#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i1z n GLN 2 N 0.00 1.13 -4.93 1.61 -0.00 -1.26 -5.07 117.38 108.86 3i1z n GLN 2 Ca 0.00 -3.03 -0.28 0.00 -0.00 0.00 0.00 57.00 53.69 3i1z n GLN 2 Cb 0.00 -1.10 -0.17 0.00 -0.00 0.00 0.00 30.24 28.97 3i1z n GLN 2 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 3i1z s LYS 3 N -2.50 2.29 0.57 2.61 -0.14 -1.26 -5.13 119.74 116.18 3i1z s LYS 3 Ca 0.27 -0.67 -0.19 0.00 -1.36 0.00 0.00 55.97 54.03 3i1z s LYS 3 Cb 0.44 -1.83 -0.05 0.00 -1.68 0.00 0.00 37.83 34.71 3i1z s LYS 3 CO 0.01 0.16 1.13 0.54 -0.76 0.00 0.00 175.35 176.43 3i1z s VAL 4 N 0.34 3.12 -0.70 3.17 0.11 -1.26 -4.95 120.40 120.24 3i1z s VAL 4 Ca -0.13 0.66 -0.27 0.00 -2.93 0.00 0.00 61.98 59.31 3i1z s VAL 4 Cb -0.16 -3.24 0.03 0.00 -1.53 0.00 0.00 36.38 31.49 3i1z s VAL 4 CO 0.05 -0.19 1.24 -2.28 -3.33 0.00 0.00 175.10 170.60 3i1z s HIS 5 N -1.86 2.38 0.21 1.54 2.46 -1.26 -4.92 115.29 113.84 3i1z s HIS 5 Ca 0.72 0.05 -0.17 0.00 0.47 0.00 0.00 55.06 56.12 3i1z s HIS 5 Cb -0.24 -4.58 0.20 0.00 -0.13 0.00 0.00 32.58 27.83 3i1z s HIS 5 CO 0.30 -1.93 1.59 -1.00 -2.47 0.00 0.00 174.74 171.22 3i1z h PRO 6 N 9.89 -0.08 -0.78 2.88 0.13 -1.96 0.14 132.00 142.21 3i1z h PRO 6 Ca -0.27 0.01 0.18 0.00 -0.87 0.00 0.00 66.00 65.05 3i1z h PRO 6 Cb 1.05 0.02 -0.13 0.00 0.13 0.00 0.00 31.00 32.07 3i1z h PRO 6 CO 1.25 -0.06 0.05 -0.97 -0.23 0.00 0.00 178.00 178.05 3i1z h ASN 7 N -0.09 -0.27 0.94 1.44 -0.73 -1.91 -2.26 115.58 112.70 3i1z h ASN 7 Ca 0.29 0.19 0.00 0.00 1.87 0.00 0.00 56.30 58.66 3i1z h ASN 7 Cb 0.56 0.32 0.00 0.00 0.27 0.00 0.00 38.32 39.48 3i1z h ASN 7 CO -0.76 -0.17 -0.54 0.61 -0.37 0.00 0.00 177.43 176.20 3i1z n GLY 8 N -1.41 -1.45 0.02 1.57 0.00 0.37 -2.59 105.19 101.71 3i1z n GLY 8 Ca 0.15 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 46.06 3i1z n GLY 8 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3i1z n ILE 9 N -2.11 0.11 -0.05 -0.61 0.13 -0.55 -4.04 119.36 112.24 3i1z n ILE 9 Ca 0.04 -0.20 -0.21 0.00 -1.10 0.00 0.00 62.75 61.28 3i1z n ILE 9 Cb 0.43 0.33 -0.13 0.00 -0.84 0.00 0.00 39.64 39.44 3i1z n ILE 9 CO 0.00 0.00 0.00 0.03 2.80 0.00 0.00 176.55 179.38 3i1z h ARG 10 N 0.00 0.13 0.00 9.51 2.47 -1.47 -3.42 114.38 121.60 3i1z h ARG 10 Ca 0.00 -0.21 0.00 0.00 -1.26 0.00 0.00 59.98 58.51 3i1z h ARG 10 Cb 0.69 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.09 3i1z h ARG 10 CO 0.00 1.10 0.00 1.28 0.56 0.00 0.00 179.97 182.91 3i1z n LEU 11 N -4.12 0.00 -0.28 3.04 4.77 -1.07 0.23 117.00 119.58 3i1z n LEU 11 Ca -0.28 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.66 3i1z n LEU 11 Cb 0.80 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.87 3i1z n LEU 11 CO 0.31 0.00 0.37 0.61 -1.33 0.00 0.00 177.39 177.35 3i1z n GLY 12 N -0.50 -1.60 3.42 -0.72 0.00 -1.26 -4.10 105.19 100.43 3i1z n GLY 12 Ca 0.00 0.79 -0.21 0.00 0.00 0.00 0.00 46.02 46.60 3i1z n GLY 12 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3i1z s ILE 13 N -5.50 1.51 -0.36 -0.61 -0.00 0.63 -4.84 121.20 112.04 3i1z s ILE 13 Ca -0.09 -2.09 0.00 0.00 -0.00 0.00 0.00 60.65 58.47 3i1z s ILE 13 Cb 0.11 -2.49 0.00 0.00 -0.00 0.00 0.00 42.46 40.08 3i1z s ILE 13 CO 0.46 -0.26 0.00 1.33 -0.00 0.00 0.00 174.94 176.47 3i1z n VAL 14 N -0.58 0.00 -3.71 8.37 0.24 -1.26 -4.65 118.33 116.73 3i1z n VAL 14 Ca -0.05 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.14 3i1z n VAL 14 Cb 0.64 -0.32 -0.11 0.00 -1.47 0.00 0.00 33.84 32.58 3i1z n VAL 14 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3i1z s LYS 15 N -2.27 0.38 0.00 7.34 2.47 -1.26 -4.82 119.74 121.58 3i1z s LYS 15 Ca 0.00 0.69 0.00 0.00 -1.56 0.00 0.00 55.97 55.10 3i1z s LYS 15 Cb 0.00 0.02 0.00 0.00 -1.46 0.00 0.00 37.83 36.39 3i1z s LYS 15 CO 0.00 -0.13 0.00 -0.35 0.16 0.00 0.00 175.35 175.03 3i1z n PRO 16 N 3.92 2.82 -2.97 4.03 -0.04 -1.26 -4.35 135.00 137.15 3i1z n PRO 16 Ca -0.21 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.28 3i1z n PRO 16 Cb 0.55 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 3i1z n PRO 16 CO 0.00 0.00 0.00 -0.46 -0.04 0.00 0.00 175.50 175.00 3i1z s TRP 17 N 0.00 -0.58 -0.66 0.54 -0.11 -1.26 -4.76 118.94 112.11 3i1z s TRP 17 Ca 0.00 0.20 0.00 0.00 1.22 0.00 0.00 56.10 57.52 3i1z s TRP 17 Cb 0.00 0.10 0.00 0.00 -1.50 0.00 0.00 33.47 32.07 3i1z s TRP 17 CO 0.00 -0.37 0.74 0.09 -4.62 0.00 0.00 176.95 172.79 3i1z n ASN 18 N 4.37 0.00 -3.40 5.86 3.02 -1.26 -3.21 115.26 120.63 3i1z n ASN 18 Ca 0.07 0.26 -0.17 0.00 -0.03 0.00 0.00 54.58 54.72 3i1z n ASN 18 Cb 0.60 -0.26 -0.10 0.00 -0.61 0.00 0.00 39.78 39.41 3i1z n ASN 18 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3i1z s SER 19 N -2.49 1.66 -0.24 6.41 0.15 -1.26 -2.44 113.70 115.49 3i1z s SER 19 Ca 0.00 -0.74 0.13 0.00 0.70 0.00 0.00 55.95 56.04 3i1z s SER 19 Cb 0.00 0.51 0.54 0.00 -1.71 0.00 0.00 66.02 65.37 3i1z s SER 19 CO 0.00 -0.39 1.49 1.07 1.20 0.00 0.00 173.24 176.61 3i1z n THR 20 N 5.31 2.47 -1.69 6.45 5.66 -0.85 -4.98 114.28 126.65 3i1z n THR 20 Ca -0.02 -2.17 -0.30 0.00 -3.05 0.00 0.00 64.05 58.50 3i1z n THR 20 Cb 0.46 -0.30 0.22 0.00 -1.55 0.00 0.00 70.33 69.17 3i1z n THR 20 CO 0.00 0.00 0.00 -1.66 -3.05 0.00 0.00 175.07 170.36 3i1z s TRP 21 N -3.01 0.93 -0.06 1.09 1.48 -1.25 -4.96 118.94 113.16 3i1z s TRP 21 Ca 0.45 0.26 -0.02 0.00 -1.06 0.00 0.00 56.10 55.73 3i1z s TRP 21 Cb 0.38 -4.05 0.03 0.00 -1.16 0.00 0.00 33.47 28.67 3i1z s TRP 21 CO 0.06 -3.22 0.03 0.12 -4.06 0.00 0.00 176.95 169.88 3i1z s PHE 22 N -3.69 0.41 0.00 1.66 5.36 -1.26 -5.03 117.98 115.42 3i1z s PHE 22 Ca 0.76 0.01 0.00 0.00 -0.96 0.00 0.00 56.93 56.74 3i1z s PHE 22 Cb -0.04 -0.66 0.00 0.00 -0.34 0.00 0.00 43.02 41.98 3i1z s PHE 22 CO 0.54 -0.27 0.00 0.00 -1.46 0.00 0.00 175.22 174.03 3i1z n ALA 23 N 5.21 0.00 -2.45 11.12 0.00 -1.26 -5.05 120.51 128.09 3i1z n ALA 23 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.17 3i1z n ALA 23 Cb 0.50 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.85 3i1z n ALA 23 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3i1z s ASN 24 N -0.75 2.79 0.45 0.00 3.04 -1.26 -4.97 114.94 114.24 3i1z s ASN 24 Ca 0.00 -1.24 0.38 0.00 0.04 0.00 0.00 52.86 52.04 3i1z s ASN 24 Cb 0.00 -0.17 1.48 0.00 -1.54 0.00 0.00 41.25 41.02 3i1z s ASN 24 CO 0.00 -0.39 1.44 0.41 -3.04 0.00 0.00 177.10 175.51 3i1z n THR 25 N -0.63 -0.13 0.00 -5.21 -1.04 -1.26 -1.58 114.28 104.43 3i1z n THR 25 Ca -0.05 1.53 0.00 0.00 -2.04 0.00 0.00 64.05 63.49 3i1z n THR 25 Cb 0.64 -2.52 0.00 0.00 -1.82 0.00 0.00 70.33 66.63 3i1z n THR 25 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3i1z n LYS 26 N -4.19 0.00 -0.09 -2.82 4.76 -1.26 -3.68 118.16 110.88 3i1z n LYS 26 Ca 0.39 0.34 0.12 0.00 -2.87 0.00 0.00 58.31 56.28 3i1z n LYS 26 Cb 1.64 -1.06 0.29 0.00 -1.84 0.00 0.00 35.03 34.06 3i1z n LYS 26 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 3i1z n GLU 27 N -1.00 2.09 -0.18 1.97 0.00 -1.04 -4.39 120.64 118.08 3i1z n GLU 27 Ca 0.00 -1.62 -0.01 0.00 0.00 0.00 0.00 57.16 55.53 3i1z n GLU 27 Cb 0.00 -1.46 0.09 0.00 0.00 0.00 0.00 31.44 30.07 3i1z n GLU 27 