#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 2.03 -4.71 -2.67 7.94 -1.26 -2.26 117.00 116.06 3i4k n LEU 6 Ca 0.00 -0.87 -0.42 0.00 -1.11 0.00 0.00 56.01 53.61 3i4k n LEU 6 Cb 0.00 -0.15 -0.03 0.00 0.53 0.00 0.00 43.42 43.77 3i4k n LEU 6 CO 0.00 0.44 1.34 -0.89 -1.11 0.00 0.00 177.39 177.16 3i4k s THR 7 N -1.71 2.31 -0.43 1.96 2.01 -1.26 -1.52 115.64 117.01 3i4k s THR 7 Ca 0.33 0.18 -0.29 0.00 0.31 0.00 0.00 61.69 62.21 3i4k s THR 7 Cb 0.18 -3.11 0.02 0.00 0.01 0.00 0.00 72.50 69.60 3i4k s THR 7 CO 0.26 0.01 1.16 -0.63 -0.69 0.00 0.00 174.62 174.74 3i4k s ILE 8 N 1.39 4.23 -0.06 1.82 1.09 -0.14 -0.86 121.20 128.67 3i4k s ILE 8 Ca 0.74 1.31 -0.05 0.00 -1.10 0.00 0.00 60.65 61.55 3i4k s ILE 8 Cb -0.47 -4.50 -0.28 0.00 -1.06 0.00 0.00 42.46 36.16 3i4k s ILE 8 CO 0.32 -0.84 0.62 1.56 -0.10 0.00 0.00 174.94 176.50 3i4k h GLN 9 N 9.14 0.28 -3.02 2.79 1.08 -1.36 0.17 115.11 124.19 3i4k h GLN 9 Ca -0.23 -0.48 -0.07 0.00 -1.45 0.00 0.00 58.65 56.42 3i4k h GLN 9 Cb 1.07 0.18 -0.16 0.00 -0.05 0.00 0.00 27.48 28.51 3i4k h GLN 9 CO 1.10 1.15 -0.07 0.21 -0.95 0.00 0.00 178.83 180.27 3i4k s LYS 10 N -2.58 0.96 -0.07 1.46 2.20 -1.14 -4.77 119.74 115.79 3i4k s LYS 10 Ca -0.15 -0.37 -0.00 0.00 -0.36 0.00 0.00 55.97 55.08 3i4k s LYS 10 Cb 0.06 0.43 0.02 0.00 -1.51 0.00 0.00 37.83 36.84 3i4k s LYS 10 CO 0.82 -0.34 -0.03 0.14 -0.36 0.00 0.00 175.35 175.58 3i4k s VAL 11 N -2.60 0.58 0.22 4.02 -7.23 -1.26 -0.05 120.40 114.08 3i4k s VAL 11 Ca -0.04 -0.06 0.11 0.00 -1.81 0.00 0.00 61.98 60.18 3i4k s VAL 11 Cb -0.01 -0.65 -0.05 0.00 0.56 0.00 0.00 36.38 36.24 3i4k s VAL 11 CO -0.03 0.27 -0.23 -1.61 -0.31 0.00 0.00 175.10 173.19 3i4k s GLU 12 N 1.48 1.56 -0.04 4.82 2.02 0.44 -4.96 118.70 124.02 3i4k s GLU 12 Ca -0.02 -1.60 -0.02 0.00 0.02 0.00 0.00 54.97 53.36 3i4k s GLU 12 Cb -0.13 -1.80 0.03 0.00 0.10 0.00 0.00 34.13 32.32 3i4k s GLU 12 CO -0.03 0.37 0.08 -1.54 0.02 0.00 0.00 175.26 174.16 3i4k s SER 13 N -2.94 -0.03 -0.02 -0.19 1.04 -1.26 0.52 113.70 110.82 3i4k s SER 13 Ca 0.24 0.15 0.03 0.00 0.48 0.00 0.00 55.95 56.85 3i4k s SER 13 Cb -0.07 0.08 -0.00 0.00 0.10 0.00 0.00 66.02 66.13 3i4k s SER 13 CO 0.11 -0.10 -0.12 -0.13 0.98 0.00 0.00 173.24 173.99 3i4k s ARG 14 N 0.78 1.13 -0.10 4.02 0.52 -0.14 -4.95 118.95 120.21 3i4k s ARG 14 Ca -0.06 -0.40 -0.24 0.00 -0.52 0.00 0.00 55.73 54.51 3i4k s ARG 14 Cb -0.09 -1.05 -0.03 0.00 0.52 0.00 0.00 34.95 34.31 3i4k s ARG 14 CO -0.03 0.18 0.73 0.42 0.02 0.00 0.00 175.30 176.62 3i4k s ILE 15 N 0.03 5.00 -0.10 1.52 1.01 -1.26 -0.09 121.20 127.32 3i4k s ILE 15 Ca -0.01 1.48 0.01 0.00 0.00 0.00 0.00 60.65 62.13 3i4k s ILE 15 Cb -0.08 -4.06 -0.02 0.00 0.01 0.00 0.00 42.46 38.31 3i4k s ILE 15 CO 0.01 0.18 -0.13 -0.76 0.00 0.00 0.00 174.94 174.24 3i4k s LEU 16 N 1.22 2.76 -0.58 2.97 1.43 0.15 -1.07 118.68 125.56 3i4k s LEU 16 Ca 0.37 -0.26 0.04 0.00 -1.03 0.00 0.00 54.13 53.25 3i4k s LEU 16 Cb -0.17 -1.60 0.14 0.00 0.03 0.00 0.00 46.19 44.59 3i4k s LEU 16 CO 0.16 0.24 0.34 -1.81 0.23 0.00 0.00 176.35 175.52 3i4k s ASP 17 N -0.12 4.55 -0.17 2.29 1.01 -0.56 -1.11 116.67 122.57 3i4k s ASP 17 Ca -0.01 -3.23 -0.16 0.00 0.71 0.00 0.00 52.55 49.86 3i4k s ASP 17 Cb -0.14 -1.66 -0.04 0.00 1.01 0.00 0.00 42.92 42.09 3i4k s ASP 17 CO 0.03 -0.20 0.38 0.54 0.21 0.00 0.00 175.17 176.13 3i4k s VAL 18 N -0.60 5.23 0.81 -1.27 0.11 -1.01 -4.90 120.40 118.77 3i4k s VAL 18 Ca 0.19 0.70 -0.13 0.00 -2.93 0.00 0.00 61.98 59.81 3i4k s VAL 18 Cb -0.20 -3.71 0.09 0.00 -1.53 0.00 0.00 36.38 31.02 3i4k s VAL 18 CO -0.05 0.31 1.20 -2.84 -3.33 0.00 0.00 175.10 170.39 3i4k s PRO 19 N 0.90 1.61 -0.11 1.54 0.02 -1.26 -1.27 135.00 136.43 3i4k s PRO 19 Ca 0.19 1.73 -0.05 0.00 0.02 0.00 0.00 61.00 62.90 3i4k s PRO 19 Cb -0.14 -1.77 -0.04 0.00 0.02 0.00 0.00 34.50 32.57 3i4k s PRO 19 CO 0.07 -2.23 0.06 -0.51 -0.33 0.00 0.00 177.00 174.06 3i4k s LEU 20 N -5.76 3.90 0.58 -5.54 1.02 -0.03 -1.80 118.68 111.05 3i4k s LEU 20 Ca 0.72 0.25 0.28 0.00 0.02 0.00 0.00 54.13 55.40 3i4k s LEU 20 Cb -0.28 -1.93 1.57 0.00 0.02 0.00 0.00 46.19 45.57 3i4k s LEU 20 CO 0.51 0.35 2.05 0.40 0.02 0.00 0.00 176.35 179.69 3i4k h ILE 21 N 4.22 0.51 -3.00 -0.59 2.04 -1.73 -3.43 117.51 115.53 3i4k h ILE 21 Ca -0.50 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.29 3i4k h ILE 21 Cb 1.20 0.79 -0.16 0.00 -0.74 0.00 0.00 36.82 37.91 3i4k h ILE 21 CO 0.58 0.00 -0.08 -0.13 0.00 0.00 0.00 178.15 178.52 3i4k s ARG 22 N -4.70 0.94 0.27 2.37 0.52 -1.26 -5.02 118.95 112.06 3i4k s ARG 22 Ca -0.05 -0.35 -0.30 0.00 -0.52 0.00 0.00 55.73 54.52 3i4k s ARG 22 Cb 0.16 0.42 -0.10 0.00 0.52 0.00 0.00 34.95 35.95 3i4k s ARG 22 CO 0.58 -0.33 1.46 -2.14 0.02 0.00 0.00 175.30 174.89 3i4k s PRO 23 N -2.50 4.24 -0.42 3.54 0.02 -1.26 -4.86 135.00 133.76 3i4k s PRO 23 Ca -0.05 2.35 -0.04 0.00 0.02 0.00 0.00 61.00 63.28 3i4k s PRO 23 Cb -0.01 -3.09 0.11 0.00 0.02 0.00 0.00 34.50 31.54 3i4k s PRO 23 CO -0.02 -0.44 0.22 -1.58 -0.33 0.00 0.00 177.00 174.85 3i4k s HIS 24 N -0.14 3.57 0.09 6.54 2.46 0.70 -4.94 115.29 123.58 3i4k s HIS 24 Ca 0.59 -2.36 -0.22 0.00 0.47 0.00 0.00 55.06 53.54 3i4k s HIS 24 Cb -0.43 -3.26 -0.07 0.00 -0.13 0.00 0.00 32.58 28.69 3i4k s HIS 24 CO 0.46 -0.97 0.65 0.20 -2.47 0.00 0.00 174.74 172.60 3i4k s GLY 25 N 1.91 2.76 0.00 1.59 0.00 -1.26 -0.95 107.32 111.36 3i4k s GLY 25 Ca 0.08 0.16 0.00 0.00 0.00 0.00 0.00 44.72 44.96 3i4k s GLY 25 CO -0.04 0.67 0.00 0.69 0.00 0.00 0.00 173.10 174.42 3i4k n PHE 26 N 1.86 -0.64 -0.09 1.90 3.72 0.36 -1.66 117.46 122.91 3i4k n PHE 26 Ca -0.08 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.20 3i4k n PHE 26 Cb 0.50 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.00 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 0.48 0.35 0.00 4.37 0.00 -1.90 -3.36 119.26 119.19 3i4k h ALA 27 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3i4k h ALA 27 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3i4k h ALA 27 CO 0.00 0.14 0.00 0.25 0.00 0.00 0.00 179.25 179.64 3i4k n THR 28 N -4.56 0.23 -3.77 0.00 -2.24 -1.26 -3.77 114.28 98.91 3i4k n THR 28 Ca -0.04 -0.58 -0.10 0.00 -2.27 0.00 0.00 64.05 61.07 3i4k n THR 28 Cb 0.30 0.94 -0.06 0.00 -2.10 0.00 0.00 70.33 69.41 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 -0.23 0.08 -0.05 4.28 -4.23 -1.26 -5.16 115.64 109.07 3i4k s THR 29 Ca 0.00 -0.92 0.01 0.00 -1.18 0.00 0.00 61.69 59.59 3i4k s THR 29 Cb 0.00 -1.42 0.02 0.00 1.34 0.00 0.00 72.50 72.44 3i4k s THR 29 CO 0.00 -0.35 -0.04 -0.89 -0.54 0.00 0.00 174.62 172.80 3i4k s THR 30 N -3.86 0.53 -0.09 3.99 2.01 -1.26 0.14 115.64 117.09 3i4k s THR 30 Ca 0.07 -0.08 -0.05 0.00 0.31 0.00 0.00 61.69 61.95 3i4k s THR 30 Cb 0.02 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 3i4k s THR 30 CO -0.08 0.24 0.10 -0.44 -0.69 0.00 0.00 174.62 173.75 3i4k s SER 31 N 1.15 6.01 -0.01 3.53 0.01 -0.12 -4.92 113.70 119.35 3i4k s SER 31 Ca -0.07 0.34 0.10 0.00 1.31 0.00 0.00 55.95 57.63 3i4k s SER 31 Cb -0.14 -1.86 -0.14 0.00 0.21 0.00 0.00 66.02 64.09 3i4k s SER 31 CO -0.01 0.38 0.26 0.35 0.41 0.00 0.00 173.24 174.63 3i4k n THR 32 N 1.85 0.00 -3.87 1.44 -2.24 -1.26 -0.21 114.28 109.99 3i4k n THR 32 Ca -0.18 -0.24 -0.09 0.00 -2.27 0.00 0.00 64.05 61.27 3i4k n THR 32 Cb 0.54 0.44 -0.07 0.00 -2.10 0.00 0.00 70.33 69.14 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 -2.51 0.83 -0.09 -0.78 -1.05 -1.26 -0.85 118.70 112.99 3i4k s GLU 33 Ca -0.02 -0.96 0.01 0.00 -0.15 0.00 0.00 54.97 53.85 3i4k s GLU 33 Cb 0.07 0.34 -0.02 0.00 -0.44 0.00 0.00 34.13 34.07 3i4k s GLU 33 CO 0.41 -0.26 -0.12 -1.14 0.95 0.00 0.00 175.26 175.10 3i4k s GLN 34 N -3.85 2.91 -0.21 -4.83 2.00 -0.39 -4.90 119.66 110.39 3i4k s GLN 34 Ca 0.05 -0.66 -0.10 0.00 -2.00 0.00 0.00 55.36 52.66 3i4k s GLN 34 Cb 0.05 -2.53 -0.05 0.00 0.80 0.00 0.00 33.01 31.28 3i4k s GLN 34 CO -0.11 0.47 0.12 -1.01 -0.50 0.00 0.00 175.29 174.26 3i4k s HIS 35 N -0.31 3.33 -0.06 1.67 3.76 -1.26 -2.41 115.29 120.01 3i4k s HIS 35 Ca 0.03 0.21 0.02 0.00 -0.15 0.00 0.00 55.06 55.17 3i4k s HIS 35 Cb -0.13 -2.19 0.01 0.00 1.11 0.00 0.00 32.58 31.39 3i4k s HIS 35 CO 0.03 0.16 -0.10 0.42 -0.85 0.00 0.00 174.74 174.39 3i4k s ILE 36 N 0.66 0.96 -0.64 0.60 1.01 -0.26 -4.55 121.20 118.97 3i4k s ILE 36 Ca 0.07 -0.38 -0.18 0.00 0.00 0.00 0.00 60.65 60.15 3i4k s ILE 36 Cb -0.12 -0.90 0.12 0.00 0.01 0.00 0.00 42.46 41.57 3i4k s ILE 36 CO 0.01 0.32 0.74 -0.22 0.00 0.00 0.00 174.94 175.78 3i4k s LEU 37 N 0.69 5.51 -0.55 2.97 2.96 -0.02 0.35 118.68 130.59 3i4k s LEU 37 Ca -0.13 -1.61 -0.28 0.00 -0.22 0.00 0.00 54.13 51.89 3i4k s LEU 37 Cb -0.15 -2.30 0.03 0.00 0.50 0.00 0.00 46.19 44.27 3i4k s LEU 37 CO 0.03 -1.06 1.22 -0.22 -1.32 0.00 0.00 176.35 175.00 3i4k s LEU 38 N 2.43 3.49 -0.01 -0.68 2.96 0.88 -0.39 118.68 127.36 3i4k s LEU 38 Ca 0.13 0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 54.20 3i4k s LEU 38 Cb -0.22 -3.26 -0.05 0.00 0.50 0.00 0.00 46.19 43.16 3i4k s LEU 38 CO 0.04 -1.46 0.30 -0.69 -1.32 0.00 0.00 176.35 173.22 3i4k s VAL 39 N 5.00 5.23 -0.02 1.68 1.01 0.70 -0.97 120.40 133.03 3i4k s VAL 39 Ca 0.46 0.41 0.01 0.00 0.00 0.00 0.00 61.98 62.87 3i4k s VAL 39 Cb -0.08 -3.59 0.01 0.00 0.00 0.00 0.00 36.38 32.72 3i4k s VAL 39 CO 0.27 0.46 -0.05 -0.94 0.00 0.00 0.00 175.10 174.85 3i4k s SER 40 N -1.41 0.77 -0.24 3.32 1.04 0.19 -0.86 113.70 116.51 3i4k s SER 40 Ca 0.25 -0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.53 3i4k s SER 40 Cb -0.14 -0.25 -0.00 0.00 0.10 0.00 0.00 66.02 65.73 3i4k s SER 40 CO 0.13 0.00 -0.01 -0.69 0.98 0.00 0.00 173.24 173.66 3i4k s VAL 41 N 0.42 3.51 -0.21 5.02 1.01 0.22 -0.42 120.40 129.94 3i4k s VAL 41 Ca -0.05 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 3i4k s VAL 41 Cb -0.09 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 3i4k s VAL 41 CO -0.00 0.31 0.13 -1.00 0.00 0.00 0.00 175.10 174.54 3i4k s HIS 42 N 1.47 3.35 0.39 5.22 0.09 0.93 -0.80 115.29 125.94 3i4k s HIS 42 Ca 0.04 0.25 0.07 0.00 -0.00 0.00 0.00 55.06 55.42 3i4k s HIS 42 Cb -0.15 -2.19 0.00 0.00 -0.00 0.00 0.00 32.58 30.24 3i4k s HIS 42 CO -0.02 0.19 0.52 -0.51 -0.00 0.00 0.00 174.74 174.92 3i4k s LEU 43 N 0.61 3.77 0.23 0.89 1.43 -0.67 -0.99 118.68 123.95 3i4k s LEU 43 Ca 0.07 -0.34 -0.07 0.00 -1.03 0.00 0.00 54.13 52.76 3i4k s LEU 43 Cb -0.12 -2.67 0.30 0.00 0.03 0.00 0.00 46.19 43.73 3i4k s LEU 43 CO 0.00 -0.63 1.83 -0.08 0.23 0.00 0.00 176.35 177.71 3i4k h GLU 44 N 0.75 0.83 -0.12 1.70 4.57 -0.95 -2.16 114.58 119.20 3i4k h GLU 44 Ca -0.42 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 3i4k h GLU 44 Cb 1.27 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.67 3i4k h GLU 44 CO 0.48 0.55 0.00 0.27 -1.18 0.00 0.00 179.01 179.13 3i4k n ASN 45 N -4.69 0.12 0.00 1.04 2.04 -0.96 -4.86 115.26 107.96 3i4k n ASN 45 Ca 0.11 -1.68 0.00 0.00 -0.44 0.00 0.00 54.58 52.57 3i4k n ASN 45 Cb 0.18 -0.06 0.00 0.00 -2.53 0.00 0.00 39.78 37.37 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 0.30 2.70 3.77 4.83 0.00 -0.81 -5.02 105.19 110.96 3i4k n GLY 46 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.08 2.91 -0.06 1.61 0.11 -1.26 -4.79 120.40 116.84 3i4k s VAL 47 Ca 0.00 0.77 0.05 0.00 -2.93 0.00 0.00 61.98 59.88 3i4k s VAL 47 Cb 0.00 -3.44 -0.01 0.00 -1.53 0.00 0.00 36.38 31.40 3i4k s VAL 47 CO 0.00 0.08 -0.21 -0.63 -3.33 0.00 0.00 175.10 171.01 3i4k s ILE 48 N -1.35 1.77 -0.00 7.04 1.01 -1.26 -1.67 121.20 126.73 3i4k s ILE 48 Ca 0.58 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 60.34 3i4k s ILE 48 Cb -0.34 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 3i4k s ILE 48 CO 0.43 0.50 -0.01 -0.83 0.00 0.00 0.00 174.94 175.03 3i4k s GLY 49 N 0.00 1.86 -0.03 6.18 0.00 0.02 -4.58 107.32 110.78 3i4k s GLY 49 Ca -0.06 -0.95 0.07 0.00 0.00 0.00 0.00 44.72 43.77 3i4k s GLY 49 CO 0.04 -0.82 -0.23 -0.19 0.00 0.00 0.00 173.10 171.90 3i4k s TYR 50 N -1.07 2.09 0.03 1.90 2.02 -1.25 -0.61 117.35 120.45 3i4k s TYR 50 Ca 0.19 -0.46 -0.00 0.00 -0.37 0.00 0.00 57.07 56.42 3i4k s TYR 50 Cb -0.11 -1.35 -0.03 0.00 -0.40 0.00 0.00 41.96 40.07 3i4k s TYR 50 CO 0.10 -0.09 -0.03 0.20 -1.57 0.00 0.00 175.55 174.16 3i4k s GLY 51 N -0.40 0.30 -0.12 0.71 0.00 -0.04 -3.73 107.32 104.05 3i4k s GLY 51 Ca 0.05 -0.75 -0.01 0.00 0.00 0.00 0.00 44.72 44.01 3i4k s GLY 51 CO 0.00 -0.83 -0.07 -0.54 0.00 0.00 0.00 173.10 171.66 3i4k s GLU 52 N -2.11 3.25 -0.48 2.90 2.02 -1.26 -0.22 118.70 122.80 3i4k s GLU 52 Ca -0.10 -0.56 -0.10 0.00 0.02 0.00 0.00 54.97 54.22 3i4k s GLU 52 Cb -0.05 -2.73 0.12 0.00 0.10 0.00 0.00 34.13 31.56 3i4k s GLU 52 CO -0.03 0.41 0.36 0.20 0.02 0.00 0.00 175.26 176.22 3i4k s GLY 53 N -0.11 2.04 -0.05 -1.39 0.00 0.47 -3.87 107.32 104.40 3i4k s GLY 53 Ca 0.01 -2.49 -0.09 0.00 0.00 0.00 0.00 44.72 42.16 3i4k s GLY 53 CO 0.03 1.11 0.21 0.54 0.00 0.00 0.00 173.10 174.99 3i4k s VAL 54 N 1.41 0.03 0.31 1.40 0.11 -1.26 -0.84 120.40 121.56 3i4k s VAL 54 Ca 0.05 -0.23 0.07 0.00 -2.93 0.00 0.00 61.98 58.94 3i4k s VAL 54 Cb -0.26 -0.38 -0.06 0.00 -1.53 0.00 0.00 36.38 34.14 3i4k s VAL 54 CO 0.00 -0.13 -0.06 0.68 -3.33 0.00 0.00 175.10 172.27 3i4k s VAL 55 N -0.43 1.84 -0.96 2.04 -7.23 -1.26 -4.86 120.40 109.53 3i4k s VAL 55 Ca -0.05 -2.13 -0.24 0.00 -1.81 0.00 0.00 61.98 57.75 3i4k s VAL 55 Cb -0.04 -2.58 -0.01 0.00 0.56 0.00 0.00 36.38 34.31 3i4k s VAL 55 CO 0.01 -0.22 1.78 -2.84 -0.31 0.00 0.00 175.10 173.52 3i4k s PRO 56 N -3.70 2.92 0.00 4.82 0.02 -1.19 -4.38 135.00 133.49 3i4k s PRO 56 Ca 0.31 -0.64 0.00 0.00 0.02 0.00 0.00 61.00 60.69 3i4k s PRO 56 Cb 0.04 -5.18 0.00 0.00 0.02 0.00 0.00 34.50 29.38 3i4k s PRO 56 CO 0.14 -3.00 0.00 0.41 -0.33 0.00 0.00 177.00 174.22 3i4k n GLY 57 N 6.78 1.53 0.00 0.52 0.00 -1.26 -4.77 105.19 107.99 3i4k n GLY 57 Ca 0.38 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.48 0.04 -0.02 0.00 -1.26 -4.78 105.19 98.68 3i4k n GLY 58 Ca 0.00 -1.01 0.02 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.19 0.02 0.32 1.61 -0.04 -1.20 -2.39 135.00 133.12 3i4k n PRO 59 Ca 0.00 0.42 0.19 0.00 -0.04 0.00 0.00 63.50 64.07 3i4k n PRO 59 Cb 0.00 -1.72 1.05 0.00 -0.04 0.00 0.00 33.50 32.79 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 0.16 0.54 5.08 -1.91 0.61 115.95 120.42 3i4k h TRP 60 Ca 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.96 3i4k h TRP 60 Cb 0.29 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.45 3i4k h TRP 60 CO 0.00 0.01 -0.08 2.35 -1.28 0.00 0.00 178.44 179.44 3i4k h TRP 61 N 0.00 -0.20 0.00 0.12 7.01 -1.77 -3.43 115.95 117.68 3i4k h TRP 61 Ca -0.00 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 3i4k h TRP 61 Cb 0.03 0.07 0.00 0.00 -2.10 0.00 0.00 29.16 27.15 3i4k h TRP 61 CO 0.00 0.16 -0.10 0.41 -2.79 0.00 0.00 178.44 176.11 3i4k n GLY 62 N 0.93 -2.19 1.28 2.65 0.00 -1.19 -5.02 105.19 101.65 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 0.72 3.46 -0.02 0.00 0.20 -5.05 105.19 104.50 3i4k n GLY 63 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.56 2.01 0.23 1.61 2.02 -1.26 -4.94 118.70 117.81 3i4k s GLU 64 Ca 0.00 -1.02 0.01 0.00 0.02 0.00 0.00 54.97 53.97 3i4k s GLU 64 Cb 0.00 -2.17 -0.04 0.00 0.10 0.00 0.00 34.13 32.02 3i4k s GLU 64 CO 0.00 0.53 0.17 -1.54 0.02 0.00 0.00 175.26 174.43 3i4k s SER 65 N -1.59 0.48 0.47 -0.19 1.04 -1.26 -3.22 113.70 109.43 3i4k s SER 65 Ca 0.15 -1.47 0.13 0.00 0.48 0.00 0.00 55.95 55.24 3i4k s SER 65 Cb -0.11 0.42 1.09 0.00 0.10 0.00 0.00 66.02 67.52 3i4k s SER 65 CO 0.06 -0.89 2.10 -0.37 0.98 0.00 0.00 173.24 175.12 3i4k h VAL 66 N 2.51 1.03 -0.06 5.02 -1.51 -1.89 -2.26 116.25 119.08 3i4k h VAL 66 Ca -0.33 -0.09 -0.03 0.00 -1.23 0.00 0.00 66.70 65.02 3i4k h VAL 66 Cb 1.25 0.75 -0.00 0.00 -2.13 0.00 0.00 31.29 31.15 3i4k h VAL 66 CO 0.49 0.05 -0.07 -0.33 -1.23 0.00 0.00 177.57 176.48 3i4k h GLU 67 N 0.26 0.16 0.00 5.19 3.07 -1.98 -0.88 114.58 120.40 3i4k h GLU 67 Ca 0.09 -0.09 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3i4k h GLU 67 Cb 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 3i4k h GLU 67 CO -0.02 0.62 0.00 2.41 -1.40 0.00 0.00 179.01 180.62 3i4k n THR 68 N -4.71 0.00 0.00 1.13 -1.04 -0.85 -1.74 114.28 107.07 3i4k n THR 68 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 3i4k n THR 68 Cb 0.31 -0.22 0.00 0.00 -1.82 0.00 0.00 70.33 68.60 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 0.04 0.00 -0.09 -2.82 4.81 -0.34 -2.16 118.16 117.61 3i4k n LYS 70 Ca 0.00 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.37 3i4k n LYS 70 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 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 0.33 -0.25 3.14 0.00 -1.59 -0.62 119.26 120.26 3i4k h ALA 71 Ca 0.00 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 3i4k h ALA 71 Cb 0.00 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3i4k h ALA 71 CO 0.00 -0.34 -0.31 -0.07 0.00 0.00 0.00 179.25 178.53 3i4k h LEU 72 N 0.18 0.71 0.76 0.00 3.38 -1.71 -1.52 115.31 117.11 3i4k h LEU 72 Ca 0.15 -0.49 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 3i4k h LEU 72 Cb 0.15 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3i4k h LEU 72 CO -0.19 1.06 -0.48 0.58 0.09 0.00 0.00 178.44 179.51 3i4k h VAL 73 N 0.37 0.00 -0.74 1.22 2.07 -1.80 0.90 116.25 118.27 3i4k h VAL 73 Ca 0.03 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.51 3i4k h VAL 73 Cb 0.89 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 3i4k h VAL 73 CO 0.07 0.00 0.28 0.44 0.02 0.00 0.00 177.57 178.38 3i4k h ASP 74 N -1.16 1.04 1.01 0.57 3.32 -1.20 0.29 116.42 120.29 3i4k h ASP 74 Ca -0.10 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.77 3i4k h ASP 74 Cb 0.93 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.21 3i4k h ASP 74 CO 0.09 0.94 -0.97 1.23 -1.72 0.00 0.00 179.24 178.81 3i4k h GLY 75 N 1.07 0.00 0.00 2.75 0.00 -1.28 -3.42 103.07 102.20 3i4k h GLY 75 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.57 3i4k h GLY 75 CO -0.02 0.00 -0.30 -1.72 0.00 0.00 0.00 176.54 174.50 3i4k n TYR 76 N -2.66 0.00 -0.06 5.60 4.02 0.19 -4.89 117.16 119.35 3i4k n TYR 76 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.86 3i4k n TYR 76 Cb 0.55 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.84 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 0.00 -0.99 7.72 3.38 -1.13 -3.38 115.31 120.91 3i4k h LEU 77 Ca 0.00 -0.12 0.13 0.00 0.09 0.00 0.00 57.88 57.98 3i4k h LEU 77 Cb 0.30 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.91 3i4k h LEU 77 CO 0.00 0.66 -0.47 0.00 0.09 0.00 0.00 178.44 178.72 3i4k h ALA 78 N -0.88 -0.13 -0.33 1.53 0.00 -0.64 0.56 119.26 119.37 3i4k h ALA 78 Ca -0.01 0.21 0.09 0.00 0.00 0.00 0.00 54.91 55.20 3i4k h ALA 78 Cb 0.28 1.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 3i4k h ALA 78 CO -0.01 -0.76 0.37 -1.00 0.00 0.00 0.00 179.25 177.85 3i4k h PRO 79 N -0.01 0.00 -0.16 0.00 0.13 -1.78 -1.04 132.00 129.14 3i4k h PRO 79 Ca 0.27 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.28 3i4k h PRO 79 Cb 0.52 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 3i4k h PRO 79 CO -0.97 0.00 -0.41 0.28 -0.23 0.00 0.00 178.00 176.68 3i4k h VAL 80 N 0.00 1.31 -0.02 1.56 2.07 -1.05 -3.28 116.25 116.83 3i4k h VAL 80 Ca 0.16 -1.55 -0.03 0.00 0.82 0.00 0.00 66.70 66.10 3i4k h VAL 80 Cb 0.89 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 3i4k h VAL 80 CO -0.00 0.47 -0.10 -0.07 0.02 0.00 0.00 177.57 177.89 3i4k h LEU 81 N 0.31 0.12 -7.87 2.57 4.07 -1.23 -3.46 115.31 109.82 3i4k h LEU 81 Ca 0.03 -0.68 -0.75 0.00 0.08 0.00 0.00 57.88 56.56 3i4k h LEU 81 Cb 0.85 -0.04 0.02 0.00 1.08 0.00 0.00 40.66 42.57 3i4k h LEU 81 CO 0.07 0.78 0.49 -0.38 -1.08 0.00 0.00 178.44 178.32 3i4k n ILE 82 N -4.66 0.00 -0.25 1.22 5.41 -1.18 -1.10 119.36 118.80 3i4k n ILE 82 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.66 3i4k n ILE 82 Cb 0.39 -0.34 0.00 0.00 -0.71 0.00 0.00 39.64 38.98 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 3.03 0.82 3.69 7.39 0.00 0.60 -4.99 105.19 115.73 3i4k n GLY 83 Ca 0.25 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.63 2.51 0.16 1.61 0.52 -0.26 -4.80 118.95 118.06 3i4k s ARG 84 Ca 0.00 -0.97 -0.30 0.00 -0.52 0.00 0.00 55.73 53.93 3i4k s ARG 84 Cb 0.00 -2.46 -0.08 0.00 0.52 0.00 0.00 34.95 32.93 3i4k s ARG 84 CO 0.00 0.49 1.30 0.00 0.02 0.00 0.00 175.30 177.11 3i4k s ALA 85 N -1.56 3.51 -0.77 2.13 0.00 -1.26 -0.97 121.76 122.83 3i4k s ALA 85 Ca 0.27 1.05 0.10 0.00 0.00 0.00 0.00 51.96 53.39 3i4k s ALA 85 Cb -0.10 -3.48 0.50 0.00 0.00 0.00 0.00 23.12 20.03 3i4k s ALA 85 CO 0.19 -0.52 1.32 1.55 0.00 0.00 0.00 175.76 178.31 3i4k n VAL 86 N 3.13 1.44 1.86 0.00 3.14 -0.57 -0.71 118.33 126.61 3i4k n VAL 86 Ca 0.08 0.46 0.05 0.00 -2.96 0.00 0.00 64.34 61.97 3i4k n VAL 86 Cb 0.43 -1.40 0.25 0.00 -1.06 0.00 0.00 33.84 32.07 3i4k n VAL 86 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3i4k n SER 87 N -1.74 0.26 -1.36 6.55 3.41 -1.26 -2.38 113.62 117.10 3i4k n SER 87 Ca 0.01 -1.75 0.08 0.00 -0.26 0.00 0.00 58.87 56.94 3i4k n SER 87 Cb 0.07 -0.03 0.33 0.00 -0.26 0.00 0.00 64.21 64.32 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 -0.48 3.82 -0.34 4.33 1.02 0.11 -4.81 120.64 124.30 3i4k n GLU 88 Ca 0.07 -3.00 -0.09 0.00 -0.02 0.00 0.00 57.16 54.13 3i4k n GLU 88 Cb 0.07 -2.04 -0.08 0.00 -0.02 0.00 0.00 31.44 29.37 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 -0.01 -0.85 -0.16 -4.62 7.94 -1.00 -0.50 117.00 117.81 3i4k n LEU 89 Ca 0.25 1.48 -0.01 0.00 -1.11 0.00 0.00 56.01 56.62 3i4k n LEU 89 Cb 1.04 -0.21 0.23 0.00 0.53 0.00 0.00 43.42 45.01 3i4k n LEU 89 CO 0.23 -1.19 1.10 0.00 -1.11 0.00 0.00 177.39 176.43 3i4k h ALA 90 N 0.34 1.35 -0.23 1.96 0.00 -1.90 -2.57 119.26 118.22 3i4k h ALA 90 Ca 0.13 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 3i4k h ALA 90 Cb 0.33 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3i4k h ALA 90 CO -0.75 0.50 -0.42 0.78 0.00 0.00 0.00 179.25 179.37 3i4k h GLY 91 N 0.96 0.60 -1.87 0.00 0.00 -1.38 -2.74 103.07 98.65 3i4k h GLY 91 Ca 0.21 -0.61 0.00 0.00 0.00 0.00 0.00 47.33 46.94 3i4k h GLY 91 CO -0.03 0.55 0.00 1.39 0.00 0.00 0.00 176.54 178.45 3i4k n ILE 92 N -4.02 0.36 0.00 2.60 5.41 0.35 -2.05 119.36 122.00 3i4k n ILE 92 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.73 3i4k n ILE 92 Cb 0.52 -0.64 0.00 0.00 -0.71 0.00 0.00 39.64 38.82 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 0.73 0.00 0.23 -1.39 0.00 -1.03 -1.12 120.51 117.92 3i4k n ALA 94 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 3i4k n ALA 94 Cb 0.19 0.00 0.53 0.00 0.00 0.00 0.00 19.45 20.17 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 0.28 0.00 3.32 -1.71 -2.04 116.42 116.28 3i4k h ASP 95 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3i4k h ASP 95 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3i4k h ASP 95 CO 0.00 0.24 0.00 -0.07 -1.72 0.00 0.00 179.24 177.69 3i4k h LEU 96 N 0.00 0.00 -0.83 1.55 3.38 -1.41 -1.22 115.31 116.78 3i4k h LEU 96 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 3i4k h LEU 96 Cb 0.59 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3i4k h LEU 96 CO 0.03 0.00 -0.46 -0.33 0.09 0.00 0.00 178.44 177.77 3i4k h GLU 97 N 0.00 0.00 0.00 1.13 4.39 -1.55 -1.79 114.58 116.76 3i4k h GLU 97 Ca 0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 3i4k h GLU 97 Cb 0.14 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.79 3i4k h GLU 97 CO 0.00 0.46 -0.11 0.00 -1.16 0.00 0.00 179.01 178.20 3i4k h ARG 98 N 0.00 0.00 0.00 2.33 3.08 -1.35 -3.28 114.38 115.16 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 0.99 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.04 3i4k h ARG 98 CO 0.06 0.11 -0.73 1.33 -1.07 0.00 0.00 179.97 179.67 3i4k n VAL 99 N -3.30 0.00 -3.59 2.04 0.24 -1.15 -4.98 118.33 107.58 3i4k n VAL 99 Ca -0.00 -0.25 -0.15 0.00 -2.04 0.00 0.00 64.34 61.90 3i4k n VAL 99 Cb 0.33 0.69 -0.13 0.00 -1.47 0.00 0.00 33.84 33.26 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 -1.89 -0.38 0.35 3.34 1.01 -0.69 -5.01 120.40 117.14 3i4k s VAL 100 Ca -0.00 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.04 3i4k s VAL 100 Cb 0.03 -0.52 -0.06 0.00 0.00 0.00 0.00 36.38 35.83 3i4k s VAL 100 CO 0.19 0.01 0.68 0.00 0.00 0.00 0.00 175.10 175.98 3i4k s ALA 101 N 2.39 3.46 0.00 5.51 0.00 -1.26 -4.28 121.76 127.57 3i4k s ALA 101 Ca 0.04 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.66 