#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n9k s PRO 5 N 0.00 3.59 0.34 1.43 0.04 -1.26 -4.94 135.00 134.20 1n9k s PRO 5 Ca 0.00 2.15 0.02 0.00 0.04 0.00 0.00 61.00 63.21 1n9k s PRO 5 Cb 0.00 -2.49 0.59 0.00 0.04 0.00 0.00 34.50 32.64 1n9k s PRO 5 CO 0.00 -0.80 1.95 1.25 0.04 0.00 0.00 177.00 179.43 1n9k h LEU 6 N 2.06 0.67 -7.06 -3.56 5.85 -2.13 -3.33 115.31 107.81 1n9k h LEU 6 Ca -0.50 -0.06 -0.62 0.00 0.84 0.00 0.00 57.88 57.54 1n9k h LEU 6 Cb 1.27 -0.17 -0.41 0.00 0.37 0.00 0.00 40.66 41.72 1n9k h LEU 6 CO 0.60 0.57 -0.68 0.20 -0.34 0.00 0.00 178.44 178.79 1n9k s ASN 7 N -6.57 3.97 0.43 1.25 0.01 -1.26 -4.96 114.94 107.81 1n9k s ASN 7 Ca -0.09 -3.16 0.28 0.00 -0.71 0.00 0.00 52.86 49.17 1n9k s ASN 7 Cb 0.17 -1.33 0.91 0.00 0.41 0.00 0.00 41.25 41.41 1n9k s ASN 7 CO 0.77 -0.19 1.80 1.55 -1.51 0.00 0.00 177.10 179.52 1n9k h PRO 8 N 6.14 0.00 0.00 -0.60 0.13 -1.98 -3.49 132.00 132.20 1n9k h PRO 8 Ca 0.05 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 65.40 1n9k h PRO 8 Cb 0.86 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.94 1n9k h PRO 8 CO 0.60 0.00 -0.29 0.41 -0.23 0.00 0.00 178.00 178.49 1n9k n GLY 9 N 0.53 -1.71 1.53 1.56 0.00 -1.26 -5.04 105.19 100.81 1n9k n GLY 9 Ca 0.02 -1.18 -0.05 0.00 0.00 0.00 0.00 46.02 44.82 1n9k n GLY 9 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1n9k n THR 10 N -3.00 0.00 -3.83 2.61 5.66 -1.26 -5.19 114.28 109.26 1n9k n THR 10 Ca 0.01 -0.54 -0.09 0.00 -3.05 0.00 0.00 64.05 60.37 1n9k n THR 10 Cb 0.37 0.44 -0.05 0.00 -1.55 0.00 0.00 70.33 69.53 1n9k n THR 10 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1n9k s ASN 11 N -1.89 -0.14 0.21 1.09 2.20 -1.26 -5.06 114.94 110.08 1n9k s ASN 11 Ca 0.09 -0.65 0.25 0.00 -0.94 0.00 0.00 52.86 51.61 1n9k s ASN 11 Cb -0.01 0.53 0.89 0.00 -2.00 0.00 0.00 41.25 40.65 1n9k s ASN 11 CO 0.06 -1.00 1.76 0.55 -2.94 0.00 0.00 177.10 175.53 1n9k n VAL 12 N -0.30 0.64 -0.11 3.54 3.14 -1.26 -1.83 118.33 122.15 1n9k n VAL 12 Ca -0.09 -0.10 -0.10 0.00 -2.96 0.00 0.00 64.34 61.10 1n9k n VAL 12 Cb 0.63 -0.77 -0.02 0.00 -1.06 0.00 0.00 33.84 32.62 1n9k n VAL 12 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1n9k h ALA 13 N 2.48 0.44 -0.25 1.55 0.00 -1.98 -2.70 119.26 118.79 1n9k h ALA 13 Ca 0.00 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 1n9k h ALA 13 Cb 0.60 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1n9k h ALA 13 CO 0.00 0.04 -0.49 0.00 0.00 0.00 0.00 179.25 178.80 1n9k h ARG 14 N 0.39 0.70 -0.48 0.00 2.47 -1.83 -1.24 114.38 114.38 1n9k h ARG 14 Ca 0.11 -0.41 -0.04 0.00 -1.26 0.00 0.00 59.98 58.38 1n9k h ARG 14 Cb 0.20 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.53 1n9k h ARG 14 CO -0.01 1.03 0.14 -0.07 0.56 0.00 0.00 179.97 181.61 1n9k h LEU 15 N 0.55 0.66 -0.28 3.04 3.38 -1.37 -2.53 115.31 118.76 1n9k h LEU 15 Ca 0.03 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1n9k h LEU 15 Cb 1.05 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1n9k h LEU 15 CO 0.10 0.64 -0.60 0.00 0.09 0.00 0.00 178.44 178.67 1n9k n ALA 16 N -2.46 3.84 -1.72 1.53 0.00 -1.02 -4.99 120.51 115.68 1n9k n ALA 16 Ca 0.03 -0.49 -0.43 0.00 0.00 0.00 0.00 53.44 52.56 1n9k n ALA 16 Cb 0.20 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.67 1n9k n ALA 16 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1n9k n GLU 17 N -1.07 2.56 -5.25 0.00 2.13 -0.48 -4.99 120.64 113.54 1n9k n GLU 17 Ca 0.07 0.91 -0.31 0.00 0.66 0.00 0.00 57.16 58.49 1n9k n GLU 17 Cb 0.36 -2.68 -0.16 0.00 0.27 0.00 0.00 31.44 29.23 1n9k n GLU 17 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 1n9k s GLN 18 N -0.21 2.37 0.38 5.31 -1.52 -1.26 -5.05 119.66 119.68 1n9k s GLN 18 Ca 0.67 -0.90 -0.24 0.00 -1.95 0.00 0.00 55.36 52.94 1n9k s GLN 18 Cb -0.53 -2.13 -0.09 0.00 -0.22 0.00 0.00 33.01 30.03 1n9k s GLN 18 CO 0.46 0.48 1.03 0.00 -0.25 0.00 0.00 175.29 177.01 1n9k s ALA 19 N -0.39 3.12 -1.29 6.09 0.00 -1.26 -4.95 121.76 123.07 1n9k s ALA 19 Ca 0.03 0.66 -0.18 0.00 0.00 0.00 0.00 51.96 52.48 1n9k s ALA 19 Cb -0.12 -3.25 0.07 0.00 0.00 0.00 0.00 23.12 19.82 1n9k s ALA 19 CO 0.01 -0.13 1.73 -1.25 0.00 0.00 0.00 175.76 176.12 1n9k s PRO 20 N -2.42 3.96 -0.11 0.00 0.04 -1.26 -4.92 135.00 130.29 1n9k s PRO 20 Ca 0.56 -1.96 -0.04 0.00 0.04 0.00 0.00 61.00 59.60 1n9k s PRO 20 Cb -0.21 -5.53 -0.04 0.00 0.04 0.00 0.00 34.50 28.76 1n9k s PRO 20 CO 0.27 -2.27 0.04 0.42 0.04 0.00 0.00 177.00 175.50 1n9k s ILE 21 N 4.31 4.68 -1.06 0.56 -1.09 -1.26 -5.03 121.20 122.32 1n9k s ILE 21 Ca 0.54 -0.10 -0.22 0.00 -2.23 0.00 0.00 60.65 58.63 1n9k s ILE 21 Cb 0.04 -3.01 0.05 0.00 -1.58 0.00 0.00 42.46 37.96 1n9k s ILE 21 CO 0.07 0.59 1.52 -2.28 -1.23 0.00 0.00 174.94 173.61 1n9k s HIS 22 N -0.76 2.53 0.32 3.97 5.65 -1.26 -5.01 115.29 120.73 1n9k s HIS 22 Ca 0.12 -0.88 -0.25 0.00 0.25 0.00 0.00 55.06 54.30 1n9k s HIS 22 Cb -0.12 -4.67 -0.10 0.00 -1.18 0.00 0.00 32.58 26.51 1n9k s HIS 22 CO 0.03 -1.91 0.93 -1.58 -0.65 0.00 0.00 174.74 171.56 1n9k s TRP 23 N 5.15 3.67 0.08 3.88 0.52 -1.26 -0.72 118.94 130.26 1n9k s TRP 23 Ca 0.48 1.75 0.02 0.00 0.02 0.00 0.00 56.10 58.38 1n9k s TRP 23 Cb 0.00 -2.90 -0.04 0.00 -1.15 0.00 0.00 33.47 29.38 1n9k s TRP 23 CO -0.07 0.20 -0.07 0.14 0.02 0.00 0.00 176.95 177.18 1n9k s VAL 24 N -1.64 0.65 0.33 4.03 -7.23 0.14 -4.86 120.40 111.83 1n9k s VAL 24 Ca 0.50 -1.69 0.07 0.00 -1.81 0.00 0.00 61.98 59.05 1n9k s VAL 24 Cb -0.18 -1.38 -0.01 0.00 0.56 0.00 0.00 36.38 35.37 1n9k s VAL 24 CO 0.23 -0.73 0.42 -0.94 -0.31 0.00 0.00 175.10 173.77 1n9k s SER 25 N -2.63 5.85 0.20 4.85 1.04 -1.26 -1.67 113.70 120.08 1n9k s SER 25 Ca 0.06 -0.24 -0.10 0.00 0.48 0.00 0.00 55.95 56.15 1n9k s SER 25 Cb 0.01 -1.21 0.25 0.00 0.10 0.00 0.00 66.02 65.17 1n9k s SER 25 CO -0.03 -0.39 1.76 0.58 0.98 0.00 0.00 173.24 176.13 1n9k h VAL 26 N 0.99 0.82 -0.54 5.02 2.07 -1.99 -1.89 116.25 120.73 1n9k h VAL 26 Ca -0.46 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 1n9k h VAL 26 Cb 1.25 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 1n9k h VAL 26 CO 0.54 0.08 0.33 0.00 0.02 0.00 0.00 177.57 178.55 1n9k h ALA 27 N 1.39 0.69 -0.80 1.67 0.00 -1.99 0.27 119.26 120.49 1n9k h ALA 27 Ca 0.29 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1n9k h ALA 27 Cb 0.32 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1n9k h ALA 27 CO -0.27 0.18 0.42 1.96 0.00 0.00 0.00 179.25 181.54 1n9k h GLN 28 N 0.73 1.12 -0.15 0.00 4.20 -1.88 0.52 115.11 119.65 1n9k h GLN 28 Ca 0.20 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 1n9k h GLN 28 Cb -0.02 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.54 1n9k h GLN 28 CO -0.04 0.83 0.05 0.82 -0.67 0.00 0.00 178.83 179.83 1n9k h ILE 29 N 1.12 1.17 -0.36 2.54 2.04 -0.70 0.57 117.51 123.90 1n9k h ILE 29 Ca 0.28 -0.53 0.01 0.00 1.00 0.00 0.00 64.86 65.62 1n9k h ILE 29 Cb 0.05 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1n9k h ILE 29 CO -0.04 0.16 0.21 -0.08 0.00 0.00 0.00 178.15 178.40 1n9k h GLU 30 N 0.07 0.42 -0.75 2.37 4.81 -0.65 -0.52 114.58 120.33 1n9k h GLU 30 Ca 0.05 -0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.37 1n9k h GLU 30 Cb 0.21 -0.10 -0.08 0.00 0.63 0.00 