43 -0.71 2.01 -1.26 -0.34 115.64 121.03 3k5e s THR 67 Ca -0.01 0.11 0.05 0.00 0.31 0.00 0.00 61.69 62.15 3k5e s THR 67 Cb -0.01 -3.36 -0.06 0.00 0.01 0.00 0.00 72.50 69.09 3k5e s THR 67 CO -0.00 0.45 0.02 -0.36 -0.69 0.00 0.00 174.62 174.04 3k5e s PHE 68 N 0.30 2.22 0.23 4.92 0.40 -0.04 -4.99 117.98 121.02 3k5e s PHE 68 Ca 0.07 -0.82 -0.07 0.00 -0.60 0.00 0.00 56.93 55.50 3k5e s PHE 68 Cb -0.11 -1.63 0.20 0.00 0.51 0.00 0.00 43.02 41.98 3k5e s PHE 68 CO -0.01 0.28 1.83 -0.44 0.70 0.00 0.00 175.22 177.59 3k5e h ASP 69 N 1.71 1.13 -4.67 1.36 5.19 -1.11 -3.44 116.42 116.58 3k5e h ASP 69 Ca -0.43 -0.12 -0.14 0.00 -0.62 0.00 0.00 57.03 55.72 3k5e h ASP 69 Cb 1.26 -0.29 -0.22 0.00 0.18 0.00 0.00 39.33 40.27 3k5e h ASP 69 CO 0.76 0.93 -0.39 -0.04 -3.12 0.00 0.00 179.24 177.38 3k5e s MET 70 N -5.75 0.50 -0.03 3.56 -1.94 -1.23 -5.00 119.30 109.40 3k5e s MET 70 Ca -0.13 -0.12 0.06 0.00 -1.71 0.00 0.00 55.69 53.79 3k5e s MET 70 Cb 0.17 0.22 -0.01 0.00 2.01 0.00 0.00 34.83 37.21 3k5e s MET 70 CO 0.83 -0.12 -0.21 0.14 -0.01 0.00 0.00 175.02 175.65 3k5e s VAL 71 N -0.96 1.69 -0.17 -6.03 -7.23 -1.26 -1.45 120.40 104.99 3k5e s VAL 71 Ca -0.10 -0.90 0.01 0.00 -1.81 0.00 0.00 61.98 59.18 3k5e s VAL 71 Cb -0.05 -1.41 0.02 0.00 0.56 0.00 0.00 36.38 35.49 3k5e s VAL 71 CO 0.02 0.48 -0.19 -0.36 -0.31 0.00 0.00 175.10 174.74 3k5e s PHE 72 N -0.37 2.66 0.91 2.82 0.08 0.20 -4.52 117.98 119.76 3k5e s PHE 72 Ca 0.05 -1.54 -0.15 0.00 0.12 0.00 0.00 56.93 55.41 3k5e s PHE 72 Cb -0.09 -1.85 0.16 0.00 -0.57 0.00 0.00 43.02 40.66 3k5e s PHE 72 CO 0.00 -0.77 1.27 0.20 -0.10 0.00 0.00 175.22 175.83 3k5e s GLY 73 N 1.28 1.71 0.63 4.36 0.00 -1.26 -1.11 107.32 112.93 3k5e s GLY 73 Ca 0.04 -1.00 0.35 0.00 0.00 0.00 0.00 44.72 44.11 3k5e s GLY 73 CO -0.12 -0.33 2.21 0.00 0.00 0.00 0.00 173.10 174.87 3k5e h ALA 74 N -1.45 1.39 0.00 3.20 0.00 -1.83 -1.81 119.26 118.76 3k5e h ALA 74 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3k5e h ALA 74 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3k5e h ALA 74 CO 0.48 -0.13 0.00 0.66 0.00 0.00 0.00 179.25 180.26 3k5e h SER 75 N 0.00 0.00 -1.83 0.00 4.64 -1.92 -3.39 113.55 111.06 3k5e h SER 75 Ca 0.02 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.68 3k5e h SER 75 Cb 0.23 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.35 3k5e h SER 75 CO -0.00 0.00 0.85 0.41 -0.87 0.00 0.00 176.83 177.22 3k5e n THR 76 N -2.53 0.27 -3.10 2.95 -1.04 -0.68 -5.00 114.28 105.14 3k5e n THR 76 Ca 0.05 -0.05 -0.23 0.00 -2.04 0.00 0.00 64.05 61.78 3k5e n THR 76 Cb 0.46 -1.37 0.00 0.00 -1.82 0.00 0.00 70.33 67.60 3k5e n THR 76 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3k5e s LYS 77 N 2.62 3.22 0.40 -2.82 -0.14 -1.26 -5.00 119.74 116.76 3k5e s LYS 77 Ca 0.91 -0.42 0.09 0.00 -1.36 0.00 0.00 55.97 55.19 3k5e s LYS 77 Cb -0.88 -2.59 0.88 0.00 -1.68 0.00 0.00 37.83 33.57 3k5e s LYS 77 CO 0.53 -0.13 1.99 1.96 -0.76 0.00 0.00 175.35 178.94 3k5e h GLN 78 N 0.51 0.56 -0.40 1.68 1.08 -1.88 -2.11 115.11 114.55 3k5e h GLN 78 Ca -0.47 -0.03 -0.13 0.00 -1.45 0.00 0.00 58.65 56.57 3k5e h GLN 78 Cb 1.24 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 28.53 3k5e h GLN 78 CO 0.59 0.37 -0.26 0.97 -0.95 0.00 0.00 178.83 179.55 3k5e h ILE 79 N 0.57 1.27 -0.54 2.54 6.09 -1.87 -1.91 117.51 123.67 3k5e h ILE 79 Ca 0.27 -1.40 0.04 0.00 -1.37 0.00 0.00 64.86 62.39 3k5e h ILE 79 Cb 0.31 1.24 -0.04 0.00 0.47 0.00 0.00 36.82 38.79 3k5e h ILE 79 CO -0.08 0.47 0.31 0.44 -3.07 0.00 0.00 178.15 176.22 3k5e h ASP 80 N 0.72 0.47 -0.31 2.19 3.32 -1.78 -1.08 116.42 119.96 3k5e h ASP 80 Ca 0.09 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 3k5e h ASP 80 Cb 0.80 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 3k5e h ASP 80 CO 0.07 0.33 0.13 0.58 -1.72 0.00 0.00 179.24 178.63 3k5e h VAL 81 N 0.60 1.17 -0.01 -1.35 2.07 -1.32 -2.14 116.25 115.26 3k5e h VAL 81 Ca 0.23 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 3k5e h VAL 81 Cb 0.08 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 3k5e h VAL 81 CO -0.13 0.18 0.01 0.22 0.02 0.00 0.00 177.57 177.87 3k5e h TYR 82 N 0.35 0.02 -0.64 1.57 5.03 -1.18 -1.15 116.97 120.98 3k5e h TYR 82 Ca 0.10 -0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.37 3k5e h TYR 82 Cb 0.15 -0.01 -0.03 0.00 1.55 0.00 0.00 36.73 38.40 3k5e h TYR 82 CO -0.01 0.14 0.23 0.00 -1.32 0.00 0.00 178.16 177.20 3k5e h ARG 83 N -0.11 0.94 0.06 1.82 3.08 -1.22 0.29 114.38 119.25 3k5e h ARG 83 Ca 0.00 -0.16 -0.13 0.00 0.07 0.00 0.00 59.98 59.76 3k5e h ARG 83 Cb 0.13 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.03 3k5e h ARG 83 CO -0.00 0.79 -0.61 0.77 -1.07 0.00 0.00 179.97 179.85 3k5e h SER 84 N 0.92 0.21 0.00 7.04 0.02 -1.31 -3.38 113.55 117.06 3k5e h SER 84 Ca 0.21 -0.91 -0.37 0.00 -0.84 0.00 0.00 61.79 59.88 3k5e h SER 84 Cb 0.21 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.62 3k5e h SER 84 CO -0.02 1.27 -2.37 1.33 -1.14 0.00 0.00 176.83 175.90 3k5e n VAL 85 N -4.33 1.38 0.14 2.27 0.24 -0.44 -4.65 118.33 112.93 3k5e n VAL 85 Ca -0.16 -0.50 -0.25 0.00 -2.04 0.00 0.00 64.34 61.40 3k5e n VAL 85 Cb 0.68 -1.43 -0.16 0.00 -1.47 0.00 0.00 33.84 31.46 3k5e n VAL 85 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 3k5e h VAL 86 N -0.16 1.22 -0.49 3.34 2.07 -1.19 -3.20 116.25 117.84 3k5e h VAL 86 Ca -0.55 -2.67 0.08 0.00 0.82 0.00 0.00 66.70 64.38 3k5e h VAL 86 Cb 1.78 3.00 -0.07 0.00 -1.52 0.00 0.00 31.29 34.49 3k5e h VAL 86 CO -0.14 0.82 0.10 0.00 0.02 0.00 0.00 177.57 178.37 3k5e h PRO 88 N 0.24 0.33 -0.33 0.00 0.13 -1.80 -2.34 132.00 128.22 3k5e h PRO 88 Ca 0.24 -0.12 -0.04 0.00 -0.87 0.00 0.00 66.00 65.21 3k5e h PRO 88 Cb 0.32 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.42 3k5e h PRO 88 CO -0.32 0.59 0.04 0.82 -0.23 0.00 0.00 178.00 178.90 3k5e h ILE 89 N 0.29 1.24 -0.58 -3.56 2.04 -1.17 -2.72 117.51 113.06 3k5e h ILE 89 Ca 0.04 -0.87 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 3k5e h ILE 89 Cb 0.66 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.88 3k5e h ILE 89 CO 0.05 0.29 0.24 0.25 0.00 0.00 0.00 178.15 178.98 3k5e h LEU 90 N 0.39 0.75 -1.23 1.44 5.85 -0.68 -0.61 115.31 121.22 3k5e h LEU 90 Ca 0.10 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.74 3k5e h LEU 90 Cb 0.39 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 3k5e h LEU 90 CO 0.01 0.67 0.50 0.44 -0.34 0.00 0.00 178.44 179.72 3k5e h ASP 91 N 0.82 0.89 0.06 1.25 3.32 -1.31 -0.96 116.42 120.49 3k5e h ASP 91 Ca 0.20 -0.03 -0.16 0.00 0.02 0.00 0.00 57.03 57.07 3k5e h ASP 91 Cb 0.14 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 3k5e h ASP 91 CO -0.02 0.65 -0.54 -0.33 -1.72 0.00 0.00 179.24 177.28 3k5e h GLU 92 N 1.04 0.51 -0.27 3.56 5.08 -0.92 -1.60 114.58 121.99 3k5e h GLU 92 Ca 0.28 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3k5e h GLU 92 Cb -0.11 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 3k5e h GLU 92 CO -0.06 0.92 0.16 0.28 -1.00 0.00 0.00 179.01 179.32 3k5e h VAL 93 N 0.40 1.10 -0.46 3.13 2.07 -0.83 -1.71 116.25 119.95 3k5e h VAL 93 Ca 0.01 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.31 3k5e h VAL 93 Cb 1.07 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 3k5e h VAL 93 CO 0.10 0.10 0.31 0.40 0.02 0.00 0.00 177.57 178.50 3k5e h ILE 94 N 0.34 1.05 0.00 4.57 5.03 -0.98 0.17 117.51 127.69 3k5e h ILE 94 Ca 0.10 -0.18 0.00 0.00 -0.12 0.00 0.00 64.86 64.66 3k5e h ILE 94 Cb 0.02 0.49 0.00 0.00 -3.03 0.00 0.00 36.82 34.30 3k5e h ILE 94 CO -0.02 0.09 0.00 0.23 -0.68 0.00 0.00 178.15 177.78 3k5e n MET 95 N -4.48 0.13 0.00 2.37 2.81 -0.62 -4.84 117.12 112.50 3k5e n MET 95 Ca 0.05 0.41 0.00 0.00 -1.81 0.00 0.00 57.70 56.35 3k5e n MET 95 Cb 0.14 -1.78 0.00 0.00 -0.71 0.00 0.00 33.22 30.87 3k5e n MET 95 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3k5e n GLY 96 N -0.23 1.73 3.89 3.03 0.00 0.04 -4.95 105.19 108.70 3k5e n GLY 96 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 3k5e n GLY 96 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k5e s TYR 97 N -2.00 3.31 -0.12 1.61 2.02 -0.67 -4.66 117.35 116.83 3k5e s TYR 97 Ca 0.00 -0.01 -0.16 0.00 -0.37 0.00 0.00 57.07 56.54 3k5e s TYR 97 Cb 0.00 -1.54 -0.05 0.00 -0.40 0.00 0.00 41.96 39.97 3k5e s TYR 97 CO 0.00 0.50 0.38 -0.80 -1.57 0.00 0.00 175.55 174.06 3k5e s ASN 98 N -3.54 6.59 0.14 2.29 0.01 -1.26 -2.35 114.94 116.82 3k5e s ASN 98 Ca 0.33 0.70 0.06 0.00 -0.71 0.00 0.00 52.86 53.24 3k5e s ASN 98 Cb -0.10 -2.23 -0.04 0.00 0.41 0.00 0.00 41.25 39.29 3k5e s ASN 98 CO 0.27 0.10 -0.14 0.00 -1.51 0.00 0.00 177.10 175.82 3k5e s THR 100 N -2.33 0.22 -0.19 0.00 2.01 -0.38 -0.79 115.64 114.18 3k5e s THR 100 Ca 0.12 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.13 3k5e s THR 100 Cb -0.04 -0.28 0.02 0.00 0.01 0.00 0.00 72.50 72.21 3k5e s THR 100 CO 0.03 0.13 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.30 3k5e s ILE 101 N 0.73 2.34 -0.01 1.82 1.01 0.17 -0.57 121.20 126.68 3k5e s ILE 101 Ca -0.07 -0.87 -0.14 0.00 0.00 0.00 0.00 60.65 59.57 3k5e s ILE 101 Cb -0.11 -2.02 -0.05 0.00 0.01 0.00 0.00 42.46 40.29 3k5e s ILE 101 CO -0.01 0.49 0.37 -0.36 0.00 0.00 0.00 174.94 175.43 3k5e s PHE 102 N 1.32 3.71 -0.19 3.97 0.08 0.01 -0.70 117.98 126.19 3k5e s PHE 102 Ca 0.05 0.93 -0.06 0.00 0.12 0.00 0.00 56.93 57.97 3k5e s PHE 102 Cb -0.14 -2.24 -0.03 0.00 -0.57 0.00 0.00 43.02 40.04 3k5e s PHE 102 CO -0.11 0.66 0.02 0.00 -0.10 0.00 0.00 175.22 175.70 3k5e s ALA 103 N -1.07 3.19 -0.03 5.36 0.00 0.19 0.50 121.76 129.89 3k5e s ALA 103 Ca 0.23 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 51.36 3k5e s ALA 103 Cb -0.16 -1.81 -0.00 0.00 0.00 0.00 