3i4k s ALA 101 Cb -0.13 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.44 3i4k s ALA 101 CO -0.10 0.10 0.00 0.54 0.00 0.00 0.00 175.76 176.31 3i4k n ARG 102 N -1.12 0.00 -4.07 0.00 1.74 -1.26 -4.85 116.66 107.10 3i4k n ARG 102 Ca 0.01 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.76 3i4k n ARG 102 Cb 0.54 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.98 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 9.00 -1.30 -0.31 7.54 0.00 -1.26 -4.85 120.51 129.33 3i4k n ALA 103 Ca 0.00 0.08 0.07 0.00 0.00 0.00 0.00 53.44 53.58 3i4k n ALA 103 Cb 0.00 -3.88 0.27 0.00 0.00 0.00 0.00 19.45 15.84 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 -1.79 0.91 -0.91 0.00 2.47 -1.89 -1.77 114.38 111.42 3i4k h ARG 104 Ca -0.59 -0.05 0.04 0.00 -1.26 0.00 0.00 59.98 58.12 3i4k h ARG 104 Cb 1.38 -0.21 -0.05 0.00 -1.65 0.00 0.00 29.97 29.44 3i4k h ARG 104 CO 0.73 0.60 0.59 1.88 0.56 0.00 0.00 179.97 184.34 3i4k h TYR 105 N 0.94 1.09 -0.10 3.04 0.05 -1.77 0.30 116.97 120.52 3i4k h TYR 105 Ca 0.44 0.03 -0.18 0.00 0.05 0.00 0.00 58.73 59.07 3i4k h TYR 105 Cb 0.41 -0.37 0.01 0.00 1.01 0.00 0.00 36.73 37.79 3i4k h TYR 105 CO -0.00 0.63 -0.62 0.00 -1.05 0.00 0.00 178.16 177.12 3i4k h ALA 106 N 1.47 0.21 -0.33 3.88 0.00 -1.70 -3.19 119.26 119.60 3i4k h ALA 106 Ca 0.36 -0.55 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 3i4k h ALA 106 Cb 0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3i4k h ALA 106 CO -0.11 0.48 -0.00 0.87 0.00 0.00 0.00 179.25 180.49 3i4k h LYS 107 N 0.24 0.52 -0.81 0.00 1.57 -0.78 -2.92 116.57 114.37 3i4k h LYS 107 Ca -0.05 -0.11 0.07 0.00 -1.87 0.00 0.00 60.65 58.69 3i4k h LYS 107 Cb 1.27 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 33.44 3i4k h LYS 107 CO 0.13 0.55 0.49 0.00 -0.57 0.00 0.00 179.45 180.04 3i4k h ALA 108 N 1.51 1.12 -0.82 3.86 0.00 -0.41 -1.76 119.26 122.75 3i4k h ALA 108 Ca 0.11 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.05 3i4k h ALA 108 Cb 0.33 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 3i4k h ALA 108 CO 0.01 0.20 0.54 0.00 0.00 0.00 0.00 179.25 180.01 3i4k h ALA 109 N 1.40 1.50 -0.13 0.00 0.00 -1.57 -0.39 119.26 120.07 3i4k h ALA 109 Ca 0.36 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 3i4k h ALA 109 Cb 0.20 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3i4k h ALA 109 CO -0.18 0.42 -0.16 0.28 0.00 0.00 0.00 179.25 179.61 3i4k h VAL 110 N 1.02 1.36 -0.19 0.00 2.07 -1.42 -1.76 116.25 117.33 3i4k h VAL 110 Ca 0.33 -1.35 0.02 0.00 0.82 0.00 0.00 66.70 66.52 3i4k h VAL 110 Cb 0.03 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 3i4k h VAL 110 CO -0.10 0.39 0.04 -0.78 0.02 0.00 0.00 177.57 177.15 3i4k h ASP 111 N -0.06 0.02 -0.61 0.57 1.82 -1.08 -2.85 116.42 114.22 3i4k h ASP 111 Ca 0.02 0.03 -0.04 0.00 -0.39 0.00 0.00 57.03 56.64 3i4k h ASP 111 Cb 0.70 0.04 -0.03 0.00 0.68 0.00 0.00 39.33 40.72 3i4k h ASP 111 CO 0.04 0.04 0.24 0.58 -1.61 0.00 0.00 179.24 178.52 3i4k h VAL 112 N 0.12 1.23 0.00 2.25 2.07 -1.08 -2.16 116.25 118.68 3i4k h VAL 112 Ca 0.09 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.86 3i4k h VAL 112 Cb 0.08 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3i4k h VAL 112 CO -0.11 0.30 0.00 0.00 0.02 0.00 0.00 177.57 177.78 3i4k n ALA 113 N -2.45 2.02 0.00 1.67 0.00 -0.66 -1.91 120.51 119.18 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 0.19 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 0.70 0.00 -0.07 0.00 8.25 -0.81 -0.97 115.22 122.32 3i4k n HIS 115 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 3i4k n HIS 115 Cb 0.26 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.34 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 0.30 -0.55 0.41 3.58 -1.66 0.45 116.42 118.95 3i4k h ASP 116 Ca 0.00 -0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.39 3i4k h ASP 116 Cb 0.00 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 40.95 3i4k h ASP 116 CO 0.00 0.23 0.18 0.00 -2.88 0.00 0.00 179.24 176.76 3i4k h ALA 117 N 1.08 0.72 -0.14 -0.78 0.00 -1.30 -1.62 119.26 117.22 3i4k h ALA 117 Ca 0.09 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3i4k h ALA 117 Cb -0.02 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3i4k h ALA 117 CO -0.02 0.38 -0.07 2.35 0.00 0.00 0.00 179.25 181.89 3i4k h TRP 118 N 0.77 0.34 -0.47 0.00 7.01 -1.73 -2.62 115.95 119.25 3i4k h TRP 118 Ca 0.18 -0.08 0.01 0.00 2.11 0.00 0.00 58.89 61.11 3i4k h TRP 118 Cb 0.27 -0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.23 3i4k h TRP 118 CO 0.02 0.62 0.30 0.00 -2.79 0.00 0.00 178.44 176.59 3i4k h ALA 119 N 0.67 0.60 -0.49 2.65 0.00 -0.06 -2.29 119.26 120.33 3i4k h ALA 119 Ca 0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3i4k h ALA 119 Cb 0.53 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3i4k h ALA 119 CO 0.02 0.01 0.24 0.00 0.00 0.00 0.00 179.25 179.52 3i4k h ARG 120 N 0.60 0.69 -0.14 0.00 3.08 -1.30 -0.40 114.38 116.91 3i4k h ARG 120 Ca 0.18 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 3i4k h ARG 120 Cb -0.04 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 3i4k h ARG 120 CO -0.06 0.53 -0.14 0.77 -1.07 0.00 0.00 179.97 180.01 3i4k h SER 121 N 0.69 0.22 0.10 7.04 0.02 -1.03 -1.96 113.55 118.63 3i4k h SER 121 Ca 0.17 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3i4k h SER 121 Cb 0.07 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.55 3i4k h SER 121 CO -0.02 0.38 -0.24 0.18 -1.14 0.00 0.00 176.83 175.98 3i4k n LEU 122 N -4.27 1.58 -2.43 5.07 4.77 -0.73 -4.96 117.00 116.02 3i4k n LEU 122 Ca -0.01 -0.51 -0.18 0.00 -0.03 0.00 0.00 56.01 55.29 3i4k n LEU 122 Cb 0.27 -0.06 0.03 0.00 -2.33 0.00 0.00 43.42 41.34 3i4k n LEU 122 CO 0.38 0.28 0.01 -3.20 -1.33 0.00 0.00 177.39 173.53 3i4k n ASN 123 N -0.13 -5.17 -4.29 -1.43 5.15 -0.24 -5.02 115.26 104.13 3i4k n ASN 123 Ca 0.13 -0.24 -0.17 0.00 -0.60 0.00 0.00 54.58 53.71 3i4k n ASN 123 Cb 0.41 -4.00 -0.10 0.00 -0.53 0.00 0.00 39.78 35.55 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 -3.05 1.44 0.86 3.44 -7.23 -0.82 -4.80 120.40 110.24 3i4k s VAL 124 Ca 0.25 -2.05 -0.11 0.00 -1.81 0.00 0.00 61.98 58.26 3i4k s VAL 124 Cb -0.11 -1.86 0.11 0.00 0.56 0.00 0.00 36.38 35.08 3i4k s VAL 124 CO 0.31 -0.61 1.09 -2.84 -0.31 0.00 0.00 175.10 172.74 3i4k s PRO 125 N -3.47 1.52 0.34 4.82 0.02 -1.25 -2.42 135.00 134.56 3i4k s PRO 125 Ca 0.17 1.00 0.05 0.00 0.02 0.00 0.00 61.00 62.25 3i4k s PRO 125 Cb -0.00 -1.83 0.62 0.00 0.02 0.00 0.00 34.50 33.31 3i4k s PRO 125 CO 0.04 -2.11 1.86 0.28 -0.33 0.00 0.00 177.00 176.74 3i4k h VAL 126 N -1.46 1.20 0.00 3.83 2.07 -1.66 -2.53 116.25 117.70 3i4k h VAL 126 Ca -0.47 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 3i4k h VAL 126 Cb 1.27 1.08 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 3i4k h VAL 126 CO 0.52 0.28 -0.04 0.08 0.02 0.00 0.00 177.57 178.43 3i4k h ARG 127 N 0.42 0.00 0.00 1.57 0.11 -1.87 -0.31 114.38 114.30 3i4k h ARG 127 Ca 0.09 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.17 3i4k h ARG 127 Cb 0.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.47 3i4k h ARG 127 CO 0.02 0.04 0.00 -0.25 0.10 0.00 0.00 179.97 179.88 3i4k n ASP 128 N -3.84 0.00 -0.48 0.08 9.92 -0.95 -0.73 116.55 120.54 3i4k n ASP 128 Ca -0.03 0.39 0.10 0.00 -0.53 0.00 0.00 54.79 54.73 3i4k n ASP 128 Cb 0.13 -0.45 -0.00 0.00 -0.64 0.00 0.00 41.12 40.17 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 -1.45 1.98 -0.64 0.64 4.77 -0.13 -4.37 117.00 117.80 3i4k n LEU 129 Ca 0.04 -0.77 0.05 0.00 -0.03 0.00 0.00 56.01 55.31 3i4k n LEU 129 Cb 0.15 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.45 3i4k n LEU 129 CO 0.13 0.37 0.38 0.18 -1.33 0.00 0.00 177.39 177.12 3i4k n LEU 130 N -0.01 2.81 0.00 2.23 4.77 0.09 -4.95 117.00 121.94 3i4k n LEU 130 Ca 0.09 -3.91 0.00 0.00 -0.03 0.00 0.00 56.01 52.16 3i4k n LEU 130 Cb 0.45 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 3i4k n LEU 130 CO 0.27 1.40 0.00 0.61 -1.33 0.00 0.00 177.39 178.34 3i4k n GLY 131 N -1.12 2.34 0.00 -0.72 0.00 -1.19 -4.83 105.19 99.68 3i4k n GLY 131 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.18 -0.93 3.53 -0.02 0.00 -0.59 -4.99 105.19 101.01 3i4k n GLY 132 Ca 0.00 -2.07 -0.33 0.00 0.00 0.00 0.00 46.02 43.62 3i4k n GLY 132 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3i4k s THR 133 N 0.00 3.46 -0.04 2.61 -4.23 -1.26 -3.93 115.64 112.25 3i4k s THR 133 Ca 0.00 -0.56 0.08 0.00 -1.18 0.00 0.00 61.69 60.02 3i4k s THR 133 Cb 0.00 -2.40 -0.11 0.00 1.34 0.00 0.00 72.50 71.32 3i4k s THR 133 CO 0.00 0.59 0.11 0.52 -0.54 0.00 0.00 174.62 175.30 3i4k n VAL 134 N 2.38 0.23 -3.46 2.29 0.31 0.37 -4.96 118.33 115.49 3i4k n VAL 134 Ca -0.18 -0.25 -0.14 0.00 -0.01 0.00 0.00 64.34 63.76 3i4k n VAL 134 Cb 0.53 -0.18 -0.04 0.00 -0.91 0.00 0.00 33.84 33.24 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 -2.40 1.19 -0.10 5.55 1.70 -0.94 -5.04 118.95 118.90 3i4k s ARG 135 Ca -0.03 -0.18 0.14 0.00 -0.47 0.00 0.00 55.73 55.18 3i4k s ARG 135 Cb 0.04 0.55 0.27 0.00 -0.57 0.00 0.00 34.95 35.24 3i4k s ARG 135 CO 0.33 -0.47 1.17 -0.40 -1.08 0.00 0.00 175.30 174.86 3i4k n ASP 136 N 0.14 2.59 -3.57 -2.89 5.68 -1.26 -4.57 116.55 112.68 3i4k n ASP 136 Ca -0.18 -2.75 -0.12 0.00 -0.50 0.00 0.00 54.79 51.24 3i4k n ASP 136 Cb 0.62 -0.34 -0.05 0.00 -1.14 0.00 0.00 41.12 40.20 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 -2.31 0.69 0.07 0.11 -2.85 -1.26 -2.02 119.74 112.17 3i4k s LYS 137 Ca 0.26 0.21 0.01 0.00 -1.00 0.00 0.00 55.97 55.45 3i4k s LYS 137 Cb 0.22 0.32 -0.04 0.00 -2.06 0.00 0.00 37.83 36.28 3i4k s LYS 137 CO 0.04 -0.21 -0.06 0.14 0.10 0.00 0.00 175.35 175.37 3i4k s VAL 138 N -1.02 0.50 0.35 1.79 -7.23 -0.96 -4.96 120.40 108.87 3i4k s VAL 138 Ca -0.03 -1.60 -0.26 0.00 -1.81 0.00 0.00 61.98 58.28 3i4k s VAL 138 Cb -0.01 -1.25 -0.09 0.00 0.56 0.00 0.00 36.38 35.59 3i4k s VAL 138 CO 0.03 -0.75 1.03 -1.81 -0.31 0.00 0.00 175.10 173.29 3i4k s ASP 139 N -2.51 7.02 -0.10 4.85 1.01 -1.26 -1.81 116.67 123.87 3i4k s ASP 139 Ca 0.03 2.03 0.02 0.00 0.71 0.00 0.00 52.55 55.34 3i4k s ASP 139 Cb 0.01 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.35 3i4k s ASP 139 CO -0.04 -0.30 -0.17 -0.69 0.21 0.00 0.00 175.17 174.17 3i4k s VAL 140 N -1.54 1.60 -0.12 -1.27 1.01 -0.62 -0.97 120.40 118.48 3i4k s VAL 140 Ca 0.53 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.70 3i4k s VAL 140 Cb -0.23 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 3i4k s VAL 140 CO 0.29 0.46 0.16 0.42 0.00 0.00 0.00 175.10 176.43 3i4k s THR 141 N 0.73 5.47 -0.15 3.92 -4.23 0.13 -4.47 115.64 117.04 3i4k s THR 141 Ca -0.12 0.25 -0.12 0.00 -1.18 0.00 0.00 61.69 60.52 3i4k s THR 141 Cb -0.16 -3.43 -0.05 0.00 1.34 0.00 0.00 72.50 70.20 3i4k s THR 141 CO 0.02 0.59 0.25 0.86 -0.54 0.00 0.00 174.62 175.80 3i4k s TRP 142 N -0.82 3.50 -0.09 3.99 -0.11 -0.47 -4.47 118.94 120.47 3i4k s TRP 142 Ca 0.15 0.57 -0.03 0.00 1.22 0.00 0.00 56.10 58.01 3i4k s TRP 142 Cb -0.12 -2.25 -0.04 0.00 -1.50 0.00 0.00 33.47 29.57 3i4k s TRP 142 CO 0.04 0.36 0.04 0.00 -4.62 0.00 0.00 176.95 172.77 3i4k s ALA 143 N 0.09 3.46 -0.15 5.86 0.00 -1.26 0.01 121.76 129.77 3i4k s ALA 143 Ca 0.15 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.35 3i4k s ALA 143 Cb -0.13 -1.61 -0.00 0.00 0.00 0.00 0.00 23.12 21.38 3i4k s ALA 143 CO 0.04 0.60 -0.15 -0.51 0.00 0.00 0.00 175.76 175.74 3i4k s LEU 144 N -0.98 2.50 1.26 0.00 1.02 0.60 -4.91 118.68 118.17 3i4k s LEU 144 Ca 0.14 -0.45 -0.20 0.00 0.02 0.00 0.00 54.13 53.65 3i4k s LEU 144 Cb -0.12 -1.56 0.31 0.00 0.02 0.00 0.00 46.19 44.84 3i4k s LEU 144 CO 0.04 0.10 1.05 -0.83 0.02 0.00 0.00 176.35 176.73 3i4k s GLY 145 N 0.71 1.53 -0.19 -3.19 0.00 -1.26 -1.65 107.32 103.27 3i4k s GLY 145 Ca -0.07 -0.83 -0.33 0.00 0.00 0.00 0.00 44.72 43.49 3i4k s GLY 145 CO 0.02 0.07 2.05 1.55 0.00 0.00 0.00 173.10 176.79 3i4k n VAL 146 N -5.02 0.43 -3.93 1.40 3.14 -0.67 -4.59 118.33 109.09 3i4k n VAL 146 Ca 0.12 -0.24 -0.09 0.00 -2.96 0.00 0.00 64.34 61.17 3i4k n VAL 146 Cb 0.59 -2.00 -0.09 0.00 -1.06 0.00 0.00 33.84 31.28 3i4k n VAL 146 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 3i4k s LEU 147 N 