0.00 28.75 29.41 1n9k h GLU 30 CO -0.00 0.28 0.37 -0.97 -0.73 0.00 0.00 179.01 177.96 1n9k h ASN 31 N 0.44 0.45 0.51 1.04 -0.73 -0.76 -0.80 115.58 115.73 1n9k h ASN 31 Ca 0.14 0.07 -0.01 0.00 1.87 0.00 0.00 56.30 58.38 1n9k h ASN 31 Cb 0.00 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.59 1n9k h ASN 31 CO -0.07 0.24 -0.06 0.77 -0.37 0.00 0.00 177.43 177.94 1n9k h SER 32 N 0.59 0.00 0.07 1.15 4.64 0.75 -2.30 113.55 118.45 1n9k h SER 32 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1n9k h SER 32 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1n9k h SER 32 CO -0.31 0.06 -0.20 0.18 -0.87 0.00 0.00 176.83 175.69 1n9k n LEU 33 N -3.32 1.73 -4.73 5.97 4.77 -0.34 -4.99 117.00 116.09 1n9k n LEU 33 Ca -0.01 -0.57 -0.42 0.00 -0.03 0.00 0.00 56.01 54.98 1n9k n LEU 33 Cb 0.23 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1n9k n LEU 33 CO 0.27 0.31 1.28 0.00 -1.33 0.00 0.00 177.39 177.91 1n9k n ALA 34 N 0.06 2.54 -1.13 -1.18 0.00 -0.87 -0.17 120.51 119.76 1n9k n ALA 34 Ca 0.14 0.39 -0.05 0.00 0.00 0.00 0.00 53.44 53.92 1n9k n ALA 34 Cb 0.42 -2.47 -0.02 0.00 0.00 0.00 0.00 19.45 17.38 1n9k n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n9k n GLY 35 N 2.84 0.55 3.75 0.00 0.00 -1.26 -5.00 105.19 106.07 1n9k n GLY 35 Ca 0.12 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1n9k n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n9k s ARG 36 N -2.04 4.53 0.79 1.61 0.52 0.76 -5.06 118.95 120.06 1n9k s ARG 36 Ca 0.00 1.12 -0.11 0.00 -0.52 0.00 0.00 55.73 56.22 1n9k s ARG 36 Cb 0.00 -3.35 0.07 0.00 0.52 0.00 0.00 34.95 32.18 1n9k s ARG 36 CO 0.00 0.30 1.11 -1.25 0.02 0.00 0.00 175.30 175.48 1n9k s PRO 37 N -0.16 2.05 0.10 3.54 0.04 -1.26 -4.94 135.00 134.38 1n9k s PRO 37 Ca 0.39 1.29 -0.28 0.00 0.04 0.00 0.00 61.00 62.44 1n9k s PRO 37 Cb -0.21 -1.87 -0.16 0.00 0.04 0.00 0.00 34.50 32.31 1n9k s PRO 37 CO 0.24 -1.81 0.64 -2.30 0.04 0.00 0.00 177.00 173.80 1n9k n PRO 38 N -3.53 0.00 -4.15 0.56 -0.02 -1.26 -4.98 135.00 121.62 1n9k n PRO 38 Ca 0.10 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.47 1n9k n PRO 38 Cb 0.53 -1.03 -0.09 0.00 -0.02 0.00 0.00 33.50 32.88 1n9k n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n9k s MET 39 N -0.51 1.29 -0.12 -0.52 0.23 -1.26 -4.98 119.30 113.43 1n9k s MET 39 Ca 0.64 -1.54 -0.16 0.00 -1.03 0.00 0.00 55.69 53.60 1n9k s MET 39 Cb -0.92 0.32 -0.05 0.00 -1.53 0.00 0.00 34.83 32.66 1n9k s MET 39 CO 0.49 -0.45 0.41 0.00 -2.03 0.00 0.00 175.02 173.43 1n9k s ALA 40 N -4.12 3.54 0.08 3.16 0.00 -1.26 0.72 121.76 123.88 1n9k s ALA 40 Ca 0.35 -0.28 0.01 0.00 0.00 0.00 0.00 51.96 52.04 1n9k s ALA 40 Cb 0.05 -2.53 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 1n9k s ALA 40 CO 0.11 0.09 -0.06 0.14 0.00 0.00 0.00 175.76 176.04 1n9k s VAL 41 N 0.36 0.57 0.05 0.00 -7.23 -0.40 -0.10 120.40 113.65 1n9k s VAL 41 Ca 0.23 -1.76 -0.02 0.00 -1.81 0.00 0.00 61.98 58.62 1n9k s VAL 41 Cb -0.15 -1.46 -0.03 0.00 0.56 0.00 0.00 36.38 35.31 1n9k s VAL 41 CO 0.09 -0.81 -0.00 -0.83 -0.31 0.00 0.00 175.10 173.23 1n9k s GLY 42 N -2.76 0.39 -0.04 2.32 0.00 0.09 -0.98 107.32 106.34 1n9k s GLY 42 Ca 0.07 -1.05 0.01 0.00 0.00 0.00 0.00 44.72 43.75 1n9k s GLY 42 CO -0.05 -1.17 -0.05 -1.36 0.00 0.00 0.00 173.10 170.48 1n9k s PHE 43 N -3.59 0.76 1.00 1.90 0.08 0.54 -1.13 117.98 117.54 1n9k s PHE 43 Ca 0.04 -0.21 -0.11 0.00 0.12 0.00 0.00 56.93 56.77 1n9k s PHE 43 Cb 0.05 -0.66 0.19 0.00 -0.57 0.00 0.00 43.02 42.04 1n9k s PHE 43 CO -0.09 -0.18 1.11 0.34 -0.10 0.00 0.00 175.22 176.30 1n9k s ASP 44 N 0.82 2.27 -0.18 1.36 2.15 -0.50 -1.13 116.67 121.46 1n9k s ASP 44 Ca -0.11 1.99 -0.16 0.00 0.43 0.00 0.00 52.55 54.70 1n9k s ASP 44 Cb -0.14 -2.49 -0.07 0.00 -0.30 0.00 0.00 42.92 39.92 1n9k s ASP 44 CO 0.00 -3.48 -0.33 -0.38 -0.17 0.00 0.00 175.17 170.82 1n9k n ILE 45 N -4.47 1.48 -2.72 4.11 5.41 -1.26 -4.12 119.36 117.78 1n9k n ILE 45 Ca 0.09 0.07 -0.42 0.00 1.00 0.00 0.00 62.75 63.49 1n9k n ILE 45 Cb 0.53 -2.23 -0.03 0.00 -0.71 0.00 0.00 39.64 37.20 1n9k n ILE 45 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1n9k s ASP 46 N -6.15 7.11 0.00 4.38 1.01 -1.26 -1.06 116.67 120.70 1n9k s ASP 46 Ca -0.29 1.37 0.00 0.00 0.71 0.00 0.00 52.55 54.35 1n9k s ASP 46 Cb 0.05 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.46 1n9k s ASP 46 CO 0.41 -0.54 0.00 0.47 0.21 0.00 0.00 175.17 175.72 1n9k n ASP 47 N 5.69 -2.86 -0.09 0.27 8.00 0.65 -4.77 116.55 123.43 1n9k n ASP 47 Ca 0.09 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.42 1n9k n ASP 47 Cb 0.47 -2.06 -0.06 0.00 -0.02 0.00 0.00 41.12 39.46 1n9k n ASP 47 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1n9k n THR 48 N -2.21 1.22 -0.01 -3.53 -1.04 -0.92 -4.48 114.28 103.31 1n9k n THR 48 Ca 0.00 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 1n9k n THR 48 Cb 0.18 -1.89 -0.02 0.00 -1.82 0.00 0.00 70.33 66.78 1n9k n THR 48 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1n9k n VAL 49 N -4.01 0.08 -4.63 12.58 0.24 -0.22 -4.61 118.33 117.77 1n9k n VAL 49 Ca -0.31 -0.09 -0.29 0.00 -2.04 0.00 0.00 64.34 61.61 1n9k n VAL 49 Cb 0.66 -0.10 -0.17 0.00 -1.47 0.00 0.00 33.84 32.76 1n9k n VAL 49 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1n9k s LEU 50 N -3.61 1.81 -0.95 1.34 1.43 -0.79 -0.52 118.68 117.38 1n9k s LEU 50 Ca -0.01 -0.44 -0.24 0.00 -1.03 0.00 0.00 54.13 52.40 1n9k s LEU 50 Cb 0.02 -1.13 0.05 0.00 0.03 0.00 0.00 46.19 45.15 1n9k s LEU 50 CO 0.13 0.05 1.40 0.12 0.23 0.00 0.00 176.35 178.28 1n9k s PHE 51 N 0.81 2.49 -2.37 0.29 5.36 0.32 -0.26 117.98 124.63 1n9k s PHE 51 Ca -0.10 -0.67 0.22 0.00 -0.96 0.00 0.00 56.93 55.42 1n9k s PHE 51 Cb -0.16 -4.67 0.50 0.00 -0.34 0.00 0.00 43.02 38.35 1n9k s PHE 51 CO 0.01 -1.96 1.44 -1.13 -1.46 0.00 0.00 175.22 172.12 1n9k n SER 52 N 8.93 3.20 -0.34 6.13 3.41 -1.26 -0.72 113.62 132.96 1n9k n SER 52 Ca 0.26 -1.95 0.30 0.00 -0.26 0.00 0.00 58.87 57.21 1n9k n SER 52 Cb 0.50 -0.26 0.62 0.00 -0.26 0.00 0.00 64.21 64.81 1n9k n SER 52 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1n9k h SER 53 N 4.02 0.25 0.13 4.04 0.02 -1.94 -2.89 113.55 117.17 1n9k h SER 53 Ca 0.00 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1n9k h SER 53 Cb 0.89 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 1n9k h SER 53 CO 0.00 0.02 -0.14 -0.65 -1.14 0.00 0.00 176.83 174.92 1n9k h PRO 54 N 0.20 -0.29 -0.25 3.45 0.11 -1.86 0.46 132.00 133.83 1n9k h PRO 54 Ca 0.62 0.02 0.06 0.00 0.11 0.00 0.00 66.00 66.81 1n9k h PRO 54 Cb 1.96 0.07 -0.06 0.00 0.11 0.00 0.00 31.00 33.08 1n9k h PRO 54 CO -0.20 -0.19 -0.15 0.78 -0.21 0.00 0.00 178.00 178.03 1n9k h GLY 55 N -0.30 0.04 1.26 -0.55 0.00 -1.77 0.36 103.07 102.11 1n9k h GLY 55 Ca 0.01 0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.49 1n9k h GLY 55 CO -0.05 -0.16 0.28 0.74 0.00 0.00 0.00 176.54 177.35 1n9k h PHE 56 N -0.13 0.96 -0.28 5.60 0.04 -1.29 0.13 116.94 121.97 1n9k h PHE 56 Ca 0.14 -0.05 -0.07 0.00 2.80 0.00 0.00 57.97 60.78 1n9k h PHE 56 Cb 0.34 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 1n9k h PHE 56 CO -0.32 0.72 -0.10 2.35 -0.60 0.00 0.00 178.31 180.35 1n9k h TRP 57 N 0.94 0.64 -0.56 -0.55 2.91 0.16 