0.00 23.12 21.14 3k5e s ALA 103 CO 0.12 0.03 -0.14 -0.47 0.00 0.00 0.00 175.76 175.30 3k5e s TYR 104 N 0.67 1.39 0.00 0.00 6.14 0.73 -2.68 117.35 123.59 3k5e s TYR 104 Ca 0.01 -0.34 0.00 0.00 0.64 0.00 0.00 57.07 57.38 3k5e s TYR 104 Cb -0.14 -0.93 0.00 0.00 0.42 0.00 0.00 41.96 41.31 3k5e s TYR 104 CO 0.02 -0.10 0.00 0.41 0.64 0.00 0.00 175.55 176.52 3k5e n GLY 105 N 3.03 1.99 3.72 8.97 0.00 -1.26 -0.41 105.19 121.23 3k5e n GLY 105 Ca -0.17 -1.32 -0.41 0.00 0.00 0.00 0.00 46.02 44.12 3k5e n GLY 105 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3k5e n GLN 106 N -1.30 2.17 -1.61 1.61 7.27 -1.26 -1.77 117.38 122.50 3k5e n GLN 106 Ca 0.00 0.77 -0.48 0.00 0.07 0.00 0.00 57.00 57.35 3k5e n GLN 106 Cb 0.00 -2.46 -0.04 0.00 2.41 0.00 0.00 30.24 30.15 3k5e n GLN 106 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 3k5e n THR 107 N 0.06 0.67 -0.15 1.69 -1.04 -1.26 -2.21 114.28 112.05 3k5e n THR 107 Ca 0.05 -0.17 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 3k5e n THR 107 Cb 0.39 -1.02 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 3k5e n THR 107 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3k5e n GLY 108 N 2.24 0.57 0.00 3.41 0.00 -1.26 -4.96 105.19 105.20 3k5e n GLY 108 Ca 0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.28 3k5e n GLY 108 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k5e n THR 109 N -2.00 0.02 0.00 2.61 -2.24 -0.94 -4.93 114.28 106.80 3k5e n THR 109 Ca 0.00 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 3k5e n THR 109 Cb 0.00 0.70 0.00 0.00 -2.10 0.00 0.00 70.33 68.93 3k5e n THR 109 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k5e n GLY 110 N 1.46 1.70 0.15 3.38 0.00 -1.26 -4.21 105.19 106.40 3k5e n GLY 110 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 3k5e n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k5e h LYS 111 N 0.00 -0.27 -0.48 1.61 1.57 -1.94 -1.92 116.57 115.15 3k5e h LYS 111 Ca 0.00 0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 3k5e h LYS 111 Cb 0.00 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3k5e h LYS 111 CO 0.00 0.01 -0.13 1.15 -0.57 0.00 0.00 179.45 179.91 3k5e h THR 112 N -0.54 1.27 -0.38 -0.16 2.02 -1.96 -1.03 112.91 112.13 3k5e h THR 112 Ca -0.03 -1.27 0.08 0.00 0.77 0.00 0.00 66.41 65.96 3k5e h THR 112 Cb 0.40 1.10 -0.08 0.00 -1.74 0.00 0.00 68.15 67.83 3k5e h THR 112 CO 0.05 0.44 -0.20 0.15 0.37 0.00 0.00 175.52 176.32 3k5e h PHE 113 N 0.78 -0.51 -0.12 3.16 3.57 -1.87 0.25 116.94 122.20 3k5e h PHE 113 Ca 0.12 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 3k5e h PHE 113 Cb 0.69 0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.71 3k5e h PHE 113 CO 0.05 -0.28 -0.02 1.15 -2.23 0.00 0.00 178.31 176.98 3k5e h THR 114 N -0.14 1.28 -0.20 4.41 2.02 -1.19 0.16 112.91 119.25 3k5e h THR 114 Ca 0.19 -0.91 -0.20 0.00 0.77 0.00 0.00 66.41 66.26 3k5e h THR 114 Cb 0.43 1.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 3k5e h THR 114 CO -0.46 0.26 -0.66 0.24 0.37 0.00 0.00 175.52 175.27 3k5e h MET 115 N -0.08 0.74 0.00 6.66 2.86 -0.95 -2.15 114.93 122.01 3k5e h MET 115 Ca 0.03 -0.53 -0.14 0.00 -2.06 0.00 0.00 59.70 57.00 3k5e h MET 115 Cb 0.41 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 3k5e h MET 115 CO 0.01 1.15 -1.53 0.39 1.06 0.00 0.00 176.91 177.99 3k5e n GLU 116 N -3.95 0.23 0.00 1.72 1.02 0.83 -1.01 120.64 119.48 3k5e n GLU 116 Ca -0.05 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 3k5e n GLU 116 Cb 0.68 -1.12 0.00 0.00 -0.02 0.00 0.00 31.44 30.98 3k5e n GLU 116 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k5e n GLY 117 N 2.92 -1.80 3.27 0.62 0.00 0.57 -0.86 105.19 109.92 3k5e n GLY 117 Ca -0.17 -1.33 -0.15 0.00 0.00 0.00 0.00 46.02 44.37 3k5e n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k5e s GLU 118 N 0.00 1.47 -0.11 1.61 2.02 -0.64 -4.78 118.70 118.26 3k5e s GLU 118 Ca 0.00 -1.75 -0.13 0.00 0.02 0.00 0.00 54.97 53.10 3k5e s GLU 118 Cb 0.00 0.31 -0.05 0.00 0.10 0.00 0.00 34.13 34.50 3k5e s GLU 118 CO 0.00 -0.53 0.31 1.03 0.02 0.00 0.00 175.26 176.10 3k5e s ARG 119 N -3.82 4.07 0.33 1.61 1.81 -1.26 -3.69 118.95 118.00 3k5e s ARG 119 Ca 0.38 0.17 -0.29 0.00 -1.72 0.00 0.00 55.73 54.27 3k5e s ARG 119 Cb 0.04 -3.35 -0.12 0.00 -0.45 0.00 0.00 34.95 31.08 3k5e s ARG 119 CO 0.18 0.41 1.46 0.43 -0.68 0.00 0.00 175.30 177.11 3k5e n SER 120 N 2.95 3.46 -4.66 0.23 7.64 -1.26 -4.94 113.62 117.03 3k5e n SER 120 Ca -0.13 1.19 -0.36 0.00 1.01 0.00 0.00 58.87 60.58 3k5e n SER 120 Cb 0.52 -1.56 0.09 0.00 -1.01 0.00 0.00 64.21 62.25 3k5e n SER 120 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3k5e n PRO 121 N 1.14 0.68 -1.59 1.43 -0.04 -1.26 -3.96 135.00 131.40 3k5e n PRO 121 Ca 0.05 0.29 -0.11 0.00 -0.04 0.00 0.00 63.50 63.70 3k5e n PRO 121 Cb 0.37 -2.35 -0.03 0.00 -0.04 0.00 0.00 33.50 31.44 3k5e n PRO 121 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 3k5e n ASN 122 N -1.94 -4.04 -3.72 3.54 5.15 -1.26 -3.39 115.26 109.59 3k5e n ASN 122 Ca 0.14 0.18 -0.22 0.00 -0.60 0.00 0.00 54.58 54.08 3k5e n ASN 122 Cb 0.49 -2.73 0.03 0.00 -0.53 0.00 0.00 39.78 37.04 3k5e n ASN 122 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3k5e n GLU 123 N -2.48 -5.02 -0.01 1.20 1.02 -1.25 -4.90 120.64 109.19 3k5e n GLU 123 Ca -0.11 0.62 -0.18 0.00 -0.02 0.00 0.00 57.16 57.47 3k5e n GLU 123 Cb 0.43 -5.22 -0.08 0.00 -0.02 0.00 0.00 31.44 26.55 3k5e n GLU 123 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 3k5e h GLU 124 N -1.90 0.78 -6.32 3.49 4.81 -1.74 -3.46 114.58 110.24 3k5e h GLU 124 Ca -0.61 -0.68 -0.59 0.00 -0.13 0.00 0.00 59.36 57.36 3k5e h GLU 124 Cb 1.36 0.15 -0.22 0.00 0.63 0.00 0.00 28.75 30.68 3k5e h GLU 124 CO 0.58 1.28 -0.84 0.71 -0.73 0.00 0.00 179.01 180.01 3k5e s TYR 125 N -3.66 1.90 0.66 0.92 1.51 -1.26 -5.11 117.35 112.31 3k5e s TYR 125 Ca -0.10 -0.41 -0.16 0.00 -1.01 0.00 0.00 57.07 55.39 3k5e s TYR 125 Cb 0.08 -1.04 -0.00 0.00 -0.11 0.00 0.00 41.96 40.89 3k5e s TYR 125 CO 0.91 0.23 1.14 0.95 -1.11 0.00 0.00 175.55 177.67 3k5e s THR 126 N -1.14 3.02 0.31 -0.71 -4.23 -1.26 -4.85 115.64 106.78 3k5e s THR 126 Ca 0.08 0.50 0.02 0.00 -1.18 0.00 0.00 61.69 61.11 3k5e s THR 126 Cb -0.10 -3.04 0.28 0.00 1.34 0.00 0.00 72.50 70.98 3k5e s THR 126 CO 0.05 -0.26 1.91 4.11 -0.54 0.00 0.00 174.62 179.89 3k5e h TRP 127 N 0.13 1.00 0.00 3.99 5.08 -2.00 -1.32 115.95 122.83 3k5e h TRP 127 Ca -0.47 0.03 -0.06 0.00 1.08 0.00 0.00 58.89 59.46 3k5e h TRP 127 Cb 1.26 -0.33 -0.01 0.00 -3.00 0.00 0.00 29.16 27.08 3k5e h TRP 127 CO 0.52 0.52 -0.30 1.05 -1.28 0.00 0.00 178.44 178.95 3k5e h GLU 128 N 0.98 0.00 -0.15 0.12 4.11 -1.98 -2.93 114.58 114.73 3k5e h GLU 128 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.81 3k5e h GLU 128 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3k5e h GLU 128 CO -0.15 0.30 0.00 0.39 0.07 0.00 0.00 179.01 179.63 3k5e n GLU 129 N -3.78 2.38 -2.37 1.06 1.02 -0.59 -4.97 120.64 113.39 3k5e n GLU 129 Ca -0.01 -2.05 -0.43 0.00 -0.02 0.00 0.00 57.16 54.65 3k5e n GLU 129 Cb 0.39 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.31 3k5e n GLU 129 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3k5e s ASP 130 N -1.81 6.76 0.00 1.62 3.68 -0.64 -4.87 116.67 121.41 3k5e s ASP 130 Ca 0.32 1.52 0.16 0.00 2.13 0.00 0.00 52.55 56.68 3k5e s ASP 130 Cb 0.21 -2.54 0.78 0.00 -1.45 0.00 0.00 42.92 39.93 3k5e s ASP 130 CO 0.30 -0.95 1.49 -0.81 0.13 0.00 0.00 175.17 175.33 3k5e n PRO 131 N 7.02 0.16 0.00 4.34 -0.04 -1.26 -1.46 135.00 143.77 3k5e n PRO 131 Ca 0.15 0.16 0.13 0.00 -0.04 0.00 0.00 63.50 63.90 3k5e n PRO 131 Cb 0.45 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.81 3k5e n PRO 131 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3k5e n LEU 132 N -1.35 1.53 -4.76 1.53 4.77 -1.26 -4.33 117.00 113.13 3k5e n LEU 132 Ca 0.07 -0.49 -0.39 0.00 -0.03 0.00 0.00 56.01 55.16 3k5e n LEU 132 Cb 0.15 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.22 3k5e n LEU 132 CO 0.13 0.27 1.05 0.00 -1.33 0.00 0.00 177.39 177.51 3k5e s ALA 133 N -2.21 3.13 0.00 -1.18 0.00 -0.54 -1.62 121.76 119.34 3k5e s ALA 133 Ca 0.31 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.71 3k5e s ALA 133 Cb 0.20 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.73 3k5e s ALA 133 CO 0.41 -1.26 0.00 0.41 0.00 0.00 0.00 175.76 175.32 3k5e n GLY 134 N 0.62 2.26 0.16 0.00 0.00 -0.04 -4.75 105.19 103.44 3k5e n GLY 134 Ca 0.07 -2.01 -0.10 0.00 0.00 0.00 0.00 46.02 43.97 3k5e n GLY 134 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3k5e h ILE 135 N 0.00 1.21 0.31 -0.61 2.04 -0.78 -2.99 117.51 116.69 3k5e h ILE 135 Ca 0.00 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.16 3k5e h ILE 135 Cb 0.00 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 3k5e h ILE 135 CO 0.00 0.23 -0.15 0.40 0.00 0.00 0.00 178.15 178.62 3k5e h ILE 136 N 0.31 0.69 -0.50 -0.67 2.04 -1.35 -0.31 117.51 117.72 3k5e h ILE 136 Ca 0.09 -0.02 -0.12 0.00 1.00 0.00 0.00 64.86 65.81 3k5e h ILE 136 Cb 0.27 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 3k5e h ILE 136 CO -0.00 0.01 -0.17 1.55 0.00 0.00 0.00 178.15 179.54 3k5e h PRO 137 N -0.43 0.98 -0.78 2.37 0.13 -1.80 -2.47 132.00 129.98 3k5e h PRO 137 Ca -0.04 -0.39 0.01 0.00 -0.87 0.00 0.00 66.00 64.71 3k5e h PRO 137 Cb 0.33 -0.05 -0.04 0.00 0.13 0.00 0.00 31.00 31.37 3k5e h PRO 137 CO 0.07 1.06 0.52 0.00 -0.23 0.00 0.00 178.00 179.42 3k5e h ARG 138 N 0.86 1.03 0.30 0.86 3.08 -1.43 -1.81 114.38 117.26 3k5e h ARG 138 Ca 0.12 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 3k5e h ARG 138 Cb 0.73 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.55 3k5e h ARG 138 CO 0.06 