#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 2.88 -4.68 -2.67 7.94 -1.26 -1.35 117.00 117.86 3i4k n LEU 6 Ca 0.00 -0.96 -0.46 0.00 -1.11 0.00 0.00 56.01 53.47 3i4k n LEU 6 Cb 0.00 -0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 3i4k n LEU 6 CO 0.00 0.48 1.33 0.41 -1.11 0.00 0.00 177.39 178.51 3i4k n THR 7 N 1.25 0.25 -2.35 1.96 -1.04 -1.26 -1.81 114.28 111.27 3i4k n THR 7 Ca 0.14 -0.04 -0.43 0.00 -2.04 0.00 0.00 64.05 61.68 3i4k n THR 7 Cb 0.58 -1.73 -0.02 0.00 -1.82 0.00 0.00 70.33 67.33 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 2.23 3.93 -0.14 12.58 1.09 0.41 -1.03 121.20 140.27 3i4k s ILE 8 Ca 0.84 0.96 -0.11 0.00 -1.10 0.00 0.00 60.65 61.24 3i4k s ILE 8 Cb -0.66 -4.19 -0.25 0.00 -1.06 0.00 0.00 42.46 36.31 3i4k s ILE 8 CO 0.42 -0.72 0.35 1.56 -0.10 0.00 0.00 174.94 176.46 3i4k h GLN 9 N 10.54 0.21 -3.51 2.79 1.08 -1.29 -0.49 115.11 124.44 3i4k h GLN 9 Ca -0.27 -0.36 -0.14 0.00 -1.45 0.00 0.00 58.65 56.42 3i4k h GLN 9 Cb 1.11 0.13 -0.21 0.00 -0.05 0.00 0.00 27.48 28.46 3i4k h GLN 9 CO 1.08 1.17 -0.49 0.21 -0.95 0.00 0.00 178.83 179.85 3i4k s LYS 10 N -2.51 0.49 -0.08 1.46 2.20 -1.07 -4.80 119.74 115.43 3i4k s LYS 10 Ca -0.24 -0.40 -0.01 0.00 -0.36 0.00 0.00 55.97 54.96 3i4k s LYS 10 Cb 0.06 0.20 0.03 0.00 -1.51 0.00 0.00 37.83 36.61 3i4k s LYS 10 CO 0.73 -0.12 -0.02 0.14 -0.36 0.00 0.00 175.35 175.72 3i4k s VAL 11 N -1.40 0.58 0.23 4.02 -7.23 -1.26 0.65 120.40 115.99 3i4k s VAL 11 Ca -0.15 -0.01 0.12 0.00 -1.81 0.00 0.00 61.98 60.12 3i4k s VAL 11 Cb -0.08 -0.69 -0.05 0.00 0.56 0.00 0.00 36.38 36.13 3i4k s VAL 11 CO 0.02 0.29 -0.22 -1.61 -0.31 0.00 0.00 175.10 173.26 3i4k s GLU 12 N 1.82 1.59 -0.03 4.82 2.02 -0.03 -4.96 118.70 123.93 3i4k s GLU 12 Ca 0.04 -1.63 -0.01 0.00 0.02 0.00 0.00 54.97 53.39 3i4k s GLU 12 Cb -0.12 -1.80 0.03 0.00 0.10 0.00 0.00 34.13 32.33 3i4k s GLU 12 CO -0.06 0.37 0.05 -1.54 0.02 0.00 0.00 175.26 174.10 3i4k s SER 13 N -3.05 0.03 -0.04 -0.19 1.04 -1.26 0.14 113.70 110.37 3i4k s SER 13 Ca 0.25 0.09 0.04 0.00 0.48 0.00 0.00 55.95 56.81 3i4k s SER 13 Cb -0.07 -0.01 -0.00 0.00 0.10 0.00 0.00 66.02 66.04 3i4k s SER 13 CO 0.12 -0.12 -0.16 -0.13 0.98 0.00 0.00 173.24 173.93 3i4k s ARG 14 N 0.99 1.64 -0.22 4.02 0.52 0.20 -4.94 118.95 121.18 3i4k s ARG 14 Ca -0.08 -0.56 -0.25 0.00 -0.52 0.00 0.00 55.73 54.32 3i4k s ARG 14 Cb -0.11 -1.44 -0.01 0.00 0.52 0.00 0.00 34.95 33.90 3i4k s ARG 14 CO -0.03 0.22 0.82 0.42 0.02 0.00 0.00 175.30 176.75 3i4k s ILE 15 N 0.06 4.86 -0.20 1.52 1.01 -1.26 -0.13 121.20 127.07 3i4k s ILE 15 Ca -0.04 1.56 -0.06 0.00 0.00 0.00 0.00 60.65 62.12 3i4k s ILE 15 Cb -0.11 -4.11 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 3i4k s ILE 15 CO 0.02 -0.03 0.01 -0.76 0.00 0.00 0.00 174.94 174.18 3i4k s LEU 16 N 2.56 3.37 -0.54 2.97 1.43 0.33 0.50 118.68 129.30 3i4k s LEU 16 Ca 0.36 -0.15 -0.07 0.00 -1.03 0.00 0.00 54.13 53.23 3i4k s LEU 16 Cb -0.16 -1.86 0.14 0.00 0.03 0.00 0.00 46.19 44.35 3i4k s LEU 16 CO 0.09 0.08 0.39 -1.81 0.23 0.00 0.00 176.35 175.34 3i4k s ASP 17 N 0.90 5.65 -0.24 2.29 1.01 0.00 -0.82 116.67 125.46 3i4k s ASP 17 Ca 0.02 -2.23 -0.07 0.00 0.71 0.00 0.00 52.55 50.97 3i4k s ASP 17 Cb -0.14 -1.97 -0.03 0.00 1.01 0.00 0.00 42.92 41.79 3i4k s ASP 17 CO 0.02 -0.59 0.07 0.54 0.21 0.00 0.00 175.17 175.42 3i4k s VAL 18 N 0.88 4.38 0.61 -1.27 0.11 -0.89 -4.82 120.40 119.39 3i4k s VAL 18 Ca 0.10 -0.15 -0.19 0.00 -2.93 0.00 0.00 61.98 58.80 3i4k s VAL 18 Cb -0.23 -3.04 -0.02 0.00 -1.53 0.00 0.00 36.38 31.56 3i4k s VAL 18 CO -0.03 0.35 1.33 -2.84 -3.33 0.00 0.00 175.10 170.58 3i4k s PRO 19 N 1.48 2.75 0.23 1.54 0.02 -1.26 -1.67 135.00 138.09 3i4k s PRO 19 Ca 0.06 2.15 0.04 0.00 0.02 0.00 0.00 61.00 63.27 3i4k s PRO 19 Cb -0.15 -1.99 -0.03 0.00 0.02 0.00 0.00 34.50 32.35 3i4k s PRO 19 CO 0.04 -1.47 0.36 -0.51 -0.33 0.00 0.00 177.00 175.09 3i4k s LEU 20 N -4.07 4.31 0.13 -5.54 1.02 -0.74 0.64 118.68 114.43 3i4k s LEU 20 Ca 0.79 0.11 -0.13 0.00 0.02 0.00 0.00 54.13 54.91 3i4k s LEU 20 Cb -0.39 -2.89 -0.04 0.00 0.02 0.00 0.00 46.19 42.88 3i4k s LEU 20 CO 0.43 -0.07 1.49 0.40 0.02 0.00 0.00 176.35 178.63 3i4k h ILE 21 N 1.21 1.28 -3.81 -0.59 2.04 -1.56 -3.41 117.51 112.68 3i4k h ILE 21 Ca -0.51 -1.36 -0.30 0.00 1.00 0.00 0.00 64.86 63.68 3i4k h ILE 21 Cb 1.22 1.33 -0.18 0.00 -0.74 0.00 0.00 36.82 38.45 3i4k h ILE 21 CO 0.62 0.45 -0.73 -0.13 0.00 0.00 0.00 178.15 178.36 3i4k s ARG 22 N -4.58 0.77 0.32 2.37 0.52 -1.26 -5.04 118.95 112.06 3i4k s ARG 22 Ca -0.12 -1.08 -0.29 0.00 -0.52 0.00 0.00 55.73 53.72 3i4k s ARG 22 Cb 0.10 -0.46 -0.10 0.00 0.52 0.00 0.00 34.95 35.01 3i4k s ARG 22 CO 0.84 0.07 1.39 -2.14 0.02 0.00 0.00 175.30 175.48 3i4k s PRO 23 N -2.59 4.27 -0.37 3.54 0.02 -1.26 -4.87 135.00 133.74 3i4k s PRO 23 Ca 0.02 2.33 -0.09 0.00 0.02 0.00 0.00 61.00 63.28 3i4k s PRO 23 Cb -0.04 -3.05 0.04 0.00 0.02 0.00 0.00 34.50 31.47 3i4k s PRO 23 CO -0.00 -0.33 0.19 -1.58 -0.33 0.00 0.00 177.00 174.94 3i4k s HIS 24 N -0.87 3.26 -0.08 6.54 2.46 0.19 -4.92 115.29 121.89 3i4k s HIS 24 Ca 0.52 -1.19 -0.20 0.00 0.47 0.00 0.00 55.06 54.67 3i4k s HIS 24 Cb -0.42 -2.48 -0.04 0.00 -0.13 0.00 0.00 32.58 29.51 3i4k s HIS 24 CO 0.53 -0.71 0.56 0.20 -2.47 0.00 0.00 174.74 172.86 3i4k s GLY 25 N 1.60 2.51 0.24 1.59 0.00 -1.26 -0.11 107.32 111.89 3i4k s GLY 25 Ca 0.01 -0.05 0.01 0.00 0.00 0.00 0.00 44.72 44.69 3i4k s GLY 25 CO 0.05 0.87 0.10 0.69 0.00 0.00 0.00 173.10 174.82 3i4k n PHE 26 N 3.48 -0.37 -0.26 1.90 3.72 0.72 0.32 117.46 126.96 3i4k n PHE 26 Ca -0.05 -1.09 -0.04 0.00 -0.05 0.00 0.00 57.45 56.21 3i4k n PHE 26 Cb 0.51 -0.18 0.07 0.00 -0.94 0.00 0.00 39.48 38.94 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 0.89 0.93 0.00 4.37 0.00 -1.88 -3.34 119.26 120.23 3i4k h ALA 27 Ca -0.17 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3i4k h ALA 27 Cb 0.58 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3i4k h ALA 27 CO 0.28 0.30 0.00 0.25 0.00 0.00 0.00 179.25 180.08 3i4k n THR 28 N -4.61 0.00 -4.04 0.00 -2.24 -1.26 -3.39 114.28 98.74 3i4k n THR 28 Ca 0.07 -0.44 -0.10 0.00 -2.27 0.00 0.00 64.05 61.32 3i4k n THR 28 Cb 0.04 1.08 -0.08 0.00 -2.10 0.00 0.00 70.33 69.28 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 -0.30 0.05 -0.06 4.28 -4.23 -1.25 -5.15 115.64 108.97 3i4k s THR 29 Ca 0.00 -1.58 -0.01 0.00 -1.18 0.00 0.00 61.69 58.92 3i4k s THR 29 Cb 0.00 -2.03 0.03 0.00 1.34 0.00 0.00 72.50 71.84 3i4k s THR 29 CO 0.00 -0.24 -0.01 -0.89 -0.54 0.00 0.00 174.62 172.93 3i4k s THR 30 N -4.02 0.43 -0.08 3.99 2.01 -1.26 -0.20 115.64 116.51 3i4k s THR 30 Ca 0.23 0.04 -0.12 0.00 0.31 0.00 0.00 61.69 62.14 3i4k s THR 30 Cb 0.04 -0.55 -0.05 0.00 0.01 0.00 0.00 72.50 71.95 3i4k s THR 30 CO 0.03 0.25 0.30 -0.44 -0.69 0.00 0.00 174.62 174.08 3i4k s SER 31 N 1.64 6.59 -0.01 3.53 0.01 0.84 -4.88 113.70 121.42 3i4k s SER 31 Ca 0.00 0.70 0.15 0.00 1.31 0.00 0.00 55.95 58.11 3i4k s SER 31 Cb -0.13 -2.18 -0.21 0.00 0.21 0.00 0.00 66.02 63.71 3i4k s SER 31 CO -0.04 0.28 0.42 0.35 0.41 0.00 0.00 173.24 174.66 3i4k n THR 32 N 2.41 0.00 -3.80 1.44 -2.24 -1.26 0.58 114.28 111.40 3i4k n THR 32 Ca -0.15 -0.28 -0.09 0.00 -2.27 0.00 0.00 64.05 61.26 3i4k n THR 32 Cb 0.53 0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 69.12 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 -2.83 0.92 -0.10 -0.78 -1.05 -1.26 -1.79 118.70 111.81 3i4k s GLU 33 Ca -0.02 -0.90 -0.00 0.00 -0.15 0.00 0.00 54.97 53.90 3i4k s GLU 33 Cb 0.10 0.38 -0.02 0.00 -0.44 0.00 0.00 34.13 34.15 3i4k s GLU 33 CO 0.62 -0.32 -0.09 -1.14 0.95 0.00 0.00 175.26 175.29 3i4k s GLN 34 N -3.85 3.11 -0.13 -4.83 2.00 -0.67 -4.89 119.66 110.40 3i4k s GLN 34 Ca 0.05 -0.60 -0.09 0.00 -2.00 0.00 0.00 55.36 52.72 3i4k s GLN 34 Cb 0.04 -2.65 -0.04 0.00 0.80 0.00 0.00 33.01 31.15 3i4k s GLN 34 CO -0.11 0.44 0.18 -1.01 -0.50 0.00 0.00 175.29 174.29 3i4k s HIS 35 N -0.21 3.55 -0.02 1.67 3.76 -1.26 -2.10 115.29 120.67 3i4k s HIS 35 Ca 0.02 0.54 0.00 0.00 -0.15 0.00 0.00 55.06 55.47 3i4k s HIS 35 Cb -0.13 -2.07 0.02 0.00 1.11 0.00 0.00 32.58 31.51 3i4k s HIS 35 CO 0.03 0.57 0.02 0.42 -0.85 0.00 0.00 174.74 174.92 3i4k s ILE 36 N -0.53 -0.01 -0.45 0.60 1.01 -0.00 -4.57 121.20 117.25 3i4k s ILE 36 Ca 0.14 0.16 -0.17 0.00 0.00 0.00 0.00 60.65 60.79 3i4k s ILE 36 Cb -0.12 -0.10 0.04 0.00 0.01 0.00 0.00 42.46 42.29 3i4k s ILE 36 CO 0.03 0.09 0.44 -0.22 0.00 0.00 0.00 174.94 175.28 3i4k s LEU 37 N 0.89 5.14 -0.31 2.97 2.96 -0.41 0.12 118.68 130.04 3i4k s LEU 37 Ca -0.08 -0.94 -0.21 0.00 -0.22 0.00 0.00 54.13 52.68 3i4k s LEU 37 Cb -0.11 -2.30 -0.01 0.00 0.50 0.00 0.00 46.19 44.27 3i4k s LEU 37 CO -0.02 -0.63 0.67 -0.22 -1.32 0.00 0.00 176.35 174.82 3i4k s LEU 38 N 2.01 4.14 -0.13 -0.68 2.96 0.82 -0.51 118.68 127.30 3i4k s LEU 38 Ca 0.09 0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 54.43 3i4k s LEU 38 Cb -0.20 -2.87 -0.03 0.00 0.50 0.00 0.00 46.19 43.59 3i4k s LEU 38 CO 0.11 -0.52 -0.01 -0.69 -1.32 0.00 0.00 176.35 173.91 3i4k s VAL 39 N 2.70 4.16 -0.06 1.68 1.01 0.09 -0.63 120.40 129.35 3i4k s VAL 39 Ca 0.27 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 62.01 3i4k s VAL 39 Cb -0.15 -2.79 -0.00 0.00 0.00 0.00 0.00 36.38 33.44 3i4k s VAL 39 CO 0.12 0.54 -0.18 -0.94 0.00 0.00 0.00 175.10 174.64 3i4k s SER 40 N -0.20 2.36 -0.24 3.32 1.04 0.12 -0.75 113.70 119.34 3i4k s SER 40 Ca 0.05 -0.40 -0.08 0.00 0.48 0.00 0.00 55.95 56.00 3i4k s SER 40 Cb -0.13 -0.82 -0.03 0.00 0.10 0.00 0.00 66.02 65.15 3i4k s SER 40 CO 0.02 0.14 0.08 -0.69 0.98 0.00 0.00 173.24 173.77 3i4k s VAL 41 N 0.19 4.45 -0.28 5.02 1.01 0.08 -0.85 120.40 130.03 3i4k s VAL 41 Ca -0.09 -0.13 -0.09 0.00 0.00 0.00 0.00 61.98 61.68 3i4k s VAL 41 Cb -0.14 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 3i4k s VAL 41 CO 0.04 0.34 0.13 -1.00 0.00 0.00 0.00 175.10 174.61 3i4k s HIS 42 N 1.50 3.15 0.32 5.22 3.76 0.21 -1.07 115.29 128.37 3i4k s HIS 42 Ca 0.06 -0.29 0.02 0.00 -0.15 0.00 0.00 55.06 54.69 3i4k s HIS 42 Cb -0.15 -2.32 -0.03 0.00 1.11 0.00 0.00 32.58 31.19 3i4k s HIS 42 CO 0.04 -0.33 0.50 -0.51 -0.85 0.00 0.00 174.74 173.60 3i4k s LEU 43 N 1.66 4.09 0.17 0.89 1.43 -0.52 -0.81 118.68 125.60 3i4k s LEU 43 Ca 0.06 0.36 -0.19 0.00 -1.03 0.00 0.00 54.13 53.33 3i4k s LEU 43 Cb -0.16 -3.20 0.10 0.00 0.03 0.00 0.00 46.19 42.96 3i4k s LEU 43 CO 0.07 -0.24 1.63 -0.08 0.23 0.00 0.00 176.35 177.97 3i4k h GLU 44 N 0.88 -0.12 0.00 1.70 4.57 -1.10 -0.14 114.58 120.38 3i4k h GLU 44 Ca -0.50 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 3i4k h GLU 44 Cb 1.22 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 3i4k h GLU 44 CO 0.61 -0.08 0.00 0.27 -1.18 0.00 0.00 179.01 178.63 3i4k n ASN 45 N -5.38 0.00 0.00 1.04 2.04 -0.46 -4.78 115.26 107.72 3i4k n ASN 45 Ca 0.02 -0.19 0.00 0.00 -0.44 0.00 0.00 54.58 53.97 3i4k n ASN 45 Cb 0.29 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.54 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 -0.52 1.71 3.79 4.83 0.00 -0.06 -5.03 105.19 109.90 3i4k n GLY 46 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.32 4.08 -0.00 1.61 0.11 -1.26 -4.84 120.40 116.79 3i4k s VAL 47 Ca 0.00 1.64 0.07 0.00 -2.93 0.00 0.00 61.98 60.76 3i4k s VAL 47 Cb 0.00 -3.87 -0.02 0.00 -1.53 0.00 0.00 36.38 30.96 3i4k s VAL 47 CO 0.00 0.05 -0.21 -0.63 -3.33 0.00 0.00 175.10 170.98 3i4k s ILE 48 N -1.69 1.67 0.13 7.04 1.01 -1.26 -1.44 121.20 126.67 3i4k s ILE 48 Ca 0.53 -0.97 0.11 0.00 0.00 0.00 0.00 60.65 60.32 3i4k s ILE 48 Cb -0.19 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 3i4k s ILE 48 CO 0.24 0.41 -0.25 -0.83 0.00 0.00 0.00 174.94 174.50 3i4k s GLY 49 N -0.66 1.54 0.05 6.18 0.00 -0.24 -4.55 107.32 109.64 3i4k s GLY 49 Ca 0.08 -1.46 0.07 0.00 0.00 0.00 0.00 44.72 43.41 3i4k s GLY 49 CO -0.00 -1.45 -0.19 -0.19 0.00 0.00 0.00 173.10 171.27 3i4k s TYR 50 N -1.18 1.65 0.01 1.90 2.02 -1.25 -0.74 117.35 119.75 3i4k s TYR 50 Ca 0.14 -0.37 -0.07 0.00 -0.37 0.00 0.00 57.07 56.39 3i4k s TYR 50 Cb -0.10 -0.97 0.00 0.00 -0.40 0.00 0.00 41.96 40.49 3i4k s TYR 50 CO 0.06 0.09 0.14 0.20 -1.57 0.00 0.00 175.55 174.47 3i4k s GLY 51 N -1.23 0.05 -0.15 0.71 0.00 0.07 -3.60 