0.18 115.95 119.67 1n9k h TRP 57 Ca 0.22 -0.15 -0.01 0.00 1.13 0.00 0.00 58.89 60.09 1n9k h TRP 57 Cb 0.16 -0.15 -0.03 0.00 -0.51 0.00 0.00 29.16 28.63 1n9k h TRP 57 CO 0.01 0.79 0.32 -0.09 -1.03 0.00 0.00 178.44 178.44 1n9k h ARG 58 N 0.31 0.76 -0.09 2.65 2.43 0.03 -2.18 114.38 118.30 1n9k h ARG 58 Ca 0.07 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.20 1n9k h ARG 58 Cb 0.60 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 29.94 1n9k h ARG 58 CO 0.03 0.57 -0.26 0.78 -1.51 0.00 0.00 179.97 179.58 1n9k h GLY 59 N 0.75 -0.33 0.88 2.80 0.00 -0.61 0.07 103.07 106.63 1n9k h GLY 59 Ca 0.20 0.32 0.02 0.00 0.00 0.00 0.00 47.33 47.86 1n9k h GLY 59 CO -0.03 -0.21 0.14 1.70 0.00 0.00 0.00 176.54 178.14 1n9k h LYS 60 N -0.35 0.29 -0.60 4.80 3.64 -0.53 0.42 116.57 124.23 1n9k h LYS 60 Ca 0.09 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1n9k h LYS 60 Cb 0.48 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 1n9k h LYS 60 CO -0.29 0.19 0.16 0.87 -2.27 0.00 0.00 179.45 178.11 1n9k h LYS 61 N 0.30 0.96 -0.31 1.90 1.57 -1.08 -0.21 116.57 119.70 1n9k h LYS 61 Ca 0.12 -0.22 -0.16 0.00 -1.87 0.00 0.00 60.65 58.51 1n9k h LYS 61 Cb 0.03 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1n9k h LYS 61 CO -0.08 0.87 -0.44 1.15 -0.57 0.00 0.00 179.45 180.39 1n9k h THR 62 N 0.87 1.29 0.00 -0.16 2.02 -0.67 -3.37 112.91 112.88 1n9k h THR 62 Ca 0.19 -1.62 -0.18 0.00 0.77 0.00 0.00 66.41 65.57 1n9k h THR 62 Cb 0.33 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.22 1n9k h THR 62 CO -0.00 0.53 -1.69 0.49 0.37 0.00 0.00 175.52 175.22 1n9k n PHE 63 N -4.03 0.00 -2.90 3.16 3.72 0.11 -4.89 117.46 112.64 1n9k n PHE 63 Ca -0.02 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.25 1n9k n PHE 63 Cb 0.56 -0.49 0.02 0.00 -0.94 0.00 0.00 39.48 38.63 1n9k n PHE 63 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1n9k n SER 64 N -2.43 -1.56 0.33 4.37 3.41 -0.16 -4.77 113.62 112.80 1n9k n SER 64 Ca -0.17 -3.25 0.17 0.00 -0.26 0.00 0.00 58.87 55.36 1n9k n SER 64 Cb 0.81 0.99 0.88 0.00 -0.26 0.00 0.00 64.21 66.64 1n9k n SER 64 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1n9k h PRO 65 N 3.57 0.00 -0.01 4.33 0.13 -1.53 -1.80 132.00 136.69 1n9k h PRO 65 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1n9k h PRO 65 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1n9k h PRO 65 CO 0.33 0.00 -0.02 0.39 -0.23 0.00 0.00 178.00 178.47 1n9k n GLU 66 N -2.96 0.54 -1.84 0.86 -0.58 -1.26 -4.97 120.64 110.44 1n9k n GLU 66 Ca -0.02 -1.05 -0.00 0.00 -0.42 0.00 0.00 57.16 55.66 1n9k n GLU 66 Cb 0.34 -1.18 -0.00 0.00 -0.57 0.00 0.00 31.44 30.03 1n9k n GLU 66 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1n9k n SER 67 N 0.49 -0.03 -1.94 1.62 3.41 -0.68 -5.04 113.62 111.46 1n9k n SER 67 Ca 0.06 -1.05 -0.19 0.00 -0.26 0.00 0.00 58.87 57.43 1n9k n SER 67 Cb 0.25 0.05 0.18 0.00 -0.26 0.00 0.00 64.21 64.43 1n9k n SER 67 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1n9k n GLU 68 N -0.01 2.15 0.13 4.33 -0.58 -1.26 -4.66 120.64 120.73 1n9k n GLU 68 Ca 0.00 -3.07 0.02 0.00 -0.42 0.00 0.00 57.16 53.69 1n9k n GLU 68 Cb 0.01 -2.08 0.02 0.00 -0.57 0.00 0.00 31.44 28.82 1n9k n GLU 68 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 1n9k h ASP 69 N 1.02 0.00 -0.78 1.62 3.32 -1.95 -3.14 116.42 116.51 1n9k h ASP 69 Ca 0.53 0.00 0.21 0.00 0.02 0.00 0.00 57.03 57.78 1n9k h ASP 69 Cb 2.51 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 42.01 1n9k h ASP 69 CO 0.92 0.54 0.55 0.10 -1.72 0.00 0.00 179.24 179.63 1n9k h TYR 70 N 0.00 0.18 0.00 4.55 -0.00 -1.86 0.48 116.97 120.32 1n9k h TYR 70 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1n9k h TYR 70 Cb 1.41 -0.05 0.00 0.00 0.00 0.00 0.00 36.73 38.08 1n9k h TYR 70 CO 0.00 0.05 0.00 1.28 -0.00 0.00 0.00 178.16 179.49 1n9k n LEU 71 N -4.38 0.00 -0.72 0.10 4.77 -1.19 -1.48 117.00 114.11 1n9k n LEU 71 Ca 0.16 0.45 0.06 0.00 -0.03 0.00 0.00 56.01 56.66 1n9k n LEU 71 Cb 0.76 -0.45 0.18 0.00 -2.33 0.00 0.00 43.42 41.57 1n9k n LEU 71 CO 0.36 -0.18 0.65 0.29 -1.33 0.00 0.00 177.39 177.18 1n9k n LYS 72 N -1.45 2.90 -3.49 3.23 5.02 0.17 -4.92 118.16 119.62 1n9k n LYS 72 Ca 0.05 -2.21 -0.40 0.00 -2.02 0.00 0.00 58.31 53.73 1n9k n LYS 72 Cb 0.19 -1.38 -0.10 0.00 -0.02 0.00 0.00 35.03 33.72 1n9k n LYS 72 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1n9k s ASN 73 N -1.14 6.10 0.59 4.39 3.84 -0.55 -4.97 114.94 123.21 1n9k s ASN 73 Ca 0.27 -0.37 0.29 0.00 0.21 0.00 0.00 52.86 53.27 1n9k s ASN 73 Cb 0.16 -2.16 1.73 0.00 -0.55 0.00 0.00 41.25 40.44 1n9k s ASN 73 CO 0.15 -0.27 2.17 1.55 -2.79 0.00 0.00 177.10 177.91 1n9k h PRO 74 N 8.48 0.00 -0.13 0.43 0.13 -1.93 -1.88 132.00 137.11 1n9k h PRO 74 Ca -0.31 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.64 1n9k h PRO 74 Cb 1.15 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 1n9k h PRO 74 CO 0.66 0.00 -0.67 0.28 -0.23 0.00 0.00 178.00 178.03 1n9k h VAL 75 N 0.00 1.34 0.27 1.56 2.07 -1.93 -1.05 116.25 118.50 1n9k h VAL 75 Ca 0.05 -1.99 -0.01 0.00 0.82 0.00 0.00 66.70 65.56 1n9k h VAL 75 Cb 0.28 1.97 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1n9k h VAL 75 CO -0.00 0.61 -0.13 0.15 0.02 0.00 0.00 177.57 178.22 1n9k h PHE 76 N 0.37 -0.34 -0.64 1.57 3.57 -1.64 -2.96 116.94 116.88 1n9k h PHE 76 Ca -0.02 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.41 1n9k h PHE 76 Cb 1.25 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 40.07 1n9k h PHE 76 CO 0.05 -0.21 0.16 -1.49 -2.23 0.00 0.00 178.31 174.59 1n9k h TRP 77 N -0.36 1.05 -0.93 0.41 4.06 -1.35 0.39 115.95 119.22 1n9k h TRP 77 Ca -0.04 -0.11 0.12 0.00 2.06 0.00 0.00 58.89 60.92 1n9k h TRP 77 Cb 0.28 -0.30 -0.08 0.00 -1.00 0.00 0.00 29.16 28.05 1n9k h TRP 77 CO -0.06 0.86 0.56 1.49 -3.56 0.00 0.00 178.44 177.72 1n9k h GLU 78 N 0.96 0.85 -0.06 0.49 4.22 -1.17 -0.49 114.58 119.38 1n9k h GLU 78 Ca 0.20 -0.05 -0.25 0.00 0.08 0.00 0.00 59.36 59.35 1n9k h GLU 78 Cb 0.34 -0.19 0.02 0.00 0.50 0.00 0.00 28.75 29.41 1n9k h GLU 78 CO -0.00 0.57 -0.93 0.87 -2.18 0.00 0.00 179.01 177.33 1n9k h LYS 79 N 0.88 0.74 -0.79 1.92 1.79 -0.97 -2.81 116.57 117.32 1n9k h LYS 79 Ca 0.46 -0.71 -0.05 0.00 -2.18 0.00 0.00 60.65 58.17 1n9k h LYS 79 Cb 0.47 0.18 -0.03 0.00 -1.58 0.00 0.00 32.23 31.27 1n9k h LYS 79 CO -0.27 1.30 0.30 1.98 -1.08 0.00 0.00 179.45 181.68 1n9k h MET 80 N 0.44 1.19 -0.01 3.15 4.05 -0.70 -2.72 114.93 120.34 1n9k h MET 80 Ca -0.10 -0.23 0.00 0.00 -0.28 0.00 0.00 59.70 59.09 1n9k h MET 80 Cb 1.58 -0.19 0.00 0.00 -0.80 0.00 0.00 31.60 32.19 1n9k h MET 80 CO 0.19 0.97 -0.20 0.09 0.23 0.00 0.00 176.91 178.19 1n9k n ASN 81 N -4.27 0.85 -1.42 1.39 3.02 -0.22 -3.96 115.26 110.66 1n9k n ASN 81 Ca 0.07 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 1n9k n ASN 81 Cb 0.20 0.06 0.09 0.00 -0.61 0.00 0.00 39.78 39.52 1n9k n ASN 81 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1n9k n ASN 82 N -0.73 1.91 0.00 6.41 3.02 -1.06 -1.74 115.26 123.06 1n9k n ASN 82 Ca 0.13 -2.97 0.00 0.00 -0.03 0.00 0.00 54.58 51.71 1n9k n ASN 82 Cb 0.33 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1n9k n ASN 82 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1n9k