6.01 1.82 0.67 6.55 1.43 -1.26 -4.63 118.68 129.27 3i4k s LEU 147 Ca 0.99 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 53.38 3i4k s LEU 147 Cb -0.64 0.59 0.00 0.00 0.03 0.00 0.00 46.19 46.17 3i4k s LEU 147 CO 0.47 -0.50 1.29 -2.84 0.23 0.00 0.00 176.35 174.99 3i4k s PRO 148 N -2.59 2.43 0.50 1.29 0.02 -1.26 -4.66 135.00 130.73 3i4k s PRO 148 Ca -0.05 2.03 0.30 0.00 0.02 0.00 0.00 61.00 63.31 3i4k s PRO 148 Cb -0.01 -1.83 1.41 0.00 0.02 0.00 0.00 34.50 34.08 3i4k s PRO 148 CO -0.04 -1.69 1.82 1.25 -0.33 0.00 0.00 177.00 178.01 3i4k h LEU 149 N 0.36 0.13 0.07 -5.54 5.85 -2.00 0.64 115.31 114.82 3i4k h LEU 149 Ca -0.50 0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.05 3i4k h LEU 149 Cb 1.33 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.36 3i4k h LEU 149 CO 0.52 0.03 -0.96 0.44 -0.34 0.00 0.00 178.44 178.13 3i4k h ASP 150 N 0.11 0.23 -0.26 1.25 5.19 -1.99 -3.14 116.42 117.81 3i4k h ASP 150 Ca 0.54 -0.83 0.03 0.00 -0.62 0.00 0.00 57.03 56.15 3i4k h ASP 150 Cb 1.91 -0.07 -0.03 0.00 0.18 0.00 0.00 39.33 41.32 3i4k h ASP 150 CO -0.09 1.41 0.06 0.58 -3.12 0.00 0.00 179.24 178.09 3i4k h VAL 151 N -0.62 0.90 0.69 -1.35 2.07 -1.72 -2.21 116.25 114.01 3i4k h VAL 151 Ca -0.22 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 3i4k h VAL 151 Cb 1.47 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 3i4k h VAL 151 CO 0.00 0.03 -0.50 0.00 0.02 0.00 0.00 177.57 177.12 3i4k h ALA 152 N 1.18 -1.23 -0.98 1.67 0.00 -1.06 -1.60 119.26 117.24 3i4k h ALA 152 Ca 0.12 -0.23 0.20 0.00 0.00 0.00 0.00 54.91 54.99 3i4k h ALA 152 Cb 0.11 0.66 -0.09 0.00 0.00 0.00 0.00 17.79 18.47 3i4k h ALA 152 CO -0.14 -1.22 0.61 0.28 0.00 0.00 0.00 179.25 178.78 3i4k h VAL 153 N -1.14 0.69 0.04 0.00 2.07 -1.51 0.51 116.25 116.91 3i4k h VAL 153 Ca -0.09 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 3i4k h VAL 153 Cb 0.94 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 3i4k h VAL 153 CO 0.04 0.12 -0.02 0.00 0.02 0.00 0.00 177.57 177.73 3i4k h ALA 154 N 1.63 -0.06 -0.24 1.67 0.00 -1.05 -0.66 119.26 120.55 3i4k h ALA 154 Ca 0.54 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.46 3i4k h ALA 154 Cb 1.02 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 3i4k h ALA 154 CO -0.30 -0.52 0.04 1.49 0.00 0.00 0.00 179.25 179.96 3i4k h GLU 155 N -0.08 0.13 -0.14 0.00 4.81 0.02 -1.28 114.58 118.03 3i4k h GLU 155 Ca -0.01 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 3i4k h GLU 155 Cb 0.07 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 3i4k h GLU 155 CO 0.01 0.08 -0.01 0.82 -0.73 0.00 0.00 179.01 179.18 3i4k h ILE 156 N 0.13 0.89 -0.88 2.32 2.04 -0.95 0.94 117.51 122.01 3i4k h ILE 156 Ca 0.11 -0.01 0.09 0.00 1.00 0.00 0.00 64.86 66.05 3i4k h ILE 156 Cb 0.11 0.85 -0.06 0.00 -0.74 0.00 0.00 36.82 36.99 3i4k h ILE 156 CO -0.15 0.01 0.57 -0.33 0.00 0.00 0.00 178.15 178.24 3i4k h GLU 157 N 0.03 0.85 -0.05 2.37 4.39 -0.82 -2.34 114.58 119.01 3i4k h GLU 157 Ca 0.07 -0.05 -0.08 0.00 0.34 0.00 0.00 59.36 59.63 3i4k h GLU 157 Cb 0.09 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.55 3i4k h GLU 157 CO -0.12 0.56 -0.28 1.49 -1.16 0.00 0.00 179.01 179.50 3i4k h GLU 158 N 0.87 0.28 -0.53 2.33 4.81 -0.59 -3.16 114.58 118.60 3i4k h GLU 158 Ca 0.40 -0.23 0.03 0.00 -0.13 0.00 0.00 59.36 59.43 3i4k h GLU 158 Cb 0.40 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 3i4k h GLU 158 CO -0.17 0.89 0.35 0.00 -0.73 0.00 0.00 179.01 179.35 3i4k h ARG 159 N -0.25 0.60 0.11 1.92 2.47 -0.59 -1.20 114.38 117.43 3i4k h ARG 159 Ca -0.02 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.66 3i4k h ARG 159 Cb 0.95 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 29.13 3i4k h ARG 159 CO 0.06 0.40 -0.05 0.82 0.56 0.00 0.00 179.97 181.75 3i4k h ILE 160 N 0.62 1.00 -0.22 2.04 2.04 -1.48 0.29 117.51 121.80 3i4k h ILE 160 Ca 0.21 -0.40 -0.10 0.00 1.00 0.00 0.00 64.86 65.58 3i4k h ILE 160 Cb 0.08 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 3i4k h ILE 160 CO -0.05 0.10 -0.27 -0.08 0.00 0.00 0.00 178.15 177.84 3i4k h GLU 161 N -0.32 0.43 0.06 2.37 4.22 -1.43 -1.34 114.58 118.57 3i4k h GLU 161 Ca -0.01 -0.16 -0.34 0.00 0.08 0.00 0.00 59.36 58.92 3i4k h GLU 161 Cb 0.27 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 3i4k h GLU 161 CO 0.02 0.67 -1.91 -1.91 -2.18 0.00 0.00 179.01 173.70 3i4k n GLU 162 N -4.11 0.67 -0.00 1.92 2.13 -0.49 -4.68 120.64 116.08 3i4k n GLU 162 Ca -0.01 0.34 0.05 0.00 0.66 0.00 0.00 57.16 58.20 3i4k n GLU 162 Cb 0.41 -1.67 -0.07 0.00 0.27 0.00 0.00 31.44 30.38 3i4k n GLU 162 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 3i4k n PHE 163 N -3.82 0.00 -2.02 4.31 3.72 0.86 -4.86 117.46 115.65 3i4k n PHE 163 Ca -0.37 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 56.95 3i4k n PHE 163 Cb 0.91 -0.15 -0.01 0.00 -0.94 0.00 0.00 39.48 39.30 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 1.66 0.17 3.77 1.37 0.00 -0.28 0.90 105.19 112.79 3i4k n GLY 164 Ca -0.00 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.67 6.43 -0.02 1.61 -0.87 -1.25 -1.39 114.94 116.80 3i4k s ASN 165 Ca 0.00 2.95 0.21 0.00 -1.57 0.00 0.00 52.86 54.45 3i4k s ASN 165 Cb 0.00 -2.66 -0.28 0.00 -0.02 0.00 0.00 41.25 38.30 3i4k s ASN 165 CO 0.00 -0.82 0.65 0.54 -2.57 0.00 0.00 177.10 174.90 3i4k n ARG 166 N 1.00 0.46 -4.25 -0.60 5.12 -1.26 -4.70 116.66 112.43 3i4k n ARG 166 Ca 0.03 -0.10 -0.18 0.00 -1.93 0.00 0.00 57.85 55.67 3i4k n ARG 166 Cb 0.39 -1.48 -0.13 0.00 -1.16 0.00 0.00 32.46 30.08 3i4k n ARG 166 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 3i4k s SER 167 N -3.72 1.30 -0.00 0.55 1.04 -1.26 -2.07 113.70 109.54 3i4k s SER 167 Ca -0.00 -0.43 0.04 0.00 0.48 0.00 0.00 55.95 56.03 3i4k s SER 167 Cb 0.14 -0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.19 3i4k s SER 167 CO 0.86 -0.02 -0.11 -0.36 0.98 0.00 0.00 173.24 174.58 3i4k s PHE 168 N -0.88 1.00 -0.26 5.02 0.08 -0.07 -1.36 117.98 121.51 3i4k s PHE 168 Ca -0.01 -0.22 -0.02 0.00 0.12 0.00 0.00 56.93 56.80 3i4k s PHE 168 Cb -0.07 -0.64 0.03 0.00 -0.57 0.00 0.00 43.02 41.77 3i4k s PHE 168 CO 0.01 -0.01 -0.03 0.21 -0.10 0.00 0.00 175.22 175.29 3i4k s LYS 169 N -0.42 2.76 -0.32 0.44 2.20 0.10 -0.86 119.74 123.64 3i4k s LYS 169 Ca 0.03 -1.04 -0.16 0.00 -0.36 0.00 0.00 55.97 54.45 3i4k s LYS 169 Cb -0.05 -3.06 -0.02 0.00 -1.51 0.00 0.00 37.83 33.19 3i4k s LYS 169 CO -0.00 -0.46 0.40 -0.51 -0.36 0.00 0.00 175.35 174.42 3i4k s LEU 170 N 1.32 4.29 0.79 5.43 1.43 0.22 -0.29 118.68 131.86 3i4k s LEU 170 Ca -0.01 -0.01 -0.11 0.00 -1.03 0.00 0.00 54.13 52.96 3i4k s LEU 170 Cb -0.17 -2.43 0.07 0.00 0.03 0.00 0.00 46.19 43.68 3i4k s LEU 170 CO -0.03 -0.32 1.09 -0.54 0.23 0.00 0.00 176.35 176.78 3i4k s LYS 171 N 2.13 2.14 0.00 1.70 1.02 -0.66 -2.13 119.74 123.94 3i4k s LYS 171 Ca 0.14 0.68 0.00 0.00 0.02 0.00 0.00 55.97 56.82 3i4k s LYS 171 Cb -0.16 -1.92 0.00 0.00 -0.52 0.00 0.00 37.83 35.23 3i4k s LYS 171 CO 0.11 -1.59 0.00 0.41 -0.92 0.00 0.00 175.35 173.36 3i4k n GLY 173 N -2.05 0.33 3.65 -3.33 0.00 -1.26 -4.17 105.19 98.36 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 -2.09 3.56 0.00 4.61 0.00 -1.25 -4.68 121.76 121.91 3i4k s ALA 174 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.40 3i4k s ALA 174 Cb 0.00 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.40 3i4k s ALA 174 CO 0.00 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 175.72 3i4k n GLY 175 N 4.10 -0.74 3.66 0.00 0.00 -1.26 -4.81 105.19 106.14 3i4k n GLY 175 Ca -0.07 -1.15 -0.48 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.01 2.86 0.01 1.61 2.03 -1.26 -4.88 116.55 115.90 3i4k n ASP 176 Ca 0.00 1.07 -0.12 0.00 0.52 0.00 0.00 54.79 56.26 3i4k n ASP 176 Cb 0.00 -1.35 -0.06 0.00 -0.72 0.00 0.00 41.12 38.98 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 6.45 0.07 -0.59 -0.67 0.11 -1.96 0.21 132.00 135.62 3i4k h PRO 177 Ca -0.46 -0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.71 3i4k h PRO 177 Cb 1.28 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 32.31 3i4k h PRO 177 CO 0.88 0.08 0.28 0.00 -0.21 0.00 0.00 178.00 179.03 3i4k h ALA 178 N 0.99 0.77 -0.27 -0.75 0.00 -1.98 0.80 119.26 118.82 3i4k h ALA 178 Ca 0.02 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.79 3i4k h ALA 178 Cb 0.02 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 3i4k h ALA 178 CO -0.00 -0.09 -0.54 0.93 0.00 0.00 0.00 179.25 179.54 3i4k h GLU 179 N 0.52 0.81 -0.45 0.00 5.08 -1.92 -1.00 114.58 117.61 3i4k h GLU 179 Ca 0.28 -0.51 -0.06 0.00 -1.00 0.00 0.00 59.36 58.07 3i4k h GLU 179 Cb 0.25 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3i4k h GLU 179 CO -0.22 1.14 0.05 0.22 -1.00 0.00 0.00 179.01 179.19 3i4k h ASP 180 N 0.62 0.67 -0.24 1.42 3.58 0.35 -1.03 116.42 121.79 3i4k h ASP 180 Ca 0.01 -0.13 -0.19 0.00 0.42 0.00 0.00 57.03 57.14 3i4k h ASP 180 Cb 1.14 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 42.01 3i4k h ASP 180 CO 0.12 0.71 -0.59 0.74 -2.88 0.00 0.00 179.24 177.33 3i4k h THR 181 N 0.68 1.28 -0.78 2.25 2.02 0.77 -2.99 112.91 116.13 3i4k h THR 181 Ca 0.14 -1.78 -0.05 0.00 0.77 0.00 0.00 66.41 65.49 3i4k h THR 181 Cb 0.35 1.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.43 3i4k h THR 181 CO 0.01 0.58 0.30 -0.09 0.37 0.00 0.00 175.52 176.68 3i4k h ARG 182 N 0.63 1.18 0.52 6.66 2.43 -0.79 0.31 114.38 125.32 3i4k h ARG 182 Ca 0.00 -0.22 -0.02 0.00 -0.81 0.00 0.00 59.98 58.93 3i4k h ARG 182 Cb 1.20 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.56 3i4k h ARG 182 CO 0.13 0.97 -0.40 -0.09 -1.51 0.00 0.00 179.97 179.07 3i4k h ARG 183 N 1.15 -0.85 -0.74 0.20 2.43 -1.15 -0.02 114.38 115.40 3i4k h ARG 183 Ca 0.26 0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.51 3i4k h ARG 183 Cb 0.24 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 3i4k h ARG 183 CO -0.02 -0.56 0.47 0.28 -1.51 0.00 0.00 179.97 178.63 3i4k h VAL 184 N -0.88 1.13 -0.18 0.20 2.07 -1.46 -0.78 116.25 116.34 3i4k h VAL 184 Ca -0.07 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.15 3i4k h VAL 184 Cb 0.73 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 3i4k h VAL 184 CO 0.02 0.17 0.07 0.00 0.02 0.00 0.00 177.57 177.85 3i4k h ALA 185 N 1.30 0.21 -0.65 1.67 0.00 -0.81 0.47 119.26 121.44 3i4k h ALA 185 Ca 0.29 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 3i4k h ALA 185 Cb -0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3i4k h ALA 185 CO -0.10 -0.36 0.12 0.93 0.00 0.00 0.00 179.25 179.85 3i4k h GLU 186 N 0.16 1.06 -0.28 0.00 5.08 -0.73 -2.25 114.58 117.63 3i4k h GLU 186 Ca 0.08 -0.28 -0.06 0.00 -1.00 0.00 0.00 59.36 58.10 3i4k h GLU 186 Cb 0.04 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3i4k h GLU 186 CO -0.07 0.97 -0.08 1.25 -1.00 0.00 0.00 179.01 180.08 3i4k h LEU 187 N 0.98 0.43 -1.12 1.33 6.46 -0.71 -2.36 115.31 120.32 3i4k h LEU 187 Ca 0.20 -0.10 0.03 0.00 -0.12 0.00 0.00 57.88 57.89 3i4k h LEU 187 Cb 0.41 -0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 40.18 3i4k h LEU 187 CO 0.01 0.56 0.60 0.00 -0.62 0.00 0.00 178.44 178.99 3i4k h ALA 188 N 1.49 1.40 -0.05 1.25 0.00 0.53 -2.13 119.26 121.75 3i4k h ALA 188 Ca 0.09 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 3i4k h ALA 188 Cb 0.41 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 17.87 3i4k h ALA 188 CO 0.02 0.52 -0.47 0.00 0.00 0.00 0.00 179.25 179.32 3i4k h ARG 189 N 1.17 0.41 -0.84 0.00 3.08 -1.17 0.78 114.38 117.81 3i4k h ARG 189 Ca 0.35 -0.37 0.10 0.00 0.07 0.00 0.00 59.98 60.13 3i4k h ARG 189 Cb -0.03 0.09 -0.06 0.00 0.08 0.00 0.00 29.97 30.05 3i4k h ARG 189 CO -0.10 1.03 0.54 0.93 -1.07 0.00 0.00 179.97 181.30 3i4k h GLU 190 N -0.08 0.78 0.00 0.04 5.08 -1.22 -3.39 114.58 115.79 3i4k h GLU 190 Ca -0.05 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3i4k h GLU 190 Cb 1.15 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.23 3i4k h GLU 190 CO 0.10 0.52 0.00 0.28 -1.00 0.00 0.00 179.01 178.90 3i4k n VAL 191 N -4.51 0.00 0.00 3.13 0.31 -0.82 -4.93 118.33 111.50 3i4k n VAL 191 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 3i4k n VAL 191 Cb 0.31 -0.55 0.00 0.00 -0.91 0.00 0.00 33.84 32.69 