#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2r s GLY 38 N 0.00 1.42 0.13 -1.84 0.00 -1.26 -4.93 107.32 100.83 2i2r s GLY 38 Ca 0.00 1.36 -0.15 0.00 0.00 0.00 0.00 44.72 45.92 2i2r s GLY 38 CO 0.00 3.07 1.61 -2.00 0.00 0.00 0.00 173.10 175.78 2i2r h LEU 39 N 8.70 0.63 -0.63 0.66 5.85 -2.03 -2.89 115.31 125.60 2i2r h LEU 39 Ca -0.45 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.02 2i2r h LEU 39 Cb 1.21 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.08 2i2r h LEU 39 CO 0.94 0.72 0.00 -0.08 -0.34 0.00 0.00 178.44 179.68 2i2r h GLU 40 N 0.51 0.00 0.41 1.25 4.81 -1.99 -1.37 114.58 118.19 2i2r h GLU 40 Ca 0.12 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2i2r h GLU 40 Cb 0.35 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.74 2i2r h GLU 40 CO 0.01 0.00 -0.20 1.96 -0.73 0.00 0.00 179.01 180.05 2i2r h GLN 41 N 0.00 -0.53 -0.80 1.92 7.50 -1.95 -2.90 115.11 118.35 2i2r h GLN 41 Ca 0.00 0.04 0.14 0.00 0.50 0.00 0.00 58.65 59.32 2i2r h GLN 41 Cb 0.72 0.12 -0.09 0.00 0.05 0.00 0.00 27.48 28.28 2i2r h GLN 41 CO 0.00 -0.22 0.38 -0.07 -1.50 0.00 0.00 178.83 177.42 2i2r h LEU 42 N -0.88 0.45 -0.50 1.46 3.38 -1.29 0.72 115.31 118.65 2i2r h LEU 42 Ca -0.06 0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.09 2i2r h LEU 42 Cb 0.55 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.26 2i2r h LEU 42 CO 0.09 0.20 0.07 -0.08 0.09 0.00 0.00 178.44 178.80 2i2r h GLU 43 N 0.57 0.19 0.23 1.13 4.81 -1.31 -1.12 114.58 119.08 2i2r h GLU 43 Ca 0.43 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.64 2i2r h GLU 43 Cb 0.60 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.94 2i2r h GLU 43 CO -0.36 0.12 -0.11 0.00 -0.73 0.00 0.00 179.01 177.93 2i2r h ALA 44 N 1.41 -0.31 -0.09 2.92 0.00 -0.45 -3.32 119.26 119.41 2i2r h ALA 44 Ca 0.25 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2i2r h ALA 44 Cb 0.35 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2i2r h ALA 44 CO -0.36 -0.45 0.00 0.00 0.00 0.00 0.00 179.25 178.45 2i2r n GLN 45 N -5.04 1.34 -4.20 0.00 10.64 0.22 -4.82 117.38 115.53 2i2r n GLN 45 Ca -0.09 -0.38 -0.16 0.00 -1.83 0.00 0.00 57.00 54.54 2i2r n GLN 45 Cb 0.26 -1.28 -0.08 0.00 -0.86 0.00 0.00 30.24 28.29 2i2r n GLN 45 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 2i2r s THR 46 N -1.63 0.00 -1.17 -0.39 -4.23 -0.44 -4.98 115.64 102.80 2i2r s THR 46 Ca 0.07 -1.87 0.08 0.00 -1.18 0.00 0.00 61.69 58.79 2i2r s THR 46 Cb 0.04 -2.51 0.37 0.00 1.34 0.00 0.00 72.50 71.74 2i2r s THR 46 CO 0.04 0.00 1.17 0.59 -0.54 0.00 0.00 174.62 175.88 2i2r n ASN 47 N -1.07 2.78 -4.73 3.99 5.03 -1.26 -4.82 115.26 115.18 2i2r n ASN 47 Ca 0.04 -2.28 -0.31 0.00 0.87 0.00 0.00 54.58 52.90 2i2r n ASN 47 Cb 0.63 -0.45 -0.07 0.00 -1.02 0.00 0.00 39.78 38.86 2i2r n ASN 47 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2i2r s PHE 48 N -1.73 3.10 0.66 3.10 0.08 -1.26 -5.06 117.98 116.87 2i2r s PHE 48 Ca 0.26 0.05 -0.09 0.00 0.12 0.00 0.00 56.93 57.26 2i2r s PHE 48 Cb 0.17 -1.60 0.01 0.00 -0.57 0.00 0.00 43.02 41.03 2i2r s PHE 48 CO 0.11 0.50 1.02 0.95 -0.10 0.00 0.00 175.22 177.70 2i2r s THR 49 N -1.29 3.55 0.21 0.64 -4.23 -1.26 -4.56 115.64 108.70 2i2r s THR 49 Ca 0.26 0.30 -0.09 0.00 -1.18 0.00 0.00 61.69 60.97 2i2r s THR 49 Cb -0.12 -3.47 0.15 0.00 1.34 0.00 0.00 72.50 70.40 2i2r s THR 49 CO 0.18 -0.57 1.79 0.11 -0.54 0.00 0.00 174.62 175.60 2i2r h LYS 50 N -0.47 0.61 -0.28 3.99 1.57 -1.93 0.48 116.57 120.54 2i2r h LYS 50 Ca -0.45 -0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.36 2i2r h LYS 50 Cb 1.25 -0.14 -0.07 0.00 0.08 0.00 0.00 32.23 33.35 2i2r h LYS 50 CO 0.63 0.40 -0.24 -0.09 -0.57 0.00 0.00 179.45 179.58 2i2r h ARG 51 N 0.63 -0.22 0.03 3.15 2.43 -2.00 -1.53 114.38 116.86 2i2r h ARG 51 Ca 0.31 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.49 2i2r h ARG 51 Cb 0.24 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 2i2r h ARG 51 CO -0.21 -0.15 -0.01 0.93 -1.51 0.00 0.00 179.97 179.02 2i2r h GLU 52 N -0.23 -0.03 -0.91 0.20 5.08 -1.61 -2.67 114.58 114.40 2i2r h GLU 52 Ca 0.15 0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.69 2i2r h GLU 52 Cb 0.46 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.65 2i2r h GLU 52 CO -0.42 0.18 0.59 -0.07 -1.00 0.00 0.00 179.01 178.29 2i2r h LEU 53 N -0.24 0.57 -0.45 1.33 3.38 -0.68 1.00 115.31 120.21 2i2r h LEU 53 Ca -0.00 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2i2r h LEU 53 Cb 0.23 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2i2r h LEU 53 CO 0.01 0.25 0.25 1.56 0.09 0.00 0.00 178.44 180.59 2i2r h GLN 54 N 0.58 0.63 -0.45 1.13 4.20 -0.95 0.22 115.11 120.48 2i2r h GLN 54 Ca 0.48 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 59.08 2i2r h GLN 54 Cb 0.94 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.58 2i2r h GLN 54 CO -0.22 0.51 0.16 0.28 -0.67 0.00 0.00 178.83 178.88 2i2r h VAL 55 N 0.59 1.21 0.05 -0.54 2.07 -0.66 0.13 116.25 119.09 2i2r h VAL 55 Ca 0.16 -0.69 0.01 0.00 0.82 0.00 0.00 66.70 67.00 2i2r h VAL 55 Cb 0.06 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2i2r h VAL 55 CO -0.03 0.25 -0.08 -0.07 0.02 0.00 0.00 177.57 177.67 2i2r h LEU 56 N 0.59 -0.22 -0.59 2.57 3.38 -0.90 -0.15 115.31 119.99 2i2r h LEU 56 Ca 0.15 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.22 2i2r h LEU 56 Cb 0.23 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.00 2i2r h LEU 56 CO -0.01 -0.12 0.25 0.22 0.09 0.00 0.00 178.44 178.88 2i2r h TYR 57 N -0.16 0.45 -0.29 1.13 3.20 -0.11 0.13 116.97 121.32 2i2r h TYR 57 Ca 0.02 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 2i2r h TYR 57 Cb 0.17 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 2i2r h TYR 57 CO -0.12 0.16 0.01 0.00 -1.64 0.00 0.00 178.16 176.56 2i2r h ARG 58 N 0.47 0.43 0.95 1.82 3.08 -0.48 0.46 114.38 121.12 2i2r h ARG 58 Ca 0.29 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.21 2i2r h ARG 58 Cb 0.30 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.29 2i2r h ARG 58 CO -0.25 0.46 -0.46 0.78 -1.07 0.00 0.00 179.97 179.42 2i2r h GLY 59 N 0.74 -1.35 0.23 0.04 0.00 0.28 -2.93 103.07 100.08 2i2r h GLY 59 Ca 0.09 0.50 0.06 0.00 0.00 0.00 0.00 47.33 47.99 2i2r h GLY 59 CO 0.01 -0.49 -0.19 -2.75 0.00 0.00 0.00 176.54 173.12 2i2r h PHE 60 N -1.29 -0.49 0.00 5.60 3.57 -0.51 -2.53 116.94 121.29 2i2r h PHE 60 Ca -0.13 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.40 2i2r h PHE 60 Cb 0.99 0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.98 2i2r h PHE 60 CO 0.00 -0.27 0.00 -0.22 -2.23 0.00 0.00 178.31 175.60 2i2r h LYS 61 N -0.18 0.00 0.04 1.11 3.11 -0.09 -1.26 116.57 119.30 2i2r h LYS 61 Ca 0.14 0.00 -0.32 0.00 -2.81 0.00 0.00 60.65 57.66 2i2r h LYS 61 Cb 0.40 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 31.58 2i2r h LYS 61 CO -0.36 0.00 -1.87 0.09 -2.81 0.00 0.00 179.45 174.51 2i2r n ASN 62 N -2.76 1.26 0.17 4.20 3.02 -0.98 -2.76 115.26 117.40 2i2r n ASN 62 Ca -0.02 0.31 0.05 0.00 -0.03 0.00 0.00 54.58 54.89 2i2r n ASN 62 Cb 0.07 -0.27 0.19 0.00 -0.61 0.00 0.00 39.78 39.16 2i2r n ASN 62 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2i2r h GLU 63 N 0.02 0.00 -2.81 3.52 4.39 -0.97 -3.40 114.58 115.33 2i2r h GLU 63 Ca -0.35 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.16 2i2r h GLU 63 Cb 2.03 0.00 -0.31 0.00 -0.10 0.00 0.00 28.75 30.37 2i2r h GLU 63 CO 0.07 0.40 -0.48 0.00 -1.16 0.00 0.00 179.01 177.85 2i2r h PRO 65 N 8.06 0.88 0.00 0.00 0.11 -1.74 -3.19 132.00 136.12 2i2r h PRO 65 Ca -0.19 -0.37 0.00 0.00 0.11 0.00 0.00 66.00 65.55 2i2r h PRO 65 Cb 1.12 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2i2r h PRO 65 CO 0.17 1.01 0.00 0.45 -0.21 0.00 0.00 178.00 179.42 2i2r n SER 66 N -4.22 0.00 0.00 -2.05 2.88 -1.26 -4.74 113.62 104.23 2i2r n SER 66 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 2i2r n SER 66 Cb 0.42 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 2i2r n SER 66 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2i2r n GLY 67 N -0.83 3.00 3.17 0.46 0.00 -1.20 -4.98 105.19 104.80 2i2r n GLY 67 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2i2r n GLY 67 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2i2r s VAL 68 N -1.26 2.48 -0.41 1.61 -7.23 -1.26 -4.18 120.40 110.15 2i2r s VAL 68 Ca 0.00 -0.91 -0.18 0.00 -1.81 0.00 0.00 61.98 59.08 2i2r s VAL 68 Cb 0.00 -2.13 0.02 0.00 0.56 0.00 0.00 36.38 34.82 2i2r s VAL 68 CO 0.00 0.42 0.50 -0.69 -0.31 0.00 0.00 175.10 175.01 2i2r s VAL 69 N 1.32 5.02 0.73 1.32 1.01 -0.81 -4.96 120.40 124.03 2i2r s VAL 69 Ca 0.03 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.94 2i2r s VAL 69 Cb -0.14 -4.05 0.14 0.00 0.00 0.00 0.00 36.38 32.33 2i2r s VAL 69 CO -0.09 -0.41 1.00 0.54 0.00 0.00 0.00 175.10 176.15 2i2r s ASN 70 N 1.84 4.28 0.30 3.32 4.22 -1.26 -2.43 114.94 125.21 2i2r s ASN 70 Ca 0.16 -0.57 0.06 0.00 -2.14 0.00 0.00 52.86 50.37 2i2r s ASN 70 Cb -0.16 0.28 0.46 0.00 1.28 0.00 0.00 41.25 43.12 2i2r s ASN 70 CO 0.15 -1.93 1.72 -0.08 -2.04 0.00 0.00 177.10 174.91 2i2r h GLU 71 N -0.52 0.29 -0.01 3.55 4.81 -1.96 -1.88 114.58 118.87 2i2r h GLU 71 Ca -0.33 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2i2r h GLU 71 Cb 1.26 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.64 2i2r h GLU 71 CO 0.37 0.62 0.00 -0.44 -0.73 0.00 0.00 179.01 178.83 2i2r h ASP 72 N 0.25 0.01 -0.50 1.04 5.19 -1.98 0.29 116.42 120.72 2i2r h ASP 72 Ca 0.03 -0.19 0.05 0.00 -0.62 0.00 0.00 57.03 56.30 2i2r h ASP 72 Cb 0.76 -0.00 -0.05 0.00 0.18 0.00 0.00 39.33 40.22 2i2r h ASP 72 CO 0.06 0.20 0.22 0.71 -3.12 0.00 0.00 179.24 177.31 2i2r h THR 73 N -0.18 0.90 -0.61 0.35 1.35 -1.92 -1.64 112.91 111.16 2i2r h THR 73 Ca 0.00 -0.15 0.13 0.00 -0.55 0.00 0.00 66.41 65.84 2i2r h THR 73 Cb 0.19 0.43 -0.10 0.00 -1.73 0.00 0.00 68.15 66.95 2i2r h THR 73 CO -0.00 0.08 0.04 0.15 -0.25 0.00 0.00 175.52 175.54 2i2r h PHE 74 N 0.43 0.04 0.80 4.73 3.04 -0.70 0.36 116.94 125.64 2i2r h PHE 74 Ca 0.23 0.04 -0.04 0.00 3.98 0.00 0.00 57.97 62.18 2i2r h PHE 74 Cb 0.18 0.08 0.01 0.00 2.56 0.00 0.00 35.95 38.78 2i2r h PHE 74 CO -0.13 -0.13 -0.38 0.87 -2.02 0.00 0.00 178.31 176.52 2i2r h LYS 75 N 0.16 -1.03 0.00 1.11 1.79 -0.05 -3.13 116.57 115.42 2i2r h LYS 75 Ca 0.32 0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.86 2i2r h LYS 75 Cb 0.52 0.24 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 2i2r h LYS 75 CO -0.49 -0.68 0.00 -0.56 -1.08 0.00 0.00 179.45 176.64 2i2r h GLN 76 N -1.16 0.00 0.00 3.15 3.07 -0.80 0.36 115.11 119.73 2i2r h GLN 76 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.63 2i2r h GLN 76 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.39 2i2r h GLN 76 CO 0.18 0.00 0.00 0.82 0.09 0.00 0.00 178.83 179.92 2i2r h ILE 77 N 0.00 0.00 0.00 1.86 2.04 -0.24 -2.84 117.51 118.33 2i2r h ILE 77 Ca 0.00 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.44 2i2r h ILE 77 Cb 0.38 1.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 2i2r h ILE 77 CO 0.00 0.00 -1.24 -1.22 0.00 0.00 0.00 178.15 175.69 2i2r n TYR 78 N -3.03 0.00 -0.36 1.37 4.02 0.08 -4.29 117.16 114.95 2i2r n TYR 78 Ca 0.00 0.00 0.29 0.00 -0.01 0.00 0.00 57.90 58.18 2i2r n TYR 78 Cb 0.26 -0.16 0.55 0.00 -0.02 0.00 0.00 39.34 39.97 2i2r n TYR 78 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2i2r h ALA 79 N 2.33 2.24 0.10 -0.72 0.00 -1.20 0.23 119.26 122.24 2i2r h ALA 79 Ca 0.00 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2i2r h ALA 79 Cb 0.60 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2i2r h ALA 79 CO 0.00 -0.86 -0.05 1.96 0.00 0.00 0.00 179.25 180.30 2i2r h GLN 80 N 0.21 -0.13 -0.07 0.00 7.50 -1.75 -3.36 115.11 117.51 2i2r h GLN 80 Ca 0.77 0.01 0.01 0.00 0.50 0.00 0.00 58.65 59.94 2i2r h GLN 80 Cb 2.01 0.03 -0.01 0.00 0.05 0.00 0.00 27.48 29.56 2i2r h GLN 80 CO -0.55 0.38 -0.02 1.19 -1.50 0.00 0.00 178.83 178.32 2i2r n PHE 81 N -4.87 0.01 -4.29 2.96 0.99 0.80 -4.09 117.46 108.97 2i2r n PHE 81 Ca -0.08 0.08 -0.22 0.00 -0.00 0.00 0.00 57.45 57.23 2i2r n PHE 81 Cb 0.28 -0.53 -0.13 0.00 -1.00 0.00 0.00 39.48 38.11 2i2r n PHE 81 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.76 176.70 2i2r s PHE 82 N -5.07 1.53 0.00 1.38 0.40 -1.23 -5.13 117.98 109.86 2i2r s PHE 82 Ca -0.01 -0.42 0.00 0.00 -0.60 0.00 0.00 56.93 55.90 2i2r s PHE 82 Cb 0.02 -0.86 0.00 0.00 0.51 0.00 0.00 43.02 42.69 2i2r s PHE 82 CO 0.05 0.12 0.00 -0.35 0.70 0.00 0.00 175.22 175.74 2i2r n PRO 83 N 1.32 0.00 -3.03 0.24 -0.04 -1.26 -4.29 135.00 127.95 2i2r n PRO 83 Ca -0.20 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.86 2i2r n PRO 83 Cb 0.54 -0.44 -0.00 0.00 -0.04 0.00 0.00 33.50 33.56 2i2r n PRO 83 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2i2r n HIS 84 N 0.00 2.51 -4.44 0.54 1.44 -1.26 -4.95 115.22 109.06 2i2r n HIS 84 Ca 0.00 -2.82 -0.21 0.00 -2.01 0.00 0.00 57.72 52.68 2i2r n HIS 84 Cb 0.00 -1.13 -0.10 0.00 0.12 0.00 0.00 29.99 28.88 2i2r n HIS 84 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 2i2r s GLY 85 N -1.90 2.08 -0.26 -1.39 0.00 -1.26 -4.74 107.32 99.86 2i2r s GLY 85 Ca 0.33 -1.95 0.01 0.00 0.00 0.00 0.00 44.72 43.12 2i2r s GLY 85 CO 0.06 -1.79 -0.04 -0.35 0.00 0.00 0.00 173.10 170.98 2i2r s ASP 86 N -3.48 4.08 -0.16 1.64 -1.08 -0.27 -4.94 116.67 112.47 2i2r s ASP 86 Ca 0.35 -1.36 0.15 0.00 -0.52 0.00 0.00 52.55 51.17 2i2r s ASP 86 Cb 0.08 -1.28 0.72 0.00 -1.46 0.00 0.00 42.92 40.98 2i2r s ASP 86 CO 0.15 -0.26 1.62 0.00 0.52 0.00 0.00 175.17 177.20 2i2r n ALA 87 N 4.59 3.39 0.04 3.66 0.00 -1.26 -2.23 120.51 128.70 2i2r n ALA 87 Ca -0.10 -1.61 -0.12 0.00 0.00 0.00 0.00 53.44 51.61 2i2r n ALA 87 Cb 0.43 -1.07 -0.05 0.00 0.00 0.00 0.00 19.45 18.76 2i2r n ALA 87 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2i2r h SER 88 N 3.80 -1.10 -0.47 0.00 0.87 -1.91 -1.09 113.55 113.65 2i2r h SER 88 Ca 0.00 0.14 -0.11 0.00 -1.23 0.00 0.00 61.79 60.59 2i2r h SER 88 Cb 1.60 0.45 -0.02 0.00 -0.44 0.00 0.00 62.40 63.99 2i2r h SER 88 CO 0.33 -0.41 -0.12 0.71 -0.53 0.00 0.00 176.83 176.80 2i2r h THR 89 N -0.49 1.27 -0.52 2.23 1.35 -1.87 -2.78 112.91 112.09 2i2r h THR 89 Ca 0.07 -1.26 -0.07 0.00 -0.55 0.00 0.00 66.41 64.59 2i2r h THR 89 Cb 0.60 1.01 -0.02 0.00 -1.73 0.00 0.00 68.15 68.00 2i2r h THR 89 CO -0.32 0.44 0.02 0.22 -0.25 0.00 0.00 175.52 175.64 2i2r h TYR 90 N 0.84 0.91 -0.86 4.73 3.20 -1.69 -2.72 116.97 121.40 2i2r h TYR 90 Ca 0.13 -0.13 0.20 0.00 3.14 0.00 0.00 58.73 62.07 2i2r h TYR 90 Cb 0.67 -0.25 -0.12 0.00 1.54 0.00 0.00 36.73 38.57 2i2r h TYR 90 CO 0.04 0.82 0.34 0.00 -1.64 0.00 0.00 178.16 177.73 2i2r h ALA 91 N 1.22 1.31 -0.45 1.82 0.00 -0.91 0.15 119.26 122.41 2i2r h ALA 91 Ca 0.16 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 2i2r h ALA 91 Cb 0.45 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2i2r h ALA 91 CO 0.02 -0.32 0.26 1.25 0.00 0.00 0.00 179.25 180.45 2i2r h HIS 92 N 0.39 0.60 -0.41 0.00 -0.00 -1.46 0.19 115.15 114.45 2i2r h HIS 92 Ca 0.52 -0.01 -0.14 0.00 -0.00 0.00 0.00 60.37 60.74 2i2r h HIS 92 Cb 0.95 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 28.15 2i2r h HIS 92 CO -0.17 0.44 -0.29 1.88 -0.00 0.00 0.00 177.93 179.79 2i2r h TYR 93 N 0.59 1.02 -0.72 5.26 -1.99 -1.30 -2.59 116.97 117.24 2i2r h TYR 93 Ca 0.16 -0.27 -0.06 0.00 2.00 0.00 0.00 58.73 60.56 2i2r h TYR 93 Cb 0.03 -0.23 -0.03 0.00 2.00 0.00 0.00 36.73 38.49 2i2r h TYR 93 CO -0.03 1.06 0.21 1.25 -0.00 0.00 0.00 178.16 180.65 2i2r h LEU 94 N 0.74 1.05 0.52 3.88 5.85 -0.43 -2.48 115.31 124.44 2i2r h LEU 94 Ca 0.08 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 2i2r h LEU 94 Cb 0.85 -0.28 0.01 0.00 0.37 0.00 0.00 40.66 41.61 2i2r h LEU 94 CO 0.07 0.99 -0.25 0.15 -0.34 0.00 0.00 178.44 179.06 2i2r h PHE 95 N 1.07 -0.65 0.00 1.25 3.57 -0.39 -2.82 116.94 118.98 2i2r h PHE 95 Ca 0.23 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.71 2i2r h PHE 95 Cb 0.32 0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.28 2i2r h PHE 95 CO 0.03 -0.40 0.00 0.27 -2.23 0.00 0.00 178.31 175.97 2i2r n ASN 96 N -3.96 0.64 0.06 0.41 0.23 -1.00 -0.29 115.26 111.35 2i2r n ASN 96 Ca -0.09 -1.84 -0.09 0.00 -0.53 0.00 0.00 54.58 52.03 2i2r n ASN 96 Cb 0.27 -0.32 -0.13 0.00 -2.08 0.00 0.00 39.78 37.53 2i2r n ASN 96 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2i2r h ALA 97 N 2.20 0.32 -3.00 -2.53 0.00 -1.18 -3.44 119.26 111.64 2i2r h ALA 97 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 54.91 53.96 2i2r h ALA 97 Cb 0.32 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2i2r h ALA 97 CO 0.00 1.21 0.00 1.19 0.00 0.00 0.00 179.25 181.65 2i2r n PHE 98 N -3.37 0.00 -2.45 0.00 3.01 0.60 -4.71 117.46 110.54 2i2r n PHE 98 Ca -0.03 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.41 2i2r n PHE 98 Cb 0.97 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 40.44 2i2r n PHE 98 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2i2r n ASP 99 N 0.00 -1.47 0.15 4.37 9.92 -1.24 -4.81 116.55 123.46 2i2r n ASP 99 Ca 0.00 0.44 0.03 0.00 -0.53 0.00 0.00 54.79 54.72 2i2r n ASP 99 Cb 0.00 -1.39 0.39 0.00 -0.64 0.00 0.00 41.12 39.49 2i2r n ASP 99 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2i2r h THR 100 N 0.00 1.20 0.00 -3.53 2.02 -1.92 0.36 112.91 111.03 2i2r h THR 100 Ca -0.05 -0.90 -0.09 0.00 0.77 0.00 0.00 66.41 66.14 2i2r h THR 100 Cb 1.01 1.36 -0.01 0.00 -1.74 0.00 0.00 68.15 68.77 2i2r h THR 100 CO 0.06 0.27 -0.41 0.74 0.37 0.00 0.00 175.52 176.54 2i2r h THR 101 N 0.14 0.99 -5.51 3.16 2.02 -1.95 -3.48 112.91 108.29 2i2r h THR 101 Ca 0.03 -1.60 -0.36 0.00 0.77 0.00 0.00 66.41 65.24 2i2r h THR 101 Cb 0.45 1.95 0.14 0.00 -1.74 0.00 0.00 68.15 68.95 2i2r h THR 101 CO 0.03 0.41 -0.66 0.00 0.37 0.00 0.00 175.52 175.67 2i2r n GLN 102 N -3.61 -7.19 -0.99 6.66 1.13 0.13 -4.93 117.38 108.57 2i2r n GLN 102 Ca -0.00 0.78 -0.12 0.00 -1.94 0.00 0.00 57.00 55.72 2i2r n GLN 102 Cb 0.52 -5.67 0.21 0.00 0.11 0.00 0.00 30.24 25.41 2i2r n GLN 102 CO 0.00 0.00 0.00 -2.37 -1.44 0.00 0.00 177.06 173.25 2i2r n THR 103 N -4.64 2.87 0.00 5.09 5.66 -1.26 -4.94 114.28 117.06 2i2r n THR 103 Ca -0.06 -2.19 0.00 0.00 -3.05 0.00 0.00 64.05 58.75 2i2r n THR 103 Cb 0.58 -0.38 0.00 0.00 -1.55 0.00 0.00 70.33 68.98 2i2r n THR 103 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2i2r n GLY 104 N -0.95 1.05 3.18 1.09 0.00 -1.26 -4.90 105.19 103.40 2i2r n GLY 104 Ca 0.45 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.36 2i2r n GLY 104 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2i2r s SER 105 N 0.00 1.15 -0.32 1.61 0.15 -1.26 -4.99 113.70 110.04 2i2r s SER 105 Ca 0.00 -1.04 -0.14 0.00 0.70 0.00 0.00 55.95 55.47 2i2r s SER 105 Cb 0.00 0.10 -0.02 0.00 -1.71 0.00 