#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i4k n LEU 6 N 0.00 1.09 -4.72 -2.67 7.94 -1.26 -2.02 117.00 115.36 3i4k n LEU 6 Ca 0.00 -0.36 -0.42 0.00 -1.11 0.00 0.00 56.01 54.12 3i4k n LEU 6 Cb 0.00 -0.00 -0.00 0.00 0.53 0.00 0.00 43.42 43.95 3i4k n LEU 6 CO 0.00 0.18 0.97 0.41 -1.11 0.00 0.00 177.39 177.84 3i4k n THR 7 N -0.15 2.10 -3.06 1.96 -1.04 -1.26 -2.35 114.28 110.48 3i4k n THR 7 Ca 0.20 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.05 61.30 3i4k n THR 7 Cb 0.29 -1.69 -0.06 0.00 -1.82 0.00 0.00 70.33 67.05 3i4k n THR 7 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 3i4k s ILE 8 N -1.12 4.90 -0.19 12.58 1.09 -0.57 -0.17 121.20 137.72 3i4k s ILE 8 Ca 0.56 1.00 -0.20 0.00 -1.10 0.00 0.00 60.65 60.91 3i4k s ILE 8 Cb -0.53 -4.04 -0.17 0.00 -1.06 0.00 0.00 42.46 36.66 3i4k s ILE 8 CO 0.62 -0.15 0.20 1.56 -0.10 0.00 0.00 174.94 177.07 3i4k h GLN 9 N 8.12 0.00 -5.13 2.79 1.08 -0.54 -0.62 115.11 120.80 3i4k h GLN 9 Ca -0.26 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 56.59 3i4k h GLN 9 Cb 1.11 0.00 -0.18 0.00 -0.05 0.00 0.00 27.48 28.36 3i4k h GLN 9 CO 0.82 0.85 -0.74 0.21 -0.95 0.00 0.00 178.83 179.02 3i4k s LYS 10 N -2.32 0.93 -0.08 1.46 2.20 -1.11 -4.73 119.74 116.08 3i4k s LYS 10 Ca -0.26 -1.21 -0.03 0.00 -0.36 0.00 0.00 55.97 54.12 3i4k s LYS 10 Cb 0.05 -0.67 0.04 0.00 -1.51 0.00 0.00 37.83 35.73 3i4k s LYS 10 CO 0.54 0.11 0.06 0.14 -0.36 0.00 0.00 175.35 175.84 3i4k s VAL 11 N -2.41 -0.00 0.30 4.02 -7.23 -1.26 -0.36 120.40 113.46 3i4k s VAL 11 Ca 0.08 0.21 0.11 0.00 -1.81 0.00 0.00 61.98 60.57 3i4k s VAL 11 Cb -0.03 -0.34 -0.05 0.00 0.56 0.00 0.00 36.38 36.52 3i4k s VAL 11 CO 0.01 0.08 -0.16 -1.61 -0.31 0.00 0.00 175.10 173.11 3i4k s GLU 12 N 2.12 1.76 -0.06 4.82 2.02 -0.62 -4.95 118.70 123.79 3i4k s GLU 12 Ca 0.04 -1.79 -0.04 0.00 0.02 0.00 0.00 54.97 53.20 3i4k s GLU 12 Cb -0.13 -1.78 0.02 0.00 0.10 0.00 0.00 34.13 32.34 3i4k s GLU 12 CO -0.05 0.28 0.15 -1.54 0.02 0.00 0.00 175.26 174.12 3i4k s SER 13 N -3.55 -0.14 -0.04 -0.19 1.04 -1.26 0.32 113.70 109.88 3i4k s SER 13 Ca 0.31 0.30 0.02 0.00 0.48 0.00 0.00 55.95 57.06 3i4k s SER 13 Cb -0.03 0.27 0.01 0.00 0.10 0.00 0.00 66.02 66.36 3i4k s SER 13 CO 0.16 -0.09 -0.09 -0.13 0.98 0.00 0.00 173.24 174.08 3i4k s ARG 14 N 0.47 1.06 -0.26 4.02 0.52 0.97 -4.95 118.95 120.78 3i4k s ARG 14 Ca -0.03 -0.28 -0.23 0.00 -0.52 0.00 0.00 55.73 54.67 3i4k s ARG 14 Cb -0.05 -0.97 -0.01 0.00 0.52 0.00 0.00 34.95 34.44 3i4k s ARG 14 CO -0.02 0.06 0.76 0.42 0.02 0.00 0.00 175.30 176.53 3i4k s ILE 15 N 0.43 4.87 -0.10 1.52 1.01 -1.26 -0.03 121.20 127.63 3i4k s ILE 15 Ca -0.07 1.33 -0.02 0.00 0.00 0.00 0.00 60.65 61.89 3i4k s ILE 15 Cb -0.11 -4.07 -0.03 0.00 0.01 0.00 0.00 42.46 38.26 3i4k s ILE 15 CO 0.01 -0.09 -0.01 -0.76 0.00 0.00 0.00 174.94 174.09 3i4k s LEU 16 N 2.76 3.47 -0.77 2.97 1.43 0.19 -0.28 118.68 128.45 3i4k s LEU 16 Ca 0.31 0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.48 3i4k s LEU 16 Cb -0.15 -1.80 0.19 0.00 0.03 0.00 0.00 46.19 44.46 3i4k s LEU 16 CO 0.09 0.32 0.61 -1.81 0.23 0.00 0.00 176.35 175.79 3i4k s ASP 17 N -0.51 5.41 -0.08 2.29 1.01 -0.31 -1.01 116.67 123.47 3i4k s ASP 17 Ca 0.09 -3.62 -0.26 0.00 0.71 0.00 0.00 52.55 49.47 3i4k s ASP 17 Cb -0.12 -1.80 -0.03 0.00 1.01 0.00 0.00 42.92 41.99 3i4k s ASP 17 CO 0.02 -0.18 0.81 0.54 0.21 0.00 0.00 175.17 176.58 3i4k s VAL 18 N -1.16 4.95 0.66 -1.27 0.11 -0.89 -4.90 120.40 117.90 3i4k s VAL 18 Ca 0.25 1.66 -0.18 0.00 -2.93 0.00 0.00 61.98 60.78 3i4k s VAL 18 Cb -0.09 -4.14 -0.00 0.00 -1.53 0.00 0.00 36.38 30.61 3i4k s VAL 18 CO -0.12 0.16 1.28 -2.84 -3.33 0.00 0.00 175.10 170.25 3i4k s PRO 19 N 1.24 2.49 0.08 1.54 0.02 -1.26 -1.25 135.00 137.86 3i4k s PRO 19 Ca 0.42 2.01 0.04 0.00 0.02 0.00 0.00 61.00 63.48 3i4k s PRO 19 Cb -0.18 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.45 3i4k s PRO 19 CO 0.19 -1.63 0.05 -0.51 -0.33 0.00 0.00 177.00 174.77 3i4k s LEU 20 N -4.49 3.69 0.36 -5.54 1.02 -1.17 -0.66 118.68 111.89 3i4k s LEU 20 Ca 0.81 -0.06 0.17 0.00 0.02 0.00 0.00 54.13 55.07 3i4k s LEU 20 Cb -0.36 -2.38 0.64 0.00 0.02 0.00 0.00 46.19 44.11 3i4k s LEU 20 CO 0.40 0.18 1.72 0.40 0.02 0.00 0.00 176.35 179.07 3i4k h ILE 21 N 2.69 0.99 -3.63 -0.59 2.04 -1.44 -3.42 117.51 114.15 3i4k h ILE 21 Ca -0.47 -1.59 -0.09 0.00 1.00 0.00 0.00 64.86 63.72 3i4k h ILE 21 Cb 1.16 1.94 -0.15 0.00 -0.74 0.00 0.00 36.82 39.03 3i4k h ILE 21 CO 0.64 0.40 -0.32 -0.13 0.00 0.00 0.00 178.15 178.74 3i4k s ARG 22 N -3.65 0.84 -0.93 2.37 0.52 -1.26 -5.04 118.95 111.79 3i4k s ARG 22 Ca -0.00 -0.79 -0.24 0.00 -0.52 0.00 0.00 55.73 54.17 3i4k s ARG 22 Cb 0.11 0.35 -0.02 0.00 0.52 0.00 0.00 34.95 35.91 3i4k s ARG 22 CO 0.70 -0.27 1.82 -2.14 0.02 0.00 0.00 175.30 175.43 3i4k s PRO 23 N -3.40 2.82 -0.58 3.54 0.02 -1.25 -4.72 135.00 131.42 3i4k s PRO 23 Ca 0.01 -0.50 -0.27 0.00 0.02 0.00 0.00 61.00 60.26 3i4k s PRO 23 Cb 0.02 -5.14 -0.01 0.00 0.02 0.00 0.00 34.50 29.40 3i4k s PRO 23 CO -0.09 -3.08 1.73 -1.58 -0.33 0.00 0.00 177.00 173.65 3i4k s HIS 24 N 8.76 1.84 0.20 6.54 2.46 -0.22 -4.67 115.29 130.20 3i4k s HIS 24 Ca 0.64 0.64 -0.15 0.00 0.47 0.00 0.00 55.06 56.65 3i4k s HIS 24 Cb -0.05 -4.19 -0.08 0.00 -0.13 0.00 0.00 32.58 28.13 3i4k s HIS 24 CO -0.03 -2.31 0.63 0.20 -2.47 0.00 0.00 174.74 170.76 3i4k s GLY 25 N 6.85 2.47 0.04 1.59 0.00 -1.26 0.12 107.32 117.13 3i4k s GLY 25 Ca 0.63 -0.04 0.00 0.00 0.00 0.00 0.00 44.72 45.32 3i4k s GLY 25 CO 0.22 0.24 0.00 0.69 0.00 0.00 0.00 173.10 174.26 3i4k n PHE 26 N 0.52 0.08 -0.14 1.90 3.72 0.43 -2.60 117.46 121.37 3i4k n PHE 26 Ca -0.03 -0.22 -0.03 0.00 -0.05 0.00 0.00 57.45 57.12 3i4k n PHE 26 Cb 0.52 -0.02 0.19 0.00 -0.94 0.00 0.00 39.48 39.23 3i4k n PHE 26 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3i4k h ALA 27 N 1.03 1.22 0.00 4.37 0.00 -1.92 -3.34 119.26 120.62 3i4k h ALA 27 Ca -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3i4k h ALA 27 Cb 0.11 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3i4k h ALA 27 CO 0.06 0.54 0.00 0.25 0.00 0.00 0.00 179.25 180.10 3i4k n THR 28 N -4.28 0.00 -3.84 0.00 -2.24 -1.26 -4.22 114.28 98.43 3i4k n THR 28 Ca 0.04 -0.38 -0.12 0.00 -2.27 0.00 0.00 64.05 61.32 3i4k n THR 28 Cb 0.22 1.00 -0.10 0.00 -2.10 0.00 0.00 70.33 69.35 3i4k n THR 28 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3i4k s THR 29 N -0.75 0.06 -0.14 4.28 -4.23 -1.25 -5.15 115.64 108.46 3i4k s THR 29 Ca 0.00 -0.49 0.01 0.00 -1.18 0.00 0.00 61.69 60.03 3i4k s THR 29 Cb 0.00 -0.41 -0.01 0.00 1.34 0.00 0.00 72.50 73.42 3i4k s THR 29 CO 0.00 -0.27 -0.16 -0.89 -0.54 0.00 0.00 174.62 172.76 3i4k s THR 30 N -0.99 2.70 0.17 3.99 2.01 -1.26 0.16 115.64 122.43 3i4k s THR 30 Ca -0.11 -0.77 -0.10 0.00 0.31 0.00 0.00 61.69 61.02 3i4k s THR 30 Cb -0.06 -2.12 -0.07 0.00 0.01 0.00 0.00 72.50 70.26 3i4k s THR 30 CO 0.02 0.53 0.50 -0.44 -0.69 0.00 0.00 174.62 174.53 3i4k s SER 31 N 0.58 6.65 0.00 3.53 0.01 0.32 -4.90 113.70 119.89 3i4k s SER 31 Ca -0.09 0.89 0.00 0.00 1.31 0.00 0.00 55.95 58.05 3i4k s SER 31 Cb -0.16 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 63.86 3i4k s SER 31 CO 0.03 0.02 0.16 0.35 0.41 0.00 0.00 173.24 174.21 3i4k n THR 32 N 0.27 0.00 -3.61 1.44 -2.24 -1.26 -1.06 114.28 107.82 3i4k n THR 32 Ca -0.03 -0.21 -0.10 0.00 -2.27 0.00 0.00 64.05 61.45 3i4k n THR 32 Cb 0.52 1.44 -0.06 0.00 -2.10 0.00 0.00 70.33 70.12 3i4k n THR 32 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3i4k s GLU 33 N -0.10 0.53 -0.03 -0.78 -1.05 -1.26 -3.03 118.70 112.97 3i4k s GLU 33 Ca 0.00 0.42 -0.09 0.00 -0.15 0.00 0.00 54.97 55.15 3i4k s GLU 33 Cb 0.00 0.26 -0.05 0.00 -0.44 0.00 0.00 34.13 33.90 3i4k s GLU 33 CO 0.00 -0.11 0.26 -1.14 0.95 0.00 0.00 175.26 175.22 3i4k s GLN 34 N -0.28 3.62 -0.22 -4.83 2.00 -0.38 -4.92 119.66 114.64 3i4k s GLN 34 Ca 0.01 0.03 -0.06 0.00 -2.00 0.00 0.00 55.36 53.34 3i4k s GLN 34 Cb -0.03 -3.14 -0.03 0.00 0.80 0.00 0.00 33.01 30.61 3i4k s GLN 34 CO -0.03 0.70 0.03 -1.01 -0.50 0.00 0.00 175.29 174.48 3i4k s HIS 35 N -1.16 3.08 -0.05 1.67 3.76 -1.26 -2.10 115.29 119.22 3i4k s HIS 35 Ca 0.23 -0.41 0.03 0.00 -0.15 0.00 0.00 55.06 54.76 3i4k s HIS 35 Cb -0.14 -2.15 0.01 0.00 1.11 0.00 0.00 32.58 31.41 3i4k s HIS 35 CO 0.12 -0.26 -0.11 0.42 -0.85 0.00 0.00 174.74 174.05 3i4k s ILE 36 N 1.21 1.01 -0.50 0.60 1.01 -0.18 -4.55 121.20 119.80 3i4k s ILE 36 Ca 0.04 -0.45 -0.18 0.00 0.00 0.00 0.00 60.65 60.07 3i4k s ILE 36 Cb -0.14 -0.91 0.07 0.00 0.01 0.00 0.00 42.46 41.48 3i4k s ILE 36 CO 0.02 0.32 0.54 -0.22 0.00 0.00 0.00 174.94 175.60 3i4k s LEU 37 N 0.43 5.29 -0.32 2.97 2.96 -0.23 0.56 118.68 130.34 3i4k s LEU 37 Ca -0.09 -1.13 -0.23 0.00 -0.22 0.00 0.00 54.13 52.46 3i4k s LEU 37 Cb -0.13 -2.33 0.00 0.00 0.50 0.00 0.00 46.19 44.24 3i4k s LEU 37 CO 0.02 -0.81 0.76 -0.22 -1.32 0.00 0.00 176.35 174.78 3i4k s LEU 38 N 2.22 4.11 0.08 -0.68 2.96 0.95 -0.43 118.68 127.89 3i4k s LEU 38 Ca 0.10 0.55 0.03 0.00 -0.22 0.00 0.00 54.13 54.59 3i4k s LEU 38 Cb -0.22 -3.01 -0.04 0.00 0.50 0.00 0.00 46.19 43.42 3i4k s LEU 38 CO 0.09 -0.62 0.06 -0.69 -1.32 0.00 0.00 176.35 173.87 3i4k s VAL 39 N 2.92 4.40 -0.02 1.68 1.01 0.29 -0.02 120.40 130.67 3i4k s VAL 39 Ca 0.31 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.48 3i4k s VAL 39 Cb -0.14 -3.11 0.01 0.00 0.00 0.00 0.00 36.38 33.14 3i4k s VAL 39 CO 0.13 0.13 -0.04 -0.94 0.00 0.00 0.00 175.10 174.38 3i4k s SER 40 N -2.35 0.70 -0.26 3.32 1.04 0.15 -1.89 113.70 114.40 3i4k s SER 40 Ca 0.28 -0.09 -0.06 0.00 0.48 0.00 0.00 55.95 56.56 3i4k s SER 40 Cb -0.12 -0.25 -0.01 0.00 0.10 0.00 0.00 66.02 65.75 3i4k s SER 40 CO 0.21 -0.01 0.05 -0.69 0.98 0.00 0.00 173.24 173.77 3i4k s VAL 41 N 0.50 3.94 -0.33 5.02 1.01 -0.11 -1.59 120.40 128.85 3i4k s VAL 41 Ca -0.06 -0.46 -0.11 0.00 0.00 0.00 0.00 61.98 61.35 3i4k s VAL 41 Cb -0.09 -2.91 -0.00 0.00 0.00 0.00 0.00 36.38 33.37 3i4k s VAL 41 CO -0.00 0.25 0.19 -1.00 0.00 0.00 0.00 175.10 174.54 3i4k s HIS 42 N 1.54 3.20 0.38 5.22 3.76 0.52 0.06 115.29 129.96 3i4k s HIS 42 Ca 0.05 -0.51 -0.06 0.00 -0.15 0.00 0.00 55.06 54.39 3i4k s HIS 42 Cb -0.16 -2.41 -0.05 0.00 1.11 0.00 0.00 32.58 31.07 3i4k s HIS 42 CO 0.01 -0.46 0.67 -0.51 -0.85 0.00 0.00 174.74 173.61 3i4k s LEU 43 N 1.64 3.87 0.55 0.89 1.43 -0.24 0.21 118.68 127.02 3i4k s LEU 43 Ca 0.05 0.84 0.22 0.00 -1.03 0.00 0.00 54.13 54.21 3i4k s LEU 43 Cb -0.18 -3.72 1.46 0.00 0.03 0.00 0.00 46.19 43.79 3i4k s LEU 43 CO 0.08 -0.37 2.14 -0.08 0.23 0.00 0.00 176.35 178.34 3i4k h GLU 44 N 1.02 0.00 -0.14 1.70 4.57 -0.54 -0.57 114.58 120.62 3i4k h GLU 44 Ca -0.48 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 3i4k h GLU 44 Cb 1.20 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.79 3i4k h GLU 44 CO 0.64 0.00 0.00 0.27 -1.18 0.00 0.00 179.01 178.74 3i4k n ASN 45 N -4.26 0.36 0.00 1.04 2.04 -0.85 -4.88 115.26 108.70 3i4k n ASN 45 Ca -0.00 -2.01 0.00 0.00 -0.44 0.00 0.00 54.58 52.13 3i4k n ASN 45 Cb 0.22 -0.08 0.00 0.00 -2.53 0.00 0.00 39.78 37.39 3i4k n ASN 45 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3i4k n GLY 46 N 0.53 3.14 3.76 4.83 0.00 -0.22 -5.04 105.19 112.18 3i4k n GLY 46 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 3i4k n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i4k s VAL 47 N -1.72 3.10 -0.01 1.61 0.11 -1.26 -4.76 120.40 117.47 3i4k s VAL 47 Ca 0.00 0.51 0.03 0.00 -2.93 0.00 0.00 61.98 59.60 3i4k s VAL 47 Cb 0.00 -3.04 -0.01 0.00 -1.53 0.00 0.00 36.38 31.81 3i4k s VAL 47 CO 0.00 -0.31 -0.11 -0.63 -3.33 0.00 0.00 175.10 170.71 3i4k s ILE 48 N -2.29 0.91 -0.03 7.04 1.01 -1.26 -1.08 121.20 125.51 3i4k s ILE 48 Ca 0.68 -0.48 0.00 0.00 0.00 0.00 0.00 60.65 60.85 3i4k s ILE 48 Cb -0.22 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 3i4k s ILE 48 CO 0.42 0.26 0.02 -0.83 0.00 0.00 0.00 174.94 174.81 3i4k s GLY 49 N -0.15 1.90 -0.04 6.18 0.00 0.11 -4.53 107.32 110.79 3i4k s GLY 49 Ca 0.02 -0.89 0.06 0.00 0.00 0.00 0.00 44.72 43.91 3i4k s GLY 49 CO -0.00 -0.73 -0.22 -0.19 0.00 0.00 0.00 173.10 171.96 3i4k s TYR 50 N -1.05 2.48 -0.03 1.90 2.02 -1.26 -0.93 117.35 120.48 3i4k s TYR 50 Ca 0.18 -0.46 -0.08 0.00 -0.37 0.00 0.00 57.07 56.34 3i4k s TYR 50 Cb -0.12 -1.58 0.01 0.00 -0.40 0.00 0.00 41.96 39.87 3i4k s TYR 50 CO 0.09 -0.04 0.18 0.20 -1.57 0.00 0.00 175.55 174.41 3i4k s GLY 51 N -0.46 -0.06 -0.13 0.71 0.00 -0.79 -3.74 107.32 102.85 3i4k s GLY 51 Ca 0.05 0.22 -0.05 0.00 0.00 0.00 0.00 44.72 44.94 3i4k s GLY 51 CO 0.01 0.10 0.04 -0.54 0.00 0.00 0.00 173.10 172.72 3i4k s GLU 52 N -0.71 3.45 -0.44 2.90 2.02 -1.26 -0.54 118.70 124.12 3i4k s GLU 52 Ca -0.08 -0.35 -0.08 0.00 0.02 0.00 0.00 54.97 54.48 3i4k s GLU 52 Cb -0.05 -3.01 0.10 0.00 0.10 0.00 0.00 34.13 31.27 3i4k s GLU 52 CO 0.01 0.54 0.29 0.20 0.02 0.00 0.00 175.26 176.32 3i4k s GLY 53 N -0.39 2.00 -0.09 -1.39 0.00 0.42 -3.69 107.32 104.19 3i4k s GLY 53 Ca 0.09 -2.37 -0.08 0.00 0.00 0.00 0.00 44.72 42.36 3i4k s GLY 53 CO 0.02 1.04 0.23 0.54 0.00 0.00 0.00 173.10 174.92 3i4k s VAL 54 N 1.36 -0.00 0.25 1.40 0.11 -1.26 -1.07 120.40 121.19 3i4k s VAL 54 Ca 0.05 0.01 0.09 0.00 -2.93 0.00 0.00 61.98 59.20 3i4k s VAL 54 Cb -0.24 -0.33 -0.05 0.00 -1.53 0.00 0.00 36.38 34.23 3i4k s VAL 54 CO -0.00 0.00 -0.15 0.68 -3.33 0.00 0.00 175.10 172.30 3i4k s VAL 55 N 0.18 2.03 -1.14 2.04 -7.23 -1.26 -4.85 120.40 110.18 3i4k s VAL 55 Ca -0.01 -2.28 -0.24 0.00 -1.81 0.00 0.00 61.98 57.64 3i4k s VAL 55 Cb -0.02 -2.21 -0.14 0.00 0.56 0.00 0.00 36.38 34.57 3i4k s VAL 55 CO -0.00 -0.47 2.01 -2.84 -0.31 0.00 0.00 175.10 173.49 3i4k s PRO 56 N -3.60 1.97 0.00 4.82 0.02 -1.15 -4.36 135.00 132.70 3i4k s PRO 56 Ca 0.27 -0.84 0.00 0.00 0.02 0.00 0.00 61.00 60.44 3i4k s PRO 56 Cb -0.02 -5.13 0.00 0.00 0.02 0.00 0.00 34.50 29.37 3i4k s PRO 56 CO 0.11 -4.58 0.00 0.41 -0.33 0.00 0.00 177.00 172.61 3i4k n GLY 57 N 5.97 2.29 0.00 0.52 0.00 -1.26 -4.80 105.19 107.91 3i4k n GLY 57 Ca 0.43 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3i4k n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4k n GLY 58 N 0.00 1.28 0.10 -0.02 0.00 -1.26 -4.75 105.19 100.54 3i4k n GLY 58 Ca 0.00 -0.91 0.09 0.00 0.00 0.00 0.00 46.02 45.20 3i4k n GLY 58 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3i4k n PRO 59 N 0.00 0.12 0.20 1.61 -0.04 -1.23 -2.88 135.00 132.78 3i4k n PRO 59 Ca 0.00 0.45 0.14 0.00 -0.04 0.00 0.00 63.50 64.05 3i4k n PRO 59 Cb 0.00 -1.77 0.73 0.00 -0.04 0.00 0.00 33.50 32.41 3i4k n PRO 59 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 3i4k h TRP 60 N 0.00 0.00 0.09 0.54 5.08 -1.93 -0.45 115.95 119.28 3i4k h TRP 60 Ca 0.00 0.00 -0.15 0.00 1.08 0.00 0.00 58.89 59.82 3i4k h TRP 60 Cb 0.20 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.37 3i4k h TRP 60 CO 0.00 0.00 -0.72 2.35 -1.28 0.00 0.00 178.44 178.79 3i4k h TRP 61 N 0.00 0.35 0.00 0.12 7.01 -1.84 -3.44 115.95 118.15 3i4k h TRP 61 Ca 0.00 -0.26 0.00 0.00 2.11 0.00 0.00 58.89 60.74 3i4k h TRP 61 Cb 0.05 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 27.09 3i4k h TRP 61 CO 0.00 1.28 -0.04 0.41 -2.79 0.00 0.00 178.44 177.30 3i4k n GLY 62 N 1.65 -0.19 1.11 2.65 0.00 -1.12 -5.03 105.19 104.25 3i4k n GLY 62 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3i4k n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4k n GLY 63 N 0.00 0.92 3.65 -0.02 0.00 -0.19 -5.05 105.19 104.48 3i4k n GLY 63 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 3i4k n GLY 63 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i4k s GLU 64 N -0.63 2.36 0.19 1.61 2.02 -1.26 -4.95 118.70 118.04 3i4k s GLU 64 Ca 0.00 -1.01 -0.07 0.00 0.02 0.00 0.00 54.97 53.90 3i4k s GLU 64 Cb 0.00 -2.39 -0.02 0.00 0.10 0.00 0.00 34.13 31.82 3i4k s GLU 64 CO 0.00 0.49 0.27 -1.54 0.02 0.00 0.00 175.26 174.51 3i4k s SER 65 N -2.58 0.06 0.46 -0.19 1.04 -1.26 -3.55 113.70 107.68 3i4k s SER 65 Ca 0.25 -1.03 0.17 0.00 0.48 0.00 0.00 55.95 55.82 3i4k s SER 65 Cb -0.10 0.45 1.14 0.00 0.10 0.00 0.00 66.02 67.60 3i4k s SER 65 CO 0.17 -0.93 1.98 -0.37 0.98 0.00 0.00 173.24 175.08 3i4k h VAL 66 N 2.52 0.84 0.00 5.02 -1.51 -1.90 -1.61 116.25 119.62 3i4k h VAL 66 Ca -0.32 -0.10 -0.00 0.00 -1.23 0.00 0.00 66.70 65.06 3i4k h VAL 66 Cb 1.24 0.53 0.00 0.00 -2.13 0.00 0.00 31.29 30.92 3i4k h VAL 66 CO 0.47 0.05 -0.00 -0.33 -1.23 0.00 0.00 177.57 176.53 3i4k h GLU 67 N 0.29 -0.00 -0.77 5.19 3.07 -1.98 -1.71 114.58 118.67 3i4k h GLU 67 Ca 0.27 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 3i4k h GLU 67 Cb 0.69 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 3i4k h GLU 67 CO -0.06 0.50 0.00 2.41 -1.40 0.00 0.00 179.01 180.46 3i4k n THR 68 N -4.85 0.03 0.00 1.13 -1.04 -0.60 -2.02 114.28 106.92 3i4k n THR 68 Ca -0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 3i4k n THR 68 Cb 0.26 -0.23 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 3i4k n THR 68 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 3i4k n LYS 70 N 0.65 0.00 -0.32 -2.82 4.81 -0.64 -1.60 118.16 118.24 3i4k n LYS 70 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3i4k n LYS 70 Cb 0.03 0.00 0.13 0.00 0.02 0.00 0.00 35.03 35.20 3i4k n LYS 70 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3i4k h ALA 71 N 0.00 1.18 -0.22 3.14 0.00 -1.66 -0.70 119.26 120.99 3i4k h ALA 71 Ca 0.00 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 3i4k h ALA 71 Cb 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.52 3i4k h ALA 71 CO 0.00 0.36 -0.60 -0.07 0.00 0.00 0.00 179.25 178.93 3i4k h LEU 72 N 1.05 0.92 0.62 0.00 3.38 -1.58 -1.76 115.31 117.94 3i4k h LEU 72 Ca 0.36 -0.57 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 3i4k h LEU 72 Cb 0.08 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.57 3i4k h LEU 72 CO -0.14 1.33 -0.30 0.58 0.09 0.00 0.00 178.44 180.00 3i4k h VAL 73 N 0.55 0.33 -0.19 1.22 2.07 -1.72 0.12 116.25 118.62 3i4k h VAL 73 Ca -0.01 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 3i4k h VAL 73 Cb 1.22 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 3i4k h VAL 73 CO 0.13 0.02 -0.01 0.44 0.02 0.00 0.00 177.57 178.18 3i4k h ASP 74 N -0.97 0.34 0.77 0.57 3.32 -1.26 0.71 116.42 119.90 3i4k h ASP 74 Ca -0.09 -0.32 -0.15 0.00 0.02 0.00 0.00 57.03 56.50 3i4k h ASP 74 Cb 0.68 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 3i4k h ASP 74 CO 0.14 0.58 -0.71 1.23 -1.72 0.00 0.00 179.24 178.76 3i4k h GLY 75 N 0.10 0.00 0.00 2.75 0.00 -1.39 -3.42 103.07 101.11 3i4k h GLY 75 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 3i4k h GLY 75 CO 0.01 0.00 -0.37 -1.72 0.00 0.00 0.00 176.54 174.46 3i4k n TYR 76 N -3.63 0.00 0.05 5.60 4.02 0.13 -4.88 117.16 118.45 3i4k n TYR 76 Ca -0.01 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.78 3i4k n TYR 76 Cb 0.71 0.05 -0.08 0.00 -0.02 0.00 0.00 39.34 40.00 3i4k n TYR 76 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 3i4k h LEU 77 N 0.00 -0.18 -0.64 7.72 3.38 -0.69 -3.37 115.31 121.53 3i4k h LEU 77 Ca 0.00 -0.35 0.12 0.00 0.09 0.00 0.00 57.88 57.74 3i4k h LEU 77 Cb 0.37 0.05 -0.12 0.00 0.09 0.00 0.00 40.66 41.05 3i4k h LEU 77 CO 0.00 0.37 -0.28 0.00 0.09 0.00 0.00 178.44 178.62 3i4k h ALA 78 N -0.33 0.14 0.00 1.53 0.00 0.20 -1.71 119.26 119.09 3i4k h ALA 78 Ca -0.02 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3i4k h ALA 78 Cb 0.52 0.70 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3i4k h ALA 78 CO 0.04 -0.59 0.21 -1.00 0.00 0.00 0.00 179.25 177.91 3i4k h PRO 79 N -0.10 0.00 0.00 0.00 0.13 -1.79 -1.03 132.00 129.21 3i4k h PRO 79 Ca 0.27 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.22 3i4k h PRO 79 Cb 0.54 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.64 3i4k h PRO 79 CO -0.70 0.00 -0.85 0.28 -0.23 0.00 0.00 178.00 176.50 3i4k h VAL 80 N 0.00 1.57 0.05 1.56 2.07 -1.48 -3.33 116.25 116.69 3i4k h VAL 80 Ca 0.00 -2.97 -0.28 0.00 0.82 0.00 0.00 66.70 64.27 3i4k h VAL 80 Cb 0.41 2.62 0.03 0.00 -1.52 0.00 0.00 31.29 32.83 3i4k h VAL 80 CO 0.00 0.84 -1.13 -0.07 0.02 0.00 0.00 177.57 177.22 3i4k h LEU 81 N 0.00 0.91 -9.21 2.57 4.07 -1.29 -3.45 115.31 108.91 3i4k h LEU 81 Ca -0.01 -0.77 -0.69 0.00 0.08 0.00 0.00 57.88 56.48 3i4k h LEU 81 Cb 1.55 -0.28 0.02 0.00 1.08 0.00 0.00 40.66 43.03 3i4k h LEU 81 CO 0.11 1.57 0.92 -0.38 -1.08 0.00 0.00 178.44 179.58 3i4k n ILE 82 N -3.83 0.35 -0.14 1.22 5.41 -1.19 -1.70 119.36 119.47 3i4k n ILE 82 Ca -0.12 -0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.56 3i4k n ILE 82 Cb 0.93 -1.39 0.00 0.00 -0.71 0.00 0.00 39.64 38.47 3i4k n ILE 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3i4k n GLY 83 N 4.09 0.73 3.67 7.39 0.00 -0.24 -5.01 105.19 115.81 3i4k n GLY 83 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 3i4k n GLY 83 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i4k s ARG 84 N -0.72 2.58 0.26 1.61 0.52 -0.69 -4.83 118.95 117.68 3i4k s ARG 84 Ca 0.00 -0.78 -0.29 0.00 -0.52 0.00 0.00 55.73 54.13 3i4k s ARG 84 Cb 0.00 -2.55 -0.09 0.00 0.52 0.00 0.00 34.95 32.82 3i4k s ARG 84 CO 0.00 0.57 1.25 0.00 0.02 0.00 0.00 175.30 177.13 3i4k s ALA 85 N -1.21 3.48 -0.87 2.13 0.00 -1.26 -1.51 121.76 122.51 3i4k s ALA 85 Ca 0.23 1.09 0.11 0.00 0.00 0.00 0.00 51.96 53.39 3i4k s ALA 85 Cb -0.12 -3.44 0.48 0.00 0.00 0.00 0.00 23.12 20.04 3i4k s ALA 85 CO 0.15 -0.46 1.33 1.55 0.00 0.00 0.00 175.76 178.33 3i4k n VAL 86 N 1.67 1.36 1.84 0.00 3.14 -0.99 -0.41 118.33 124.94 3i4k n VAL 86 Ca 0.02 0.39 0.15 0.00 -2.96 0.00 0.00 64.34 61.94 3i4k n VAL 86 Cb 0.43 -1.28 0.88 0.00 -1.06 0.00 0.00 33.84 32.81 3i4k n VAL 86 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3i4k n SER 87 N -1.65 0.00 -1.47 6.55 3.41 -1.26 -1.88 113.62 117.32 3i4k n SER 87 Ca 0.02 -0.87 0.11 0.00 -0.26 0.00 0.00 58.87 57.86 3i4k n SER 87 Cb 0.10 -0.02 0.34 0.00 -0.26 0.00 0.00 64.21 64.37 3i4k n SER 87 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3i4k n GLU 88 N -1.02 3.11 -0.04 4.33 1.02 0.46 -4.78 120.64 123.72 3i4k n GLU 88 Ca 0.22 -2.76 -0.01 0.00 -0.02 0.00 0.00 57.16 54.59 3i4k n GLU 88 Cb 0.11 -1.70 -0.01 0.00 -0.02 0.00 0.00 31.44 29.83 3i4k n GLU 88 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 3i4k n LEU 89 N 1.49 -0.09 -0.16 -4.62 7.94 -0.79 -0.07 117.00 120.70 3i4k n LEU 89 Ca 0.25 0.57 0.10 0.00 -1.11 0.00 0.00 56.01 55.83 3i4k n LEU 89 Cb 0.73 -0.23 0.43 0.00 0.53 0.00 0.00 43.42 44.88 3i4k n LEU 89 CO 0.20 -0.33 1.21 0.00 -1.11 0.00 0.00 177.39 177.35 3i4k h ALA 90 N -0.37 1.89 -0.28 1.96 0.00 -1.88 -1.20 119.26 119.37 3i4k h ALA 90 Ca 0.01 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3i4k h ALA 90 Cb 0.03 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3i4k h ALA 90 CO -0.08 -0.04 -0.48 0.78 0.00 0.00 0.00 179.25 179.43 3i4k h GLY 91 N 0.58 0.82 -1.87 0.00 0.00 -0.85 -2.97 103.07 98.78 3i4k h GLY 91 Ca 0.33 -0.90 0.00 0.00 0.00 0.00 0.00 47.33 46.76 3i4k h GLY 91 CO -0.11 0.81 0.00 1.39 0.00 0.00 0.00 176.54 178.63 3i4k n ILE 92 N -4.01 0.24 0.00 2.60 5.41 0.11 -2.10 119.36 121.61 3i4k n ILE 92 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.72 3i4k n ILE 92 Cb 0.58 -0.57 0.00 0.00 -0.71 0.00 0.00 39.64 38.94 3i4k n ILE 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i4k n ALA 94 N 0.80 0.00 0.26 -1.39 0.00 -1.12 -1.94 120.51 117.12 3i4k n ALA 94 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 3i4k n ALA 94 Cb 0.13 0.00 0.57 0.00 0.00 0.00 0.00 19.45 20.15 3i4k n ALA 94 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3i4k h ASP 95 N 0.00 0.00 0.24 0.00 3.32 -1.72 -2.72 116.42 115.54 3i4k h ASP 95 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 3i4k h ASP 95 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3i4k h ASP 95 CO 0.00 0.05 -0.32 -0.07 -1.72 0.00 0.00 179.24 177.18 3i4k h LEU 96 N 0.00 0.12 -2.41 1.55 3.38 -1.68 -2.26 115.31 114.00 3i4k h LEU 96 Ca -0.00 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3i4k h LEU 96 Cb 0.63 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 3i4k h LEU 96 CO 0.01 0.43 -0.02 -0.33 0.09 0.00 0.00 178.44 178.62 3i4k h GLU 97 N 0.11 0.00 0.00 1.13 4.39 -1.65 0.03 114.58 118.59 3i4k h GLU 97 Ca 0.01 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.61 3i4k h GLU 97 Cb 0.62 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 3i4k h GLU 97 CO 0.04 0.02 -0.48 0.00 -1.16 0.00 0.00 179.01 177.44 3i4k h ARG 98 N 0.00 0.00 0.00 2.33 3.08 -1.55 -3.34 114.38 114.91 3i4k h ARG 98 Ca -0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.91 3i4k h ARG 98 Cb 0.06 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 3i4k h ARG 98 CO 0.00 0.48 -1.83 1.33 -1.07 0.00 0.00 179.97 178.88 3i4k n VAL 99 N -3.60 0.52 -3.68 2.04 0.24 -0.66 -4.96 118.33 108.22 3i4k n VAL 99 Ca -0.00 -0.48 -0.18 0.00 -2.04 0.00 0.00 64.34 61.64 3i4k n VAL 99 Cb 0.57 -0.27 -0.17 0.00 -1.47 0.00 0.00 33.84 32.50 3i4k n VAL 99 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3i4k s VAL 100 N -2.65 -0.14 0.26 3.34 1.01 -0.09 -5.04 120.40 117.09 3i4k s VAL 100 Ca -0.06 0.37 -0.07 0.00 0.00 0.00 0.00 61.98 62.22 3i4k s VAL 100 Cb 0.07 -0.19 -0.06 0.00 0.00 0.00 0.00 36.38 36.20 3i4k s VAL 100 CO 0.59 0.16 0.55 0.00 0.00 0.00 0.00 175.10 176.40 3i4k s ALA 