0.68 -0.15 1.15 -1.07 0.00 0.00 179.97 180.64 3k5e h THR 139 N 1.06 0.73 -0.66 2.04 2.02 -0.93 -1.25 112.91 115.91 3k5e h THR 139 Ca 0.29 -0.37 0.11 0.00 0.77 0.00 0.00 66.41 67.21 3k5e h THR 139 Cb -0.12 0.93 -0.08 0.00 -1.74 0.00 0.00 68.15 67.14 3k5e h THR 139 CO -0.06 0.08 0.26 -0.07 0.37 0.00 0.00 175.52 176.09 3k5e h LEU 140 N -0.60 0.26 -1.19 2.58 3.38 -1.35 -0.76 115.31 117.64 3k5e h LEU 140 Ca -0.04 0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 3k5e h LEU 140 Cb 0.44 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3k5e h LEU 140 CO 0.07 0.14 -0.30 -0.74 0.09 0.00 0.00 178.44 177.70 3k5e h HIS 141 N 0.44 0.20 0.01 1.13 2.76 -1.20 -3.17 115.15 115.32 3k5e h HIS 141 Ca 0.34 -0.04 -0.24 0.00 -2.20 0.00 0.00 60.37 58.24 3k5e h HIS 141 Cb 0.45 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.32 3k5e h HIS 141 CO -0.16 0.47 -1.21 1.96 -1.30 0.00 0.00 177.93 177.68 3k5e h GLN 142 N 0.16 0.02 -0.69 5.26 1.08 -0.15 -3.22 115.11 117.57 3k5e h GLN 142 Ca 0.02 -0.03 0.11 0.00 -1.45 0.00 0.00 58.65 57.30 3k5e h GLN 142 Cb 0.61 0.01 -0.08 0.00 -0.05 0.00 0.00 27.48 27.97 3k5e h GLN 142 CO 0.04 0.88 0.30 0.82 -0.95 0.00 0.00 178.83 179.92 3k5e h ILE 143 N 0.00 0.77 -0.00 2.54 2.04 -1.15 0.25 117.51 121.96 3k5e h ILE 143 Ca -0.09 -0.17 -0.10 0.00 1.00 0.00 0.00 64.86 65.50 3k5e h ILE 143 Cb 1.85 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 3k5e h ILE 143 CO 0.12 0.09 -0.46 -0.26 0.00 0.00 0.00 178.15 177.64 3k5e h PHE 144 N 0.50 0.01 0.01 1.37 0.04 -1.63 -2.39 116.94 114.85 3k5e h PHE 144 Ca 0.36 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.12 3k5e h PHE 144 Cb 0.45 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.59 3k5e h PHE 144 CO -0.14 0.47 -0.00 1.49 -0.60 0.00 0.00 178.31 179.52 3k5e h GLU 145 N 0.01 -0.01 -0.87 1.51 4.57 -1.34 -2.97 114.58 115.48 3k5e h GLU 145 Ca -0.00 0.00 0.07 0.00 -1.18 0.00 0.00 59.36 58.25 3k5e h GLU 145 Cb 0.81 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.34 3k5e h GLU 145 CO 0.06 0.77 0.53 0.87 -1.18 0.00 0.00 179.01 180.06 3k5e h LYS 146 N -0.83 0.93 -0.62 1.92 1.57 -0.53 -2.98 116.57 116.02 3k5e h LYS 146 Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3k5e h LYS 146 Cb 0.78 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.88 3k5e h LYS 146 CO 0.00 0.61 0.00 1.28 -0.57 0.00 0.00 179.45 180.78 3k5e n LEU 147 N -4.63 5.16 -0.34 2.94 4.77 -0.90 -4.66 117.00 119.33 3k5e n LEU 147 Ca 0.13 -2.61 -0.03 0.00 -0.03 0.00 0.00 56.01 53.47 3k5e n LEU 147 Cb 0.20 -0.64 0.09 0.00 -2.33 0.00 0.00 43.42 40.74 3k5e n LEU 147 CO 0.30 0.66 1.24 0.00 -1.33 0.00 0.00 177.39 178.26 3k5e h THR 148 N 3.81 1.25 -0.09 -5.08 1.03 -1.36 -3.38 112.91 109.09 3k5e h THR 148 Ca 0.00 -0.51 -0.18 0.00 -0.01 0.00 0.00 66.41 65.71 3k5e h THR 148 Cb 1.73 -0.08 -0.21 0.00 -1.07 0.00 0.00 68.15 68.52 3k5e h THR 148 CO 0.38 0.25 -0.49 -0.90 -0.01 0.00 0.00 175.52 174.75 3k5e n ASP 149 N -4.40 -0.62 -1.91 0.00 5.68 -1.26 -5.09 116.55 108.95 3k5e n ASP 149 Ca 0.10 -2.13 0.00 0.00 -0.50 0.00 0.00 54.79 52.26 3k5e n ASP 149 Cb 0.04 0.32 0.00 0.00 -1.14 0.00 0.00 41.12 40.34 3k5e n ASP 149 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 3k5e n ASN 150 N -0.97 0.00 -0.23 -1.12 6.94 -1.26 -4.95 115.26 113.66 3k5e n ASN 150 Ca -0.13 -0.54 0.01 0.00 -0.02 0.00 0.00 54.58 53.90 3k5e n ASN 150 Cb 0.85 0.00 0.03 0.00 -2.36 0.00 0.00 39.78 38.30 3k5e n ASN 150 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3k5e n GLY 151 N 5.00 -0.20 3.34 4.83 0.00 -1.26 -4.82 105.19 112.08 3k5e n GLY 151 Ca 0.00 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 3k5e n GLY 151 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5e s THR 152 N -1.76 4.27 0.47 2.61 2.01 -1.26 -3.97 115.64 118.00 3k5e s THR 152 Ca 0.05 -0.91 -0.21 0.00 0.31 0.00 0.00 61.69 60.94 3k5e s THR 152 Cb 0.03 -3.36 -0.09 0.00 0.01 0.00 0.00 72.50 69.08 3k5e s THR 152 CO 0.03 -0.17 1.02 -1.61 -0.69 0.00 0.00 174.62 173.20 3k5e s GLU 153 N 1.50 3.90 0.15 4.92 2.02 -0.30 -4.90 118.70 125.99 3k5e s GLU 153 Ca 0.01 1.33 -0.24 0.00 0.02 0.00 0.00 54.97 56.09 3k5e s GLU 153 Cb -0.19 -2.14 0.07 0.00 0.10 0.00 0.00 34.13 31.97 3k5e s GLU 153 CO 0.05 -0.34 0.66 -0.59 0.02 0.00 0.00 175.26 175.06 3k5e s PHE 154 N -2.00 -0.47 0.06 1.61 -0.12 -1.26 -0.96 117.98 114.85 3k5e s PHE 154 Ca 0.66 0.24 0.00 0.00 -0.05 0.00 0.00 56.93 57.78 3k5e s PHE 154 Cb -0.15 0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 42.78 3k5e s PHE 154 CO 0.19 -0.85 -0.05 -1.54 -0.05 0.00 0.00 175.22 172.92 3k5e s SER 155 N -2.73 0.68 -0.08 1.98 1.04 -0.59 -4.97 113.70 109.02 3k5e s SER 155 Ca 0.03 -0.84 0.04 0.00 0.48 0.00 0.00 55.95 55.66 3k5e s SER 155 Cb -0.02 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.23 3k5e s SER 155 CO -0.10 -0.44 -0.20 -0.69 0.98 0.00 0.00 173.24 172.78 3k5e s VAL 156 N -2.97 1.75 0.05 5.02 1.01 -1.26 -1.73 120.40 122.27 3k5e s VAL 156 Ca 0.01 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 61.21 3k5e s VAL 156 Cb 0.01 -1.53 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 3k5e s VAL 156 CO -0.05 0.49 -0.17 -0.54 0.00 0.00 0.00 175.10 174.83 3k5e s LYS 157 N 0.38 1.11 0.06 2.72 1.02 -0.69 0.59 119.74 124.93 3k5e s LYS 157 Ca -0.16 -0.87 0.06 0.00 0.02 0.00 0.00 55.97 55.02 3k5e s LYS 157 Cb -0.17 -1.18 -0.03 0.00 -0.52 0.00 0.00 37.83 35.94 3k5e s LYS 157 CO 0.07 0.29 -0.16 0.14 -0.92 0.00 0.00 175.35 174.77 3k5e s VAL 158 N -0.87 1.26 0.07 3.17 -7.23 -0.40 -0.62 120.40 115.78 3k5e s VAL 158 Ca 0.04 -1.24 0.02 0.00 -1.81 0.00 0.00 61.98 58.98 3k5e s VAL 158 Cb -0.08 -1.17 -0.03 0.00 0.56 0.00 0.00 36.38 35.65 3k5e s VAL 158 CO 0.02 -0.09 -0.06 -0.94 -0.31 0.00 0.00 175.10 173.72 3k5e s SER 159 N -1.53 0.94 -0.26 4.85 1.04 -0.19 -1.27 113.70 117.29 3k5e s SER 159 Ca 0.01 -0.83 -0.04 0.00 0.48 0.00 0.00 55.95 55.58 3k5e s SER 159 Cb -0.09 0.09 0.09 0.00 0.10 0.00 0.00 66.02 66.20 3k5e s SER 159 CO 0.02 -0.38 0.11 -0.22 0.98 0.00 0.00 173.24 173.75 3k5e s LEU 160 N -2.46 0.74 -0.09 2.42 2.96 -1.26 -0.32 118.68 120.67 3k5e s LEU 160 Ca 0.03 -1.13 -0.01 0.00 -0.22 0.00 0.00 54.13 52.80 3k5e s LEU 160 Cb -0.00 -0.40 -0.03 0.00 0.50 0.00 0.00 46.19 46.25 3k5e s LEU 160 CO -0.03 -0.41 -0.05 -0.22 -1.32 0.00 0.00 176.35 174.32 3k5e s LEU 161 N 2.03 3.24 0.06 -0.68 0.20 -0.49 -1.88 118.68 121.16 3k5e s LEU 161 Ca 0.07 -0.02 0.04 0.00 0.69 0.00 0.00 54.13 54.91 3k5e s LEU 161 Cb -0.16 -1.73 -0.03 0.00 -0.43 0.00 0.00 46.19 43.85 3k5e s LEU 161 CO -0.27 0.32 -0.12 -1.61 -0.29 0.00 0.00 176.35 174.39 3k5e s GLU 162 N -0.57 0.73 -0.16 1.98 2.02 0.58 -0.21 118.70 123.07 3k5e s GLU 162 Ca 0.09 -0.84 0.01 0.00 0.02 0.00 0.00 54.97 54.24 3k5e s GLU 162 Cb -0.12 -0.67 0.03 0.00 0.10 0.00 0.00 34.13 33.47 3k5e s GLU 162 CO 0.02 0.15 -0.13 0.42 0.02 0.00 0.00 175.26 175.73 3k5e s ILE 163 N -1.20 1.62 -0.06 -1.63 1.01 0.46 -0.20 121.20 121.21 3k5e s ILE 163 Ca -0.04 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 59.88 3k5e s ILE 163 Cb -0.09 -1.56 0.02 0.00 0.01 0.00 0.00 42.46 40.83 3k5e s ILE 163 CO 0.01 0.39 -0.08 -0.47 0.00 0.00 0.00 174.94 174.80 3k5e s TYR 164 N 1.45 1.07 -1.56 3.97 6.14 -0.62 -0.93 117.35 126.88 3k5e s TYR 164 Ca 0.03 -0.37 -0.13 0.00 0.64 0.00 0.00 57.07 57.25 3k5e s TYR 164 Cb -0.14 -0.86 0.09 0.00 0.42 0.00 0.00 41.96 41.47 3k5e s TYR 164 CO -0.10 -0.25 0.86 -1.71 0.64 0.00 0.00 175.55 174.99 3k5e n ASN 165 N 4.04 -3.69 -1.37 4.32 5.15 -1.26 -0.47 115.26 121.97 3k5e n ASN 165 Ca -0.23 -0.87 -0.17 0.00 -0.60 0.00 0.00 54.58 52.71 3k5e n ASN 165 Cb 0.51 -3.50 -0.07 0.00 -0.53 0.00 0.00 39.78 36.19 3k5e n ASN 165 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3k5e n GLU 166 N -4.54 -1.52 -4.11 1.20 -0.58 -1.26 -4.99 120.64 104.85 3k5e n GLU 166 Ca -0.01 1.09 -0.30 0.00 -0.42 0.00 0.00 57.16 57.53 3k5e n GLU 166 Cb 0.54 -5.47 -0.08 0.00 -0.57 0.00 0.00 31.44 25.86 3k5e n GLU 166 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 3k5e s GLU 167 N -3.47 2.63 -0.13 3.49 2.02 0.38 -4.94 118.70 118.69 3k5e s GLU 167 Ca 0.00 -0.80 -0.06 0.00 0.02 0.00 0.00 54.97 54.12 3k5e s GLU 167 Cb 0.00 -2.59 -0.04 0.00 0.10 0.00 0.00 34.13 31.60 3k5e s GLU 167 CO 0.00 0.54 0.08 -0.51 0.02 0.00 0.00 175.26 175.40 3k5e s LEU 168 N -2.35 4.03 0.01 1.80 1.02 -1.26 -1.58 118.68 120.35 3k5e s LEU 168 Ca 0.27 0.27 0.01 0.00 0.02 0.00 0.00 54.13 54.70 3k5e s LEU 168 Cb -0.12 -1.98 -0.01 0.00 0.02 0.00 0.00 46.19 44.10 3k5e s LEU 168 CO 0.19 0.32 -0.05 -0.36 0.02 0.00 0.00 176.35 176.48 3k5e s PHE 169 N -0.51 0.40 -0.41 0.29 0.40 0.73 -0.85 117.98 118.02 3k5e s PHE 169 Ca 0.11 -0.17 -0.09 0.00 -0.60 0.00 0.00 56.93 56.17 3k5e s PHE 169 Cb -0.12 -0.25 0.07 0.00 0.51 0.00 0.00 43.02 43.23 3k5e s PHE 169 CO 0.02 -0.03 0.24 0.34 0.70 0.00 0.00 175.22 176.49 3k5e s ASP 170 N -0.45 5.62 0.00 1.36 -1.08 -1.26 -0.30 116.67 120.56 3k5e s ASP 170 Ca -0.02 -1.41 0.18 0.00 -0.52 0.00 0.00 52.55 50.78 3k5e s ASP 170 Cb -0.04 -1.98 0.72 0.00 -1.46 0.00 0.00 42.92 40.16 3k5e s ASP 170 CO -0.00 -0.50 1.51 0.18 0.52 0.00 0.00 175.17 176.88 3k5e n LEU 171 N 4.92 1.28 -0.00 -1.34 7.99 -0.79 -3.98 117.00 125.08 3k5e n LEU 171 Ca -0.10 -0.56 0.03 0.00 -0.01 0.00 0.00 56.01 55.37 3k5e n LEU 171 Cb 0.43 -0.10 -0.05 0.00 -0.11 0.00 0.00 43.42 43.59 3k5e n LEU 171 CO 0.38 0.28 -0.59 0.18 -1.51 0.00 0.00 177.39 176.13 3k5e n LEU 172 N 0.09 0.00 -4.59 2.23 4.77 -1.26 -4.04 117.00 114.20 3k5e n LEU 172 Ca 0.14 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.70 3k5e n LEU 172 Cb 0.25 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.32 3k5e n LEU 172 CO 0.11 0.00 1.57 0.21 -1.33 0.00 