107.32 103.17 3i4k s GLY 51 Ca 0.06 -0.16 -0.05 0.00 0.00 0.00 0.00 44.72 44.56 3i4k s GLY 51 CO 0.02 -0.30 0.03 -0.54 0.00 0.00 0.00 173.10 172.31 3i4k s GLU 52 N -1.51 3.66 -0.50 2.90 2.02 -1.26 -0.73 118.70 123.28 3i4k s GLU 52 Ca -0.14 -0.38 -0.08 0.00 0.02 0.00 0.00 54.97 54.39 3i4k s GLU 52 Cb -0.07 -3.05 0.13 0.00 0.10 0.00 0.00 34.13 31.23 3i4k s GLU 52 CO 0.01 0.39 0.36 0.20 0.02 0.00 0.00 175.26 176.24 3i4k s GLY 53 N 0.01 2.12 -0.03 -1.39 0.00 0.33 -3.93 107.32 104.42 3i4k s GLY 53 Ca 0.04 -2.66 -0.03 0.00 0.00 0.00 0.00 44.72 42.07 3i4k s GLY 53 CO 0.01 1.11 0.09 0.54 0.00 0.00 0.00 173.10 174.85 3i4k s VAL 54 N 1.12 0.01 0.20 1.40 0.11 -1.26 -1.29 120.40 120.68 3i4k s VAL 54 Ca 0.08 -0.06 0.11 0.00 -2.93 0.00 0.00 61.98 59.17 3i4k s VAL 54 Cb -0.24 -0.16 -0.04 0.00 -1.53 0.00 0.00 36.38 34.41 3i4k s VAL 54 CO -0.02 -0.03 -0.22 0.68 -3.33 0.00 0.00 175.10 172.18 3i4k s VAL 55 N -0.07 2.22 -0.73 2.04 -7.23 -1.26 -4.85 120.40 110.53 3i4k s VAL 55 Ca -0.01 -2.05 -0.26 0.00 -1.81 0.00 0.00 61.98 57.85 3i4k s VAL 55 Cb -0.01 -2.07 -0.08 0.00 0.56 0.00 0.00 36.38 34.77 3i4k s VAL 55 CO 0.00 -0.21 2.21 -2.84 -0.31 0.00 0.00 175.10 173.96 3i4k s PRO 56 N -2.82 2.09 0.00 4.82 0.02 -1.20 -4.10 135.00 133.80 3i4k s PRO 56 Ca 0.21 0.50 0.00 0.00 0.02 0.00 0.00 61.00 61.73 3i4k s PRO 56 Cb -0.07 -4.76 0.00 0.00 0.02 0.00 0.00 34.50 29.69 3i4k s PRO 56 CO 0.10 -3.69 0.00 0.41 -0.33 0.00 0.00 177.00 173.49 3i4k n GLY 57 N 6.49 1.10 0.00 0.52 0.00 -1.26 -4.75 105.19 107.30 3i4k n GLY 57 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 0.15 -0.02 0.00 -1.26 -4.75 105.19 98.02 3i4k n GLY 58 Ca 0.00 -0.92 0.11 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.04 0.15 0.11 1.61 -0.04 -1.24 -2.96 135.00 132.59 3i4k n PRO 59 Ca 0.00 0.56 0.15 0.00 -0.04 0.00 0.00 63.50 64.17 3i4k n PRO 59 Cb 0.00 -1.91 0.68 0.00 -0.04 0.00 0.00 33.50 32.23 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 -0.19 0.54 5.08 -1.91 0.55 115.95 120.01 3i4k h TRP 60 Ca 0.00 0.00 -0.10 0.00 1.08 0.00 0.00 58.89 59.87 3i4k h TRP 60 Cb 0.12 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.28 3i4k h TRP 60 CO 0.00 0.00 -0.27 2.35 -1.28 0.00 0.00 178.44 179.24 3i4k h TRP 61 N 0.00 0.65 0.00 0.12 7.01 -1.83 -3.43 115.95 118.47 3i4k h TRP 61 Ca 0.15 -0.21 0.00 0.00 2.11 0.00 0.00 58.89 60.93 3i4k h TRP 61 Cb 0.60 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 27.53 3i4k h TRP 61 CO 0.00 0.92 -0.01 0.41 -2.79 0.00 0.00 178.44 176.97 3i4k n GLY 62 N 0.29 0.63 0.62 2.65 0.00 -1.06 -5.03 105.19 103.29 3i4k n GLY 62 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 1.55 3.75 -0.02 0.00 0.16 -5.06 105.19 105.57 3i4k n GLY 63 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.81 2.88 0.17 1.61 2.02 -1.26 -4.93 118.70 118.39 3i4k s GLU 64 Ca 0.00 -0.63 -0.01 0.00 0.02 0.00 0.00 54.97 54.35 3i4k s GLU 64 Cb 0.00 -2.74 -0.04 0.00 0.10 0.00 0.00 34.13 31.45 3i4k s GLU 64 CO 0.00 0.60 0.11 -1.54 0.02 0.00 0.00 175.26 174.45 3i4k s SER 65 N -2.02 0.20 0.37 -0.19 1.04 -1.26 -3.59 113.70 108.25 3i4k s SER 65 Ca 0.25 -1.31 0.09 0.00 0.48 0.00 0.00 55.95 55.46 3i4k s SER 65 Cb -0.12 0.35 0.85 0.00 0.10 0.00 0.00 66.02 67.20 3i4k s SER 65 CO 0.17 -0.80 1.91 -0.37 0.98 0.00 0.00 173.24 175.13 3i4k h VAL 66 N 2.70 0.89 -0.11 5.02 -1.51 -1.91 -1.38 116.25 119.96 3i4k h VAL 66 Ca -0.35 -0.22 -0.03 0.00 -1.23 0.00 0.00 66.70 64.87 3i4k h VAL 66 Cb 1.23 0.19 -0.00 0.00 -2.13 0.00 0.00 31.29 30.57 3i4k h VAL 66 CO 0.55 0.12 -0.03 -0.33 -1.23 0.00 0.00 177.57 176.64 3i4k h GLU 67 N 0.65 0.22 -0.96 5.19 3.07 -1.98 -1.47 114.58 119.31 3i4k h GLU 67 Ca 0.38 -0.09 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 3i4k h GLU 67 Cb 0.58 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.48 3i4k h GLU 67 CO -0.15 0.54 0.00 2.41 -1.40 0.00 0.00 179.01 180.41 3i4k n THR 68 N -4.74 0.03 0.00 1.13 -1.04 -0.52 -1.77 114.28 107.37 3i4k n THR 68 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 3i4k n THR 68 Cb 0.25 -0.27 0.00 0.00 -1.82 0.00 0.00 70.33 68.50 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 0.71 0.00 -0.10 -2.82 4.81 -0.55 -2.02 118.16 118.19 3i4k n LYS 70 Ca 0.00 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.38 3i4k n LYS 70 Cb 0.02 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.08 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 0.32 -0.29 3.14 0.00 -1.61 0.96 119.26 121.79 3i4k h ALA 71 Ca 0.00 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 3i4k h ALA 71 Cb 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3i4k h ALA 71 CO 0.00 -0.39 -0.26 -0.07 0.00 0.00 0.00 179.25 178.53 3i4k h LEU 72 N 0.11 0.74 0.18 0.00 3.38 -1.68 -0.77 115.31 117.27 3i4k h LEU 72 Ca 0.17 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 3i4k h LEU 72 Cb 0.22 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3i4k h LEU 72 CO -0.27 1.05 -0.09 0.58 0.09 0.00 0.00 178.44 179.80 3i4k h VAL 73 N 0.44 0.88 -0.31 1.22 2.07 -1.75 0.05 116.25 118.84 3i4k h VAL 73 Ca 0.05 -0.24 -0.09 0.00 0.82 0.00 0.00 66.70 67.24 3i4k h VAL 73 Cb 0.83 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 3i4k h VAL 73 CO 0.07 0.06 -0.16 0.44 0.02 0.00 0.00 177.57 177.99 3i4k h ASP 74 N -0.35 0.69 0.33 0.57 3.32 -0.88 -1.07 116.42 119.03 3i4k h ASP 74 Ca -0.02 -0.41 0.00 0.00 0.02 0.00 0.00 57.03 56.61 3i4k h ASP 74 Cb 0.28 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.64 3i4k h ASP 74 CO 0.04 0.95 -0.30 0.61 -1.72 0.00 0.00 179.24 178.82 3i4k n GLY 75 N -0.02 -0.83 0.52 2.75 0.00 -0.30 -4.62 105.19 102.69 3i4k n GLY 75 Ca -0.03 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.62 3i4k n GLY 75 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3i4k n TYR 76 N -0.91 -0.11 -0.04 1.61 4.02 -0.10 -4.93 117.16 116.69 3i4k n TYR 76 Ca 0.11 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.88 3i4k n TYR 76 Cb 0.34 0.13 -0.10 0.00 -0.02 0.00 0.00 39.34 39.68 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 -0.03 -0.44 7.72 3.38 -1.27 -3.38 115.31 121.30 3i4k h LEU 77 Ca 0.00 -0.72 0.09 0.00 0.09 0.00 0.00 57.88 57.33 3i4k h LEU 77 Cb 0.00 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 40.66 3i4k h LEU 77 CO 0.00 0.78 -0.27 0.00 0.09 0.00 0.00 178.44 179.04 3i4k h ALA 78 N -0.07 -0.03 -0.31 1.53 0.00 -1.43 -1.64 119.26 117.32 3i4k h ALA 78 Ca -0.00 0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.13 3i4k h ALA 78 Cb 0.75 0.62 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 3i4k h ALA 78 CO 0.00 -0.64 0.47 -1.00 0.00 0.00 0.00 179.25 178.08 3i4k h PRO 79 N -0.18 0.00 -0.02 0.00 0.13 -1.82 0.93 132.00 131.03 3i4k h PRO 79 Ca 0.20 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.17 3i4k h PRO 79 Cb 0.50 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 3i4k h PRO 79 CO -0.55 0.00 -0.73 0.28 -0.23 0.00 0.00 178.00 176.77 3i4k h VAL 80 N 0.00 1.46 -0.11 1.56 2.07 -1.47 -3.30 116.25 116.47 3i4k h VAL 80 Ca 0.15 -2.33 -0.22 0.00 0.82 0.00 0.00 66.70 65.12 3i4k h VAL 80 Cb 1.08 2.25 0.01 0.00 -1.52 0.00 0.00 31.29 33.11 3i4k h VAL 80 CO -0.00 0.68 -0.80 -0.07 0.02 0.00 0.00 177.57 177.39 3i4k h LEU 81 N 0.10 0.79 -9.36 2.57 4.07 -0.87 -3.46 115.31 109.16 3i4k h LEU 81 Ca -0.02 -0.54 -0.60 0.00 0.08 0.00 0.00 57.88 56.81 3i4k h LEU 81 Cb 1.29 -0.23 0.03 0.00 1.08 0.00 0.00 40.66 42.82 3i4k h LEU 81 CO 0.11 1.32 1.03 -0.38 -1.08 0.00 0.00 178.44 179.44 3i4k n ILE 82 N -3.89 0.43 -0.24 1.22 5.41 -1.17 -1.90 119.36 119.21 3i4k n ILE 82 Ca -0.07 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.60 3i4k n ILE 82 Cb 0.76 -1.83 0.00 0.00 -0.71 0.00 0.00 39.64 37.86 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 4.14 0.66 3.46 7.39 0.00 -0.19 -5.01 105.19 115.65 3i4k n GLY 83 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.76 1.84 0.28 1.61 0.52 -0.80 -4.85 118.95 116.78 3i4k s ARG 84 Ca 0.00 -1.13 -0.29 0.00 -0.52 0.00 0.00 55.73 53.79 3i4k s ARG 84 Cb 0.00 -2.11 -0.10 0.00 0.52 0.00 0.00 34.95 33.26 3i4k s ARG 84 CO 0.00 0.50 1.20 0.00 0.02 0.00 0.00 175.30 177.01 3i4k s ALA 85 N -1.05 3.45 0.07 2.13 0.00 -1.26 -0.45 121.76 124.65 3i4k s ALA 85 Ca 0.16 1.04 0.32 0.00 0.00 0.00 0.00 51.96 53.48 3i4k s ALA 85 Cb -0.10 -3.40 1.56 0.00 0.00 0.00 0.00 23.12 21.18 3i4k s ALA 85 CO 0.08 -0.37 1.96 -0.24 0.00 0.00 0.00 175.76 177.18 3i4k h VAL 86 N 3.22 0.00 0.00 0.00 3.04 -1.71 -0.95 116.25 119.84 3i4k h VAL 86 Ca -0.47 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.06 3i4k h VAL 86 Cb 1.22 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 31.45 3i4k h VAL 86 CO 0.68 0.00 0.00 -1.54 -1.01 0.00 0.00 177.57 175.70 3i4k n SER 87 N -2.68 0.00 -1.31 3.17 3.41 -1.26 -1.78 113.62 113.17 3i4k n SER 87 Ca -0.01 -0.95 0.08 0.00 -0.26 0.00 0.00 58.87 57.73 3i4k n SER 87 Cb 0.14 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.40 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 -0.83 3.58 -0.24 4.33 1.02 -0.36 -4.82 120.64 123.32 3i4k n GLU 88 Ca 0.11 -2.80 -0.06 0.00 -0.02 0.00 0.00 57.16 54.40 3i4k n GLU 88 Cb 0.05 -1.84 -0.06 0.00 -0.02 0.00 0.00 31.44 29.57 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 0.52 -0.61 -0.28 -4.62 -0.00 -0.73 -0.88 117.00 110.41 3i4k n LEU 89 Ca 0.23 1.12 -0.02 0.00 -0.00 0.00 0.00 56.01 57.33 3i4k n LEU 89 Cb 0.87 -0.18 0.10 0.00 -0.00 0.00 0.00 43.42 44.21 3i4k n LEU 89 CO 0.21 -0.88 1.17 0.00 -0.00 0.00 0.00 177.39 177.88 3i4k h ALA 90 N 0.19 1.02 -0.02 1.96 0.00 -1.89 -2.10 119.26 118.43 3i4k h ALA 90 Ca 0.09 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3i4k h ALA 90 Cb 0.23 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3i4k h ALA 90 CO -0.54 0.26 -0.43 0.78 0.00 0.00 0.00 179.25 179.32 3i4k h GLY 91 N 0.92 0.05 -2.03 0.00 0.00 -1.43 -2.49 103.07 98.09 3i4k h GLY 91 Ca 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.60 3i4k h GLY 91 CO -0.13 0.04 0.00 1.39 0.00 0.00 0.00 176.54 177.84 3i4k n ILE 92 N -4.02 0.53 0.00 2.60 5.41 -0.06 -1.88 119.36 121.94 3i4k n ILE 92 Ca -0.02 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.73 3i4k n ILE 92 Cb 0.47 -0.77 0.00 0.00 -0.71 0.00 0.00 39.64 38.62 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 0.76 0.00 0.25 -1.39 0.00 -0.94 -1.53 120.51 117.67 3i4k n ALA 94 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3i4k n ALA 94 Cb 0.26 0.00 0.59 0.00 0.00 0.00 0.00 19.45 20.30 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 -0.13 0.00 3.32 -1.67 -2.55 116.42 115.40 3i4k h ASP 95 Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 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 0.13 0.01 -0.07 -1.72 0.00 0.00 179.24 177.59 3i4k h LEU 96 N 0.00 0.29 -2.48 1.55 3.38 -1.56 -2.13 115.31 114.36 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 0.59 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 3i4k h LEU 96 CO 0.02 0.34 -0.01 -0.33 0.09 0.00 0.00 178.44 178.55 3i4k h GLU 97 N 0.32 0.00 0.00 1.13 4.39 -1.64 -1.27 114.58 117.50 3i4k h GLU 97 Ca 0.07 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.66 3i4k h GLU 97 Cb 0.20 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 3i4k h GLU 97 CO 0.00 0.01 -0.53 0.00 -1.16 0.00 0.00 179.01 177.33 3i4k h ARG 98 N 0.00 0.00 0.00 2.33 3.08 -1.52 -3.33 114.38 114.95 3i4k h ARG 98 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3i4k h ARG 98 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 3i4k h ARG 98 CO 0.00 0.53 -1.33 1.33 -1.07 0.00 0.00 179.97 179.43 3i4k n VAL 99 N -3.61 0.00 -3.48 2.04 0.24 -0.70 -4.94 118.33 107.88 3i4k n VAL 99 Ca -0.00 -0.28 -0.13 0.00 -2.04 0.00 0.00 64.34 61.89 3i4k n VAL 99 Cb 0.60 0.45 -0.11 0.00 -1.47 0.00 0.00 33.84 33.32 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 -2.79 -0.49 0.48 3.34 1.01 -0.56 -5.03 120.40 116.36 3i4k s VAL 100 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.87 3i4k s VAL 100 Cb 0.10 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.74 3i4k s VAL 100 CO 0.61 -0.09 0.86 0.00 0.00 0.00 0.00 175.10 176.47 3i4k s ALA 101 N 2.46 3.28 0.00 5.51 0.00 -1.26 -4.32 121.76 127.42 3i4k s ALA 101 