0.00 66.02 64.39 2i2r s SER 105 CO 0.00 -0.48 0.33 0.68 1.20 0.00 0.00 173.24 174.97 2i2r s VAL 106 N -3.63 5.20 0.58 4.45 -7.23 -1.02 -4.87 120.40 113.89 2i2r s VAL 106 Ca 0.14 0.10 -0.08 0.00 -1.81 0.00 0.00 61.98 60.33 2i2r s VAL 106 Cb 0.05 -3.76 -0.01 0.00 0.56 0.00 0.00 36.38 33.22 2i2r s VAL 106 CO -0.03 -0.01 0.93 -1.59 -0.31 0.00 0.00 175.10 174.09 2i2r s LYS 107 N 1.96 3.21 0.24 4.82 -2.85 -1.26 -1.93 119.74 123.94 2i2r s LYS 107 Ca 0.11 0.28 -0.04 0.00 -1.00 0.00 0.00 55.97 55.31 2i2r s LYS 107 Cb -0.16 -2.22 0.46 0.00 -2.06 0.00 0.00 37.83 33.85 2i2r s LYS 107 CO 0.11 -0.59 1.72 0.35 0.10 0.00 0.00 175.35 177.04 2i2r h PHE 108 N -0.17 0.45 -0.86 1.78 3.57 -1.99 -2.26 116.94 117.46 2i2r h PHE 108 Ca -0.45 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.15 2i2r h PHE 108 Cb 1.23 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.83 2i2r h PHE 108 CO 0.54 0.02 0.56 1.05 -2.23 0.00 0.00 178.31 178.26 2i2r h GLU 109 N 0.39 0.91 0.28 1.11 9.09 -1.96 0.13 114.58 124.53 2i2r h GLU 109 Ca 0.42 -0.05 -0.01 0.00 0.05 0.00 0.00 59.36 59.76 2i2r h GLU 109 Cb 0.66 -0.21 0.00 0.00 -1.65 0.00 0.00 28.75 27.55 2i2r h GLU 109 CO -0.43 0.60 -0.14 -0.44 0.05 0.00 0.00 179.01 178.66 2i2r h ASP 110 N 0.94 -0.33 -0.99 3.06 3.32 -1.81 -2.17 116.42 118.45 2i2r h ASP 110 Ca 0.38 0.01 0.17 0.00 0.02 0.00 0.00 57.03 57.61 2i2r h ASP 110 Cb 0.25 0.09 -0.10 0.00 0.22 0.00 0.00 39.33 39.79 2i2r h ASP 110 CO -0.14 -0.23 0.60 0.15 -1.72 0.00 0.00 179.24 177.90 2i2r h PHE 111 N -0.38 1.07 0.10 4.55 3.57 -0.59 -1.21 116.94 124.04 2i2r h PHE 111 Ca -0.04 0.03 -0.27 0.00 3.53 0.00 0.00 57.97 61.23 2i2r h PHE 111 Cb 0.30 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 2i2r h PHE 111 CO -0.06 0.28 -1.24 -0.39 -2.23 0.00 0.00 178.31 174.67 2i2r h VAL 112 N 0.81 1.49 0.42 1.41 -1.51 -0.90 -2.45 116.25 115.52 2i2r h VAL 112 Ca 0.55 -3.10 -0.02 0.00 -1.23 0.00 0.00 66.70 62.90 2i2r h VAL 112 Cb 0.79 2.89 0.00 0.00 -2.13 0.00 0.00 31.29 32.84 2i2r h VAL 112 CO -0.36 0.89 -0.20 0.74 -1.23 0.00 0.00 177.57 177.42 2i2r h THR 113 N 0.06 0.59 -0.96 7.19 2.02 -0.92 0.48 112.91 121.37 2i2r h THR 113 Ca -0.12 -0.05 0.14 0.00 0.77 0.00 0.00 66.41 67.14 2i2r h THR 113 Cb 1.94 0.61 -0.15 0.00 -1.74 0.00 0.00 68.15 68.81 2i2r h THR 113 CO 0.18 0.01 -0.43 0.00 0.37 0.00 0.00 175.52 175.65 2i2r h ALA 114 N -0.02 -0.01 -0.43 6.16 0.00 -1.31 0.34 119.26 123.99 2i2r h ALA 114 Ca -0.06 0.24 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 2i2r h ALA 114 Cb 0.45 1.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 2i2r h ALA 114 CO 0.10 -0.70 -0.08 -0.07 0.00 0.00 0.00 179.25 178.49 2i2r h LEU 115 N -0.02 0.73 -1.22 0.00 3.38 -1.24 0.11 115.31 117.05 2i2r h LEU 115 Ca 0.30 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2i2r h LEU 115 Cb 0.56 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2i2r h LEU 115 CO -0.95 0.85 0.37 -1.28 0.09 0.00 0.00 178.44 177.51 2i2r h SER 116 N 0.68 0.80 0.01 -0.43 0.87 0.28 0.69 113.55 116.46 2i2r h SER 116 Ca 0.12 -0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2i2r h SER 116 Cb 0.54 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 2i2r h SER 116 CO 0.03 0.64 -0.01 0.40 -0.53 0.00 0.00 176.83 177.37 2i2r h ILE 117 N 0.91 1.49 -0.29 2.23 2.04 0.16 -1.66 117.51 122.39 2i2r h ILE 117 Ca 0.23 -1.60 -0.08 0.00 1.00 0.00 0.00 64.86 64.42 2i2r h ILE 117 Cb 0.01 2.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 2i2r h ILE 117 CO -0.04 0.41 -0.15 -0.07 0.00 0.00 0.00 178.15 178.30 2i2r h LEU 118 N -0.72 0.48 0.00 1.44 4.07 -0.43 -0.97 115.31 119.18 2i2r h LEU 118 Ca -0.00 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.83 2i2r h LEU 118 Cb 0.68 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.29 2i2r h LEU 118 CO 0.00 0.66 -1.47 0.18 -1.08 0.00 0.00 178.44 176.73 2i2r n LEU 119 N -4.19 0.51 0.00 1.67 4.77 0.20 -4.76 117.00 115.21 2i2r n LEU 119 Ca 0.00 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 2i2r n LEU 119 Cb 0.34 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 2i2r n LEU 119 CO 0.41 0.12 -0.15 0.54 -1.33 0.00 0.00 177.39 176.98 2i2r n ARG 120 N -1.89 1.84 -0.47 3.23 5.12 -0.72 -4.34 116.66 119.44 2i2r n ARG 120 Ca 0.00 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.63 2i2r n ARG 120 Cb 0.45 -0.65 0.25 0.00 -1.16 0.00 0.00 32.46 31.35 2i2r n ARG 120 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2i2r n GLY 121 N 1.13 -2.58 3.73 -0.13 0.00 -0.38 -4.98 105.19 101.98 2i2r n GLY 121 Ca 0.00 -1.19 -0.35 0.00 0.00 0.00 0.00 46.02 44.49 2i2r n GLY 121 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2i2r s THR 122 N -2.28 2.48 0.17 2.61 -1.32 -1.26 -4.74 115.64 111.29 2i2r s THR 122 Ca 0.64 0.25 -0.22 0.00 -1.21 0.00 0.00 61.69 61.15 2i2r s THR 122 Cb -0.19 -2.87 0.07 0.00 -1.51 0.00 0.00 72.50 67.99 2i2r s THR 122 CO 0.63 -0.11 1.61 0.58 -2.21 0.00 0.00 174.62 175.11 2i2r h VAL 123 N 0.03 0.30 -0.73 5.08 2.07 -1.96 0.23 116.25 121.26 2i2r h VAL 123 Ca -0.48 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.18 2i2r h VAL 123 Cb 1.29 0.30 -0.14 0.00 -1.52 0.00 0.00 31.29 31.22 2i2r h VAL 123 CO 0.52 0.00 -0.25 -0.74 0.02 0.00 0.00 177.57 177.12 2i2r h HIS 124 N -0.22 -0.61 -0.30 1.57 -0.00 -1.98 0.33 115.15 113.94 2i2r h HIS 124 Ca 0.18 0.07 -0.03 0.00 -0.00 0.00 0.00 60.37 60.59 2i2r h HIS 124 Cb 0.50 0.38 -0.01 0.00 -0.00 0.00 0.00 27.41 28.28 2i2r h HIS 124 CO -0.49 -0.35 0.09 0.93 -0.00 0.00 0.00 177.93 178.11 2i2r h GLU 125 N -0.05 0.47 -0.63 5.26 5.08 -1.25 0.29 114.58 123.75 2i2r h GLU 125 Ca 0.33 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 2i2r h GLU 125 Cb 0.56 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 2i2r h GLU 125 CO -0.77 0.53 0.34 0.87 -1.00 0.00 0.00 179.01 178.98 2i2r h LYS 126 N 0.33 0.88 -0.29 2.33 1.57 -0.09 -1.16 116.57 120.13 2i2r h LYS 126 Ca 0.10 -0.11 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 2i2r h LYS 126 Cb 0.26 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 2i2r h LYS 126 CO -0.00 0.67 -0.14 -0.07 -0.57 0.00 0.00 179.45 179.34 2i2r h LEU 127 N 0.86 0.63 -1.35 2.94 3.38 -0.01 -2.16 115.31 119.61 2i2r h LEU 127 Ca 0.22 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 