n GLY 83 N -0.43 0.75 0.31 7.41 0.00 -1.19 -4.89 105.19 107.15 1n9k n GLY 83 Ca 0.16 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.39 1n9k n GLY 83 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1n9k h TRP 84 N 0.00 0.00 0.00 1.61 4.06 -1.64 0.17 115.95 120.16 1n9k h TRP 84 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1n9k h TRP 84 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1n9k h TRP 84 CO 0.00 0.00 0.00 -0.25 -3.56 0.00 0.00 178.44 174.63 1n9k n ASP 85 N -3.00 0.25 0.21 -3.49 8.00 -1.25 -1.54 116.55 115.71 1n9k n ASP 85 Ca -0.02 0.59 0.15 0.00 0.71 0.00 0.00 54.79 56.22 1n9k n ASP 85 Cb 0.14 -0.63 0.69 0.00 -0.02 0.00 0.00 41.12 41.30 1n9k n ASP 85 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1n9k h GLU 86 N 0.00 0.00 -0.43 -1.24 3.07 -1.03 0.19 114.58 115.14 1n9k h GLU 86 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1n9k h GLU 86 Cb 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1n9k h GLU 86 CO 0.00 0.00 0.00 1.19 -1.40 0.00 0.00 179.01 178.80 1n9k n PHE 87 N -2.56 0.55 -3.07 4.33 3.72 -0.59 -4.95 117.46 114.90 1n9k n PHE 87 Ca -0.00 -0.28 -0.38 0.00 -0.05 0.00 0.00 57.45 56.74 1n9k n PHE 87 Cb 0.16 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.64 1n9k n PHE 87 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1n9k s SER 88 N -1.43 7.20 -0.25 4.37 0.01 0.65 -4.75 113.70 119.50 1n9k s SER 88 Ca 0.40 1.50 -0.09 0.00 1.31 0.00 0.00 55.95 59.07 1n9k s SER 88 Cb 0.23 -2.45 -0.04 0.00 0.21 0.00 0.00 66.02 63.97 1n9k s SER 88 CO 0.32 0.13 0.11 -0.63 0.41 0.00 0.00 173.24 173.58 1n9k s ILE 89 N -1.32 4.71 0.39 1.44 1.01 0.10 -4.86 121.20 122.66 1n9k s ILE 89 Ca 0.38 -0.04 -0.28 0.00 0.00 0.00 0.00 60.65 60.72 1n9k s ILE 89 Cb -0.20 -3.21 -0.10 0.00 0.01 0.00 0.00 42.46 38.96 1n9k s ILE 89 CO 0.23 0.32 1.46 -2.84 0.00 0.00 0.00 174.94 174.11 1n9k s PRO 90 N 1.54 4.04 0.02 2.79 0.02 -1.26 -0.52 135.00 141.63 1n9k s PRO 90 Ca 0.06 2.51 -0.23 0.00 0.02 0.00 0.00 61.00 63.36 1n9k s PRO 90 Cb -0.15 -2.91 -0.05 0.00 0.02 0.00 0.00 34.50 31.40 1n9k s PRO 90 CO 0.06 -0.56 0.68 0.15 -0.33 0.00 0.00 177.00 177.00 1n9k s LYS 91 N -2.14 4.41 0.27 5.54 1.02 0.32 -4.85 119.74 124.30 1n9k s LYS 91 Ca 0.54 0.90 -0.03 0.00 0.02 0.00 0.00 55.97 57.40 1n9k s LYS 91 Cb -0.45 -3.36 0.39 0.00 -0.52 0.00 0.00 37.83 33.90 1n9k s LYS 91 CO 0.61 0.32 1.91 0.93 -0.92 0.00 0.00 175.35 178.20 1n9k h GLU 92 N 5.68 1.16 -0.35 1.68 5.08 -1.78 -0.29 114.58 125.76 1n9k h GLU 92 Ca -0.44 -0.07 0.03 0.00 -1.00 0.00 0.00 59.36 57.88 1n9k h GLU 92 Cb 1.20 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 30.17 1n9k h GLU 92 CO 0.70 0.77 0.24 -0.24 -1.00 0.00 0.00 179.01 179.48 1n9k h VAL 93 N 1.20 1.02 0.07 3.13 3.04 -1.79 0.23 116.25 123.15 1n9k h VAL 93 Ca 0.39 -0.13 -0.25 0.00 -1.01 0.00 0.00 66.70 65.71 1n9k h VAL 93 Cb 0.05 0.62 0.00 0.00 -2.01 0.00 0.00 31.29 29.96 1n9k h VAL 93 CO -0.13 0.07 -1.09 0.00 -1.01 0.00 0.00 177.57 175.40 1n9k h ALA 94 N 1.80 0.23 -0.63 3.17 0.00 -1.34 -1.19 119.26 121.29 1n9k h ALA 94 Ca 0.14 -0.79 0.02 0.00 0.00 0.00 0.00 54.91 54.28 1n9k h ALA 94 Cb 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1n9k h ALA 94 CO -0.03 0.88 0.40 0.00 0.00 0.00 0.00 179.25 180.49 1n9k h ARG 95 N 0.16 0.78 -0.37 0.00 3.08 -0.61 0.75 114.38 118.16 1n9k h ARG 95 Ca -0.11 -0.05 -0.13 0.00 0.07 0.00 0.00 59.98 59.76 1n9k h ARG 95 Cb 1.77 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 31.63 1n9k h ARG 95 CO 0.19 0.51 -0.29 1.96 -1.07 0.00 0.00 179.97 181.27 1n9k h GLN 96 N 0.80 0.79 -0.05 0.04 4.20 -0.82 -1.23 115.11 118.84 1n9k h GLN 96 Ca 0.24 -0.36 -0.19 0.00 0.06 0.00 0.00 58.65 58.41 1n9k h GLN 96 Cb -0.03 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 27.75 1n9k h GLN 96 CO -0.08 0.98 -0.71 -0.07 -0.67 0.00 0.00 178.83 178.28 1n9k h LEU 97 N 0.68 0.72 -0.65 1.46 3.38 -0.88 -2.35 115.31 117.66 1n9k h LEU 97 Ca 0.08 -0.70 -0.04 0.00 0.09 0.00 0.00 57.88 57.31 1n9k h LEU 97 Cb 0.82 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 1n9k h LEU 97 CO 0.07 1.32 0.25 0.40 0.09 0.00 0.00 178.44 180.57 1n9k h ILE 98 N 0.18 1.24 -0.42 1.22 2.04 -0.82 0.89 117.51 121.84 1n9k h ILE 98 Ca -0.07 -0.76 -0.04 0.00 1.00 0.00 0.00 64.86 64.98 1n9k h ILE 98 Cb 1.38 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.96 1n9k h ILE 98 CO 0.14 0.30 0.10 0.44 0.00 0.00 0.00 178.15 179.13 1n9k h ASP 99 N 0.92 0.58 -0.10 1.72 3.32 -1.22 0.63 116.42 122.27 1n9k h ASP 99 Ca 0.22 -0.09 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 1n9k h ASP 99 Cb 0.22 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1n9k h ASP 99 CO -0.02 0.59 -0.25 -0.03 -1.72 0.00 0.00 179.24 177.81 1n9k h MET 100 N 0.62 0.35 -0.23 3.56 4.05 -0.94 0.55 114.93 122.89 1n9k h MET 100 Ca 0.14 -0.24 -0.12 0.00 -0.28 0.00 0.00 59.70 59.20 1n9k h MET 100 Cb 0.24 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.07 1n9k h MET 100 CO -0.00 0.85 -0.36 0.45 0.23 0.00 0.00 176.91 178.07 1n9k h HIS 101 N -0.10 0.58 -0.76 1.39 3.86 -0.47 -1.90 115.15 117.76 1n9k h HIS 101 Ca -0.00 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 59.05 1n9k h HIS 101 Cb 0.85 -0.13 -0.04 0.00 1.06 0.00 0.00 27.41 29.16 1n9k h HIS 101 CO 0.11 0.80 0.45 0.28 0.86 0.00 0.00 177.93 180.43 1n9k h VAL 102 N 0.42 1.21 -0.49 2.45 2.07 0.33 -1.27 116.25 120.98 1n9k h VAL 102 Ca 0.04 -0.48 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 1n9k h VAL 102 Cb 0.83 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1n9k h VAL 102 CO 0.07 0.22 0.08 -0.09 0.02 0.00 0.00 177.57 177.87 1n9k h ARG 103 N 1.04 0.75 0.00 1.57 2.43 -0.19 -1.69 114.38 118.30 1n9k h ARG 103 Ca 0.27 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1n9k h ARG 103 Cb -0.03 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 1n9k h ARG 103 CO -0.05 0.71 0.00 0.54 -1.51 0.00 0.00 179.97 179.66 1n9k n ARG 104 N -4.27 0.72 -1.65 0.20 1.74 -0.78 -4.91 116.66 107.71 1n9k n ARG 104 Ca 0.03 0.01 -0.11 0.00 -0.77 0.00 0.00 57.85 57.01 1n9k n ARG 104 Cb 0.24 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.15 1n9k n ARG 104 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n9k n GLY 105 N 0.77 0.77 3.81 -0.13 0.00 -0.64 -4.27 105.19 105.50 1n9k n GLY 105 Ca 0.18 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 1n9k n GLY 105 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1n9k s ASP 106 N -2.74 5.61 -0.08 1.61 1.01 -0.49 -4.55 116.67 117.03 1n9k s ASP 106 Ca 0.00 1.72 -0.21 0.00 0.71 0.00 0.00 52.55 54.78 1n9k s ASP 106 Cb 0.00 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 1n9k s ASP 106 CO 0.00 -1.29 0.59 0.00 0.21 0.00 0.00 175.17 174.68 1n9k s ALA 107 N -2.72 3.41 -0.27 5.23 0.00 0.22 -4.74 121.76 122.90 1n9k s ALA 107 Ca 0.61 -0.02 -0.09 0.00 0.00 0.00 0.00 51.96 52.45 1n9k s ALA 107 Cb -0.15 -2.79 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 1n9k s ALA 107 CO 0.45 -0.03 0.14 0.42 0.00 0.00 0.00 175.76 176.74 1n9k s ILE 108 N 0.62 4.81 0.05 0.00 -1.09 0.35 -1.27 121.20 124.66 1n9k s ILE 108 Ca 0.32 -0.05 0.06 0.00 -2.23 0.00 0.00 60.65 58.75 1n9k s ILE 108 Cb -0.17 -3.30 -0.03 0.00 -1.58 