Ca 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.82 3i4k s ALA 101 Cb -0.15 -2.80 0.00 0.00 0.00 0.00 0.00 23.12 20.17 3i4k s ALA 101 CO -0.13 -0.27 0.00 0.54 0.00 0.00 0.00 175.76 175.90 3i4k n ARG 102 N -1.89 0.00 -3.30 0.00 1.74 -1.26 -4.87 116.66 107.07 3i4k n ARG 102 Ca 0.03 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.87 3i4k n ARG 102 Cb 0.54 0.00 0.03 0.00 -1.02 0.00 0.00 32.46 32.02 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 7.67 -1.09 -0.33 7.54 0.00 -1.26 -4.86 120.51 128.18 3i4k n ALA 103 Ca 0.00 0.25 0.10 0.00 0.00 0.00 0.00 53.44 53.80 3i4k n ALA 103 Cb 0.00 -4.01 0.31 0.00 0.00 0.00 0.00 19.45 15.74 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 -1.61 0.82 -0.49 0.00 2.47 -1.89 -1.40 114.38 112.27 3i4k h ARG 104 Ca -0.52 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 58.15 3i4k h ARG 104 Cb 1.35 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 29.46 3i4k h ARG 104 CO 0.57 0.54 0.30 1.88 0.56 0.00 0.00 179.97 183.83 3i4k h TYR 105 N 0.84 0.65 -0.40 3.04 0.05 -1.75 0.10 116.97 119.50 3i4k h TYR 105 Ca 0.50 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.27 3i4k h TYR 105 Cb 0.66 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 38.16 3i4k h TYR 105 CO -0.00 0.44 0.22 0.00 -1.05 0.00 0.00 178.16 177.77 3i4k h ALA 106 N 1.15 0.51 -0.26 3.88 0.00 -1.64 -2.90 119.26 120.00 3i4k h ALA 106 Ca 0.18 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3i4k h ALA 106 Cb -0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3i4k h ALA 106 CO -0.03 0.04 -0.09 0.87 0.00 0.00 0.00 179.25 180.03 3i4k h LYS 107 N 0.52 0.42 -0.75 0.00 1.57 -0.88 -2.73 116.57 114.72 3i4k h LYS 107 Ca 0.14 -0.11 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 3i4k h LYS 107 Cb 0.05 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 3i4k h LYS 107 CO -0.02 0.53 0.49 0.00 -0.57 0.00 0.00 179.45 179.88 3i4k h ALA 108 N 1.51 1.71 -0.52 3.86 0.00 -0.59 -1.58 119.26 123.64 3i4k h ALA 108 Ca 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3i4k h ALA 108 Cb 0.42 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3i4k h ALA 108 CO 0.02 0.17 0.29 0.00 0.00 0.00 0.00 179.25 179.73 3i4k h ALA 109 N 1.60 0.66 -0.59 0.00 0.00 -1.50 -0.74 119.26 118.69 3i4k h ALA 109 Ca 0.33 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 3i4k h ALA 109 Cb 0.30 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3i4k h ALA 109 CO -0.11 0.17 0.11 0.28 0.00 0.00 0.00 179.25 179.69 3i4k h VAL 110 N 0.69 1.26 -0.03 0.00 2.07 -1.44 -1.50 116.25 117.29 3i4k h VAL 110 Ca 0.18 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 3i4k h VAL 110 Cb 0.03 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 3i4k h VAL 110 CO -0.03 0.36 0.01 -0.78 0.02 0.00 0.00 177.57 177.14 3i4k h ASP 111 N 0.87 0.05 -0.71 0.57 1.82 -0.95 -3.15 116.42 114.93 3i4k h ASP 111 Ca 0.18 -0.20 -0.07 0.00 -0.39 0.00 0.00 57.03 56.55 3i4k h ASP 111 Cb 0.40 -0.01 -0.03 0.00 0.68 0.00 0.00 39.33 40.37 3i4k h ASP 111 CO 0.01 0.23 0.17 0.58 -1.61 0.00 0.00 179.24 178.62 3i4k h VAL 112 N -0.14 1.26 0.00 2.25 2.07 -1.12 -2.21 116.25 118.36 3i4k h VAL 112 Ca 0.01 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.55 3i4k h VAL 112 Cb 0.20 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 3i4k h VAL 112 CO -0.00 0.38 0.00 0.00 0.02 0.00 0.00 177.57 177.97 3i4k n ALA 113 N -2.46 1.03 0.00 1.67 0.00 -0.57 -1.24 120.51 118.94 3i4k n ALA 113 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3i4k n ALA 113 Cb 0.26 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 0.53 0.00 0.24 0.00 8.25 -0.83 -1.08 115.22 122.33 3i4k n HIS 115 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 3i4k n HIS 115 Cb 0.00 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.03 3i4k n HIS 115 CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 3i4k h ASP 116 N 0.00 -0.48 -0.67 0.41 3.58 -1.45 0.15 116.42 117.96 3i4k h ASP 116 Ca 0.00 -0.03 0.01 0.00 0.42 0.00 0.00 57.03 57.43 3i4k h ASP 116 Cb 0.00 0.13 -0.04 0.00 1.72 0.00 0.00 39.33 41.14 3i4k h ASP 116 CO 0.00 -0.28 0.43 0.00 -2.88 0.00 0.00 179.24 176.52 3i4k h ALA 117 N -0.12 0.86 -0.11 -0.78 0.00 -1.34 -1.38 119.26 116.38 3i4k h ALA 117 Ca -0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3i4k h ALA 117 Cb 0.49 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3i4k h ALA 117 CO 0.10 0.24 0.02 2.35 0.00 0.00 0.00 179.25 181.96 3i4k h TRP 118 N 0.88 0.20 -0.42 0.00 7.01 -1.78 -2.32 115.95 119.52 3i4k h TRP 118 Ca 0.25 -0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.21 3i4k h TRP 118 Cb -0.07 -0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 26.92 3i4k h TRP 118 CO -0.03 0.39 0.18 0.00 -2.79 0.00 0.00 178.44 176.18 3i4k h ALA 119 N 0.79 1.54 -0.38 2.65 0.00 -0.51 -2.58 119.26 120.77 3i4k h ALA 119 Ca 0.03 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3i4k h ALA 119 Cb 0.30 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3i4k h ALA 119 CO 0.00 0.37 -0.02 0.00 0.00 0.00 0.00 179.25 179.60 3i4k h ARG 120 N 0.59 0.68 0.00 0.00 3.08 -1.13 0.78 114.38 118.37 3i4k h ARG 120 Ca 0.15 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 3i4k h ARG 120 Cb 0.10 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 3i4k h ARG 120 CO -0.02 0.79 -0.06 0.77 -1.07 0.00 0.00 179.97 180.38 3i4k h SER 121 N 0.50 0.00 -0.03 7.04 0.02 -1.04 0.63 113.55 120.67 3i4k h SER 121 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3i4k h SER 121 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 3i4k h SER 121 CO 0.02 0.06 -0.10 0.18 -1.14 0.00 0.00 176.83 175.85 3i4k n LEU 122 N -3.82 2.70 -3.52 5.07 4.77 -1.05 -4.99 117.00 116.16 3i4k n LEU 122 Ca -0.02 -0.95 -0.21 0.00 -0.03 0.00 0.00 56.01 54.80 3i4k n LEU 122 Cb 0.15 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.30 3i4k n LEU 122 CO 0.29 0.46 -0.01 -3.20 -1.33 0.00 0.00 177.39 173.60 3i4k n ASN 123 N 0.99 -3.83 -4.08 -1.43 5.15 0.21 -5.03 115.26 107.24 3i4k n ASN 123 Ca 0.12 -0.80 -0.10 0.00 -0.60 0.00 0.00 54.58 53.20 3i4k n ASN 123 Cb 0.54 -4.42 -0.08 0.00 -0.53 0.00 0.00 39.78 35.29 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 -3.50 0.06 0.75 3.44 -7.23 0.06 -4.88 120.40 109.10 3i4k s VAL 124 Ca 0.24 -1.71 -0.11 0.00 -1.81 0.00 0.00 61.98 58.59 3i4k s VAL 124 Cb -0.05 -2.10 0.04 0.00 0.56 0.00 0.00 36.38 34.83 3i4k s VAL 124 CO 0.79 -0.25 1.08 -2.84 -0.31 0.00 0.00 175.10 173.57 3i4k s PRO 125 N -4.04 2.48 0.33 4.82 0.02 -1.26 -1.36 135.00 135.98 3i4k s PRO 125 Ca 0.25 0.83 0.06 0.00 0.02 0.00 0.00 61.00 62.16 3i4k s PRO 125 Cb 0.05 -1.95 0.58 0.00 0.02 0.00 0.00 34.50 33.20 3i4k s PRO 125 CO 0.04 -1.39 1.82 0.28 -0.33 0.00 0.00 177.00 177.42 3i4k h VAL 126 N -0.93 1.23 -0.24 3.83 2.07 -1.43 -2.34 116.25 118.44 3i4k h VAL 126 Ca -0.45 -1.03 0.07 0.00 0.82 0.00 0.00 66.70 66.11 3i4k h VAL 126 Cb 1.24 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 3i4k h VAL 126 CO 0.57 0.33 0.20 0.08 0.02 0.00 0.00 177.57 178.77 3i4k h ARG 127 N 0.36 0.00 0.00 1.57 0.11 -1.85 0.32 114.38 114.89 3i4k h ARG 127 Ca 0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.14 3i4k h ARG 127 Cb 0.51 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.59 3i4k h ARG 127 CO 0.03 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.85 3i4k n ASP 128 N -4.17 0.00 -0.88 0.08 9.92 -0.88 -0.57 116.55 120.06 3i4k n ASP 128 Ca 0.03 0.28 0.11 0.00 -0.53 0.00 0.00 54.79 54.67 3i4k n ASP 128 Cb 0.35 -0.39 0.10 0.00 -0.64 0.00 0.00 41.12 40.55 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 -1.39 2.84 -0.83 0.64 4.77 0.10 -4.39 117.00 118.75 3i4k n LEU 129 Ca 0.05 -1.08 0.05 0.00 -0.03 0.00 0.00 56.01 55.01 3i4k n LEU 129 Cb 0.14 -0.04 0.15 0.00 -2.33 0.00 0.00 43.42 41.34 3i4k n LEU 129 CO 0.12 0.51 0.28 0.18 -1.33 0.00 0.00 177.39 177.15 3i4k n LEU 130 N 1.21 2.16 0.00 2.23 4.77 0.27 -4.98 117.00 122.67 3i4k n LEU 130 Ca 0.13 -3.29 0.00 0.00 -0.03 0.00 0.00 56.01 52.83 3i4k n LEU 130 Cb 0.53 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3i4k n LEU 130 CO 0.13 1.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.91 3i4k n GLY 131 N -0.66 0.24 0.00 -0.72 0.00 -1.16 -4.82 105.19 98.07 3i4k n GLY 131 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.74 -0.78 3.30 -0.02 0.00 -0.74 -4.98 105.19 100.23 3i4k n GLY 132 Ca 0.00 -1.92 -0.31 0.00 0.00 0.00 0.00 46.02 43.79 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 2.02 -0.07 2.61 -4.23 -1.26 -3.76 115.64 110.95 3i4k s THR 133 Ca 0.00 -1.09 0.08 0.00 -1.18 0.00 0.00 61.69 59.50 3i4k s THR 133 Cb 0.00 -1.68 -0.11 0.00 1.34 0.00 0.00 72.50 72.05 3i4k s THR 133 CO 0.00 0.57 0.06 0.52 -0.54 0.00 0.00 174.62 175.23 3i4k n VAL 134 N 2.50 0.47 -3.83 2.29 0.31 0.28 -4.96 118.33 115.40 3i4k n VAL 134 Ca -0.16 -0.33 -0.10 0.00 -0.01 0.00 0.00 64.34 63.74 3i4k n VAL 134 Cb 0.51 -0.56 -0.06 0.00 -0.91 0.00 0.00 33.84 32.82 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 -2.29 1.17 0.00 5.55 1.70 -1.10 -5.07 118.95 118.91 3i4k s ARG 135 Ca -0.04 -0.98 0.00 0.00 -0.47 0.00 0.00 55.73 54.24 3i4k s ARG 135 Cb 0.03 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.84 3i4k s ARG 135 CO 0.36 -0.45 0.59 -0.40 -1.08 0.00 0.00 175.30 174.32 3i4k n ASP 136 N -0.24 1.09 -3.67 -2.89 5.68 -1.26 -4.62 116.55 110.64 3i4k n ASP 136 Ca -0.11 -1.32 -0.14 0.00 -0.50 0.00 0.00 54.79 52.73 3i4k n ASP 136 Cb 0.63 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.54 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 -0.32 0.87 -0.01 0.11 -2.85 -1.26 -0.05 119.74 116.23 3i4k s LYS 137 Ca 0.00 -0.24 -0.03 0.00 -1.00 0.00 0.00 55.97 54.70 3i4k s LYS 137 Cb 0.00 0.39 -0.00 0.00 -2.06 0.00 0.00 37.83 36.16 3i4k s LYS 137 CO 0.00 -0.28 0.06 0.14 0.10 0.00 0.00 175.35 175.37 3i4k s VAL 138 N -2.01 0.05 0.76 1.79 -7.23 -0.74 -4.95 120.40 108.07 3i4k s VAL 138 Ca -0.08 -0.39 -0.14 0.00 -1.81 0.00 0.00 61.98 59.56 3i4k s VAL 138 Cb -0.02 -0.22 0.06 0.00 0.56 0.00 0.00 36.38 36.75 3i4k s VAL 138 CO 0.01 -0.21 1.18 -1.81 -0.31 0.00 0.00 175.10 173.96 3i4k s ASP 139 N -0.66 4.07 -0.06 4.85 1.01 -1.26 -2.22 116.67 122.40 3i4k s ASP 139 Ca -0.07 2.27 0.00 0.00 0.71 0.00 0.00 52.55 55.46 3i4k s ASP 139 Cb -0.05 -2.58 0.02 0.00 1.01 0.00 0.00 42.92 41.33 3i4k s ASP 139 CO 0.00 -2.34 -0.04 -0.69 0.21 0.00 0.00 175.17 172.31 3i4k s VAL 140 N -2.18 0.58 -0.06 -1.27 1.01 -0.63 -2.29 120.40 115.55 3i4k s VAL 140 Ca 0.72 -0.10 -0.14 0.00 0.00 0.00 0.00 61.98 62.46 3i4k s VAL 140 Cb -0.27 -0.63 -0.05 0.00 0.00 0.00 0.00 36.38 35.43 3i4k s VAL 140 CO 0.48 0.26 0.36 0.42 0.00 0.00 0.00 175.10 176.61 3i4k s THR 141 N 1.24 5.16 -0.21 3.92 -4.23 0.74 -4.50 115.64 117.77 3i4k s THR 141 Ca -0.06 0.72 -0.10 0.00 -1.18 0.00 0.00 61.69 61.07 3i4k s THR 141 Cb -0.14 -3.67 -0.05 0.00 1.34 0.00 0.00 72.50 69.98 3i4k s THR 141 CO -0.02 0.52 0.15 0.86 -0.54 0.00 0.00 174.62 175.58 3i4k s TRP 142 N -0.56 3.39 -0.12 3.99 -0.11 -0.87 -4.50 118.94 120.16 3i4k s TRP 142 Ca 0.22 0.32 -0.06 0.00 1.22 0.00 0.00 56.10 57.80 3i4k s TRP 142 Cb -0.15 -2.20 -0.04 0.00 -1.50 0.00 0.00 33.47 29.58 3i4k s TRP 142 CO 0.10 0.24 0.10 0.00 -4.62 0.00 0.00 176.95 172.77 3i4k s ALA 143 N 0.52 3.69 -0.14 5.86 0.00 -1.26 -0.85 121.76 129.57 3i4k s ALA 143 Ca 0.08 -0.69 -0.03 0.00 0.00 0.00 0.00 51.96 51.33 3i4k s ALA 143 Cb -0.12 -1.85 -0.02 0.00 0.00 0.00 0.00 23.12 21.13 3i4k s ALA 143 CO -0.00 0.56 -0.06 -0.51 0.00 0.00 0.00 175.76 175.75 3i4k s LEU 144 N -0.84 3.11 0.00 0.00 1.02 0.10 -4.92 118.68 117.14 3i4k s LEU 144 Ca 0.13 -0.17 -0.16 0.00 0.02 0.00 0.00 54.13 53.95 3i4k s LEU 144 Cb -0.12 -1.73 0.24 0.00 0.02 0.00 0.00 46.19 44.60 3i4k s LEU 144 CO 0.03 0.18 0.80 0.61 0.02 0.00 0.00 176.35 177.98 3i4k n GLY 145 N 3.45 -2.86 3.72 -3.19 0.00 -1.26 -1.62 105.19 103.43 3i4k n GLY 145 Ca -0.18 -1.45 -0.42 0.00 0.00 0.00 0.00 46.02 43.97 3i4k n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i4k s VAL 146 N -2.39 2.45 -0.07 1.61 0.11 0.15 -4.48 120.40 117.78 3i4k s VAL 146 Ca 0.53 0.33 -0.23 0.00 -2.93 0.00 0.00 61.98 59.68 3i4k s VAL 146 Cb -0.06 -3.21 0.05 0.00 -1.53 0.00 0.00 