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 3i1z h PHE 28 N 3.42 0.34 0.00 -1.84 3.57 -1.37 1.05 116.94 122.11 3i1z h PHE 28 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3i1z h PHE 28 Cb 0.74 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.42 3i1z h PHE 28 CO 0.12 0.09 0.00 0.00 -2.23 0.00 0.00 178.31 176.29 3i1z n ALA 29 N -2.46 -0.34 -0.33 2.41 0.00 -1.26 0.21 120.51 118.74 3i1z n ALA 29 Ca 0.07 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.77 3i1z n ALA 29 Cb 0.25 0.05 0.50 0.00 0.00 0.00 0.00 19.45 20.25 3i1z n ALA 29 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3i1z h ASP 30 N 0.00 0.41 -0.11 0.00 5.19 -1.80 -1.02 116.42 119.08 3i1z h ASP 30 Ca 0.00 0.22 -0.04 0.00 -0.62 0.00 0.00 57.03 56.59 3i1z h ASP 30 Cb 0.00 0.20 -0.00 0.00 0.18 0.00 0.00 39.33 39.70 3i1z h ASP 30 CO 0.00 -0.24 -0.08 -1.13 -3.12 0.00 0.00 179.24 174.66 3i1z h ASN 31 N 0.20 0.27 -0.40 6.45 -1.24 0.13 -1.88 115.58 119.11 3i1z h ASN 31 Ca 0.76 -0.45 -0.03 0.00 0.71 0.00 0.00 56.30 57.29 3i1z h ASN 31 Cb 1.83 -0.07 -0.02 0.00 0.73 0.00 0.00 38.32 40.78 3i1z h ASN 31 CO -0.67 0.66 0.17 0.25 -1.29 0.00 0.00 177.43 176.55 3i1z h LEU 32 N -0.13 0.60 0.40 0.34 5.85 0.11 0.35 115.31 122.83 3i1z h LEU 32 Ca 0.02 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 3i1z h LEU 32 Cb 0.57 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.45 3i1z h LEU 32 CO 0.02 0.56 -0.19 -0.78 -0.34 0.00 0.00 178.44 177.71 3i1z h ASP 33 N 0.66 -0.46 -1.00 1.25 1.82 -1.34 -1.90 116.42 115.46 3i1z h ASP 33 Ca 0.16 -0.12 0.25 0.00 -0.39 0.00 0.00 57.03 56.92 3i1z h ASP 33 Cb 0.16 0.12 -0.13 0.00 0.68 0.00 0.00 39.33 40.16 3i1z h ASP 33 CO -0.01 -0.10 0.58 -1.28 -1.61 0.00 0.00 179.24 176.82 3i1z h SER 34 N -0.86 0.66 0.00 2.28 0.87 -1.00 0.49 113.55 115.99 3i1z h SER 34 Ca -0.05 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 3i1z h SER 34 Cb 0.55 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 3i1z h SER 34 CO 0.09 0.09 0.00 -0.67 -0.53 0.00 0.00 176.83 175.81 3i1z n ASP 35 N -4.90 0.00 0.00 6.23 2.03 0.12 -2.33 116.55 117.70 3i1z n ASP 35 Ca 0.27 0.46 0.03 0.00 0.52 0.00 0.00 54.79 56.07 3i1z n ASP 35 Cb 0.74 0.00 0.17 0.00 -0.72 0.00 0.00 41.12 41.32 3i1z n ASP 35 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 3i1z n PHE 36 N -0.68 0.00 0.04 -0.67 -0.00 -0.74 -2.08 117.46 113.33 3i1z n PHE 36 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.45 57.36 3i1z n PHE 36 Cb 0.00 -0.29 -0.13 0.00 -0.00 0.00 0.00 39.48 39.06 3i1z n PHE 36 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 3i1z h LYS 37 N 0.00 0.05 0.00 -4.13 3.64 0.18 -3.15 116.57 113.16 3i1z h LYS 37 Ca 0.00 -0.08 -0.12 0.00 -1.27 0.00 0.00 60.65 59.17 3i1z h LYS 37 Cb 0.07 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 3i1z h LYS 37 CO 0.00 0.88 -0.57 -0.39 -2.27 0.00 0.00 179.45 177.10 3i1z h VAL 38 N 0.01 1.03 0.23 2.00 -1.51 -1.01 -3.25 116.25 113.76 3i1z h VAL 38 Ca -0.13 -2.32 -0.01 0.00 -1.23 0.00 0.00 66.70 63.01 3i1z h VAL 38 Cb 1.89 2.41 0.00 0.00 -2.13 0.00 0.00 31.29 33.46 3i1z h VAL 38 CO 0.12 0.56 -0.11 0.03 -1.23 0.00 0.00 177.57 176.94 3i1z h ARG 39 N 0.00 -0.30 -1.19 5.19 3.08 -1.63 0.56 114.38 120.08 3i1z h ARG 39 Ca -0.01 0.02 0.38 0.00 0.07 0.00 0.00 59.98 60.44 3i1z h ARG 39 Cb 1.37 0.07 -0.12 0.00 0.08 0.00 0.00 29.97 31.36 3i1z h ARG 39 CO 0.07 0.07 0.76 0.37 -1.07 0.00 0.00 179.97 180.17 3i1z h GLN 40 N -0.77 0.19 0.06 0.04 -0.00 -1.63 0.53 115.11 113.52 3i1z h GLN 40 Ca -0.03 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.60 3i1z h GLN 40 Cb 0.51 -0.04 0.00 0.00 0.00 0.00 0.00 27.48 27.94 3i1z h GLN 40 CO 0.05 0.12 -0.03 -0.92 0.00 0.00 0.00 178.83 178.06 3i1z h TYR 41 N 0.19 -0.07 -0.65 3.99 5.03 -1.57 -3.22 116.97 120.68 3i1z h TYR 41 Ca 0.75 -0.00 0.13 0.00 2.58 0.00 0.00 58.73 62.19 3i1z h TYR 41 Cb 2.17 0.02 -0.12 0.00 1.55 0.00 0.00 36.73 40.35 3i1z h TYR 41 CO -0.01 0.32 -0.17 1.25 -1.32 0.00 0.00 178.16 178.24 3i1z h LEU 42 N -0.98 -0.62 -1.10 2.82 5.85 0.34 0.17 115.31 121.78 3i1z h LEU 42 Ca -0.01 0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 3i1z h LEU 42 Cb 0.43 0.41 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 3i1z h LEU 42 CO 0.01 -0.22 -0.26 0.71 -0.34 0.00 0.00 178.44 178.35 3i1z h THR 43 N -0.01 0.64 0.16 1.05 1.35 -0.31 -2.45 112.91 113.35 3i1z h THR 43 Ca 0.31 -1.19 -0.01 0.00 -0.55 0.00 0.00 66.41 64.97 3i1z h THR 43 Cb 0.48 1.79 0.00 0.00 -1.73 0.00 0.00 68.15 68.69 3i1z h THR 43 CO -0.67 0.25 -0.08 0.50 -0.25 0.00 0.00 175.52 175.28 3i1z h LYS 44 N 0.00 -0.21 -0.69 4.72 3.64 -0.70 -0.99 116.57 122.33 3i1z h LYS 44 Ca -0.00 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3i1z h LYS 44 Cb 0.77 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.60 3i1z h LYS 44 CO 0.03 0.13 0.40 0.93 -2.27 0.00 0.00 179.45 178.68 3i1z h GLU 45 N -0.58 0.94 -0.72 1.90 4.39 -1.35 -2.79 114.58 116.37 3i1z h GLU 45 Ca -0.02 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.59 3i1z h GLU 45 Cb 0.44 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 3i1z h GLU 45 CO 0.04 0.68 0.00 1.28 -1.16 0.00 0.00 179.01 179.85 3i1z n LEU 46 N -4.54 4.04 -0.02 1.33 4.77 -0.93 -4.49 117.00 117.17 3i1z n LEU 46 Ca 0.06 -2.05 -0.05 0.00 -0.03 0.00 0.00 56.01 53.94 3i1z n LEU 46 Cb 0.07 -0.61 -0.03 0.00 -2.33 0.00 0.00 43.42 40.51 3i1z n LEU 46 CO 0.37 0.50 0.50 0.00 -1.33 0.00 0.00 177.39 177.43 3i1z h ALA 47 N 3.33 -0.55 0.00 -1.18 0.00 -0.89 0.13 119.26 120.11 3i1z h ALA 47 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i1z h ALA 47 Cb 1.44 0.76 0.00 0.00 0.00 0.00 0.00 17.79 19.99 3i1z h ALA 47 CO 0.31 -0.62 0.00 0.87 0.00 0.00 0.00 179.25 179.81 3i1z h LYS 48 N -0.18 0.00 0.00 0.00 1.57 -1.85 -2.56 116.57 113.55 3i1z h LYS 48 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3i1z h LYS 48 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3i1z h LYS 48 CO -0.16 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.72 3i1z n ALA 49 N -2.07 1.61 -2.97 3.86 0.00 0.45 -4.89 120.51 116.49 3i1z n ALA 49 Ca -0.02 -0.05 -0.08 0.00 0.00 0.00 0.00 53.44 53.30 3i1z n ALA 49 Cb 0.15 -1.18 0.04 0.00 0.00 0.00 0.00 19.45 18.45 3i1z n ALA 49 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3i1z n SER 50 N -1.38 -6.53 -4.88 0.00 2.88 -0.97 -4.42 113.62 98.33 3i1z n SER 50 Ca 0.04 -0.39 -0.30 0.00 -1.33 0.00 0.00 58.87 56.90 3i1z n SER 50 Cb 0.11 -4.72 -0.03 0.00 -0.75 0.00 0.00 64.21 58.82 3i1z n SER 50 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3i1z s VAL 51 N -3.20 4.79 0.00 2.46 0.11 -1.26 -3.05 120.40 120.26 3i1z s VAL 51 Ca 0.23 0.59 0.00 0.00 -2.93 0.00 0.00 61.98 59.87 3i1z s VAL 51 Cb -0.03 -3.75 0.00 0.00 -1.53 0.00 0.00 36.38 31.07 3i1z s VAL 51 CO 0.66 -0.58 0.00 -1.54 -3.33 0.00 0.00 175.10 170.30 3i1z n SER 52 N -1.46 4.42 0.00 3.54 3.41 -0.87 -4.62 113.62 118.04 3i1z n SER 52 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 3i1z n SER 52 Cb 0.54 0.55 0.00 0.00 -0.26 0.00 0.00 64.21 65.04 3i1z n SER 52 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3i1z