0.00 177.39 177.96 3k5e s ASN 173 N -2.84 5.74 0.00 -1.43 3.04 -1.26 -4.90 114.94 113.30 3k5e s ASN 173 Ca -0.03 1.19 0.09 0.00 0.04 0.00 0.00 52.86 54.15 3k5e s ASN 173 Cb 0.04 -2.52 0.30 0.00 -1.54 0.00 0.00 41.25 37.53 3k5e s ASN 173 CO 0.29 -1.85 1.23 -0.81 -3.04 0.00 0.00 177.10 172.93 3k5e n PRO 174 N 8.56 1.51 0.00 0.43 -0.05 -1.26 -3.86 135.00 140.33 3k5e n PRO 174 Ca 0.23 -0.78 0.03 0.00 -0.05 0.00 0.00 63.50 62.93 3k5e n PRO 174 Cb 0.48 -1.20 -0.00 0.00 -0.05 0.00 0.00 33.50 32.72 3k5e n PRO 174 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 175.50 175.88 3k5e n SER 175 N 0.11 0.86 -4.08 3.54 7.64 -1.26 -4.98 113.62 115.45 3k5e n SER 175 Ca 0.09 -0.93 -0.13 0.00 1.01 0.00 0.00 58.87 58.91 3k5e n SER 175 Cb 0.19 0.52 -0.11 0.00 -1.01 0.00 0.00 64.21 63.80 3k5e n SER 175 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3k5e s SER 176 N -1.03 0.91 0.86 6.43 1.04 -1.25 -5.17 113.70 115.49 3k5e s SER 176 Ca 0.05 -0.60 -0.08 0.00 0.48 0.00 0.00 55.95 55.79 3k5e s SER 176 Cb 0.05 0.04 0.16 0.00 0.10 0.00 0.00 66.02 66.36 3k5e s SER 176 CO 0.15 -0.23 0.98 -0.90 0.98 0.00 0.00 173.24 174.22 3k5e n ASP 177 N 1.28 0.55 -0.93 7.02 5.68 -1.26 -4.91 116.55 123.98 3k5e n ASP 177 Ca -0.22 -1.64 0.08 0.00 -0.50 0.00 0.00 54.79 52.51 3k5e n ASP 177 Cb 0.55 -0.71 0.22 0.00 -1.14 0.00 0.00 41.12 40.05 3k5e n ASP 177 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 3k5e n VAL 178 N -3.11 0.68 0.08 2.12 0.24 -1.26 -3.04 118.33 114.04 3k5e n VAL 178 Ca 0.14 -0.68 -0.06 0.00 -2.04 0.00 0.00 64.34 61.70 3k5e n VAL 178 Cb 0.48 0.34 -0.03 0.00 -1.47 0.00 0.00 33.84 33.16 3k5e n VAL 178 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3k5e h SER 179 N 2.96 0.03 -3.05 -1.34 0.02 -1.99 -3.45 113.55 106.72 3k5e h SER 179 Ca 0.00 -0.02 -0.57 0.00 -0.84 0.00 0.00 61.79 60.36 3k5e h SER 179 Cb 0.68 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.16 3k5e h SER 179 CO 0.00 0.90 0.98 -1.61 -1.14 0.00 0.00 176.83 175.96 3k5e s GLU 180 N -3.00 3.96 0.27 3.45 2.02 -1.17 -5.02 118.70 119.20 3k5e s GLU 180 Ca -0.00 1.37 -0.04 0.00 0.02 0.00 0.00 54.97 56.32 3k5e s GLU 180 Cb 0.11 -3.88 -0.05 0.00 0.10 0.00 0.00 34.13 30.41 3k5e s GLU 180 CO 0.81 -1.07 0.52 -0.98 0.02 0.00 0.00 175.26 174.56 3k5e s ARG 181 N 4.12 3.62 0.38 1.61 1.70 -1.26 -4.70 118.95 124.42 3k5e s ARG 181 Ca 0.58 -0.04 0.06 0.00 -0.47 0.00 0.00 55.73 55.86 3k5e s ARG 181 Cb -0.19 -2.68 -0.00 0.00 -0.57 0.00 0.00 34.95 31.51 3k5e s ARG 181 CO 0.22 0.26 0.53 -0.51 -1.08 0.00 0.00 175.30 174.72 3k5e s LEU 182 N -3.45 3.83 -0.08 -1.89 1.43 -0.03 -4.97 118.68 113.52 3k5e s LEU 182 Ca 0.43 -0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.40 3k5e s LEU 182 Cb -0.11 -2.80 -0.03 0.00 0.03 0.00 0.00 46.19 43.28 3k5e s LEU 182 CO 0.29 -0.57 -0.11 -1.10 0.23 0.00 0.00 176.35 175.09 3k5e s GLN 183 N -4.29 2.81 -0.05 1.70 -0.21 -1.25 -4.44 119.66 113.92 3k5e s GLN 183 Ca 0.48 -0.64 0.02 0.00 0.02 0.00 0.00 55.36 55.24 3k5e s GLN 183 Cb -0.10 -2.52 -0.03 0.00 1.00 0.00 0.00 33.01 31.36 3k5e s GLN 183 CO 0.33 0.54 -0.09 1.41 -2.12 0.00 0.00 175.29 175.35 3k5e s MET 184 N -0.49 2.65 0.02 2.91 1.75 -1.26 -1.15 119.30 123.73 3k5e s MET 184 Ca 0.07 -0.61 -0.00 0.00 -1.25 0.00 0.00 55.69 53.89 3k5e s MET 184 Cb -0.12 -2.51 -0.02 0.00 2.84 0.00 0.00 34.83 35.02 3k5e s MET 184 CO 0.02 0.65 -0.02 -0.06 -0.65 0.00 0.00 175.02 174.95 3k5e s PHE 185 N -0.80 0.27 0.29 4.11 0.40 -0.52 -4.99 117.98 116.74 3k5e s PHE 185 Ca 0.13 -0.55 -0.29 0.00 -0.60 0.00 0.00 56.93 55.62 3k5e s PHE 185 Cb -0.11 -0.20 -0.10 0.00 0.51 0.00 0.00 43.02 43.12 3k5e s PHE 185 CO 0.02 -0.20 1.37 -0.51 0.70 0.00 0.00 175.22 176.59 3k5e s ASP 186 N -1.54 6.71 -0.37 1.36 -0.00 -1.26 0.03 116.67 121.60 3k5e s ASP 186 Ca -0.15 2.68 -0.17 0.00 -0.00 0.00 0.00 52.55 54.92 3k5e s ASP 186 Cb -0.09 -2.64 0.00 0.00 -0.00 0.00 0.00 42.92 40.19 3k5e s ASP 186 CO -0.01 -0.62 0.43 -0.62 -0.00 0.00 0.00 175.17 174.35 3k5e s ASP 187 N -0.08 6.22 0.18 0.27 3.68 -0.64 -4.67 116.67 121.64 3k5e s ASP 187 Ca 0.54 -0.31 -0.13 0.00 2.13 0.00 0.00 52.55 54.78 3k5e s ASP 187 Cb -0.41 -2.23 0.08 0.00 -1.45 0.00 0.00 42.92 38.92 3k5e s ASP 187 CO 0.49 -0.46 1.80 -0.65 0.13 0.00 0.00 175.17 176.48 3k5e h PRO 188 N 8.55 0.82 0.00 4.34 0.11 -1.94 -3.34 132.00 140.54 3k5e h PRO 188 Ca -0.28 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3k5e h PRO 188 Cb 1.13 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.07 3k5e h PRO 188 CO 0.75 0.61 0.00 0.54 -0.21 0.00 0.00 178.00 179.69 3k5e n ARG 189 N -4.60 0.00 -3.25 1.05 1.74 -1.26 -4.39 116.66 105.95 3k5e n ARG 189 Ca 0.04 0.27 -0.40 0.00 -0.77 0.00 0.00 57.85 56.99 3k5e n ARG 189 Cb 0.07 -1.08 -0.08 0.00 -1.02 0.00 0.00 32.46 30.35 3k5e n ARG 189 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3k5e s ASN 190 N -2.37 6.41 0.80 0.55 4.22 -1.25 -5.07 114.94 118.23 3k5e s ASN 190 Ca 0.00 0.48 -0.13 0.00 -2.14 0.00 0.00 52.86 51.07 3k5e s ASN 190 Cb 0.00 -2.27 0.08 0.00 1.28 0.00 0.00 41.25 40.34 3k5e s ASN 190 CO 0.00 -0.28 1.20 -1.59 -2.04 0.00 0.00 177.10 174.39 3k5e s LYS 191 N 2.28 1.67 -1.49 3.55 -2.85 -1.26 -2.69 119.74 118.96 3k5e s LYS 191 Ca 0.20 1.73 0.00 0.00 -1.00 0.00 0.00 55.97 56.90 3k5e s LYS 191 Cb -0.16 -1.78 0.00 0.00 -2.06 0.00 0.00 37.83 33.83 3k5e s LYS 191 CO 0.09 -2.18 0.00 2.89 0.10 0.00 0.00 175.35 176.25 3k5e n ARG 192 N -3.29 -1.57 -4.21 1.78 1.85 -1.26 -4.99 116.66 104.97 3k5e n ARG 192 Ca 0.13 0.83 -0.23 0.00 -1.00 0.00 0.00 57.85 57.58 3k5e n ARG 192 Cb 0.51 -5.22 -0.07 0.00 -1.05 0.00 0.00 32.46 26.63 3k5e n ARG 192 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 3k5e s GLY 193 N -2.19 1.77 0.19 2.89 0.00 -1.10 -4.64 107.32 104.24 3k5e s GLY 193 Ca 0.00 -1.72 0.05 0.00 0.00 0.00 0.00 44.72 43.06 3k5e s GLY 193 CO 0.00 -1.72 -0.09 -1.34 0.00 0.00 0.00 173.10 169.95 3k5e s VAL 194 N -2.36 1.34 -0.17 1.40 -7.23 -1.26 -1.62 120.40 110.50 3k5e s VAL 194 Ca 0.34 -2.10 0.01 0.00 -1.81 0.00 0.00 61.98 58.41 3k5e s VAL 194 Cb -0.05 -2.05 0.01 0.00 0.56 0.00 0.00 36.38 34.85 3k5e s VAL 194 CO 0.21 -0.58 -0.18 -0.63 -0.31 0.00 0.00 175.10 173.62 3k5e s ILE 195 N -3.22 2.32 -0.48 -0.62 1.01 0.10 -4.74 121.20 115.58 3k5e s ILE 195 Ca 0.22 -0.86 -0.18 0.00 0.00 0.00 0.00 60.65 59.83 3k5e s ILE 195 Cb 0.02 -1.98 0.05 0.00 0.01 0.00 0.00 42.46 40.57 3k5e s ILE 195 CO 0.05 0.52 0.51 -0.63 0.00 0.00 0.00 174.94 175.39 3k5e s ILE 196 N 1.16 5.04 0.13 2.92 1.09 -1.26 -1.44 121.20 128.84 3k5e s ILE 196 Ca 0.01 -0.64 -0.31 0.00 -1.10 0.00 0.00 60.65 58.62 3k5e s ILE 196 Cb -0.14 -4.19 -0.10 0.00 -1.06 0.00 0.00 42.46 36.98 3k5e s ILE 196 CO -0.08 -0.65 1.66 -0.75 -0.10 0.00 0.00 174.94 175.03 3k5e s LYS 197 N 2.21 4.18 0.00 2.79 2.20 -0.30 -2.83 119.74 127.99 3k5e s LYS 197 Ca 0.11 2.42 0.00 0.00 -0.36 0.00 0.00 55.97 58.14 3k5e s LYS 197 Cb -0.20 -3.37 0.00 0.00 -1.51 0.00 0.00 37.83 32.75 3k5e s LYS 197 CO 0.11 -0.71 0.00 0.41 -0.36 0.00 0.00 175.35 174.80 3k5e n GLY 198 N 3.95 1.20 3.70 5.54 0.00 -1.26 -3.95 105.19 114.38 3k5e n GLY 198 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3k5e n GLY 198 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3k5e s LEU 199 N 0.00 4.35 -0.07 0.99 2.96 -1.13 -4.99 118.68 120.79 3k5e s LEU 199 Ca 0.00 2.19 -0.12 0.00 -0.22 0.00 0.00 54.13 55.97 3k5e s LEU 199 Cb 0.00 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.07 3k5e s LEU 199 CO 0.00 -0.65 0.31 -1.61 -1.32 0.00 0.00 176.35 173.07 3k5e s GLU 200 N 1.66 3.87 -0.24 1.98 0.41 -1.26 -5.07 118.70 120.05 3k5e s GLU 200 Ca 0.63 0.19 -0.05 0.00 -0.41 0.00 0.00 54.97 55.33 3k5e s GLU 200 Cb -0.33 -3.26 -0.01 0.00 -1.78 0.00 0.00 34.13 28.74 3k5e s GLU 200 CO 0.28 0.60 0.01 -1.21 -0.49 0.00 0.00 175.26 174.45 3k5e s GLU 201 N -0.68 3.40 -0.19 1.61 2.02 -1.26 -4.50 118.70 119.10 3k5e s GLU 201 Ca 0.20 -0.63 -0.16 0.00 0.02 0.00 0.00 54.97 54.40 3k5e s GLU 201 Cb -0.14 -3.15 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 3k5e s GLU 201 CO 0.08 -0.24 0.38 0.42 0.02 0.00 0.00 175.26 175.92 3k5e s ILE 202 N 1.52 5.22 -0.04 -1.63 1.09 -0.39 -4.86 121.20 122.11 3k5e s ILE 202 Ca 0.05 0.68 -0.30 0.00 -1.10 0.00 0.00 60.65 59.99 3k5e s ILE 202 Cb -0.15 -3.71 -0.04 0.00 -1.06 0.00 0.00 42.46 37.50 3k5e s ILE 202 CO -0.00 0.29 1.26 -0.89 -0.10 0.00 0.00 174.94 175.49 3k5e s THR 203 N 1.08 4.10 -0.52 2.92 2.01 -1.26 -1.27 115.64 122.70 3k5e s THR 203 Ca 0.19 1.44 -0.16 0.00 0.31 0.00 0.00 61.69 63.47 3k5e s THR 203 Cb -0.14 -3.93 0.11 0.00 0.01 0.00 0.00 72.50 68.55 3k5e s THR 203 CO 0.07 -0.00 0.47 -0.69 -0.69 0.00 0.00 174.62 173.78 3k5e s VAL 204 N 2.28 5.19 0.14 3.82 1.01 0.20 -4.94 120.40 128.10 3k5e s VAL 204 Ca 0.58 -1.28 0.10 0.00 0.00 0.00 0.00 61.98 61.38 3k5e s VAL 204 Cb -0.27 -4.26 -0.10 0.00 0.00 0.00 0.00 36.38 31.75 3k5e s VAL 204 CO 0.23 -0.77 1.44 0.45 0.00 0.00 0.00 175.10 176.45 3k5e h HIS 205 N 8.85 0.00 -2.74 5.22 3.86 -1.94 -3.36 115.15 125.04 3k5e h HIS 205 Ca -0.29 0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.02 3k5e h HIS 205 Cb 1.10 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.52 3k5e h HIS 205 CO 0.70 0.78 0.35 0.54 0.86 0.00 0.00 177.93 181.15 3k5e s ASN 206 N -6.70 -0.18 0.43 2.45 2.20 -1.26 -5.01 114.94 106.87 3k5e s ASN 206 Ca 0.01 -0.61 0.15 0.00 -0.94 0.00 0.00 52.86 51.46 3k5e s ASN 206 Cb 0.11 0.65 1.04 0.00 -2.00 0.00 0.00 41.25 41.04 3k5e s ASN 206 CO 0.78 -1.22 1.94 0.50 -2.94 0.00 0.00 177.10 176.17 3k5e h LYS 207 N 2.00 0.41 0.00 3.55 3.64 -1.93 -2.04 116.57 122.20 3k5e h LYS 207 Ca -0.23 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 3k5e h LYS 207 Cb 1.24 