36.38 31.63 3i4k s VAL 146 CO 0.41 0.03 0.52 -0.76 -3.33 0.00 0.00 175.10 171.96 3i4k s LEU 147 N 1.01 0.01 0.73 2.54 1.43 -1.26 -4.42 118.68 118.72 3i4k s LEU 147 Ca 0.70 0.56 -0.16 0.00 -1.03 0.00 0.00 54.13 54.20 3i4k s LEU 147 Cb -0.45 1.94 0.01 0.00 0.03 0.00 0.00 46.19 47.72 3i4k s LEU 147 CO 0.33 -0.47 0.98 -2.65 0.23 0.00 0.00 176.35 174.77 3i4k n PRO 148 N 1.40 0.50 -0.27 1.29 -0.02 -1.26 -4.63 135.00 132.01 3i4k n PRO 148 Ca -0.19 0.23 0.01 0.00 -2.02 0.00 0.00 63.50 61.53 3i4k n PRO 148 Cb 0.56 -2.24 0.08 0.00 -0.02 0.00 0.00 33.50 31.89 3i4k n PRO 148 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3i4k h LEU 149 N -0.28 -0.80 -0.05 2.45 5.85 -1.99 -1.15 115.31 119.34 3i4k h LEU 149 Ca -0.47 0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 3i4k h LEU 149 Cb 1.33 0.50 -0.00 0.00 0.37 0.00 0.00 40.66 42.86 3i4k h LEU 149 CO 0.47 -0.26 0.02 0.44 -0.34 0.00 0.00 178.44 178.77 3i4k h ASP 150 N -0.02 0.07 -0.57 1.25 5.19 -1.98 0.62 116.42 120.98 3i4k h ASP 150 Ca 0.36 -0.15 -0.00 0.00 -0.62 0.00 0.00 57.03 56.62 3i4k h ASP 150 Cb 0.57 -0.02 -0.03 0.00 0.18 0.00 0.00 39.33 40.03 3i4k h ASP 150 CO -0.80 0.19 0.34 0.58 -3.12 0.00 0.00 179.24 176.44 3i4k h VAL 151 N -0.07 1.17 0.41 -1.35 2.07 -1.81 -0.84 116.25 115.83 3i4k h VAL 151 Ca 0.02 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 3i4k h VAL 151 Cb 0.15 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 3i4k h VAL 151 CO -0.00 0.18 -0.20 0.00 0.02 0.00 0.00 177.57 177.57 3i4k h ALA 152 N 1.58 -0.55 -0.95 1.67 0.00 -0.98 -2.23 119.26 117.80 3i4k h ALA 152 Ca 0.21 -0.18 0.18 0.00 0.00 0.00 0.00 54.91 55.12 3i4k h ALA 152 Cb -0.02 0.21 -0.10 0.00 0.00 0.00 0.00 17.79 17.88 3i4k h ALA 152 CO -0.04 -0.58 0.55 0.28 0.00 0.00 0.00 179.25 179.46 3i4k h VAL 153 N -1.01 0.71 -0.18 0.00 2.07 -0.75 -1.08 116.25 116.01 3i4k h VAL 153 Ca -0.06 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 3i4k h VAL 153 Cb 0.54 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3i4k h VAL 153 CO 0.09 0.13 0.10 0.00 0.02 0.00 0.00 177.57 177.91 3i4k h ALA 154 N 1.62 0.23 -0.00 1.67 0.00 -1.15 -1.91 119.26 119.72 3i4k h ALA 154 Ca 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.40 3i4k h ALA 154 Cb 0.82 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3i4k h ALA 154 CO -0.38 -0.24 -0.00 1.49 0.00 0.00 0.00 179.25 180.12 3i4k h GLU 155 N 0.20 -0.00 -0.29 0.00 4.81 -0.59 -1.03 114.58 117.67 3i4k h GLU 155 Ca 0.06 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.35 3i4k h GLU 155 Cb 0.06 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.38 3i4k h GLU 155 CO -0.01 -0.00 -0.08 0.82 -0.73 0.00 0.00 179.01 179.01 3i4k h ILE 156 N -0.00 0.69 -0.67 2.32 2.04 -1.22 0.25 117.51 120.92 3i4k h ILE 156 Ca 0.00 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.94 3i4k h ILE 156 Cb 0.00 0.69 -0.06 0.00 -0.74 0.00 0.00 36.82 36.71 3i4k h ILE 156 CO -0.00 0.00 0.34 -0.33 0.00 0.00 0.00 178.15 178.16 3i4k h GLU 157 N -0.01 0.59 -0.24 2.37 4.39 -1.13 -1.62 114.58 118.92 3i4k h GLU 157 Ca 0.14 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.77 3i4k h GLU 157 Cb 0.23 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 3i4k h GLU 157 CO -0.31 0.39 0.01 1.49 -1.16 0.00 0.00 179.01 179.43 3i4k h GLU 158 N 0.61 0.41 -0.79 2.33 4.81 -0.04 -2.92 114.58 119.00 3i4k h GLU 158 Ca 0.31 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 3i4k h GLU 158 Cb 0.27 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 3i4k h GLU 158 CO -0.23 0.58 0.51 0.00 -0.73 0.00 0.00 179.01 179.15 3i4k h ARG 159 N 0.19 1.04 -0.67 1.92 2.47 -0.26 0.19 114.38 119.27 3i4k h ARG 159 Ca 0.07 -0.07 0.06 0.00 -1.26 0.00 0.00 59.98 58.77 3i4k h ARG 159 Cb 0.39 -0.23 -0.05 0.00 -1.65 0.00 0.00 29.97 28.43 3i4k h ARG 159 CO 0.01 0.70 0.37 0.82 0.56 0.00 0.00 179.97 182.44 3i4k h ILE 160 N 1.07 0.98 0.03 2.04 2.04 -1.26 0.47 117.51 122.88 3i4k h ILE 160 Ca 0.29 -0.24 -0.26 0.00 1.00 0.00 0.00 64.86 65.64 3i4k h ILE 160 Cb -0.10 0.22 0.02 0.00 -0.74 0.00 0.00 36.82 36.22 3i4k h ILE 160 CO -0.06 0.13 -1.07 -0.08 0.00 0.00 0.00 178.15 177.07 3i4k h GLU 161 N 0.69 0.59 0.16 2.37 4.22 -1.26 -1.36 114.58 119.99 3i4k h GLU 161 Ca 0.30 -0.67 -0.33 0.00 0.08 0.00 0.00 59.36 58.73 3i4k h GLU 161 Cb 0.17 0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3i4k h GLU 161 CO -0.18 1.27 -1.65 1.49 -2.18 0.00 0.00 179.01 177.77 3i4k h GLU 162 N 0.31 0.34 0.00 1.92 4.81 -0.77 -3.41 114.58 117.78 3i4k h GLU 162 Ca -0.13 -0.57 0.00 0.00 -0.13 0.00 0.00 59.36 58.53 3i4k h GLU 162 Cb 1.72 0.21 0.00 0.00 0.63 0.00 0.00 28.75 31.32 3i4k h GLU 162 CO 0.20 1.23 -0.40 1.19 -0.73 0.00 0.00 179.01 180.50 3i4k n PHE 163 N -3.53 0.00 -2.67 0.92 3.72 0.14 -4.92 117.46 111.12 3i4k n PHE 163 Ca -0.21 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.06 3i4k n PHE 163 Cb 1.06 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.62 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 1.53 -0.03 3.73 1.37 0.00 0.35 0.24 105.19 112.37 3i4k n GLY 164 Ca 0.00 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.81 6.73 0.00 1.61 -0.87 -1.25 -1.54 114.94 116.81 3i4k s ASN 165 Ca 0.17 2.49 0.24 0.00 -1.57 0.00 0.00 52.86 54.19 3i4k s ASN 165 Cb -0.07 -2.60 0.35 0.00 -0.02 0.00 0.00 41.25 38.91 3i4k s ASN 165 CO 0.20 -0.69 1.31 0.54 -2.57 0.00 0.00 177.10 175.89 3i4k n ARG 166 N 3.42 0.73 -3.95 -0.60 1.74 -1.26 -4.62 116.66 112.12 3i4k n ARG 166 Ca 0.10 -0.52 -0.11 0.00 -0.77 0.00 0.00 57.85 56.56 3i4k n ARG 166 Cb 0.41 -1.49 -0.12 0.00 -1.02 0.00 0.00 32.46 30.23 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 -2.63 0.20 0.02 0.55 1.04 -1.26 -2.41 113.70 109.21 3i4k s SER 167 Ca 0.18 -0.27 0.04 0.00 0.48 0.00 0.00 55.95 56.38 3i4k s SER 167 Cb 0.18 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 3i4k s SER 167 CO 0.61 -0.15 -0.12 -0.36 0.98 0.00 0.00 173.24 174.20 3i4k s PHE 168 N -0.78 1.01 -0.14 5.02 0.08 0.35 -2.05 117.98 121.48 3i4k s PHE 168 Ca -0.08 -0.29 -0.00 0.00 0.12 0.00 0.00 56.93 56.68 3i4k s PHE 168 Cb -0.05 -0.62 -0.01 0.00 -0.57 0.00 0.00 43.02 41.77 3i4k s PHE 168 CO -0.00 0.00 -0.14 0.21 -0.10 0.00 0.00 175.22 175.19 3i4k s LYS 169 N -0.80 3.31 -0.23 0.44 2.20 -0.03 -0.77 119.74 123.86 3i4k s LYS 169 Ca 0.01 -0.71 -0.06 0.00 -0.36 0.00 0.00 55.97 54.85 3i4k s LYS 169 Cb -0.06 -2.63 -0.02 0.00 -1.51 0.00 0.00 37.83 33.60 3i4k s LYS 169 CO 0.00 0.12 0.03 -0.51 -0.36 0.00 0.00 175.35 174.64 3i4k s LEU 170 N 0.56 3.33 0.73 5.43 1.43 0.13 0.01 118.68 130.29 3i4k s LEU 170 Ca -0.09 -0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 52.68 3i4k s LEU 170 Cb -0.16 -1.87 0.03 0.00 0.03 0.00 0.00 46.19 44.22 3i4k s LEU 170 CO 0.04 0.00 1.10 -0.54 0.23 0.00 0.00 176.35 177.17 3i4k s LYS 171 N 1.38 2.69 0.00 1.70 1.02 -0.64 -1.80 119.74 124.08 3i4k s LYS 171 Ca 0.05 0.52 0.00 0.00 0.02 0.00 0.00 55.97 56.56 3i4k s LYS 171 Cb -0.15 -2.00 0.00 0.00 -0.52 0.00 0.00 37.83 35.17 3i4k s LYS 171 CO 0.02 -1.17 0.00 0.41 -0.92 0.00 0.00 175.35 173.69 3i4k n GLY 173 N -2.76 1.63 3.71 -3.33 0.00 -1.26 -4.25 105.19 98.94 3i4k n GLY 173 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.45 3.40 0.00 4.61 0.00 -1.22 -4.69 121.76 121.41 3i4k s ALA 174 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 51.95 3i4k s ALA 174 Cb 0.00 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.28 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 3.22 -0.85 3.64 0.00 0.00 -1.26 -4.81 105.19 105.13 3i4k n GLY 175 Ca -0.03 -1.05 -0.59 0.00 0.00 0.00 0.00 46.02 44.35 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 -2.21 1.41 -0.07 1.61 2.03 -1.26 -4.85 116.55 113.21 3i4k n ASP 176 Ca 0.00 1.13 -0.09 0.00 0.52 0.00 0.00 54.79 56.35 3i4k n ASP 176 Cb 0.00 -1.05 -0.02 0.00 -0.72 0.00 0.00 41.12 39.33 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 5.12 0.35 -0.31 -0.67 0.11 -1.96 0.58 132.00 135.21 3i4k h PRO 177 Ca -0.47 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.63 3i4k h PRO 177 Cb 1.36 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 3i4k h PRO 177 CO 0.85 0.23 0.18 0.00 -0.21 0.00 0.00 178.00 179.05 3i4k h ALA 178 N 1.10 0.39 -0.37 -0.75 0.00 -1.99 0.30 119.26 117.94 3i4k h ALA 178 Ca 0.10 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3i4k h ALA 178 Cb -0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3i4k h ALA 178 CO -0.02 -0.19 0.15 0.93 0.00 0.00 0.00 179.25 180.11 3i4k h GLU 179 N 0.36 0.56 -0.68 0.00 5.08 -1.91 -0.95 114.58 117.04 3i4k h GLU 179 Ca 0.13 -0.10 0.09 0.00 -1.00 0.00 0.00 59.36 58.47 3i4k h GLU 179 Cb 0.01 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.10 3i4k h GLU 179 CO -0.07 0.54 0.33 0.22 -1.00 0.00 0.00 179.01 179.03 3i4k h ASP 180 N 0.45 0.42 -0.29 1.42 3.58 -0.31 0.82 116.42 122.52 3i4k h ASP 180 Ca 0.12 0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.60 3i4k h ASP 180 Cb 0.19 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 3i4k h ASP 180 CO -0.01 0.25 0.04 0.74 -2.88 0.00 0.00 179.24 177.38 3i4k h THR 181 N 0.57 1.24 -0.41 2.25 2.02 -0.05 -2.40 112.91 116.12 3i4k h THR 181 Ca 0.33 -0.82 0.02 0.00 0.77 0.00 0.00 66.41 66.72 3i4k h THR 181 Cb 0.34 1.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 3i4k h THR 181 CO -0.26 0.26 0.23 0.03 0.37 0.00 0.00 175.52 176.15 3i4k h ARG 182 N 0.29 0.46 -0.20 6.66 -0.00 -0.46 0.44 114.38 121.57 3i4k h ARG 182 Ca 0.09 -0.03 0.05 0.00 -0.50 0.00 0.00 59.98 59.59 3i4k h ARG 182 Cb 0.35 -0.10 -0.07 0.00 0.00 0.00 0.00 29.97 30.15 3i4k h ARG 182 CO 0.01 0.30 -0.38 -0.09 0.00 0.00 0.00 179.97 179.81 3i4k h ARG 183 N 0.47 -0.39 -0.48 0.04 2.43 -0.69 0.79 114.38 116.55 3i4k h ARG 183 Ca 0.17 0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.23 3i4k h ARG 183 Cb 0.03 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 3i4k h ARG 183 CO -0.09 -0.26 -0.23 0.28 -1.51 0.00 0.00 179.97 178.16 3i4k h VAL 184 N -0.41 1.27 -0.71 0.20 2.07 -1.15 -2.45 116.25 115.06 3i4k h VAL 184 Ca 0.10 -1.40 0.06 0.00 0.82 0.00 0.00 66.70 66.28 3i4k h VAL 184 Cb 0.58 1.14 -0.06 0.00 -1.52 0.00 0.00 31.29 31.44 3i4k h VAL 184 CO -0.43 0.48 0.41 0.00 0.02 0.00 0.00 177.57 178.06 3i4k h ALA 185 N 0.87 0.96 -0.32 1.67 0.00 0.47 -1.03 119.26 121.87 3i4k h ALA 185 Ca 0.11 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 3i4k h ALA 185 Cb 0.82 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3i4k h ALA 185 CO 0.07 0.11 -0.28 0.93 0.00 0.00 0.00 179.25 180.08 3i4k h GLU 186 N 0.76 0.76 -0.43 0.00 5.08 -0.78 -2.74 114.58 117.23 3i4k h GLU 186 Ca 0.31 -0.39 0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3i4k h GLU 186 Cb 0.17 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 3i4k h GLU 186 CO -0.17 1.01 0.29 1.25 -1.00 0.00 0.00 179.01 180.38 3i4k h LEU 187 N 0.53 0.44 -0.43 1.33 6.46 -1.06 -1.88 115.31 120.70 3i4k h LEU 187 Ca 0.06 -0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.77 3i4k h LEU 187 Cb 0.85 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.66 3i4k h LEU 187 CO 0.07 0.31 0.13 0.00 -0.62 0.00 0.00 178.44 178.33 3i4k h ALA 188 N 1.74 0.56 0.00 1.25 0.00 -0.91 -1.36 119.26 120.54 3i4k h ALA 188 Ca 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i4k h ALA 188 Cb 0.04 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3i4k h ALA 188 CO -0.04 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.43 3i4k h ARG 189 N 0.55 0.00 0.00 0.00 3.08 -1.09 0.90 114.38 117.82 3i4k h ARG 189 Ca 0.14 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.96 3i4k h ARG 189 Cb 0.28 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.28 3i4k h ARG 189 CO -0.00 0.00 -2.17 0.39 -1.07 0.00 0.00 179.97 177.12 3i4k n GLU 190 N -2.78 0.67 0.00 0.04 1.02 -0.98 -4.74 120.64 113.88 3i4k n GLU 190 Ca -0.01 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 3i4k n GLU 190 Cb 0.16 -1.55 0.00 0.00 -0.02 0.00 0.00 31.44 30.03 3i4k n GLU 190 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3i4k n VAL 191 N -2.61 0.00 -0.58 2.62 0.31 -0.55 -4.80 118.33 112.72 3i4k n VAL 191 Ca -0.21 0.00 0.45 0.00 -0.01 0.00 0.00 64.34 64.57 3i4k n VAL 191 Cb 0.94 -0.82 0.72 0.00 -0.91 0.00 0.00 33.84 33.77 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 2.80 -0.87 0.10 2.92 0.00 0.31 -1.12 105.19 109.33 3i4k n GLY 192 Ca 0.00 0.67 -0.13 0.00 0.00 0.00 0.00 46.02 46.56 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 -0.13 -0.29 1.61 3.32 -1.87 -3.31 116.42 115.74 3i4k h ASP 193 Ca 0.86 -0.23 -0.15 0.00 0.02 0.00 0.00 57.03 57.53 3i4k h ASP 193 Cb 3.20 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 42.77 3i4k h ASP 193 CO -0.17 0.16 -0.38 0.03 -1.72 0.00 0.00 179.24 177.17 3i4k h ARG 194 N -0.43 0.84 -5.26 3.56 3.08 -1.48 -3.47 114.38 111.23 3i4k h ARG 194 Ca -0.02 -0.43 -0.48 0.00 0.07 0.00 0.00 59.98 59.13 3i4k h ARG 194 Cb 0.35 0.01 -0.14 0.00 0.08 0.00 0.00 29.97 30.27 3i4k h ARG 194 CO 0.03 1.07 -0.61 0.14 -1.07 0.00 0.00 179.97 179.52 3i4k s VAL 195 N -4.37 1.25 -0.19 2.04 -7.23 -1.12 -5.03 120.40 105.75 3i4k s VAL 195 Ca -0.10 -2.01 -0.24 0.00 -1.81 0.00 0.00 61.98 57.82 3i4k s VAL 195 Cb 0.12 -2.76 -0.01 0.00 0.56 0.00 0.00 36.38 34.28 3i4k s VAL 195 CO 0.87 -0.03 0.80 -0.55 -0.31 0.00 0.00 175.10 175.87 3i4k s SER 196 N -3.49 6.89 -0.09 4.85 0.15 -1.01 -4.57 113.70 116.43 3i4k s SER 196 Ca 0.36 1.09 -0.01 0.00 0.70 0.00 0.00 55.95 58.09 3i4k s SER 196 Cb 0.08 -2.43 -0.03 0.00 -1.71 0.00 0.00 66.02 61.93 3i4k s SER 196 CO 0.15 -0.40 -0.05 -0.76 1.20 0.00 0.00 173.24 173.38 3i4k s LEU 197 N 2.23 3.26 0.11 3.45 1.43 -1.26 -0.49 118.68 127.40 3i4k s LEU 197 Ca 0.36 -0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.47 3i4k s LEU 197 Cb -0.16 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 3i4k s LEU 197 CO 0.11 0.32 -0.09 -0.13 0.23 0.00 0.00 176.35 176.79 3i4k s ARG 198 N -0.53 0.87 0.31 1.70 3.00 0.05 -0.97 118.95 123.37 3i4k s ARG 198 Ca 0.08 -1.25 0.05 0.00 0.00 0.00 0.00 55.73 54.61 3i4k s ARG 198 Cb -0.12 -0.44 -0.06 0.00 0.00 0.00 0.00 34.95 34.33 3i4k s ARG 198 CO 0.02 0.05 0.00 0.96 0.00 0.00 0.00 175.30 176.33 3i4k s ILE 199 N -2.92 1.46 -0.26 1.52 -5.25 -0.76 0.19 121.20 115.17 3i4k s ILE 199 Ca 0.09 -2.05 -0.06 0.00 -0.99 0.00 0.00 60.65 57.64 3i4k s ILE 199 Cb 0.00 -2.65 0.13 0.00 2.95 0.00 0.00 42.46 42.89 3i4k s ILE 199 CO -0.01 -0.14 0.52 -0.62 -1.79 0.00 0.00 174.94 172.90 3i4k s ASP 200 N -3.49 -0.68 0.00 4.36 -1.08 -0.74 -1.18 116.67 113.86 3i4k s ASP 200 Ca 0.33 1.02 0.20 0.00 -0.52 0.00 0.00 52.55 53.58 3i4k s ASP 200 Cb 0.07 1.78 0.46 0.00 -1.46 0.00 0.00 42.92 43.77 3i4k s ASP 200 CO 0.14 -0.25 1.39 -0.38 0.52 0.00 0.00 175.17 176.60 3i4k n ILE 201 N 5.41 0.71 -4.14 4.11 5.41 -1.18 -4.38 119.36 125.30 3i4k n ILE 201 Ca -0.07 -0.86 -0.33 0.00 1.00 0.00 0.00 62.75 62.49 3i4k n ILE 201 Cb 0.50 0.77 -0.02 0.00 -0.71 0.00 0.00 39.64 40.18 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 1.36 -2.70 -1.45 4.38 3.02 -1.02 -1.37 115.26 117.47 3i4k n ASN 202 Ca 0.19 -1.00 -0.19 0.00 -0.03 0.00 0.00 54.58 53.56 3i4k n ASN 202 Cb 0.57 -2.90 -0.08 0.00 -0.61 0.00 0.00 39.78 36.76 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 -4.42 -0.29 0.27 5.41 0.00 0.01 -4.89 120.51 116.60 3i4k n ALA 203 Ca -0.02 0.29 0.10 0.00 0.00 0.00 0.00 53.44 53.81 3i4k n ALA 203 Cb 0.54 -1.89 0.26 0.00 0.00 0.00 0.00 19.45 18.36 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 -2.47 2.31 -4.65 0.00 5.12 -0.47 -3.81 116.66 112.69 3i4k n ARG 204 Ca -0.19 -2.02 -0.33 0.00 -1.93 0.00 0.00 57.85 53.38 3i4k n ARG 204 Cb 0.61 -1.45 -0.12 0.00 -1.16 0.00 0.00 32.46 30.34 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 -1.31 2.82 0.65 -1.55 0.52 -0.95 -5.01 118.94 114.12 3i4k s TRP 205 Ca 0.38 -0.07 -0.08 0.00 0.02 0.00 0.00 56.10 56.35 3i4k s TRP 205 Cb 0.20 -1.63 0.02 0.00 -1.15 0.00 0.00 33.47 30.92 3i4k s TRP 205 CO 0.27 0.30 0.99 0.16 0.02 0.00 0.00 176.95 178.69 3i4k s ASP 206 N -1.05 5.37 0.17 2.95 1.47 -1.26 -4.16 116.67 120.16 3i4k s ASP 206 Ca 0.14 0.80 -0.20 0.00 1.18 0.00 0.00 52.55 54.46 3i4k s ASP 206 Cb -0.11 -1.65 0.09 0.00 -0.34 0.00 0.00 42.92 40.91 3i4k s ASP 206 CO 0.04 -1.27 1.62 -0.09 0.68 0.00 0.00 175.17 176.15 3i4k h ARG 207 N -0.43 -0.17 -0.63 2.11 2.43 -2.00 -1.92 114.38 113.79 3i4k h ARG 207 Ca -0.45 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 58.81 3i4k h ARG 207 Cb 1.27 0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.79 3i4k h ARG 207 CO 0.62 -0.11 0.29 -0.09 -1.51 0.00 0.00 179.97 179.17 3i4k h ARG 208 N -0.17 0.51 -0.42 0.20 2.43 -1.99 -1.65 114.38 113.29 3i4k h ARG 208 Ca 0.19 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 3i4k h ARG 208 Cb 0.47 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 3i4k h ARG 208 CO -0.50 0.34 0.16 1.15 -1.51 0.00 0.00 179.97 179.61 3i4k h THR 209 N 0.53 1.20 -0.02 0.20 2.02 -1.82 -2.05 112.91 112.97 3i4k h THR 209 Ca 0.30 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.86 3i4k h THR 209 Cb 0.29 0.84 -0.00 0.00 -1.74 0.00 0.00 68.15 67.54 3i4k h THR 209 CO -0.24 0.23 0.00 0.00 0.37 0.00 0.00 175.52 175.87 3i4k h ALA 210 N 1.01 0.02 0.00 6.16 0.00 -0.98 -1.16 119.26 124.30 3i4k h ALA 210 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3i4k h ALA 210 Cb 0.20 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3i4k h ALA 210 CO -0.01 -0.49 -0.08 -0.07 0.00 0.00 0.00 179.25 178.60 3i4k h LEU 211 N 0.01 0.00 0.04 0.00 3.38 -1.24 -0.04 115.31 117.46 3i4k h LEU 211 Ca 0.01 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 3i4k h LEU 211 Cb 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 3i4k h LEU 211 CO -0.01 0.08 -0.52 -0.74 0.09 0.00 0.00 178.44 177.33 3i4k h HIS 212 N 0.00 0.15 0.00 1.13 2.76 -0.78 -3.41 115.15 115.00 3i4k h HIS 212 Ca -0.00 -0.11 -0.23 0.00 -2.20 0.00 0.00 60.37 57.83 3i4k h HIS 212 Cb 0.18 -0.01 -0.04 0.00 1.55 0.00 0.00 27.41 29.10 3i4k h HIS 212 CO 0.00 1.20 -1.53 1.88 -1.30 0.00 0.00 177.93 178.19 3i4k h TYR 213 N -0.81 0.00 -0.07 5.26 0.05 -1.16 -3.38 116.97 116.86 3i4k h TYR 213 Ca -0.12 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.66 3i4k h TYR 213 Cb 1.26 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.99 3i4k h TYR 213 CO 0.22 0.79 0.03 -0.07 -1.05 0.00 0.00 178.16 178.08 3i4k h LEU 214 N 0.00 0.08 -1.33 3.88 3.38 -1.20 -1.66 115.31 118.46 3i4k h LEU 214 Ca -0.21 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.79 3i4k h LEU 214 Cb 1.79 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 42.48 3i4k h LEU 214 CO 0.06 0.08 0.48 -0.65 0.09 0.00 0.00 178.44 178.51 3i4k h PRO 215 N 0.10 0.84 -0.59 1.13 0.11 -1.79 -0.18 132.00 131.62 3i4k h PRO 215 Ca 0.03 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.10 3i4k h PRO 215 Cb 0.02 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 30.91 3i4k h PRO 215 CO -0.00 0.56 0.38 0.82 -0.21 0.00 0.00 178.00 179.54 3i4k h ILE 216 N 0.87 1.11 0.00 4.15 2.04 -1.56 0.33 117.51 124.45 3i4k h ILE 216 Ca 0.30 -0.26 -0.06 0.00 1.00 0.00 0.00 64.86 65.84 3i4k h ILE 216 Cb 0.10 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 3i4k h ILE 216 CO -0.09 0.14 -0.29 -0.07 0.00 0.00 0.00 178.15 177.84 3i4k h LEU 217 N 0.76 0.00 0.01 1.44 3.38 -1.32 -1.33 115.31 118.25 3i4k h LEU 217 Ca 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 3i4k h LEU 217 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3i4k h LEU 217 CO -0.07 0.29 -0.01 0.00 0.09 0.00 0.00 178.44 178.74 3i4k h ALA 218 N 1.71 -0.02 0.00 1.53 0.00 0.37 -0.49 119.26 122.36 3i4k h ALA 218 Ca -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 3i4k h ALA 218 Cb 0.76 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3i4k h ALA 218 CO 0.04 -0.24 -0.01 1.49 0.00 0.00 0.00 179.25 180.54 3i4k h GLU 219 N -0.57 0.00 -0.01 0.00 4.81 -0.23 -1.12 114.58 117.47 3i4k h GLU 219 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3i4k h GLU 219 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 3i4k h GLU 219 CO 0.00 0.01 -0.05 0.00 -0.73 0.00 0.00 179.01 178.24 3i4k n ALA 220 N -2.48 2.69 0.00 2.92 0.00 -0.52 -4.94 120.51 118.18 3i4k n ALA 220 Ca -0.03 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.11 3i4k n ALA 220 Cb 0.09 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.20 3i4k n ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i4k n GLY 221 N 1.16 0.52 3.73 0.00 0.00 -0.42 -4.59 105.19 105.59 3i4k n GLY 221 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3i4k n GLY 221 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i4k s VAL 222 N -2.00 2.13 -1.40 1.61 1.01 -0.22 -4.73 120.40 116.80 3i4k s VAL 222 Ca 0.00 0.10 0.23 0.00 0.00 0.00 0.00 61.98 62.30 3i4k s VAL 222 Cb 0.00 -3.06 -0.08 0.00 0.00 0.00 0.00 36.38 33.24 3i4k s VAL 222 CO 0.00 0.01 1.10 -0.62 0.00 0.00 0.00 175.10 175.59 3i4k n GLU 223 N 3.54 0.46 -3.67 2.72 1.02 -0.15 -4.65 120.64 119.92 3i4k n GLU 223 Ca 0.14 -0.36 -0.08 0.00 -0.02 0.00 0.00 57.16 56.84 3i4k n GLU 223 Cb 0.36 -1.49 -0.09 0.00 -0.02 0.00 0.00 31.44 30.20 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 -2.79 -0.57 -0.44 -4.62 2.96 -1.24 -4.24 118.68 107.74 3i4k s LEU 224 Ca 0.13 1.14 -0.12 0.00 -0.22 0.00 0.00 54.13 55.06 3i4k s LEU 224 Cb 0.17 1.69 0.07 0.00 0.50 0.00 0.00 46.19 48.63 3i4k s LEU 224 CO 0.72 -0.22 0.32 -0.36 -1.32 0.00 0.00 176.35 175.49 3i4k s PHE 225 N 1.99 3.29 -0.05 5.38 0.08 -0.23 -1.83 117.98 126.61 3i4k s PHE 225 Ca -0.07 -1.22 -0.23 0.00 0.12 0.00 0.00 56.93 55.54 3i4k s PHE 225 Cb -0.09 -3.03 -0.04 0.00 -0.57 0.00 0.00 43.02 39.29 3i4k s PHE 225 CO -0.15 -0.81 0.67 -2.00 -0.10 0.00 0.00 175.22 172.82 3i4k s GLU 226 N 1.53 4.41 0.00 0.44 2.12 -0.33 -4.26 118.70 122.62 3i4k s GLU 226 Ca 0.03 0.83 0.00 0.00 0.36 0.00 0.00 54.97 56.19 3i4k s GLU 226 Cb -0.23 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 30.74 3i4k s GLU 226 CO 0.04 0.15 0.00 0.94 -0.54 0.00 0.00 175.26 175.85 3i4k n GLN 227 N 3.50 0.00 0.14 4.30 -0.06 -1.26 -3.13 117.38 120.87 3i4k n GLN 227 Ca -0.03 0.00 0.12 0.00 -2.00 0.00 0.00 57.00 55.09 3i4k n GLN 227 Cb 0.51 0.00 0.16 0.00 -4.06 0.00 0.00 30.24 26.85 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 0.36 0.00 -5.43 3.69 0.13 -1.91 0.15 132.00 128.99 3i4k h PRO 228 Ca 0.00 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.59 3i4k h PRO 228 Cb 0.00 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 30.99 3i4k h PRO 228 CO 0.00 0.00 -0.61 0.95 -0.23 0.00 0.00 178.00 178.11 3i4k s THR 229 N -3.23 1.57 0.22 1.56 -4.23 -1.26 -2.23 115.64 108.04 3i4k s THR 229 Ca 0.05 -2.02 -0.28 0.00 -1.18 0.00 0.00 61.69 58.26 3i4k s THR 229 Cb 0.09 -2.84 -0.16 0.00 1.34 0.00 0.00 72.50 70.93 3i4k s THR 229 CO 0.70 -0.03 0.68 -2.65 -0.54 0.00 0.00 174.62 172.78 3i4k n PRO 230 N -0.79 0.41 -0.27 3.99 -0.02 -1.25 -4.20 135.00 132.87 3i4k n PRO 230 Ca -0.04 0.14 0.06 0.00 -2.02 0.00 0.00 63.50 61.65 3i4k n PRO 230 Cb 0.66 -1.27 0.20 0.00 -0.02 0.00 0.00 33.50 33.08 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 1.37 1.15 0.00 3.55 0.00 -1.89 -2.48 119.26 120.97 3i4k h ALA 231 Ca -0.32 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 3i4k h ALA 231 Cb 1.41 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 3i4k h ALA 231 CO 0.58 -0.15 -0.27 0.38 0.00 0.00 0.00 179.25 179.80 3i4k h ASP 232 N 0.53 0.00 -1.49 0.00 2.03 -1.90 -3.40 116.42 112.20 3i4k h ASP 232 Ca 0.43 0.00 -0.73 0.00 -0.73 0.00 0.00 57.03 56.00 3i4k h ASP 232 Cb 0.62 0.00 -0.14 0.00 -0.83 0.00 0.00 39.33 38.99 3i4k h ASP 232 CO -0.38 0.27 1.88 -0.67 -1.03 0.00 0.00 179.24 179.31 3i4k n ASP 233 N -3.52 5.00 0.02 4.15 -0.08 -0.93 -4.79 116.55 116.39 3i4k n ASP 233 Ca -0.00 -2.99 -0.04 0.00 -1.51 0.00 0.00 54.79 50.25 3i4k n ASP 233 Cb 0.42 -1.59 0.18 0.00 2.34 0.00 0.00 41.12 42.47 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 9.81 0.48 -1.51 -2.67 3.38 -1.83 -2.91 115.31 120.06 3i4k h LEU 234 Ca 0.39 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 3i4k h LEU 234 Cb 0.78 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 3i4k h LEU 234 CO 1.45 0.77 0.14 -0.33 0.09 0.00 0.00 178.44 180.57 3i4k h GLU 235 N 0.41 0.47 -0.37 1.13 5.08 -1.92 -1.61 114.58 117.76 3i4k h GLU 235 Ca 0.05 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 3i4k h GLU 235 Cb 0.74 