n ARG 53 N -1.71 0.00 -4.42 4.33 0.63 -1.25 -4.68 116.66 109.56 3i1z n ARG 53 Ca 0.00 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.59 3i1z n ARG 53 Cb 0.33 0.00 -0.12 0.00 0.45 0.00 0.00 32.46 33.12 3i1z n ARG 53 CO 0.00 0.00 0.00 0.96 -2.51 0.00 0.00 177.63 176.08 3i1z s ILE 54 N 0.00 3.86 0.31 5.15 -5.25 -1.26 -2.06 121.20 121.95 3i1z s ILE 54 Ca 0.00 -0.37 0.07 0.00 -0.99 0.00 0.00 60.65 59.36 3i1z s ILE 54 Cb 0.00 -2.69 -0.03 0.00 2.95 0.00 0.00 42.46 42.69 3i1z s ILE 54 CO 0.00 0.50 0.27 -0.69 -1.79 0.00 0.00 174.94 173.22 3i1z s VAL 55 N 0.33 3.84 -0.13 8.37 1.01 -0.54 -4.84 120.40 128.45 3i1z s VAL 55 Ca -0.04 -1.37 -0.06 0.00 0.00 0.00 0.00 61.98 60.50 3i1z s VAL 55 Cb -0.14 -3.26 0.05 0.00 0.00 0.00 0.00 36.38 33.03 3i1z s VAL 55 CO 0.03 -0.23 0.30 -0.63 0.00 0.00 0.00 175.10 174.57 3i1z s ILE 56 N -2.25 -0.09 0.03 2.22 1.01 -1.02 -2.01 121.20 119.09 3i1z s ILE 56 Ca 0.38 0.15 0.02 0.00 0.00 0.00 0.00 60.65 61.20 3i1z s ILE 56 Cb -0.07 -0.46 -0.02 0.00 0.01 0.00 0.00 42.46 41.93 3i1z s ILE 56 CO 0.26 0.06 -0.07 -1.83 0.00 0.00 0.00 174.94 173.36 3i1z s GLU 57 N 1.46 0.48 -0.59 2.79 1.03 -1.26 -2.01 118.70 120.60 3i1z s GLU 57 Ca -0.08 -0.61 0.01 0.00 0.03 0.00 0.00 54.97 54.31 3i1z s GLU 57 Cb -0.10 -0.29 0.15 0.00 -0.80 0.00 0.00 34.13 33.09 3i1z s GLU 57 CO -0.10 0.06 0.37 1.03 -1.33 0.00 0.00 175.26 175.29 3i1z s ARG 58 N -1.23 2.33 -0.54 -4.83 1.81 -1.26 -1.02 118.95 114.21 3i1z s ARG 58 Ca -0.08 -2.64 -0.27 0.00 -1.72 0.00 0.00 55.73 51.02 3i1z s ARG 58 Cb -0.08 -3.54 -0.00 0.00 -0.45 0.00 0.00 34.95 30.87 3i1z s ARG 58 CO 0.00 -1.15 1.64 -1.25 -0.68 0.00 0.00 175.30 173.86 3i1z s PRO 59 N -0.28 3.06 0.00 3.54 0.04 -1.26 -4.62 135.00 135.48 3i1z s PRO 59 Ca 0.18 0.67 0.00 0.00 0.04 0.00 0.00 61.00 61.89 3i1z s PRO 59 Cb -0.22 -4.23 0.00 0.00 0.04 0.00 0.00 34.50 30.09 3i1z s PRO 59 CO -0.02 -2.21 0.00 0.00 0.04 0.00 0.00 177.00 174.80 3i1z n ALA 60 N 10.85 -1.33 -3.40 8.56 0.00 -1.26 -3.40 120.51 130.53 3i1z n ALA 60 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.46 3i1z n ALA 60 Cb 0.50 -0.23 0.00 0.00 0.00 0.00 0.00 19.45 19.73 3i1z n ALA 60 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i1z n LYS 61 N 1.09 -1.58 -3.28 0.00 4.76 -1.26 -4.97 118.16 112.92 3i1z n LYS 61 Ca 0.00 1.24 0.00 0.00 -2.87 0.00 0.00 58.31 56.68 3i1z n LYS 61 Cb 0.16 -3.91 0.00 0.00 -1.84 0.00 0.00 35.03 29.45 3i1z n LYS 61 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3i1z n SER 62 N -1.84 0.00 -3.64 4.39 2.88 -1.22 -4.68 113.62 109.52 3i1z n SER 62 Ca -0.13 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.30 3i1z n SER 62 Cb 0.60 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.99 3i1z n SER 62 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 3i1z s ILE 63 N -2.68 0.00 -0.04 2.46 2.07 -0.92 -4.09 121.20 117.99 3i1z s ILE 63 Ca 0.00 0.00 -0.04 0.00 -1.41 0.00 0.00 60.65 59.20 3i1z s ILE 63 Cb 0.00 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.58 3i1z s ILE 63 CO 0.00 0.00 -0.07 -1.14 -1.91 0.00 0.00 174.94 171.82 3i1z n ARG 64 N 3.29 0.13 -2.19 3.50 0.63 -0.19 -2.58 116.66 119.26 3i1z n ARG 64 Ca -0.16 0.18 -0.02 0.00 -0.92 0.00 0.00 57.85 56.92 3i1z n ARG 64 Cb 0.57 -0.86 -0.02 0.00 0.45 0.00 0.00 32.46 32.60 3i1z n ARG 64 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3i1z n VAL 65 N -2.93-10.82 -3.58 5.15 0.31 -1.26 -3.23 118.33 101.97 3i1z n VAL 65 Ca -0.03 2.32 -0.33 0.00 -0.01 0.00 0.00 64.34 66.30 3i1z n VAL 65 Cb 0.10 -5.64 -0.05 0.00 -0.91 0.00 0.00 33.84 27.34 3i1z n VAL 65 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3i1z s THR 66 N -0.49 5.09 -0.25 2.52 2.01 -0.85 -3.16 115.64 120.51 3i1z s THR 66 Ca -0.11 0.28 -0.00 0.00 0.31 0.00 0.00 61.69 62.16 3i1z s THR 66 Cb 0.01 -3.63 0.07 0.00 0.01 0.00 0.00 72.50 68.96 3i1z s THR 66 CO 0.30 0.11 0.01 -0.63 -0.69 0.00 0.00 174.62 173.73 3i1z s ILE 67 N -1.59 1.13 0.02 1.82 1.01 0.49 -1.46 121.20 122.62 3i1z s ILE 67 Ca 0.39 -1.14 -0.28 0.00 0.00 0.00 0.00 60.65 59.62 3i1z s ILE 67 Cb -0.13 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 3i1z s ILE 67 CO 0.21 -0.30 0.91 -1.00 0.00 0.00 0.00 174.94 174.76 3i1z s HIS 68 N 1.55 3.69 -0.26 3.97 3.76 -0.88 -2.52 115.29 124.60 3i1z s HIS 68 Ca 0.00 1.63 -0.18 0.00 -0.15 0.00 0.00 55.06 56.36 3i1z s HIS 68 Cb -0.18 -3.02 0.07 0.00 1.11 0.00 0.00 32.58 30.56 3i1z s HIS 68 CO -0.11 0.09 0.67 -0.08 -0.85 0.00 0.00 174.74 174.46 3i1z s THR 69 N 0.61 -0.00 -1.76 1.30 -1.32 -1.20 -2.05 115.64 111.22 3i1z s THR 69 Ca 0.47 0.01 0.00 0.00 -1.21 0.00 0.00 61.69 60.96 3i1z s THR 69 Cb -0.21 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 69.82 3i1z s THR 69 CO 0.26 0.00 0.59 0.00 -2.21 0.00 0.00 174.62 173.27 3i1z n ALA 70 N 3.79 2.14 -2.83 11.08 0.00 -1.17 -2.93 120.51 130.58 3i1z n ALA 70 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.15 3i1z n ALA 70 Cb 0.57 -1.00 0.06 0.00 0.00 0.00 0.00 19.45 19.08 3i1z n ALA 70 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3i1z n ARG 71 N -0.34 0.96 0.14 0.00 0.63 -1.26 -4.88 116.66 111.91 3i1z n ARG 71 Ca 0.00 -2.20 0.09 0.00 -0.92 0.00 0.00 57.85 54.82 3i1z n ARG 71 Cb 0.04 -1.22 0.59 0.00 0.45 0.00 0.00 32.46 32.32 3i1z n ARG 71 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 3i1z h PRO 72 N 3.20 0.16 -0.79 -0.14 0.13 -1.87 -2.43 132.00 130.25 3i1z h PRO 72 Ca -0.07 -0.01 0.07 0.00 -0.87 0.00 0.00 66.00 65.13 3i1z h PRO 72 Cb 1.06 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 32.10 3i1z h PRO 72 CO 0.24 0.10 0.52 0.78 -0.23 0.00 0.00 178.00 179.41 3i1z h GLY 73 N 0.16 1.08 -0.81 1.56 0.00 -1.94 0.27 103.07 103.38 3i1z h GLY 73 Ca 0.09 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.09 3i1z h GLY 73 CO -0.01 0.23 0.00 4.51 0.00 0.00 0.00 176.54 181.27 3i1z n ILE 74 N -4.49 0.29 -0.00 2.60 3.06 -0.92 -1.16 119.36 118.75 3i1z n ILE 74 Ca 0.12 -0.32 0.01 0.00 -2.50 0.00 0.00 62.75 60.06 3i1z n ILE 74 Cb 0.24 0.18 -0.02 0.00 0.54 0.00 0.00 39.64 40.59 3i1z n ILE 74 CO 0.00 0.00 0.00 0.52 -2.50 0.00 0.00 176.55 174.57 3i1z n VAL 75 N 0.20 0.01 -0.10 9.51 0.31 0.15 -4.74 118.33 123.67 3i1z n VAL 75 Ca 0.11 -0.06 -0.23 0.00 -0.01 0.00 0.00 64.34 64.15 3i1z n VAL 75 Cb 0.23 0.32 -0.12 0.00 -0.91 0.00 0.00 33.84 33.37 3i1z n VAL 75 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3i1z n ILE 76 N -1.63 1.57 -0.42 2.52 5.41 0.70 -2.66 119.36 124.85 3i1z n ILE 76 Ca -0.01 -0.43 0.00 0.00 1.00 0.00 0.00 62.75 63.31 3i1z n ILE 76 Cb 0.11 -1.74 0.00 0.00 -0.71 0.00 0.00 39.64 37.30 3i1z n ILE 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3i1z n GLY 77 N 1.73 -2.52 3.59 7.39 0.00 -0.31 -0.73 105.19 114.35 3i1z n GLY 77 Ca -0.44 -1.61 -0.41 0.00 0.00 0.00 0.00 46.02 43.56 3i1z n GLY 77 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3i1z s LYS 78 N -0.88 2.84 0.00 1.61 2.20 -1.26 -3.33 119.74 120.92 3i1z s LYS 78 Ca 0.00 1.79 0.00 0.00 -0.36 0.00 0.00 55.97 57.40 3i1z s LYS 78 Cb 0.00 -4.42 0.00 0.00 -1.51 0.00 0.00 37.83 31.90 3i1z s LYS 78 CO 0.00 -2.43 0.00 1.63 -0.36 0.00 0.00 175.35 174.19 3i1z n LYS 79 N 8.82 0.00 0.00 4.03 4.01 -1.26 -2.95 118.16 130.81 3i1z n LYS 79 Ca 0.31 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.11 3i1z n LYS 79 Cb 0.48 -1.61 0.00 0.00 -0.51 0.00 0.00 35.03 33.39 3i1z n LYS 79 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3i1z n GLY 80 N -1.11 0.05 0.13 0.72 0.00 -1.21 -5.06 105.19 98.72 3i1z n GLY 80 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3i1z n GLY 80 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3i1z h GLU 81 N 0.00 0.36 0.00 1.61 4.22 -1.34 -1.83 114.58 117.60 3i1z h GLU 81 Ca 0.00 -0.20 0.00 0.00 0.08 0.00 0.00 59.36 59.24 3i1z h GLU 81 Cb 0.00 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.26 3i1z h GLU 81 CO 0.00 0.76 0.00 -0.44 -2.18 0.00 0.00 179.01 177.15 3i1z h ASP 82 N -0.02 0.00 0.09 1.04 3.45 -1.14 -2.48 116.42 117.35 3i1z h ASP 82 Ca 0.02 0.00 -0.28 0.00 0.43 0.00 0.00 57.03 57.20 3i1z h ASP 82 Cb 0.70 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.46 3i1z h ASP 82 CO 0.04 0.00 -1.49 0.58 -1.57 0.00 0.00 179.24 176.80 3i1z h VAL 83 N 0.00 0.91 0.66 -1.35 2.07 -1.21 -3.38 116.25 113.96 3i1z h VAL 83 Ca 0.00 -2.33 -0.03 0.00 0.82 0.00 0.00 66.70 65.17 3i1z h VAL 83 Cb 0.58 2.55 -0.01 0.00 -1.52 0.00 0.00 31.29 32.89 3i1z h VAL 83 CO 0.00 0.65 -0.43 -0.08 0.02 0.00 0.00 177.57 177.73 3i1z h GLU 84 N -0.41 -0.99 -0.36 1.57 4.57 -1.22 -1.61 114.58 116.13 3i1z h GLU 84 Ca -0.34 0.07 0.11 0.00 -1.18 0.00 0.00 59.36 58.01 3i1z h GLU 84 Cb 1.70 0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 30.50 3i1z h GLU 84 CO -0.01 -0.66 0.60 1.57 -1.18 0.00 0.00 179.01 179.33 3i1z h LYS 85 N -1.03 0.00 0.00 1.92 2.10 -1.67 0.20 116.57 118.09 3i1z h LYS 85 Ca -0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 3i1z h LYS 85 Cb 0.84 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.17 3i1z h LYS 85 CO 0.07 0.00 -0.82 -0.07 -2.00 0.00 0.00 179.45 176.63 3i1z h LEU 86 N 0.00 0.00 0.37 7.07 3.38 -1.48 -3.30 115.31 121.35 3i1z h LEU 86 Ca 0.17 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 3i1z h LEU 86 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3i1z h LEU 86 CO -0.00 0.03 -0.18 0.03 0.09 0.00 0.00 178.44 178.41 3i1z h ARG 87 N 0.00 -0.48 -0.42 1.13 3.08 -0.19 -2.91 114.38 114.59 3i1z h ARG 87 Ca 0.00 0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.14 3i1z h ARG 87 Cb 0.94 0.11 -0.08 0.00 0.08 0.00 0.00 29.97 31.01 3i1z h ARG 87 CO 0.00 -0.16 -0.54 -0.22 -1.07 0.00 0.00 179.97 177.99 3i1z h LYS 88 N -0.93 -0.37 -0.11 0.04 3.64 -1.66 -0.61 116.57 116.57 3i1z h LYS 88 Ca -0.05 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 3i1z h LYS 88 Cb 0.54 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.40 3i1z h LYS 88 CO 0.08 -0.25 -0.14 -0.39 -2.27 0.00 0.00 179.45 176.48 3i1z h VAL 89 N -0.38 0.62 -0.63 2.00 -1.51 -1.71 0.57 116.25 115.20 3i1z h VAL 89 Ca 0.09 0.00 0.06 0.00 -1.23 0.00 0.00 66.70 65.62 3i1z h VAL 89 Cb 0.60 0.62 -0.10 0.00 -2.13 0.00 0.00 31.29 30.28 3i1z h VAL 89 CO -0.60 0.00 -0.56 0.58 -1.23 0.00 0.00 177.57 175.76 3i1z h VAL 90 N -0.19 0.00 -0.39 7.19 2.07 -0.94 0.41 116.25 124.40 3i1z h VAL 90 Ca 0.09 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.58 3i1z h VAL 90 Cb 0.31 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.06 3i1z h VAL 90 CO -0.22 0.00 0.14 0.00 0.02 0.00 0.00 177.57 177.51 3i1z h ALA 91 N 0.15 0.51 0.00 1.67 0.00 -1.10 0.11 119.26 120.60 3i1z h ALA 91 Ca 0.11 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3i1z h ALA 91 Cb 0.52 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3i1z h ALA 91 CO -0.72 0.14 0.00 -0.25 0.00 0.00 0.00 179.25 178.42 3i1z n ASP 92 N -4.62 0.20 0.06 0.00 9.92 0.20 -0.30 116.55 122.01 3i1z n ASP 92 Ca -0.00 -0.63 0.00 0.00 -0.53 0.00 0.00 54.79 53.63 3i1z n ASP 92 Cb 0.16 -0.10 0.00 0.00 -0.64 0.00 0.00 41.12 40.54 3i1z n ASP 92 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 3i1z n ILE 93 N 0.04 0.30 -0.20 0.53 5.41 -0.32 -4.86 119.36 120.25 3i1z n ILE 93 Ca 0.00 0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.85 3i1z n ILE 93 Cb 0.05 -0.72 0.11 0.00 -0.71 0.00 0.00 39.64 38.37 3i1z n ILE 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i1z h ALA 94 N 0.00 0.75 0.00 -1.39 0.00 -0.59 -3.46 119.26 114.57 3i1z h ALA 94 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3i1z h ALA 94 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3i1z h ALA 94 CO 0.00 -0.24 0.00 0.41 0.00 0.00 0.00 179.25 179.42 3i1z n GLY 95 N -1.30 1.12 3.25 0.00 0.00 0.59 -5.07 105.19 103.78 3i1z n GLY 95 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 3i1z n GLY 95 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i1z s VAL 96 N -2.00 0.12 0.99 1.61 -7.23 -1.24 -5.05 120.40 107.60 3i1z s VAL 96 Ca 0.00 -1.29 -0.16 0.00 -1.81 0.00 0.00 61.98 58.72 3i1z s VAL 96 Cb 0.00 -1.54 -0.07 0.00 0.56 0.00 0.00 36.38 35.33 3i1z s VAL 96 CO 0.00 -0.53 -0.38 -0.81 -0.31 0.00 0.00 175.10 173.07 3i1z n PRO 97 N -0.11 -0.22 -3.51 4.82 -0.04 -1.26 -4.24 135.00 130.43 3i1z n PRO 97 Ca -0.12 -0.05 -0.02 0.00 -0.04 0.00 0.00 63.50 63.27 3i1z n PRO 97 Cb 0.63 -1.36 -0.05 0.00 -0.04 0.00 0.00 33.50 32.68 3i1z n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3i1z s ALA 98 N -2.16 -1.84 0.80 0.55 0.00 -1.26 -2.17 121.76 115.68 3i1z s ALA 98 Ca 0.47 1.95 0.00 0.00 0.00 0.00 0.00 51.96 54.38 3i1z s ALA 98 Cb -0.16 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.19 3i1z s ALA 98 CO 0.75 -1.01 0.00 1.04 0.00 0.00 0.00 175.76 176.53 3i1z n GLN 99 N 5.43 2.66 0.00 0.00 3.00 -1.06 -4.92 117.38 122.48 3i1z n GLN 99 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 3i1z n GLN 99 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.74 3i1z n GLN 99 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.06 178.57 3i1z n ILE 100 N 0.00 0.00 -3.45 5.09 3.06 -1.20 -4.88 119.36 117.99 3i1z n ILE 100 Ca 0.00 0.00 -0.20 0.00 -2.50 0.00 0.00 62.75 60.05 3i1z n ILE 100 Cb 0.00 0.00 -0.00 0.00 0.54 0.00 0.00 39.64 40.18 3i1z n ILE 100 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 3i1z s ASN 101 N 0.00 6.01 -0.51 9.51 0.01 -1.19 -4.99 114.94 123.78 3i1z s ASN 101 Ca 0.00 -0.04 0.04 0.00 -0.71 0.00 0.00 52.86 52.16 3i1z s ASN 101 Cb 0.00 -1.41 0.17 0.00 0.41 0.00 0.00 41.25 40.42 3i1z s ASN 101 CO 0.00 -0.43 0.39 0.27 -1.51 0.00 0.00 177.10 175.83 3i1z s ILE 102 N -2.22 1.18 -0.30 0.60 -5.25 -1.26 -0.38 121.20 113.56 3i1z s ILE 102 Ca 0.44 -3.19 -0.29 0.00 -0.99 0.00 0.00 60.65 56.61 3i1z s ILE 102 Cb -0.10 -1.79 -0.07 0.00 2.95 0.00 0.00 42.46 43.45 3i1z s ILE 102 CO 0.32 -1.16 2.26 0.00 -1.79 0.00 0.00 174.94 174.57 3i1z n ALA 103 N 2.55 1.47 -1.71 2.27 0.00 -1.05 -4.85 120.51 119.19 3i1z n ALA 103 Ca 0.27 -0.31 -0.37 0.00 0.00 0.00 0.00 53.44 53.02 3i1z n ALA 103 Cb 0.44 -2.87 0.06 0.00 0.00 0.00 0.00 19.45 17.08 3i1z n ALA 103 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3i1z n GLU 104 N 8.68 1.15 -3.27 0.00 2.13 -1.26 -3.28 120.64 124.79 3i1z n GLU 104 Ca 0.34 0.45 -0.44 0.00 0.66 