0.00 0.00 42.46 37.38 1n9k s ILE 108 CO 0.14 0.26 -0.13 -0.36 -1.23 0.00 0.00 174.94 173.62 1n9k s PHE 109 N 1.68 2.68 -0.12 3.97 0.08 -0.15 -3.18 117.98 122.94 1n9k s PHE 109 Ca 0.06 -0.18 0.03 0.00 0.12 0.00 0.00 56.93 56.96 1n9k s PHE 109 Cb -0.16 -1.49 0.00 0.00 -0.57 0.00 0.00 43.02 40.80 1n9k s PHE 109 CO 0.07 0.33 -0.21 -0.06 -0.10 0.00 0.00 175.22 175.25 1n9k s PHE 110 N -1.01 2.65 -0.15 0.36 0.08 -1.26 -0.34 117.98 118.31 1n9k s PHE 110 Ca 0.17 -1.10 0.00 0.00 0.12 0.00 0.00 56.93 56.12 1n9k s PHE 110 Cb -0.11 -1.78 0.02 0.00 -0.57 0.00 0.00 43.02 40.59 1n9k s PHE 110 CO 0.08 -0.46 -0.14 0.08 -0.10 0.00 0.00 175.22 174.68 1n9k s VAL 111 N 0.55 1.54 0.14 -0.44 1.01 -0.28 -0.41 120.40 122.51 1n9k s VAL 111 Ca -0.13 -0.63 0.10 0.00 0.00 0.00 0.00 61.98 61.33 1n9k s VAL 111 Cb -0.17 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 1n9k s VAL 111 CO 0.04 0.45 -0.24 0.28 0.00 0.00 0.00 175.10 175.63 1n9k s THR 112 N 1.50 2.10 -2.36 3.92 -1.32 -0.16 -4.07 115.64 115.24 1n9k s THR 112 Ca 0.05 -1.78 0.21 0.00 -1.21 0.00 0.00 61.69 58.96 1n9k s THR 112 Cb -0.13 -1.90 0.43 0.00 -1.51 0.00 0.00 72.50 69.40 1n9k s THR 112 CO -0.11 -0.04 1.48 0.61 -2.21 0.00 0.00 174.62 174.36 1n9k n GLY 113 N 0.74 0.80 3.75 6.08 0.00 -1.26 -0.92 105.19 114.38 1n9k n GLY 113 Ca -0.17 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 44.92 1n9k n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n9k n ARG 114 N 0.75 2.05 -1.74 1.61 1.74 -1.26 -4.94 116.66 114.88 1n9k n ARG 114 Ca 0.17 0.74 -0.42 0.00 -0.77 0.00 0.00 57.85 57.57 1n9k n ARG 114 Cb 0.43 -2.57 -0.01 0.00 -1.02 0.00 0.00 32.46 29.29 1n9k n ARG 114 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1n9k n SER 115 N -0.31 3.57 -4.81 0.55 7.64 -1.26 -4.72 113.62 114.28 1n9k n SER 115 Ca 0.07 1.18 -0.33 0.00 1.01 0.00 0.00 58.87 60.80 1n9k n SER 115 Cb 0.42 -1.57 -0.00 0.00 -1.01 0.00 0.00 64.21 62.05 1n9k n SER 115 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1n9k s PRO 116 N -1.21 3.47 0.23 1.43 0.04 -1.26 -4.99 135.00 132.71 1n9k s PRO 116 Ca 0.60 1.19 0.01 0.00 0.04 0.00 0.00 61.00 62.84 1n9k s PRO 116 Cb -0.52 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 31.92 1n9k s PRO 116 CO 0.56 -0.69 0.06 0.95 0.04 0.00 0.00 177.00 177.92 1n9k s THR 117 N -2.42 0.59 0.17 1.26 -4.23 -1.26 -4.99 115.64 104.75 1n9k s THR 117 Ca 0.63 -1.99 -0.17 0.00 -1.18 0.00 0.00 61.69 58.97 1n9k s THR 117 Cb -0.15 -2.46 0.09 0.00 1.34 0.00 0.00 72.50 71.32 1n9k s THR 117 CO 0.34 -0.16 1.66 0.11 -0.54 0.00 0.00 174.62 176.03 1n9k h LYS 118 N 2.49 -0.03 -5.27 3.99 1.57 -1.98 -3.43 116.57 113.91 1n9k h LYS 118 Ca -0.38 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 57.89 1n9k h LYS 118 Cb 1.23 0.01 -0.14 0.00 0.08 0.00 0.00 32.23 33.41 1n9k h LYS 118 CO 0.61 -0.02 -0.59 0.95 -0.57 0.00 0.00 179.45 179.83 1n9k s THR 119 N -6.20 1.25 -0.27 -0.16 -4.23 -1.26 -5.16 115.64 99.60 1n9k s THR 119 Ca -0.14 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.16 1n9k s THR 119 Cb 0.14 -2.75 0.08 0.00 1.34 0.00 0.00 72.50 71.31 1n9k s THR 119 CO 0.71 0.00 0.72 -1.83 -0.54 0.00 0.00 174.62 173.68 1n9k s GLU 120 N -3.85 0.77 -0.01 3.99 4.04 -1.26 -4.80 118.70 117.58 1n9k s GLU 120 Ca 0.34 1.07 0.11 0.00 0.04 0.00 0.00 54.97 56.52 1n9k s GLU 120 Cb 0.08 0.30 0.32 0.00 0.02 0.00 0.00 34.13 34.85 1n9k s GLU 120 CO 0.15 -0.12 1.27 0.25 -1.84 0.00 0.00 175.26 174.97 1n9k n THR 121 N 3.30 1.05 -0.13 1.83 -2.24 -0.71 -4.59 114.28 112.79 1n9k n THR 121 Ca -0.16 -1.03 -0.09 0.00 -2.27 0.00 0.00 64.05 60.49 1n9k n THR 121 Cb 0.57 0.47 -0.01 0.00 -2.10 0.00 0.00 70.33 69.26 1n9k n THR 121 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1n9k h VAL 122 N 2.05 1.20 -0.89 2.28 2.07 -1.94 0.34 116.25 121.36 1n9k h VAL 122 Ca 0.00 -0.62 0.11 0.00 0.82 0.00 0.00 66.70 67.01 1n9k h VAL 122 Cb 0.76 0.87 -0.08 0.00 -1.52 0.00 0.00 31.29 31.32 1n9k h VAL 122 CO 0.01 0.22 0.52 0.28 0.02 0.00 0.00 177.57 178.62 1n9k h SER 123 N 0.49 0.73 -0.22 0.57 0.02 -1.93 -0.45 113.55 112.77 1n9k h SER 123 Ca 0.13 0.06 -0.13 0.00 -0.84 0.00 0.00 61.79 61.00 1n9k h SER 123 Cb 0.20 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.66 1n9k h SER 123 CO -0.01 0.39 -0.38 0.50 -1.14 0.00 0.00 176.83 176.19 1n9k h LYS 124 N 0.83 0.64 -0.90 3.45 3.64 -1.76 -1.76 116.57 120.71 1n9k h LYS 124 Ca 0.44 -0.40 0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1n9k h LYS 124 Cb 0.46 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.26 1n9k h LYS 124 CO -0.27 1.02 0.57 1.15 -2.27 0.00 0.00 179.45 179.64 1n9k h THR 125 N 0.33 1.06 -0.37 1.00 2.02 0.07 -1.19 112.91 115.82 1n9k h THR 125 Ca 0.01 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 66.74 1n9k h THR 125 Cb 0.98 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1n9k h THR 125 CO 0.09 0.19 -0.16 -0.07 0.37 0.00 0.00 175.52 175.94 1n9k h LEU 126 N 1.04 0.78 -0.70 2.58 3.38 -0.95 0.96 115.31 122.40 1n9k h LEU 126 Ca 0.39 -0.40 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1n9k h LEU 126 Cb 0.16 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1n9k h LEU 126 CO -0.17 1.00 0.19 0.00 0.09 0.00 0.00 178.44 179.56 1n9k h ALA 127 N 0.81 0.93 0.13 1.53 0.00 -0.96 -1.92 119.26 119.77 1n9k h ALA 127 Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1n9k h ALA 127 Cb 0.70 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1n9k h ALA 127 CO 0.05 0.63 -0.06 -0.44 0.00 0.00 0.00 179.25 179.43 1n9k h ASP 128 N 1.05 -0.15 -0.71 0.00 5.19 -1.22 -0.08 116.42 120.49 1n9k h ASP 128 Ca 0.22 -0.36 -0.06 0.00 -0.62 0.00 0.00 57.03 56.21 1n9k h ASP 128 Cb 0.34 0.04 -0.03 0.00 0.18 0.00 0.00 39.33 39.86 1n9k h ASP 128 CO -0.00 0.33 0.21 0.78 -3.12 0.00 0.00 179.24 177.44 1n9k h ASN 129 N -0.68 1.06 -0.47 6.45 2.35 -0.81 -3.00 115.58 120.48 1n9k h ASN 129 Ca -0.02 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.53 1n9k h ASN 129 Cb 0.51 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1n9k h ASN 129 CO 0.03 0.99 0.00 0.49 -1.65 0.00 0.00 177.43 177.29 1n9k n PHE 130 N -4.25 0.62 -3.51 1.19 3.72 -0.72 -4.97 117.46 109.55 1n9k n PHE 130 Ca 0.06 -0.31 -0.19 0.00 -0.05 0.00 0.00 57.45 56.96 1n9k n PHE 130 Cb 0.23 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.85 1n9k n PHE 130 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1n9k n HIS 131 N 1.36 -2.22 -3.29 1.38 8.25 -0.38 -4.84 115.22 115.49 1n9k n HIS 131 Ca 0.20 0.93 -0.40 0.00 -0.26 0.00 0.00 57.72 58.20 1n9k n HIS 131 Cb 0.56 -4.94 -0.08 0.00 1.12 0.00 0.00 29.99 26.65 1n9k n HIS 131 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1n9k s ILE 132 N -3.41 5.10 0.32 1.59 1.01 -0.18 -5.02 121.20 120.61 1n9k s ILE 132 Ca 0.08 0.78 -0.29 0.00 0.00 0.00 0.00 60.65 61.22 1n9k s ILE 132 Cb -0.03 -3.79 -0.11 0.00 0.01 0.00 0.00 42.46 38.54 1n9k s ILE 132 CO 0.75 0.11 1.46 -2.84 0.00 0.00 0.00 174.94 174.42 1n9k s PRO 133 N 2.22 4.20 0.37 2.79 0.02 -1.26 -4.77 135.00 138.56 1n9k s PRO 133 Ca 0.19 2.44 0.23 0.00 0.02 0.00 0.00 61.00 63.88 1n9k s PRO 133 Cb -0.16 -3.03 1.30 0.00 0.02 0.00 0.00 34.50 32.63 1n9k s PRO 133 CO 0.09 -0.46 1.47 0.00 -0.33 0.00 0.00 177.00 177.77 1n9k n ALA 