101 N 2.02 3.59 0.00 5.51 0.00 -1.26 -4.18 121.76 127.44 3i4k s ALA 101 Ca 0.02 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.57 3i4k s ALA 101 Cb -0.12 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.63 3i4k s ALA 101 CO -0.04 0.37 0.00 0.54 0.00 0.00 0.00 175.76 176.63 3i4k n ARG 102 N -0.55 0.00 -3.89 0.00 1.74 -1.26 -4.87 116.66 107.83 3i4k n ARG 102 Ca -0.01 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.82 3i4k n ARG 102 Cb 0.53 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.96 3i4k n ARG 102 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3i4k n ALA 103 N 8.83 -2.05 -0.06 7.54 0.00 -1.26 -4.86 120.51 128.65 3i4k n ALA 103 Ca 0.00 -0.25 0.01 0.00 0.00 0.00 0.00 53.44 53.20 3i4k n ALA 103 Cb 0.00 -1.72 0.33 0.00 0.00 0.00 0.00 19.45 18.06 3i4k n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4k h ARG 104 N -1.85 0.65 -0.67 0.00 2.47 -1.89 -2.62 114.38 110.47 3i4k h ARG 104 Ca -0.63 -0.07 -0.05 0.00 -1.26 0.00 0.00 59.98 57.96 3i4k h ARG 104 Cb 1.37 -0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 29.53 3i4k h ARG 104 CO 0.60 0.51 0.22 1.88 0.56 0.00 0.00 179.97 183.74 3i4k h TYR 105 N 0.66 1.08 -0.27 3.04 0.05 -1.79 -0.10 116.97 119.64 3i4k h TYR 105 Ca 0.17 -0.10 -0.03 0.00 0.05 0.00 0.00 58.73 58.81 3i4k h TYR 105 Cb 0.07 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.48 3i4k h TYR 105 CO 0.00 0.86 0.06 0.00 -1.05 0.00 0.00 178.16 178.04 3i4k h ALA 106 N 1.09 0.36 -0.18 3.88 0.00 -1.83 -2.88 119.26 119.69 3i4k h ALA 106 Ca 0.22 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3i4k h ALA 106 Cb 0.29 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3i4k h ALA 106 CO -0.01 0.03 -0.03 0.87 0.00 0.00 0.00 179.25 180.11 3i4k h LYS 107 N 0.27 0.27 -0.47 0.00 1.57 -1.26 -2.80 116.57 114.15 3i4k h LYS 107 Ca 0.08 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.85 3i4k h LYS 107 Cb 0.30 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 3i4k h LYS 107 CO 0.00 0.32 0.26 0.00 -0.57 0.00 0.00 179.45 179.46 3i4k h ALA 108 N 1.71 0.60 -0.30 3.86 0.00 -0.79 -1.61 119.26 122.73 3i4k h ALA 108 Ca 0.06 0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3i4k h ALA 108 Cb 0.23 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 3i4k h ALA 108 CO 0.01 -0.07 -0.09 0.00 0.00 0.00 0.00 179.25 179.09 3i4k h ALA 109 N 1.23 0.17 -0.73 0.00 0.00 -1.49 -0.07 119.26 118.36 3i4k h ALA 109 Ca 0.20 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 3i4k h ALA 109 Cb 0.06 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 3i4k h ALA 109 CO -0.11 -0.48 0.44 0.28 0.00 0.00 0.00 179.25 179.37 3i4k h VAL 110 N -0.03 1.20 -0.21 0.00 2.07 -1.51 -1.68 116.25 116.09 3i4k h VAL 110 Ca 0.15 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 3i4k h VAL 110 Cb 0.25 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 3i4k h VAL 110 CO -0.32 0.21 -0.04 -0.78 0.02 0.00 0.00 177.57 176.66 3i4k h ASP 111 N 1.00 0.40 0.62 0.57 1.82 -0.38 -3.10 116.42 117.34 3i4k h ASP 111 Ca 0.26 -0.36 -0.06 0.00 -0.39 0.00 0.00 57.03 56.48 3i4k h ASP 111 Cb -0.04 -0.11 -0.01 0.00 0.68 0.00 0.00 39.33 39.85 3i4k h ASP 111 CO -0.05 0.67 -0.28 0.58 -1.61 0.00 0.00 179.24 178.54 3i4k h VAL 112 N 0.13 0.84 0.00 2.25 2.07 -0.80 -2.29 116.25 118.44 3i4k h VAL 112 Ca 0.05 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.43 3i4k h VAL 112 Cb 0.49 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 3i4k h VAL 112 CO 0.02 0.28 0.00 0.00 0.02 0.00 0.00 177.57 177.89 3i4k n ALA 113 N -2.32 2.32 0.00 1.67 0.00 -0.65 -1.71 120.51 119.82 3i4k n ALA 113 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3i4k n ALA 113 Cb 0.40 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.85 3i4k n ALA 113 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3i4k n HIS 115 N 0.51 0.00 -0.25 0.00 -0.00 -0.86 -1.04 115.22 113.58 3i4k n HIS 115 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.67 3i4k n HIS 115 Cb 0.39 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.43 3i4k n HIS 115 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.34 176.56 3i4k h ASP 116 N 0.00 0.83 -0.13 0.41 3.58 -1.61 0.13 116.42 119.64 3i4k h ASP 116 Ca 0.00 -0.06 -0.07 0.00 0.42 0.00 0.00 57.03 57.33 3i4k h ASP 116 Cb 0.00 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 40.84 3i4k h ASP 116 CO 0.00 0.64 -0.18 0.00 -2.88 0.00 0.00 179.24 176.82 3i4k h ALA 117 N 1.23 0.20 0.00 -0.78 0.00 -1.32 -1.71 119.26 116.87 3i4k h ALA 117 Ca 0.25 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 3i4k h ALA 117 Cb -0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3i4k h ALA 117 CO -0.05 0.12 -0.23 2.35 0.00 0.00 0.00 179.25 181.44 3i4k h TRP 118 N -0.04 0.00 0.02 0.00 7.01 -1.76 -1.84 115.95 119.34 3i4k h TRP 118 Ca 0.02 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 3i4k h TRP 118 Cb 0.73 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.79 3i4k h TRP 118 CO 0.09 0.23 -0.01 0.00 -2.79 0.00 0.00 178.44 175.97 3i4k h ALA 119 N 1.77 -0.02 -0.51 2.65 0.00 -0.66 -3.20 119.26 119.28 3i4k h ALA 119 Ca -0.00 -0.37 0.03 0.00 0.00 0.00 0.00 54.91 54.57 3i4k h ALA 119 Cb 0.61 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 3i4k h ALA 119 CO 0.03 -0.12 0.34 0.00 0.00 0.00 0.00 179.25 179.50 3i4k h ARG 120 N -0.81 0.58 0.00 0.00 3.08 -1.22 0.34 114.38 116.35 3i4k h ARG 120 Ca -0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3i4k h ARG 120 Cb 0.74 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.66 3i4k h ARG 120 CO 0.00 0.38 0.00 0.77 -1.07 0.00 0.00 179.97 180.06 3i4k h SER 121 N 0.60 0.00 -0.01 7.04 0.02 -1.40 -1.48 113.55 118.32 3i4k h SER 121 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 3i4k h SER 121 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 3i4k h SER 121 CO -0.05 0.00 -0.10 0.18 -1.14 0.00 0.00 176.83 175.72 3i4k n LEU 122 N -2.57 1.86 -1.04 5.07 4.77 -0.04 -4.97 117.00 120.08 3i4k n LEU 122 Ca 0.01 -0.92 -0.14 0.00 -0.03 0.00 0.00 56.01 54.94 3i4k n LEU 122 Cb 0.22 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 3i4k n LEU 122 CO 0.21 0.35 -0.13 -3.20 -1.33 0.00 0.00 177.39 173.29 3i4k n ASN 123 N 0.41 -5.20 -4.63 -1.43 5.15 -0.33 -4.98 115.26 104.25 3i4k n ASN 123 Ca 0.07 0.34 -0.28 0.00 -0.60 0.00 0.00 54.58 54.10 3i4k n ASN 123 Cb 0.31 -3.89 -0.09 0.00 -0.53 0.00 0.00 39.78 35.58 3i4k n ASN 123 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3i4k s VAL 124 N -2.31 3.59 0.78 3.44 -7.23 -0.91 -4.71 120.40 113.04 3i4k s VAL 124 Ca 0.00 -1.33 -0.13 0.00 -1.81 0.00 0.00 61.98 58.72 3i4k s VAL 124 Cb 0.00 -2.74 0.06 0.00 0.56 0.00 0.00 36.38 34.26 3i4k s VAL 124 CO 0.00 0.00 1.15 -2.84 -0.31 0.00 0.00 175.10 173.10 3i4k s PRO 125 N -2.57 1.99 0.20 4.82 0.02 -1.26 -2.14 135.00 136.05 3i4k s PRO 125 Ca 0.25 1.50 -0.11 0.00 0.02 0.00 0.00 61.00 62.66 3i4k s PRO 125 Cb -0.10 -1.84 0.16 0.00 0.02 0.00 0.00 34.50 32.74 3i4k s PRO 125 CO 0.16 -1.90 1.83 0.28 -0.33 0.00 0.00 177.00 177.05 3i4k h VAL 126 N -0.85 1.07 -0.46 3.83 2.07 -1.65 -2.12 116.25 118.14 3i4k h VAL 126 Ca -0.45 -0.26 0.13 0.00 0.82 0.00 0.00 66.70 66.94 3i4k h VAL 126 Cb 1.26 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 3i4k h VAL 126 CO 0.49 0.14 0.53 0.08 0.02 0.00 0.00 177.57 178.83 3i4k h ARG 127 N 0.77 0.00 0.00 1.57 0.11 -1.85 0.58 114.38 115.55 3i4k h ARG 127 Ca 0.26 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.34 3i4k h ARG 127 Cb 0.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.11 3i4k h ARG 127 CO -0.11 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.71 3i4k n ASP 128 N -3.61 0.00 0.01 0.08 9.92 -0.80 -1.49 116.55 120.66 3i4k n ASP 128 Ca 0.09 0.24 0.11 0.00 -0.53 0.00 0.00 54.79 54.70 3i4k n ASP 128 Cb 0.72 -0.40 -0.00 0.00 -0.64 0.00 0.00 41.12 40.79 3i4k n ASP 128 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3i4k n LEU 129 N -1.40 0.69 -1.26 0.64 4.77 0.20 -4.19 117.00 116.46 3i4k n LEU 129 Ca 0.08 -0.20 -0.04 0.00 -0.03 0.00 0.00 56.01 55.82 3i4k n LEU 129 Cb 0.23 -0.08 0.21 0.00 -2.33 0.00 0.00 43.42 41.45 3i4k n LEU 129 CO 0.20 0.14 0.77 0.18 -1.33 0.00 0.00 177.39 177.35 3i4k n LEU 130 N -1.72 4.43 0.00 2.23 4.77 -0.65 -4.94 117.00 121.12 3i4k n LEU 130 Ca 0.03 -3.61 0.00 0.00 -0.03 0.00 0.00 56.01 52.40 3i4k n LEU 130 Cb 0.39 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 3i4k n LEU 130 CO 0.41 1.12 0.00 0.61 -1.33 0.00 0.00 177.39 178.20 3i4k n GLY 131 N -0.99 2.33 0.00 -0.72 0.00 -1.19 -4.83 105.19 99.79 3i4k n GLY 131 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.36 3i4k n GLY 131 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4k n GLY 132 N -1.27 -0.40 3.47 -0.02 0.00 -0.56 -5.00 105.19 101.42 3i4k n GLY 132 Ca 0.00 -2.17 -0.33 0.00 0.00 0.00 0.00 46.02 43.52 3i4k n GLY 132 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3i4k s THR 133 N 0.00 3.31 -0.06 2.61 -4.23 -1.26 -3.98 115.64 112.03 3i4k s THR 133 Ca 0.00 -0.60 0.07 0.00 -1.18 0.00 0.00 61.69 59.98 3i4k s THR 133 Cb 0.00 -2.36 -0.10 0.00 1.34 0.00 0.00 72.50 71.38 3i4k s THR 133 CO 0.00 0.56 0.06 0.52 -0.54 0.00 0.00 174.62 175.22 3i4k n VAL 134 N 2.78 0.41 -3.61 2.29 0.31 0.20 -4.98 118.33 115.74 3i4k n VAL 134 Ca -0.18 -0.30 -0.12 0.00 -0.01 0.00 0.00 64.34 63.74 3i4k n VAL 134 Cb 0.53 -0.55 -0.05 0.00 -0.91 0.00 0.00 33.84 32.86 3i4k n VAL 134 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i4k s ARG 135 N -2.27 1.05 -0.00 5.55 1.70 -1.10 -5.06 118.95 118.81 3i4k s ARG 135 Ca -0.04 -0.52 0.01 0.00 -0.47 0.00 0.00 55.73 54.71 3i4k s ARG 135 Cb 0.03 0.47 0.02 0.00 -0.57 0.00 0.00 34.95 34.90 3i4k s ARG 135 CO 0.32 -0.40 1.01 -0.40 -1.08 0.00 0.00 175.30 174.75 3i4k n ASP 136 N 0.04 2.04 -3.47 -2.89 5.68 -1.26 -4.59 116.55 112.10 3i4k n ASP 136 Ca -0.17 -2.02 -0.14 0.00 -0.50 0.00 0.00 54.79 51.96 3i4k n ASP 136 Cb 0.62 -0.02 -0.03 0.00 -1.14 0.00 0.00 41.12 40.55 3i4k n ASP 136 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 3i4k s LYS 137 N -1.04 1.15 0.03 0.11 -2.85 -1.26 -1.83 119.74 114.06 3i4k s LYS 137 Ca 0.01 -0.19 -0.01 0.00 -1.00 0.00 0.00 55.97 54.79 3i4k s LYS 137 Cb 0.01 0.53 -0.03 0.00 -2.06 0.00 0.00 37.83 36.28 3i4k s LYS 137 CO 0.01 -0.45 -0.03 0.14 0.10 0.00 0.00 175.35 175.12 3i4k s VAL 138 N -2.74 0.16 0.64 1.79 -7.23 -0.60 -4.96 120.40 107.46 3i4k s VAL 138 Ca -0.03 -1.33 -0.14 0.00 -1.81 0.00 0.00 61.98 58.67 3i4k s VAL 138 Cb -0.01 -0.86 -0.01 0.00 0.56 0.00 0.00 36.38 36.06 3i4k s VAL 138 CO -0.04 -0.73 1.07 -1.81 -0.31 0.00 0.00 175.10 173.27 3i4k s ASP 139 N -2.15 5.52 -0.05 4.85 1.01 -1.26 -0.91 116.67 123.67 3i4k s ASP 139 Ca -0.05 1.78 0.01 0.00 0.71 0.00 0.00 52.55 55.00 3i4k s ASP 139 Cb -0.01 -2.52 0.02 0.00 1.01 0.00 0.00 42.92 41.42 3i4k s ASP 139 CO -0.05 -1.35 -0.04 -0.69 0.21 0.00 0.00 175.17 173.25 3i4k s VAL 140 N -2.64 0.52 -0.18 -1.27 1.01 0.20 -2.37 120.40 115.67 3i4k s VAL 140 Ca 0.62 -0.10 -0.14 0.00 0.00 0.00 0.00 61.98 62.36 3i4k s VAL 140 Cb -0.16 -0.56 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 3i4k s VAL 140 CO 0.44 0.23 0.32 -0.89 0.00 0.00 0.00 175.10 175.19 3i4k s THR 141 N 1.03 5.28 -0.17 3.92 2.01 -0.07 -4.43 115.64 123.20 3i4k s THR 141 Ca -0.09 0.57 -0.15 0.00 0.31 0.00 0.00 61.69 62.33 3i4k s THR 141 Cb -0.14 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 3i4k s THR 141 CO -0.01 0.34 0.36 0.86 -0.69 0.00 0.00 174.62 175.48 3i4k s TRP 142 N 0.77 3.43 -0.13 4.92 -0.11 -0.86 -4.55 118.94 122.41 3i4k s TRP 142 Ca 0.17 0.63 -0.07 0.00 1.22 0.00 0.00 56.10 58.05 3i4k s TRP 142 Cb -0.14 -2.44 -0.04 0.00 -1.50 0.00 0.00 33.47 29.35 3i4k s TRP 142 CO 0.05 0.13 0.12 0.00 -4.62 0.00 0.00 176.95 172.63 3i4k s ALA 143 N 0.84 3.78 -0.27 5.86 0.00 -1.26 -1.39 121.76 129.31 3i4k s ALA 143 Ca 0.19 -0.67 -0.06 0.00 0.00 0.00 0.00 51.96 51.42 3i4k s ALA 143 Cb -0.14 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.05 3i4k s ALA 143 CO 0.06 0.55 0.04 -0.51 0.00 0.00 0.00 175.76 175.91 3i4k s LEU 144 N -0.82 3.55 0.00 0.00 1.02 0.11 -4.93 118.68 117.61 3i4k s LEU 144 Ca 0.14 -0.59 -0.06 0.00 0.02 0.00 0.00 54.13 53.63 3i4k s LEU 144 Cb -0.12 -1.84 0.09 0.00 0.02 0.00 0.00 46.19 44.35 3i4k s LEU 144 CO 0.03 -0.13 0.26 0.61 0.02 0.00 0.00 176.35 177.14 3i4k n GLY 145 N 4.84 -3.23 3.67 -3.19 0.00 -1.26 -1.59 105.19 104.43 3i4k n GLY 145 Ca -0.16 -1.34 -0.45 0.00 0.00 0.00 0.00 46.02 44.07 3i4k n GLY 145 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3i4k n VAL 146 N -3.50 0.59 -3.64 1.61 3.14 -1.07 -4.57 118.33 110.90 3i4k n VAL 146 Ca 0.04 -0.11 -0.15 0.00 -2.96 0.00 0.00 64.34 61.16 3i4k n VAL 146 Cb 0.16 -2.05 -0.08 0.00 -1.06 0.00 0.00 33.84 30.82 3i4k n VAL 146 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 3i4k s LEU 147 N 3.86 -0.28 1.01 6.55 1.43 -1.26 -4.69 118.68 125.30 3i4k s LEU 147 Ca 0.89 0.95 -0.12 0.00 -1.03 0.00 0.00 54.13 54.82 3i4k s LEU 147 Cb -0.57 2.12 0.18 0.00 0.03 0.00 0.00 46.19 47.94 3i4k s LEU 147 CO 0.46 -0.35 0.96 -2.65 0.23 0.00 0.00 176.35 174.99 3i4k n PRO 148 N 2.06 -1.11 0.00 1.29 -0.02 -1.26 -4.73 135.00 131.23 3i4k n PRO 148 Ca -0.16 -0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.05 3i4k n PRO 148 Cb 0.56 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 3i4k n PRO 148 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3i4k n LEU 149 N -3.98 0.00 -0.34 2.45 7.94 -1.26 -2.44 117.00 119.37 3i4k n LEU 149 Ca 0.08 0.86 0.01 0.00 -1.11 0.00 0.00 56.01 55.86 3i4k n LEU 149 Cb 0.53 -0.36 0.15 0.00 0.53 0.00 0.00 43.42 44.27 3i4k n LEU 149 CO 0.52 -0.36 1.23 0.44 -1.11 0.00 0.00 177.39 178.11 3i4k h ASP 150 N 0.00 0.95 -0.36 1.96 5.19 -1.99 -2.21 116.42 119.96 3i4k h ASP 150 Ca 0.00 0.01 0.07 0.00 -0.62 0.00 0.00 57.03 56.49 3i4k h ASP 150 Cb 0.00 -0.19 -0.09 0.00 0.18 0.00 0.00 39.33 39.23 3i4k h ASP 150 CO 0.00 0.62 -0.35 0.58 -3.12 0.00 0.00 179.24 176.97 3i4k h VAL 151 N 1.09 0.21 -0.36 -1.35 2.07 -1.88 -1.56 116.25 114.48 3i4k h VAL 151 Ca 0.40 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.79 3i4k h VAL 151 Cb 0.14 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 3i4k h VAL 151 CO -0.16 0.00 -0.26 0.00 0.02 0.00 0.00 177.57 177.17 3i4k h ALA 152 N 0.65 0.52 -0.73 1.67 0.00 -1.28 -2.55 119.26 117.54 3i4k h ALA 152 Ca 0.16 -0.40 0.19 0.00 0.00 0.00 0.00 54.91 54.86 3i4k h ALA 152 Cb 0.55 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3i4k h ALA 152 CO -0.52 0.52 0.51 0.28 0.00 0.00 0.00 179.25 180.04 3i4k h VAL 153 N 0.61 0.69 0.21 0.00 2.07 -0.92 -0.34 116.25 118.57 3i4k h VAL 153 Ca 0.07 -0.05 -0.30 0.00 0.82 0.00 0.00 66.70 67.24 3i4k h VAL 153 Cb 0.83 0.53 0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3i4k h VAL 153 CO 0.07 0.03 -1.29 0.00 0.02 0.00 0.00 177.57 176.40 3i4k h ALA 154 N 1.65 -0.12 -0.80 1.67 0.00 -1.10 -3.26 119.26 117.29 3i4k h ALA 154 Ca 0.36 -0.80 0.03 0.00 0.00 0.00 0.00 54.91 54.49 3i4k h ALA 154 Cb 1.19 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.08 3i4k h ALA 154 CO -0.05 0.61 0.52 1.49 0.00 0.00 0.00 179.25 181.81 3i4k h GLU 155 N 0.05 0.98 0.44 0.00 4.81 -0.69 -2.02 114.58 118.15 3i4k h GLU 155 Ca -0.22 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.94 3i4k h GLU 155 Cb 2.00 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 31.15 3i4k h GLU 155 CO 0.24 0.65 -0.35 0.82 -0.73 0.00 0.00 179.01 179.64 3i4k h ILE 156 N 1.01 0.29 -0.63 2.32 2.04 -1.40 0.10 117.51 121.24 3i4k h ILE 156 Ca 0.32 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.31 3i4k h ILE 156 Cb -0.00 0.29 -0.11 0.00 -0.74 0.00 0.00 36.82 36.25 3i4k h ILE 156 CO -0.11 0.00 -0.10 -0.33 0.00 0.00 0.00 178.15 177.61 3i4k h GLU 157 N -0.78 0.04 -0.26 2.37 4.39 -1.54 0.74 114.58 119.53 3i4k h GLU 157 Ca -0.04 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.66 3i4k h GLU 157 Cb 0.67 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 3i4k h GLU 157 CO -0.01 0.02 0.17 1.49 -1.16 0.00 0.00 179.01 179.52 3i4k h GLU 158 N 0.04 0.33 -0.53 2.33 4.81 -1.00 -2.45 114.58 118.11 3i4k h GLU 158 Ca 0.31 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 3i4k h GLU 158 Cb 0.50 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 3i4k h GLU 158 CO -0.61 0.22 0.35 0.00 -0.73 0.00 0.00 179.01 178.24 3i4k h ARG 159 N 0.34 0.70 -0.29 1.92 2.47 0.74 -0.60 114.38 119.67 3i4k h ARG 159 Ca 0.10 -0.05 0.03 0.00 -1.26 0.00 0.00 59.98 58.80 3i4k h ARG 159 Cb -0.03 -0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 28.11 3i4k h ARG 159 CO -0.03 0.47 0.11 0.82 0.56 0.00 0.00 179.97 181.90 3i4k h ILE 160 N 0.72 0.93 0.13 2.04 2.04 -0.77 0.11 117.51 122.71 3i4k h ILE 160 Ca 0.19 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 3i4k h ILE 160 Cb -0.07 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 3i4k h ILE 160 CO -0.04 0.04 -0.06 -0.08 0.00 0.00 0.00 178.15 178.01 3i4k h GLU 161 N 0.24 -0.17 0.12 2.37 4.22 -1.18 -0.37 114.58 119.81 3i4k h GLU 161 Ca 0.13 0.01 -0.28 0.00 0.08 0.00 0.00 59.36 59.29 3i4k h GLU 161 Cb 0.09 0.04 0.03 0.00 0.50 0.00 0.00 28.75 29.40 3i4k h GLU 161 CO -0.12 0.10 -1.18 1.49 -2.18 0.00 0.00 179.01 177.11 3i4k h GLU 162 N -0.42 0.60 0.00 1.92 4.81 -1.07 -3.39 114.58 117.02 3i4k h GLU 162 Ca -0.02 -0.80 0.00 0.00 -0.13 0.00 0.00 59.36 58.41 3i4k h GLU 162 Cb 0.34 0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.98 3i4k h GLU 162 CO 0.03 1.36 -0.60 1.19 -0.73 0.00 0.00 179.01 180.26 3i4k n PHE 163 N -3.84 0.00 -2.06 0.92 3.72 0.16 -4.85 117.46 111.51 3i4k n PHE 163 Ca -0.14 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.12 3i4k n PHE 163 Cb 0.96 -0.03 -0.02 0.00 -0.94 0.00 0.00 39.48 39.44 3i4k n PHE 163 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3i4k n GLY 164 N 1.62 0.22 3.78 1.37 0.00 -0.01 0.41 105.19 112.57 3i4k n GLY 164 Ca 0.00 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 3i4k n GLY 164 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i4k s ASN 165 N -2.47 6.27 0.00 1.61 -0.87 -1.25 -1.42 114.94 116.81 3i4k s ASN 165 Ca 0.00 2.99 0.18 0.00 -1.57 0.00 0.00 52.86 54.46 3i4k s ASN 165 Cb 0.00 -2.66 -0.08 0.00 -0.02 0.00 0.00 41.25 38.48 3i4k s ASN 165 CO 0.00 -0.92 0.86 0.54 -2.57 0.00 0.00 177.10 175.01 3i4k n ARG 166 N 0.33 1.41 -4.18 -0.60 1.74 -1.26 -4.63 116.66 109.47 3i4k n ARG 166 Ca 0.02 -0.52 -0.17 0.00 -0.77 0.00 0.00 57.85 56.41 3i4k n ARG 166 Cb 0.40 -1.34 -0.15 0.00 -1.02 0.00 0.00 32.46 30.36 3i4k n ARG 166 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3i4k s SER 167 N -2.33 0.70 -0.07 0.55 1.04 -1.26 -2.09 113.70 110.24 3i4k s SER 167 Ca 0.12 -0.11 0.03 0.00 0.48 0.00 0.00 55.95 56.47 3i4k s SER 167 Cb 0.14 -0.12 0.01 0.00 0.10 0.00 0.00 66.02 66.15 3i4k s SER 167 CO 0.57 0.05 -0.17 -0.36 0.98 0.00 0.00 173.24 174.31 3i4k s PHE 168 N 0.00 1.88 -0.24 5.02 0.08 0.57 -2.03 117.98 123.25 3i4k s PHE 168 Ca 0.00 -0.70 -0.08 0.00 0.12 0.00 0.00 56.93 56.28 3i4k s PHE 168 Cb -0.04 -1.30 -0.04 0.00 -0.57 0.00 0.00 43.02 41.07 3i4k s PHE 168 CO -0.00 -0.30 0.10 0.21 -0.10 0.00 0.00 175.22 175.12 3i4k s LYS 169 N 0.43 3.81 -0.27 0.44 2.20 -0.49 -0.96 119.74 124.90 3i4k s LYS 169 Ca -0.14 -0.41 -0.09 0.00 -0.36 0.00 0.00 55.97 54.97 3i4k s LYS 169 Cb -0.16 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 32.76 3i4k s LYS 169 CO 0.05 -0.06 0.13 -0.51 -0.36 0.00 0.00 175.35 174.60 3i4k s LEU 170 N 1.31 3.79 0.67 5.43 1.43 0.71 0.05 118.68 132.06 3i4k s LEU 170 Ca 0.05 -0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 52.83 3i4k s LEU 170 Cb -0.15 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.06 3i4k s LEU 170 CO 0.04 -0.08 1.05 -0.54 0.23 0.00 0.00 176.35 177.06 3i4k s LYS 171 N 1.66 3.14 0.00 1.70 1.02 -0.62 -1.83 119.74 124.81 3i4k s LYS 171 Ca 0.06 0.92 0.00 0.00 0.02 0.00 0.00 55.97 56.97 3i4k s LYS 171 Cb -0.16 -2.02 0.00 0.00 -0.52 0.00 0.00 37.83 35.14 3i4k s LYS 171 CO 0.07 -0.94 0.00 0.41 -0.92 0.00 0.00 175.35 173.97 3i4k n GLY 173 N -2.11 0.75 3.72 -3.33 0.00 -1.26 -4.31 105.19 98.65 3i4k n GLY 173 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3i4k n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4k s ALA 174 N -2.21 3.33 0.00 4.61 0.00 -1.26 -4.72 121.76 121.51 3i4k s ALA 174 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.12 3i4k s ALA 174 Cb 0.00 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.15 3i4k s ALA 174 CO 0.00 -0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.07 3i4k n GLY 175 N 3.05 0.65 3.58 0.00 0.00 -1.26 -4.74 105.19 106.47 3i4k n GLY 175 Ca -0.01 -0.85 -0.51 0.00 0.00 0.00 0.00 46.02 44.65 3i4k n GLY 175 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3i4k n ASP 176 N -3.04 1.41 -0.09 1.61 2.03 -1.26 -4.87 116.55 112.34 3i4k n ASP 176 Ca 0.00 1.13 -0.10 0.00 0.52 0.00 0.00 54.79 56.34 3i4k n ASP 176 Cb 0.00 -1.18 -0.03 0.00 -0.72 0.00 0.00 41.12 39.19 3i4k n ASP 176 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3i4k h PRO 177 N 4.03 0.44 -0.73 -0.67 0.11 -1.96 -0.98 132.00 132.24 3i4k h PRO 177 Ca -0.46 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 65.56 3i4k h PRO 177 Cb 1.34 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.35 3i4k h PRO 177 CO 0.74 0.49 0.46 0.00 -0.21 0.00 0.00 178.00 179.48 3i4k h ALA 178 N 0.93 0.92 -0.50 -0.75 0.00 -1.98 0.35 119.26 118.24 3i4k h ALA 178 Ca 0.09 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 3i4k h ALA 178 Cb 0.22 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3i4k h ALA 178 CO -0.00 0.37 -0.09 0.93 0.00 0.00 0.00 179.25 180.45 3i4k h GLU 179 N 0.99 0.94 -0.64 0.00 5.08 -1.92 0.14 114.58 119.17 3i4k h GLU 179 Ca 0.26 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 3i4k h GLU 179 Cb -0.07 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 3i4k h GLU 179 CO -0.05 1.01 0.35 0.22 -1.00 0.00 0.00 179.01 179.54 3i4k h ASP 180 N 0.80 0.79 0.00 1.42 3.58 -0.53 -1.65 116.42 120.84 3i4k h ASP 180 Ca 0.13 -0.09 -0.00 0.00 0.42 0.00 0.00 57.03 57.49 3i4k h ASP 180 Cb 0.65 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.49 3i4k h ASP 180 CO 0.04 0.66 -0.00 0.74 -2.88 0.00 0.00 179.24 177.80 3i4k h THR 181 N 0.87 1.32 -0.74 2.25 2.02 -0.10 -2.78 112.91 115.75 3i4k h THR 181 Ca 0.22 -0.93 0.16 0.00 0.77 0.00 0.00 66.41 66.63 3i4k h THR 181 Cb 0.04 1.95 -0.11 0.00 -1.74 0.00 0.00 68.15 68.29 3i4k h THR 181 CO -0.04 0.24 0.21 -0.09 0.37 0.00 0.00 175.52 176.21 3i4k h ARG 182 N -0.40 0.30 0.22 6.66 9.65 -0.87 0.34 114.38 130.28 3i4k h ARG 182 Ca -0.00 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 3i4k h ARG 182 Cb 0.40 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 28.91 3i4k h ARG 182 CO 0.00 0.20 -0.17 -0.09 2.80 0.00 0.00 179.97 182.71 3i4k h ARG 183 N 0.31 -0.36 -0.56 0.20 2.43 -1.25 -1.63 114.38 113.52 3i4k h ARG 183 Ca 0.41 0.02 0.11 0.00 -0.81 0.00 0.00 59.98 59.72 3i4k h ARG 183 Cb 0.69 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.29 3i4k h ARG 183 CO -0.48 -0.24 0.38 0.28 -1.51 0.00 0.00 179.97 178.40 3i4k h VAL 184 N -0.37 0.85 -0.20 0.20 2.07 -1.17 -0.93 116.25 116.70 3i4k h VAL 184 Ca -0.03 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 3i4k h VAL 184 Cb 0.31 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3i4k h VAL 184 CO 0.01 0.05 0.10 0.00 0.02 0.00 0.00 177.57 177.75 3i4k h ALA 185 N 1.72 0.26 0.02 1.67 0.00 -0.08 0.93 119.26 123.79 3i4k h ALA 185 Ca 0.26 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3i4k h ALA 185 Cb 0.66 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3i4k h ALA 185 CO -0.06 -0.19 -0.01 0.93 0.00 0.00 0.00 179.25 179.92 3i4k h GLU 186 N 0.21 -0.03 -0.34 0.00 5.08 -0.39 -2.29 114.58 116.82 3i4k h GLU 186 Ca 0.07 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.53 3i4k h GLU 186 Cb 0.09 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3i4k h GLU 186 CO -0.01 0.32 0.32 1.25 -1.00 0.00 0.00 179.01 179.89 3i4k h LEU 187 N -0.39 0.00 0.52 1.33 6.46 -1.15 -1.45 115.31 120.63 3i4k h LEU 187 Ca -0.00 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.73 3i4k h LEU 187 Cb 0.37 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.30 3i4k h LEU 187 CO 0.01 0.00 -0.25 0.00 -0.62 0.00 0.00 178.44 177.58 3i4k h ALA 188 N 1.68 -0.69 -0.20 1.25 0.00 -0.26 -2.68 119.26 118.36 3i4k h ALA 188 Ca 0.16 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3i4k h ALA 188 Cb 0.80 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 3i4k h ALA 188 CO -0.00 -0.69 0.00 0.00 0.00 0.00 0.00 179.25 178.56 3i4k h ARG 189 N -1.10 0.28 -0.15 0.00 3.08 -0.98 0.54 114.38 116.06 3i4k h ARG 189 Ca -0.07 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 3i4k h ARG 189 Cb 0.59 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 3i4k h ARG 189 CO 0.12 0.31 0.06 0.93 -1.07 0.00 0.00 179.97 180.31 3i4k h GLU 190 N 0.28 0.23 0.00 0.04 5.08 -1.32 -3.41 114.58 115.47 3i4k h GLU 190 Ca 0.07 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3i4k h GLU 190 Cb 0.19 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3i4k h GLU 190 CO 0.00 0.32 0.00 0.28 -1.00 0.00 0.00 179.01 178.62 3i4k n VAL 191 N -4.87 0.00 0.00 3.13 0.31 -1.01 -4.85 118.33 111.04 3i4k n VAL 191 Ca -0.05 0.43 0.00 0.00 -0.01 0.00 0.00 64.34 64.71 3i4k n VAL 191 Cb 0.12 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 3i4k n VAL 191 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i4k n GLY 192 N 1.65 0.00 0.32 2.92 0.00 0.19 -2.06 105.19 108.20 3i4k n GLY 192 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 3i4k n GLY 192 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3i4k h ASP 193 N 0.00 -0.97 0.61 1.61 3.32 -1.85 -2.67 116.42 116.47 3i4k h ASP 193 Ca 0.00 0.24 -0.13 0.00 0.02 0.00 0.00 57.03 57.16 3i4k h ASP 193 Cb 0.00 0.55 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 3i4k h ASP 193 CO 0.00 -0.28 -0.61 0.03 -1.72 0.00 0.00 179.24 176.66 3i4k h ARG 194 N -0.06 0.00 -4.84 3.56 3.08 -1.79 -3.47 114.38 110.85 3i4k h ARG 194 Ca 0.32 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 60.05 3i4k h ARG 194 Cb 0.57 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 30.47 3i4k h ARG 194 CO -0.78 0.61 -0.63 0.14 -1.07 0.00 0.00 179.97 178.24 3i4k s VAL 195 N -3.62 0.57 -0.28 2.04 -7.23 -1.01 -5.04 120.40 105.83 3i4k s VAL 195 Ca -0.01 -1.99 -0.23 0.00 -1.81 0.00 0.00 61.98 57.93 3i4k s VAL 195 Cb 0.13 -2.46 -0.00 0.00 0.56 0.00 0.00 36.38 34.61 3i4k s VAL 195 CO 0.76 -0.16 0.77 -0.55 -0.31 0.00 0.00 175.10 175.61 3i4k s SER 196 N -3.26 6.68 -0.12 4.85 0.15 -0.89 -4.59 113.70 116.52 3i4k s SER 196 Ca 0.33 0.74 -0.04 0.00 0.70 0.00 0.00 55.95 57.68 3i4k s SER 196 Cb 0.07 -2.40 -0.04 0.00 -1.71 0.00 0.00 66.02 61.95 3i4k s SER 196 CO 0.10 -0.55 0.03 -0.76 1.20 0.00 0.00 173.24 173.26 3i4k s LEU 197 N 2.85 3.74 0.18 3.45 1.43 -1.26 -0.32 118.68 128.75 3i4k s LEU 197 Ca 0.32 0.16 0.02 0.00 -1.03 0.00 0.00 54.13 53.59 3i4k s LEU 197 Cb -0.15 -1.89 -0.05 0.00 0.03 0.00 0.00 46.19 44.14 3i4k s LEU 197 CO 0.11 0.32 0.00 -0.13 0.23 0.00 0.00 176.35 176.88 3i4k s ARG 198 N -0.51 1.13 0.11 1.70 3.00 -0.13 -0.80 118.95 123.45 3i4k s ARG 198 Ca 0.10 -1.55 0.03 0.00 0.00 0.00 0.00 55.73 54.30 3i4k s ARG 198 Cb -0.12 -0.28 -0.04 0.00 0.00 0.00 0.00 34.95 34.51 3i4k s ARG 198 CO 0.02 -0.13 -0.08 0.96 0.00 0.00 0.00 175.30 176.07 3i4k s ILE 199 N -3.65 0.83 -0.10 1.52 -5.25 -0.63 -0.21 121.20 113.71 3i4k s ILE 199 Ca 0.25 -1.89 -0.05 0.00 -0.99 0.00 0.00 60.65 57.97 3i4k s ILE 199 Cb 0.06 -1.64 0.05 0.00 2.95 0.00 0.00 42.46 43.88 3i4k s ILE 199 CO 0.04 -0.78 0.22 -0.62 -1.79 0.00 0.00 174.94 172.01 3i4k s ASP 200 N -2.94 -0.10 -0.07 4.36 -1.08 -0.76 -0.42 116.67 115.67 3i4k s ASP 200 Ca 0.11 0.47 0.10 0.00 -0.52 0.00 0.00 52.55 52.72 3i4k s ASP 200 Cb 0.03 0.39 0.25 0.00 -1.46 0.00 0.00 42.92 42.13 3i4k s ASP 200 CO -0.03 -0.18 1.19 -0.38 0.52 0.00 0.00 175.17 176.29 3i4k n ILE 201 N 4.43 1.46 -4.45 4.11 5.41 -1.15 -4.34 119.36 124.83 3i4k n ILE 201 Ca -0.22 -1.47 -0.38 0.00 1.00 0.00 0.00 62.75 61.68 3i4k n ILE 201 Cb 0.52 0.18 -0.09 0.00 -0.71 0.00 0.00 39.64 39.55 3i4k n ILE 201 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3i4k n ASN 202 N -0.45 -0.76 -3.35 4.38 3.02 -1.16 -0.05 115.26 116.89 3i4k n ASN 202 Ca 0.11 -1.25 -0.24 0.00 -0.03 0.00 0.00 54.58 53.17 3i4k n ASN 202 Cb 0.51 -1.64 0.01 0.00 -0.61 0.00 0.00 39.78 38.05 3i4k n ASN 202 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3i4k n ALA 203 N -4.28 -1.07 0.58 5.41 0.00 0.69 -4.87 120.51 116.98 3i4k n ALA 203 Ca -0.06 0.15 0.12 0.00 0.00 0.00 0.00 53.44 53.65 3i4k n ALA 203 Cb 0.55 -3.31 0.16 0.00 0.00 0.00 0.00 19.45 16.85 3i4k n ALA 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3i4k n ARG 204 N -3.94 2.38 -4.26 0.00 5.12 0.93 -4.16 116.66 112.73 3i4k n ARG 204 Ca -0.03 -2.11 -0.31 0.00 -1.93 0.00 0.00 57.85 53.47 3i4k n ARG 204 Cb 0.56 -1.48 -0.09 0.00 -1.16 0.00 0.00 32.46 30.29 3i4k n ARG 204 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 3i4k s TRP 205 N -1.67 2.97 0.63 -1.55 0.52 -0.99 -5.02 118.94 113.82 3i4k s TRP 205 Ca 0.33 -0.01 -0.06 0.00 0.02 0.00 0.00 56.10 56.39 3i4k s TRP 205 Cb 0.21 -1.59 0.03 0.00 -1.15 0.00 0.00 33.47 30.97 3i4k s TRP 205 CO 0.30 0.45 0.93 0.16 0.02 0.00 0.00 176.95 178.81 3i4k s ASP 206 N -1.87 5.29 0.18 2.95 1.47 -1.26 -4.13 116.67 119.31 3i4k s ASP 206 Ca 0.22 0.57 -0.18 0.00 1.18 0.00 0.00 52.55 54.34 3i4k s ASP 206 Cb -0.11 -1.44 0.13 0.00 -0.34 0.00 0.00 42.92 41.16 3i4k s ASP 206 CO 0.13 -1.26 1.63 -0.09 0.68 0.00 0.00 175.17 176.26 3i4k h ARG 207 N -0.31 -0.09 -0.87 2.11 2.43 -1.99 -2.01 114.38 113.64 3i4k h ARG 207 Ca -0.45 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.73 3i4k h ARG 207 Cb 1.28 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.81 3i4k h ARG 207 CO 0.60 -0.06 0.53 -0.09 -1.51 0.00 0.00 179.97 179.44 3i4k h ARG 208 N -0.10 1.17 -0.17 0.20 2.43 -1.99 -2.06 114.38 113.86 3i4k h ARG 208 Ca 0.22 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 3i4k h ARG 208 Cb 0.44 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 3i4k h ARG 208 CO -0.53 0.82 0.08 1.15 -1.51 0.00 0.00 179.97 179.97 3i4k h THR 209 N 1.19 1.14 -0.33 0.20 2.02 -1.79 -2.09 112.91 113.25 3i4k h THR 209 Ca 0.31 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 67.09 3i4k h THR 209 Cb -0.06 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 3i4k h THR 209 CO -0.06 0.13 0.20 0.00 0.37 0.00 0.00 175.52 176.16 3i4k h ALA 210 N 0.94 0.42 0.00 6.16 0.00 -1.19 -1.16 119.26 124.43 3i4k h ALA 210 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3i4k h ALA 210 Cb 0.14 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3i4k h ALA 210 CO -0.01 -0.10 -0.14 -0.07 0.00 0.00 0.00 179.25 178.93 3i4k h LEU 211 N 0.43 0.00 0.04 0.00 3.38 -1.31 -0.32 115.31 117.53 3i4k h LEU 211 Ca 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3i4k h LEU 211 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3i4k h LEU 211 CO -0.02 0.14 -0.02 -0.74 0.09 0.00 0.00 178.44 177.89 3i4k h HIS 212 N 0.00 -0.05 0.21 1.13 2.76 -0.93 -3.40 115.15 114.86 3i4k h HIS 212 Ca -0.00 -0.00 -0.34 0.00 -2.20 0.00 0.00 60.37 57.83 3i4k h HIS 212 Cb 0.27 0.02 0.02 0.00 1.55 0.00 0.00 27.41 29.27 3i4k h HIS 212 CO 0.00 0.48 -1.63 1.88 -1.30 0.00 0.00 177.93 177.36 3i4k h TYR 213 N -0.96 0.79 -1.05 5.26 0.05 -1.18 -3.36 116.97 116.52 3i4k h TYR 213 Ca -0.01 -0.58 0.28 0.00 0.05 0.00 0.00 58.73 58.47 3i4k h TYR 213 Cb 0.56 -0.03 -0.08 0.00 1.01 0.00 0.00 36.73 38.19 3i4k h TYR 213 CO 0.14 1.61 0.70 -0.07 -1.05 0.00 0.00 178.16 179.48 3i4k h LEU 214 N 0.12 0.32 -1.98 3.88 3.38 -1.25 0.27 115.31 120.04 3i4k h LEU 214 Ca -0.30 0.06 0.02 0.00 0.09 0.00 0.00 57.88 57.75 3i4k h LEU 214 Cb 2.12 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.87 3i4k h LEU 214 CO 0.21 0.07 0.07 -0.65 0.09 0.00 0.00 178.44 178.23 3i4k h PRO 215 N 0.28 0.03 -0.29 1.13 0.11 -1.77 -0.76 132.00 130.72 3i4k h PRO 215 Ca 0.56 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.64 3i4k h PRO 215 Cb 1.65 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.74 3i4k h PRO 215 CO -0.20 0.02 0.06 0.82 -0.21 0.00 0.00 178.00 178.48 3i4k h ILE 216 N 0.03 1.22 -0.51 4.15 2.04 -0.70 -1.63 117.51 122.11 3i4k h ILE 216 Ca 0.04 -0.75 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 3i4k h ILE 216 Cb 0.14 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3i4k h ILE 216 CO -0.00 0.25 0.11 -0.07 0.00 0.00 0.00 178.15 178.43 3i4k h LEU 217 N 0.31 0.73 -0.19 1.44 3.38 -1.30 -1.12 115.31 118.56 3i4k h LEU 217 Ca 0.09 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.94 3i4k h LEU 217 Cb 0.31 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3i4k h LEU 217 CO 0.00 0.73 0.10 0.00 0.09 0.00 0.00 178.44 179.37 3i4k h ALA 218 N 1.36 0.23 -0.28 1.53 0.00 -0.80 0.78 119.26 122.08 3i4k h ALA 218 Ca 0.17 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 3i4k h ALA 218 Cb 0.30 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3i4k h ALA 218 CO 0.00 -0.31 -0.12 1.49 0.00 0.00 0.00 179.25 180.31 3i4k h GLU 219 N 0.22 0.47 0.00 0.00 4.81 -1.03 -2.13 114.58 116.91 3i4k h GLU 219 Ca 0.07 -0.13 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 3i4k h GLU 219 Cb -0.00 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3i4k h GLU 219 CO -0.04 0.59 -0.23 0.00 -0.73 0.00 0.00 179.01 178.60 3i4k h ALA 220 N 1.44 1.12 0.00 2.92 0.00 -0.36 -3.47 119.26 120.91 3i4k h ALA 220 Ca 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3i4k h ALA 220 Cb 0.48 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3i4k h ALA 220 CO 0.03 0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.98 3i4k n GLY 221 N -0.14 0.74 3.72 0.00 0.00 0.15 -4.28 105.19 105.38 3i4k n GLY 221 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3i4k n GLY 221 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3i4k n VAL 222 N 0.00 1.31 0.76 1.61 0.31 -0.50 -4.76 118.33 117.06 3i4k n VAL 222 Ca 0.00 -0.33 0.09 0.00 -0.01 0.00 0.00 64.34 64.09 3i4k n VAL 222 Cb 0.00 -1.75 -0.11 0.00 -0.91 0.00 0.00 33.84 31.07 3i4k n VAL 222 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3i4k n GLU 223 N 1.59 0.91 -3.68 5.55 1.02 0.02 -4.65 120.64 121.39 3i4k n GLU 223 Ca 0.08 -0.02 -0.10 0.00 -0.02 0.00 0.00 57.16 57.10 3i4k n GLU 223 Cb 0.35 -1.37 -0.10 0.00 -0.02 0.00 0.00 31.44 30.30 3i4k n GLU 223 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3i4k s LEU 224 N -3.03 -0.27 -0.38 -4.62 2.96 -1.24 -4.17 118.68 107.93 3i4k s LEU 224 Ca 0.05 1.02 -0.09 0.00 -0.22 0.00 0.00 54.13 54.89 3i4k s LEU 224 Cb 0.14 1.55 0.05 0.00 0.50 0.00 0.00 46.19 48.43 3i4k s LEU 224 CO 0.76 -0.20 0.19 -0.36 -1.32 0.00 0.00 176.35 175.41 3i4k s PHE 225 N 1.46 3.29 -0.17 5.38 0.08 -0.35 -1.61 117.98 126.06 3i4k s PHE 225 Ca -0.10 -1.34 -0.20 0.00 0.12 0.00 0.00 56.93 55.42 3i4k s PHE 225 Cb -0.08 -2.57 -0.03 0.00 -0.57 0.00 0.00 43.02 39.77 3i4k s PHE 225 CO -0.14 -0.75 0.57 -2.00 -0.10 0.00 0.00 175.22 172.80 3i4k s GLU 226 N 1.45 4.25 -0.03 0.44 2.12 0.44 -4.22 118.70 123.15 3i4k s GLU 226 Ca 0.01 0.55 -0.00 0.00 0.36 0.00 0.00 54.97 55.89 3i4k s GLU 226 Cb -0.21 -3.53 0.00 0.00 0.26 0.00 0.00 34.13 30.65 3i4k s GLU 226 CO 0.04 -0.11 0.03 0.94 -0.54 0.00 0.00 175.26 175.62 3i4k n GLN 227 N 4.58 -0.07 0.19 4.30 -0.06 -1.26 -2.92 117.38 122.14 3i4k n GLN 227 Ca -0.03 0.04 0.11 0.00 -2.00 0.00 0.00 57.00 55.11 3i4k n GLN 227 Cb 0.50 -0.09 0.12 0.00 -4.06 0.00 0.00 30.24 26.72 3i4k n GLN 227 CO 0.00 0.00 0.00 -1.00 -0.20 0.00 0.00 177.06 175.86 3i4k h PRO 228 N 0.73 0.00 -5.47 3.69 0.13 -1.89 0.20 132.00 129.38 3i4k h PRO 228 Ca -0.03 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.52 3i4k h PRO 228 Cb 0.06 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.06 3i4k h PRO 228 CO 0.01 0.05 -0.59 0.95 -0.23 0.00 0.00 178.00 178.19 3i4k s THR 229 N -3.21 1.64 0.24 1.56 -4.23 -1.26 -2.35 115.64 108.03 3i4k s THR 229 Ca 0.05 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.29 3i4k s THR 229 Cb 0.06 -2.84 -0.16 0.00 1.34 0.00 0.00 72.50 70.90 3i4k s THR 229 CO 0.70 0.00 0.64 -2.65 -0.54 0.00 0.00 174.62 172.77 3i4k n PRO 230 N -0.92 0.40 -0.29 3.99 -0.02 -1.26 -4.28 135.00 132.62 3i4k n PRO 230 Ca -0.06 0.14 0.03 0.00 -2.02 0.00 0.00 63.50 61.60 3i4k n PRO 230 Cb 0.67 -1.25 0.17 0.00 -0.02 0.00 0.00 33.50 33.07 3i4k n PRO 230 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i4k h ALA 231 N 1.25 1.18 0.00 3.55 0.00 -1.89 -2.44 119.26 120.91 3i4k h ALA 231 Ca -0.32 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 3i4k h ALA 231 Cb 1.41 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 3i4k h ALA 231 CO 0.57 0.06 -0.15 0.38 0.00 0.00 0.00 179.25 180.12 3i4k h ASP 232 N 0.75 0.00 -1.84 0.00 2.03 -1.91 -3.39 116.42 112.06 3i4k h ASP 232 Ca 0.40 0.00 -0.75 0.00 -0.73 0.00 0.00 57.03 55.95 3i4k h ASP 232 Cb 0.41 0.00 -0.17 0.00 -0.83 0.00 0.00 39.33 38.74 3i4k h ASP 232 CO -0.27 0.15 1.65 -0.67 -1.03 0.00 0.00 179.24 179.08 3i4k n ASP 233 N -3.34 5.22 0.10 4.15 -0.08 -0.92 -4.80 116.55 116.88 3i4k n ASP 233 Ca -0.00 -3.07 0.02 0.00 -1.51 0.00 0.00 54.79 50.23 3i4k n ASP 233 Cb 0.37 -1.50 0.37 0.00 2.34 0.00 0.00 41.12 42.70 3i4k n ASP 233 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 3i4k h LEU 234 N 8.48 0.26 -1.13 -2.67 3.38 -1.83 -2.84 115.31 118.96 3i4k h LEU 234 Ca 0.35 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.22 3i4k h LEU 234 Cb 0.73 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 3i4k h LEU 234 CO 1.44 0.41 0.12 -0.33 0.09 0.00 0.00 178.44 180.18 3i4k h GLU 235 N 0.26 0.74 -0.43 1.13 5.08 -1.91 -2.56 114.58 116.89 3i4k h GLU 235 Ca 0.05 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.14 3i4k h GLU 235 Cb 0.39 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3i4k h GLU 235 CO 0.02 0.67 -0.27 1.15 -1.00 0.00 0.00 179.01 179.58 3i4k h THR 236 N 0.72 1.27 -0.64 1.13 2.02 -1.91 0.64 112.91 116.14 3i4k h THR 236 Ca 0.16 -1.43 0.03 0.00 0.77 0.00 0.00 66.41 65.94 3i4k h THR 236 Cb 0.26 1.