0.00 0.00 57.16 58.17 3i1z n GLU 104 Cb 0.41 -2.47 -0.07 0.00 0.27 0.00 0.00 31.44 29.58 3i1z n GLU 104 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3i1z s VAL 105 N -1.40 5.05 -0.44 6.31 1.01 -1.15 -4.81 120.40 124.97 3i1z s VAL 105 Ca 0.80 -0.70 -0.28 0.00 0.00 0.00 0.00 61.98 61.80 3i1z s VAL 105 Cb -0.39 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 31.78 3i1z s VAL 105 CO 0.43 -0.67 1.66 0.00 0.00 0.00 0.00 175.10 176.52 3i1z s ARG 106 N 2.17 3.24 -0.06 2.72 3.03 -1.26 -4.42 118.95 124.38 3i1z s ARG 106 Ca 0.10 1.01 -0.05 0.00 2.03 0.00 0.00 55.73 58.82 3i1z s ARG 106 Cb -0.21 -4.18 0.02 0.00 -1.03 0.00 0.00 34.95 29.54 3i1z s ARG 106 CO 0.10 -1.98 0.09 1.63 -1.13 0.00 0.00 175.30 174.02 3i1z n LYS 107 N 8.53 -4.25 0.26 3.89 5.02 -1.26 -4.88 118.16 125.46 3i1z n LYS 107 Ca 0.19 3.20 0.15 0.00 -2.02 0.00 0.00 58.31 59.84 3i1z n LYS 107 Cb 0.48 -4.29 0.57 0.00 -0.02 0.00 0.00 35.03 31.78 3i1z n LYS 107 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3i1z h PRO 108 N 3.59 0.00 -0.20 1.97 0.13 -1.96 -3.30 132.00 132.23 3i1z h PRO 108 Ca -0.21 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.82 3i1z h PRO 108 Cb 0.48 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.60 3i1z h PRO 108 CO 0.00 0.03 -0.28 0.93 -0.23 0.00 0.00 178.00 178.46 3i1z h GLU 109 N 0.00 0.39 -0.07 0.86 3.07 -1.91 -2.72 114.58 114.20 3i1z h GLU 109 Ca -0.00 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 3i1z h GLU 109 Cb 0.63 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.52 3i1z h GLU 109 CO 0.00 0.63 0.00 1.28 -1.40 0.00 0.00 179.01 179.53 3i1z n LEU 110 N -4.12 0.70 -4.36 1.33 7.99 -1.24 -4.71 117.00 112.59 3i1z n LEU 110 Ca -0.01 -0.30 -0.41 0.00 -0.01 0.00 0.00 56.01 55.28 3i1z n LEU 110 Cb 0.41 -0.05 -0.10 0.00 -0.11 0.00 0.00 43.42 43.56 3i1z n LEU 110 CO 0.41 0.15 -0.12 -0.62 -1.51 0.00 0.00 177.39 175.70 3i1z s ASP 111 N -1.54 5.79 0.15 -1.43 2.15 -1.03 -4.95 116.67 115.81 3i1z s ASP 111 Ca 0.28 -1.12 -0.32 0.00 0.43 0.00 0.00 52.55 51.82 3i1z s ASP 111 Cb 0.14 -2.05 -0.09 0.00 -0.30 0.00 0.00 42.92 40.63 3i1z s ASP 111 CO 0.22 -0.45 1.54 0.00 -0.17 0.00 0.00 175.17 176.32 3i1z h ALA 112 N 8.48 -0.66 -0.47 3.66 0.00 -1.86 -1.94 119.26 126.48 3i1z h ALA 112 Ca -0.25 0.06 0.09 0.00 0.00 0.00 0.00 54.91 54.81 3i1z h ALA 112 Cb 1.10 1.25 -0.09 0.00 0.00 0.00 0.00 17.79 20.05 3i1z h ALA 112 CO 0.71 -1.01 -0.14 -0.22 0.00 0.00 0.00 179.25 178.59 3i1z h LYS 113 N -0.20 -0.03 -0.39 0.00 1.63 -1.85 -0.53 116.57 115.22 3i1z h LYS 113 Ca 0.12 0.00 0.06 0.00 -0.85 0.00 0.00 60.65 59.98 3i1z h LYS 113 Cb 0.50 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.08 3i1z h LYS 113 CO -0.77 -0.02 0.06 -0.07 -3.45 0.00 0.00 179.45 175.20 3i1z h LEU 114 N -0.03 -0.03 0.01 5.20 3.38 -1.62 0.11 115.31 122.33 3i1z h LEU 114 Ca 0.22 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.28 3i1z h LEU 114 Cb 0.37 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3i1z h LEU 114 CO -0.50 0.02 -0.09 0.58 0.09 0.00 0.00 178.44 178.54 3i1z h VAL 115 N 0.18 0.77 0.46 1.22 2.07 -0.81 0.55 116.25 120.69 3i1z h VAL 115 Ca 0.19 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.69 3i1z h VAL 115 Cb 0.23 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 3i1z h VAL 115 CO -0.26 0.00 -0.47 0.00 0.02 0.00 0.00 177.57 176.86 3i1z h ALA 116 N 0.81 -1.12 -0.89 1.67 0.00 -0.73 0.61 119.26 119.61 3i1z h ALA 116 Ca 0.03 -0.18 0.23 0.00 0.00 0.00 0.00 54.91 54.99 3i1z h ALA 116 Cb 0.20 0.70 -0.13 0.00 0.00 0.00 0.00 17.79 18.57 3i1z h ALA 116 CO -0.09 -1.15 0.36 -0.44 0.00 0.00 0.00 179.25 177.93 3i1z h ASP 117 N -0.93 0.26 0.41 0.00 5.19 -0.63 0.30 116.42 121.02 3i1z h ASP 117 Ca -0.06 0.16 -0.02 0.00 -0.62 0.00 0.00 57.03 56.50 3i1z h ASP 117 Cb 0.81 0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.49 3i1z h ASP 117 CO -0.06 -0.04 -0.20 -1.28 -3.12 0.00 0.00 179.24 174.54 3i1z h SER 118 N 0.35 -0.47 0.88 6.45 0.87 0.10 0.11 113.55 121.84 3i1z h SER 118 Ca 0.56 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 61.12 3i1z h SER 118 Cb 1.10 0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 63.18 3i1z h SER 118 CO -0.56 -0.32 -0.03 -0.29 -0.53 0.00 0.00 176.83 175.10 3i1z h ILE 119 N -0.57 0.08 0.01 2.23 2.10 0.18 0.20 117.51 121.73 3i1z h ILE 119 Ca -0.06 -0.51 -0.04 0.00 1.08 0.00 0.00 64.86 65.33 3i1z h ILE 119 Cb 0.43 1.47 0.00 0.00 -1.09 0.00 0.00 36.82 37.64 3i1z h ILE 119 CO 0.09 0.03 -0.16 0.74 -1.08 0.00 0.00 178.15 177.77 3i1z h THR 120 N 0.00 1.61 0.00 2.19 2.02 -0.26 -2.60 112.91 115.87 3i1z h THR 120 Ca -0.00 -2.02 0.00 0.00 0.77 0.00 0.00 66.41 65.16 3i1z h THR 120 Cb 0.47 2.94 0.00 0.00 -1.74 0.00 0.00 68.15 69.82 3i1z h THR 120 CO 0.00 0.54 0.01 0.28 0.37 0.00 0.00 175.52 176.72 3i1z h SER 121 N -0.67 0.00 0.11 4.18 0.02 -0.05 0.34 113.55 117.48 3i1z h SER 121 Ca -0.02 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.70 3i1z h SER 121 Cb 0.97 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.54 3i1z h SER 121 CO 0.03 0.00 -0.95 1.56 -1.14 0.00 0.00 176.83 176.33 3i1z h GLN 122 N 0.00 0.45 -0.05 3.45 1.08 -0.53 -3.06 115.11 116.44 3i1z h GLN 122 Ca 0.00 -0.63 -0.07 0.00 -1.45 0.00 0.00 58.65 56.50 3i1z h GLN 122 Cb 0.02 0.22 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 3i1z h GLN 122 CO 0.00 1.27 -0.24 -0.07 -0.95 0.00 0.00 178.83 178.84 3i1z h LEU 123 N -0.07 0.30 -0.77 1.46 3.38 -0.61 -3.08 115.31 115.94 3i1z h LEU 123 Ca -0.15 -0.65 0.13 0.00 0.09 0.00 0.00 57.88 57.30 3i1z h LEU 123 Cb 1.69 -0.09 -0.14 0.00 0.09 0.00 0.00 40.66 42.22 3i1z h LEU 123 CO 0.18 0.91 -0.33 -0.33 0.09 0.00 0.00 178.44 178.96 3i1z h GLU 124 N -0.28 -0.08 0.00 1.13 4.39 -0.58 0.55 114.58 119.72 3i1z h GLU 124 Ca -0.02 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3i1z h GLU 124 Cb 0.90 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 3i1z h GLU 124 CO 0.05 -0.05 0.00 0.54 -1.16 0.00 0.00 179.01 178.39 3i1z n ARG 125 N -5.47 0.09 -1.92 2.33 1.74 -1.16 -4.88 116.66 107.40 3i1z n ARG 125 Ca 0.08 0.24 -0.00 0.00 -0.77 0.00 0.00 57.85 57.40 3i1z n ARG 125 Cb 0.38 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 3i1z n ARG 125 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 3i1z n ARG 126 N -1.34 -0.41 -4.42 5.56 3.00 0.19 -5.10 116.66 114.14 3i1z n ARG 126 Ca 0.03 0.81 -0.21 0.00 -0.00 0.00 0.00 57.85 58.47 3i1z n ARG 126 Cb 0.07 -2.67 -0.09 0.00 0.00 0.00 0.00 32.46 29.77 3i1z n ARG 126 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 3i1z s VAL 127 N -2.73 0.69 -0.07 5.15 -7.23 -1.17 -5.04 120.40 110.00 3i1z s VAL 127 Ca 0.01 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.89 3i1z s VAL 127 Cb -0.00 -2.55 -0.06 0.00 0.56 0.00 0.00 36.38 34.33 3i1z s VAL 127 CO 0.21 0.00 1.78 -0.32 -0.31 0.00 0.00 175.10 176.46 3i1z s MET 128 N -3.83 4.02 0.27 4.82 1.75 -1.26 -4.80 119.30 120.27 3i1z s MET 128 Ca 0.32 2.20 0.02 0.00 -1.25 0.00 0.00 55.69 56.98 3i1z s MET 128 Cb 0.06 -4.07 0.39 0.00 2.84 0.00 0.00 34.83 34.04 3i1z s MET 128 CO 0.15 -1.05 1.71 0.27 -0.65 0.00 