134 N 1.32 1.06 0.19 -1.55 0.00 -1.26 0.36 120.51 120.63 1n9k n ALA 134 Ca 0.04 0.91 0.05 0.00 0.00 0.00 0.00 53.44 54.44 1n9k n ALA 134 Cb 0.40 -0.96 0.36 0.00 0.00 0.00 0.00 19.45 19.24 1n9k n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n9k h THR 135 N 0.00 0.96 0.00 0.00 1.03 -2.01 -3.04 112.91 109.84 1n9k h THR 135 Ca 0.80 -1.45 -0.24 0.00 -0.01 0.00 0.00 66.41 65.51 1n9k h THR 135 Cb 2.27 1.86 -0.04 0.00 -1.07 0.00 0.00 68.15 71.16 1n9k h THR 135 CO -0.63 0.37 -1.72 0.59 -0.01 0.00 0.00 175.52 174.11 1n9k n ASN 136 N -3.64 0.67 -4.82 0.00 3.02 0.16 -4.96 115.26 105.68 1n9k n ASN 136 Ca -0.01 0.31 -0.33 0.00 -0.03 0.00 0.00 54.58 54.52 1n9k n ASN 136 Cb 0.48 0.33 -0.05 0.00 -0.61 0.00 0.00 39.78 39.92 1n9k n ASN 136 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1n9k s MET 137 N -2.76 4.02 -0.04 3.52 1.75 -0.07 -0.49 119.30 125.23 1n9k s MET 137 Ca -0.05 1.15 -0.03 0.00 -1.25 0.00 0.00 55.69 55.51 1n9k s MET 137 Cb 0.08 -2.14 0.01 0.00 2.84 0.00 0.00 34.83 35.62 1n9k s MET 137 CO 0.82 -0.22 0.10 -0.80 -0.65 0.00 0.00 175.02 174.28 1n9k s ASN 138 N -2.33 -0.10 0.29 1.11 0.01 -1.19 -4.90 114.94 107.83 1n9k s ASN 138 Ca 0.63 0.19 -0.29 0.00 -0.71 0.00 0.00 52.86 52.69 1n9k s ASN 138 Cb -0.11 0.20 -0.14 0.00 0.41 0.00 0.00 41.25 41.61 1n9k s ASN 138 CO 0.19 -0.04 1.12 -2.65 -1.51 0.00 0.00 177.10 174.22 1n9k n PRO 139 N 3.05 1.58 -1.65 -0.60 -0.02 -1.26 -4.62 135.00 131.47 1n9k n PRO 139 Ca -0.12 0.56 -0.45 0.00 -2.02 0.00 0.00 63.50 61.46 1n9k n PRO 139 Cb 0.59 -2.01 -0.02 0.00 -0.02 0.00 0.00 33.50 32.04 1n9k n PRO 139 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1n9k n VAL 140 N 0.48 1.40 -3.67 -1.45 0.31 -1.26 -4.70 118.33 109.44 1n9k n VAL 140 Ca 0.09 -0.35 -0.37 0.00 -0.01 0.00 0.00 64.34 63.70 1n9k n VAL 140 Cb 0.32 -1.34 -0.10 0.00 -0.91 0.00 0.00 33.84 31.81 1n9k n VAL 140 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1n9k s ILE 141 N -0.52 5.25 -0.52 2.52 1.01 0.45 -5.02 121.20 124.37 1n9k s ILE 141 Ca 0.64 0.14 -0.18 0.00 0.00 0.00 0.00 60.65 61.25 1n9k s ILE 141 Cb -0.66 -3.46 0.07 0.00 0.01 0.00 0.00 42.46 38.43 1n9k s ILE 141 CO 0.55 0.33 0.61 -0.36 0.00 0.00 0.00 174.94 176.07 1n9k s PHE 142 N 1.23 3.07 0.13 3.97 0.08 -1.26 -0.99 117.98 124.20 1n9k s PHE 142 Ca 0.07 -0.73 0.03 0.00 0.12 0.00 0.00 56.93 56.42 1n9k s PHE 142 Cb -0.14 -3.61 -0.04 0.00 -0.57 0.00 0.00 43.02 38.66 1n9k s PHE 142 CO 0.06 -1.06 0.20 0.00 -0.10 0.00 0.00 175.22 174.32 1n9k s ALA 143 N 2.46 3.81 0.00 5.36 0.00 -0.10 -4.77 121.76 128.52 1n9k s ALA 143 Ca 0.12 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 51.03 1n9k s ALA 143 Cb -0.22 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.28 1n9k s ALA 143 CO 0.09 0.60 0.00 0.41 0.00 0.00 0.00 175.76 176.87 1n9k n GLY 144 N -0.22 -0.53 0.65 0.00 0.00 -0.41 -4.36 105.19 100.31 1n9k n GLY 144 Ca -0.07 -0.83 0.05 0.00 0.00 0.00 0.00 46.02 45.16 1n9k n GLY 144 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n9k n ASP 145 N 0.00 1.88 -4.88 1.61 5.75 -1.26 -2.77 116.55 116.88 1n9k n ASP 145 Ca 0.00 -3.83 -0.31 0.00 -0.01 0.00 0.00 54.79 50.64 1n9k n ASP 145 Cb 0.00 -0.54 0.02 0.00 -1.03 0.00 0.00 41.12 39.58 1n9k n ASP 145 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1n9k s LYS 146 N -3.21 3.30 0.16 0.11 1.02 -1.26 -4.98 119.74 114.87 1n9k s LYS 146 Ca 0.39 0.63 -0.30 0.00 0.02 0.00 0.00 55.97 56.71 1n9k s LYS 146 Cb 0.37 -2.06 -0.08 0.00 -0.52 0.00 0.00 37.83 35.55 1n9k s LYS 146 CO -0.05 -0.76 1.23 -2.14 -0.92 0.00 0.00 175.35 172.71 1n9k s PRO 147 N -5.25 4.45 0.00 -1.68 0.02 -1.26 -1.35 135.00 129.93 1n9k s PRO 147 Ca 0.56 1.89 0.00 0.00 0.02 0.00 0.00 61.00 63.48 1n9k s PRO 147 Cb -0.11 -3.26 0.00 0.00 0.02 0.00 0.00 34.50 31.15 1n9k s PRO 147 CO 0.53 -0.17 0.00 0.41 -0.33 0.00 0.00 177.00 177.44 1n9k n GLY 148 N 2.53 0.48 3.36 0.52 0.00 -1.26 -5.05 105.19 105.76 1n9k n GLY 148 Ca 0.06 -0.93 -0.24 0.00 0.00 0.00 0.00 46.02 44.91 1n9k n GLY 148 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n9k s GLN 149 N -1.75 1.34 0.09 1.61 -0.21 -0.46 -5.11 119.66 115.18 1n9k s GLN 149 Ca 0.00 -1.41 0.01 0.00 0.02 0.00 0.00 55.36 53.97 1n9k s GLN 149 Cb 0.00 -1.53 -0.04 0.00 1.00 0.00 0.00 33.01 32.44 1n9k s GLN 149 CO 0.00 0.33 0.24 -0.80 -2.12 0.00 0.00 175.29 172.94 1n9k s ASN 150 N -2.54 6.36 0.99 5.90 0.02 -1.26 -4.80 114.94 119.61 1n9k s ASN 150 Ca 0.16 0.26 -0.12 0.00 -1.02 0.00 0.00 52.86 52.14 1n9k s ASN 150 Cb -0.07 -1.95 0.19 0.00 0.02 0.00 0.00 41.25 39.43 1n9k s ASN 150 CO 0.07 0.13 1.08 0.42 0.02 0.00 0.00 177.10 178.82 1n9k s THR 151 N -1.59 2.29 0.14 1.60 -4.23 -1.11 -1.29 115.64 111.45 1n9k s THR 151 Ca 0.35 0.09 -0.17 0.00 -1.18 0.00 0.00 61.69 60.79 1n9k s THR 151 Cb -0.12 -2.43 -0.00 0.00 1.34 0.00 0.00 72.50 71.29 1n9k s THR 151 CO 0.28 -0.12 1.75 0.50 -0.54 0.00 0.00 174.62 176.49 1n9k h LYS 152 N -1.95 0.52 -0.57 3.99 3.64 -1.88 -0.63 116.57 119.68 1n9k h LYS 152 Ca -0.53 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 58.81 1n9k h LYS 152 Cb 1.31 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.99 1n9k h LYS 152 CO 0.53 0.42 0.36 0.77 -2.27 0.00 0.00 179.45 179.26 1n9k h SER 153 N 0.48 0.60 -0.75 4.20 0.02 -1.93 0.22 113.55 116.39 1n9k h SER 153 Ca 0.13 -0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.12 1n9k h SER 153 Cb 0.05 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.40 1n9k h SER 153 CO -0.02 0.43 0.47 1.56 -1.14 0.00 0.00 176.83 178.12 1n9k h GLN 154 N 0.72 0.87 -0.63 3.45 4.20 -1.83 0.51 115.11 122.41 1n9k h GLN 154 Ca 0.22 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.80 1n9k h GLN 154 Cb -0.03 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.53 1n9k h GLN 154 CO -0.07 0.58 0.09 -1.49 -0.67 0.00 0.00 178.83 177.26 1n9k h TRP 155 N 0.90 1.12 0.11 2.96 4.06 -0.38 0.39 115.95 125.11 1n9k h TRP 155 Ca 0.31 -0.16 0.00 0.00 2.06 0.00 0.00 58.89 61.10 1n9k h TRP 155 Cb 0.06 -0.30 -0.01 0.00 -1.00 0.00 0.00 29.16 27.90 1n9k h TRP 155 CO -0.04 0.95 -0.12 -0.07 -3.56 0.00 0.00 178.44 175.60 1n9k h LEU 156 N 0.96 -0.31 0.20 -4.49 3.38 0.03 -0.15 115.31 114.92 1n9k h LEU 156 Ca 0.19 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.20 1n9k h LEU 156 Cb 0.45 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1n9k h LEU 156 CO 0.01 -0.18 -0.32 -0.61 0.09 0.00 0.00 178.44 177.43 1n9k h GLN 157 N -0.26 -0.57 -0.97 1.13 5.75 -0.74 -1.31 115.11 118.15 1n9k h GLN 157 Ca 0.01 0.04 0.19 0.00 -0.15 0.00 0.00 58.65 58.74 1n9k h GLN 157 Cb 0.25 0.13 -0.11 0.00 1.07 0.00 0.00 27.48 28.82 1n9k h GLN 157 CO -0.04 -0.38 0.56 0.22 -2.65 0.00 0.00 178.83 176.54 1n9k h ASP 158 N -0.59 0.70 -0.26 -0.69 1.82 -0.04 -1.30 116.42 116.06 1n9k h ASP 158 Ca 0.01 0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.76 1n9k h ASP 158 Cb 0.59 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.58 1n9k h ASP 158 CO -0.14 0.23 0.00 0.29 -1.61 0.00 0.00 179.24 178.01 1n9k n LYS 159 N -4.82 2.05 -3.53 0.28 4.76 -0.08 -4.93 118.16 111.89 1n9k n LYS 159 Ca 0.22 -1.58 -0.26 0.00 -2.87 0.00 0.00 58.31 53.82 1n9k n LYS 159 Cb 0.57 -1.44 0.00 0.00 -1.84 0.00 0.00 35.03 32.32 1n9k n LYS 159 