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 3.42 0.04 0.45 2.92 0.00 0.27 -3.02 105.19 109.26 3i4k n GLY 192 Ca 0.00 0.00 0.38 0.00 0.00 0.00 0.00 46.02 46.40 3i4k n GLY 192 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3i4k n ASP 193 N 0.07 0.18 0.01 1.61 8.00 -1.26 -1.29 116.55 123.87 3i4k n ASP 193 Ca 0.00 1.25 -0.12 0.00 0.71 0.00 0.00 54.79 56.63 3i4k n ASP 193 Cb 0.00 -0.62 -0.14 0.00 -0.02 0.00 0.00 41.12 40.35 3i4k n ASP 193 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3i4k h ARG 194 N 0.00 0.10 -5.04 -1.24 3.08 -1.93 -3.48 114.38 105.86 3i4k h ARG 194 Ca 0.82 -0.16 -0.35 0.00 0.07 0.00 0.00 59.98 60.35 3i4k h ARG 194 Cb 2.69 0.06 -0.14 0.00 0.08 0.00 0.00 29.97 32.65 3i4k h ARG 194 CO -0.40 0.81 -0.68 0.14 -1.07 0.00 0.00 179.97 178.77 3i4k s VAL 195 N -2.61 1.03 -0.27 2.04 -7.23 -0.41 -5.04 120.40 107.90 3i4k s VAL 195 Ca -0.07 -2.04 -0.28 0.00 -1.81 0.00 0.00 61.98 57.78 3i4k s VAL 195 Cb 0.08 -2.15 0.01 0.00 0.56 0.00 0.00 36.38 34.88 3i4k s VAL 195 CO 0.82 -0.48 1.03 -0.55 -0.31 0.00 0.00 175.10 175.61 3i4k s SER 196 N -3.24 6.99 -0.15 4.85 0.15 -0.88 -4.55 113.70 116.87 3i4k s SER 196 Ca 0.24 1.19 -0.06 0.00 0.70 0.00 0.00 55.95 58.02 3i4k s SER 196 Cb 0.05 -2.53 -0.04 0.00 -1.71 0.00 0.00 66.02 61.79 3i4k s SER 196 CO 0.05 -0.75 0.05 -0.76 1.20 0.00 0.00 173.24 173.04 3i4k s LEU 197 N 3.35 3.80 0.24 3.45 1.43 -1.26 -0.89 118.68 128.80 3i4k s LEU 197 Ca 0.43 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.70 3i4k s LEU 197 Cb -0.14 -1.94 -0.05 0.00 0.03 0.00 0.00 46.19 44.09 3i4k s LEU 197 CO 0.10 0.24 -0.03 -0.13 0.23 0.00 0.00 176.35 176.77 3i4k s ARG 198 N -0.04 1.37 0.17 1.70 3.00 -0.04 -1.35 118.95 123.76 3i4k s ARG 198 Ca 0.06 -1.68 0.03 0.00 0.00 0.00 0.00 55.73 54.13 3i4k s ARG 198 Cb -0.12 -0.76 -0.05 0.00 0.00 0.00 0.00 34.95 34.03 3i4k s ARG 198 CO 0.01 -0.05 -0.04 0.96 0.00 0.00 0.00 175.30 176.18 3i4k s ILE 199 N -3.31 0.92 -0.17 1.52 -5.25 -0.62 -0.61 121.20 113.67 3i4k s ILE 199 Ca 0.28 -2.01 -0.06 0.00 -0.99 0.00 0.00 60.65 57.86 3i4k s ILE 199 Cb 0.05 -2.02 0.08 0.00 2.95 0.00 0.00 42.46 43.51 3i4k s ILE 199 CO 0.09 -0.58 0.37 -0.62 -1.79 0.00 0.00 174.94 172.41 3i4k s ASP 200 N -3.18 -0.11 0.00 4.36 -1.08 -0.91 -1.15 116.67 114.60 3i4k s ASP 200 Ca 0.21 0.86 0.13 0.00 -0.52 0.00 0.00 52.55 53.22 3i4k s ASP 200 Cb 0.05 1.08 0.33 0.00 -1.46 0.00 0.00 42.92 42.92 3i4k s ASP 200 CO 0.03 -0.23 1.25 -0.38 0.52 0.00 0.00 175.17 176.36 3i4k n ILE 201 N 5.23 0.88 -4.23 4.11 5.41 -1.19 -4.37 119.36 125.20 3i4k n ILE 201 Ca -0.10 -0.94 -0.34 0.00 1.00 0.00 0.00 62.75 62.37 3i4k n ILE 201 Cb 0.50 0.59 -0.04 0.00 -0.71 0.00 0.00 39.64 39.98 3i4k n ILE 201 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3i4k n ASN 202 N 0.70 -1.84 -2.36 4.38 3.02 -1.10 -1.10 115.26 116.96 3i4k n ASN 202 Ca 0.13 -1.09 -0.18 0.00 -0.03 0.00 0.00 54.58 53.42 3i4k n ASN 202 Cb 0.44 -2.47 -0.01 0.00 -0.61 0.00 0.00 39.78 37.13 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 -4.36 -0.66 0.84 5.41 0.00 0.14 -4.88 120.51 117.00 3i4k n ALA 203 Ca -0.06 0.15 0.12 0.00 0.00 0.00 0.00 53.44 53.66 3i4k n ALA 203 Cb 0.55 -1.93 0.23 0.00 0.00 0.00 0.00 19.45 18.30 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 -2.89 2.24 -4.14 0.00 5.12 -0.26 -3.92 116.66 112.81 3i4k n ARG 204 Ca -0.21 -1.84 -0.34 0.00 -1.93 0.00 0.00 57.85 53.53 3i4k n ARG 204 Cb 0.66 -1.47 -0.08 0.00 -1.16 0.00 0.00 32.46 30.41 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 -1.79 3.31 0.73 -1.55 0.52 -0.93 -5.03 118.94 114.20 3i4k s TRP 205 Ca 0.34 0.26 -0.10 0.00 0.02 0.00 0.00 56.10 56.62 3i4k s TRP 205 Cb 0.21 -1.79 0.05 0.00 -1.15 0.00 0.00 33.47 30.79 3i4k s TRP 205 CO 0.31 0.56 1.09 0.16 0.02 0.00 0.00 176.95 179.09 3i4k s ASP 206 N -1.36 4.94 0.19 2.95 1.47 -1.26 -4.17 116.67 119.43 3i4k s ASP 206 Ca 0.19 0.79 -0.13 0.00 1.18 0.00 0.00 52.55 54.58 3i4k s ASP 206 Cb -0.12 -1.46 0.21 0.00 -0.34 0.00 0.00 42.92 41.22 3i4k s ASP 206 CO 0.09 -1.60 1.67 -0.09 0.68 0.00 0.00 175.17 175.92 3i4k h ARG 207 N -0.75 0.08 -0.51 2.11 2.43 -1.99 -2.35 114.38 113.40 3i4k h ARG 207 Ca -0.45 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 58.71 3i4k h ARG 207 Cb 1.30 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.80 3i4k h ARG 207 CO 0.64 0.06 0.32 -0.09 -1.51 0.00 0.00 179.97 179.38 3i4k h ARG 208 N 0.09 0.69 -0.26 0.20 2.43 -1.99 -1.53 114.38 114.00 3i4k h ARG 208 Ca 0.27 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 3i4k h ARG 208 Cb 0.42 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 3i4k h ARG 208 CO -0.47 0.49 0.14 1.15 -1.51 0.00 0.00 179.97 179.76 3i4k h THR 209 N 0.69 1.13 -0.55 0.20 2.02 -1.85 -1.43 112.91 113.11 3i4k h THR 209 Ca 0.19 -0.35 -0.03 0.00 0.77 0.00 0.00 66.41 66.99 3i4k h THR 209 Cb -0.03 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 3i4k h THR 209 CO -0.04 0.13 0.24 0.00 0.37 0.00 0.00 175.52 176.22 3i4k h ALA 210 N 1.01 0.71 0.00 6.16 0.00 -1.31 -1.17 119.26 124.67 3i4k h ALA 210 Ca 0.09 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3i4k h ALA 210 Cb 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3i4k h ALA 210 CO -0.01 0.30 -0.17 -0.07 0.00 0.00 0.00 179.25 179.30 3i4k h LEU 211 N 0.75 0.00 0.10 0.00 3.38 -1.11 -1.09 115.31 117.34 3i4k h LEU 211 Ca 0.19 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.99 3i4k h LEU 211 Cb 0.16 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.92 3i4k h LEU 211 CO -0.02 0.17 -0.79 -0.74 0.09 0.00 0.00 178.44 177.15 3i4k h HIS 212 N 0.00 0.40 0.04 1.13 2.76 -0.74 -3.42 115.15 115.32 3i4k h HIS 212 Ca -0.00 -0.29 -0.34 0.00 -2.20 0.00 0.00 60.37 57.54 3i4k h HIS 212 Cb 0.39 -0.02 -0.05 0.00 1.55 0.00 0.00 27.41 29.29 3i4k h HIS 212 CO 0.00 1.30 -2.01 0.66 -1.30 0.00 0.00 177.93 176.59 3i4k n TYR 213 N -4.19 0.78 -0.27 5.26 4.01 -0.49 -4.37 117.16 117.89 3i4k n TYR 213 Ca -0.16 0.23 0.23 0.00 -0.16 0.00 0.00 57.90 58.04 3i4k n TYR 213 Cb 0.77 -1.12 0.57 0.00 -0.31 0.00 0.00 39.34 39.24 3i4k n TYR 213 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3i4k h LEU 214 N 0.02 0.31 -1.66 7.72 3.38 -1.41 0.87 115.31 124.55 3i4k h LEU 214 Ca -0.41 0.05 0.07 0.00 0.09 0.00 0.00 57.88 57.68 3i4k h LEU 214 Cb 2.05 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 42.76 3i4k h LEU 214 CO 0.05 0.09 0.34 -0.65 0.09 0.00 0.00 178.44 178.37 3i4k h PRO 215 N 0.30 0.40 -0.53 1.13 0.11 -1.79 0.69 132.00 132.30 3i4k h PRO 215 Ca 0.51 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.56 3i4k h PRO 215 Cb 1.48 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.48 3i4k h PRO 215 CO -0.17 0.26 0.16 0.82 -0.21 0.00 0.00 178.00 178.86 3i4k h ILE 216 N 0.41 1.23 -0.63 4.15 2.04 -1.09 -0.14 117.51 123.49 3i4k h ILE 216 Ca 0.22 -0.79 -0.08 0.00 1.00 0.00 0.00 64.86 65.21 3i4k h ILE 216 Cb 0.36 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 3i4k h ILE 216 CO -0.06 0.29 0.06 -0.07 0.00 0.00 0.00 178.15 178.38 3i4k h LEU 217 N 0.74 1.03 -0.17 1.44 3.38 -1.17 0.06 115.31 120.62 3i4k h LEU 217 Ca 0.17 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.90 3i4k h LEU 217 Cb 0.28 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 3i4k h LEU 217 CO -0.00 1.06 -0.08 0.00 0.09 0.00 0.00 178.44 179.50 3i4k h ALA 218 N 1.02 0.07 -0.12 1.53 0.00 -0.40 -0.56 119.26 120.80 3i4k h ALA 218 Ca 0.19 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 3i4k h ALA 218 Cb 0.49 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3i4k h ALA 218 CO 0.02 -0.51 -0.08 1.49 0.00 0.00 0.00 179.25 180.17 3i4k h GLU 219 N -0.05 0.18 0.00 0.00 4.81 -0.69 -2.09 114.58 116.74 3i4k h GLU 219 Ca 0.09 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3i4k h GLU 219 Cb 0.19 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.54 3i4k h GLU 219 CO -0.21 0.28 0.00 0.00 -0.73 0.00 0.00 179.01 178.35 3i4k n ALA 220 N -2.50 2.24 0.00 2.92 0.00 -0.02 -4.92 120.51 118.23 3i4k n ALA 220 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.33 3i4k n ALA 220 Cb 0.22 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.23 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 1.22 0.85 3.70 0.00 0.00 -0.45 -4.37 105.19 106.13 3i4k n GLY 221 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 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 3.01 -1.13 1.61 1.01 -0.75 -4.68 120.40 117.47 3i4k s VAL 222 Ca 0.00 0.56 0.23 0.00 0.00 0.00 0.00 61.98 62.78 3i4k s VAL 222 Cb 0.00 -3.36 -0.07 0.00 0.00 0.00 0.00 36.38 32.95 3i4k s VAL 222 CO 0.00 0.01 1.20 -0.62 0.00 0.00 0.00 175.10 175.69 3i4k n GLU 223 N 5.07 0.15 -3.69 2.72 1.02 -0.45 -4.59 120.64 120.86 3i4k n GLU 223 Ca 0.15 -0.11 -0.10 0.00 -0.02 0.00 0.00 57.16 57.07 3i4k n GLU 223 Cb 0.40 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.22 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 -2.92 -0.13 -0.44 -4.62 2.96 -1.25 -4.01 118.68 108.27 3i4k s LEU 224 Ca 0.11 0.87 -0.07 0.00 -0.22 0.00 0.00 54.13 54.82 3i4k s LEU 224 Cb 0.17 1.28 0.11 0.00 0.50 0.00 0.00 46.19 48.25 3i4k s LEU 224 CO 0.74 -0.20 0.29 -0.36 -1.32 0.00 0.00 176.35 175.51 3i4k s PHE 225 N 1.57 3.46 0.02 5.38 0.08 -0.22 -1.59 117.98 126.68 3i4k s PHE 225 Ca -0.08 -1.98 -0.26 0.00 0.12 0.00 0.00 56.93 54.73 3i4k s PHE 225 Cb -0.09 -3.33 -0.05 0.00 -0.57 0.00 0.00 43.02 38.98 3i4k s PHE 225 CO -0.12 -0.97 0.80 -2.00 -0.10 0.00 0.00 175.22 172.83 3i4k s GLU 226 N 1.31 4.51 0.00 0.44 2.12 -0.30 -4.29 118.70 122.48 3i4k s GLU 226 Ca 0.06 1.11 0.00 0.00 0.36 0.00 0.00 54.97 56.50 3i4k s GLU 226 Cb -0.25 -3.40 0.00 0.00 0.26 0.00 0.00 34.13 30.74 3i4k s GLU 226 CO -0.01 0.17 0.00 0.94 -0.54 0.00 0.00 175.26 175.82 3i4k n GLN 227 N 3.21 -0.01 0.21 4.30 -0.06 -1.26 -3.19 117.38 120.59 3i4k n GLN 227 Ca -0.00 -0.00 0.11 0.00 -2.00 0.00 0.00 57.00 55.10 3i4k n GLN 227 Cb 0.50 0.01 0.22 0.00 -4.06 0.00 0.00 30.24 26.91 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 0.93 0.00 -5.22 3.69 0.13 -1.91 0.40 132.00 130.03 3i4k h PRO 228 Ca 0.00 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.57 3i4k h PRO 228 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.00 3i4k h PRO 228 CO 0.00 0.11 -0.56 0.95 -0.23 0.00 0.00 178.00 178.27 3i4k s THR 229 N -3.24 1.10 0.22 1.56 -4.23 -1.26 -2.20 115.64 107.60 3i4k s THR 229 Ca 0.05 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.28 3i4k s THR 229 Cb 0.06 -2.57 -0.16 0.00 1.34 0.00 0.00 72.50 71.17 3i4k s THR 229 CO 0.67 0.00 0.63 -2.65 -0.54 0.00 0.00 174.62 172.73 3i4k n PRO 230 N -0.89 0.33 -0.14 3.99 -0.02 -1.25 -4.21 135.00 132.80 3i4k n PRO 230 Ca -0.07 0.11 0.01 0.00 -2.02 0.00 0.00 63.50 61.54 3i4k n PRO 230 Cb 0.66 -1.20 0.29 0.00 -0.02 0.00 0.00 33.50 33.23 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 1.23 1.50 0.00 3.55 0.00 -1.89 -2.65 119.26 121.01 3i4k h ALA 231 Ca -0.31 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3i4k h ALA 231 Cb 1.42 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3i4k h ALA 231 CO 0.58 0.44 0.00 0.38 0.00 0.00 0.00 179.25 180.65 3i4k h ASP 232 N 0.85 0.00 -1.72 0.00 2.03 -1.91 -3.40 116.42 112.27 3i4k h ASP 232 Ca 0.23 0.00 -0.75 0.00 -0.73 0.00 0.00 57.03 55.77 3i4k h ASP 232 Cb -0.05 0.00 -0.17 0.00 -0.83 0.00 0.00 39.33 38.28 3i4k h ASP 232 CO -0.04 0.00 1.74 -0.67 -1.03 0.00 0.00 179.24 179.24 3i4k n ASP 233 N -2.97 5.20 -0.05 4.15 -0.08 -1.00 -4.79 116.55 117.02 3i4k n ASP 233 Ca 0.02 -3.09 0.00 0.00 -1.51 0.00 0.00 54.79 50.22 3i4k n ASP 233 Cb 0.37 -1.49 0.29 0.00 2.34 0.00 0.00 41.12 42.63 3i4k n ASP 233 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 3i4k h LEU 234 N 8.27 0.58 -1.28 -2.67 3.38 -1.84 -2.63 115.31 119.13 3i4k h LEU 234 Ca 0.36 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.22 3i4k h LEU 234 Cb 0.70 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 3i4k h LEU 234 CO 1.49 0.57 0.14 -0.33 0.09 0.00 0.00 178.44 180.40 3i4k h GLU 235 N 0.63 0.63 -0.22 1.13 5.08 -1.91 -2.50 114.58 117.41 3i4k h GLU 235 Ca 0.15 -0.10 -0.13 0.00 -1.00 0.00 0.00 59.36 58.28 3i4k h GLU 235 Cb 0.21 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3i4k h GLU 235 CO -0.01 0.55 -0.41 1.15 -1.00 0.00 0.00 