2i2r h LEU 127 Cb 0.05 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2i2r h LEU 127 CO -0.03 0.90 0.26 -0.09 0.09 0.00 0.00 178.44 179.56 2i2r h ARG 128 N 0.36 0.70 -0.48 1.13 2.43 -0.34 -1.38 114.38 116.80 2i2r h ARG 128 Ca 0.07 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2i2r h ARG 128 Cb 0.66 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 2i2r h ARG 128 CO 0.04 0.53 0.24 2.35 -1.51 0.00 0.00 179.97 181.63 2i2r h TRP 129 N 0.70 0.69 -0.53 2.20 7.01 -0.71 -1.52 115.95 123.78 2i2r h TRP 129 Ca 0.18 -0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.09 2i2r h TRP 129 Cb 0.05 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 26.88 2i2r h TRP 129 CO 0.00 0.54 0.10 1.15 -2.79 0.00 0.00 178.44 177.44 2i2r h THR 130 N 0.64 1.25 -0.54 2.65 2.02 -0.93 -2.92 112.91 115.07 2i2r h THR 130 Ca 0.17 -0.93 0.07 0.00 0.77 0.00 0.00 66.41 66.49 2i2r h THR 130 Cb 0.10 0.82 -0.06 0.00 -1.74 0.00 0.00 68.15 67.27 2i2r h THR 130 CO -0.02 0.34 0.24 0.15 0.37 0.00 0.00 175.52 176.59 2i2r h PHE 131 N 0.76 0.42 -0.05 3.16 3.57 -0.86 -1.17 116.94 122.78 2i2r h PHE 131 Ca 0.16 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.66 2i2r h PHE 131 Cb 0.38 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 2i2r h PHE 131 CO 0.03 0.16 -0.12 -0.91 -2.23 0.00 0.00 178.31 175.24 2i2r h ASN 132 N 0.45 0.06 -0.23 0.41 2.35 -1.14 0.13 115.58 117.62 2i2r h ASN 132 Ca 0.26 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.93 2i2r h ASN 132 Cb 0.24 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 2i2r h ASN 132 CO -0.22 0.19 -0.12 0.25 -1.65 0.00 0.00 177.43 175.88 2i2r h LEU 133 N 0.07 0.50 -0.40 1.61 5.85 -1.08 -3.22 115.31 118.64 2i2r h LEU 133 Ca 0.01 -0.42 -0.11 0.00 0.84 0.00 0.00 57.88 58.21 2i2r h LEU 133 Cb 0.25 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2i2r h LEU 133 CO 0.02 0.80 -0.16 1.88 -0.34 0.00 0.00 178.44 180.64 2i2r h TYR 134 N 0.19 0.94 -0.56 1.25 0.05 -0.51 -3.36 116.97 114.97 2i2r h TYR 134 Ca 0.05 -0.22 -0.40 0.00 0.05 0.00 0.00 58.73 58.21 2i2r h TYR 134 Cb 0.62 -0.22 -0.05 0.00 1.01 0.00 0.00 36.73 38.09 2i2r h TYR 134 CO 0.06 0.97 1.29 0.34 -1.05 0.00 0.00 178.16 179.78 2i2r s ASP 135 N -6.50 5.40 0.12 3.88 2.15 0.40 -4.74 116.67 117.39 2i2r s ASP 135 Ca -0.12 -1.79 -0.24 0.00 0.43 0.00 0.00 52.55 50.82 2i2r s ASP 135 Cb 0.10 -2.59 -0.06 0.00 -0.30 0.00 0.00 42.92 40.08 2i2r s ASP 135 CO 0.83 -2.68 1.67 0.40 -0.17 0.00 0.00 175.17 175.22 2i2r h ILE 136 N 6.09 0.58 -0.12 4.11 2.04 -1.78 -2.74 117.51 125.70 2i2r h ILE 136 Ca 0.26 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.12 2i2r h ILE 136 Cb 0.93 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 2i2r h ILE 136 CO 1.27 0.00 0.00 -0.46 0.00 0.00 0.00 178.15 178.96 2i2r n ASN 137 N -5.30 1.34 -3.40 1.72 2.04 -1.26 -4.94 115.26 105.46 2i2r n ASN 137 Ca -0.05 -2.09 -0.32 0.00 -0.44 0.00 0.00 54.58 51.68 2i2r n ASN 137 Cb 0.22 -0.34 0.03 0.00 -2.53 0.00 0.00 39.78 37.17 2i2r n ASN 137 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 2i2r n LYS 138 N 0.01 -1.98 -0.06 -3.83 4.01 -1.03 -4.96 118.16 110.32 2i2r n LYS 138 Ca 0.05 1.51 0.00 0.00 -0.51 0.00 0.00 58.31 59.36 2i2r n LYS 138 Cb 0.28 -2.83 0.00 0.00 -0.51 0.00 0.00 35.03 31.97 2i2r n LYS 138 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 2i2r n ASP 139 N -0.43 0.00 -0.42 4.39 5.68 -1.26 -5.03 116.55 119.48 2i2r n ASP 139 Ca -0.06 -1.10 -0.06 0.00 -0.50 0.00 0.00 54.79 53.07 2i2r n ASP 139 Cb 0.64 -0.02 -0.02 0.00 -1.14 0.00 0.00 41.12 40.58 2i2r n ASP 139 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2i2r n GLY 140 N 0.00 0.77 2.92 6.12 0.00 -1.26 -5.00 105.19 108.74 2i2r n GLY 140 Ca 0.00 -0.39 -0.20 0.00 0.00 0.00 0.00 46.02 45.42 2i2r n GLY 140 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2i2r s TYR 141 N -2.04 0.85 -0.24 1.61 2.02 -1.26 -4.06 117.35 114.22 2i2r s TYR 141 Ca 0.00 -0.25 -0.06 0.00 -0.37 0.00 0.00 57.07 56.39 2i2r s TYR 141 Cb 0.00 -0.71 -0.02 0.00 -0.40 0.00 0.00 41.96 40.82 2i2r s TYR 141 CO 0.00 -0.19 0.04 0.42 -1.57 0.00 0.00 175.55 174.24 2i2r s ILE 142 N 0.83 4.08 0.21 2.71 1.01 -0.30 -4.74 121.20 125.00 2i2r s ILE 142 Ca -0.12 -0.25 0.09 0.00 0.00 0.00 0.00 60.65 60.37 2i2r s ILE 142 Cb -0.15 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 2i2r s ILE 142 CO 0.01 0.37 -0.07 0.54 0.00 0.00 0.00 174.94 175.79 2i2r s ASN 143 N 1.51 4.35 0.29 3.58 4.22 -1.26 -1.84 114.94 125.79 2i2r s ASN 143 Ca 0.06 -0.61 -0.02 0.00 -2.14 0.00 0.00 52.86 50.15 2i2r s ASN 143 Cb -0.15 -0.76 0.62 0.00 1.28 0.00 0.00 41.25 42.24 2i2r s ASN 143 CO 0.02 0.07 1.57 0.07 -2.04 0.00 0.00 177.10 176.79 2i2r h LYS 144 N 2.56 0.01 -0.98 3.55 5.09 -1.99 0.15 116.57 124.96 2i2r h LYS 144 Ca -0.46 -0.00 0.17 0.00 0.09 0.00 0.00 60.65 60.45 2i2r h LYS 144 Cb 1.22 -0.00 -0.17 0.00 0.10 0.00 0.00 32.23 33.38 2i2r h LYS 144 CO 0.57 0.01 -0.34 0.39 -2.09 0.00 0.00 179.45 177.99 2i2r n GLU 145 N -5.53 -0.18 0.04 0.07 -0.58 -1.26 -1.87 120.64 111.34 2i2r n GLU 145 Ca 0.20 1.52 0.11 0.00 -0.42 0.00 0.00 57.16 58.56 2i2r n GLU 145 Cb 0.64 -2.26 -0.09 0.00 -0.57 0.00 0.00 31.44 29.17 2i2r n GLU 145 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 2i2r n GLU 146 N -5.50 0.63 -0.18 3.49 0.28 0.48 -3.48 120.64 116.37 2i2r n GLU 146 Ca 0.12 -0.03 -0.10 0.00 -0.16 0.00 0.00 57.16 57.00 2i2r n GLU 146 Cb 0.43 -1.68 0.01 0.00 1.43 0.00 0.00 31.44 31.63 2i2r n GLU 146 CO 0.00 0.00 0.00 1.98 -0.16 0.00 0.00 177.13 178.95 2i2r h MET 147 N 0.00 0.91 -0.40 3.44 4.05 -1.11 -2.71 114.93 119.11 2i2r h MET 147 Ca -0.01 -0.28 0.07 0.00 -0.28 0.00 0.00 59.70 59.19 2i2r h MET 147 Cb 1.04 -0.08 -0.06 0.00 -0.80 0.00 0.00 31.60 31.69 2i2r h MET 147 CO 0.00 0.93 0.01 0.52 0.23 0.00 0.00 176.91 178.59 2i2r h MET 148 N 0.78 0.11 -0.40 0.39 2.86 -1.45 -1.24 114.93 115.99 2i2r h MET 148 Ca 0.15 -0.01 0.08 0.00 -2.06 0.00 0.00 59.70 57.86 2i2r h MET 148 Cb 0.51 -0.02 -0.09 0.00 0.06 0.00 0.00 31.60 32.06 2i2r h MET 148 CO 0.02 0.07 -0.25 -0.44 1.06 0.00 0.00 176.91 177.38 2i2r h ASP 149 N 0.11 -0.83 0.21 1.22 3.45 -1.55 0.48 116.42 119.51 2i2r h ASP 149 Ca 0.20 0.17 -0.00 0.00 0.43 0.00 0.00 57.03 57.82 2i2r h