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1n9k n ASN 160 N 0.81 -4.10 -4.67 4.39 5.15 -0.49 -4.81 115.26 111.54 1n9k n ASN 160 Ca 0.17 -0.52 -0.42 0.00 -0.60 0.00 0.00 54.58 53.21 1n9k n ASN 160 Cb 0.44 -3.35 -0.03 0.00 -0.53 0.00 0.00 39.78 36.31 1n9k n ASN 160 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1n9k s ILE 161 N -3.06 3.34 -0.21 -1.44 1.01 -0.55 -4.43 121.20 115.86 1n9k s ILE 161 Ca 0.48 0.56 0.22 0.00 0.00 0.00 0.00 60.65 61.91 1n9k s ILE 161 Cb -0.25 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1n9k s ILE 161 CO 0.59 -0.03 0.97 0.54 0.00 0.00 0.00 174.94 177.01 1n9k n ARG 162 N 6.62 0.61 -3.76 2.79 5.12 0.85 -4.75 116.66 124.15 1n9k n ARG 162 Ca 0.17 0.11 -0.15 0.00 -1.93 0.00 0.00 57.85 56.04 1n9k n ARG 162 Cb 0.42 -1.80 -0.16 0.00 -1.16 0.00 0.00 32.46 29.76 1n9k n ARG 162 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1n9k s ILE 163 N -3.33 -0.07 -0.12 0.55 1.01 -1.26 -0.96 121.20 117.03 1n9k s ILE 163 Ca -0.01 0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.88 1n9k s ILE 163 Cb 0.10 -0.12 0.02 0.00 0.01 0.00 0.00 42.46 42.47 1n9k s ILE 163 CO 0.80 0.09 -0.15 0.12 0.00 0.00 0.00 174.94 175.81 1n9k s PHE 164 N 1.19 2.05 -0.15 3.97 5.36 -0.33 -0.74 117.98 129.33 1n9k s PHE 164 Ca -0.08 -1.03 -0.07 0.00 -0.96 0.00 0.00 56.93 54.79 1n9k s PHE 164 Cb -0.13 -1.49 -0.04 0.00 -0.34 0.00 0.00 43.02 41.02 1n9k s PHE 164 CO -0.04 -0.54 0.09 0.71 -1.46 0.00 0.00 175.22 173.99 1n9k s TYR 165 N 1.14 3.39 -0.03 10.12 2.02 -0.28 -0.64 117.35 133.07 1n9k s TYR 165 Ca -0.03 0.30 -0.31 0.00 -0.37 0.00 0.00 57.07 56.66 1n9k s TYR 165 Cb -0.14 -2.00 0.11 0.00 -0.40 0.00 0.00 41.96 39.53 1n9k s TYR 165 CO -0.04 0.43 1.16 0.20 -1.57 0.00 0.00 175.55 175.73 1n9k s GLY 166 N -0.30 -0.35 -0.02 0.71 0.00 -0.56 -1.40 107.32 105.40 1n9k s GLY 166 Ca 0.10 0.88 0.17 0.00 0.00 0.00 0.00 44.72 45.87 1n9k s GLY 166 CO 0.01 0.24 0.50 2.09 0.00 0.00 0.00 173.10 175.94 1n9k n ASP 167 N -0.35 0.93 -4.92 1.64 5.75 -1.26 -0.93 116.55 117.41 1n9k n ASP 167 Ca -0.06 -0.31 -0.29 0.00 -0.01 0.00 0.00 54.79 54.13 1n9k n ASP 167 Cb 0.61 1.53 -0.04 0.00 -1.03 0.00 0.00 41.12 42.19 1n9k n ASP 167 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1n9k s SER 168 N -3.54 6.39 0.23 -1.12 0.01 -1.26 -4.73 113.70 109.68 1n9k s SER 168 Ca -0.02 0.36 -0.08 0.00 1.31 0.00 0.00 55.95 57.51 1n9k s SER 168 Cb 0.12 -1.99 0.36 0.00 0.21 0.00 0.00 66.02 64.72 1n9k s SER 168 CO 0.72 0.05 1.69 0.44 0.41 0.00 0.00 173.24 176.55 1n9k h ASP 169 N 2.46 -0.05 -0.06 2.44 3.32 -1.94 -0.47 116.42 122.12 1n9k h ASP 169 Ca -0.47 0.13 0.02 0.00 0.02 0.00 0.00 57.03 56.73 1n9k h ASP 169 Cb 1.18 0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.92 1n9k h ASP 169 CO 0.71 -0.04 0.07 -0.55 -1.72 0.00 0.00 179.24 177.71 1n9k h ASN 170 N 0.23 0.00 -0.36 6.45 7.08 -1.98 0.76 115.58 127.75 1n9k h ASN 170 Ca 0.36 0.00 -0.09 0.00 -3.08 0.00 0.00 56.30 53.48 1n9k h ASN 170 Cb 0.58 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.81 1n9k h ASN 170 CO -0.47 0.00 -0.14 0.44 -2.08 0.00 0.00 177.43 175.17 1n9k h ASP 171 N 0.00 0.76 -0.13 6.14 3.32 -1.47 -1.41 116.42 123.62 1n9k h ASP 171 Ca 0.03 -0.39 -0.22 0.00 0.02 0.00 0.00 57.03 56.47 1n9k h ASP 171 Cb 0.16 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.51 1n9k h ASP 171 CO -0.00 0.98 -0.75 0.40 -1.72 0.00 0.00 179.24 178.15 1n9k h ILE 172 N 0.53 1.28 -0.12 0.35 1.08 -0.79 -2.55 117.51 117.30 1n9k h ILE 172 Ca 0.09 -1.96 -0.11 0.00 -0.39 0.00 0.00 64.86 62.49 1n9k h ILE 172 Cb 0.68 1.95 -0.01 0.00 -3.07 0.00 0.00 36.82 36.36 1n9k h ILE 172 CO 0.05 0.62 -0.41 0.71 -0.69 0.00 0.00 178.15 178.43 1n9k h THR 173 N 0.54 1.31 -0.33 -0.27 1.35 -1.17 -0.94 112.91 113.39 1n9k h THR 173 Ca -0.04 -1.53 -0.10 0.00 -0.55 0.00 0.00 66.41 64.18 1n9k h THR 173 Cb 1.37 1.67 -0.01 0.00 -1.73 0.00 0.00 68.15 69.46 1n9k h THR 173 CO 0.15 0.46 -0.21 0.00 -0.25 0.00 0.00 175.52 175.68 1n9k h ALA 174 N 1.34 0.47 0.27 6.62 0.00 -1.16 0.13 119.26 126.93 1n9k h ALA 174 Ca 0.02 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1n9k h ALA 174 Cb 0.83 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1n9k h ALA 174 CO 0.07 0.42 -0.13 0.00 0.00 0.00 0.00 179.25 179.60 1n9k h ALA 175 N 0.76 -0.36 -0.79 0.00 0.00 -1.12 -2.99 119.26 114.76 1n9k h ALA 175 Ca 0.07 -0.10 0.18 0.00 0.00 0.00 0.00 54.91 55.05 1n9k h ALA 175 Cb 0.75 0.14 -0.14 0.00 0.00 0.00 0.00 17.79 18.54 1n9k h ALA 175 CO 0.06 -0.68 -0.06 0.00 0.00 0.00 0.00 179.25 178.57 1n9k h ARG 176 N -0.42 0.05 -0.87 0.00 -0.00 -0.87 0.12 114.38 112.39 1n9k h ARG 176 Ca -0.04 -0.00 0.17 0.00 -0.50 0.00 0.00 59.98 59.61 1n9k h ARG 176 Cb 0.32 -0.01 -0.10 0.00 0.00 0.00 0.00 29.97 30.17 1n9k h ARG 176 CO 0.06 0.04 0.43 -0.44 0.00 0.00 0.00 179.97 180.06 1n9k h ASP 177 N 0.06 0.48 -0.73 7.04 3.32 -0.60 -1.76 116.42 124.22 1n9k h ASP 177 Ca 0.42 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.58 1n9k h ASP 177 Cb 0.72 0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1n9k h ASP 177 CO -0.74 0.15 0.00 1.33 -1.72 0.00 0.00 179.24 178.26 1n9k n VAL 178 N -4.92 1.18 -1.64 -1.35 0.24 -1.04 -4.95 118.33 105.85 1n9k n VAL 178 Ca 0.19 -1.04 -0.09 0.00 -2.04 0.00 0.00 64.34 61.36 1n9k n VAL 178 Cb 0.52 0.42 -0.02 0.00 -1.47 0.00 0.00 33.84 33.28 1n9k n VAL 178 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n9k n GLY 179 N 1.56 0.63 3.93 7.63 0.00 -0.66 -4.97 105.19 113.31 1n9k n GLY 179 Ca 0.25 -0.57 -0.25 0.00 0.00 0.00 0.00 46.02 45.44 1n9k n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n9k s ALA 180 N -2.39 3.36 -0.51 4.61 0.00 0.37 -4.98 121.76 122.24 1n9k s ALA 180 Ca 0.00 -0.90 -0.23 0.00 0.00 0.00 0.00 51.96 50.83 1n9k s ALA 180 Cb 0.00 -2.49 0.04 0.00 0.00 0.00 0.00 23.12 20.66 1n9k s ALA 180 CO 0.00 -0.95 0.84 0.50 0.00 0.00 0.00 175.76 176.15 1n9k s ARG 181 N -5.02 3.33 -0.20 0.00 3.52 -0.13 -3.94 118.95 116.51 1n9k s ARG 181 Ca 0.56 -0.29 -0.23 0.00 -0.13 0.00 0.00 55.73 55.64 1n9k s ARG 181 Cb -0.11 -4.02 -0.02 0.00 -1.56 0.00 0.00 34.95 29.25 1n9k s ARG 181 CO 0.43 -1.31 0.75 0.20 -0.81 0.00 0.00 175.30 174.56 1n9k s GLY 182 N 2.55 1.99 -0.15 8.12 0.00 -1.26 -1.19 107.32 117.38 1n9k s GLY 182 Ca 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 44.72 44.86 1n9k s GLY 182 CO 0.20 1.56 -0.15 -0.42 0.00 0.00 0.00 173.10 174.29 1n9k s ILE 183 N 2.24 2.71 0.18 0.90 1.01 0.19 -4.31 121.20 124.12 1n9k s ILE 183 Ca 0.33 -0.76 -0.29 0.00 0.00 0.00 0.00 60.65 59.94 1n9k s ILE 183 Cb -0.16 -2.14 -0.08 0.00 0.01 0.00 0.00 42.46 40.09 1n9k s ILE 183 CO 0.10 0.51 0.90 -0.60 0.00 0.00 0.00 174.94 175.86 1n9k s ARG 184 N 0.78 4.74 -0.07 2.79 6.06 0.24 -1.50 118.95 131.99 1n9k s ARG 184 Ca -0.06 1.38 0.03 0.00 -2.50 0.00 0.00 55.73 54.58 1n9k s ARG 184 Cb -0.15 -3.30 -0.02 0.00 0.06 0.00 0.00 34.95 31.53 1n9k s ARG 184 CO 0.01 0.44 -0.13 0.42 -2.50 0.00 0.00 175.30 173.53 1n9k s ILE 185 N -0.82 3.12 0.09 4.11 1.01 -0.10 -1.09 121.20 127.51 1n9k s ILE 185 Ca 0.41 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 60.07 1n9k s ILE 185 Cb -0.24 -2.24 -0.06 0.00 0.01 0.00 0.00 42.46 39.92 1n9k s ILE 185 CO 0.30 0.58 1.15 -0.76 0.00 