0.00 175.02 175.46 3i1z h PHE 129 N 10.46 0.57 0.85 4.11 -0.00 -1.99 -2.42 116.94 128.52 3i1z h PHE 129 Ca -0.41 -0.12 -0.04 0.00 -0.00 0.00 0.00 57.97 57.40 3i1z h PHE 129 Cb 1.19 -0.14 0.00 0.00 -0.00 0.00 0.00 35.95 37.00 3i1z h PHE 129 CO 0.91 0.71 -0.48 0.00 -0.00 0.00 0.00 178.31 179.46 3i1z h ARG 130 N 0.45 -1.19 0.09 6.09 -0.00 -2.00 -2.75 114.38 115.07 3i1z h ARG 130 Ca 0.07 0.08 0.01 0.00 -0.50 0.00 0.00 59.98 59.64 3i1z h ARG 130 Cb 0.67 0.27 -0.04 0.00 0.00 0.00 0.00 29.97 30.87 3i1z h ARG 130 CO 0.05 -0.79 -0.45 0.00 0.00 0.00 0.00 179.97 178.78 3i1z h ARG 131 N -1.23 -0.61 -0.07 0.04 3.08 -1.92 -0.82 114.38 112.85 3i1z h ARG 131 Ca -0.11 0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.00 3i1z h ARG 131 Cb 0.97 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 31.16 3i1z h ARG 131 CO 0.14 -0.40 0.17 0.00 -1.07 0.00 0.00 179.97 178.80 3i1z h ALA 132 N -0.68 1.43 -0.41 0.04 0.00 -1.54 0.80 119.26 118.90 3i1z h ALA 132 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i1z h ALA 132 Cb 0.64 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3i1z h ALA 132 CO -0.25 -0.21 0.00 -1.33 0.00 0.00 0.00 179.25 177.46 3i1z n MET 133 N -3.35 0.00 -0.20 0.00 2.81 -0.43 -2.22 117.12 113.73 3i1z n MET 133 Ca -0.01 0.43 -0.07 0.00 -1.81 0.00 0.00 57.70 56.24 3i1z n MET 133 Cb 0.25 -1.17 -0.06 0.00 -0.71 0.00 0.00 33.22 31.54 3i1z n MET 133 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 3i1z h LYS 134 N 0.00 -0.07 -0.70 0.03 3.64 -0.75 0.12 116.57 118.84 3i1z h LYS 134 Ca 0.00 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.51 3i1z h LYS 134 Cb 0.00 0.02 -0.12 0.00 -0.41 0.00 0.00 32.23 31.71 3i1z h LYS 134 CO 0.00 -0.05 -0.22 0.54 -2.27 0.00 0.00 179.45 177.45 3i1z n ARG 135 N -4.32 -0.11 0.07 1.90 5.12 0.27 0.48 116.66 120.07 3i1z n ARG 135 Ca 0.00 1.09 -0.12 0.00 -1.93 0.00 0.00 57.85 56.90 3i1z n ARG 135 Cb 0.17 -1.62 -0.07 0.00 -1.16 0.00 0.00 32.46 29.77 3i1z n ARG 135 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3i1z h ALA 136 N 1.21 -0.87 -0.22 7.54 0.00 -0.52 -2.05 119.26 124.36 3i1z h ALA 136 Ca 0.29 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.19 3i1z h ALA 136 Cb 0.47 0.78 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3i1z h ALA 136 CO -0.71 -0.96 0.20 0.28 0.00 0.00 0.00 179.25 178.06 3i1z h VAL 137 N -0.53 0.58 0.23 0.00 2.07 0.76 -2.94 116.25 116.42 3i1z h VAL 137 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3i1z h VAL 137 Cb 0.54 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 3i1z h VAL 137 CO -0.21 0.00 -0.11 1.56 0.02 0.00 0.00 177.57 178.83 3i1z h GLN 138 N 0.00 -0.30 -0.54 1.57 4.20 -0.08 -2.94 115.11 117.02 3i1z h GLN 138 Ca 0.10 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3i1z h GLN 138 Cb 0.51 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.36 3i1z h GLN 138 CO -0.00 -0.20 0.00 0.27 -0.67 0.00 0.00 178.83 178.23 3i1z n ASN 139 N -3.32 0.54 -0.10 1.46 2.04 -1.02 -1.88 115.26 112.98 3i1z n ASN 139 Ca -0.04 -1.79 -0.18 0.00 -0.44 0.00 0.00 54.58 52.13 3i1z n ASN 139 Cb 0.12 -0.27 -0.08 0.00 -2.53 0.00 0.00 39.78 37.02 3i1z n ASN 139 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3i1z n ALA 140 N -0.17 1.61 0.26 -2.53 0.00 -1.12 -4.28 120.51 114.28 3i1z n ALA 140 Ca 0.00 -0.84 0.13 0.00 0.00 0.00 0.00 53.44 52.74 3i1z n ALA 140 Cb 0.13 0.13 0.72 0.00 0.00 0.00 0.00 19.45 20.43 3i1z n ALA 140 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3i1z h MET 141 N -0.33 0.00 -0.52 0.00 2.86 -1.39 -3.14 114.93 112.41 3i1z h MET 141 Ca -0.48 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.23 3i1z h MET 141 Cb 1.59 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 33.15 3i1z h MET 141 CO -0.18 0.12 -0.47 -0.09 1.06 0.00 0.00 176.91 177.34 3i1z h ARG 142 N 0.00 -0.27 -3.34 1.72 9.65 -1.56 -3.17 114.38 117.42 3i1z h ARG 142 Ca -0.00 0.02 -0.72 0.00 -1.10 0.00 0.00 59.98 58.18 3i1z h ARG 142 Cb 0.39 0.06 -0.34 0.00 -1.39 0.00 0.00 29.97 28.69 3i1z h ARG 142 CO 0.02 -0.18 0.01 1.47 2.80 0.00 0.00 179.97 184.08 3i1z n LEU 143 N -5.39 4.45 0.00 3.80 -0.00 -1.18 -5.02 117.00 113.66 3i1z n LEU 143 Ca -0.00 -5.12 0.00 0.00 -0.00 0.00 0.00 56.01 50.89 3i1z n LEU 143 Cb 0.34 -1.16 0.00 0.00 -0.00 0.00 0.00 43.42 42.60 3i1z n LEU 143 CO -0.00 1.53 0.00 0.61 -0.00 0.00 0.00 177.39 179.53 3i1z n GLY 144 N 2.33 0.86 1.76 1.47 0.00 -1.20 -4.95 105.19 105.46 3i1z n GLY 144 Ca 0.22 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.89 3i1z n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i1z n ALA 145 N 3.42 -1.90 -0.04 4.61 0.00 -1.26 -4.47 120.51 120.88 3i1z n ALA 145 Ca 0.00 0.45 0.06 0.00 0.00 0.00 0.00 53.44 53.94 3i1z n ALA 145 Cb 0.00 -1.40 0.13 0.00 0.00 0.00 0.00 19.45 18.18 3i1z n ALA 145 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i1z n LYS 146 N -0.35 2.37 0.00 0.00 4.76 0.81 -4.89 118.16 120.86 3i1z n LYS 146 Ca 0.00 -1.87 0.00 0.00 -2.87 0.00 0.00 58.31 53.57 3i1z n LYS 146 Cb 0.00 -1.26 0.00 0.00 -1.84 0.00 0.00 35.03 31.93 3i1z n LYS 146 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3i1z n GLY 147 N 0.55 1.47 3.61 0.72 0.00 -1.21 -1.96 105.19 108.38 3i1z n GLY 147 Ca 0.11 -0.98 -0.04 0.00 0.00 0.00 0.00 46.02 45.10 3i1z n GLY 147 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3i1z s ILE 148 N -2.00 0.00 -0.16 -0.61 2.07 -0.80 -1.14 121.20 118.56 3i1z s ILE 148 Ca 0.00 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.17 3i1z s ILE 148 Cb 0.00 -1.00 0.07 0.00 0.13 0.00 0.00 42.46 41.66 3i1z s ILE 148 CO 0.00 0.00 0.37 -1.59 -1.91 0.00 0.00 174.94 171.81 3i1z s LYS 149 N -1.85 0.30 0.10 3.50 -2.85 -0.17 -2.16 119.74 116.61 3i1z s LYS 149 Ca 0.08 0.84 0.03 0.00 -1.00 0.00 0.00 55.97 55.92 3i1z s LYS 149 Cb -0.01 0.08 -0.04 0.00 -2.06 0.00 0.00 37.83 35.81 3i1z s LYS 149 CO -0.05 -0.22 0.12 0.14 0.10 0.00 0.00 175.35 175.45 3i1z s VAL 150 N 2.00 4.67 -0.36 1.79 -7.23 -1.07 -1.06 120.40 119.14 3i1z s VAL 150 Ca -0.05 -0.79 0.07 0.00 -1.81 0.00 0.00 61.98 59.39 3i1z s VAL 150 Cb -0.11 -3.30 0.18 0.00 0.56 0.00 0.00 36.38 33.72 3i1z s VAL 150 CO -0.11 0.06 0.58 -0.70 -0.31 0.00 0.00 175.10 174.61 3i1z s GLU 151 N -2.63 0.70 0.51 4.82 2.12 -0.48 -1.23 118.70 122.51 3i1z s GLU 151 Ca 0.31 -0.05 -0.09 0.00 0.36 0.00 0.00 54.97 55.49 3i1z s GLU 151 Cb -0.12 0.04 -0.05 0.00 0.26 0.00 0.00 34.13 34.27 3i1z s GLU 151 CO 0.23 -1.14 0.87 0.14 -0.54 0.00 0.00 175.26 174.83 3i1z s VAL 152 N 2.14 4.78 0.17 3.70 -7.23 -1.07 -2.09 120.40 120.81 3i1z s VAL 152 Ca 0.14 0.60 -0.18 0.00 -1.81 0.00 0.00 61.98 60.73 3i1z s VAL 152 Cb -0.07 -3.82 0.03 0.00 0.56 0.00 0.00 36.38 33.08 3i1z s VAL 152 CO -0.14 -0.84 0.49 -0.94 -0.31 0.00 0.00 175.10 173.36 3i1z s SER 153 N -3.80 -0.28 0.00 4.85 1.04 -0.66 -3.05 113.70 111.80 3i1z s SER 153 Ca 0.52 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.57 3i1z s SER 153 Cb -0.10 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.56 3i1z s SER 153 CO 0.43 -0.98 0.00 0.61 0.98 0.00 0.00 173.24 174.28 3i1z n GLY 154 N -0.31 -2.98 4.24 7.32 0.00 -0.79 -3.13 105.19 109.53 3i1z n GLY 154 Ca -0.13 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.82 3i1z n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i1z n ARG 155 N 0.27 -1.73 -1.74 1.61 1.74 -1.26 -4.63 116.66 110.91 3i1z n ARG 155 Ca 0.00 0.20 -0.42 0.00 -0.77 0.00 0.00 57.85 56.86 3i1z n ARG 155 Cb 0.00 -4.11 -0.03 0.00 -1.02 0.00 0.00 32.46 27.30 3i1z n ARG 155 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3i1z s LEU 156 N -7.25 4.39 0.00 0.55 1.02 -1.26 -0.65 118.68 115.47 3i1z s LEU 156 Ca 0.17 2.77 0.00 0.00 0.02 0.00 0.00 54.13 57.09 3i1z s LEU 156 Cb -0.10 -3.58 0.00 0.00 0.02 0.00 0.00 46.19 42.54 3i1z s LEU 156 CO 0.97 -0.98 0.00 0.61 0.02 0.00 0.00 176.35 176.97 3i1z n GLY 157 N 4.13 1.39 0.00 -3.19 0.00 -1.26 -3.90 105.19 102.36 3i1z n GLY 157 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3i1z n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i1z n GLY 158 N -1.49 0.76 3.31 -0.02 0.00 0.17 -5.14 105.19 102.79 3i1z n GLY 158 Ca 0.00 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 3i1z n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i1z s ALA 159 N -0.71 2.10 -2.00 4.61 0.00 -1.25 -4.97 121.76 119.54 3i1z s ALA 159 Ca 0.00 -1.19 0.05 0.00 0.00 0.00 0.00 51.96 50.82 3i1z s ALA 159 Cb 0.00 -0.45 0.28 0.00 0.00 0.00 0.00 23.12 22.95 3i1z s ALA 159 CO 0.00 0.50 0.73 0.39 0.00 0.00 0.00 175.76 177.38 3i1z n GLU 160 N 1.89 0.16 -4.02 0.00 1.02 -1.26 -4.11 120.64 114.31 3i1z n GLU 160 Ca -0.17 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.75 3i1z n GLU 160 Cb 0.52 -1.47 -0.17 0.00 -0.02 0.00 0.00 31.44 30.31 3i1z n GLU 160 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 3i1z s ILE 161 N -2.00 0.60 -0.69 -3.67 -5.25 -1.26 -5.10 121.20 103.83 3i1z s ILE 161 Ca 0.07 -0.09 -0.21 0.00 -0.99 0.00 0.00 60.65 59.43 3i1z s ILE 161 Cb 0.03 -0.66 0.09 0.00 2.95 0.00 0.00 42.46 44.87 3i1z s ILE 161 CO 0.05 0.27 0.93 0.00 -1.79 0.00 0.00 174.94 174.40 3i1z s ALA 162 N 1.38 3.23 1.01 2.27 0.00 -1.26 -4.44 121.76 123.96 3i1z s ALA 162 Ca -0.03 -2.10 -0.01 0.00 0.00 0.00 0.00 51.96 49.82 3i1z s ALA 162 Cb -0.13 -3.81 0.01 0.00 0.00 0.00 0.00 23.12 19.19 3i1z s ALA 162 CO -0.03 -2.71 0.05 0.54 0.00 0.00 0.00 175.76 173.61 3i1z n ARG 163 N 7.17 -1.15 -2.96 0.00 1.74 -1.26 -4.45 116.66 115.76 3i1z n ARG 163 Ca -0.00 -0.07 -0.14 0.00 -0.77 0.00 0.00 57.85 56.86 3i1z n ARG 163 Cb 0.45 -0.07 0.02 0.00 -1.02 0.00 0.00 32.46 31.85 3i1z n ARG 163 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3i1z n THR 164 N -2.63 -0.13 -2.29 0.55 -2.24 -1.26 -1.89 114.28 104.39 3i1z n THR 164 Ca 0.01 -2.98 -0.43 0.00 -2.27 0.00 0.00 64.05 58.38 3i1z n THR 164 Cb 0.03 0.49 -0.02 0.00 -2.10 0.00 0.00 70.33 68.72 3i1z n THR 164 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3i1z s GLU 165 N -0.93 4.17 0.00 -0.78 8.01 -1.17 -4.93 118.70 123.08 3i1z s GLU 165 Ca 0.31 1.78 0.00 0.00 0.01 0.00 0.00 54.97 57.07 3i1z s GLU 165 Cb 0.30 -3.85 0.00 0.00 -4.31 0.00 0.00 34.13 26.27 3i1z s GLU 165 CO -0.08 -0.81 0.00 -2.67 0.01 0.00 0.00 175.26 171.71 3i1z n TRP 166 N 6.93 0.00 0.00 1.61 -0.00 -1.26 -2.60 117.44 122.12 3i1z n TRP 166 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.65 3i1z n TRP 166 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.75 3i1z n TRP 166 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 177.69 178.67 3i1z n TYR 167 N 0.00 0.00 -3.73 -2.67 9.36 -0.37 -4.88 117.16 114.87 3i1z n TYR 167 Ca 0.00 0.00 -0.20 0.00 3.32 0.00 0.00 57.90 61.02 3i1z n TYR 167 Cb 0.00 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 38.69 3i1z n TYR 167 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 3i1z s ARG 168 N 0.00 2.97 -0.29 2.98 3.00 -1.26 -2.59 118.95 123.76 3i1z s ARG 168 Ca 0.00 -1.10 -0.20 0.00 -1.00 0.00 0.00 55.73 53.43 3i1z s ARG 168 Cb 0.00 -2.66 0.18 0.00 0.00 0.00 0.00 34.95 32.47 3i1z s ARG 168 CO 0.00 0.15 1.21 -2.00 0.00 0.00 0.00 175.30 174.66 3i1z s GLU 169 N -4.05 0.19 0.00 5.12 2.12 -0.92 -5.00 118.70 116.16 3i1z s GLU 169 Ca 0.41 0.28 0.00 0.00 0.36 0.00 0.00 54.97 56.02 3i1z s GLU 169 Cb -0.08 0.06 0.00 0.00 0.26 0.00 0.00 34.13 34.37 3i1z s GLU 169 CO 0.28 -0.03 0.00 0.41 -0.54 0.00 0.00 175.26 175.38 3i1z n GLY 170 N 2.70 1.02 0.00 -1.50 0.00 -1.26 -1.90 105.19 104.25 3i1z n GLY 170 Ca -0.15 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.11 3i1z n GLY 170 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3i1z n ARG 171 N 0.00 0.00 -3.68 1.61 0.63 -0.83 -4.85 116.66 109.54 3i1z n ARG 171 Ca 0.00 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.64 3i1z n ARG 171 Cb 0.00 0.00 -0.12 0.00 0.45 0.00 0.00 32.46 32.79 3i1z n ARG 171 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3i1z s VAL 172 N 0.00 1.41 -1.32 5.15 1.01 -1.26 -3.84 120.40 121.55 3i1z s VAL 172 Ca 0.00 -2.80 -0.15 0.00 0.00 0.00 0.00 61.98 59.03 3i1z s VAL 172 Cb 0.00 -1.97 0.09 0.00 0.00 0.00 0.00 36.38 34.50 3i1z s VAL 172 CO 0.00 -0.97 1.82 -0.81 0.00 0.00 0.00 175.10 175.14 3i1z n PRO 173 N 3.21 3.20 -0.31 2.72 -0.04 -1.26 -4.84 135.00 137.68 3i1z n PRO 173 Ca 0.14 -3.25 0.12 0.00 -0.04 0.00 0.00 63.50 60.47 3i1z n PRO 173 Cb 0.37 -3.29 0.29 0.00 -0.04 0.00 0.00 33.50 30.83 3i1z n PRO 173 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3i1z h LEU 174 N 10.78 0.41 -1.73 1.53 5.85 -2.00 -1.29 115.31 128.85 3i1z h LEU 174 Ca 0.45 0.14 -0.02 0.00 0.84 0.00 0.00 57.88 59.28 3i1z h LEU 174 Cb 0.78 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 3i1z h LEU 174 CO 1.55 0.06 -0.07 0.45 -0.34 0.00 0.00 178.44 180.09 3i1z h HIS 175 N 0.47 0.08 -2.66 1.25 3.86 -2.02 -3.41 115.15 112.73 3i1z h HIS 175 Ca 0.54 -0.00 -0.55 0.00 -1.16 0.00 0.00 60.37 59.19 3i1z h HIS 175 Cb 0.97 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 29.38 3i1z h HIS 175 CO -0.12 0.15 1.23 0.99 0.86 0.00 0.00 177.93 181.05 3i1z s THR 176 N -4.89 3.57 0.07 2.45 2.01 -0.49 -4.91 115.64 113.44 3i1z s THR 176 Ca -0.05 0.53 -0.36 0.00 0.31 0.00 0.00 61.69 62.12 3i1z s THR 176 Cb 0.16 -3.90 -0.20 0.00 0.01 0.00 0.00 72.50 68.58 3i1z s THR 176 CO 0.70 -0.66 1.59 -0.07 -0.69 0.00 0.00 174.62 175.48 3i1z h LEU 177 N 13.93 -1.05 -2.41 4.42 -0.00 -1.86 -2.91 115.31 125.43 3i1z h LEU 177 Ca -0.30 0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.62 3i1z h LEU 177 Cb 1.15 0.28 0.00 0.00 -0.00 0.00 0.00 40.66 42.09 3i1z h LEU 177 CO 1.10 -0.72 0.15 0.08 -0.00 0.00 0.00 178.44 179.05 3i1z h ARG 178 N -1.17 0.00 -6.83 1.13 0.11 -1.91 -3.43 114.38 102.28 3i1z h ARG 178 Ca -0.11 0.00 -0.54 0.00 0.10 0.00 0.00 59.98 59.42 3i1z h ARG 178 Cb 0.91 0.00 0.10 0.00 1.11 0.00 0.00 29.97 32.09 3i1z h ARG 178 CO 0.17 0.00 0.77 0.00 0.10 0.00 0.00 179.97 181.01 3i1z n ALA 179 N -1.96 2.22 -2.63 0.08 0.00 -1.10 -4.17 120.51 112.95 3i1z n ALA 179 Ca -0.02 0.36 -0.43 0.00 0.00 0.00 0.00 53.44 53.35 3i1z n ALA 179 Cb 0.20 -2.41 -0.02 0.00 0.00 0.00 0.00 19.45 17.23 3i1z n ALA 179 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3i1z s ASP 180 N 0.14 7.12 -0.03 0.00 -1.08 -0.23 -4.96 116.67 117.63 