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 3k5e h LYS 207 CO 0.27 0.27 0.00 -0.25 -2.27 0.00 0.00 179.45 177.47 3k5e n ASP 208 N -4.47 0.00 -0.01 4.20 10.43 -1.26 -2.59 116.55 122.84 3k5e n ASP 208 Ca 0.13 -0.82 0.08 0.00 2.57 0.00 0.00 54.79 56.75 3k5e n ASP 208 Cb 0.48 0.00 -0.12 0.00 1.84 0.00 0.00 41.12 43.31 3k5e n ASP 208 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 3k5e n GLU 209 N -0.94 0.72 0.17 -1.24 2.13 -0.77 -4.71 120.64 116.00 3k5e n GLU 209 Ca 0.16 -0.12 -0.14 0.00 0.66 0.00 0.00 57.16 57.71 3k5e n GLU 209 Cb 0.07 -1.37 -0.07 0.00 0.27 0.00 0.00 31.44 30.35 3k5e n GLU 209 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3k5e h VAL 210 N 0.00 0.40 -0.24 6.31 2.07 -1.59 -3.20 116.25 119.99 3k5e h VAL 210 Ca 0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3k5e h VAL 210 Cb 0.69 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3k5e h VAL 210 CO 0.00 0.00 0.14 0.22 0.02 0.00 0.00 177.57 177.95 3k5e h TYR 211 N -0.57 0.33 -0.12 1.57 3.20 -1.84 -1.96 116.97 117.56 3k5e h TYR 211 Ca -0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 3k5e h TYR 211 Cb 0.54 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 3k5e h TYR 211 CO -0.20 0.26 0.02 -0.56 -1.64 0.00 0.00 178.16 176.04 3k5e h GLN 212 N 0.30 0.17 -0.52 1.82 3.07 -1.89 0.66 115.11 118.72 3k5e h GLN 212 Ca 0.09 -0.02 -0.10 0.00 0.09 0.00 0.00 58.65 58.71 3k5e h GLN 212 Cb 0.03 -0.03 -0.02 0.00 0.08 0.00 0.00 27.48 27.54 3k5e h GLN 212 CO -0.02 0.18 -0.07 0.82 0.09 0.00 0.00 178.83 179.83 3k5e h ILE 213 N 0.17 1.27 -0.69 1.86 2.04 -1.37 -1.67 117.51 119.13 3k5e h ILE 213 Ca 0.04 -1.21 -0.08 0.00 1.00 0.00 0.00 64.86 64.62 3k5e h ILE 213 Cb 0.10 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 3k5e h ILE 213 CO -0.00 0.42 0.13 -0.07 0.00 0.00 0.00 178.15 178.63 3k5e h LEU 214 N 0.83 1.07 -0.78 1.44 3.38 -0.70 -2.60 115.31 117.94 3k5e h LEU 214 Ca 0.14 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3k5e h LEU 214 Cb 0.63 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 3k5e h LEU 214 CO 0.04 1.05 0.37 -0.33 0.09 0.00 0.00 178.44 179.66 3k5e h GLU 215 N 1.06 1.13 -0.91 1.13 5.08 -0.75 -1.80 114.58 119.52 3k5e h GLU 215 Ca 0.21 -0.17 0.05 0.00 -1.00 0.00 0.00 59.36 58.45 3k5e h GLU 215 Cb 0.42 -0.20 -0.06 0.00 0.50 0.00 0.00 28.75 29.41 3k5e h GLU 215 CO 0.01 0.89 0.58 -0.22 -1.00 0.00 0.00 179.01 179.26 3k5e h LYS 216 N 1.11 1.05 0.15 2.33 1.63 -1.17 -0.46 116.57 121.21 3k5e h LYS 216 Ca 0.27 -0.06 -0.01 0.00 -0.85 0.00 0.00 60.65 60.00 3k5e h LYS 216 Cb 0.13 -0.24 0.00 0.00 -0.60 0.00 0.00 32.23 31.53 3k5e h LYS 216 CO -0.03 0.69 -0.07 0.78 -3.45 0.00 0.00 179.45 177.37 3k5e h GLY 217 N 1.08 -0.21 0.92 5.01 0.00 -1.06 -2.04 103.07 106.77 3k5e h GLY 217 Ca 0.38 0.08 0.02 0.00 0.00 0.00 0.00 47.33 47.80 3k5e h GLY 217 CO -0.15 -0.08 0.24 0.00 0.00 0.00 0.00 176.54 176.55 3k5e h ALA 218 N 0.63 0.51 -0.39 3.60 0.00 -0.92 -0.92 119.26 121.76 3k5e h ALA 218 Ca -0.02 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.94 3k5e h ALA 218 Cb 0.17 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3k5e h ALA 218 CO 0.03 -0.09 0.06 0.00 0.00 0.00 0.00 179.25 179.26 3k5e h ALA 219 N 1.17 0.41 0.00 0.00 0.00 -1.05 -1.22 119.26 118.57 3k5e h ALA 219 Ca 0.16 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 3k5e h ALA 219 Cb -0.00 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3k5e h ALA 219 CO -0.07 -0.34 -0.39 0.87 0.00 0.00 0.00 179.25 179.33 3k5e h LYS 220 N 0.19 0.00 -0.30 0.00 1.57 -1.03 -2.40 116.57 114.60 3k5e h LYS 220 Ca 0.19 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.86 3k5e h LYS 220 Cb 0.24 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3k5e h LYS 220 CO -0.26 0.39 -0.27 0.00 -0.57 0.00 0.00 179.45 178.74 3k5e h ARG 221 N 0.00 0.61 -0.69 3.15 3.08 -0.29 -1.50 114.38 118.72 3k5e h ARG 221 Ca -0.00 -0.25 -0.06 0.00 0.07 0.00 0.00 59.98 59.73 3k5e h ARG 221 Cb 0.77 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.76 3k5e h ARG 221 CO 0.05 0.81 0.18 1.15 -1.07 0.00 0.00 179.97 181.10 3k5e h THR 222 N 0.53 1.26 -0.33 2.04 2.02 -0.76 -1.10 112.91 116.57 3k5e h THR 222 Ca 0.07 -0.94 -0.01 0.00 0.77 0.00 0.00 66.41 66.31 3k5e h THR 222 Cb 0.73 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 3k5e h THR 222 CO 0.06 0.36 0.18 0.71 0.37 0.00 0.00 175.52 177.20 3k5e h THR 223 N 1.03 1.13 -0.57 3.16 1.35 -1.21 -2.76 112.91 115.04 3k5e h THR 223 Ca 0.22 -0.34 0.09 0.00 -0.55 0.00 0.00 66.41 65.82 3k5e h THR 223 Cb 0.35 0.76 -0.07 0.00 -1.73 0.00 0.00 68.15 67.46 3k5e h THR 223 CO -0.00 0.13 0.20 0.00 -0.25 0.00 0.00 175.52 175.61 3k5e h ALA 224 N 1.05 0.72 -0.87 6.62 0.00 -0.92 -2.44 119.26 123.41 3k5e h ALA 224 Ca 0.12 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.12 3k5e h ALA 224 Cb 0.05 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3k5e h ALA 224 CO -0.02 -0.21 0.58 0.00 0.00 0.00 0.00 179.25 179.60 3k5e h ALA 225 N 1.39 1.39 -0.13 0.00 0.00 -1.13 0.21 119.26 121.00 3k5e h ALA 225 Ca 0.28 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 3k5e h ALA 225 Cb 0.34 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3k5e h ALA 225 CO -0.29 0.56 -0.51 1.79 0.00 0.00 0.00 179.25 180.80 3k5e h THR 226 N 1.17 1.34 0.00 0.00 1.35 -1.16 -3.25 112.91 112.36 3k5e h THR 226 Ca 0.33 -1.75 -0.12 0.00 -0.55 0.00 0.00 66.41 64.31 3k5e h THR 226 Cb -0.11 1.80 -0.02 0.00 -1.73 0.00 0.00 68.15 68.10 3k5e h THR 226 CO -0.08 0.53 -1.02 0.25 -0.25 0.00 0.00 175.52 174.96 3k5e h LEU 227 N 0.27 0.00 -8.04 3.87 5.85 -1.14 -3.46 115.31 112.66 3k5e h LEU 227 Ca 0.01 0.00 -0.59 0.00 0.84 0.00 0.00 57.88 58.14 3k5e h LEU 227 Cb 0.99 0.00 -0.34 0.00 0.37 0.00 0.00 40.66 41.68 3k5e h LEU 227 CO 0.08 0.45 -0.84 -0.04 -0.34 0.00 0.00 178.44 177.76 3k5e s MET 228 N -3.01 2.24 0.15 1.25 -1.94 0.70 -5.10 119.30 113.59 3k5e s MET 228 Ca -0.00 -0.58 -0.34 0.00 -1.71 0.00 0.00 55.69 53.07 3k5e s MET 228 Cb 0.08 -1.86 -0.13 0.00 2.01 0.00 0.00 34.83 34.93 3k5e s MET 228 CO 0.78 -0.02 1.62 0.09 -0.01 0.00 0.00 175.02 177.48 3k5e n ASN 229 N 4.05 3.23 -4.35 3.03 5.03 -1.26 -2.87 115.26 122.12 3k5e n ASN 229 Ca -0.20 1.07 -0.36 0.00 0.87 0.00 0.00 54.58 55.96 3k5e n ASN 229 Cb 0.52 -1.44 -0.07 0.00 -1.02 0.00 0.00 39.78 37.76 3k5e n ASN 229 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3k5e n ALA 230 N 3.73 -1.56 -0.36 5.41 0.00 -1.26 -4.84 120.51 121.63 3k5e n ALA 230 Ca 0.17 -0.24 0.08 0.00 0.00 0.00 0.00 53.44 53.45 3k5e n ALA 230 Cb 0.30 -2.05 0.26 0.00 0.00 0.00 0.00 19.45 17.96 3k5e n ALA 230 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 3k5e h TYR 231 N -1.38 1.12 0.00 0.00 5.03 -1.81 -0.28 116.97 119.65 3k5e h TYR 231 Ca -0.62 0.03 -0.07 0.00 2.58 0.00 0.00 58.73 60.65 3k5e h TYR 231 Cb 1.39 -0.35 -0.01 0.00 1.55 0.00 0.00 36.73 39.31 3k5e h TYR 231 CO 0.61 0.41 -0.35 0.66 -1.32 0.00 0.00 178.16 178.17 3k5e h SER 232 N 0.94 0.00 0.44 -2.11 4.64 -1.89 -1.99 113.55 113.58 3k5e h SER 232 Ca 0.51 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.60 3k5e h SER 232 Cb 0.57 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.62 3k5e h SER 232 CO -0.28 0.35 -1.75 -1.20 -0.87 0.00 0.00 176.83 173.08 3k5e n SER 233 N -3.24 0.61 -0.01 4.97 7.64 -1.00 -4.57 113.62 118.02 3k5e n SER 233 Ca 0.02 0.28 0.10 0.00 1.01 0.00 0.00 58.87 60.28 3k5e n SER 233 Cb 0.63 0.42 -0.15 0.00 -1.01 0.00 0.00 64.21 64.10 3k5e n SER 233 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3k5e n ARG 234 N -2.85 0.51 -2.90 1.43 1.74 -0.15 -1.78 116.66 112.65 3k5e n ARG 234 Ca -0.16 -0.14 -0.30 0.00 -0.77 0.00 0.00 57.85 56.48 3k5e n ARG 234 Cb 0.94 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.85 3k5e n ARG 234 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3k5e s SER 235 N -4.02 6.54 -0.08 0.55 1.04 -0.76 -4.70 113.70 112.27 3k5e s SER 235 Ca -0.03 1.13 -0.01 0.00 0.48 0.00 0.00 55.95 57.52 3k5e s SER 235 Cb 0.14 -2.32 -0.03 0.00 0.10 0.00 0.00 66.02 63.91 3k5e s SER 235 CO 0.88 -0.37 -0.02 -1.00 0.98 0.00 0.00 173.24 173.70 3k5e s HIS 236 N -2.33 3.08 -0.06 5.02 3.76 -0.11 -2.38 115.29 122.28 3k5e s HIS 236 Ca 0.51 0.13 0.04 0.00 -0.15 0.00 0.00 55.06 55.60 3k5e s HIS 236 Cb -0.10 -1.76 -0.00 0.00 1.11 0.00 0.00 32.58 31.82 3k5e s HIS 236 CO 0.30 0.42 -0.19 -1.54 -0.85 0.00 0.00 174.74 172.88 3k5e s SER 237 N -0.86 2.46 -0.33 1.40 1.04 -0.75 -0.40 113.70 116.27 3k5e s SER 237 Ca 0.13 -0.42 0.03 0.00 0.48 0.00 0.00 55.95 56.18 3k5e s SER 237 Cb -0.11 -0.87 0.09 0.00 0.10 0.00 0.00 66.02 65.23 3k5e s SER 237 CO 0.02 0.15 0.02 -0.69 0.98 0.00 0.00 173.24 173.72 3k5e s VAL 238 N 0.19 2.31 -0.53 5.02 1.01 0.71 -1.31 120.40 127.80 3k5e s VAL 238 Ca -0.09 -2.18 -0.22 0.00 0.00 0.00 0.00 61.98 59.48 3k5e s VAL 238 Cb -0.14 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.65 3k5e s VAL 238 CO 0.04 -0.48 0.80 0.12 0.00 0.00 0.00 175.10 175.58 3k5e s PHE 239 N 0.95 2.90 -0.14 5.22 2.19 -0.02 -1.39 117.98 127.69 3k5e s PHE 239 Ca 0.07 -0.25 -0.07 0.00 0.33 0.00 0.00 56.93 57.01 3k5e s PHE 239 Cb -0.19 -3.84 -0.04 0.00 -1.31 0.00 0.00 43.02 37.63 3k5e s PHE 239 CO -0.07 -1.22 0.11 -1.12 1.83 0.00 0.00 175.22 174.76 3k5e s SER 240 N 2.79 6.13 -0.08 6.13 0.01 0.56 -0.89 113.70 128.34 3k5e s SER 240 Ca 0.24 0.33 0.03 0.00 1.31 0.00 0.00 55.95 57.86 3k5e s SER 240 Cb -0.15 -1.99 0.01 0.00 0.21 0.00 0.00 66.02 64.09 3k5e s SER 240 CO 0.16 0.33 -0.19 0.54 0.41 0.00 0.00 173.24 174.49 3k5e s VAL 241 N -0.54 1.64 -0.14 3.43 0.11 -0.00 -1.02 120.40 123.88 3k5e s VAL 241 Ca 0.12 -0.77 0.02 0.00 -2.93 0.00 0.00 61.98 58.41 3k5e s VAL 241 Cb -0.12 -1.44 0.00 0.00 -1.53 