0.00 0.00 174.94 176.21 1n9k s LEU 186 N -0.52 4.40 0.15 2.97 1.43 -1.26 -3.98 118.68 121.88 1n9k s LEU 186 Ca 0.07 2.01 -0.30 0.00 -1.03 0.00 0.00 54.13 54.88 1n9k s LEU 186 Cb -0.12 -3.59 -0.07 0.00 0.03 0.00 0.00 46.19 42.45 1n9k s LEU 186 CO 0.02 -0.39 1.13 -0.60 0.23 0.00 0.00 176.35 176.74 1n9k s ARG 187 N 0.64 4.54 0.36 1.70 3.52 -1.26 -3.60 118.95 124.86 1n9k s ARG 187 Ca 0.56 1.75 -0.28 0.00 -0.13 0.00 0.00 55.73 57.63 1n9k s ARG 187 Cb -0.29 -3.29 -0.10 0.00 -1.56 0.00 0.00 34.95 29.71 1n9k s ARG 187 CO 0.31 -0.02 1.34 0.00 -0.81 0.00 0.00 175.30 176.12 1n9k s ALA 188 N 0.08 3.44 -0.82 6.12 0.00 -1.26 -4.89 121.76 124.43 1n9k s ALA 188 Ca 0.52 1.32 0.18 0.00 0.00 0.00 0.00 51.96 53.97 1n9k s ALA 188 Cb -0.30 -3.51 0.75 0.00 0.00 0.00 0.00 23.12 20.06 1n9k s ALA 188 CO 0.34 -0.78 1.55 -1.13 0.00 0.00 0.00 175.76 175.74 1n9k n SER 189 N 0.52 0.23 -1.11 0.00 3.41 -1.26 -1.18 113.62 114.23 1n9k n SER 189 Ca 0.01 0.56 0.10 0.00 -0.26 0.00 0.00 58.87 59.28 1n9k n SER 189 Cb 0.42 -0.61 0.27 0.00 -0.26 0.00 0.00 64.21 64.03 1n9k n SER 189 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1n9k n ASN 190 N -1.75 3.23 -4.73 4.04 0.23 -1.26 -4.92 115.26 110.10 1n9k n ASN 190 Ca 0.03 -1.98 -0.36 0.00 -0.53 0.00 0.00 54.58 51.74 1n9k n ASN 190 Cb 0.19 -0.35 0.07 0.00 -2.08 0.00 0.00 39.78 37.61 1n9k n ASN 190 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1n9k s SER 191 N -1.16 4.53 0.00 0.53 0.15 -0.33 -4.90 113.70 112.52 1n9k s SER 191 Ca 0.40 2.56 0.28 0.00 0.70 0.00 0.00 55.95 59.89 1n9k s SER 191 Cb 0.22 -2.61 1.08 0.00 -1.71 0.00 0.00 66.02 62.99 1n9k s SER 191 CO 0.29 -2.05 1.76 0.35 1.20 0.00 0.00 173.24 174.79 1n9k n THR 192 N -2.07 0.00 -3.09 6.45 -2.24 -1.26 -4.75 114.28 107.33 1n9k n THR 192 Ca 0.15 -0.15 -0.43 0.00 -2.27 0.00 0.00 64.05 61.36 1n9k n THR 192 Cb 0.49 0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.89 1n9k n THR 192 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1n9k s TYR 193 N -2.27 3.03 0.04 4.78 5.04 -1.26 -5.02 117.35 121.70 1n9k s TYR 193 Ca 0.32 -0.14 -0.00 0.00 -2.44 0.00 0.00 57.07 54.81 1n9k s TYR 193 Cb 0.20 -3.46 -0.03 0.00 0.35 0.00 0.00 41.96 39.02 1n9k s TYR 193 CO 0.43 -0.95 -0.04 0.15 -1.34 0.00 0.00 175.55 173.80 1n9k s LYS 194 N 2.90 0.53 0.67 4.97 -0.14 -1.26 -4.37 119.74 123.03 1n9k s LYS 194 Ca 0.22 -1.01 -0.15 0.00 -1.36 0.00 0.00 55.97 53.67 1n9k s LYS 194 Cb -0.15 0.12 0.00 0.00 -1.68 0.00 0.00 37.83 36.12 1n9k s LYS 194 CO 0.18 -0.07 1.11 -1.25 -0.76 0.00 0.00 175.35 174.55 1n9k s PRO 195 N -3.00 2.74 0.35 -1.68 0.04 -1.26 -5.11 135.00 127.08 1n9k s PRO 195 Ca -0.01 1.39 -0.27 0.00 0.04 0.00 0.00 61.00 62.15 1n9k s PRO 195 Cb 0.01 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.49 1n9k s PRO 195 CO -0.06 -1.30 1.17 1.28 0.04 0.00 0.00 177.00 178.13 1n9k n LEU 196 N -2.50 3.03 -4.78 -3.56 4.77 -1.26 -4.98 117.00 107.73 1n9k n LEU 196 Ca 0.10 1.16 -0.32 0.00 -0.03 0.00 0.00 56.01 56.92 1n9k n LEU 196 Cb 0.52 -1.42 0.06 0.00 -2.33 0.00 0.00 43.42 40.26 1n9k n LEU 196 CO 0.48 -0.90 0.71 -2.84 -1.33 0.00 0.00 177.39 173.52 1n9k s PRO 197 N -1.87 2.64 -0.99 3.23 0.02 -1.26 -4.95 135.00 131.82 1n9k s PRO 197 Ca 0.58 1.18 -0.20 0.00 0.02 0.00 0.00 61.00 62.59 1n9k s PRO 197 Cb -0.59 -1.94 0.11 0.00 0.02 0.00 0.00 34.50 32.10 1n9k s PRO 197 CO 0.60 -1.35 1.26 -0.65 -0.33 0.00 0.00 177.00 176.53 1n9k s GLN 198 N -4.64 3.64 -0.02 5.54 -1.52 -1.26 -4.97 119.66 116.43 1n9k s GLN 198 Ca 0.62 -1.63 -0.35 0.00 -1.95 0.00 0.00 55.36 52.05 1n9k s GLN 198 Cb -0.17 -5.08 -0.13 0.00 -0.22 0.00 0.00 33.01 27.41 1n9k s GLN 198 CO 0.50 -1.92 1.72 0.00 -0.25 0.00 0.00 175.29 175.34 1n9k n ALA 199 N 7.24 0.70 0.00 6.09 0.00 -1.26 -1.71 120.51 131.58 1n9k n ALA 199 Ca 0.28 0.37 0.00 0.00 0.00 0.00 0.00 53.44 54.09 1n9k n ALA 199 Cb 0.49 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.57 1n9k n ALA 199 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n9k n GLY 200 N 3.88 0.38 0.15 0.00 0.00 -1.26 -4.98 105.19 103.36 1n9k n GLY 200 Ca 0.21 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.33 1n9k n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n9k n ALA 201 N -1.68 1.03 -0.24 4.61 0.00 -0.69 -1.46 120.51 122.07 1n9k n ALA 201 Ca 0.00 0.19 0.06 0.00 0.00 0.00 0.00 53.44 53.69 1n9k n ALA 201 Cb 0.00 -1.28 0.17 0.00 0.00 0.00 0.00 19.45 18.34 1n9k n ALA 201 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1n9k n PHE 202 N -2.20 0.53 -1.02 0.00 3.72 -1.26 -4.95 117.46 112.28 1n9k n PHE 202 Ca -0.01 -0.52 -0.01 0.00 -0.05 0.00 0.00 57.45 56.86 1n9k n PHE 202 Cb 0.04 -0.05 -0.00 0.00 -0.94 0.00 0.00 39.48 38.53 1n9k n PHE 202 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1n9k n GLY 203 N 0.52 0.48 3.88 1.37 0.00 -0.54 -5.04 105.19 105.87 1n9k n GLY 203 Ca 0.13 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1n9k n GLY 203 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1n9k s GLU 204 N -0.77 3.12 0.32 1.61 1.03 -1.26 -4.85 118.70 117.89 1n9k s GLU 204 Ca 0.00 0.55 -0.29 0.00 0.03 0.00 0.00 54.97 55.26 1n9k s GLU 204 Cb 0.00 -2.05 -0.11 0.00 -0.80 0.00 0.00 34.13 31.18 1n9k s GLU 204 CO 0.00 -0.87 1.46 -1.21 -1.33 0.00 0.00 175.26 173.31 1n9k s GLU 205 N -5.29 4.20 -0.08 -4.83 2.02 -1.26 -4.43 118.70 109.02 1n9k s GLU 205 Ca 0.57 2.43 0.04 0.00 0.02 0.00 0.00 54.97 58.04 1n9k s GLU 205 Cb -0.11 -3.04 -0.00 0.00 0.10 0.00 0.00 34.13 31.08 1n9k s GLU 205 CO 0.52 -0.45 -0.22 0.08 0.02 0.00 0.00 175.26 175.21 1n9k s VAL 206 N -0.62 1.90 0.10 2.63 1.01 0.10 -0.59 120.40 124.94 1n9k s VAL 206 Ca 0.56 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 1n9k s VAL 206 Cb -0.44 -1.64 -0.06 0.00 0.00 0.00 0.00 36.38 34.24 1n9k s VAL 206 CO 0.53 0.53 0.98 -0.63 0.00 0.00 0.00 175.10 176.50 1n9k s ILE 207 N 0.24 4.49 0.40 2.22 1.01 -0.25 -0.68 121.20 128.62 1n9k s ILE 207 Ca -0.14 2.03 -0.26 0.00 0.00 0.00 0.00 60.65 62.29 1n9k s ILE 207 Cb -0.16 -4.30 -0.09 0.00 0.01 0.00 0.00 42.46 37.92 1n9k s ILE 207 CO 0.07 0.29 1.22 0.68 0.00 0.00 0.00 174.94 177.20 1n9k s VAL 208 N 0.11 2.94 -1.63 2.92 -7.23 -0.67 -3.47 120.40 113.36 1n9k s VAL 208 Ca 0.48 0.81 0.00 0.00 -1.81 0.00 0.00 61.98 61.46 1n9k s VAL 208 Cb -0.24 -3.47 0.00 0.00 0.56 0.00 0.00 36.38 33.24 1n9k s VAL 208 CO 0.30 0.10 0.00 0.59 -0.31 0.00 0.00 175.10 175.78 1n9k n ASN 209 N 0.13 -5.12 -0.92 4.85 3.02 -1.26 -4.85 115.26 111.11 1n9k n ASN 209 Ca 0.04 0.16 0.06 0.00 -0.03 0.00 0.00 54.58 54.81 1n9k n ASN 209 Cb 0.45 -4.18 0.20 0.00 -0.61 0.00 0.00 39.78 35.64 1n9k n ASN 209 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1n9k n SER 210 N -1.14 2.65 0.01 6.41 3.41 -1.23 -3.91 113.62 119.83 1n9k n SER 210 Ca -0.20 -2.11 0.10 0.00 -0.26 0.00 0.00 58.87 56.40 1n9k n SER 210 Cb 0.63 -0.36 0.42 0.00 -0.26 0.00 0.00 64.21 64.63 1n9k n SER 210 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1n9k n GLU 211 N 0.70 0.01 0.00 4.33 0.00 -1.24 -3.99 120.64 120.46 1n9k n GLU 211 Ca 0.15 0.18 0.00 0.00 0.00 0.00 0.00 57.16 57.49 1n9k n GLU 211 Cb 0.46 -1.52 0.00 0.00 0.00 0.00 0.00 31.44 30.38 1n9k n GLU 211 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.13 179.61