179.01 179.30 3i4k h THR 236 N 0.62 1.30 -0.63 1.13 2.02 -1.88 -0.46 112.91 115.02 3i4k h THR 236 Ca 0.15 -1.57 -0.05 0.00 0.77 0.00 0.00 66.41 65.71 3i4k h THR 236 Cb 0.18 1.57 -0.03 0.00 -1.74 0.00 0.00 68.15 68.14 3i4k h THR 236 CO -0.01 0.49 0.19 -0.07 0.37 0.00 0.00 175.52 176.49 3i4k h LEU 237 N 0.43 0.90 -0.17 2.58 3.38 -1.39 -0.75 115.31 120.29 3i4k h LEU 237 Ca 0.04 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 3i4k h LEU 237 Cb 0.90 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 3i4k h LEU 237 CO 0.08 0.84 -0.22 -0.09 0.09 0.00 0.00 178.44 179.14 3i4k h ARG 238 N 0.93 0.45 -0.36 1.13 9.65 -1.25 -3.18 114.38 121.75 3i4k h ARG 238 Ca 0.21 -0.25 -0.04 0.00 -1.10 0.00 0.00 59.98 58.80 3i4k h ARG 238 Cb 0.27 0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.85 3i4k h ARG 238 CO -0.01 0.84 0.07 1.49 2.80 0.00 0.00 179.97 185.15 3i4k h GLU 239 N 0.09 0.53 -0.40 0.20 4.57 -0.77 -1.27 114.58 117.52 3i4k h GLU 239 Ca 0.02 -0.09 -0.12 0.00 -1.18 0.00 0.00 59.36 57.99 3i4k h GLU 239 Cb 0.77 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.26 3i4k h GLU 239 CO 0.05 0.51 -0.24 -0.84 -1.18 0.00 0.00 179.01 177.31 3i4k h ILE 240 N 0.52 1.27 -0.28 2.32 3.07 -1.16 -1.18 117.51 122.07 3i4k h ILE 240 Ca 0.12 -1.38 -0.08 0.00 1.55 0.00 0.00 64.86 65.07 3i4k h ILE 240 Cb 0.24 1.22 -0.02 0.00 -0.27 0.00 0.00 36.82 37.99 3i4k h ILE 240 CO -0.00 0.46 -0.16 0.74 -1.05 0.00 0.00 178.15 178.14 3i4k h THR 241 N 0.71 1.24 -0.36 0.16 2.02 -1.44 -0.43 112.91 114.83 3i4k h THR 241 Ca 0.09 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.16 3i4k h THR 241 Cb 0.78 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 68.38 3i4k h THR 241 CO 0.06 0.35 0.17 0.03 0.37 0.00 0.00 175.52 176.51 3i4k h ARG 242 N 0.45 0.51 0.00 6.66 3.08 -0.67 0.77 114.38 125.18 3i4k h ARG 242 Ca 0.08 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3i4k h ARG 242 Cb 0.55 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.50 3i4k h ARG 242 CO 0.04 0.46 -0.07 0.54 -1.07 0.00 0.00 179.97 179.87 3i4k n ARG 243 N -4.73 0.22 0.00 0.04 1.74 -0.50 -4.21 116.66 109.21 3i4k n ARG 243 Ca -0.01 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 3i4k n ARG 243 Cb 0.11 -1.74 0.00 0.00 -1.02 0.00 0.00 32.46 29.81 3i4k n ARG 243 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3i4k n THR 244 N -2.11 0.00 -1.42 0.55 -2.24 -0.20 -5.00 114.28 103.87 3i4k n THR 244 Ca 0.06 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.71 3i4k n THR 244 Cb 0.41 0.41 -0.05 0.00 -2.10 0.00 0.00 70.33 69.00 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 -1.33 -4.45 -4.42 3.42 3.02 0.27 -5.01 115.26 106.77 3i4k n ASN 245 Ca 0.00 0.28 -0.32 0.00 -0.03 0.00 0.00 54.58 54.51 3i4k n ASN 245 Cb 0.01 -3.07 -0.14 0.00 -0.61 0.00 0.00 39.78 35.97 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 -2.47 2.80 0.56 2.41 0.11 -1.26 -5.07 120.40 117.50 3i4k s VAL 246 Ca 0.00 -0.81 -0.20 0.00 -2.93 0.00 0.00 61.98 58.04 3i4k s VAL 246 Cb 0.00 -2.09 -0.06 0.00 -1.53 0.00 0.00 36.38 32.71 3i4k s VAL 246 CO 0.00 0.58 1.06 -1.20 -3.33 0.00 0.00 175.10 172.21 3i4k n SER 247 N 2.56 1.29 0.00 3.54 7.64 -1.26 -4.44 113.62 122.95 3i4k n SER 247 Ca -0.17 0.88 0.00 0.00 1.01 0.00 0.00 58.87 60.59 3i4k n SER 247 Cb 0.52 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 3i4k n SER 247 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3i4k n VAL 248 N -1.38 0.00 -3.77 0.44 0.31 -1.26 -1.06 118.33 111.61 3i4k n VAL 248 Ca 0.12 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.33 3i4k n VAL 248 Cb 0.45 -0.10 -0.12 0.00 -0.91 0.00 0.00 33.84 33.16 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 -2.01 -0.63 0.00 3.52 0.00 -0.05 -2.21 121.76 120.38 3i4k s ALA 250 Ca 0.00 0.82 0.00 0.00 0.00 0.00 0.00 51.96 52.78 3i4k s ALA 250 Cb 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.63 3i4k s ALA 250 CO 0.00 -0.14 0.00 -3.47 0.00 0.00 0.00 175.76 172.15 3i4k n ASP 251 N 3.29 0.00 0.26 0.00 -0.08 -1.26 -0.73 116.55 118.03 3i4k n ASP 251 Ca -0.16 0.00 0.18 0.00 -1.51 0.00 0.00 54.79 53.30 3i4k n ASP 251 Cb 0.57 0.00 0.92 0.00 2.34 0.00 0.00 41.12 44.95 3i4k n ASP 251 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 3i4k h GLU 252 N 0.00 0.00 0.00 -0.67 9.09 -1.95 -0.12 114.58 120.93 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 -3.36 3.06 0.02 -1.88 -3.42 113.55 107.98 3i4k h SER 253 Ca 0.00 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 3i4k h SER 253 Cb 0.06 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 62.21 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 -3.41 1.07 -0.05 2.27 1.01 -0.06 -4.78 120.40 116.46 3i4k s VAL 254 Ca 0.04 -1.21 -0.01 0.00 0.00 0.00 0.00 61.98 60.81 3i4k s VAL 254 Cb 0.09 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 3i4k s VAL 254 CO 0.53 -0.39 -0.05 0.79 0.00 0.00 0.00 175.10 175.98 3i4k n TRP 255 N 4.81 0.00 -3.97 5.22 7.02 -1.26 -4.85 117.44 124.40 3i4k n TRP 255 Ca -0.06 0.00 -0.21 0.00 -1.02 0.00 0.00 57.50 56.21 3i4k n TRP 255 Cb 0.44 -0.19 -0.03 0.00 -2.42 0.00 0.00 31.31 29.11 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 -2.10 4.49 0.24 -0.99 -4.23 -1.26 -4.12 115.64 107.67 3i4k s THR 256 Ca -0.07 -1.25 -0.06 0.00 -1.18 0.00 0.00 61.69 59.13 3i4k s THR 256 Cb 0.02 -3.49 0.24 0.00 1.34 0.00 0.00 72.50 70.61 3i4k s THR 256 CO 0.11 -0.30 1.91 -0.65 -0.54 0.00 0.00 174.62 175.15 3i4k h PRO 257 N 1.31 1.24 -0.96 3.99 0.11 -1.93 -0.38 132.00 135.38 3i4k h PRO 257 Ca -0.49 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 65.56 3i4k h PRO 257 Cb 1.24 -0.28 -0.05 0.00 0.11 0.00 0.00 31.00 32.02 3i4k h PRO 257 CO 0.60 0.82 0.64 0.00 -0.21 0.00 0.00 178.00 179.84 3i4k h ALA 258 N 1.37 1.22 -0.06 -0.75 0.00 -1.99 -0.66 119.26 118.39 3i4k h ALA 258 Ca 0.36 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.09 3i4k h ALA 258 Cb -0.10 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.28 3i4k h ALA 258 CO -0.09 0.62 -0.49 0.93 0.00 0.00 0.00 179.25 180.22 3i4k h GLU 259 N 1.31 0.15 -0.55 0.00 5.08 -1.64 -0.73 114.58 118.19 3i4k h GLU 259 Ca 0.35 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.52 3i4k h GLU 259 Cb -0.15 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 3i4k h GLU 259 CO -0.08 0.60 -0.09 0.00 -1.00 0.00 0.00 179.01 178.45 3i4k h ALA 260 N 1.38 0.79 -0.20 3.43 0.00 -0.29 -2.30 119.26 122.07 3i4k h ALA 260 Ca 0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 3i4k h ALA 260 Cb 0.90 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3i4k h ALA 260 CO 0.07 0.67 0.11 1.25 0.00 0.00 0.00 179.25 181.35 3i4k h LEU 261 N 0.92 0.25 -0.96 0.00 6.46 -0.73 -1.97 115.31 119.30 3i4k h LEU 261 Ca 0.15 -0.08 0.10 0.00 -0.12 0.00 0.00 57.88 57.92 3i4k h LEU 261 Cb 0.65 -0.06 -0.08 0.00 -0.73 0.00 0.00 40.66 40.44 3i4k h LEU 261 CO 0.05 0.27 0.59 0.00 -0.62 0.00 0.00 178.44 178.72 3i4k h ALA 262 N 1.00 1.39 -0.75 1.25 0.00 -0.96 -0.41 119.26 120.79 3i4k h ALA 262 Ca 0.07 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3i4k h ALA 262 Cb 0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3i4k h ALA 262 CO -0.01 0.25 0.25 0.28 0.00 0.00 0.00 179.25 180.01 3i4k h VAL 263 N 0.99 1.26 -0.22 0.00 2.07 -1.04 -0.13 116.25 119.18 3i4k h VAL 263 Ca 0.45 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 3i4k h VAL 263 Cb 0.38 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 3i4k h VAL 263 CO -0.24 0.35 0.08 0.58 0.02 0.00 0.00 177.57 178.37 3i4k h VAL 264 N 1.11 1.17 -0.17 2.57 2.07 -0.44 -0.36 116.25 122.20 3i4k h VAL 264 Ca 0.24 -0.53 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 3i4k h VAL 264 Cb 0.29 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 3i4k h VAL 264 CO -0.01 0.17 -0.14 0.11 0.02 0.00 0.00 177.57 177.72 3i4k h LYS 265 N 0.19 0.28 -0.01 1.57 1.57 -0.91 -2.48 116.57 116.78 3i4k h LYS 265 Ca 0.07 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3i4k h LYS 265 Cb 0.19 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3i4k h LYS 265 CO -0.00 0.43 -0.14 0.00 -0.57 0.00 0.00 179.45 179.17 3i4k n ALA 266 N -2.49 2.84 -4.09 3.86 0.00 -0.08 -4.93 120.51 115.63 3i4k n ALA 266 Ca -0.00 -0.43 -0.32 0.00 0.00 0.00 0.00 53.44 52.68 3i4k n ALA 266 Cb 0.29 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.59 3i4k n ALA 266 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3i4k n GLN 267 N -0.21 -3.68 0.15 0.00 6.02 -0.20 -4.85 117.38 114.60 3i4k n GLN 267 Ca 0.15 0.43 0.12 0.00 -0.01 0.00 0.00 57.00 57.69 3i4k n GLN 267 Cb 0.36 -5.04 0.22 0.00 1.02 0.00 0.00 30.24 26.80 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 0.91 0.88 -2.04 -1.58 0.00 -1.68 -3.41 119.26 112.32 3i4k h ALA 268 Ca -0.60 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.26 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 0.72 0.00 0.13 0.00 0.00 0.00 0.00 179.25 180.10 3i4k s ALA 269 N -3.19 -1.72 0.02 0.00 0.00 -1.26 -3.84 121.76 111.76 3i4k s ALA 269 Ca 0.07 1.69 0.10 0.00 0.00 0.00 0.00 51.96 53.82 3i4k s ALA 269 Cb 0.09 -0.69 -0.16 0.00 0.00 0.00 0.00 23.12 22.36 3i4k s ALA 269 CO 0.67 -0.34 1.16 -0.44 0.00 0.00 0.00 175.76 176.81 3i4k h ASP 270 N 4.25 0.00 -4.20 0.00 3.45 -1.80 -3.47 116.42 114.65 3i4k h ASP 270 Ca -0.28 0.00 -0.42 0.00 0.43 0.00 0.00 57.03 56.76 3i4k h ASP 270 Cb 1.15 0.00 -0.27 0.00 -0.56 0.00 0.00 39.33 39.65 3i4k h ASP 270 CO 0.19 0.88 -0.79 -0.69 -1.57 0.00 0.00 179.24 177.26 3i4k s VAL 271 N -2.75 0.90 -0.11 -1.35 1.01 -1.05 -1.58 120.40 115.47 3i4k s VAL 271 Ca 0.00 -0.65 -0.00 0.00 0.00 0.00 0.00 61.98 61.33 3i4k s VAL 271 Cb 0.09 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.66 3i4k s VAL 271 CO 0.81 0.13 -0.09 -0.63 0.00 0.00 0.00 175.10 175.32 3i4k s ILE 272 N -0.50 3.46 -0.92 2.22 1.01 0.23 -0.87 121.20 125.84 3i4k s ILE 272 Ca 0.02 -0.54 -0.22 0.00 0.00 0.00 0.00 60.65 59.92 3i4k s ILE 272 Cb -0.06 -2.45 0.08 0.00 0.01 0.00 0.00 42.46 40.04 3i4k s ILE 272 CO 0.00 0.55 1.28 0.00 0.00 0.00 0.00 174.94 176.76 3i4k s ALA 273 N -0.15 2.97 -0.42 9.38 0.00 0.09 -0.95 121.76 132.68 3i4k s ALA 273 Ca 0.01 -2.28 -0.28 0.00 0.00 0.00 0.00 51.96 49.42 3i4k s ALA 273 Cb -0.13 -4.27 0.02 0.00 0.00 0.00 0.00 23.12 18.74 3i4k s ALA 273 CO 0.03 -3.29 1.04 -1.17 0.00 0.00 0.00 175.76 172.37 3i4k s LEU 274 N 4.24 3.84 -0.20 0.00 2.96 -0.31 -4.80 118.68 124.40 3i4k s LEU 274 Ca 0.38 0.57 0.01 0.00 -0.22 0.00 0.00 54.13 54.87 3i4k s LEU 274 Cb -0.04 -3.43 0.03 0.00 0.50 0.00 0.00 46.19 43.25 3i4k s LEU 274 CO -0.05 -1.05 -0.16 -0.54 -1.32 0.00 0.00 176.35 173.23 3i4k s LYS 275 N 3.95 2.66 0.58 1.98 1.02 -1.26 -1.02 119.74 127.64 3i4k s LYS 275 Ca 0.43 -0.96 0.27 0.00 0.02 0.00 0.00 55.97 55.74 3i4k s LYS 275 Cb -0.10 -2.62 1.59 0.00 -0.52 0.00 0.00 37.83 36.19 3i4k s LYS 275 CO 0.24 -0.33 2.09 1.79 -0.92 0.00 0.00 175.35 178.22 3i4k h THR 276 N 6.21 0.54 0.03 2.17 1.35 -1.89 -1.33 112.91 119.98 3i4k h THR 276 Ca -0.37 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.45 3i4k h THR 276 Cb 1.11 0.83 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 3i4k h THR 276 CO 0.57 0.00 -0.19 0.71 -0.25 0.00 0.00 175.52 176.36 3i4k h THR 277 N 0.00 1.72 -0.72 6.82 1.35 -1.93 -1.09 112.91 119.05 3i4k h THR 277 Ca 0.10 -2.38 0.03 0.00 -0.55 0.00 0.00 66.41 63.61 3i4k h THR 277 Cb 0.53 3.33 -0.04 0.00 -1.73 0.00 0.00 68.15 70.24 3i4k h THR 277 CO -0.00 0.62 0.47 0.50 -0.25 0.00 0.00 175.52 176.87 3i4k h LYS 278 N -0.88 0.85 -0.00 4.72 3.64 -1.71 -2.40 116.57 120.79 3i4k h LYS 278 Ca -0.04 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3i4k h LYS 278 Cb 1.13 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 3i4k h LYS 278 CO 0.02 0.56 -0.03 0.72 -2.27 0.00 0.00 179.45 178.45 3i4k n HIS 279 N -4.45 0.00 -1.17 1.91 8.25 -0.57 -4.42 115.22 114.77 3i4k n HIS 279 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 3i4k n HIS 279 Cb 0.12 -0.35 0.00 0.00 1.12 0.00 0.00 29.99 30.88 3i4k n HIS 279 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3i4k n GLY 280 N 1.37 1.07 0.00 -1.41 0.00 -0.90 -4.70 105.19 100.61 3i4k n GLY 280 Ca 0.11 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.65 3i4k n GLY 280 