3i1z s ASP 180 Ca 0.59 1.49 0.03 0.00 -0.52 0.00 0.00 52.55 54.15 3i1z s ASP 180 Cb -0.51 -2.55 -0.00 0.00 -1.46 0.00 0.00 42.92 38.40 3i1z s ASP 180 CO 0.56 -0.61 -0.12 -0.63 0.52 0.00 0.00 175.17 174.89 3i1z s ILE 181 N 2.80 1.05 -0.18 4.11 -1.09 -1.26 -1.96 121.20 124.66 3i1z s ILE 181 Ca 0.47 -0.51 -0.03 0.00 -2.23 0.00 0.00 60.65 58.35 3i1z s ILE 181 Cb -0.17 -0.91 -0.01 0.00 -1.58 0.00 0.00 42.46 39.78 3i1z s ILE 181 CO 0.12 0.31 -0.06 -0.62 -1.23 0.00 0.00 174.94 173.45 3i1z s ASP 182 N 0.07 4.33 0.02 3.58 -1.08 -0.14 -4.91 116.67 118.54 3i1z s ASP 182 Ca -0.02 -0.32 0.02 0.00 -0.52 0.00 0.00 52.55 51.71 3i1z s ASP 182 Cb -0.09 -1.71 -0.01 0.00 -1.46 0.00 0.00 42.92 39.64 3i1z s ASP 182 CO 0.01 0.07 -0.08 -0.47 0.52 0.00 0.00 175.17 175.22 3i1z s TYR 183 N 0.94 0.68 -0.13 -5.34 5.04 -1.26 -1.78 117.35 115.50 3i1z s TYR 183 Ca -0.01 -0.28 -0.31 0.00 -2.44 0.00 0.00 57.07 54.03 3i1z s TYR 183 Cb -0.15 -0.42 0.13 0.00 0.35 0.00 0.00 41.96 41.87 3i1z s TYR 183 CO 0.00 -0.03 1.04 1.21 -1.34 0.00 0.00 175.55 176.44 3i1z s ASN 184 N -0.79 -0.28 0.08 4.32 3.04 -1.24 -4.73 114.94 115.34 3i1z s ASN 184 Ca -0.02 0.14 0.06 0.00 0.04 0.00 0.00 52.86 53.08 3i1z s ASN 184 Cb -0.06 0.27 -0.03 0.00 -1.54 0.00 0.00 41.25 39.89 3i1z s ASN 184 CO 0.00 -0.38 -0.16 -0.89 -3.04 0.00 0.00 177.10 172.63 3i1z s THR 185 N -2.10 1.30 -0.27 -5.21 2.01 -1.26 -2.75 115.64 107.36 3i1z s THR 185 Ca 0.04 -1.40 -0.01 0.00 0.31 0.00 0.00 61.69 60.63 3i1z s THR 185 Cb -0.01 -1.24 0.13 0.00 0.01 0.00 0.00 72.50 71.39 3i1z s THR 185 CO -0.04 -0.19 0.30 -0.55 -0.69 0.00 0.00 174.62 173.44 3i1z s SER 186 N -1.83 1.38 0.36 3.53 0.15 -0.99 -4.90 113.70 111.39 3i1z s SER 186 Ca 0.01 -0.51 -0.28 0.00 0.70 0.00 0.00 55.95 55.87 3i1z s SER 186 Cb -0.10 0.59 -0.10 0.00 -1.71 0.00 0.00 66.02 64.70 3i1z s SER 186 CO 0.03 -0.36 1.37 -1.61 1.20 0.00 0.00 173.24 173.87 3i1z s GLU 187 N 2.39 4.21 -0.14 5.44 2.02 -1.26 -3.52 118.70 127.83 3i1z s GLU 187 Ca 0.09 2.34 0.01 0.00 0.02 0.00 0.00 54.97 57.43 3i1z s GLU 187 Cb -0.14 -2.99 0.02 0.00 0.10 0.00 0.00 34.13 31.12 3i1z s GLU 187 CO -0.27 -0.36 -0.16 0.00 0.02 0.00 0.00 175.26 174.50 3i1z s ALA 188 N -1.15 1.89 -0.61 5.21 0.00 -0.05 -5.00 121.76 122.05 3i1z s ALA 188 Ca 0.51 -0.90 -0.24 0.00 0.00 0.00 0.00 51.96 51.33 3i1z s ALA 188 Cb -0.42 -1.00 0.05 0.00 0.00 0.00 0.00 23.12 21.75 3i1z s ALA 188 CO 0.56 -0.27 0.98 -1.01 0.00 0.00 0.00 175.76 176.02 3i1z s HIS 189 N 1.29 2.70 0.41 0.00 3.76 -1.26 -0.64 115.29 121.53 3i1z s HIS 189 Ca 0.01 -0.23 -0.07 0.00 -0.15 0.00 0.00 55.06 54.62 3i1z s HIS 189 Cb -0.14 -4.21 0.10 0.00 1.11 0.00 0.00 32.58 29.44 3i1z s HIS 189 CO -0.08 -1.54 0.40 0.25 -0.85 0.00 0.00 174.74 172.92 3i1z n THR 190 N 6.11 0.00 -0.58 1.30 -2.24 0.91 -4.82 114.28 114.96 3i1z n THR 190 Ca -0.00 -0.21 -0.12 0.00 -2.27 0.00 0.00 64.05 61.45 3i1z n THR 190 Cb 0.47 -1.25 0.18 0.00 -2.10 0.00 0.00 70.33 67.63 3i1z n THR 190 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3i1z n THR 191 N -3.17 2.47 -0.72 4.28 -2.24 -1.26 -3.94 114.28 109.71 3i1z n THR 191 Ca 0.05 -1.31 0.00 0.00 -2.27 0.00 0.00 64.05 60.52 3i1z n THR 191 Cb 0.20 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 3i1z n THR 191 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i1z n TYR 192 N -0.40 0.00 -1.71 4.78 0.18 -1.26 -5.16 117.16 113.59 3i1z n TYR 192 Ca 0.38 0.00 0.00 0.00 1.88 0.00 0.00 57.90 60.16 3i1z n TYR 192 Cb 1.26 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 40.22 3i1z n TYR 192 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3i1z n GLY 193 N 0.00 1.97 2.83 -7.48 0.00 -1.25 -5.13 105.19 96.12 3i1z n GLY 193 Ca 0.00 -0.39 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 3i1z n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i1z s VAL 194 N -1.21 -0.47 -0.07 1.61 1.01 -1.26 -0.06 120.40 119.94 3i1z s VAL 194 Ca 0.00 -0.65 -0.27 0.00 0.00 0.00 0.00 61.98 61.07 3i1z s VAL 194 Cb 0.00 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 3i1z s VAL 194 CO 0.00 -0.44 0.85 -0.63 0.00 0.00 0.00 175.10 174.88 3i1z s ILE 195 N 1.91 4.92 -0.03 2.22 1.01 0.18 -4.83 121.20 126.59 3i1z s ILE 195 Ca 0.14 1.75 -0.15 0.00 0.00 0.00 0.00 60.65 62.39 3i1z s ILE 195 Cb -0.13 -4.18 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 3i1z s ILE 195 CO -0.16 0.14 0.39 -0.83 0.00 0.00 0.00 174.94 174.48 3i1z s GLY 196 N 0.98 2.43 -0.06 6.18 0.00 -1.18 -0.87 107.32 114.79 3i1z s GLY 196 Ca 0.43 -0.26 0.02 0.00 0.00 0.00 0.00 44.72 44.92 3i1z s GLY 196 CO 0.20 0.22 -0.13 0.14 0.00 0.00 0.00 173.10 173.53 3i1z s VAL 197 N -0.75 1.17 -0.08 1.40 1.01 -1.23 -1.66 120.40 120.27 3i1z s VAL 197 Ca 0.23 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.72 3i1z s VAL 197 Cb -0.16 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.17 3i1z s VAL 197 CO 0.12 0.36 -0.12 -0.54 0.00 0.00 0.00 175.10 174.92 3i1z s LYS 198 N 0.60 1.78 0.22 2.72 1.02 -0.89 -2.35 119.74 122.85 3i1z s LYS 198 Ca -0.14 -0.43 0.09 0.00 0.02 0.00 0.00 55.97 55.52 3i1z s LYS 198 Cb -0.15 -1.51 -0.04 0.00 -0.52 0.00 0.00 37.83 35.60 3i1z s LYS 198 CO 0.04 -0.01 -0.08 0.14 -0.92 0.00 0.00 175.35 174.52 3i1z s VAL 199 N 0.81 3.20 -0.04 3.17 -7.23 -1.11 -1.38 120.40 117.83 3i1z s VAL 199 Ca -0.12 -1.81 -0.01 0.00 -1.81 0.00 0.00 61.98 58.24 3i1z s VAL 199 Cb -0.15 -2.64 0.03 0.00 0.56 0.00 0.00 36.38 34.18 3i1z s VAL 199 CO 0.02 -0.22 0.02 0.26 -0.31 0.00 0.00 175.10 174.87 3i1z s TRP 200 N -1.98 0.24 -0.16 2.82 0.51 -0.22 -3.71 118.94 116.44 3i1z s TRP 200 Ca 0.27 0.07 -0.00 0.00 -2.12 0.00 0.00 56.10 54.33 3i1z s TRP 200 Cb -0.08 -0.45 0.04 0.00 -0.81 0.00 0.00 33.47 32.17 3i1z s TRP 200 CO 0.17 -0.16 -0.08 0.42 -0.51 0.00 0.00 176.95 176.78 3i1z s ILE 201 N 1.47 1.30 -0.17 2.03 1.01 -0.73 -1.00 121.20 125.10 3i1z s ILE 201 Ca -0.04 -0.66 -0.10 0.00 0.00 0.00 0.00 60.65 59.85 3i1z s ILE 201 Cb -0.13 -1.38 -0.05 0.00 0.01 0.00 0.00 42.46 40.92 3i1z s ILE 201 CO -0.03 0.23 0.16 0.12 0.00 0.00 0.00 174.94 175.43 3i1z s PHE 202 N 1.57 3.46 0.01 3.97 5.36 -0.29 -0.97 117.98 131.09 3i1z s PHE 202 Ca 0.02 0.43 -0.03 0.00 -0.96 0.00 0.00 56.93 56.38 3i1z s PHE 202 Cb -0.15 -2.14 -0.01 0.00 -0.34 0.00 0.00 43.02 40.38 3i1z s PHE 202 CO -0.08 0.38 -0.06 1.63 -1.46 0.00 0.00 175.22 175.63 3i1z n LYS 203 N 3.17 0.08 -3.92 10.12 5.02 -0.83 -0.14 118.16 131.66 3i1z n LYS 203 Ca -0.16 0.03 -0.16 0.00 -2.02 0.00 0.00 58.31 56.01 3i1z n LYS 203 Cb 0.53 -0.48 -0.05 0.00 -0.02 0.00 0.00 35.03 35.01 3i1z n LYS 203 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i1z n GLY 204 N 2.88 2.58 0.00 0.72 0.00 -1.26 -4.49 105.19 105.62 3i1z n GLY 204 Ca -0.02 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.27 3i1z n GLY 204 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i1z n GLU 205 N -0.56 0.00 0.00 1.61 -0.58 -1.26 -1.07 120.64 118.78 3i1z n GLU 205 Ca 0.04 0.28 0.13 0.00 -0.42 0.00 0.00 57.16 57.18 3i1z n GLU 205 Cb 0.55 -0.85 0.29 0.00 -0.57 0.00 0.00 31.44 30.86 3i1z n GLU 205 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16