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 3i4k h GLU 235 CO 0.06 0.39 -0.36 1.15 -1.00 0.00 0.00 179.01 179.24 3i4k h THR 236 N 0.47 1.28 -0.59 1.13 2.02 -1.92 0.11 112.91 115.41 3i4k h THR 236 Ca 0.12 -1.53 0.00 0.00 0.77 0.00 0.00 66.41 65.77 3i4k h THR 236 Cb 0.09 1.37 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 3i4k h THR 236 CO -0.01 0.51 0.38 -0.07 0.37 0.00 0.00 175.52 176.70 3i4k h LEU 237 N 0.72 0.69 -0.20 2.58 3.38 -1.25 0.98 115.31 122.21 3i4k h LEU 237 Ca 0.07 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3i4k h LEU 237 Cb 0.94 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 3i4k h LEU 237 CO 0.09 0.52 0.11 -0.09 0.09 0.00 0.00 178.44 179.16 3i4k h ARG 238 N 0.80 0.28 -0.56 1.13 9.65 -1.12 -2.98 114.38 121.58 3i4k h ARG 238 Ca 0.21 -0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 59.02 3i4k h ARG 238 Cb -0.07 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.43 3i4k h ARG 238 CO -0.04 0.27 0.20 1.49 2.80 0.00 0.00 179.97 184.68 3i4k h GLU 239 N 0.22 0.82 -0.26 0.20 4.57 -0.09 -1.35 114.58 118.69 3i4k h GLU 239 Ca 0.07 -0.14 -0.09 0.00 -1.18 0.00 0.00 59.36 58.02 3i4k h GLU 239 Cb 0.06 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 3i4k h GLU 239 CO -0.01 0.70 -0.23 -0.84 -1.18 0.00 0.00 179.01 177.44 3i4k h ILE 240 N 0.81 1.26 -0.22 2.32 3.07 -0.69 -1.47 117.51 122.59 3i4k h ILE 240 Ca 0.19 -1.24 -0.11 0.00 1.55 0.00 0.00 64.86 65.25 3i4k h ILE 240 Cb 0.20 1.32 -0.01 0.00 -0.27 0.00 0.00 36.82 38.06 3i4k h ILE 240 CO -0.01 0.40 -0.34 0.74 -1.05 0.00 0.00 178.15 177.88 3i4k h THR 241 N 0.44 1.29 -0.42 0.16 2.02 -1.31 -0.53 112.91 114.56 3i4k h THR 241 Ca 0.07 -1.44 -0.08 0.00 0.77 0.00 0.00 66.41 65.72 3i4k h THR 241 Cb 0.65 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.53 3i4k h THR 241 CO 0.05 0.45 -0.08 0.03 0.37 0.00 0.00 175.52 176.34 3i4k h ARG 242 N 0.41 0.72 0.00 6.66 3.08 -0.63 0.53 114.38 125.15 3i4k h ARG 242 Ca 0.05 -0.22 -0.10 0.00 0.07 0.00 0.00 59.98 59.78 3i4k h ARG 242 Cb 0.80 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.76 3i4k h ARG 242 CO 0.06 0.79 -0.99 0.00 -1.07 0.00 0.00 179.97 178.76 3i4k h ARG 243 N 0.66 0.00 0.00 0.04 3.08 -1.10 -3.39 114.38 113.67 3i4k h ARG 243 Ca 0.12 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 3i4k h ARG 243 Cb 0.52 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 3i4k h ARG 243 CO 0.03 0.24 -1.53 0.25 -1.07 0.00 0.00 179.97 177.89 3i4k n THR 244 N -2.93 0.00 -1.49 2.04 -2.24 -0.22 -5.00 114.28 104.45 3i4k n THR 244 Ca -0.03 -0.26 -0.15 0.00 -2.27 0.00 0.00 64.05 61.33 3i4k n THR 244 Cb 0.72 0.23 -0.06 0.00 -2.10 0.00 0.00 70.33 69.12 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 -1.90 -4.77 -4.47 3.42 3.02 0.19 -5.00 115.26 105.75 3i4k n ASN 245 Ca -0.02 0.34 -0.33 0.00 -0.03 0.00 0.00 54.58 54.54 3i4k n ASN 245 Cb 0.30 -3.59 -0.13 0.00 -0.61 0.00 0.00 39.78 35.75 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 -2.56 3.19 0.47 2.41 0.11 -1.26 -5.07 120.40 117.70 3i4k s VAL 246 Ca 0.00 -0.66 -0.24 0.00 -2.93 0.00 0.00 61.98 58.16 3i4k s VAL 246 Cb 0.00 -2.29 -0.08 0.00 -1.53 0.00 0.00 36.38 32.48 3i4k s VAL 246 CO 0.00 0.57 1.31 -1.20 -3.33 0.00 0.00 175.10 172.46 3i4k n SER 247 N 2.64 2.66 0.00 3.54 7.64 -1.26 -4.38 113.62 124.46 3i4k n SER 247 Ca -0.18 1.06 0.00 0.00 1.01 0.00 0.00 58.87 60.76 3i4k n SER 247 Cb 0.52 -1.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 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 -0.52 0.00 -3.75 0.44 0.31 -1.26 -1.06 118.33 112.48 3i4k n VAL 248 Ca 0.08 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.28 3i4k n VAL 248 Cb 0.42 -0.23 -0.13 0.00 -0.91 0.00 0.00 33.84 32.99 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 -2.08 -0.49 0.00 3.52 0.00 -0.62 -1.63 121.76 120.47 3i4k s ALA 250 Ca 0.00 0.84 0.00 0.00 0.00 0.00 0.00 51.96 52.80 3i4k s ALA 250 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 23.12 22.59 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 3.95 0.00 0.26 0.00 2.03 -1.26 -0.74 116.55 120.79 3i4k n ASP 251 Ca -0.23 0.00 0.17 0.00 0.52 0.00 0.00 54.79 55.25 3i4k n ASP 251 Cb 0.54 0.00 0.89 0.00 -0.72 0.00 0.00 41.12 41.83 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 -0.25 114.58 120.81 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 -3.37 3.06 0.02 -1.87 -3.42 113.55 107.97 3i4k h SER 253 Ca 0.00 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.36 3i4k h SER 253 Cb 0.10 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.25 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 -3.46 1.18 -0.12 2.27 1.01 -0.10 -4.76 120.40 116.42 3i4k s VAL 254 Ca 0.04 -1.36 -0.04 0.00 0.00 0.00 0.00 61.98 60.62 3i4k s VAL 254 Cb 0.07 -1.75 -0.06 0.00 0.00 0.00 0.00 36.38 34.65 3i4k s VAL 254 CO 0.60 -0.45 -0.14 0.79 0.00 0.00 0.00 175.10 175.90 3i4k n TRP 255 N 4.75 0.00 -3.86 5.22 7.02 -1.26 -4.85 117.44 124.46 3i4k n TRP 255 Ca -0.05 0.00 -0.21 0.00 -1.02 0.00 0.00 57.50 56.22 3i4k n TRP 255 Cb 0.43 -0.43 -0.03 0.00 -2.42 0.00 0.00 31.31 28.86 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 -2.22 4.00 0.35 -0.99 -4.23 -1.26 -4.10 115.64 107.20 3i4k s THR 256 Ca -0.16 -1.30 0.03 0.00 -1.18 0.00 0.00 61.69 59.08 3i4k s THR 256 Cb 0.06 -3.33 0.26 0.00 1.34 0.00 0.00 72.50 70.83 3i4k s THR 256 CO 0.22 -0.23 2.01 -0.65 -0.54 0.00 0.00 174.62 175.43 3i4k h PRO 257 N 1.26 0.81 -0.30 3.99 0.11 -1.93 -0.07 132.00 135.87 3i4k h PRO 257 Ca -0.46 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.52 3i4k h PRO 257 Cb 1.25 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3i4k h PRO 257 CO 0.58 0.54 -0.14 0.00 -0.21 0.00 0.00 178.00 178.77 3i4k h ALA 258 N 1.61 1.20 -0.08 -0.75 0.00 -1.99 -0.19 119.26 119.07 3i4k h ALA 258 Ca 0.22 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 3i4k h ALA 258 Cb -0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3i4k h ALA 258 CO -0.05 0.51 -0.70 0.93 0.00 0.00 0.00 179.25 179.95 3i4k h GLU 259 N 0.48 0.36 -0.57 0.00 5.08 -1.61 -1.25 114.58 117.07 3i4k h GLU 259 Ca 0.09 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 58.07 3i4k h GLU 259 Cb 0.52 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 3i4k h GLU 259 CO 0.03 0.92 -0.00 0.00 -1.00 0.00 0.00 179.01 178.96 3i4k h ALA 260 N 1.00 0.92 -0.39 3.43 0.00 -0.53 -2.06 119.26 121.63 3i4k h ALA 260 Ca -0.02 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 3i4k h ALA 260 Cb 1.26 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3i4k h ALA 260 CO 0.12 0.64 -0.12 1.25 0.00 0.00 0.00 179.25 181.14 3i4k h LEU 261 N 0.90 0.68 -0.73 0.00 6.46 -0.80 -2.09 115.31 119.73 3i4k h LEU 261 Ca 0.16 -0.20 -0.09 0.00 -0.12 0.00 0.00 57.88 57.64 3i4k h LEU 261 Cb 0.53 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.26 3i4k h LEU 261 CO 0.03 0.82 0.02 0.00 -0.62 0.00 0.00 178.44 178.69 3i4k h ALA 262 N 1.24 0.94 -0.58 1.25 0.00 -0.88 -0.75 119.26 120.48 3i4k h ALA 262 Ca 0.11 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 3i4k h ALA 262 Cb 0.57 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3i4k h ALA 262 CO 0.04 0.64 0.06 0.28 0.00 0.00 0.00 179.25 180.27 3i4k h VAL 263 N 0.91 1.25 -0.13 0.00 2.07 -1.13 -1.04 116.25 118.20 3i4k h VAL 263 Ca 0.17 -1.02 -0.00 0.00 0.82 0.00 0.00 66.70 66.66 3i4k h VAL 263 Cb 0.50 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3i4k h VAL 263 CO 0.02 0.37 0.06 0.58 0.02 0.00 0.00 177.57 178.63 3i4k h VAL 264 N 0.90 1.12 -0.54 2.57 2.07 -0.86 -0.44 116.25 121.07 3i4k h VAL 264 Ca 0.18 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.31 3i4k h VAL 264 Cb 0.45 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 3i4k h VAL 264 CO 0.02 0.11 0.17 0.11 0.02 0.00 0.00 177.57 177.99 3i4k h LYS 265 N 0.08 0.81 -0.00 1.57 1.57 -0.97 -2.43 116.57 117.21 3i4k h LYS 265 Ca 0.04 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 3i4k h LYS 265 Cb 0.12 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3i4k h LYS 265 CO -0.01 0.71 -0.12 0.00 -0.57 0.00 0.00 179.45 179.46 3i4k n ALA 266 N -2.46 2.75 -4.01 3.86 0.00 -0.41 -4.90 120.51 115.34 3i4k n ALA 266 Ca 0.04 -0.24 -0.31 0.00 0.00 0.00 0.00 53.44 52.93 3i4k n ALA 266 Cb 0.20 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 -1.09 -4.28 0.15 0.00 6.02 -0.24 -4.86 117.38 113.08 3i4k n GLN 267 Ca 0.13 0.49 0.12 0.00 -0.01 0.00 0.00 57.00 57.73 3i4k n GLN 267 Cb 0.29 -5.16 0.23 0.00 1.02 0.00 0.00 30.24 26.61 3i4k n GLN 267 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3i4k h ALA 268 N 0.92 0.90 -2.08 -1.58 0.00 -1.65 -3.42 119.26 112.35 3i4k h ALA 268 Ca -0.60 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.25 3i4k h ALA 268 Cb 1.38 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.97 3i4k h ALA 268 CO 0.69 0.00 0.12 0.00 0.00 0.00 0.00 179.25 180.06 3i4k s ALA 269 N -3.19 -1.65 -0.11 0.00 0.00 -1.26 -3.79 121.76 111.76 3i4k s ALA 269 Ca 0.07 1.37 0.16 0.00 0.00 0.00 0.00 51.96 53.56 3i4k s ALA 269 Cb 0.09 -0.27 -0.09 0.00 0.00 0.00 0.00 23.12 22.85 3i4k s ALA 269 CO 0.66 -0.35 1.02 -0.44 0.00 0.00 0.00 175.76 176.65 3i4k h ASP 270 N 3.59 0.00 -4.54 0.00 3.45 -1.67 -3.47 116.42 113.79 3i4k h ASP 270 Ca -0.28 0.00 -0.37 0.00 0.43 0.00 0.00 57.03 56.81 3i4k h ASP 270 Cb 1.15 0.00 -0.22 0.00 -0.56 0.00 0.00 39.33 39.70 3i4k h ASP 270 CO 0.31 0.60 -0.77 -0.69 -1.57 0.00 0.00 179.24 177.13 3i4k s VAL 271 N -2.91 0.91 -0.10 -1.35 1.01 -1.10 -1.73 120.40 115.14 3i4k s VAL 271 Ca -0.01 -1.17 0.04 0.00 0.00 0.00 0.00 61.98 60.84 3i4k s VAL 271 Cb 0.08 -0.90 -0.00 0.00 0.00 0.00 0.00 36.38 35.56 3i4k s VAL 271 CO 0.79 -0.24 -0.23 -0.63 0.00 0.00 0.00 175.10 174.80 3i4k s ILE 272 N -1.23 2.18 -0.85 2.22 1.01 -0.32 -1.58 121.20 122.62 3i4k s ILE 272 Ca -0.04 -0.98 -0.25 0.00 0.00 0.00 0.00 60.65 59.37 3i4k s ILE 272 Cb -0.10 -1.84 0.03 0.00 0.01 0.00 0.00 42.46 40.57 3i4k s ILE 272 CO 0.01 0.56 1.38 0.00 0.00 0.00 0.00 174.94 176.90 3i4k s ALA 273 N 0.30 2.68 -0.48 9.38 0.00 0.08 -1.66 121.76 132.07 3i4k s ALA 273 Ca -0.17 -1.69 -0.26 0.00 0.00 0.00 0.00 51.96 49.84 3i4k s ALA 273 Cb -0.17 -4.37 0.03 0.00 0.00 0.00 0.00 23.12 18.60 3i4k s ALA 273 CO 0.08 -3.48 0.95 -1.17 0.00 0.00 0.00 175.76 172.14 3i4k s LEU 274 N 5.68 3.97 -0.18 0.00 1.98 -0.13 -4.79 118.68 125.21 3i4k s LEU 274 Ca 0.41 0.09 0.01 0.00 -2.89 0.00 0.00 54.13 51.75 3i4k s LEU 274 Cb -0.05 -3.19 0.02 0.00 0.66 0.00 0.00 46.19 43.63 3i4k s LEU 274 CO 0.05 -1.10 -0.19 -0.54 -1.89 0.00 0.00 176.35 172.68 3i4k s LYS 275 N 3.87 3.03 0.54 1.98 1.02 -1.26 -1.26 119.74 127.67 3i4k s LYS 275 Ca 0.37 -0.81 0.22 0.00 0.02 0.00 0.00 55.97 55.77 3i4k s LYS 275 Cb -0.10 -2.60 1.43 0.00 -0.52 0.00 0.00 37.83 36.04 3i4k s LYS 275 CO 0.26 -0.19 2.13 1.79 -0.92 0.00 0.00 175.35 178.42 3i4k h THR 276 N 5.91 0.81 0.01 2.17 1.35 -1.88 -1.40 112.91 119.88 3i4k h THR 276 Ca -0.44 0.00 -0.10 0.00 -0.55 0.00 0.00 66.41 65.31 3i4k h THR 276 Cb 1.15 0.92 0.01 0.00 -1.73 0.00 0.00 68.15 68.50 3i4k h THR 276 CO 0.63 0.00 -0.41 0.71 -0.25 0.00 0.00 175.52 176.20 3i4k h THR 277 N 0.00 1.51 -0.48 6.82 1.35 -1.92 -1.06 112.91 119.14 3i4k h THR 277 Ca 0.06 -2.06 -0.07 0.00 -0.55 0.00 0.00 66.41 63.79 3i4k h THR 277 Cb 0.27 2.77 -0.02 0.00 -1.73 0.00 0.00 68.15 69.45 3i4k h THR 277 CO -0.00 0.58 0.00 0.50 -0.25 0.00 0.00 175.52 176.35 3i4k h LYS 278 N -0.38 0.80 0.00 4.72 3.64 -1.76 -2.91 116.57 120.69 3i4k h LYS 278 Ca -0.05 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 3i4k h LYS 278 Cb 1.17 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 3i4k h LYS 278 CO 0.08 0.80 0.00 0.72 -2.27 0.00 0.00 179.45 178.78 3i4k n HIS 279 N -4.22 0.00 -1.06 1.91 8.25 -0.57 -4.30 115.22 115.23 3i4k n HIS 279 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 3i4k n HIS 279 Cb 0.30 -0.47 0.00 0.00 1.12 0.00 0.00 29.99 30.94 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 0.76 1.05 0.00 -1.41 0.00 -1.10 -4.66 105.19 99.83 3i4k n GLY 280 Ca 0.06 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.15 2.58 0.28 -0.02 0.00 -0.40 -3.85 105.19 102.62 3i4k n GLY 281 Ca 0.00 -2.11 -0.06 0.00 