ASP 149 Cb 0.28 0.42 -0.01 0.00 -0.56 0.00 0.00 39.33 39.45 2i2r h ASP 149 CO -0.32 -0.27 -0.17 0.40 -1.57 0.00 0.00 179.24 177.31 2i2r h ILE 150 N -0.18 0.63 -0.52 0.35 1.08 -1.02 0.26 117.51 118.11 2i2r h ILE 150 Ca 0.19 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.61 2i2r h ILE 150 Cb 0.48 0.63 -0.02 0.00 -3.07 0.00 0.00 36.82 34.84 2i2r h ILE 150 CO -0.50 0.00 0.15 0.58 -0.69 0.00 0.00 178.15 177.69 2i2r h VAL 151 N -0.39 1.24 -0.41 1.67 2.07 -1.03 -0.30 116.25 119.10 2i2r h VAL 151 Ca -0.01 -0.81 0.03 0.00 0.82 0.00 0.00 66.70 66.72 2i2r h VAL 151 Cb 0.35 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 2i2r h VAL 151 CO -0.02 0.30 0.22 0.11 0.02 0.00 0.00 177.57 178.21 2i2r h LYS 152 N 0.72 0.44 -0.64 1.57 6.56 -0.72 -0.66 116.57 123.83 2i2r h LYS 152 Ca 0.17 -0.03 0.06 0.00 -1.06 0.00 0.00 60.65 59.79 2i2r h LYS 152 Cb 0.30 -0.10 -0.04 0.00 -0.57 0.00 0.00 32.23 31.82 2i2r h LYS 152 CO -0.00 0.29 0.43 0.00 -2.06 0.00 0.00 179.45 178.10 2i2r h ALA 153 N 1.20 1.76 0.09 3.86 0.00 0.26 0.15 119.26 126.58 2i2r h ALA 153 Ca 0.17 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 2i2r h ALA 153 Cb 0.05 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 17.68 2i2r h ALA 153 CO -0.10 0.15 -0.72 0.82 0.00 0.00 0.00 179.25 179.40 2i2r h ILE 154 N 0.66 1.50 -0.86 0.00 2.04 -0.90 -2.91 117.51 117.04 2i2r h ILE 154 Ca 0.27 -2.38 0.13 0.00 1.00 0.00 0.00 64.86 63.89 2i2r h ILE 154 Cb 0.24 3.01 -0.09 0.00 -0.74 0.00 0.00 36.82 39.25 2i2r h ILE 154 CO -0.08 0.68 0.47 1.88 0.00 0.00 0.00 178.15 181.10 2i2r h TYR 155 N -0.31 0.84 -0.51 1.37 -1.99 -0.81 0.62 116.97 116.18 2i2r h TYR 155 Ca -0.12 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.64 2i2r h TYR 155 Cb 1.51 -0.24 -0.02 0.00 2.00 0.00 0.00 36.73 39.98 2i2r h TYR 155 CO 0.18 0.25 0.31 -0.44 -0.00 0.00 0.00 178.16 178.46 2i2r h ASP 156 N 0.70 0.61 -0.27 3.88 3.32 -0.81 -2.43 116.42 121.42 2i2r h ASP 156 Ca 0.46 -0.06 0.08 0.00 0.02 0.00 0.00 57.03 57.53 2i2r h ASP 156 Cb 0.58 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 2i2r h ASP 156 CO -0.33 0.49 0.23 -0.03 -1.72 0.00 0.00 179.24 177.88 2i2r h MET 157 N 0.68 0.00 0.00 3.56 4.05 -0.43 -0.70 114.93 122.10 2i2r h MET 157 Ca 0.18 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.60 2i2r h MET 157 Cb -0.01 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.79 2i2r h MET 157 CO -0.03 0.00 0.00 0.00 0.23 0.00 0.00 176.91 177.11 2i2r n MET 158 N -4.17 0.00 -2.78 0.39 -0.00 -0.83 -3.73 117.12 105.99 2i2r n MET 158 Ca 0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 57.70 57.64 2i2r n MET 158 Cb 0.38 0.00 0.08 0.00 -0.00 0.00 0.00 33.22 33.68 2i2r n MET 158 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2i2r n GLY 159 N 4.75 1.28 0.74 3.17 0.00 -1.05 -4.17 105.19 109.91 2i2r n GLY 159 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2i2r n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2r n ALA 160 N 0.09 2.12 0.00 4.61 0.00 -1.21 -3.63 120.51 122.48 2i2r n ALA 160 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2i2r n ALA 160 Cb 0.74 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.19 2i2r n ALA 160 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2i2r n TYR 161 N 0.40 -0.04 -0.10 0.00 -0.00 -1.26 -4.51 117.16 111.64 2i2r n TYR 161 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.90 57.87 2i2r n TYR 161 Cb 0.26 0.01 -0.01 0.00 -0.00 0.00 0.00 39.34 39.60 2i2r n TYR 161 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 2i2r n THR 162 N -0.96 0.00 0.00 -3.48 5.66 -1.26 -4.19 114.28 110.06 2i2r n THR 162 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2i2r n THR 162 Cb 0.00 -0.04 0.00 0.00 -1.55 0.00 0.00 70.33 68.74 2i2r n THR 162 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2i2r n TYR 163 N 0.72 0.00 -0.25 1.09 9.36 -1.26 -1.82 117.16 125.00 2i2r n TYR 163 Ca 0.05 0.00 -0.07 0.00 3.32 0.00 0.00 57.90 61.20 2i2r n TYR 163 Cb 0.00 0.00 0.04 0.00 -0.63 0.00 0.00 39.34 38.76 2i2r n TYR 163 CO 0.00 0.00 0.00 -1.35 0.22 0.00 0.00 176.86 175.73 2i2r h PRO 164 N 0.00 1.01 0.00 2.98 0.11 -1.94 -1.39 132.00 132.77 2i2r h PRO 164 Ca 0.00 -0.17 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2i2r h PRO 164 Cb 0.00 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 30.94 2i2r h PRO 164 CO 0.00 0.83 0.30 -0.39 -0.21 0.00 0.00 178.00 178.53 2i2r h VAL 165 N 0.96 0.00 -0.77 3.15 -1.51 -1.56 -3.43 116.25 113.08 2i2r h VAL 165 Ca 0.23 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.70 2i2r h VAL 165 Cb 0.19 0.41 0.00 0.00 -2.13 0.00 0.00 31.29 29.76 2i2r h VAL 165 CO -0.02 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 176.50 2i2r n LEU 166 N -2.33 0.00 -3.59 4.19 4.77 -0.52 -4.79 117.00 114.73 2i2r n LEU 166 Ca -0.01 0.03 -0.32 0.00 -0.03 0.00 0.00 56.01 55.67 2i2r n LEU 166 Cb 0.33 -0.09 0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2i2r n LEU 166 CO 0.08 0.00 -0.98 0.00 -1.33 0.00 0.00 177.39 175.16 2i2r n ALA 167 N -0.22 -4.43 0.00 -1.18 0.00 -1.24 -4.90 120.51 108.54 2i2r n ALA 167 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.01 2i2r n ALA 167 Cb 0.03 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.40 2i2r n ALA 167 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2i2r n GLU 168 N 1.92 0.00 -1.54 0.00 1.02 -1.26 -4.85 120.64 115.92 2i2r n GLU 168 Ca 0.01 0.00 -0.55 0.00 -0.02 0.00 0.00 57.16 56.60 2i2r n GLU 168 Cb 0.47 -0.62 -0.08 0.00 -0.02 0.00 0.00 31.44 31.19 2i2r n GLU 168 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2i2r n ASP 169 N -2.17 2.12 -3.84 1.62 3.85 -1.26 -4.93 116.55 111.94 2i2r n ASP 169 Ca 0.00 0.75 -0.27 0.00 -0.71 0.00 0.00 54.79 54.56 2i2r n ASP 169 Cb 0.24 -1.17 0.21 0.00 -1.35 0.00 0.00 41.12 39.05 2i2r n ASP 169 CO 0.00 0.00 0.00 1.07 -1.01 0.00 0.00 177.20 177.26 2i2r n THR 170 N 5.93 0.00 1.09 2.12 5.66 -1.26 -4.92 114.28 122.90 2i2r n THR 170 Ca 0.36 -0.18 0.13 0.00 -3.05 0.00 0.00 64.05 61.31 2i2r n THR 170 Cb 0.15 -0.72 0.34 0.00 -1.55 0.00 0.00 70.33 68.55 2i2r n THR 170 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2i2r n PRO 171 N -3.36 0.26 -0.07 1.09 -0.04 -1.26 -4.31 135.00 127.31 2i2r n PRO 171 Ca 0.06 -0.14 -0.08 0.00 -0.04 0.00 0.00 63.50 63.30 2i2r n PRO 171 Cb 0.52 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.44 2i2r n PRO 171 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2i2r h ARG 172 N 0.34 0.00 -0.17 0.54 -0.00 -1.97 -3.21 114.38 109.91 2i2r h ARG 172 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 2i2r h ARG 172 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.46 2i2r h ARG 172 CO 0.00 0.28 0.00 0.00 0.00 0.00 0.00 179.97 180.25 2i2r n GLN 173 N -4.62 0.25 0.00 0.04 10.64 -1.26 -1.92 117.38 120.50 2i2r n GLN 173 Ca -0.10 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.07 2i2r n GLN 173 Cb 0.30 -1.08 0.00 0.00 -0.86 0.00 0.00 30.24 28.60 2i2r n GLN 173 CO 0.00 0.00 0.00 1.58 -1.83 0.00 0.00 177.06 176.81 2i2r n HIS 174 N 0.10 0.00 -0.25 2.61 -0.00 -1.25 -4.25 115.22 112.18 2i2r n HIS 174 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.65 2i2r n HIS 174 Cb 0.04 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.08 2i2r n HIS 174 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 2i2r h VAL 175 N 0.00 1.26 -0.64 3.57 2.07 -1.38 -2.93 116.25 118.20 2i2r h VAL 175 Ca 0.00 -0.92 -0.00 0.00 0.82 0.00 0.00 66.70 66.59 2i2r h VAL 175 Cb 0.95 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 2i2r h VAL 175 CO 0.00 0.36 0.38 0.44 0.02 0.00 0.00 177.57 178.77 2i2r h ASP 176 N 1.05 0.77 -0.62 0.57 3.32 -1.65 0.48 116.42 120.35 2i2r h ASP 176 Ca 0.22 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 2i2r h ASP 176 Cb 0.33 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 2i2r h ASP 176 CO -0.00 0.61 0.15 -0.37 -1.72 0.00 0.00 179.24 177.90 2i2r h VAL 177 N 0.87 1.25 0.60 -1.35 -1.51 -1.73 -0.84 116.25 113.55 2i2r h VAL 177 Ca 0.23 -0.94 -0.02 0.00 -1.23 0.00 0.00 66.70 64.74 2i2r h VAL 177 Cb -0.01 0.60 -0.01 0.00 -2.13 0.00 0.00 31.29 29.73 2i2r h VAL 177 CO -0.04 0.35 -0.49 0.15 -1.23 0.00 0.00 177.57 176.31 2i2r h PHE 178 N 0.97 -1.33 -0.71 5.19 3.04 -1.18 -2.51 116.94 120.41 2i2r h PHE 178 Ca 0.20 0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.11 2i2r h PHE 178 Cb 0.36 0.50 -0.03 0.00 2.56 0.00 0.00 35.95 39.34 2i2r h PHE 178 CO 0.03 -0.68 0.27 0.74 -2.02 0.00 0.00 178.31 176.64 2i2r h PHE 179 N -1.06 1.09 0.00 0.41 -1.00 -0.84 0.63 116.94 116.17 2i2r h PHE 179 Ca -0.08 -0.09 0.00 0.00 2.81 0.00 0.00 57.97 60.61 2i2r h PHE 179 Cb 0.89 -0.32 0.00 0.00 3.61 0.00 0.00 35.95 40.12 2i2r h PHE 179 CO -0.19 0.85 0.00 1.04 -1.61 0.00 0.00 178.31 178.40 2i2r n GLN 180 N -4.35 0.20 -0.30 1.51 6.02 -0.33 -0.93 117.38 119.20 2i2r n GLN 180 Ca 0.05 0.45 0.07 0.00 -0.01 0.00 0.00 57.00 57.56 2i2r n GLN 180 Cb 0.19 -1.89 0.10 0.00 1.02 0.00 0.00 30.24 29.66 2i2r n GLN 180 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2i2r n LYS 181 N -2.27 0.91 0.00 -1.09 2.85 -0.95 -4.80 118.16 112.81 2i2r n LYS 181 Ca 0.02 -2.20 0.00 0.00 -1.05 0.00 0.00 58.31 55.08 2i2r n LYS 181 Cb 0.21 -1.17 0.00 0.00 -0.65 0.00 0.00 35.03 33.42 2i2r n LYS 181 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 177.40 177.23 2i2r n MET 182 N -0.93 0.00 -2.24 -1.58 0.00 0.17 -4.99 117.12 107.55 2i2r n MET 182 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 57.70 57.45 2i2r n MET 182 Cb 0.68 -0.27 -0.04 0.00 0.00 0.00 0.00 33.22 33.60 2i2r n MET 182 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2i2r s ASP 183 N -4.44 5.62 0.08 6.12 2.15 -0.11 -4.65 116.67 121.44 2i2r s ASP 183 Ca 0.00 -0.39 -0.37 0.00 0.43 0.00 0.00 52.55 52.22 2i2r s ASP 183 Cb 0.00 -2.55 -0.18 0.00 -0.30 0.00 0.00 42.92 39.89 2i2r s ASP 183 CO 0.00 -2.22 1.56 0.50 -0.17 0.00 0.00 175.17 174.84 2i2r h LYS 184 N 12.10 -1.08 -0.00 4.34 3.64 -1.89 -3.23 116.57 130.45 2i2r h LYS 184 Ca -0.10 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2i2r h LYS 184 Cb 1.07 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 2i2r h LYS 184 CO 1.26 -0.72 -0.12 0.27 -2.27 0.00 0.00 179.45 177.88 2i2r n ASN 185 N -5.59 0.36 -0.40 4.20 6.94 -1.26 -4.93 115.26 114.57 2i2r n ASN 185 Ca -0.13 -0.36 -0.01 0.00 -0.02 0.00 0.00 54.58 54.05 2i2r n ASN 185 Cb 0.49 -0.12 0.00 0.00 -2.36 0.00 0.00 39.78 37.79 2i2r n ASN 185 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2i2r n LYS 186 N -1.11 -0.30 -0.21 -3.83 4.01 -1.22 -4.97 118.16 110.54 2i2r n LYS 186 Ca 0.13 0.06 0.09 0.00 -0.51 0.00 0.00 58.31 58.07 2i2r n LYS 186 Cb 0.29 -3.24 0.24 0.00 -0.51 0.00 0.00 35.03 31.81 2i2r n LYS 186 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 2i2r n ASP 187 N 1.50 2.50 -0.26 4.39 3.85 -1.26 -4.93 116.55 122.34 2i2r n ASP 187 Ca -0.01 -1.95 -0.03 0.00 -0.71 0.00 0.00 54.79 52.09 2i2r n ASP 187 Cb 0.51 -0.28 -0.01 0.00 -1.35 0.00 0.00 41.12 39.99 2i2r n ASP 187 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2i2r n GLY 188 N 1.27 0.53 2.81 6.12 0.00 -1.26 -4.98 105.19 109.68 2i2r n GLY 188 Ca 0.16 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 2i2r n GLY 188 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2i2r s ILE 189 N -1.74 0.38 -0.24 -0.61 -1.16 -1.26 -4.39 121.20 112.18 2i2r s ILE 189 Ca 0.00 0.06 -0.07 0.00 -0.51 0.00 0.00 60.65 60.13 2i2r s ILE 189 Cb 0.00 -0.50 -0.03 0.00 0.61 0.00 0.00 42.46 42.55 2i2r s ILE 189 CO 0.00 0.23 0.05 0.54 -2.81 0.00 0.00 174.94 172.95 2i2r s VAL 190 N 1.56 4.16 0.45 4.00 0.11 -0.77 -4.90 120.40 125.00 2i2r s VAL 190 Ca -0.01 -0.22 0.05 0.00 -2.93 0.00 0.00 61.98 58.86 2i2r s VAL 190 Cb -0.13 -2.94 0.01 0.00 -1.53 0.00 0.00 36.38 31.80 2i2r s VAL 190 CO -0.03 0.36 0.62 0.42 -3.33 0.00 0.00 175.10 173.14 2i2r s THR 191 N 1.57 3.22 0.14 5.04 -4.23 -1.26 -1.15 115.64 118.96 2i2r s THR 191 Ca 0.06 -0.84 -0.18 0.00 -1.18 0.00 0.00 61.69 59.56 2i2r s THR 191 Cb -0.15 -3.13 -0.01 0.00 1.34 0.00 0.00 72.50 70.54 2i2r s THR 191 CO 0.02 -0.07 1.77 0.25 -0.54 0.00 0.00 174.62 176.05 2i2r h LEU 192 N 0.49 0.21 -1.06 4.79 5.85 -1.99 0.18 115.31 123.78 2i2r h LEU 192 Ca -0.42 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.29 2i2r h LEU 192 Cb 1.28 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 2i2r h LEU 192 CO 0.50 0.16 0.36 0.44 -0.34 0.00 0.00 178.44 179.56 2i2r h ASP 193 N 0.30 0.93 -0.65 1.25 3.45 -1.95 0.35 116.42 120.10 2i2r h ASP 193 Ca 