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 3i4k h THR 236 CO -0.00 0.49 0.39 -0.07 0.37 0.00 0.00 175.52 176.69 3i4k h LEU 237 N 0.78 0.64 -0.35 2.58 3.38 -1.43 0.55 115.31 121.45 3i4k h LEU 237 Ca 0.09 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 3i4k h LEU 237 Cb 0.84 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 3i4k h LEU 237 CO 0.07 0.44 0.12 -0.09 0.09 0.00 0.00 178.44 179.08 3i4k h ARG 238 N 0.77 0.54 -0.57 1.13 9.65 -1.25 -3.02 114.38 121.62 3i4k h ARG 238 Ca 0.26 -0.11 -0.05 0.00 -1.10 0.00 0.00 59.98 58.98 3i4k h ARG 238 Cb 0.03 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.50 3i4k h ARG 238 CO -0.11 0.55 0.17 1.49 2.80 0.00 0.00 179.97 184.87 3i4k h GLU 239 N 0.42 0.86 -0.65 0.20 4.57 -0.21 -1.05 114.58 118.72 3i4k h GLU 239 Ca 0.11 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 58.09 3i4k h GLU 239 Cb 0.22 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 3i4k h GLU 239 CO -0.01 0.75 0.23 -0.84 -1.18 0.00 0.00 179.01 177.96 3i4k h ILE 240 N 0.83 1.24 -0.46 2.32 3.07 -0.79 -0.87 117.51 122.85 3i4k h ILE 240 Ca 0.19 -0.78 -0.11 0.00 1.55 0.00 0.00 64.86 65.70 3i4k h ILE 240 Cb 0.25 0.49 -0.01 0.00 -0.27 0.00 0.00 36.82 37.28 3i4k h ILE 240 CO -0.01 0.31 -0.15 0.74 -1.05 0.00 0.00 178.15 177.99 3i4k h THR 241 N 0.95 1.27 -0.81 0.16 2.02 -1.35 -0.69 112.91 114.47 3i4k h THR 241 Ca 0.22 -1.29 0.05 0.00 0.77 0.00 0.00 66.41 66.15 3i4k h THR 241 Cb 0.24 1.14 -0.06 0.00 -1.74 0.00 0.00 68.15 67.73 3i4k h THR 241 CO -0.01 0.44 0.50 0.03 0.37 0.00 0.00 175.52 176.85 3i4k h ARG 242 N 0.76 0.91 0.00 6.66 3.08 -0.66 0.63 114.38 125.76 3i4k h ARG 242 Ca 0.11 -0.05 -0.22 0.00 0.07 0.00 0.00 59.98 59.89 3i4k h ARG 242 Cb 0.71 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.52 3i4k h ARG 242 CO 0.05 0.60 -1.10 0.00 -1.07 0.00 0.00 179.97 178.46 3i4k h ARG 243 N 0.94 0.00 0.00 0.04 3.08 -0.94 -3.38 114.38 114.11 3i4k h ARG 243 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 3i4k h ARG 243 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 3i4k h ARG 243 CO -0.15 0.88 -1.17 0.25 -1.07 0.00 0.00 179.97 178.72 3i4k n THR 244 N -3.29 0.00 -2.37 2.04 -2.24 -0.28 -5.00 114.28 103.13 3i4k n THR 244 Ca -0.03 -0.26 -0.18 0.00 -2.27 0.00 0.00 64.05 61.31 3i4k n THR 244 Cb 0.95 0.56 -0.01 0.00 -2.10 0.00 0.00 70.33 69.73 3i4k n THR 244 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3i4k n ASN 245 N -1.67 -5.30 -4.24 3.42 3.02 0.22 -5.00 115.26 105.70 3i4k n ASN 245 Ca -0.00 -0.03 -0.30 0.00 -0.03 0.00 0.00 54.58 54.22 3i4k n ASN 245 Cb 0.28 -4.36 -0.16 0.00 -0.61 0.00 0.00 39.78 34.93 3i4k n ASN 245 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3i4k s VAL 246 N -2.92 1.90 0.62 2.41 0.11 -1.26 -5.08 120.40 116.19 3i4k s VAL 246 Ca 0.01 -0.99 -0.18 0.00 -2.93 0.00 0.00 61.98 57.89 3i4k s VAL 246 Cb -0.00 -1.60 -0.03 0.00 -1.53 0.00 0.00 36.38 33.21 3i4k s VAL 246 CO 0.01 0.53 1.07 -1.20 -3.33 0.00 0.00 175.10 172.19 3i4k n SER 247 N 2.88 1.18 0.00 3.54 7.64 -1.26 -4.44 113.62 123.16 3i4k n SER 247 Ca -0.17 0.80 0.00 0.00 1.01 0.00 0.00 58.87 60.51 3i4k n SER 247 Cb 0.52 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.28 3i4k n SER 247 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3i4k n VAL 248 N -1.84 0.00 -3.75 0.44 0.31 -1.26 -1.22 118.33 111.01 3i4k n VAL 248 Ca 0.15 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.35 3i4k n VAL 248 Cb 0.48 -0.02 -0.12 0.00 -0.91 0.00 0.00 33.84 33.26 3i4k n VAL 248 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i4k s ALA 250 N -2.00 -0.66 0.00 3.52 0.00 -0.11 -2.04 121.76 120.47 3i4k s ALA 250 Ca 0.00 0.91 0.00 0.00 0.00 0.00 0.00 51.96 52.87 3i4k s ALA 250 Cb 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 23.12 22.57 3i4k s ALA 250 CO 0.00 -0.17 0.00 -3.47 0.00 0.00 0.00 175.76 172.12 3i4k n ASP 251 N 3.53 0.00 0.22 0.00 2.03 -1.26 -0.74 116.55 120.34 3i4k n ASP 251 Ca -0.18 0.00 0.16 0.00 0.52 0.00 0.00 54.79 55.28 3i4k n ASP 251 Cb 0.56 0.00 0.83 0.00 -0.72 0.00 0.00 41.12 41.78 3i4k n ASP 251 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 3i4k h GLU 252 N 0.00 0.00 0.00 -0.67 9.09 -1.95 0.31 114.58 121.36 3i4k h GLU 252 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3i4k h GLU 252 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3i4k h GLU 252 CO 0.00 0.00 0.00 0.77 0.05 0.00 0.00 179.01 179.83 3i4k h SER 253 N 0.00 0.00 -3.24 3.06 0.02 -1.89 -3.41 113.55 108.09 3i4k h SER 253 Ca 0.06 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.43 3i4k h SER 253 Cb 0.34 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.48 3i4k h SER 253 CO -0.00 0.00 -0.76 -0.69 -1.14 0.00 0.00 176.83 174.24 3i4k s VAL 254 N -3.44 1.00 -0.12 2.27 1.01 0.10 -4.79 120.40 116.43 3i4k s VAL 254 Ca 0.03 -1.38 -0.03 0.00 0.00 0.00 0.00 61.98 60.60 3i4k s VAL 254 Cb 0.09 -1.70 -0.06 0.00 0.00 0.00 0.00 36.38 34.71 3i4k s VAL 254 CO 0.42 -0.58 -0.14 0.79 0.00 0.00 0.00 175.10 175.59 3i4k n TRP 255 N 4.81 0.00 -3.12 5.22 7.02 -1.26 -4.85 117.44 125.25 3i4k n TRP 255 Ca -0.03 0.00 -0.18 0.00 -1.02 0.00 0.00 57.50 56.27 3i4k n TRP 255 Cb 0.43 -0.44 0.01 0.00 -2.42 0.00 0.00 31.31 28.89 3i4k n TRP 255 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 3i4k s THR 256 N -2.23 2.77 0.21 -0.99 -4.23 -1.26 -4.09 115.64 105.82 3i4k s THR 256 Ca -0.17 -1.06 -0.02 0.00 -1.18 0.00 0.00 61.69 59.26 3i4k s THR 256 Cb 0.06 -2.83 -0.01 0.00 1.34 0.00 0.00 72.50 71.06 3i4k s THR 256 CO 0.24 0.00 1.58 -0.65 -0.54 0.00 0.00 174.62 175.24 3i4k h PRO 257 N 0.62 0.58 -0.19 3.99 0.11 -1.93 -1.82 132.00 133.36 3i4k h PRO 257 Ca -0.38 -0.30 -0.04 0.00 0.11 0.00 0.00 66.00 65.38 3i4k h PRO 257 Cb 1.28 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 3i4k h PRO 257 CO 0.46 0.89 -0.06 0.00 -0.21 0.00 0.00 178.00 179.08 3i4k h ALA 258 N 1.07 1.54 -0.02 -0.75 0.00 -1.99 -1.02 119.26 118.09 3i4k h ALA 258 Ca 0.04 -0.17 -0.20 0.00 0.00 0.00 0.00 54.91 54.57 3i4k h ALA 258 Cb 0.93 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3i4k h ALA 258 CO 0.08 0.33 -0.86 0.93 0.00 0.00 0.00 179.25 179.74 3i4k h GLU 259 N 0.28 0.31 -0.20 0.00 5.08 -1.82 -1.47 114.58 116.77 3i4k h GLU 259 Ca 0.06 -0.32 -0.08 0.00 -1.00 0.00 0.00 59.36 58.03 3i4k h GLU 259 Cb 0.30 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 3i4k h GLU 259 CO 0.01 1.00 -0.23 0.00 -1.00 0.00 0.00 179.01 178.80 3i4k h ALA 260 N 0.89 1.25 -0.18 3.43 0.00 -0.67 -1.98 119.26 122.00 3i4k h ALA 260 Ca -0.05 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 3i4k h ALA 260 Cb 1.47 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 3i4k h ALA 260 CO 0.14 0.49 -0.19 1.25 0.00 0.00 0.00 179.25 180.95 3i4k h LEU 261 N 0.32 0.48 -1.31 0.00 6.46 -1.01 -1.94 115.31 118.31 3i4k h LEU 261 Ca 0.05 -0.48 0.00 0.00 -0.12 0.00 0.00 57.88 57.33 3i4k h LEU 261 Cb 0.58 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.34 3i4k h LEU 261 CO 0.04 0.86 0.43 0.00 -0.62 0.00 0.00 178.44 179.15 3i4k h ALA 262 N 0.63 1.49 -0.57 1.25 0.00 -1.05 0.73 119.26 121.73 3i4k h ALA 262 Ca 0.03 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 3i4k h ALA 262 Cb 0.73 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3i4k h ALA 262 CO 0.05 0.46 -0.07 0.28 0.00 0.00 0.00 179.25 179.97 3i4k h VAL 263 N 0.91 1.27 -0.09 0.00 2.07 -1.23 0.29 116.25 119.47 3i4k h VAL 263 Ca 0.24 -1.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.53 3i4k h VAL 263 Cb -0.07 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 3i4k h VAL 263 CO -0.05 0.44 0.04 0.58 0.02 0.00 0.00 177.57 178.60 3i4k h VAL 264 N 0.95 1.13 -0.59 2.57 2.07 -0.48 -0.73 116.25 121.17 3i4k h VAL 264 Ca 0.15 -0.37 -0.04 0.00 0.82 0.00 0.00 66.70 67.26 3i4k h VAL 264 Cb 0.64 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 3i4k h VAL 264 CO 0.04 0.11 0.21 0.11 0.02 0.00 0.00 177.57 178.06 3i4k h LYS 265 N 0.01 0.87 -0.01 1.57 1.57 -0.69 -2.01 116.57 117.89 3i4k h LYS 265 Ca 0.03 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3i4k h LYS 265 Cb 0.14 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3i4k h LYS 265 CO -0.00 0.73 0.00 0.00 -0.57 0.00 0.00 179.45 179.61 3i4k n ALA 266 N -2.45 2.64 -4.23 3.86 0.00 0.07 -4.89 120.51 115.51 3i4k n ALA 266 Ca 0.05 -0.29 -0.36 0.00 0.00 0.00 0.00 53.44 52.84 3i4k n ALA 266 Cb 0.18 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.24 3i4k n ALA 266 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3i4k n GLN 267 N -0.52 -3.06 0.08 0.00 6.02 -0.37 -4.84 117.38 114.68 3i4k n GLN 267 Ca 0.21 0.36 0.13 0.00 -0.01 0.00 0.00 57.00 57.69 3i4k n GLN 267 Cb 0.20 -5.05 0.46 0.00 1.02 0.00 0.00 30.24 26.87 3i4k n GLN 267 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3i4k n ALA 268 N -4.38 2.26 -3.58 -1.58 0.00 -0.65 -4.68 120.51 107.91 3i4k n ALA 268 Ca 0.06 -0.04 -0.14 0.00 0.00 0.00 0.00 53.44 53.31 3i4k n ALA 268 Cb 0.50 -1.46 -0.06 0.00 0.00 0.00 0.00 19.45 18.42 3i4k n ALA 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i4k s ALA 269 N -3.08 -1.82 -0.11 0.00 0.00 -1.26 -3.83 121.76 111.65 3i4k s ALA 269 Ca 0.11 1.65 0.14 0.00 0.00 0.00 0.00 51.96 53.87 3i4k s ALA 269 Cb 0.14 -0.66 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 3i4k s ALA 269 CO 0.57 -0.33 1.30 -0.44 0.00 0.00 0.00 175.76 176.85 3i4k h ASP 270 N 3.71 0.00 -4.40 0.00 3.45 -1.76 -3.47 116.42 113.95 3i4k h ASP 270 Ca -0.26 0.00 -0.31 0.00 0.43 0.00 0.00 57.03 56.89 3i4k h ASP 270 Cb 1.15 0.00 -0.24 0.00 -0.56 0.00 0.00 39.33 39.68 3i4k h ASP 270 CO 0.24 0.59 -0.75 -0.69 -1.57 0.00 0.00 179.24 177.06 3i4k s VAL 271 N -2.92 0.54 -0.13 -1.35 1.01 -1.06 -1.64 120.40 114.86 3i4k s VAL 271 Ca 0.02 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.27 3i4k s VAL 271 Cb 0.08 -0.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.91 3i4k s VAL 271 CO 0.77 -0.16 -0.18 -0.63 0.00 0.00 0.00 175.10 174.90 3i4k s ILE 272 N -0.86 2.57 -0.89 2.22 1.01 0.03 -0.93 121.20 124.35 3i4k s ILE 272 Ca -0.04 -0.83 -0.25 0.00 0.00 0.00 0.00 60.65 59.53 3i4k s ILE 272 Cb -0.07 -2.05 0.04 0.00 0.01 0.00 0.00 42.46 40.39 3i4k s ILE 272 CO 0.00 0.54 1.40 0.00 0.00 0.00 0.00 174.94 176.88 3i4k s ALA 273 N 0.49 2.68 -0.17 9.38 0.00 0.08 -1.63 121.76 132.60 3i4k s ALA 273 Ca -0.12 -1.82 -0.29 0.00 0.00 0.00 0.00 51.96 49.73 3i4k s ALA 273 Cb -0.16 -4.41 -0.00 0.00 0.00 0.00 0.00 23.12 18.54 3i4k s ALA 273 CO 0.05 -3.52 1.01 -1.17 0.00 0.00 0.00 175.76 172.13 3i4k s LEU 274 N 5.55 4.18 -0.14 0.00 1.98 -0.38 -4.77 118.68 125.10 3i4k s LEU 274 Ca 0.43 1.44 -0.01 0.00 -2.89 0.00 0.00 54.13 53.09 3i4k s LEU 274 Cb -0.04 -3.53 0.04 0.00 0.66 0.00 0.00 46.19 43.32 3i4k s LEU 274 CO 0.02 -0.54 -0.02 -0.54 -1.89 0.00 0.00 176.35 173.38 3i4k s LYS 275 N 2.55 1.00 0.60 1.98 1.02 -1.26 -0.10 119.74 125.53 3i4k s LYS 275 Ca 0.46 -0.29 0.33 0.00 0.02 0.00 0.00 55.97 56.49 3i4k s LYS 275 Cb -0.17 -1.69 1.92 0.00 -0.52 0.00 0.00 37.83 37.37 3i4k s LYS 275 CO 0.12 -0.43 2.27 1.79 -0.92 0.00 0.00 175.35 178.18 3i4k h THR 276 N 6.38 0.43 0.27 2.17 1.35 -1.87 -0.19 112.91 121.45 3i4k h THR 276 Ca -0.21 -0.03 -0.01 0.00 -0.55 0.00 0.00 66.41 65.60 3i4k h THR 276 Cb 1.12 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 3i4k h THR 276 CO 0.34 0.01 -0.13 0.71 -0.25 0.00 0.00 175.52 176.20 3i4k h THR 277 N 0.00 0.00 -0.87 6.82 1.35 -1.93 -0.48 112.91 117.80 3i4k h THR 277 Ca -0.00 -0.63 0.17 0.00 -0.55 0.00 0.00 66.41 65.40 3i4k h THR 277 Cb 0.02 0.00 -0.07 0.00 -1.73 0.00 0.00 68.15 66.37 3i4k h THR 277 CO 0.00 0.00 0.57 0.50 -0.25 0.00 0.00 175.52 176.34 3i4k h LYS 278 N -0.99 0.54 0.00 4.72 3.64 -1.75 -0.60 116.57 122.13 3i4k h LYS 278 Ca -0.04 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3i4k h LYS 278 Cb 0.28 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 3i4k h LYS 278 CO 0.06 0.35 0.00 0.72 -2.27 0.00 0.00 179.45 178.32 3i4k n HIS 279 N -4.54 0.27 -1.29 1.91 8.25 -0.13 -4.48 115.22 115.21 3i4k n HIS 279 Ca 0.18 0.08 0.00 0.00 -0.26 0.00 0.00 57.72 57.72 3i4k n HIS 279 Cb 0.56 -0.63 0.00 0.00 1.12 0.00 0.00 29.99 31.03 3i4k n HIS 279 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i4k n GLY 280 N 1.12 1.01 0.00 -1.41 0.00 -0.23 -4.67 105.19 101.01 3i4k n GLY 280 Ca 0.06 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.59 