0.00 0.00 36.38 33.30 3k5e s VAL 241 CO 0.02 0.47 -0.20 -0.89 -3.33 0.00 0.00 175.10 171.17 3k5e s THR 242 N 0.47 2.27 -0.31 5.04 2.01 0.21 -1.36 115.64 123.96 3k5e s THR 242 Ca -0.16 -0.91 -0.04 0.00 0.31 0.00 0.00 61.69 60.88 3k5e s THR 242 Cb -0.17 -1.92 0.04 0.00 0.01 0.00 0.00 72.50 70.47 3k5e s THR 242 CO 0.06 0.54 0.04 -0.63 -0.69 0.00 0.00 174.62 173.94 3k5e s ILE 243 N 0.72 3.33 -0.13 1.82 1.01 0.13 -1.71 121.20 126.37 3k5e s ILE 243 Ca -0.09 -1.23 -0.23 0.00 0.00 0.00 0.00 60.65 59.10 3k5e s ILE 243 Cb -0.16 -2.88 -0.03 0.00 0.01 0.00 0.00 42.46 39.40 3k5e s ILE 243 CO 0.01 -0.11 0.70 -1.00 0.00 0.00 0.00 174.94 174.54 3k5e s HIS 244 N 1.33 3.48 0.02 3.97 3.76 -0.71 -0.45 115.29 126.68 3k5e s HIS 244 Ca -0.03 1.14 0.04 0.00 -0.15 0.00 0.00 55.06 56.07 3k5e s HIS 244 Cb -0.19 -2.85 -0.02 0.00 1.11 0.00 0.00 32.58 30.63 3k5e s HIS 244 CO 0.00 -0.07 -0.13 -1.64 -0.85 0.00 0.00 174.74 172.05 3k5e s MET 245 N 1.46 0.96 -0.10 1.40 -1.94 0.31 -1.54 119.30 119.85 3k5e s MET 245 Ca 0.35 -0.64 -0.04 0.00 -1.71 0.00 0.00 55.69 53.65 3k5e s MET 245 Cb -0.17 -0.95 0.05 0.00 2.01 0.00 0.00 34.83 35.77 3k5e s MET 245 CO 0.14 0.24 0.19 0.21 -0.01 0.00 0.00 175.02 175.80 3k5e s LYS 246 N -0.82 0.08 0.07 2.03 2.20 -0.13 -0.32 119.74 122.84 3k5e s LYS 246 Ca 0.03 0.59 0.04 0.00 -0.36 0.00 0.00 55.97 56.27 3k5e s LYS 246 Cb -0.07 -0.19 -0.04 0.00 -1.51 0.00 0.00 37.83 36.02 3k5e s LYS 246 CO 0.01 -0.28 0.01 -1.21 -0.36 0.00 0.00 175.35 173.51 3k5e s GLU 247 N 2.17 2.64 0.29 4.03 2.02 0.34 -1.16 118.70 129.04 3k5e s GLU 247 Ca 0.01 -0.77 0.08 0.00 0.02 0.00 0.00 54.97 54.31 3k5e s GLU 247 Cb -0.12 -2.59 -0.04 0.00 0.10 0.00 0.00 34.13 31.48 3k5e s GLU 247 CO -0.07 0.56 0.13 -0.08 0.02 0.00 0.00 175.26 175.83 3k5e s THR 248 N -1.26 3.65 -0.30 3.63 -1.32 -1.26 0.08 115.64 118.85 3k5e s THR 248 Ca 0.25 -1.63 -0.02 0.00 -1.21 0.00 0.00 61.69 59.07 3k5e s THR 248 Cb -0.12 -3.09 0.00 0.00 -1.51 0.00 0.00 72.50 67.79 3k5e s THR 248 CO 0.17 -0.29 0.08 0.35 -2.21 0.00 0.00 174.62 172.71 3k5e n THR 249 N -1.11-11.33 -1.60 5.08 -2.24 -1.26 -4.93 114.28 96.89 3k5e n THR 249 Ca -0.05 1.62 0.00 0.00 -2.27 0.00 0.00 64.05 63.35 3k5e n THR 249 Cb 0.59 -6.81 0.00 0.00 -2.10 0.00 0.00 70.33 62.02 3k5e n THR 249 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3k5e n GLU 253 N 0.53 -4.50 -3.61 -0.78 2.13 -1.26 -5.01 120.64 108.15 3k5e n GLU 253 Ca 0.02 3.38 -0.37 0.00 0.66 0.00 0.00 57.16 60.85 3k5e n GLU 253 Cb 0.06 -3.90 -0.10 0.00 0.27 0.00 0.00 31.44 27.77 3k5e n GLU 253 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 3k5e s GLU 254 N -4.14 4.06 -0.22 5.31 2.02 -1.26 -4.96 118.70 119.51 3k5e s GLU 254 Ca 0.00 -0.22 -0.09 0.00 0.02 0.00 0.00 54.97 54.68 3k5e s GLU 254 Cb 0.00 -3.56 -0.04 0.00 0.10 0.00 0.00 34.13 30.63 3k5e s GLU 254 CO 0.00 0.00 0.11 -0.51 0.02 0.00 0.00 175.26 174.88 3k5e s LEU 255 N 1.23 3.86 -0.22 1.80 1.43 0.11 -4.95 118.68 121.93 3k5e s LEU 255 Ca 0.09 0.03 -0.08 0.00 -1.03 0.00 0.00 54.13 53.14 3k5e s LEU 255 Cb -0.14 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 3k5e s LEU 255 CO 0.06 0.08 0.09 -0.69 0.23 0.00 0.00 176.35 176.12 3k5e s VAL 256 N 0.94 4.74 -0.06 -1.59 1.01 -1.26 -0.50 120.40 123.68 3k5e s VAL 256 Ca 0.05 -0.04 0.05 0.00 0.00 0.00 0.00 61.98 62.05 3k5e s VAL 256 Cb -0.14 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 3k5e s VAL 256 CO 0.03 0.38 -0.22 -0.54 0.00 0.00 0.00 175.10 174.75 3k5e s LYS 257 N 1.05 2.36 -0.18 2.72 1.02 0.57 -5.00 119.74 122.29 3k5e s LYS 257 Ca 0.05 -0.80 0.01 0.00 0.02 0.00 0.00 55.97 55.24 3k5e s LYS 257 Cb -0.14 -1.98 0.02 0.00 -0.52 0.00 0.00 37.83 35.21 3k5e s LYS 257 CO 0.03 0.31 -0.17 0.42 -0.92 0.00 0.00 175.35 175.02 3k5e s ILE 258 N -0.02 1.91 -0.09 2.17 1.01 -1.26 0.11 121.20 125.02 3k5e s ILE 258 Ca -0.06 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 59.71 3k5e s ILE 258 Cb -0.14 -1.77 -0.02 0.00 0.01 0.00 0.00 42.46 40.54 3k5e s ILE 258 CO 0.04 0.46 -0.13 -0.83 0.00 0.00 0.00 174.94 174.48 3k5e s GLY 259 N 1.34 1.55 0.02 6.18 0.00 0.40 -4.19 107.32 112.62 3k5e s GLY 259 Ca 0.04 -0.93 0.05 0.00 0.00 0.00 0.00 44.72 43.88 3k5e s GLY 259 CO -0.12 -0.47 -0.15 1.25 0.00 0.00 0.00 173.10 173.61 3k5e s LYS 260 N -0.20 1.03 -0.05 2.90 2.20 -0.99 0.18 119.74 124.81 3k5e s LYS 260 Ca 0.00 -0.70 -0.00 0.00 -0.36 0.00 0.00 55.97 54.92 3k5e s LYS 260 Cb -0.13 -1.03 0.03 0.00 -1.51 0.00 0.00 37.83 35.18 3k5e s LYS 260 CO 0.03 0.26 -0.01 -1.17 -0.36 0.00 0.00 175.35 174.11 3k5e s LEU 261 N -0.90 0.93 -0.21 5.43 2.96 -0.46 0.04 118.68 126.46 3k5e s LEU 261 Ca 0.03 -0.06 -0.08 0.00 -0.22 0.00 0.00 54.13 53.80 3k5e s LEU 261 Cb -0.07 -0.35 -0.04 0.00 0.50 0.00 0.00 46.19 46.23 3k5e s LEU 261 CO 0.01 -0.13 0.08 0.20 -1.32 0.00 0.00 176.35 175.19 3k5e s ASN 262 N 1.40 5.54 -0.37 3.68 0.02 0.03 -0.82 114.94 124.43 3k5e s ASN 262 Ca -0.04 -0.01 -0.07 0.00 -1.02 0.00 0.00 52.86 51.73 3k5e s ASN 262 Cb -0.13 -1.97 0.06 0.00 0.02 0.00 0.00 41.25 39.22 3k5e s ASN 262 CO -0.03 0.09 0.15 -0.76 0.02 0.00 0.00 177.10 176.58 3k5e s LEU 263 N 0.87 4.63 -0.19 0.60 1.43 -0.07 -0.66 118.68 125.29 3k5e s LEU 263 Ca 0.04 -1.33 -0.03 0.00 -1.03 0.00 0.00 54.13 51.78 3k5e s LEU 263 Cb -0.14 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 3k5e s LEU 263 CO 0.03 -0.41 -0.06 -0.69 0.23 0.00 0.00 176.35 175.45 3k5e s VAL 264 N 1.38 3.37 -0.46 -1.59 1.01 0.13 -0.84 120.40 123.39 3k5e s VAL 264 Ca 0.01 -0.51 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 3k5e s VAL 264 Cb -0.21 -2.50 0.12 0.00 0.00 0.00 0.00 36.38 33.80 3k5e s VAL 264 CO 0.02 0.46 0.27 -0.62 0.00 0.00 0.00 175.10 175.22 3k5e s ASP 265 N 1.05 5.33 0.66 3.32 -1.08 -0.43 -0.64 116.67 124.88 3k5e s ASP 265 Ca 0.00 -2.15 -0.16 0.00 -0.52 0.00 0.00 52.55 49.72 3k5e s ASP 265 Cb -0.15 -1.86 -0.00 0.00 -1.46 0.00 0.00 42.92 39.45 3k5e s ASP 265 CO -0.00 -0.54 1.15 -0.76 0.52 0.00 0.00 175.17 175.54 3k5e s LEU 266 N 0.97 3.45 0.50 -1.34 1.43 -1.09 -1.81 118.68 120.77 3k5e s LEU 266 Ca 0.09 2.16 -0.23 0.00 -1.03 0.00 0.00 54.13 55.13 3k5e s LEU 266 Cb -0.23 -4.57 -0.07 0.00 0.03 0.00 0.00 46.19 41.35 3k5e s LEU 266 CO -0.04 -1.75 1.18 0.00 0.23 0.00 0.00 176.35 175.97 3k5e n ALA 267 N -2.27 0.92 -1.74 4.21 0.00 -1.00 -4.87 120.51 115.76 3k5e n ALA 267 Ca 0.12 0.16 -0.42 0.00 0.00 0.00 0.00 53.44 53.30 3k5e n ALA 267 Cb 0.51 -2.22 -0.00 0.00 0.00 0.00 0.00 19.45 17.74 3k5e n ALA 267 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k5e n GLY 268 N 0.97 0.91 0.26 0.00 0.00 -0.74 -4.75 105.19 101.85 3k5e n GLY 268 Ca 0.10 0.30 0.12 0.00 0.00 0.00 0.00 46.02 46.54 3k5e n GLY 268 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k5e n SER 269 N 0.55 0.80 -4.73 1.61 3.41 -0.73 -4.83 113.62 109.70 3k5e n SER 269 Ca 0.03 -1.46 -0.42 0.00 -0.26 0.00 0.00 58.87 56.76 3k5e n SER 269 Cb 0.38 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.27 3k5e n SER 269 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 3k5e s GLU 270 N -1.93 4.26 -0.25 4.33 1.03 -1.26 -4.91 118.70 119.97 3k5e s GLU 270 Ca 0.34 2.28 -0.04 0.00 0.03 0.00 0.00 54.97 57.58 3k5e s GLU 270 Cb 0.17 -3.15 0.01 0.00 -0.80 0.00 0.00 34.13 30.36 3k5e s GLU 270 CO 0.27 -0.48 -0.02 1.21 -1.33 0.00 0.00 175.26 174.92 3k5e s ASN 271 N 0.75 4.52 0.00 0.83 2.47 -1.26 -5.08 114.94 117.17 3k5e s ASN 271 Ca 0.64 -0.61 0.00 0.00 0.42 0.00 0.00 52.86 53.31 3k5e s ASN 271 Cb -0.42 -1.75 0.00 0.00 -1.45 0.00 0.00 41.25 37.63 3k5e s ASN 271 CO 0.37 -0.09 0.00 0.59 -3.72 0.00 0.00 177.10 174.24 3k5e n ASN 287 N 4.78 0.00 -4.67 -4.21 4.13 -1.26 -5.20 115.26 108.83 3k5e n ASN 287 Ca -0.17 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 55.74 3k5e n ASN 287 Cb 0.49 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.64 3k5e n ASN 287 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 3k5e s ILE 288 N 0.00 4.65 -0.62 2.41 -4.36 -1.26 -5.07 121.20 116.95 3k5e s ILE 288 Ca 0.00 -0.10 -0.10 0.00 -0.26 0.00 0.00 60.65 60.19 3k5e s ILE 288 Cb 0.00 -3.04 0.16 0.00 1.25 0.00 0.00 42.46 40.83 3k5e s ILE 288 CO 0.00 0.53 0.51 0.21 0.24 0.00 0.00 174.94 176.44 3k5e s ASN 289 N -0.25 5.96 0.25 4.36 3.04 -1.26 -4.95 114.94 122.09 3k5e s ASN 289 Ca 0.07 -2.37 -0.04 0.00 0.04 0.00 0.00 52.86 50.56 3k5e s ASN 289 Cb -0.12 -2.05 0.38 0.00 -1.54 0.00 0.00 41.25 37.91 3k5e s ASN 289 CO 0.02 -0.59 1.85 -0.61 -3.04 0.00 0.00 177.10 174.73 3k5e h GLN 290 N 7.94 0.98 -0.51 0.43 5.75 -1.97 -0.42 115.11 127.30 3k5e h GLN 290 Ca -0.07 -0.06 -0.10 0.00 -0.15 0.00 0.00 58.65 58.27 3k5e h GLN 290 Cb 1.04 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 29.35 3k5e h GLN 290 CO 0.81 0.65 -0.06 0.77 -2.65 0.00 0.00 178.83 178.34 3k5e h SER 291 N 1.01 0.90 -0.23 -0.69 0.02 -1.92 -0.33 113.55 112.30 3k5e h SER 291 Ca 0.40 -0.27 -0.11 0.00 -0.84 0.00 0.00 61.79 60.98 3k5e h SER 291 Cb 0.22 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.51 3k5e h SER 291 CO -0.19 1.00 -0.28 0.25 -1.14 0.00 0.00 176.83 176.47 3k5e h LEU 292 N 0.83 0.64 -0.98 5.07 5.85 -1.87 -0.40 115.31 124.46 3k5e h LEU 292 Ca 0.14 -0.50 0.04 0.00 0.84 0.00 0.00 57.88 58.40 3k5e h LEU 292 Cb 0.58 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 3k5e h LEU 292 CO 0.04 1.01 0.64 -0.07 -0.34 0.00 0.00 178.44 179.71 3k5e h LEU 293 N 0.29 1.06 -0.21 2.25 3.38 -0.99 -2.61 115.31 118.48 3k5e h LEU 293 Ca 0.03 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.77 3k5e h LEU 293 Cb 0.85 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.36 3k5e h LEU 293 CO 0.07 0.73 -0.90 0.74 0.09 0.00 0.00 178.44 179.16 3k5e h THR 294 N 1.24 1.40 -0.04 0.22 2.02 -0.97 -1.99 