0.00 0.00 0.00 46.02 43.85 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 0.80 0.04 0.99 3.38 -1.88 -1.15 115.31 117.49 3i4k h LEU 282 Ca 0.00 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 3i4k h LEU 282 Cb 0.00 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.53 3i4k h LEU 282 CO 0.00 0.92 -0.02 -0.07 0.09 0.00 0.00 178.44 179.36 3i4k h LEU 283 N 0.74 -0.04 -0.73 1.67 3.38 -1.96 -2.17 115.31 116.20 3i4k h LEU 283 Ca 0.13 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.95 3i4k h LEU 283 Cb 0.57 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 3i4k h LEU 283 CO 0.03 0.13 0.48 -0.33 0.09 0.00 0.00 178.44 178.85 3i4k h GLU 284 N -0.22 0.95 -0.59 1.13 4.39 -1.80 -2.40 114.58 116.05 3i4k h GLU 284 Ca -0.01 -0.06 0.09 0.00 0.34 0.00 0.00 59.36 59.73 3i4k h GLU 284 Cb 0.20 -0.21 -0.07 0.00 -0.10 0.00 0.00 28.75 28.56 3i4k h GLU 284 CO 0.01 0.63 0.22 0.77 -1.16 0.00 0.00 179.01 179.48 3i4k h SER 285 N 0.98 0.23 -1.00 1.42 0.02 -1.02 0.35 113.55 114.53 3i4k h SER 285 Ca 0.27 0.07 0.16 0.00 -0.84 0.00 0.00 61.79 61.45 3i4k h SER 285 Cb -0.10 0.05 -0.09 0.00 0.14 0.00 0.00 62.40 62.40 3i4k h SER 285 CO -0.06 0.14 0.62 0.11 -1.14 0.00 0.00 176.83 176.50 3i4k h LYS 286 N 0.41 0.84 -0.29 3.45 1.79 -0.87 -0.04 116.57 121.86 3i4k h LYS 286 Ca 0.29 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.67 3i4k h LYS 286 Cb 0.35 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.80 3i4k h LYS 286 CO -0.29 0.56 0.01 0.87 -1.08 0.00 0.00 179.45 179.52 3i4k h LYS 287 N 0.87 0.51 -0.18 3.15 1.57 -0.82 -0.63 116.57 121.03 3i4k h LYS 287 Ca 0.53 -0.16 0.04 0.00 -1.87 0.00 0.00 60.65 59.20 3i4k h LYS 287 Cb 0.70 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.92 3i4k h LYS 287 CO -0.31 0.65 -0.08 0.82 -0.57 0.00 0.00 179.45 179.95 3i4k h ILE 288 N 0.31 0.74 -0.85 1.86 1.08 -0.21 -1.56 117.51 118.88 3i4k h ILE 288 Ca 0.08 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.59 3i4k h ILE 288 Cb 0.41 0.74 -0.05 0.00 -3.07 0.00 0.00 36.82 34.85 3i4k h ILE 288 CO 0.01 0.00 0.54 0.00 -0.69 0.00 0.00 178.15 178.01 3i4k h ALA 289 N 1.10 1.12 -0.39 1.87 0.00 -0.83 -1.67 119.26 120.46 3i4k h ALA 289 Ca 0.10 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3i4k h ALA 289 Cb 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3i4k h ALA 289 CO -0.22 0.36 0.15 0.00 0.00 0.00 0.00 179.25 179.54 3i4k h ALA 290 N 1.36 0.50 -0.06 0.00 0.00 -0.50 -1.25 119.26 119.31 3i4k h ALA 290 Ca 0.34 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3i4k h ALA 290 Cb 0.03 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3i4k h ALA 290 CO -0.12 0.12 0.01 0.82 0.00 0.00 0.00 179.25 180.07 3i4k h ILE 291 N 0.48 1.22 0.07 0.00 2.04 -1.07 -1.59 117.51 118.66 3i4k h ILE 291 Ca 0.13 -0.66 0.02 0.00 1.00 0.00 0.00 64.86 65.35 3i4k h ILE 291 Cb 0.20 1.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.80 3i4k h ILE 291 CO -0.01 0.18 -0.23 0.00 0.00 0.00 0.00 178.15 178.09 3i4k h ALA 292 N 0.76 -0.36 -0.76 1.87 0.00 -1.29 -1.91 119.26 117.56 3i4k h ALA 292 Ca 0.02 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.98 3i4k h ALA 292 Cb 0.28 0.39 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 3i4k h ALA 292 CO 0.00 -0.75 0.43 1.49 0.00 0.00 0.00 179.25 180.42 3i4k h GLU 293 N -0.41 0.73 0.00 0.00 4.81 -1.22 0.11 114.58 118.60 3i4k h GLU 293 Ca 0.04 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 3i4k h GLU 293 Cb 0.45 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 3i4k h GLU 293 CO -0.17 0.48 -0.20 0.00 -0.73 0.00 0.00 179.01 178.40 3i4k h ALA 294 N 1.41 1.54 -0.45 2.92 0.00 -0.85 -1.99 119.26 121.84 3i4k h ALA 294 Ca 0.36 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3i4k h ALA 294 Cb 0.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3i4k h ALA 294 CO -0.22 0.24 0.00 0.41 0.00 0.00 0.00 179.25 179.68 3i4k n GLY 295 N -0.84 1.38 2.50 0.00 0.00 -0.37 -4.92 105.19 102.93 3i4k n GLY 295 Ca -0.02 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 1.36 0.51 3.75 -0.02 0.00 -0.67 -5.01 105.19 105.10 3i4k n GLY 296 Ca 0.18 0.00 -0.40 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 4.49 0.53 0.99 1.43 0.24 -4.97 118.68 121.39 3i4k s LEU 297 Ca 0.00 1.58 -0.16 0.00 -1.03 0.00 0.00 54.13 54.52 3i4k s LEU 297 Cb 0.00 -3.34 -0.07 0.00 0.03 0.00 0.00 46.19 42.81 3i4k s LEU 297 CO 0.00 0.02 1.00 0.00 0.23 0.00 0.00 176.35 177.60 3i4k s ALA 298 N -0.22 3.06 -0.08 4.21 0.00 -0.70 -3.71 121.76 124.32 3i4k s ALA 298 Ca 0.40 0.14 0.04 0.00 0.00 0.00 0.00 51.96 52.55 3i4k s ALA 298 Cb -0.22 -3.12 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 3i4k s ALA 298 CO 0.25 -0.33 -0.23 0.00 0.00 0.00 0.00 175.76 175.45 3i4k s HIS 300 N 0.09 3.05 -1.06 0.00 5.04 -0.67 -1.56 115.29 120.19 3i4k s HIS 300 Ca -0.11 -0.37 -0.23 0.00 -1.54 0.00 0.00 55.06 52.81 3i4k s HIS 300 Cb -0.16 -2.05 -0.03 0.00 0.04 0.00 0.00 32.58 30.39 3i4k s HIS 300 CO 0.06 -0.15 1.84 0.20 -2.34 0.00 0.00 174.74 174.35 3i4k s GLY 301 N 0.76 0.53 0.90 1.59 0.00 -0.68 -0.96 107.32 109.46 3i4k s GLY 301 Ca -0.00 -2.00 -0.13 0.00 0.00 0.00 0.00 44.72 42.58 3i4k s GLY 301 CO 0.02 3.29 1.20 0.00 0.00 0.00 0.00 173.10 177.61 3i4k s ALA 302 N 8.84 2.20 0.08 3.20 0.00 -0.39 -1.46 121.76 134.24 3i4k s ALA 302 Ca 0.64 -0.77 0.05 0.00 0.00 0.00 0.00 51.96 51.87 3i4k s ALA 302 Cb -0.02 -2.93 -0.03 0.00 0.00 0.00 0.00 23.12 20.14 3i4k s ALA 302 CO 0.03 -2.13 -0.13 -0.08 0.00 0.00 0.00 175.76 173.45 3i4k s THR 303 N -3.55 1.06 -0.30 0.00 -1.32 -1.26 -4.51 115.64 105.76 3i4k s THR 303 Ca 0.66 -1.41 0.16 0.00 -1.21 0.00 0.00 61.69 59.88 3i4k s THR 303 Cb -0.10 -1.16 0.59 0.00 -1.51 0.00 0.00 72.50 70.32 3i4k s THR 303 CO 0.51 -0.33 1.49 -1.20 -2.21 0.00 0.00 174.62 172.88 3i4k n SER 304 N 1.04 4.25 -3.03 8.08 7.64 -1.26 -4.91 113.62 125.43 3i4k n SER 304 Ca -0.19 -2.90 -0.16 0.00 1.01 0.00 0.00 58.87 56.63 3i4k n SER 304 Cb 0.55 -0.55 0.07 0.00 -1.01 0.00 0.00 64.21 63.27 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 -0.11 -3.48 -4.70 -3.43 4.32 -1.26 -3.25 117.00 105.08 3i4k n LEU 305 Ca 0.22 -0.49 -0.30 0.00 -0.02 0.00 0.00 56.01 55.42 3i4k n LEU 305 Cb 0.92 -2.65 0.14 0.00 -1.62 0.00 0.00 43.42 40.22 3i4k n LEU 305 CO 0.19 0.40 0.66 -1.61 -1.22 0.00 0.00 177.39 175.82 3i4k s GLU 306 N -5.50 1.25 0.00 3.23 8.01 -1.26 -4.95 118.70 119.48 3i4k s GLU 306 Ca 0.19 0.97 0.00 0.00 0.01 0.00 0.00 54.97 56.14 3i4k s GLU 306 Cb -0.08 -1.80 0.00 0.00 -4.31 0.00 0.00 34.13 27.94 3i4k s GLU 306 CO 0.60 -2.29 0.00 0.41 0.01 0.00 0.00 175.26 174.00 3i4k n GLY 307 N -0.85 0.38 0.13 -1.39 0.00 -1.26 -3.88 105.19 98.31 3i4k n GLY 307 Ca 0.08 -1.54 -0.06 0.00 0.00 0.00 0.00 46.02 44.50 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 0.14 -0.00 1.61 0.13 -1.95 -2.43 132.00 129.51 3i4k h PRO 308 Ca 0.00 -0.13 -0.00 0.00 -0.87 0.00 0.00 66.00 65.00 3i4k h PRO 308 Cb 0.00 0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.16 3i4k h PRO 308 CO 0.00 0.84 -0.00 0.82 -0.23 0.00 0.00 178.00 179.43 3i4k h ILE 309 N 0.09 1.36 -0.23 -3.56 1.08 -1.96 -1.69 117.51 112.61 3i4k h ILE 309 Ca -0.02 -1.07 -0.00 0.00 -0.39 0.00 0.00 64.86 63.38 3i4k h ILE 309 Cb 1.34 2.09 -0.01 0.00 -3.07 0.00 0.00 36.82 37.17 3i4k h ILE 309 CO 0.11 0.28 0.14 1.23 -0.69 0.00 0.00 178.15 179.21 3i4k h GLY 310 N -0.45 0.34 1.14 5.37 0.00 -1.91 -1.30 103.07 106.26 3i4k h GLY 310 Ca 0.00 -0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.24 3i4k h GLY 310 CO 0.00 0.14 0.44 -0.84 0.00 0.00 0.00 176.54 176.28 3i4k h THR 311 N 0.28 1.03 -0.47 4.70 2.02 -1.47 -0.41 112.91 118.59 3i4k h THR 311 Ca 0.08 -0.24 -0.13 0.00 0.77 0.00 0.00 66.41 66.89 3i4k h THR 311 Cb 0.03 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 3i4k h THR 311 CO -0.01 0.13 -0.21 0.00 0.37 0.00 0.00 175.52 175.79 3i4k h ALA 312 N 1.63 0.74 0.10 6.16 0.00 -0.73 0.19 119.26 127.35 3i4k h ALA 312 Ca 0.28 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3i4k h ALA 312 Cb 0.21 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3i4k h ALA 312 CO -0.09 0.67 -0.05 0.00 0.00 0.00 0.00 179.25 179.78 3i4k h ALA 313 N 0.93 -0.13 0.00 0.00 0.00 -0.11 -0.18 119.26 119.77 3i4k h ALA 313 Ca 0.11 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3i4k h ALA 313 Cb 0.77 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3i4k h ALA 313 CO 0.06 -0.54 -0.14 0.77 0.00 0.00 0.00 179.25 179.40 3i4k h SER 314 N -0.20 0.00 0.25 0.00 0.02 -0.96 -0.65 113.55 112.01 3i4k h SER 314 Ca -0.01 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.72 3i4k h SER 314 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3i4k h SER 314 CO 0.02 0.14 -0.86 -0.07 -1.14 0.00 0.00 176.83 174.92 3i4k h LEU 315 N 0.00 0.58 -0.61 5.07 3.38 -0.46 -1.41 115.31 121.86 3i4k h LEU 315 Ca -0.00 -0.43 -0.09 0.00 0.09 0.00 0.00 57.88 57.46 3i4k h LEU 315 Cb 0.32 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3i4k h LEU 315 CO 0.02 1.21 0.04 1.56 0.09 0.00 0.00 178.44 181.36 3i4k h GLN 316 N 0.28 1.05 -0.22 1.13 1.08 -0.14 -0.74 115.11 117.56 3i4k h GLN 316 Ca -0.06 -0.31 0.00 0.00 -1.45 0.00 0.00 58.65 56.82 3i4k h GLN 316 Cb 1.48 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 28.79 3i4k h GLN 316 CO 0.15 1.01 0.14 0.35 -0.95 0.00 0.00 178.83 179.53 3i4k h PHE 317 N 0.96 0.28 -0.34 2.96 3.04 -1.02 -2.66 116.94 120.15 3i4k h PHE 317 Ca 0.18 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.10 3i4k h PHE 317 Cb 0.51 -0.09 -0.02 0.00 2.56 0.00 0.00 35.95 38.90 3i4k h PHE 317 CO 0.04 0.19 0.06 0.00 -2.02 0.00 0.00 178.31 176.58 3i4k h ALA 318 N 1.07 1.47 -0.14 2.41 0.00 -0.95 -1.88 119.26 121.24 3i4k h ALA 318 Ca 0.08 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3i4k h ALA 318 Cb -0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3i4k h ALA 318 CO -0.02 0.38 -0.13 0.00 0.00 0.00 0.00 179.25 179.49 3i4k h ALA 319 N 1.58 1.52 -0.02 0.00 0.00 -0.81 -3.09 119.26 118.44 3i4k h ALA 319 Ca 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3i4k h ALA 319 Cb 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3i4k h ALA 319 CO -0.00 0.34 -0.10 -1.13 0.00 0.00 0.00 179.25 178.36 3i4k n SER 320 N -4.28 2.57 -4.05 0.00 3.41 -0.90 0.10 113.62 110.46 3i4k n SER 320 Ca -0.01 -1.78 -0.32 0.00 -0.26 0.00 0.00 58.87 56.50 3i4k n SER 320 Cb 0.26 0.11 -0.15 0.00 -0.26 0.00 0.00 64.21 64.18 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 -1.90 2.34 0.54 6.66 2.01 -0.76 -4.79 115.64 119.75 3i4k s THR 321 Ca 0.23 -2.06 0.21 0.00 0.31 0.00 0.00 61.69 60.37 3i4k s THR 321 Cb 0.17 -2.60 0.29 0.00 0.01 0.00 0.00 72.50 70.38 3i4k s THR 321 CO 0.32 -0.40 2.18 0.50 -0.69 0.00 0.00 174.62 176.53 3i4k h LYS 322 N 7.71 0.00 0.00 4.92 3.11 -1.90 -1.64 116.57 128.76 3i4k h LYS 322 Ca -0.10 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.74 3i4k h LYS 322 Cb 1.03 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.26 3i4k h LYS 322 CO 0.51 0.01 0.00 0.00 -2.81 0.00 0.00 179.45 177.16 3i4k h ALA 323 N 1.99 1.00 -1.15 5.00 0.00 -1.92 -3.33 119.26 120.85 3i4k h ALA 323 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 3i4k h ALA 323 Cb 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.73 3i4k h ALA 323 CO 0.00 0.00 1.25 0.42 0.00 0.00 0.00 179.25 180.92 3i4k s ILE 324 N -4.06 3.74 -0.81 0.00 -1.09 -0.62 -3.17 121.20 115.19 3i4k s ILE 324 Ca -0.05 -0.30 0.08 0.00 -2.23 0.00 0.00 60.65 58.15 3i4k s ILE 324 Cb 0.12 -4.76 0.16 0.00 -1.58 0.00 0.00 42.46 36.39 3i4k s ILE 324 CO 0.38 -1.68 1.01 -1.54 -1.23 0.00 0.00 174.94 171.89 3i4k n SER 325 N 10.14 2.26 -2.52 3.58 3.41 -0.60 -4.68 113.62 125.21 3i4k n SER 325 Ca 0.25 -1.73 -0.16 0.00 -0.26 0.00 0.00 58.87 56.97 3i4k n SER 325 Cb 0.50 -0.10 0.02 0.00 -0.26 0.00 0.00 64.21 64.37 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 0.32 2.17 -4.91 7.33 9.36 -0.86 -4.89 117.16 125.68 3i4k n TYR 326 Ca 0.07 -2.65 0.00 0.00 3.32 0.00 0.00 57.90 58.64 3i4k n TYR 326 Cb 0.31 -0.25 0.00 0.00 -0.63 0.00 0.00 39.34 38.76 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 -0.42 0.77 3.62 2.98 0.00 -1.26 -4.68 105.19 106.19 3i4k n GLY 327 Ca 0.25 