3i4k n GLY 280 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4k n GLY 281 N -0.75 2.91 0.21 -0.02 0.00 -0.19 -3.90 105.19 103.44 3i4k n GLY 281 Ca 0.00 -2.00 -0.08 0.00 0.00 0.00 0.00 46.02 43.94 3i4k n GLY 281 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3i4k h LEU 282 N 0.00 0.53 -0.20 0.99 3.38 -1.88 -0.45 115.31 117.68 3i4k h LEU 282 Ca 0.00 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 3i4k h LEU 282 Cb 0.00 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3i4k h LEU 282 CO 0.00 0.95 -0.04 -0.07 0.09 0.00 0.00 178.44 179.37 3i4k h LEU 283 N 0.38 0.38 -0.83 1.67 3.38 -1.95 -2.21 115.31 116.12 3i4k h LEU 283 Ca 0.01 -0.36 -0.06 0.00 0.09 0.00 0.00 57.88 57.56 3i4k h LEU 283 Cb 1.03 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 3i4k h LEU 283 CO 0.09 0.65 0.18 -0.33 0.09 0.00 0.00 178.44 179.12 3i4k h GLU 284 N 0.10 1.05 -0.02 1.13 4.39 -1.80 -2.35 114.58 117.08 3i4k h GLU 284 Ca 0.05 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 3i4k h GLU 284 Cb 0.48 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.98 3i4k h GLU 284 CO 0.02 0.92 -0.03 0.77 -1.16 0.00 0.00 179.01 179.52 3i4k h SER 285 N 1.00 0.02 -0.25 1.42 0.02 -0.91 -1.30 113.55 113.56 3i4k h SER 285 Ca 0.21 -0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.05 3i4k h SER 285 Cb 0.33 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 3i4k h SER 285 CO -0.00 0.06 -0.23 0.11 -1.14 0.00 0.00 176.83 175.63 3i4k h LYS 286 N 0.02 0.72 -0.47 3.45 1.79 -0.84 -2.81 116.57 118.43 3i4k h LYS 286 Ca 0.01 -0.29 -0.08 0.00 -2.18 0.00 0.00 60.65 58.10 3i4k h LYS 286 Cb 0.08 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 3i4k h LYS 286 CO 0.00 0.89 -0.03 0.87 -1.08 0.00 0.00 179.45 180.10 3i4k h LYS 287 N 0.63 0.85 0.20 3.15 1.57 -1.17 -1.82 116.57 119.98 3i4k h LYS 287 Ca 0.09 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.59 3i4k h LYS 287 Cb 0.73 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.94 3i4k h LYS 287 CO 0.06 0.92 -0.28 0.82 -0.57 0.00 0.00 179.45 180.39 3i4k h ILE 288 N 0.70 0.39 -0.52 1.86 1.08 -1.37 -0.78 117.51 118.87 3i4k h ILE 288 Ca 0.13 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.61 3i4k h ILE 288 Cb 0.55 0.39 -0.03 0.00 -3.07 0.00 0.00 36.82 34.67 3i4k h ILE 288 CO 0.03 0.00 0.35 0.00 -0.69 0.00 0.00 178.15 177.84 3i4k h ALA 289 N 0.10 1.67 -0.49 1.87 0.00 -1.44 0.11 119.26 121.08 3i4k h ALA 289 Ca 0.01 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 3i4k h ALA 289 Cb 0.54 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3i4k h ALA 289 CO -0.12 0.30 -0.19 0.00 0.00 0.00 0.00 179.25 179.24 3i4k h ALA 290 N 1.68 0.72 -0.08 0.00 0.00 -0.81 -0.61 119.26 120.18 3i4k h ALA 290 Ca 0.20 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 3i4k h ALA 290 Cb -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3i4k h ALA 290 CO -0.05 0.67 -0.31 0.82 0.00 0.00 0.00 179.25 180.39 3i4k h ILE 291 N 0.86 1.42 -0.05 0.00 2.04 -0.50 -2.23 117.51 119.05 3i4k h ILE 291 Ca 0.12 -1.69 0.02 0.00 1.00 0.00 0.00 64.86 64.30 3i4k h ILE 291 Cb 0.76 2.28 -0.02 0.00 -0.74 0.00 0.00 36.82 39.11 3i4k h ILE 291 CO 0.06 0.49 -0.06 0.00 0.00 0.00 0.00 178.15 178.64 3i4k h ALA 292 N 0.45 -0.02 -0.62 1.87 0.00 -0.98 -2.44 119.26 117.52 3i4k h ALA 292 Ca -0.02 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.00 3i4k h ALA 292 Cb 0.95 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.80 3i4k h ALA 292 CO 0.06 -0.54 0.28 1.49 0.00 0.00 0.00 179.25 180.54 3i4k h GLU 293 N -0.09 0.48 -0.53 0.00 4.81 -1.15 0.78 114.58 118.88 3i4k h GLU 293 Ca 0.04 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 3i4k h GLU 293 Cb 0.15 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 3i4k h GLU 293 CO -0.10 0.32 0.35 0.00 -0.73 0.00 0.00 179.01 178.85 3i4k h ALA 294 N 1.38 1.65 -0.45 2.92 0.00 -1.05 -1.76 119.26 121.95 3i4k h ALA 294 Ca 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3i4k h ALA 294 Cb 0.31 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3i4k h ALA 294 CO -0.25 0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.72 3i4k n GLY 295 N -1.46 1.24 2.35 0.00 0.00 -0.72 -4.93 105.19 101.68 3i4k n GLY 295 Ca 0.05 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3i4k n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4k n GLY 296 N 1.29 0.56 3.78 -0.02 0.00 -0.66 -5.02 105.19 105.11 3i4k n GLY 296 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 3i4k n GLY 296 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i4k s LEU 297 N 0.00 4.52 0.52 0.99 1.43 0.19 -4.97 118.68 121.36 3i4k s LEU 297 Ca 0.00 1.45 -0.15 0.00 -1.03 0.00 0.00 54.13 54.39 3i4k s LEU 297 Cb 0.00 -3.14 -0.07 0.00 0.03 0.00 0.00 46.19 43.01 3i4k s LEU 297 CO 0.00 0.17 0.97 0.00 0.23 0.00 0.00 176.35 177.72 3i4k s ALA 298 N -0.76 3.09 -0.07 4.21 0.00 -0.65 -3.75 121.76 123.82 3i4k s ALA 298 Ca 0.34 0.12 0.05 0.00 0.00 0.00 0.00 51.96 52.47 3i4k s ALA 298 Cb -0.21 -3.08 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 3i4k s ALA 298 CO 0.23 -0.26 -0.24 0.00 0.00 0.00 0.00 175.76 175.48 3i4k s HIS 300 N 0.01 3.03 -1.21 0.00 5.04 -0.65 -1.59 115.29 119.93 3i4k s HIS 300 Ca -0.09 -0.24 -0.21 0.00 -1.54 0.00 0.00 55.06 52.98 3i4k s HIS 300 Cb -0.15 -1.93 -0.04 0.00 0.04 0.00 0.00 32.58 30.50 3i4k s HIS 300 CO 0.05 0.02 1.87 0.20 -2.34 0.00 0.00 174.74 174.55 3i4k s GLY 301 N 0.21 0.59 0.95 1.59 0.00 0.17 -1.25 107.32 109.57 3i4k s GLY 301 Ca -0.02 -2.35 -0.12 0.00 0.00 0.00 0.00 44.72 42.22 3i4k s GLY 301 CO 0.03 3.31 1.11 0.00 0.00 0.00 0.00 173.10 177.55 3i4k s ALA 302 N 9.02 1.38 0.02 3.20 0.00 0.85 -1.30 121.76 134.93 3i4k s ALA 302 Ca 0.64 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 52.24 3i4k s ALA 302 Cb 0.00 -3.09 -0.02 0.00 0.00 0.00 0.00 23.12 20.02 3i4k s ALA 302 CO 0.11 -2.53 -0.10 -0.08 0.00 0.00 0.00 175.76 173.16 3i4k s THR 303 N -3.09 0.74 -0.22 0.00 -1.32 -1.26 -4.51 115.64 105.98 3i4k s THR 303 Ca 0.64 -0.77 0.15 0.00 -1.21 0.00 0.00 61.69 60.50 3i4k s THR 303 Cb -0.17 -0.69 0.66 0.00 -1.51 0.00 0.00 72.50 70.79 3i4k s THR 303 CO 0.56 -0.06 1.59 -1.20 -2.21 0.00 0.00 174.62 173.29 3i4k n SER 304 N 2.12 4.64 -2.57 8.08 7.64 -1.26 -4.89 113.62 127.38 3i4k n SER 304 Ca -0.18 -3.04 -0.11 0.00 1.01 0.00 0.00 58.87 56.55 3i4k n SER 304 Cb 0.56 -0.62 0.06 0.00 -1.01 0.00 0.00 64.21 63.19 3i4k n SER 304 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3i4k n LEU 305 N -0.07 -3.29 -4.67 -3.43 4.32 -1.26 -2.93 117.00 105.67 3i4k n LEU 305 Ca 0.26 -0.40 -0.30 0.00 -0.02 0.00 0.00 56.01 55.55 3i4k n LEU 305 Cb 1.06 -2.20 0.16 0.00 -1.62 0.00 0.00 43.42 40.83 3i4k n LEU 305 CO 0.25 0.26 0.65 -1.61 -1.22 0.00 0.00 177.39 175.72 3i4k s GLU 306 N -4.96 0.93 0.00 3.23 8.01 -1.26 -4.92 118.70 119.73 3i4k s GLU 306 Ca 0.03 1.21 0.00 0.00 0.01 0.00 0.00 54.97 56.23 3i4k s GLU 306 Cb -0.01 -1.74 0.00 0.00 -4.31 0.00 0.00 34.13 28.06 3i4k s GLU 306 CO 0.47 -2.58 0.00 0.41 0.01 0.00 0.00 175.26 173.57 3i4k n GLY 307 N -0.20 0.34 0.25 -1.39 0.00 -1.26 -4.12 105.19 98.81 3i4k n GLY 307 Ca 0.09 -1.82 -0.06 0.00 0.00 0.00 0.00 46.02 44.22 3i4k n GLY 307 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i4k h PRO 308 N 0.00 0.82 -0.59 1.61 0.13 -1.95 -0.50 132.00 131.52 3i4k h PRO 308 Ca 0.00 -0.07 -0.05 0.00 -0.87 0.00 0.00 66.00 65.01 3i4k h PRO 308 Cb 0.00 -0.18 -0.02 0.00 0.13 0.00 0.00 31.00 30.93 3i4k h PRO 308 CO 0.00 0.58 0.16 0.82 -0.23 0.00 0.00 178.00 179.33 3i4k h ILE 309 N 0.83 1.25 -0.12 -3.56 1.08 -1.96 -0.86 117.51 114.17 3i4k h ILE 309 Ca 0.22 -0.86 -0.09 0.00 -0.39 0.00 0.00 64.86 63.74 3i4k h ILE 309 Cb -0.04 0.69 0.00 0.00 -3.07 0.00 0.00 36.82 34.40 3i4k h ILE 309 CO -0.04 0.32 -0.27 1.23 -0.69 0.00 0.00 178.15 178.70 3i4k h GLY 310 N 0.84 0.43 1.85 5.37 0.00 -1.88 -2.33 103.07 107.35 3i4k h GLY 310 Ca 0.19 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 3i4k h GLY 310 CO -0.00 0.46 0.05 -0.84 0.00 0.00 0.00 176.54 176.22 3i4k h THR 311 N -0.03 1.06 -0.42 4.70 2.02 -1.08 -1.50 112.91 117.67 3i4k h THR 311 Ca 0.00 -0.20 -0.15 0.00 0.77 0.00 0.00 66.41 66.83 3i4k h THR 311 Cb 0.87 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 3i4k h THR 311 CO 0.06 0.07 -0.33 0.00 0.37 0.00 0.00 175.52 175.69 3i4k h ALA 312 N 1.86 0.60 -0.17 6.16 0.00 -1.02 -1.62 119.26 125.08 3i4k h ALA 312 Ca 0.05 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 3i4k h ALA 312 Cb 0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3i4k h ALA 312 CO -0.01 0.67 -0.30 0.00 0.00 0.00 0.00 179.25 179.62 3i4k h ALA 313 N 0.80 1.18 -0.16 0.00 0.00 -0.74 -1.86 119.26 118.49 3i4k h ALA 313 Ca 0.08 -0.35 -0.20 0.00 0.00 0.00 0.00 54.91 54.44 3i4k h ALA 313 Cb 0.93 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3i4k h ALA 313 CO 0.09 0.53 -0.70 0.77 0.00 0.00 0.00 179.25 179.94 3i4k h SER 314 N 0.28 0.77 -0.44 0.00 0.02 -1.22 -2.41 113.55 110.56 3i4k h SER 314 Ca 0.04 -0.48 -0.06 0.00 -0.84 0.00 0.00 61.79 60.45 3i4k h SER 314 Cb 0.68 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 3i4k h SER 314 CO 0.05 1.25 0.07 -0.07 -1.14 0.00 0.00 176.83 176.99 3i4k h LEU 315 N 0.47 0.75 -0.78 5.07 3.38 -1.02 0.16 115.31 123.34 3i4k h LEU 315 Ca -0.03 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.69 3i4k h LEU 315 Cb 1.30 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 3i4k h LEU 315 CO 0.14 0.77 -0.11 1.56 0.09 0.00 0.00 178.44 180.89 3i4k h GLN 316 N 0.76 0.81 -0.05 1.13 1.08 -1.28 -0.10 115.11 117.45 3i4k h GLN 316 Ca 0.16 -0.27 -0.00 0.00 -1.45 0.00 0.00 58.65 57.09 3i4k h GLN 316 Cb 0.35 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.72 3i4k h GLN 316 CO 0.01 0.88 0.01 0.35 -0.95 0.00 0.00 178.83 179.13 3i4k h PHE 317 N 0.73 0.08 -0.37 2.96 3.04 -0.81 -2.57 116.94 120.01 3i4k h PHE 317 Ca 0.12 -0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.06 3i4k h PHE 317 Cb 0.60 -0.02 -0.02 0.00 2.56 0.00 0.00 35.95 39.07 3i4k h PHE 317 CO 0.03 0.29 0.22 0.00 -2.02 0.00 0.00 178.31 176.83 3i4k h ALA 318 N 0.78 1.70 0.00 2.41 0.00 -0.55 -0.84 119.26 122.77 3i4k h ALA 318 Ca 0.01 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3i4k h ALA 318 Cb 0.25 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3i4k h ALA 318 CO 0.00 0.26 -0.26 0.00 0.00 0.00 0.00 179.25 179.25 3i4k h ALA 319 N 1.75 1.22 -0.31 0.00 0.00 -0.75 -3.09 119.26 118.08 3i4k h ALA 319 Ca 0.13 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3i4k h ALA 319 Cb -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3i4k h ALA 319 CO -0.03 0.32 0.00 -1.13 0.00 0.00 0.00 179.25 178.42 3i4k n SER 320 N -3.71 2.82 -3.96 0.00 3.41 -0.57 0.60 113.62 112.21 3i4k n SER 320 Ca -0.01 -1.89 -0.31 0.00 -0.26 0.00 0.00 58.87 56.40 3i4k n SER 320 Cb 0.37 -0.20 -0.15 0.00 -0.26 0.00 0.00 64.21 63.97 3i4k n SER 320 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3i4k s THR 321 N -1.02 1.84 0.39 6.66 2.01 -0.43 -4.81 115.64 120.28 3i4k s THR 321 Ca 0.24 -1.79 0.06 0.00 0.31 0.00 0.00 61.69 60.51 3i4k s THR 321 Cb 0.13 -2.22 0.23 0.00 0.01 0.00 0.00 72.50 70.65 3i4k s THR 321 CO 0.18 -0.39 2.01 0.50 -0.69 0.00 0.00 174.62 176.22 3i4k h LYS 322 N 7.80 0.53 -0.58 4.92 3.11 -1.90 -2.00 116.57 128.45 3i4k h LYS 322 Ca -0.12 -0.05 0.17 0.00 -2.81 0.00 0.00 60.65 57.84 3i4k h LYS 322 Cb 1.04 -0.11 -0.02 0.00 -1.00 0.00 0.00 32.23 32.14 3i4k h LYS 322 CO 0.47 0.41 0.52 0.00 -2.81 0.00 0.00 179.45 178.05 3i4k h ALA 323 N 1.68 2.40 -1.10 5.00 0.00 -1.92 -3.31 119.26 122.00 3i4k h ALA 323 Ca 0.14 -0.02 -0.44 0.00 0.00 0.00 0.00 54.91 54.58 3i4k h ALA 323 Cb 0.06 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 3i4k h ALA 323 CO -0.02 -0.82 1.09 0.42 0.00 0.00 0.00 179.25 179.92 3i4k s ILE 324 N -4.75 3.54 -0.10 0.00 -1.09 -0.75 -3.18 121.20 114.87 3i4k s ILE 324 Ca -0.04 -0.17 0.01 0.00 -2.23 0.00 0.00 60.65 58.22 3i4k s ILE 324 Cb 0.18 -4.29 0.03 0.00 -1.58 0.00 0.00 42.46 36.79 3i4k s ILE 324 CO 0.63 -1.23 0.96 -1.54 -1.23 0.00 0.00 174.94 172.52 3i4k n SER 325 N 12.12 1.95 -1.84 3.58 3.41 -0.62 -4.67 113.62 127.55 3i4k n SER 325 Ca 0.28 -1.87 -0.07 0.00 -0.26 0.00 0.00 58.87 56.96 3i4k n SER 325 Cb 0.49 -0.02 0.07 0.00 -0.26 0.00 0.00 64.21 64.49 3i4k n SER 325 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i4k n TYR 326 N -0.34 1.34 -4.52 7.33 9.36 -0.81 -4.91 117.16 124.61 3i4k n TYR 326 Ca 0.01 -1.78 0.00 0.00 3.32 0.00 0.00 57.90 59.45 3i4k n TYR 326 Cb 0.23 -0.26 0.00 0.00 -0.63 0.00 0.00 39.34 38.68 3i4k n TYR 326 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3i4k n GLY 327 N -0.58 -1.06 3.28 2.98 0.00 -1.26 -4.70 105.19 103.84 3i4k n GLY 327 Ca 0.23 -1.15 -0.19 0.00 0.00 0.00 0.00 46.02 44.91 3i4k n GLY 327 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3i4k s THR 328 N 0.00 0.02 -0.08 2.61 -4.23 -1.00 0.43 115.64 113.39 3i4k s THR 328 Ca 0.00 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.75 3i4k s THR 328 Cb 0.00 -2.49 0.45 0.00 1.34 0.00 0.00 72.50 71.79 3i4k s THR 328 CO 0.00 0.00 1.16 -1.84 -0.54 0.00 0.00 174.62 173.40 3i4k n GLU 329 N -0.60 0.61 -1.57 3.99 0.28 -0.42 -0.90 120.64 122.03 3i4k n GLU 329 Ca 0.07 -2.50 -0.41 0.00 -0.16 0.00 0.00 57.16 54.15 3i4k n GLU 329 Cb 0.63 -0.55 -0.01 0.00 1.43 0.00 0.00 31.44 32.93 3i4k n GLU 329 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 3i4k n LEU 330 N 0.09 6.81 -0.55 -1.84 4.77 -1.26 -4.34 117.00 120.68 3i4k n LEU 330 Ca 0.08 -4.00 0.08 0.00 -0.03 0.00 0.00 56.01 52.15 3i4k n LEU 330 Cb 1.03 -1.56 0.04 0.00 -2.33 0.00 0.00 43.42 40.60 3i4k n LEU 330 CO -0.00 1.08 0.42 2.22 -1.33 0.00 0.00 177.39 179.78 3i4k n PHE 331 N 5.80 0.00 -0.03 -1.77 1.16 -1.26 -4.82 117.46 116.53 3i4k n PHE 331 Ca 0.56 0.00 -0.01 0.00 -1.87 0.00 0.00 57.45 56.13 3i4k n PHE 331 Cb 0.36 0.00 -0.01 0.00 -1.61 0.00 0.00 39.48 38.22 3i4k n PHE 331 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3i4k n GLY 332 N 1.00 -1.67 0.45 4.97 0.00 -1.26 -0.36 105.19 108.31 3i4k n GLY 332 Ca 0.08 0.37 0.22 0.00 0.00 0.00 0.00 46.02 46.69 3i4k n GLY 332 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3i4k h PRO 333 N 0.00 0.00 0.00 1.61 0.11 -1.83 0.25 132.00 132.13 3i4k h PRO 333 Ca 0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 3i4k h PRO 333 Cb 0.