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4k n GLY 281 N -0.89 2.59 0.26 -0.02 0.00 -0.41 -3.76 105.19 102.95 3i4k n GLY 281 Ca 0.00 -2.12 -0.01 0.00 0.00 0.00 0.00 46.02 43.89 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 0.47 -0.45 0.99 3.38 -1.88 -1.62 115.31 116.21 3i4k h LEU 282 Ca 0.00 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 3i4k h LEU 282 Cb 0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3i4k h LEU 282 CO 0.00 0.61 -0.09 -0.07 0.09 0.00 0.00 178.44 178.97 3i4k h LEU 283 N 0.46 0.86 -0.59 1.67 3.38 -1.96 -2.37 115.31 116.75 3i4k h LEU 283 Ca 0.09 -0.36 -0.15 0.00 0.09 0.00 0.00 57.88 57.56 3i4k h LEU 283 Cb 0.45 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3i4k h LEU 283 CO 0.02 1.01 -0.51 -0.33 0.09 0.00 0.00 178.44 178.73 3i4k h GLU 284 N 0.69 0.51 -0.86 1.13 4.39 -1.80 -2.98 114.58 115.66 3i4k h GLU 284 Ca 0.11 -0.30 0.01 0.00 0.34 0.00 0.00 59.36 59.52 3i4k h GLU 284 Cb 0.63 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.26 3i4k h GLU 284 CO 0.04 0.90 0.57 0.77 -1.16 0.00 0.00 179.01 180.13 3i4k h SER 285 N 0.40 0.99 -0.24 1.42 0.02 -1.09 -0.25 113.55 114.80 3i4k h SER 285 Ca 0.02 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 3i4k h SER 285 Cb 1.03 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.30 3i4k h SER 285 CO 0.09 0.72 0.11 0.11 -1.14 0.00 0.00 176.83 176.72 3i4k h LYS 286 N 1.17 0.42 -0.25 3.45 1.79 -1.28 -1.71 116.57 120.17 3i4k h LYS 286 Ca 0.32 -0.05 -0.11 0.00 -2.18 0.00 0.00 60.65 58.62 3i4k h LYS 286 Cb -0.13 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 30.43 3i4k h LYS 286 CO -0.07 0.36 -0.29 0.87 -1.08 0.00 0.00 179.45 179.24 3i4k h LYS 287 N 0.42 0.64 -0.18 3.15 1.57 -1.03 -1.99 116.57 119.15 3i4k h LYS 287 Ca 0.10 -0.35 0.03 0.00 -1.87 0.00 0.00 60.65 58.56 3i4k h LYS 287 Cb 0.11 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 3i4k h LYS 287 CO -0.01 0.96 -0.01 0.82 -0.57 0.00 0.00 179.45 180.64 3i4k h ILE 288 N 0.35 0.86 -0.93 1.86 1.08 -0.66 -1.63 117.51 118.44 3i4k h ILE 288 Ca 0.03 -0.01 0.02 0.00 -0.39 0.00 0.00 64.86 64.51 3i4k h ILE 288 Cb 0.86 0.82 -0.05 0.00 -3.07 0.00 0.00 36.82 35.38 3i4k h ILE 288 CO 0.07 0.01 0.61 0.00 -0.69 0.00 0.00 178.15 178.15 3i4k h ALA 289 N 1.16 1.20 -0.19 1.87 0.00 -1.31 -0.55 119.26 121.44 3i4k h ALA 289 Ca 0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3i4k h ALA 289 Cb 0.11 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3i4k h ALA 289 CO -0.15 0.53 0.08 0.00 0.00 0.00 0.00 179.25 179.71 3i4k h ALA 290 N 1.36 0.25 -0.20 0.00 0.00 -0.88 -0.20 119.26 119.58 3i4k h ALA 290 Ca 0.35 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3i4k h ALA 290 Cb -0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3i4k h ALA 290 CO -0.09 -0.17 0.05 0.82 0.00 0.00 0.00 179.25 179.86 3i4k h ILE 291 N 0.16 1.20 0.20 0.00 2.04 -1.07 -1.28 117.51 118.76 3i4k h ILE 291 Ca 0.06 -0.65 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3i4k h ILE 291 Cb 0.17 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 3i4k h ILE 291 CO -0.01 0.20 -0.18 0.00 0.00 0.00 0.00 178.15 178.17 3i4k h ALA 292 N 0.86 -0.38 -0.43 1.87 0.00 -1.07 -2.36 119.26 117.77 3i4k h ALA 292 Ca 0.06 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.99 3i4k h ALA 292 Cb 0.26 0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 3i4k h ALA 292 CO 0.00 -0.74 -0.00 1.49 0.00 0.00 0.00 179.25 180.00 3i4k h GLU 293 N -0.41 0.10 -0.58 0.00 4.81 -0.97 0.19 114.58 117.73 3i4k h GLU 293 Ca -0.00 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 3i4k h GLU 293 Cb 0.37 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 3i4k h GLU 293 CO -0.03 0.07 0.39 0.00 -0.73 0.00 0.00 179.01 178.70 3i4k h ALA 294 N 1.38 1.65 -0.10 2.92 0.00 -1.08 -0.49 119.26 123.54 3i4k h ALA 294 Ca 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3i4k h ALA 294 Cb 0.30 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3i4k h ALA 294 CO -0.35 0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.61 3i4k n GLY 295 N -1.46 0.07 1.99 0.00 0.00 -0.62 -4.94 105.19 100.24 3i4k n GLY 295 Ca 0.06 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 1.13 0.50 3.74 -0.02 0.00 -0.12 -5.03 105.19 105.38 3i4k n GLY 296 Ca 0.17 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 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 4.36 0.58 0.99 1.43 0.50 -4.96 118.68 121.58 3i4k s LEU 297 Ca 0.00 1.18 -0.16 0.00 -1.03 0.00 0.00 54.13 54.11 3i4k s LEU 297 Cb 0.00 -3.01 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 3i4k s LEU 297 CO 0.00 -0.01 1.06 0.00 0.23 0.00 0.00 176.35 177.63 3i4k s ALA 298 N 0.33 2.75 -0.06 4.21 0.00 -0.61 -3.78 121.76 124.59 3i4k s ALA 298 Ca 0.34 0.44 0.05 0.00 0.00 0.00 0.00 51.96 52.79 3i4k s ALA 298 Cb -0.18 -3.24 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 3i4k s ALA 298 CO 0.18 -0.76 -0.21 0.00 0.00 0.00 0.00 175.76 174.96 3i4k s HIS 300 N -0.26 3.10 -1.21 0.00 5.04 -0.13 -1.88 115.29 119.94 3i4k s HIS 300 Ca -0.00 -0.02 -0.20 0.00 -1.54 0.00 0.00 55.06 53.30 3i4k s HIS 300 Cb -0.13 -1.88 0.03 0.00 0.04 0.00 0.00 32.58 30.64 3i4k s HIS 300 CO 0.03 0.23 1.75 0.20 -2.34 0.00 0.00 174.74 174.61 3i4k s GLY 301 N -0.27 1.18 0.82 1.59 0.00 0.02 -1.16 107.32 109.49 3i4k s GLY 301 Ca 0.06 -2.58 -0.12 0.00 0.00 0.00 0.00 44.72 42.08 3i4k s GLY 301 CO 0.02 2.94 1.15 0.00 0.00 0.00 0.00 173.10 177.22 3i4k s ALA 302 N 6.13 2.46 0.05 3.20 0.00 -0.19 -1.17 121.76 132.25 3i4k s ALA 302 Ca 0.57 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 52.02 3i4k s ALA 302 Cb 0.02 -3.00 -0.02 0.00 0.00 0.00 0.00 23.12 20.12 3i4k s ALA 302 CO 0.06 -1.74 -0.12 -0.08 0.00 0.00 0.00 175.76 173.88 3i4k s THR 303 N -3.45 0.93 -0.60 0.00 -1.32 -1.26 -4.49 115.64 105.45 3i4k s THR 303 Ca 0.62 -1.11 0.16 0.00 -1.21 0.00 0.00 61.69 60.15 3i4k s THR 303 Cb -0.12 -0.90 0.70 0.00 -1.51 0.00 0.00 72.50 70.68 3i4k s THR 303 CO 0.51 -0.18 1.62 -1.20 -2.21 0.00 0.00 174.62 173.15 3i4k n SER 304 N 1.58 4.89 -2.51 8.08 7.64 -1.26 -4.88 113.62 127.15 3i4k n SER 304 Ca -0.20 -2.72 -0.11 0.00 1.01 0.00 0.00 58.87 56.85 3i4k n SER 304 Cb 0.55 -0.59 0.06 0.00 -1.01 0.00 0.00 64.21 63.21 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 0.59 -3.26 -4.79 -3.43 4.32 -1.26 -3.20 117.00 105.98 3i4k n LEU 305 Ca 0.25 -0.39 -0.32 0.00 -0.02 0.00 0.00 56.01 55.53 3i4k n LEU 305 Cb 0.99 -2.14 0.05 0.00 -1.62 0.00 0.00 43.42 40.70 3i4k n LEU 305 CO 0.25 0.24 0.72 -1.61 -1.22 0.00 0.00 177.39 175.77 3i4k s GLU 306 N -4.87 2.81 0.00 3.23 8.01 -1.26 -4.93 118.70 121.69 3i4k s GLU 306 Ca 0.01 1.20 0.00 0.00 0.01 0.00 0.00 54.97 56.19 3i4k s GLU 306 Cb -0.00 -1.96 0.00 0.00 -4.31 0.00 0.00 34.13 27.85 3i4k s GLU 306 CO 0.46 -1.21 0.00 0.41 0.01 0.00 0.00 175.26 174.92 3i4k n GLY 307 N -1.11 -1.16 0.25 -1.39 0.00 -1.26 -3.99 105.19 96.53 3i4k n GLY 307 Ca 0.09 -1.59 -0.00 0.00 0.00 0.00 0.00 46.02 44.52 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 0.42 -0.23 1.61 0.13 -1.94 -0.87 132.00 131.11 3i4k h PRO 308 Ca 0.00 -0.11 -0.12 0.00 -0.87 0.00 0.00 66.00 64.90 3i4k h PRO 308 Cb 0.00 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.08 3i4k h PRO 308 CO 0.00 0.53 -0.32 0.82 -0.23 0.00 0.00 178.00 178.80 3i4k h ILE 309 N 0.39 1.32 -0.23 -3.56 1.08 -1.96 -1.84 117.51 112.71 3i4k h ILE 309 Ca 0.08 -1.52 -0.12 0.00 -0.39 0.00 0.00 64.86 62.91 3i4k h ILE 309 Cb 0.43 1.74 -0.00 0.00 -3.07 0.00 0.00 36.82 35.92 3i4k h ILE 309 CO 0.02 0.47 -0.34 1.23 -0.69 0.00 0.00 178.15 178.85 3i4k h GLY 310 N 0.33 0.70 1.50 5.37 0.00 -1.87 -2.35 103.07 106.75 3i4k h GLY 310 Ca 0.03 -0.77 -0.00 0.00 0.00 0.00 0.00 47.33 46.58 3i4k h GLY 310 CO 0.07 0.70 0.31 -0.84 0.00 0.00 0.00 176.54 176.78 3i4k h THR 311 N 0.34 1.14 -0.18 4.70 2.02 -1.19 -1.36 112.91 118.38 3i4k h THR 311 Ca 0.02 -0.29 -0.15 0.00 0.77 0.00 0.00 66.41 66.77 3i4k h THR 311 Cb 0.92 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 3i4k h THR 311 CO 0.08 0.14 -0.50 0.00 0.37 0.00 0.00 175.52 175.61 3i4k h ALA 312 N 1.66 0.79 -0.59 6.16 0.00 -1.21 -1.53 119.26 124.55 3i4k h ALA 312 Ca 0.18 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 3i4k h ALA 312 Cb -0.04 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3i4k h ALA 312 CO -0.04 0.67 0.16 0.00 0.00 0.00 0.00 179.25 180.05 3i4k h ALA 313 N 1.07 0.77 -0.09 0.00 0.00 -0.72 -1.13 119.26 119.16 3i4k h ALA 313 Ca 0.02 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 3i4k h ALA 313 Cb 1.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 3i4k h ALA 313 CO 0.09 0.46 -0.51 0.77 0.00 0.00 0.00 179.25 180.06 3i4k h SER 314 N 0.84 0.28 -0.32 0.00 0.02 -1.30 -2.05 113.55 111.03 3i4k h SER 314 Ca 0.19 -0.14 -0.11 0.00 -0.84 0.00 0.00 61.79 60.88 3i4k h SER 314 Cb 0.32 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 3i4k h SER 314 CO -0.00 0.75 -0.20 -0.07 -1.14 0.00 0.00 176.83 176.17 3i4k h LEU 315 N 0.20 0.80 -0.88 5.07 3.38 -0.91 -0.47 115.31 122.50 3i4k h LEU 315 Ca 0.01 -0.28 -0.11 0.00 0.09 0.00 0.00 57.88 57.58 3i4k h LEU 315 Cb 0.98 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 3i4k h LEU 315 CO 0.08 0.99 -0.42 1.56 0.09 0.00 0.00 178.44 180.73 3i4k h GLN 316 N 0.70 0.29 -0.05 1.13 1.08 -1.00 -1.20 115.11 116.05 3i4k h GLN 316 Ca 0.10 -0.14 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 3i4k h GLN 316 Cb 0.71 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.14 3i4k h GLN 316 CO 0.05 0.67 0.01 0.35 -0.95 0.00 0.00 178.83 178.96 3i4k h PHE 317 N 0.24 0.10 0.00 2.96 3.04 -0.87 -2.95 116.94 119.46 3i4k h PHE 317 Ca 0.02 -0.01 -0.03 0.00 3.98 0.00 0.00 57.97 61.93 3i4k h PHE 317 Cb 0.85 -0.03 -0.00 0.00 2.56 0.00 0.00 35.95 39.33 3i4k h PHE 317 CO 0.02 0.34 -0.14 0.00 -2.02 0.00 0.00 178.31 176.50 3i4k h ALA 318 N 0.75 1.70 0.00 2.41 0.00 -0.92 -1.37 119.26 121.83 3i4k h ALA 318 Ca 0.02 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 3i4k h ALA 318 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3i4k h ALA 318 CO 0.00 0.18 -0.27 0.00 0.00 0.00 0.00 179.25 179.16 3i4k h ALA 319 N 1.86 1.25 -0.08 0.00 0.00 -1.05 -3.16 119.26 118.08 3i4k h ALA 319 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3i4k h ALA 319 Cb 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3i4k h ALA 319 CO 0.02 0.34 0.00 -1.13 0.00 0.00 0.00 179.25 178.48 3i4k n SER 320 N -3.78 2.20 -4.07 0.00 3.41 -0.71 0.14 113.62 110.81 3i4k n SER 320 Ca -0.01 -1.60 -0.33 0.00 -0.26 0.00 0.00 58.87 56.67 3i4k n SER 320 Cb 0.37 -0.04 -0.14 0.00 -0.26 0.00 0.00 64.21 64.14 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 -1.03 2.56 0.28 6.66 2.01 -0.60 -4.78 115.64 120.74 3i4k s THR 321 Ca 0.16 -2.08 0.00 0.00 0.31 0.00 0.00 61.69 60.08 3i4k s THR 321 Cb 0.11 -2.76 0.28 0.00 0.01 0.00 0.00 72.50 70.13 3i4k s THR 321 CO 0.16 -0.49 1.84 0.50 -0.69 0.00 0.00 174.62 175.94 3i4k h LYS 322 N 7.77 0.99 0.00 4.92 3.11 -1.91 -1.11 116.57 130.34 3i4k h LYS 322 Ca -0.10 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.68 3i4k h LYS 322 Cb 1.03 -0.22 0.00 0.00 -1.00 0.00 0.00 32.23 32.04 3i4k h LYS 322 CO 0.55 0.66 0.15 0.00 -2.81 0.00 0.00 179.45 178.00 3i4k n ALA 323 N -2.35 0.81 -2.66 5.00 0.00 -1.26 -3.73 120.51 116.31 3i4k n ALA 323 Ca 0.18 0.14 -0.42 0.00 0.00 0.00 0.00 53.44 53.34 3i4k n ALA 323 Cb 0.32 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.74 3i4k n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3i4k s ILE 324 N -3.33 4.10 -1.17 0.00 -1.09 -0.42 -2.99 121.20 116.30 3i4k s ILE 324 Ca -0.02 -0.74 0.10 0.00 -2.23 0.00 0.00 60.65 57.76 3i4k s ILE 324 Cb 0.04 -4.95 0.10 0.00 -1.58 0.00 0.00 42.46 36.07 3i4k s ILE 324 CO 0.13 -1.80 0.85 -1.54 -1.23 0.00 0.00 174.94 171.36 3i4k n SER 325 N 8.35 1.92 -2.43 3.58 3.41 -0.82 -4.71 113.62 122.92 3i4k n SER 325 Ca 0.24 -1.47 -0.19 0.00 -0.26 0.00 0.00 58.87 57.18 3i4k n SER 325 Cb 0.50 -0.02 0.02 0.00 -0.26 0.00 0.00 64.21 64.44 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 0.53 2.53 -4.82 7.33 9.36 -0.79 -4.91 117.16 126.39 3i4k n TYR 326 Ca 0.06 -2.68 0.00 0.00 3.32 0.00 0.00 57.90 58.60 3i4k n TYR 326 Cb 0.26 -0.23 0.00 0.00 -0.63 