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 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 0.00 -0.25 2.61 -4.23 -0.97 -1.69 115.64 111.11 3i4k s THR 328 Ca 0.00 -1.36 0.19 0.00 -1.18 0.00 0.00 61.69 59.35 3i4k s THR 328 Cb 0.00 -2.65 0.49 0.00 1.34 0.00 0.00 72.50 71.69 3i4k s THR 328 CO 0.00 0.00 1.13 -1.84 -0.54 0.00 0.00 174.62 173.37 3i4k n GLU 329 N -0.53 2.04 -1.42 3.99 0.28 -0.54 -0.18 120.64 124.28 3i4k n GLU 329 Ca -0.03 -3.56 -0.40 0.00 -0.16 0.00 0.00 57.16 53.02 3i4k n GLU 329 Cb 0.61 -1.66 -0.02 0.00 1.43 0.00 0.00 31.44 31.80 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 -0.57 8.39 -0.82 -1.84 4.77 -1.26 -4.34 117.00 121.34 3i4k n LEU 330 Ca 0.15 -4.35 0.10 0.00 -0.03 0.00 0.00 56.01 51.89 3i4k n LEU 330 Cb 0.86 -1.57 0.08 0.00 -2.33 0.00 0.00 43.42 40.46 3i4k n LEU 330 CO 0.13 1.90 0.57 2.22 -1.33 0.00 0.00 177.39 180.88 3i4k n PHE 331 N 3.98 0.00 -0.12 -1.77 1.16 -1.26 -4.78 117.46 114.66 3i4k n PHE 331 Ca 0.73 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 56.28 3i4k n PHE 331 Cb 0.26 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.10 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 1.16 -1.56 0.32 4.97 0.00 -1.26 -1.13 105.19 107.69 3i4k n GLY 332 Ca 0.12 0.50 0.16 0.00 0.00 0.00 0.00 46.02 46.79 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 0.24 0.00 1.61 0.11 -1.78 0.78 132.00 132.96 3i4k h PRO 333 Ca 0.05 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.14 3i4k h PRO 333 Cb 0.12 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.17 3i4k h PRO 333 CO -0.27 0.16 0.06 1.96 -0.21 0.00 0.00 178.00 179.69 3i4k h GLN 334 N 0.24 0.00 0.00 1.05 4.20 -1.51 -1.47 115.11 117.63 3i4k h GLN 334 Ca 0.60 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 59.24 3i4k h GLN 334 Cb 1.26 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.02 3i4k h GLN 334 CO -0.64 0.00 -0.74 1.25 -0.67 0.00 0.00 178.83 178.03 3i4k h LEU 335 N 0.00 0.00 -9.86 1.46 5.85 -0.91 -3.47 115.31 108.39 3i4k h LEU 335 Ca 0.00 0.00 -0.49 0.00 0.84 0.00 0.00 57.88 58.23 3i4k h LEU 335 Cb 0.12 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.16 3i4k h LEU 335 CO 0.00 0.29 0.42 -0.76 -0.34 0.00 0.00 178.44 178.06 3i4k s LEU 336 N -5.98 4.41 0.20 2.25 1.43 -0.56 -1.64 118.68 118.79 3i4k s LEU 336 Ca 0.02 2.11 -0.10 0.00 -1.03 0.00 0.00 54.13 55.12 3i4k s LEU 336 Cb 0.08 -3.85 0.14 0.00 0.03 0.00 0.00 46.19 42.58 3i4k s LEU 336 CO 0.76 -0.21 1.83 0.50 0.23 0.00 0.00 176.35 179.46 3i4k h LYS 337 N 3.36 0.99 0.00 1.70 1.63 -0.02 -3.42 116.57 120.81 3i4k h LYS 337 Ca -0.47 -0.10 0.00 0.00 -0.85 0.00 0.00 60.65 59.23 3i4k h LYS 337 Cb 1.21 -0.20 0.00 0.00 -0.60 0.00 0.00 32.23 32.64 3i4k h LYS 337 CO 0.65 0.72 0.00 -3.47 -3.45 0.00 0.00 179.45 173.90 3i4k n ASP 338 N -4.51 0.34 -3.84 4.20 2.03 -1.26 -4.95 116.55 108.56 3i4k n ASP 338 Ca 0.06 -0.24 -0.09 0.00 0.52 0.00 0.00 54.79 55.05 3i4k n ASP 338 Cb 0.07 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.43 3i4k n ASP 338 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3i4k s THR 339 N -0.94 0.01 -0.31 5.18 -1.32 -1.26 -5.02 115.64 111.99 3i4k s THR 339 Ca 0.00 -0.99 0.12 0.00 -1.21 0.00 0.00 61.69 59.61 3i4k s THR 339 Cb 0.00 -1.85 0.47 0.00 -1.51 0.00 0.00 72.50 69.61 3i4k s THR 339 CO 0.00 -0.05 1.13 0.00 -2.21 0.00 0.00 174.62 173.49 3i4k n TYR 340 N -0.38 2.27 -0.36 9.09 4.11 -1.26 -4.86 117.16 125.76 3i4k n TYR 340 Ca -0.06 -2.40 0.01 0.00 -0.00 0.00 0.00 57.90 55.44 3i4k n TYR 340 Cb 0.61 -0.27 0.01 0.00 -0.00 0.00 0.00 39.34 39.69 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 -0.57 0.79 0.00 -3.48 0.13 -1.26 -0.58 119.36 114.39 3i4k n ILE 341 Ca 0.29 -0.81 0.00 0.00 -1.10 0.00 0.00 62.75 61.13 3i4k n ILE 341 Cb 0.86 0.58 0.00 0.00 -0.84 0.00 0.00 39.64 40.23 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 -0.43 0.00 -2.02 9.51 0.31 -1.22 -3.77 118.33 120.72 3i4k n VAL 342 Ca 0.01 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.08 3i4k n VAL 342 Cb 0.35 0.00 0.18 0.00 -0.91 0.00 0.00 33.84 33.45 3i4k n VAL 342 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3i4k n GLN 343 N 0.00 -0.97 -4.06 5.55 3.00 -1.26 -5.10 117.38 114.54 3i4k n GLN 343 Ca 0.00 -2.07 -0.13 0.00 -0.01 0.00 0.00 57.00 54.79 3i4k n GLN 343 Cb 0.00 -1.14 -0.13 0.00 0.00 0.00 0.00 30.24 28.97 3i4k n GLN 343 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 3i4k s GLU 344 N -5.56 0.39 0.41 -1.09 2.02 -1.26 -5.04 118.70 108.57 3i4k s GLU 344 Ca 0.69 -0.45 -0.24 0.00 0.02 0.00 0.00 54.97 54.99 3i4k s GLU 344 Cb -0.02 -0.23 -0.08 0.00 0.10 0.00 0.00 34.13 33.90 3i4k s GLU 344 CO 0.48 0.05 1.10 -0.06 0.02 0.00 0.00 175.26 176.85 3i4k s PHE 345 N -0.80 3.13 -0.66 1.61 0.08 -1.26 -5.00 117.98 115.08 3i4k s PHE 345 Ca -0.06 1.60 -0.15 0.00 0.12 0.00 0.00 56.93 58.44 3i4k s PHE 345 Cb -0.06 -3.25 0.17 0.00 -0.57 0.00 0.00 43.02 39.31 3i4k s PHE 345 CO -0.00 -0.99 0.61 -1.21 -0.10 0.00 0.00 175.22 173.53 3i4k s GLU 346 N -2.49 3.23 -0.11 0.44 2.02 -1.26 -5.05 118.70 115.49 3i4k s GLU 346 Ca 0.59 -2.02 -0.11 0.00 0.02 0.00 0.00 54.97 53.44 3i4k s GLU 346 Cb -0.26 -4.35 -0.05 0.00 0.10 0.00 0.00 34.13 29.58 3i4k s GLU 346 CO 0.32 -1.31 0.26 0.71 0.02 0.00 0.00 175.26 175.25 3i4k s TYR 347 N 1.01 3.57 0.00 1.61 2.02 -1.26 -2.77 117.35 121.52 3i4k s TYR 347 Ca 0.09 0.65 0.00 0.00 -0.37 0.00 0.00 57.07 57.44 3i4k s TYR 347 Cb -0.22 -2.18 0.00 0.00 -0.40 0.00 0.00 41.96 39.16 3i4k s TYR 347 CO -0.02 0.51 0.00 0.36 -1.57 0.00 0.00 175.55 174.83 3i4k n LYS 348 N 2.60 0.00 -3.66 -0.62 2.85 -1.06 -4.98 118.16 113.29 3i4k n LYS 348 Ca -0.15 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 56.87 3i4k n LYS 348 Cb 0.53 0.00 0.06 0.00 -0.65 0.00 0.00 35.03 34.97 3i4k n LYS 348 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3i4k n ASP 349 N 0.00 -4.01 -3.19 -5.58 8.00 -0.97 -2.01 116.55 108.79 3i4k n ASP 349 Ca 0.00 -0.67 -0.23 0.00 0.71 0.00 0.00 54.79 54.60 3i4k n ASP 349 Cb 0.00 -4.57 0.02 0.00 -0.02 0.00 0.00 41.12 36.55 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 -1.66 -0.51 0.91 0.44 0.00 0.14 -4.88 105.19 99.64 3i4k n GLY 350 Ca -0.11 0.11 -0.05 0.00 0.00 0.00 0.00 46.02 45.98 3i4k n GLY 350 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3i4k n GLN 351 N -3.89 0.16 -3.66 1.61 6.02 -0.85 -1.61 117.38 115.16 3i4k n GLN 351 Ca -0.06 -0.84 -0.11 0.00 -0.01 0.00 0.00 57.00 55.97 3i4k n GLN 351 Cb 0.58 0.75 -0.08 0.00 1.02 0.00 0.00 30.24 32.51 3i4k n GLN 351 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3i4k s VAL 352 N -2.46 -0.00 0.36 5.09 0.11 -0.94 -2.56 120.40 120.00 3i4k s VAL 352 Ca 0.09 0.01 -0.16 0.00 -2.93 0.00 0.00 61.98 59.00 3i4k s VAL 352 Cb 0.00 -0.86 -0.09 0.00 -1.53 0.00 0.00 36.38 33.90 3i4k s VAL 352 CO 0.07 0.01 0.80 0.00 -3.33 0.00 0.00 175.10 172.64 3i4k s ALA 353 N 0.83 3.24 0.02 1.54 0.00 -1.12 -1.78 121.76 124.49 3i4k s ALA 353 Ca -0.04 0.11 -0.30 0.00 0.00 0.00 0.00 51.96 51.73 3i4k s ALA 353 Cb -0.05 -2.87 -0.04 0.00 0.00 0.00 0.00 23.12 20.16 3i4k s ALA 353 CO -0.07 0.23 1.04 0.42 0.00 0.00 0.00 175.76 177.39 3i4k s ILE 354 N -2.09 4.62 0.16 0.00 1.09 0.93 -4.70 121.20 121.21 3i4k s ILE 354 Ca 0.56 1.88 -0.31 0.00 -1.10 0.00 0.00 60.65 61.68 3i4k s ILE 354 Cb -0.10 -4.21 -0.11 0.00 -1.06 0.00 0.00 42.46 36.99 3i4k s ILE 354 CO 0.18 0.15 1.69 -2.84 -0.10 0.00 0.00 174.94 174.02 3i4k s PRO 355 N 1.02 4.16 0.29 2.79 0.02 -1.26 -4.96 135.00 137.06 3i4k s PRO 355 Ca 0.54 2.50 -0.06 0.00 0.02 0.00 0.00 61.00 64.00 3i4k s PRO 355 Cb -0.24 -3.27 -0.06 0.00 0.02 0.00 0.00 34.50 30.96 3i4k s PRO 355 CO 0.28 -0.73 0.57 -0.65 -0.33 0.00 0.00 177.00 176.15 3i4k s GLN 356 N 1.68 3.67 0.00 5.54 -1.52 -1.26 -4.61 119.66 123.16 3i4k s GLN 356 Ca 0.75 0.08 0.00 0.00 -1.95 0.00 0.00 55.36 54.24 3i4k s GLN 356 Cb -0.46 -2.62 0.00 0.00 -0.22 0.00 0.00 33.01 29.70 3i4k s GLN 356 CO 0.33 0.21 0.00 0.41 -0.25 0.00 0.00 175.29 175.98 3i4k n GLY 357 N -0.86 2.89 3.53 3.09 0.00 -1.26 -4.64 105.19 107.95 3i4k n GLY 357 Ca -0.01 -1.99 -0.33 0.00 0.00 0.00 0.00 46.02 43.70 3i4k n GLY 357 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3i4k n PRO 358 N -0.29 -0.24 0.00 1.61 -0.04 -1.26 -3.62 135.00 131.15 3i4k n PRO 358 Ca 0.00 -0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 3i4k n PRO 358 Cb 0.00 -2.09 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 3i4k n PRO 358 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i4k n GLY 359 N 1.02 2.52 0.00 0.55 0.00 -0.47 -1.24 105.19 107.56 3i4k n GLY 359 Ca 0.09 -0.43 0.10 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 -0.33 0.99 7.99 -1.26 -1.19 117.00 123.20 3i4k n LEU 360 Ca 0.00 0.13 -0.04 0.00 -0.01 0.00 0.00 56.01 56.10 3i4k n LEU 360 Cb 0.00 -0.13 -0.01 0.00 -0.11 0.00 0.00 43.42 43.17 3i4k n LEU 360 CO 0.00 -0.05 -0.04 0.61 -1.51 0.00 0.00 177.39 176.40 3i4k n GLY 361 N 0.31 0.48 3.48 -0.72 0.00 -0.38 -4.73 105.19 103.63 3i4k n GLY 361 Ca 0.12 -0.84 -0.08 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.15 -0.17 -0.13 1.61 0.11 -1.26 -4.48 120.40 113.92 3i4k s VAL 362 Ca 0.00 0.05 -0.06 0.00 -2.93 0.00 0.00 61.98 59.03 3i4k s VAL 362 Cb 0.00 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.97 3i4k s VAL 362 CO 0.00 0.02 0.09 -1.81 -3.33 0.00 0.00 175.10 170.07 3i4k s ASP 363 N 1.78 5.96 0.27 3.54 1.11 -1.25 -5.03 116.67 123.05 3i4k s ASP 363 Ca -0.09 0.29 -0.29 0.00 0.18 0.00 0.00 52.55 52.64 3i4k s ASP 363 Cb -0.08 -1.92 -0.09 0.00 1.07 0.00 0.00 42.92 41.90 3i4k s ASP 363 CO -0.17 0.33 1.12 0.68 1.18 0.00 0.00 175.17 178.31 3i4k s VAL 364 N -0.54 3.47 0.71 -1.27 -7.23 -1.26 -3.37 120.40 110.91 3i4k s VAL 364 Ca 0.11 1.44 0.02 0.00 -1.81 0.00 0.00 61.98 61.74 3i4k s VAL 364 Cb -0.12 -3.92 0.13 0.00 0.56 0.00 0.00 36.38 33.04 3i4k s VAL 364 CO 0.02 0.33 0.98 -0.62 -0.31 0.00 0.00 175.10 175.49 3i4k s ASP 365 N -0.70 4.38 0.00 4.85 -1.08 0.26 -4.83 116.67 119.55 3i4k s ASP 365 Ca 0.46 -0.58 0.00 0.00 -0.52 0.00 0.00 52.55 51.91 3i4k s ASP 365 Cb -0.32 0.26 0.00 0.00 -1.46 0.00 0.00 42.92 41.39 3i4k s ASP 365 CO 0.41 -1.86 0.00 0.47 0.52 0.00 0.00 175.17 174.71 3i4k n ASP 367 N -2.76 0.00 0.11 -0.34 8.00 -1.26 -1.60 116.55 118.70 3i4k n ASP 367 Ca 0.17 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.62 3i4k n ASP 367 Cb 0.61 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.80 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 0.09 0.38 -1.24 1.57 -1.92 -2.33 116.57 113.13 3i4k h LYS 368 Ca 0.00 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 3i4k h LYS 368 Cb 0.00 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3i4k h LYS 368 CO 0.00 0.76 -0.18 0.28 -0.57 0.00 0.00 179.45 179.74 3i4k h VAL 369 N 0.06 0.63 -0.32 0.50 2.07 -1.59 -2.08 116.25 115.51 3i4k h VAL 369 Ca -0.01 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.46 3i4k h VAL 369 Cb 1.26 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 3i4k h VAL 369 CO 0.10 0.02 0.22 0.78 0.02 0.00 0.00 177.57 178.70 3i4k h ASN 370 N -0.56 0.26 -0.11 0.57 -0.26 -1.83 -0.68 115.58 112.98 3i4k h ASN 370 Ca -0.05 -0.00 -0.14 0.00 -0.56 0.00 0.00 56.30 55.54 3i4k h ASN 370 Cb 0.42 -0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 37.61 3i4k h ASN 370 CO 0.09 0.18 -0.42 0.15 -1.06 0.00 0.00 177.43 176.37 3i4k h PHE 371 N 0.30 0.77 -0.02 1.19 3.57 -0.99 -3.10 116.94 118.67 3i4k h PHE 371 Ca 0.13 -0.23 0.00 0.00 3.53 0.00 0.00 57.97 61.40 3i4k h PHE 371 Cb 0.16 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.73 3i4k h PHE 371 CO -0.00 0.96 -0.02 0.66 -2.23 0.00 0.00 178.31 177.68 3i4k n TYR 372 N -4.02 0.00 -2.08 0.41 4.01 -0.82 -4.92 117.16 109.74 3i4k n TYR 372 Ca -0.02 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.29 3i4k n TYR 372 Cb 0.54 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.54 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 -2.02 3.68 -1.80 -0.72 2.01 -0.30 -0.82 115.64 115.67 3i4k s THR 373 Ca 0.31 0.81 0.00 0.00 0.31 0.00 0.00 61.69 63.11 3i4k s THR 373 Cb 0.20 -3.59 0.00 0.00 0.01 0.00 0.00 72.50 69.12 3i4k s THR 373 CO 0.32 -0.15 0.45 -1.14 -0.69 0.00 0.00 174.62 173.42