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.14 3i4k h PRO 333 CO -0.07 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 178.76 3i4k n GLN 334 N -3.28 0.03 0.03 1.05 6.02 0.52 -2.89 117.38 118.85 3i4k n GLN 334 Ca 0.13 0.22 0.11 0.00 -0.01 0.00 0.00 57.00 57.45 3i4k n GLN 334 Cb 1.07 -1.55 -0.09 0.00 1.02 0.00 0.00 30.24 30.69 3i4k n GLN 334 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3i4k n LEU 335 N -1.60 0.37 -4.71 1.08 4.32 0.87 -4.95 117.00 112.38 3i4k n LEU 335 Ca 0.04 0.06 -0.42 0.00 -0.02 0.00 0.00 56.01 55.67 3i4k n LEU 335 Cb 0.22 -0.03 -0.03 0.00 -1.62 0.00 0.00 43.42 41.96 3i4k n LEU 335 CO 0.17 -0.03 0.81 -0.76 -1.22 0.00 0.00 177.39 176.37 3i4k s LEU 336 N -4.58 4.38 0.47 2.23 1.43 -1.14 -1.20 118.68 120.27 3i4k s LEU 336 Ca -0.03 1.91 0.15 0.00 -1.03 0.00 0.00 54.13 55.12 3i4k s LEU 336 Cb 0.13 -3.58 1.09 0.00 0.03 0.00 0.00 46.19 43.86 3i4k s LEU 336 CO 0.86 -0.39 2.05 0.50 0.23 0.00 0.00 176.35 179.60 3i4k h LYS 337 N 6.69 0.01 -3.64 1.70 1.63 -1.14 -3.44 116.57 118.39 3i4k h LYS 337 Ca -0.42 -0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.32 3i4k h LYS 337 Cb 1.22 -0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 32.76 3i4k h LYS 337 CO 0.79 0.12 -0.10 0.34 -3.45 0.00 0.00 179.45 177.15 3i4k s ASP 338 N -7.02 -0.02 0.00 4.20 2.15 -1.26 -4.98 116.67 109.74 3i4k s ASP 338 Ca -0.04 -0.97 0.00 0.00 0.43 0.00 0.00 52.55 51.97 3i4k s ASP 338 Cb 0.16 0.61 0.00 0.00 -0.30 0.00 0.00 42.92 43.39 3i4k s ASP 338 CO 0.69 -1.18 0.00 1.07 -0.17 0.00 0.00 175.17 175.58 3i4k n THR 339 N -0.40 0.00 -2.50 1.71 5.66 -1.26 -4.87 114.28 112.62 3i4k n THR 339 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 3i4k n THR 339 Cb 0.62 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 69.42 3i4k n THR 339 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3i4k n TYR 340 N 0.00 0.07 -0.15 1.09 4.11 -1.26 -4.86 117.16 116.16 3i4k n TYR 340 Ca 0.00 -1.02 0.00 0.00 -0.00 0.00 0.00 57.90 56.88 3i4k n TYR 340 Cb 0.00 0.15 0.00 0.00 -0.00 0.00 0.00 39.34 39.49 3i4k n TYR 340 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.86 178.37 3i4k n ILE 341 N -0.09 0.00 0.00 -3.48 0.13 -1.26 0.76 119.36 115.42 3i4k n ILE 341 Ca -0.03 -0.40 0.00 0.00 -1.10 0.00 0.00 62.75 61.21 3i4k n ILE 341 Cb 0.94 1.15 0.00 0.00 -0.84 0.00 0.00 39.64 40.89 3i4k n ILE 341 CO 0.00 0.00 0.00 0.52 2.80 0.00 0.00 176.55 179.87 3i4k n VAL 342 N -0.19 0.00 -0.93 9.51 0.31 -1.24 -3.56 118.33 122.22 3i4k n VAL 342 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.04 3i4k n VAL 342 Cb 0.04 0.00 0.21 0.00 -0.91 0.00 0.00 33.84 33.18 3i4k n VAL 342 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3i4k s GLN 343 N 0.00 -0.38 0.03 5.55 1.11 -1.26 -5.06 119.66 119.65 3i4k s GLN 343 Ca 0.00 0.51 0.08 0.00 0.01 0.00 0.00 55.36 55.97 3i4k s GLN 343 Cb 0.00 -1.64 -0.03 0.00 -1.01 0.00 0.00 33.01 30.33 3i4k s GLN 343 CO 0.00 -3.28 -0.24 -1.21 0.01 0.00 0.00 175.29 170.58 3i4k s GLU 344 N -4.85 1.94 0.38 2.91 2.02 -1.26 -5.07 118.70 114.77 3i4k s GLU 344 Ca 0.67 -1.04 -0.23 0.00 0.02 0.00 0.00 54.97 54.40 3i4k s GLU 344 Cb -0.20 -2.06 -0.10 0.00 0.10 0.00 0.00 34.13 31.87 3i4k s GLU 344 CO 0.60 0.53 0.93 -0.06 0.02 0.00 0.00 175.26 177.28 3i4k s PHE 345 N -0.82 3.47 -0.54 1.61 0.08 -1.26 -5.02 117.98 115.52 3i4k s PHE 345 Ca 0.12 1.65 -0.17 0.00 0.12 0.00 0.00 56.93 58.66 3i4k s PHE 345 Cb -0.10 -2.86 0.11 0.00 -0.57 0.00 0.00 43.02 39.60 3i4k s PHE 345 CO 0.03 0.04 0.54 -1.21 -0.10 0.00 0.00 175.22 174.52 3i4k s GLU 346 N -2.69 3.01 -0.41 0.44 2.02 -1.26 -5.02 118.70 114.79 3i4k s GLU 346 Ca 0.56 -1.46 -0.06 0.00 0.02 0.00 0.00 54.97 54.03 3i4k s GLU 346 Cb -0.13 -4.24 0.10 0.00 0.10 0.00 0.00 34.13 29.96 3i4k s GLU 346 CO 0.18 -1.32 0.23 0.71 0.02 0.00 0.00 175.26 175.08 3i4k s TYR 347 N 1.99 3.46 -0.07 1.61 2.02 -1.26 -2.44 117.35 122.65 3i4k s TYR 347 Ca 0.07 -2.01 -0.22 0.00 -0.37 0.00 0.00 57.07 54.53 3i4k s TYR 347 Cb -0.26 -3.09 0.05 0.00 -0.40 0.00 0.00 41.96 38.25 3i4k s TYR 347 CO 0.05 -0.93 0.52 -1.59 -1.57 0.00 0.00 175.55 172.03 3i4k s LYS 348 N 1.27 0.82 -1.14 -0.62 -2.85 -0.88 -4.81 119.74 111.53 3i4k s LYS 348 Ca 0.05 0.22 -0.03 0.00 -1.00 0.00 0.00 55.97 55.21 3i4k s LYS 348 Cb -0.23 0.38 0.00 0.00 -2.06 0.00 0.00 37.83 35.92 3i4k s LYS 348 CO -0.02 -0.22 0.97 -0.25 0.10 0.00 0.00 175.35 175.94 3i4k n ASP 349 N 1.49 -3.65 -1.03 0.03 8.00 -0.68 -2.48 116.55 118.23 3i4k n ASP 349 Ca -0.19 -0.53 -0.13 0.00 0.71 0.00 0.00 54.79 54.65 3i4k n ASP 349 Cb 0.56 -4.65 -0.06 0.00 -0.02 0.00 0.00 41.12 36.96 3i4k n ASP 349 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3i4k n GLY 350 N -1.43 1.25 3.39 0.44 0.00 0.16 -4.86 105.19 104.15 3i4k n GLY 350 Ca -0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.65 3i4k n GLY 350 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i4k s GLN 351 N -3.09 1.84 -0.00 1.61 -0.21 -1.04 -0.63 119.66 118.14 3i4k s GLN 351 Ca 0.00 -2.10 -0.03 0.00 0.02 0.00 0.00 55.36 53.25 3i4k s GLN 351 Cb 0.00 -0.09 -0.00 0.00 1.00 0.00 0.00 33.01 33.92 3i4k s GLN 351 CO 0.00 -0.58 0.06 0.54 -2.12 0.00 0.00 175.29 173.19 3i4k s VAL 352 N -3.34 0.06 0.11 1.09 0.11 -0.09 -2.08 120.40 116.26 3i4k s VAL 352 Ca 0.32 -0.47 -0.15 0.00 -2.93 0.00 0.00 61.98 58.75 3i4k s VAL 352 Cb 0.02 -0.24 -0.07 0.00 -1.53 0.00 0.00 36.38 34.56 3i4k s VAL 352 CO 0.21 -0.26 0.54 0.00 -3.33 0.00 0.00 175.10 172.26 3i4k s ALA 353 N -0.81 3.60 -0.20 1.54 0.00 -1.02 -1.56 121.76 123.32 3i4k s ALA 353 Ca -0.09 -0.11 -0.29 0.00 0.00 0.00 0.00 51.96 51.47 3i4k s ALA 353 Cb -0.05 -2.53 -0.00 0.00 0.00 0.00 0.00 23.12 20.53 3i4k s ALA 353 CO 0.00 0.45 1.15 0.42 0.00 0.00 0.00 175.76 177.78 3i4k s ILE 354 N -1.34 4.48 -0.31 0.00 1.09 -0.76 -4.72 121.20 119.64 3i4k s ILE 354 Ca 0.34 1.79 -0.39 0.00 -1.10 0.00 0.00 60.65 61.29 3i4k s ILE 354 Cb -0.16 -4.15 -0.14 0.00 -1.06 0.00 0.00 42.46 36.94 3i4k s ILE 354 CO 0.19 -0.15 1.92 -2.65 -0.10 0.00 0.00 174.94 174.14 3i4k n PRO 355 N 6.44 1.10 -3.07 2.79 -0.02 -1.26 -4.95 135.00 136.03 3i4k n PRO 355 Ca 0.13 0.37 -0.38 0.00 -2.02 0.00 0.00 63.50 61.60 3i4k n PRO 355 Cb 0.45 -2.20 -0.06 0.00 -0.02 0.00 0.00 33.50 31.68 3i4k n PRO 355 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3i4k s GLN 356 N 4.60 4.42 0.00 -0.52 -1.52 -1.26 -4.46 119.66 120.92 3i4k s GLN 356 Ca 1.03 1.01 0.00 0.00 -1.95 0.00 0.00 55.36 55.45 3i4k s GLN 356 Cb -1.02 -3.17 0.00 0.00 -0.22 0.00 0.00 33.01 28.60 3i4k s GLN 356 CO 0.60 0.55 0.00 0.41 -0.25 0.00 0.00 175.29 176.60 3i4k n GLY 357 N 1.42 3.36 3.75 3.09 0.00 -1.26 -4.75 105.19 110.80 3i4k n GLY 357 Ca -0.06 -1.71 -0.34 0.00 0.00 0.00 0.00 46.02 43.91 3i4k n GLY 357 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3i4k s PRO 358 N -2.14 2.66 4.61 1.61 0.04 -1.26 -4.03 135.00 136.50 3i4k s PRO 358 Ca 0.00 1.63 0.00 0.00 0.04 0.00 0.00 61.00 62.67 3i4k s PRO 358 Cb 0.00 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.63 3i4k s PRO 358 CO 0.00 -1.40 0.00 0.41 0.04 0.00 0.00 177.00 176.05 3i4k n GLY 359 N 0.07 1.88 0.10 0.56 0.00 -0.91 -1.69 105.19 105.20 3i4k n GLY 359 Ca 0.12 -0.49 0.06 0.00 0.00 0.00 0.00 46.02 45.71 3i4k n GLY 359 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i4k n LEU 360 N 0.00 0.29 -0.36 0.99 4.32 -1.26 -1.88 117.00 119.10 3i4k n LEU 360 Ca 0.00 0.57 -0.05 0.00 -0.02 0.00 0.00 56.01 56.51 3i4k n LEU 360 Cb 0.00 -0.57 -0.02 0.00 -1.62 0.00 0.00 43.42 41.21 3i4k n LEU 360 CO 0.00 -0.67 -0.04 0.61 -1.22 0.00 0.00 177.39 176.07 3i4k n GLY 361 N -1.33 0.68 3.22 -0.72 0.00 -0.68 -4.73 105.19 101.63 3i4k n GLY 361 Ca -0.01 -0.85 -0.12 0.00 0.00 0.00 0.00 46.02 45.05 3i4k n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i4k s VAL 362 N -2.17 -0.02 -0.15 1.61 0.11 -1.26 -4.37 120.40 114.14 3i4k s VAL 362 Ca 0.00 0.08 -0.05 0.00 -2.93 0.00 0.00 61.98 59.08 3i4k s VAL 362 Cb 0.00 -0.53 -0.04 0.00 -1.53 0.00 0.00 36.38 34.28 3i4k s VAL 362 CO 0.00 0.03 0.03 -1.81 -3.33 0.00 0.00 175.10 170.02 3i4k s ASP 363 N 1.04 5.41 0.30 3.54 1.11 -1.23 -5.04 116.67 121.81 3i4k s ASP 363 Ca -0.07 0.08 -0.29 0.00 0.18 0.00 0.00 52.55 52.45 3i4k s ASP 363 Cb -0.07 -1.82 -0.10 0.00 1.07 0.00 0.00 42.92 41.99 3i4k s ASP 363 CO -0.08 0.23 1.35 0.68 1.18 0.00 0.00 175.17 178.53 3i4k s VAL 364 N -0.01 2.70 0.53 -1.27 -7.23 -1.26 -3.68 120.40 110.18 3i4k s VAL 364 Ca 0.04 0.66 0.07 0.00 -1.81 0.00 0.00 61.98 60.95 3i4k s VAL 364 Cb -0.12 -3.42 0.06 0.00 0.56 0.00 0.00 36.38 33.46 3i4k s VAL 364 CO 0.01 0.14 0.74 -0.62 -0.31 0.00 0.00 175.10 175.06 3i4k s ASP 365 N -0.20 5.23 0.00 4.85 -1.08 0.23 -4.89 116.67 120.81 3i4k s ASP 365 Ca 0.52 -0.58 0.00 0.00 -0.52 0.00 0.00 52.55 51.97 3i4k s ASP 365 Cb -0.40 -0.16 0.00 0.00 -1.46 0.00 0.00 42.92 40.90 3i4k s ASP 365 CO 0.50 -1.18 0.00 0.47 0.52 0.00 0.00 175.17 175.48 3i4k n ASP 367 N -2.18 0.00 0.16 -0.34 8.00 -1.26 -1.36 116.55 119.57 3i4k n ASP 367 Ca 0.12 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.63 3i4k n ASP 367 Cb 0.60 0.00 0.24 0.00 -0.02 0.00 0.00 41.12 41.94 3i4k n ASP 367 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3i4k h LYS 368 N 0.00 0.00 -0.08 -1.24 1.57 -1.93 -1.00 116.57 113.89 3i4k h LYS 368 Ca 0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 3i4k h LYS 368 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3i4k h LYS 368 CO 0.00 0.53 -0.60 0.28 -0.57 0.00 0.00 179.45 179.08 3i4k h VAL 369 N 0.00 1.38 0.13 0.50 2.07 -1.52 -1.96 116.25 116.84 3i4k h VAL 369 Ca -0.01 -1.97 -0.29 0.00 0.82 0.00 0.00 66.70 65.26 3i4k h VAL 369 Cb 0.99 1.98 0.02 0.00 -1.52 0.00 0.00 31.29 32.77 3i4k h VAL 369 CO 0.07 0.58 -1.24 0.78 0.02 0.00 0.00 177.57 177.78 3i4k h ASN 370 N 0.21 0.77 -0.65 0.57 -0.26 -1.79 -2.90 115.58 111.51 3i4k h ASN 370 Ca -0.01 -0.73 0.00 0.00 -0.56 0.00 0.00 56.30 55.01 3i4k h ASN 370 Cb 1.11 -0.24 -0.03 0.00 -1.06 0.00 0.00 38.32 38.10 3i4k h ASN 370 CO 0.10 1.55 0.42 0.15 -1.06 0.00 0.00 177.43 178.58 3i4k h PHE 371 N 0.23 0.84 -0.11 1.19 3.57 -1.09 -2.86 116.94 118.70 3i4k h PHE 371 Ca -0.18 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.34 3i4k h PHE 371 Cb 1.92 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 40.38 3i4k h PHE 371 CO 0.10 0.54 0.00 0.66 -2.23 0.00 0.00 178.31 177.38 3i4k n TYR 372 N -4.61 0.14 -2.39 0.41 4.01 -0.74 -4.90 117.16 109.07 3i4k n TYR 372 Ca 0.05 -0.07 -0.42 0.00 -0.16 0.00 0.00 57.90 57.30 3i4k n TYR 372 Cb 0.03 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.03 3i4k n TYR 372 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3i4k s THR 373 N -1.86 4.01 -2.00 -0.72 2.01 -1.08 -1.17 115.64 114.83 3i4k s THR 373 Ca 0.34 1.41 0.05 0.00 0.31 0.00 0.00 61.69 63.80 3i4k s THR 373 Cb 0.19 -3.91 0.13 0.00 0.01 0.00 0.00 72.50 68.92 3i4k s THR 373 CO 0.29 0.07 0.74 -1.14 -0.69 0.00 0.00 174.62 173.89