112.91 114.79 3k5e h THR 294 Ca 0.39 -2.40 0.02 0.00 0.77 0.00 0.00 66.41 65.20 3k5e h THR 294 Cb 0.01 2.36 -0.03 0.00 -1.74 0.00 0.00 68.15 68.75 3k5e h THR 294 CO -0.13 0.72 -0.11 0.25 0.37 0.00 0.00 175.52 176.62 3k5e h LEU 295 N 0.24 -0.34 -0.53 2.58 5.85 -0.80 0.13 115.31 122.44 3k5e h LEU 295 Ca -0.07 0.06 0.09 0.00 0.84 0.00 0.00 57.88 58.80 3k5e h LEU 295 Cb 1.53 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 42.64 3k5e h LEU 295 CO 0.16 -0.16 0.13 1.23 -0.34 0.00 0.00 178.44 179.46 3k5e h GLY 296 N -0.18 0.68 1.88 3.75 0.00 -1.38 -1.85 103.07 105.96 3k5e h GLY 296 Ca 0.05 -0.05 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 3k5e h GLY 296 CO -0.14 -0.06 -0.37 3.21 0.00 0.00 0.00 176.54 179.18 3k5e h ARG 297 N 0.28 0.14 -0.28 4.80 3.08 -0.74 -1.63 114.38 120.03 3k5e h ARG 297 Ca 0.27 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.23 3k5e h ARG 297 Cb 0.35 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 3k5e h ARG 297 CO -0.32 0.50 0.07 0.28 -1.07 0.00 0.00 179.97 179.43 3k5e h VAL 298 N 0.12 1.21 0.13 2.04 2.07 -0.31 -2.15 116.25 119.36 3k5e h VAL 298 Ca 0.01 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 3k5e h VAL 298 Cb 0.72 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3k5e h VAL 298 CO 0.05 0.23 -0.06 0.40 0.02 0.00 0.00 177.57 178.21 3k5e h ILE 299 N 0.29 0.89 -0.63 4.57 2.04 -1.18 -0.83 117.51 122.65 3k5e h ILE 299 Ca 0.09 -0.05 0.12 0.00 1.00 0.00 0.00 64.86 66.02 3k5e h ILE 299 Cb 0.28 0.92 -0.12 0.00 -0.74 0.00 0.00 36.82 37.16 3k5e h ILE 299 CO 0.00 0.01 -0.25 0.74 0.00 0.00 0.00 178.15 178.65 3k5e h THR 300 N -0.20 0.24 -0.85 -0.27 2.02 -1.30 -0.50 112.91 112.05 3k5e h THR 300 Ca -0.02 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 3k5e h THR 300 Cb 0.15 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 66.76 3k5e h THR 300 CO 0.03 0.00 0.52 0.00 0.37 0.00 0.00 175.52 176.44 3k5e h ALA 301 N 1.33 1.09 -0.48 6.16 0.00 -1.07 -1.11 119.26 125.19 3k5e h ALA 301 Ca 0.28 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 3k5e h ALA 301 Cb 0.53 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3k5e h ALA 301 CO -0.69 0.54 -0.22 -0.07 0.00 0.00 0.00 179.25 178.81 3k5e h LEU 302 N 1.17 1.02 -0.00 0.00 3.38 -0.23 0.79 115.31 121.43 3k5e h LEU 302 Ca 0.31 -0.40 -0.24 0.00 0.09 0.00 0.00 57.88 57.64 3k5e h LEU 302 Cb -0.06 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 3k5e h LEU 302 CO -0.06 1.19 -1.08 -0.37 0.09 0.00 0.00 178.44 178.22 3k5e h VAL 303 N 0.85 1.58 0.00 1.22 -1.51 -1.01 -3.08 116.25 114.29 3k5e h VAL 303 Ca 0.11 -3.10 0.00 0.00 -1.23 0.00 0.00 66.70 62.48 3k5e h VAL 303 Cb 0.81 2.81 0.00 0.00 -2.13 0.00 0.00 31.29 32.78 3k5e h VAL 303 CO 0.07 0.90 0.00 -0.62 -1.23 0.00 0.00 177.57 176.69 3k5e n GLU 304 N -3.50 0.39 -2.92 5.19 1.02 -0.43 -4.91 120.64 115.48 3k5e n GLU 304 Ca -0.04 0.01 -0.21 0.00 -0.02 0.00 0.00 57.16 56.89 3k5e n GLU 304 Cb 0.95 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.90 3k5e n GLU 304 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3k5e n ARG 305 N -1.30 -4.38 -2.21 3.49 5.12 -0.63 -4.97 116.66 111.77 3k5e n ARG 305 Ca 0.13 0.87 -0.41 0.00 -1.93 0.00 0.00 57.85 56.51 3k5e n ARG 305 Cb 0.24 -5.60 -0.03 0.00 -1.16 0.00 0.00 32.46 25.92 3k5e n ARG 305 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3k5e s THR 306 N -3.13 3.07 0.36 0.55 2.01 0.18 -4.95 115.64 113.72 3k5e s THR 306 Ca 0.26 0.96 0.04 0.00 0.31 0.00 0.00 61.69 63.26 3k5e s THR 306 Cb -0.12 -3.61 0.22 0.00 0.01 0.00 0.00 72.50 69.01 3k5e s THR 306 CO 0.32 0.18 1.97 1.55 -0.69 0.00 0.00 174.62 177.96 3k5e h PRO 307 N 4.53 0.65 -5.31 4.92 0.13 -1.93 -3.41 132.00 131.58 3k5e h PRO 307 Ca -0.46 -0.07 -0.62 0.00 -0.87 0.00 0.00 66.00 63.97 3k5e h PRO 307 Cb 1.22 -0.13 -0.13 0.00 0.13 0.00 0.00 31.00 32.09 3k5e h PRO 307 CO 0.72 0.51 -0.06 -1.58 -0.23 0.00 0.00 178.00 177.37 3k5e s HIS 308 N -5.39 3.26 -0.21 1.56 5.65 -1.26 -5.06 115.29 113.84 3k5e s HIS 308 Ca -0.09 0.59 0.00 0.00 0.25 0.00 0.00 55.06 55.82 3k5e s HIS 308 Cb 0.17 -2.69 0.02 0.00 -1.18 0.00 0.00 32.58 28.90 3k5e s HIS 308 CO 0.76 -0.27 -0.14 0.08 -0.65 0.00 0.00 174.74 174.52 3k5e s VAL 309 N 2.27 2.41 -0.09 0.89 1.01 -1.26 -4.88 120.40 120.74 3k5e s VAL 309 Ca 0.20 -0.99 -0.04 0.00 0.00 0.00 0.00 61.98 61.15 3k5e s VAL 309 Cb -0.16 -2.13 -0.14 0.00 0.00 0.00 0.00 36.38 33.96 3k5e s VAL 309 CO 0.09 0.38 3.11 -0.81 0.00 0.00 0.00 175.10 177.87 3k5e n PRO 310 N 4.63 1.87 -0.30 2.72 -0.04 -1.26 -4.67 135.00 137.95 3k5e n PRO 310 Ca -0.19 -1.07 0.11 0.00 -0.04 0.00 0.00 63.50 62.31 3k5e n PRO 310 Cb 0.48 -1.82 0.25 0.00 -0.04 0.00 0.00 33.50 32.38 3k5e n PRO 310 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3k5e h TYR 311 N 2.55 0.11 0.00 0.54 0.05 -1.93 -1.61 116.97 116.68 3k5e h TYR 311 Ca 0.19 0.06 0.00 0.00 0.05 0.00 0.00 58.73 59.03 3k5e h TYR 311 Cb 1.26 0.09 0.00 0.00 1.01 0.00 0.00 36.73 39.10 3k5e h TYR 311 CO 1.40 -0.30 0.00 0.54 -1.05 0.00 0.00 178.16 178.75 3k5e n ARG 312 N -5.35 0.15 0.00 4.88 1.74 -1.26 -2.70 116.66 114.12 3k5e n ARG 312 Ca 0.20 0.17 0.10 0.00 -0.77 0.00 0.00 57.85 57.55 3k5e n ARG 312 Cb 0.65 -1.50 0.45 0.00 -1.02 0.00 0.00 32.46 31.04 3k5e n ARG 312 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3k5e n GLU 313 N -1.36 0.01 -3.82 5.56 1.02 -0.61 -4.81 120.64 116.64 3k5e n GLU 313 Ca 0.06 0.15 -0.09 0.00 -0.02 0.00 0.00 57.16 57.25 3k5e n GLU 313 Cb 0.14 -1.51 -0.06 0.00 -0.02 0.00 0.00 31.44 29.99 3k5e n GLU 313 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3k5e s SER 314 N -3.05 -0.00 0.16 1.62 1.04 -1.23 -4.86 113.70 107.38 3k5e s SER 314 Ca 0.10 -0.62 -0.16 0.00 0.48 0.00 0.00 55.95 55.76 3k5e s SER 314 Cb 0.14 0.41 0.06 0.00 0.10 0.00 0.00 66.02 66.72 3k5e s SER 314 CO 0.38 -0.82 1.78 0.11 0.98 0.00 0.00 173.24 175.68 3k5e h LYS 315 N 2.58 0.39 -0.30 4.02 1.79 -1.87 -2.36 116.57 120.80 3k5e h LYS 315 Ca -0.33 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.10 3k5e h LYS 315 Cb 1.22 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.77 3k5e h LYS 315 CO 0.51 0.26 0.14 1.25 -1.08 0.00 0.00 179.45 180.53 3k5e h LEU 316 N 0.40 0.40 -0.73 2.94 5.85 -1.92 -1.03 115.31 121.21 3k5e h LEU 316 Ca 0.17 -0.13 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 3k5e h LEU 316 Cb 0.08 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3k5e h LEU 316 CO -0.12 0.41 -0.45 0.71 -0.34 0.00 0.00 178.44 178.65 3k5e h THR 317 N 0.35 0.98 -0.13 1.05 1.35 -1.77 -1.10 112.91 113.63 3k5e h THR 317 Ca 0.10 -1.79 -0.02 0.00 -0.55 0.00 0.00 66.41 64.15 3k5e h THR 317 Cb 0.12 2.07 -0.00 0.00 -1.73 0.00 0.00 68.15 68.61 3k5e h THR 317 CO -0.01 0.44 -0.00 0.03 -0.25 0.00 0.00 175.52 175.73 3k5e h ARG 318 N 0.00 0.24 -0.50 4.72 3.08 -1.19 -0.50 114.38 120.23 3k5e h ARG 318 Ca -0.00 -0.08 -0.08 0.00 0.07 0.00 0.00 59.98 59.89 3k5e h ARG 318 Cb 1.04 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.04 3k5e h ARG 318 CO 0.06 0.48 0.00 0.82 -1.07 0.00 0.00 179.97 180.27 3k5e h ILE 319 N -0.03 1.25 -0.34 2.04 2.04 -1.08 -3.16 117.51 118.23 3k5e h ILE 319 Ca 0.04 -1.02 -0.07 0.00 1.00 0.00 0.00 64.86 64.81 3k5e h ILE 319 Cb 0.38 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 3k5e h ILE 319 CO 0.01 0.36 0.02 0.18 0.00 0.00 0.00 178.15 178.72 3k5e n LEU 320 N -4.21 4.24 -0.34 1.44 4.77 -0.43 -4.73 117.00 117.74 3k5e n LEU 320 Ca 0.03 -3.21 0.07 0.00 -0.03 0.00 0.00 56.01 52.86 3k5e n LEU 320 Cb 0.31 -0.59 0.26 0.00 -2.33 0.00 0.00 43.42 41.06 3k5e n LEU 320 CO 0.42 0.82 1.24 0.06 -1.33 0.00 0.00 177.39 178.59 3k5e h GLN 321 N 1.74 0.94 0.00 3.23 3.07 -1.04 -0.26 115.11 122.80 3k5e h GLN 321 Ca 0.08 -0.06 0.00 0.00 0.09 0.00 0.00 58.65 58.77 3k5e h GLN 321 Cb 1.61 -0.21 0.00 0.00 0.08 0.00 0.00 27.48 28.96 3k5e h GLN 321 CO 0.33 0.62 0.00 0.22 0.09 0.00 0.00 178.83 180.09 3k5e h ASP 322 N 0.97 0.00 0.72 0.06 3.58 -1.85 -1.24 116.42 118.67 3k5e h ASP 322 Ca 0.47 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.92 3k5e h ASP 322 Cb 0.45 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.50 3k5e h ASP 322 CO -0.23 0.00 -0.16 -1.20 -2.88 0.00 0.00 179.24 174.77 3k5e n SER 323 N -2.93 0.22 -3.84 2.28 7.64 -0.11 -2.64 113.62 114.24 3k5e n SER 323 Ca -0.01 0.05 -0.29 0.00 1.01 0.00 0.00 58.87 59.63 3k5e n SER 323 Cb 0.16 -0.20 -0.13 0.00 -1.01 0.00 0.00 64.21 63.02 3k5e n SER 323 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3k5e s LEU 324 N -2.87 3.81 -0.27 -3.43 1.43 -0.47 -4.71 118.68 112.17 3k5e s LEU 324 Ca 0.17 -3.07 0.00 0.00 -1.03 0.00 0.00 54.13 50.20 3k5e s LEU 324 Cb 0.19 -1.41 0.00 0.00 0.03 0.00 0.00 46.19 45.00 3k5e s LEU 324 CO 0.56 -0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.54 3k5e n GLY 325 N 2.99 0.32 0.00 -3.19 0.00 -1.26 -4.95 105.19 99.10 3k5e n GLY 325 Ca 0.10 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.32 3k5e n GLY 325 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5e n GLY 326 N -1.33 5.48 0.86 -0.02 0.00 -1.14 -4.77 105.19 104.28 3k5e n GLY 326 Ca -0.03 -1.79 0.10 0.00 0.00 0.00 0.00 46.02 44.30 3k5e n GLY 326 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k5e n ARG 327 N 0.00 2.12 -3.57 1.61 1.74 -1.15 0.19 116.66 117.60 3k5e n ARG 327 Ca 0.00 -1.70 -0.37 0.00 -0.77 0.00 0.00 57.85 55.01 3k5e n ARG 327 Cb 0.00 -1.43 -0.06 0.00 -1.02 0.00 0.00 32.46 29.95 3k5e n ARG 327 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3k5e s THR 328 N -1.56 5.10 -0.30 0.55 2.01 -1.08 -4.71 115.64 115.65 3k5e s THR 328 Ca 0.35 0.68 -0.29 0.00 0.31 0.00 0.00 61.69 62.74 3k5e s THR 328 Cb 0.19 -3.66 0.01 0.00 0.01 0.00 0.00 72.50 69.06 3k5e