0.13 -0.09 -0.03 0.00 0.43 0.00 0.00 57.03 57.47 2i2r h ASP 193 Cb 0.05 -0.24 -0.03 0.00 -0.56 0.00 0.00 39.33 38.55 2i2r h ASP 193 CO -0.09 0.77 0.30 -0.08 -1.57 0.00 0.00 179.24 178.57 2i2r h GLU 194 N 1.03 0.94 -0.16 3.56 4.81 -1.64 -1.97 114.58 121.15 2i2r h GLU 194 Ca 0.25 -0.15 -0.20 0.00 -0.13 0.00 0.00 59.36 59.14 2i2r h GLU 194 Cb 0.08 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.30 2i2r h GLU 194 CO -0.04 0.76 -0.69 0.35 -0.73 0.00 0.00 179.01 178.66 2i2r h PHE 195 N 0.90 0.89 0.66 0.92 3.57 -0.06 -2.40 116.94 121.42 2i2r h PHE 195 Ca 0.22 -0.37 -0.03 0.00 3.53 0.00 0.00 57.97 61.32 2i2r h PHE 195 Cb 0.14 -0.15 0.01 0.00 2.79 0.00 0.00 35.95 38.73 2i2r h PHE 195 CO 0.00 1.17 -0.32 -0.07 -2.23 0.00 0.00 178.31 176.86 2i2r h LEU 196 N 0.48 -0.75 -1.58 0.59 3.38 -0.26 -2.78 115.31 114.39 2i2r h LEU 196 Ca -0.03 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2i2r h LEU 196 Cb 1.29 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.23 2i2r h LEU 196 CO 0.14 -0.41 -0.12 -0.08 0.09 0.00 0.00 178.44 178.06 2i2r h GLU 197 N -1.11 0.12 -0.27 1.13 4.81 -1.47 -2.37 114.58 115.43 2i2r h GLU 197 Ca -0.09 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.01 2i2r h GLU 197 Cb 0.72 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 2i2r h GLU 197 CO 0.15 0.25 -0.27 1.03 -0.73 0.00 0.00 179.01 179.43 2i2r h SER 198 N 0.12 0.53 0.59 1.04 0.87 -1.42 -2.98 113.55 112.30 2i2r h SER 198 Ca 0.03 -0.19 -0.28 0.00 -1.23 0.00 0.00 61.79 60.11 2i2r h SER 198 Cb 0.28 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 2i2r h SER 198 CO 0.02 0.79 -1.41 0.00 -0.53 0.00 0.00 176.83 175.69 2i2r h GLN 200 N 0.05 0.66 0.00 0.00 1.08 -1.46 -0.98 115.11 114.45 2i2r h GLN 200 Ca -0.19 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 56.95 2i2r h GLN 200 Cb 1.96 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 29.24 2i2r h GLN 200 CO 0.15 0.44 -0.09 0.93 -0.95 0.00 0.00 178.83 179.31 2i2r h GLU 201 N 0.68 0.00 -5.02 1.46 3.07 -1.57 -3.41 114.58 109.79 2i2r h GLU 201 Ca 0.18 0.00 -0.69 0.00 -0.50 0.00 0.00 59.36 58.35 2i2r h GLU 201 Cb -0.07 0.00 -0.18 0.00 -0.84 0.00 0.00 28.75 27.66 2i2r h GLU 201 CO -0.04 0.09 0.80 0.34 -1.40 0.00 0.00 179.01 178.80 2i2r s ASP 202 N -5.88 6.60 0.44 1.42 -1.08 -0.37 -4.93 116.67 112.86 2i2r s ASP 202 Ca -0.01 -1.99 0.30 0.00 -0.52 0.00 0.00 52.55 50.33 2i2r s ASP 202 Cb 0.11 -2.40 1.41 0.00 -1.46 0.00 0.00 42.92 40.59 2i2r s ASP 202 CO 0.56 -1.08 1.63 0.44 0.52 0.00 0.00 175.17 177.24 2i2r h ASP 203 N 8.86 0.25 0.16 -0.34 3.32 -1.82 -2.21 116.42 124.65 2i2r h ASP 203 Ca 0.13 0.13 -0.36 0.00 0.02 0.00 0.00 57.03 56.95 2i2r h ASP 203 Cb 1.03 0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 2i2r h ASP 203 CO 1.11 -0.16 -1.90 0.78 -1.72 0.00 0.00 179.24 177.34 2i2r h ASN 204 N 0.10 0.48 0.11 6.45 2.35 -1.92 -2.89 115.58 120.26 2i2r h ASN 204 Ca 0.81 -0.93 0.00 0.00 -0.55 0.00 0.00 56.30 55.63 2i2r h ASN 204 Cb 2.53 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 40.75 2i2r h ASN 204 CO -0.40 1.82 0.00 0.40 -1.65 0.00 0.00 177.43 177.59 2i2r h ILE 205 N 0.08 0.00 0.00 2.81 5.03 -1.72 -2.42 117.51 121.30 2i2r h ILE 205 Ca -0.39 -0.04 -0.14 0.00 -0.12 0.00 0.00 64.86 64.17 2i2r h ILE 205 Cb 2.06 0.59 -0.02 0.00 -3.03 0.00 0.00 36.82 36.42 2i2r h ILE 205 CO 0.12 0.00 -0.79 0.24 -0.68 0.00 0.00 178.15 177.04 2i2r h MET 206 N 0.00 0.00 0.00 2.37 2.86 -1.48 -3.23 114.93 115.44 2i2r h MET 206 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2i2r h MET 206 Cb 0.05 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.71 2i2r h MET 206 CO 0.00 0.92 -0.04 0.07 1.06 0.00 0.00 176.91 178.92 2i2r h ARG 207 N -1.00 0.00 0.00 1.72 0.11 -1.41 -3.13 114.38 110.67 2i2r h ARG 207 Ca -0.21 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.87 2i2r h ARG 207 Cb 1.13 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.21 2i2r h ARG 207 CO -0.13 0.04 0.00 0.45 0.10 0.00 0.00 179.97 180.43 2i2r n SER 208 N -3.14 0.00 -0.13 0.08 2.88 -0.92 -2.50 113.62 109.89 2i2r n SER 208 Ca 0.01 0.95 0.04 0.00 -1.33 0.00 0.00 58.87 58.54 2i2r n SER 208 Cb 0.37 -0.45 0.08 0.00 -0.75 0.00 0.00 64.21 63.46 2i2r n SER 208 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2i2r n LEU 209 N -1.88 -0.09 -0.03 2.46 4.77 -1.22 -2.68 117.00 118.33 2i2r n LEU 209 Ca 0.00 0.63 -0.20 0.00 -0.03 0.00 0.00 56.01 56.41 2i2r n LEU 209 Cb 0.00 -0.21 -0.13 0.00 -2.33 0.00 0.00 43.42 40.75 2i2r n LEU 209 CO 0.00 -0.62 -0.27 1.56 -1.33 0.00 0.00 177.39 176.73 2i2r h GLN 210 N 0.00 0.14 -0.94 3.23 4.20 -1.55 -3.47 115.11 116.72 2i2r h GLN 210 Ca 0.20 -0.23 -0.13 0.00 0.06 0.00 0.00 58.65 58.55 2i2r h GLN 210 Cb 0.36 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 2i2r h GLN 210 CO -0.36 1.11 0.17 1.28 -0.67 0.00 0.00 178.83 180.36 2i2r n LEU 211 N -4.19 0.15 -4.55 1.46 7.99 -1.04 -4.54 117.00 112.27 2i2r n LEU 211 Ca -0.23 0.14 -0.31 0.00 -0.01 0.00 0.00 56.01 55.59 2i2r n LEU 211 Cb 0.76 -0.14 -0.04 0.00 -0.11 0.00 0.00 43.42 43.89 2i2r n LEU 211 CO 0.34 -0.12 1.79 0.12 -1.51 0.00 0.00 177.39 178.01 2i2r s PHE 212 N 0.76 1.16 1.12 -1.77 5.36 -1.26 -4.99 117.98 118.36 2i2r s PHE 212 Ca 0.18 1.56 -0.14 0.00 -0.96 0.00 0.00 56.93 57.57 2i2r s PHE 212 Cb -0.23 -3.61 0.25 0.00 -0.34 0.00 0.00 43.02 39.09 2i2r s PHE 212 CO 0.11 -2.28 1.06 1.14 -1.46 0.00 0.00 175.22 173.79 2i2r s GLN 213 N 8.25 -0.55 -0.30 10.12 -2.07 -1.26 -5.05 119.66 128.80 2i2r s GLN 213 Ca 0.93 0.55 -0.03 0.00 -1.82 0.00 0.00 55.36 54.99 2i2r s GLN 213 Cb -0.15 -1.62 0.10 0.00 -1.09 0.00 0.00 33.01 30.25 2i2r s GLN 213 CO 0.21 -3.40 0.12 1.21 -1.32 0.00 0.00 175.29 172.11 2i2r s ASN 214 N -3.08 3.69 -0.91 12.60 2.47 -1.26 -5.05 114.94 123.40 2i2r s ASN 214 Ca 0.67 -1.43 -0.23 0.00 0.42 0.00 0.00 52.86 52.29 2i2r s ASN 214 Cb -0.20 -0.52 0.06 0.00 -1.45 0.00 0.00 41.25 39.14 2i2r s ASN 214 CO 0.61 -0.43 1.30 0.54 -3.72 0.00 0.00 177.10 175.40 2i2r s VAL 215 N 1.91 4.08 0.00 -5.21 0.11 -1.26 -5.24 120.40 114.80 2i2r s VAL 215 Ca 0.09 -0.63 0.00 0.00 -2.93 0.00 0.00 61.98 58.51 2i2r s VAL 215 Cb -0.17 -4.94 0.00 0.00 -1.53 0.00 0.00 36.38 29.75 2i2r s VAL 215 CO -0.32 -1.79 0.00 0.80 -3.33 0.00 0.00 175.10 170.46