0.00 0.00 39.34 38.74 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 -0.48 0.04 3.49 2.98 0.00 -1.26 -4.66 105.19 105.30 3i4k n GLY 327 Ca 0.31 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.24 2.61 -4.23 -0.15 -0.80 115.64 112.84 3i4k s THR 328 Ca 0.00 -1.58 0.19 0.00 -1.18 0.00 0.00 61.69 59.12 3i4k s THR 328 Cb 0.00 -2.49 0.49 0.00 1.34 0.00 0.00 72.50 71.84 3i4k s THR 328 CO 0.00 0.00 1.14 -1.84 -0.54 0.00 0.00 174.62 173.38 3i4k n GLU 329 N -0.47 2.05 -1.93 3.99 0.28 -0.32 0.21 120.64 124.44 3i4k n GLU 329 Ca 0.00 -3.52 -0.42 0.00 -0.16 0.00 0.00 57.16 53.05 3i4k n GLU 329 Cb 0.62 -1.63 0.00 0.00 1.43 0.00 0.00 31.44 31.87 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 -0.54 6.78 -0.42 -1.84 4.77 -1.26 -4.40 117.00 120.09 3i4k n LEU 330 Ca 0.17 -4.30 0.04 0.00 -0.03 0.00 0.00 56.01 51.89 3i4k n LEU 330 Cb 0.87 -1.60 0.09 0.00 -2.33 0.00 0.00 43.42 40.45 3i4k n LEU 330 CO 0.14 1.19 0.54 2.22 -1.33 0.00 0.00 177.39 180.15 3i4k n PHE 331 N 5.40 0.25 -0.23 -1.77 1.16 -1.26 -4.83 117.46 116.18 3i4k n PHE 331 Ca 0.48 -0.39 -0.06 0.00 -1.87 0.00 0.00 57.45 55.61 3i4k n PHE 331 Cb 0.38 -0.03 -0.06 0.00 -1.61 0.00 0.00 39.48 38.17 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 0.27 -1.96 0.31 4.97 0.00 -1.26 -0.78 105.19 106.74 3i4k n GLY 332 Ca 0.07 0.76 0.13 0.00 0.00 0.00 0.00 46.02 46.99 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 0.37 0.00 1.61 0.11 -1.81 0.23 132.00 132.51 3i4k h PRO 333 Ca 0.09 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3i4k h PRO 333 Cb 0.23 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.26 3i4k h PRO 333 CO -0.53 0.24 0.00 1.04 -0.21 0.00 0.00 178.00 178.55 3i4k n GLN 334 N -5.06 0.00 0.00 1.05 6.02 0.04 -1.56 117.38 117.86 3i4k n GLN 334 Ca 0.22 0.49 -0.00 0.00 -0.01 0.00 0.00 57.00 57.70 3i4k n GLN 334 Cb 0.67 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 30.31 3i4k n GLN 334 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 3i4k n LEU 335 N -1.50 0.58 -4.68 1.08 7.94 0.07 -4.89 117.00 115.60 3i4k n LEU 335 Ca 0.00 0.26 -0.43 0.00 -1.11 0.00 0.00 56.01 54.73 3i4k n LEU 335 Cb 0.00 0.14 -0.02 0.00 0.53 0.00 0.00 43.42 44.07 3i4k n LEU 335 CO 0.00 0.19 0.87 -0.76 -1.11 0.00 0.00 177.39 176.58 3i4k s LEU 336 N -5.54 4.21 0.65 -1.96 1.43 -0.60 -2.15 118.68 114.72 3i4k s LEU 336 Ca -0.05 1.56 0.38 0.00 -1.03 0.00 0.00 54.13 54.99 3i4k s LEU 336 Cb 0.09 -3.55 2.09 0.00 0.03 0.00 0.00 46.19 44.85 3i4k s LEU 336 CO 0.83 -0.55 2.24 0.50 0.23 0.00 0.00 176.35 179.60 3i4k h LYS 337 N 7.32 0.00 -4.08 1.70 3.64 -1.64 -3.43 116.57 120.08 3i4k h LYS 337 Ca -0.29 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 58.95 3i4k h LYS 337 Cb 1.13 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 32.83 3i4k h LYS 337 CO 0.90 0.00 -0.36 0.34 -2.27 0.00 0.00 179.45 178.06 3i4k s ASP 338 N -5.25 0.03 0.35 4.20 2.15 -1.26 -4.97 116.67 111.92 3i4k s ASP 338 Ca -0.05 -1.12 0.04 0.00 0.43 0.00 0.00 52.55 51.85 3i4k s ASP 338 Cb 0.13 0.48 -0.04 0.00 -0.30 0.00 0.00 42.92 43.19 3i4k s ASP 338 CO 0.42 -0.98 0.13 0.28 -0.17 0.00 0.00 175.17 174.85 3i4k s THR 339 N -4.07 0.61 -0.16 1.71 -1.32 -1.26 -4.96 115.64 106.19 3i4k s THR 339 Ca 0.29 -2.00 0.24 0.00 -1.21 0.00 0.00 61.69 59.00 3i4k s THR 339 Cb 0.03 -2.50 0.47 0.00 -1.51 0.00 0.00 72.50 68.99 3i4k s THR 339 CO 0.09 0.00 1.14 0.00 -2.21 0.00 0.00 174.62 173.64 3i4k n TYR 340 N -0.74 0.67 -1.96 9.09 4.11 -1.26 -4.91 117.16 122.15 3i4k n TYR 340 Ca -0.03 -1.47 0.05 0.00 -0.00 0.00 0.00 57.90 56.45 3i4k n TYR 340 Cb 0.65 -0.15 0.09 0.00 -0.00 0.00 0.00 39.34 39.93 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 -0.19 0.88 0.00 -3.48 0.13 -1.26 -1.90 119.36 113.54 3i4k n ILE 341 Ca 0.05 -1.62 0.00 0.00 -1.10 0.00 0.00 62.75 60.08 3i4k n ILE 341 Cb 0.94 0.39 0.00 0.00 -0.84 0.00 0.00 39.64 40.13 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 -0.31 0.00 -1.33 9.51 0.31 -1.18 -3.94 118.33 121.40 3i4k n VAL 342 Ca 0.10 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.13 3i4k n VAL 342 Cb 0.87 0.00 0.20 0.00 -0.91 0.00 0.00 33.84 34.00 3i4k n VAL 342 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3i4k s GLN 343 N 0.00 -0.12 0.32 5.55 1.11 -1.26 -5.09 119.66 120.17 3i4k s GLN 343 Ca 0.00 0.07 0.11 0.00 0.01 0.00 0.00 55.36 55.54 3i4k s GLN 343 Cb 0.00 -1.71 -0.06 0.00 -1.01 0.00 0.00 33.01 30.23 3i4k s GLN 343 CO 0.00 -3.00 -0.14 -1.21 0.01 0.00 0.00 175.29 170.95 3i4k s GLU 344 N -5.36 1.76 -0.16 2.91 2.02 -1.26 -5.03 118.70 113.57 3i4k s GLU 344 Ca 0.69 -1.87 -0.10 0.00 0.02 0.00 0.00 54.97 53.71 3i4k s GLU 344 Cb -0.12 -1.73 -0.05 0.00 0.10 0.00 0.00 34.13 32.34 3i4k s GLU 344 CO 0.55 0.22 0.18 -0.06 0.02 0.00 0.00 175.26 176.17 3i4k s PHE 345 N -2.57 3.48 -0.96 1.61 0.08 -1.26 -5.04 117.98 113.32 3i4k s PHE 345 Ca 0.31 0.47 -0.21 0.00 0.12 0.00 0.00 56.93 57.62 3i4k s PHE 345 Cb -0.01 -2.15 0.09 0.00 -0.57 0.00 0.00 43.02 40.38 3i4k s PHE 345 CO 0.16 0.41 1.28 -1.21 -0.10 0.00 0.00 175.22 175.75 3i4k s GLU 346 N -0.03 3.57 -0.42 0.44 2.02 -1.26 -4.98 118.70 118.04 3i4k s GLU 346 Ca 0.12 -1.40 -0.16 0.00 0.02 0.00 0.00 54.97 53.55 3i4k s GLU 346 Cb -0.12 -5.10 0.02 0.00 0.10 0.00 0.00 34.13 29.04 3i4k s GLU 346 CO 0.01 -1.99 0.36 0.71 0.02 0.00 0.00 175.26 174.38 3i4k s TYR 347 N 3.88 3.21 -0.20 1.61 2.02 -1.26 -2.50 117.35 124.10 3i4k s TYR 347 Ca 0.39 -0.53 -0.19 0.00 -0.37 0.00 0.00 57.07 56.37 3i4k s TYR 347 Cb -0.03 -2.76 0.05 0.00 -0.40 0.00 0.00 41.96 38.83 3i4k s TYR 347 CO -0.09 -0.65 0.55 -1.59 -1.57 0.00 0.00 175.55 172.20 3i4k s LYS 348 N 1.87 0.65 -0.97 -0.62 -2.85 -0.28 -4.90 119.74 112.63 3i4k s LYS 348 Ca 0.08 0.75 -0.03 0.00 -1.00 0.00 0.00 55.97 55.77 3i4k s LYS 348 Cb -0.19 0.32 0.00 0.00 -2.06 0.00 0.00 37.83 35.90 3i4k s LYS 348 CO 0.11 -0.08 0.83 -0.25 0.10 0.00 0.00 175.35 176.06 3i4k n ASP 349 N 2.75 -3.38 -1.96 0.03 8.00 -0.77 -2.71 116.55 118.50 3i4k n ASP 349 Ca -0.14 -0.45 -0.21 0.00 0.71 0.00 0.00 54.79 54.70 3i4k n ASP 349 Cb 0.56 -4.03 -0.05 0.00 -0.02 0.00 0.00 41.12 37.58 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 -1.33 0.84 3.27 0.44 0.00 0.26 -4.83 105.19 103.84 3i4k n GLY 350 Ca -0.13 -0.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 3i4k n GLY 350 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3i4k s GLN 351 N -4.36 1.23 -0.02 1.61 -0.21 -1.10 -1.59 119.66 115.21 3i4k s GLN 351 Ca 0.00 -1.52 0.01 0.00 0.02 0.00 0.00 55.36 53.87 3i4k s GLN 351 Cb 0.00 0.31 0.02 0.00 1.00 0.00 0.00 33.01 34.33 3i4k s GLN 351 CO 0.00 -0.42 -0.02 0.54 -2.12 0.00 0.00 175.29 173.26 3i4k s VAL 352 N -4.11 0.32 0.50 1.09 0.11 -0.75 -1.12 120.40 116.44 3i4k s VAL 352 Ca 0.33 -0.05 -0.19 0.00 -2.93 0.00 0.00 61.98 59.13 3i4k s VAL 352 Cb 0.06 -0.35 -0.08 0.00 -1.53 0.00 0.00 36.38 34.47 3i4k s VAL 352 CO 0.10 0.15 1.03 0.00 -3.33 0.00 0.00 175.10 173.05 3i4k s ALA 353 N 0.64 2.87 -0.04 1.54 0.00 -1.04 -2.27 121.76 123.46 3i4k s ALA 353 Ca -0.07 0.55 -0.30 0.00 0.00 0.00 0.00 51.96 52.14 3i4k s ALA 353 Cb -0.10 -3.24 -0.02 0.00 0.00 0.00 0.00 23.12 19.75 3i4k s ALA 353 CO -0.01 -0.36 0.98 0.42 0.00 0.00 0.00 175.76 176.79 3i4k s ILE 354 N -2.08 4.85 -0.26 0.00 1.09 -0.85 -4.73 121.20 119.21 3i4k s ILE 354 Ca 0.66 2.03 -0.32 0.00 -1.10 0.00 0.00 60.65 61.92 3i4k s ILE 354 Cb -0.16 -4.31 -0.09 0.00 -1.06 0.00 0.00 42.46 36.84 3i4k s ILE 354 CO 0.22 0.11 2.16 -2.65 -0.10 0.00 0.00 174.94 174.68 3i4k n PRO 355 N 4.29 1.57 -2.90 2.79 -0.02 -1.26 -4.96 135.00 134.52 3i4k n PRO 355 Ca 0.07 0.46 -0.33 0.00 -2.02 0.00 0.00 63.50 61.68 3i4k n PRO 355 Cb 0.50 -2.78 -0.06 0.00 -0.02 0.00 0.00 33.50 31.14 3i4k n PRO 355 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3i4k s GLN 356 N 5.94 4.12 0.00 -0.52 -1.52 -1.26 -4.49 119.66 121.92 3i4k s GLN 356 Ca 1.04 0.93 0.00 0.00 -1.95 0.00 0.00 55.36 55.38 3i4k s GLN 356 Cb -0.64 -2.27 0.00 0.00 -0.22 0.00 0.00 33.01 29.88 3i4k s GLN 356 CO 0.44 0.02 0.00 0.41 -0.25 0.00 0.00 175.29 175.91 3i4k n GLY 357 N -0.64 2.71 3.59 3.09 0.00 -1.26 -4.67 105.19 108.00 3i4k n GLY 357 Ca 0.06 -2.11 -0.29 0.00 0.00 0.00 0.00 46.02 43.68 3i4k n GLY 357 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3i4k s PRO 358 N -2.25 -0.05 3.00 1.61 0.04 -1.26 -3.92 135.00 132.18 3i4k s PRO 358 Ca 0.00 0.85 0.00 0.00 0.04 0.00 0.00 61.00 61.89 3i4k s PRO 358 Cb 0.00 -1.65 0.00 0.00 0.04 0.00 0.00 34.50 32.89 3i4k s PRO 358 CO 0.00 -3.14 0.00 0.41 0.04 0.00 0.00 177.00 174.31 3i4k n GLY 359 N -0.01 1.14 0.00 0.56 0.00 -1.02 -0.32 105.19 105.55 3i4k n GLY 359 Ca 0.05 -0.57 0.04 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.32 0.99 7.99 -1.26 -1.96 117.00 122.43 3i4k n LEU 360 Ca 0.00 0.25 -0.04 0.00 -0.01 0.00 0.00 56.01 56.21 3i4k n LEU 360 Cb 0.00 -0.25 -0.01 0.00 -0.11 0.00 0.00 43.42 43.05 3i4k n LEU 360 CO 0.00 -0.18 -0.04 0.61 -1.51 0.00 0.00 177.39 176.27 3i4k n GLY 361 N -0.58 0.50 3.34 -0.72 0.00 0.56 -4.74 105.19 103.54 3i4k n GLY 361 Ca 0.04 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.22 -0.08 1.61 0.11 -1.26 -4.41 120.40 114.00 3i4k s VAL 362 Ca 0.00 0.09 -0.11 0.00 -2.93 0.00 0.00 61.98 59.04 3i4k s VAL 362 Cb 0.00 -0.70 -0.05 0.00 -1.53 0.00 0.00 36.38 34.10 3i4k s VAL 362 CO 0.00 0.04 0.25 -1.81 -3.33 0.00 0.00 175.10 170.25 3i4k s ASP 363 N 1.81 6.54 0.38 3.54 -0.00 -1.25 -5.04 116.67 122.65 3i4k s ASP 363 Ca -0.07 0.64 -0.24 0.00 -0.00 0.00 0.00 52.55 52.88 3i4k s ASP 363 Cb -0.09 -2.15 -0.09 0.00 -0.00 0.00 0.00 42.92 40.59 3i4k s ASP 363 CO -0.14 0.33 1.02 0.68 -0.00 0.00 0.00 175.17 177.06 3i4k s VAL 364 N -0.81 3.88 0.53 -1.27 -7.23 -1.26 -3.12 120.40 111.12 3i4k s VAL 364 Ca 0.18 1.44 0.07 0.00 -1.81 0.00 0.00 61.98 61.86 3i4k s VAL 364 Cb -0.14 -3.75 0.04 0.00 0.56 0.00 0.00 36.38 33.10 3i4k s VAL 364 CO 0.07 0.01 0.51 -0.62 -0.31 0.00 0.00 175.10 174.76 3i4k s ASP 365 N -1.62 4.82 0.00 4.85 -1.08 -0.80 -4.80 116.67 118.05 3i4k s ASP 365 Ca 0.56 -1.06 0.00 0.00 -0.52 0.00 0.00 52.55 51.53 3i4k s ASP 365 Cb -0.20 0.24 0.00 0.00 -1.46 0.00 0.00 42.92 41.50 3i4k s ASP 365 CO 0.26 -1.10 0.00 0.47 0.52 0.00 0.00 175.17 175.31 3i4k n ASP 367 N -1.86 0.00 -0.13 -0.34 8.00 -1.26 -1.53 116.55 119.42 3i4k n ASP 367 Ca 0.04 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.43 3i4k n ASP 367 Cb 0.63 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.72 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 0.69 0.04 -1.24 1.79 -1.91 -0.74 116.57 115.20 3i4k h LYS 368 Ca 0.00 -0.22 0.01 0.00 -2.18 0.00 0.00 60.65 58.26 3i4k h LYS 368 Cb 0.00 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.58 3i4k h LYS 368 CO 0.00 0.79 -0.08 0.28 -1.08 0.00 0.00 179.45 179.35 3i4k h VAL 369 N 0.52 0.80 -0.51 0.50 2.07 -1.57 -2.39 116.25 115.67 3i4k h VAL 369 Ca 0.11 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.67 3i4k h VAL 369 Cb 0.48 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 3i4k h VAL 369 CO 0.02 0.00 0.28 0.78 0.02 0.00 0.00 177.57 178.67 3i4k h ASN 370 N -0.17 0.43 -0.33 0.57 -0.26 -1.82 -0.55 115.58 113.46 3i4k h ASN 370 Ca 0.02 0.02 0.10 0.00 -0.56 0.00 0.00 56.30 55.87 3i4k h ASN 370 Cb 0.18 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 3i4k h ASN 370 CO -0.05 0.30 0.25 0.15 -1.06 0.00 0.00 177.43 177.02 3i4k h PHE 371 N 0.55 0.00 -0.02 1.19 3.57 -0.81 -2.45 116.94 118.98 3i4k h PHE 371 Ca 0.22 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.72 3i4k h PHE 371 Cb 0.08 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.82 3i4k h PHE 371 CO -0.08 0.00 -0.04 0.66 -2.23 0.00 0.00 178.31 176.61 3i4k n TYR 372 N -4.34 0.00 -2.07 0.41 4.01 -0.77 -5.00 117.16 109.39 3i4k n TYR 372 Ca 0.05 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.43 3i4k n TYR 372 Cb 0.42 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.47 3i4k n TYR 372 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3i4k s THR 373 N -1.37 2.74 -2.63 -0.72 2.01 -0.28 -1.49 115.64 113.89 3i4k s THR 373 Ca 0.17 0.48 0.27 0.00 0.31 0.00 0.00 61.69 62.92 3i4k s THR 373 Cb 0.13 -3.21 0.46 0.00 0.01 0.00 0.00 72.50 69.89 3i4k s THR 373 CO 0.22 -0.08 1.62 -1.14 -0.69 0.00 0.00 174.62 174.55