s THR 328 CO 0.27 0.53 1.08 -0.60 -0.69 0.00 0.00 174.62 175.21 3k5e s ARG 329 N -1.23 4.09 -0.03 4.92 3.52 -0.26 -4.60 118.95 125.36 3k5e s ARG 329 Ca 0.24 1.13 0.06 0.00 -0.13 0.00 0.00 55.73 57.03 3k5e s ARG 329 Cb -0.16 -3.73 -0.02 0.00 -1.56 0.00 0.00 34.95 29.48 3k5e s ARG 329 CO 0.13 -0.87 -0.19 -0.08 -0.81 0.00 0.00 175.30 173.48 3k5e s THR 330 N 3.61 2.62 0.07 4.11 -1.32 -1.26 -1.25 115.64 122.22 3k5e s THR 330 Ca 0.46 -0.91 0.09 0.00 -1.21 0.00 0.00 61.69 60.12 3k5e s THR 330 Cb -0.13 -1.98 -0.03 0.00 -1.51 0.00 0.00 72.50 68.85 3k5e s THR 330 CO 0.14 0.58 -0.24 -0.44 -2.21 0.00 0.00 174.62 172.45 3k5e s SER 331 N -0.70 2.94 -0.16 8.08 0.01 0.26 -1.96 113.70 122.17 3k5e s SER 331 Ca 0.11 -0.62 0.01 0.00 1.31 0.00 0.00 55.95 56.76 3k5e s SER 331 Cb -0.10 -0.23 0.01 0.00 0.21 0.00 0.00 66.02 65.90 3k5e s SER 331 CO -0.00 0.19 -0.19 -0.63 0.41 0.00 0.00 173.24 173.02 3k5e s ILE 332 N -0.90 2.28 -0.45 1.44 1.01 0.59 -0.81 121.20 124.36 3k5e s ILE 332 Ca 0.10 -0.89 -0.16 0.00 0.00 0.00 0.00 60.65 59.70 3k5e s ILE 332 Cb -0.10 -1.94 0.05 0.00 0.01 0.00 0.00 42.46 40.48 3k5e s ILE 332 CO 0.03 0.53 0.40 -0.63 0.00 0.00 0.00 174.94 175.28 3k5e s ILE 333 N 0.96 5.17 -0.21 2.92 1.01 0.18 -1.32 121.20 129.92 3k5e s ILE 333 Ca -0.03 -0.77 -0.20 0.00 0.00 0.00 0.00 60.65 59.64 3k5e s ILE 333 Cb -0.15 -4.08 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 3k5e s ILE 333 CO -0.04 -0.51 0.61 0.00 0.00 0.00 0.00 174.94 175.00 3k5e s ALA 334 N 1.85 3.55 -0.06 9.38 0.00 -0.08 -0.19 121.76 136.21 3k5e s ALA 334 Ca 0.07 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.71 3k5e s ALA 334 Cb -0.21 -2.95 -0.03 0.00 0.00 0.00 0.00 23.12 19.93 3k5e s ALA 334 CO 0.09 -0.57 -0.03 0.95 0.00 0.00 0.00 175.76 176.20 3k5e s THR 335 N 1.94 4.02 0.13 0.00 -4.23 0.45 -0.52 115.64 117.44 3k5e s THR 335 Ca 0.27 -0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.36 3k5e s THR 335 Cb -0.16 -2.69 -0.04 0.00 1.34 0.00 0.00 72.50 70.95 3k5e s THR 335 CO 0.10 0.55 0.01 0.27 -0.54 0.00 0.00 174.62 175.01 3k5e s ILE 336 N -0.90 0.41 0.12 2.99 -4.36 -0.53 -4.27 121.20 114.66 3k5e s ILE 336 Ca 0.14 -1.93 0.02 0.00 -0.26 0.00 0.00 60.65 58.62 3k5e s ILE 336 Cb -0.11 -1.98 -0.04 0.00 1.25 0.00 0.00 42.46 41.59 3k5e s ILE 336 CO 0.04 -0.57 0.26 -0.55 0.24 0.00 0.00 174.94 174.35 3k5e s SER 337 N -3.08 6.32 0.00 4.36 0.15 -1.26 -1.67 113.70 118.51 3k5e s SER 337 Ca 0.21 0.19 0.25 0.00 0.70 0.00 0.00 55.95 57.30 3k5e s SER 337 Cb 0.07 -1.91 0.59 0.00 -1.71 0.00 0.00 66.02 63.05 3k5e s SER 337 CO 0.01 0.09 1.46 -0.81 1.20 0.00 0.00 173.24 175.19 3k5e n PRO 338 N -0.27 0.27 -2.64 5.44 -0.04 -1.26 -4.86 135.00 131.63 3k5e n PRO 338 Ca -0.06 -0.16 -0.42 0.00 -0.04 0.00 0.00 63.50 62.82 3k5e n PRO 338 Cb 0.53 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.46 3k5e n PRO 338 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3k5e s ALA 339 N -2.84 3.24 0.63 0.55 0.00 -1.26 -1.00 121.76 121.08 3k5e s ALA 339 Ca 0.15 0.63 0.34 0.00 0.00 0.00 0.00 51.96 53.08 3k5e s ALA 339 Cb 0.18 -3.35 1.93 0.00 0.00 0.00 0.00 23.12 21.88 3k5e s ALA 339 CO 0.64 -0.23 2.18 0.66 0.00 0.00 0.00 175.76 179.02 3k5e h SER 340 N 6.41 0.00 -0.68 0.00 4.64 -1.94 0.11 113.55 122.09 3k5e h SER 340 Ca -0.42 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.00 3k5e h SER 340 Cb 1.22 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.26 3k5e h SER 340 CO 0.75 0.00 0.45 -0.07 -0.87 0.00 0.00 176.83 177.10 3k5e h LEU 341 N 0.00 0.48 -3.28 5.97 4.07 -1.96 -2.82 115.31 117.77 3k5e h LEU 341 Ca 0.03 0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.00 3k5e h LEU 341 Cb 0.29 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.94 3k5e h LEU 341 CO -0.00 0.28 0.00 0.59 -1.08 0.00 0.00 178.44 178.23 3k5e n ASN 342 N -4.48 5.21 -0.04 -0.43 3.02 0.37 -4.69 115.26 114.22 3k5e n ASN 342 Ca 0.11 -2.76 -0.08 0.00 -0.03 0.00 0.00 54.58 51.82 3k5e n ASN 342 Cb 0.36 -0.65 -0.02 0.00 -0.61 0.00 0.00 39.78 38.86 3k5e n ASN 342 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3k5e h LEU 343 N 3.75 -0.42 -0.26 3.41 5.85 -1.60 0.99 115.31 127.03 3k5e h LEU 343 Ca 0.00 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 3k5e h LEU 343 Cb 1.77 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 43.01 3k5e h LEU 343 CO 0.41 -0.17 0.09 -0.08 -0.34 0.00 0.00 178.44 178.35 3k5e h GLU 344 N -0.12 0.40 0.00 1.25 4.81 -1.87 -0.24 114.58 118.81 3k5e h GLU 344 Ca 0.12 -0.08 -0.09 0.00 -0.13 0.00 0.00 59.36 59.18 3k5e h GLU 344 Cb 0.29 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 3k5e h GLU 344 CO -0.28 0.46 -0.41 0.93 -0.73 0.00 0.00 179.01 178.98 3k5e h GLU 345 N 0.26 0.00 -0.32 1.92 4.39 -1.89 -0.64 114.58 118.30 3k5e h GLU 345 Ca 0.08 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.68 3k5e h GLU 345 Cb 0.22 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 3k5e h GLU 345 CO -0.00 0.41 -0.19 1.15 -1.16 0.00 0.00 179.01 179.21 3k5e h THR 346 N 0.00 1.29 -0.50 1.13 2.02 -0.55 -1.89 112.91 114.42 3k5e h THR 346 Ca -0.00 -1.31 -0.06 0.00 0.77 0.00 0.00 66.41 65.80 3k5e h THR 346 Cb 0.83 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.67 3k5e h THR 346 CO 0.05 0.43 0.07 -0.07 0.37 0.00 0.00 175.52 176.37 3k5e h LEU 347 N 0.46 0.80 -0.52 2.58 3.38 -0.81 -2.24 115.31 118.96 3k5e h LEU 347 Ca 0.07 -0.27 0.02 0.00 0.09 0.00 0.00 57.88 57.79 3k5e h LEU 347 Cb 0.73 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 3k5e h LEU 347 CO 0.05 0.86 0.32 0.28 0.09 0.00 0.00 178.44 180.05 3k5e h SER 348 N 0.71 0.54 -0.37 -0.43 0.02 -1.10 -1.61 113.55 111.30 3k5e h SER 348 Ca 0.15 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.08 3k5e h SER 348 Cb 0.41 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 3k5e h SER 348 CO 0.01 0.38 0.17 0.74 -1.14 0.00 0.00 176.83 176.99 3k5e h THR 349 N 0.65 1.18 -0.30 -2.27 2.02 -1.27 -1.13 112.91 111.78 3k5e h THR 349 Ca 0.20 -0.52 -0.00 0.00 0.77 0.00 0.00 66.41 66.86 3k5e h THR 349 Cb -0.01 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 3k5e h THR 349 CO -0.08 0.19 0.18 -0.07 0.37 0.00 0.00 175.52 176.11 3k5e h LEU 350 N 0.46 0.37 -0.45 2.58 3.38 -1.25 0.71 115.31 121.11 3k5e h LEU 350 Ca 0.13 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3k5e h LEU 350 Cb 0.15 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3k5e h LEU 350 CO -0.01 0.32 0.27 -0.08 0.09 0.00 0.00 178.44 179.03 3k5e h GLU 351 N 0.38 0.61 0.02 1.13 4.57 -1.27 0.58 114.58 120.60 3k5e h GLU 351 Ca 0.11 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.24 3k5e h GLU 351 Cb 0.03 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 3k5e h GLU 351 CO -0.02 0.46 -0.09 -0.92 -1.18 0.00 0.00 179.01 177.25 3k5e h TYR 352 N 0.59 -0.23 -0.54 0.92 5.03 -0.90 -2.10 116.97 119.74 3k5e h TYR 352 Ca 0.16 0.01 -0.09 0.00 2.58 0.00 0.00 58.73 61.39 3k5e h TYR 352 Cb 0.01 0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.37 3k5e h TYR 352 CO -0.03 -0.14 -0.01 0.00 -1.32 0.00 0.00 178.16 176.66 3k5e h ALA 353 N 0.80 0.97 -0.13 1.82 0.00 -0.55 -2.83 119.26 119.34 3k5e h ALA 353 Ca 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3k5e h ALA 353 Cb 0.20 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3k5e h ALA 353 CO -0.08 0.62 0.05 1.25 0.00 0.00 0.00 179.25 181.09 3k5e h HIS 354 N 0.85 0.19 -0.56 0.00 -0.00 -0.74 -2.39 115.15 112.51 3k5e h HIS 354 Ca 0.16 -0.01 0.11 0.00 -0.00 0.00 0.00 60.37 60.62 3k5e h HIS 354 Cb 0.51 -0.06 -0.11 0.00 -0.00 0.00 0.00 27.41 27.76 3k5e h HIS 354 CO 0.03 0.27 -0.20 0.00 -0.00 0.00 0.00 177.93 178.03 3k5e h ARG 355 N 0.05 -0.07 -0.08 5.26 3.08 -1.28 -2.07 114.38 119.27 3k5e h ARG 355 Ca 0.04 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.12 3k5e h ARG 355 Cb 0.16 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.22 3k5e h ARG 355 CO -0.00 -0.04 0.16 0.00 -1.07 0.00 0.00 179.97 179.01 3k5e h ALA 356 N 1.37 1.45 -0.77 0.04 0.00 -1.18 -1.35 119.26 118.82 3k5e h ALA 356 Ca 0.26 -0.00 0.20 0.00 0.00 0.00 0.00 54.91 55.37 3k5e h ALA 356 Cb 0.47 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 3k5e h ALA 356 CO -0.61 -0.20 0.54 0.87 0.00 0.00 0.00 179.25 179.85 3k5e h LYS 357 N 0.00 0.14 0.00 0.00 1.57 -1.20 -1.83 116.57 115.25 3k5e h LYS 357 Ca 0.04 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3k5e h LYS 357 Cb 0.36 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.64 3k5e h LYS 357 CO -0.00 0.09 0.00 0.09 -0.57 0.00 0.00 179.45 179.06 3k5e n ASN 358 N -4.38 0.00 -4.71 0.86 3.02 -0.51 -2.76 115.26 106.78 3k5e n ASN 358 Ca 0.16 -1.24 -0.41 0.00 -0.03 0.00 0.00 54.58 53.06 3k5e n ASN 358 Cb 0.74 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.88 3k5e n ASN 358 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3k5e s ILE 359 N -2.00 4.95 -0.16 2.41 1.01 -0.69 -4.74 121.20 121.98 3k5e s ILE 359 Ca 0.27 1.70 -0.06 0.00 0.00 0.00 0.00 60.65 62.56 3k5e s ILE 359 Cb 0.12 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 3k5e s ILE 359 CO 0.21 0.18 0.04 -0.22 0.00 0.00 0.00 174.94 175.14 3k5e s LEU 360 N 1.13 3.69 0.00 2.97 2.96 -1.26 -0.94 118.68 127.24 3k5e s LEU 360 Ca 0.43 0.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.41 3k5e s LEU 360 Cb -0.19 -1.91 0.00 0.00 0.50 0.00 0.00 46.19 44.59 3k5e s LEU 360 CO 0.20 0.22 0.00 -0.46 -1.32 0.00 0.00 176.35 174.99 3k5e n ASN 361 N 3.24 0.59 0.00 3.68 2.04 -1.26 -4.20 115.26 119.34 3k5e n ASN 361 Ca -0.17 -0.97 0.00 0.00 -0.44 0.00 0.00 54.58 53.00 3k5e n ASN 361 Cb 0.53 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.78 3k5e n ASN 361 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99