#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2r n GLY 38 N 0.00 1.12 0.20 8.31 0.00 -1.26 -4.93 105.19 108.63 2i2r n GLY 38 Ca 0.00 0.66 -0.11 0.00 0.00 0.00 0.00 46.02 46.58 2i2r n GLY 38 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2i2r h LEU 39 N 6.04 0.60 -0.38 0.99 5.85 -2.03 -2.87 115.31 123.52 2i2r h LEU 39 Ca -0.45 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 57.97 2i2r h LEU 39 Cb 1.26 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2i2r h LEU 39 CO 0.89 0.76 0.00 -0.08 -0.34 0.00 0.00 178.44 179.66 2i2r h GLU 40 N 0.43 0.00 0.32 1.25 4.81 -2.00 -0.98 114.58 118.42 2i2r h GLU 40 Ca 0.10 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 2i2r h GLU 40 Cb 0.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.83 2i2r h GLU 40 CO 0.02 0.00 -0.15 1.96 -0.73 0.00 0.00 179.01 180.10 2i2r h GLN 41 N 0.00 -0.41 -0.98 1.92 7.50 -1.95 -2.91 115.11 118.27 2i2r h GLN 41 Ca 0.00 0.03 0.17 0.00 0.50 0.00 0.00 58.65 59.34 2i2r h GLN 41 Cb 0.71 0.09 -0.10 0.00 0.05 0.00 0.00 27.48 28.23 2i2r h GLN 41 CO 0.00 -0.09 0.59 -0.07 -1.50 0.00 0.00 178.83 177.77 2i2r h LEU 42 N -0.83 0.79 -0.36 1.46 3.38 -1.24 0.54 115.31 119.05 2i2r h LEU 42 Ca -0.04 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.05 2i2r h LEU 42 Cb 0.52 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 2i2r h LEU 42 CO 0.07 0.33 0.13 -0.08 0.09 0.00 0.00 178.44 178.98 2i2r h GLU 43 N 0.81 0.28 0.35 1.13 4.81 -1.23 -1.35 114.58 119.38 2i2r h GLU 43 Ca 0.54 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.74 2i2r h GLU 43 Cb 0.76 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.08 2i2r h GLU 43 CO -0.35 0.18 -0.17 0.00 -0.73 0.00 0.00 179.01 177.95 2i2r h ALA 44 N 1.23 -0.47 -0.03 2.92 0.00 -0.51 -3.33 119.26 119.06 2i2r h ALA 44 Ca 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2i2r h ALA 44 Cb 0.13 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2i2r h ALA 44 CO -0.16 -0.57 0.00 0.00 0.00 0.00 0.00 179.25 178.52 2i2r n GLN 45 N -5.14 1.09 -4.16 0.00 10.64 0.16 -4.81 117.38 115.16 2i2r n GLN 45 Ca -0.09 -0.12 -0.13 0.00 -1.83 0.00 0.00 57.00 54.82 2i2r n GLN 45 Cb 0.28 -1.14 -0.08 0.00 -0.86 0.00 0.00 30.24 28.44 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 -1.76 0.00 -1.25 -0.39 -4.23 -0.52 -4.99 115.64 102.50 2i2r s THR 46 Ca 0.02 -1.83 0.07 0.00 -1.18 0.00 0.00 61.69 58.77 2i2r s THR 46 Cb 0.01 -2.47 0.28 0.00 1.34 0.00 0.00 72.50 71.67 2i2r s THR 46 CO 0.01 0.00 1.07 0.59 -0.54 0.00 0.00 174.62 175.75 2i2r n ASN 47 N -0.73 2.25 -4.82 3.99 5.03 -1.26 -4.80 115.26 114.92 2i2r n ASN 47 Ca 0.02 -2.20 -0.31 0.00 0.87 0.00 0.00 54.58 52.96 2i2r n ASN 47 Cb 0.64 -0.41 -0.06 0.00 -1.02 0.00 0.00 39.78 38.93 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 -1.65 3.30 0.62 3.10 0.08 -1.26 -5.07 117.98 117.10 2i2r s PHE 48 Ca 0.20 0.14 -0.09 0.00 0.12 0.00 0.00 56.93 57.30 2i2r s PHE 48 Cb 0.13 -1.67 -0.01 0.00 -0.57 0.00 0.00 43.02 40.90 2i2r s PHE 48 CO 0.09 0.55 0.98 0.95 -0.10 0.00 0.00 175.22 177.68 2i2r s THR 49 N -1.41 4.11 0.27 0.64 -4.23 -1.26 -4.60 115.64 109.16 2i2r s THR 49 Ca 0.30 0.43 -0.00 0.00 -1.18 0.00 0.00 61.69 61.25 2i2r s THR 49 Cb -0.12 -3.65 0.26 0.00 1.34 0.00 0.00 72.50 70.32 2i2r s THR 49 CO 0.23 -0.78 1.80 0.11 -0.54 0.00 0.00 174.62 175.44 2i2r h LYS 50 N -0.30 0.77 -0.06 3.99 1.57 -1.93 0.33 116.57 120.93 2i2r h LYS 50 Ca -0.45 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.32 2i2r h LYS 50 Cb 1.23 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 33.32 2i2r h LYS 50 CO 0.62 0.51 -0.20 -0.09 -0.57 0.00 0.00 179.45 179.72 2i2r h ARG 51 N 0.79 -0.28 -0.11 3.15 2.43 -2.00 -1.43 114.38 116.94 2i2r h ARG 51 Ca 0.48 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.66 2i2r h ARG 51 Cb 0.58 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 2i2r h ARG 51 CO -0.31 -0.18 0.03 0.93 -1.51 0.00 0.00 179.97 178.93 2i2r h GLU 52 N -0.29 0.17 -0.89 0.20 5.08 -1.65 -2.80 114.58 114.40 2i2r h GLU 52 Ca 0.08 -0.04 0.13 0.00 -1.00 0.00 0.00 59.36 58.53 2i2r h GLU 52 Cb 0.40 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.55 2i2r h GLU 52 CO -0.23 0.32 0.57 -0.07 -1.00 0.00 0.00 179.01 178.60 2i2r h LEU 53 N -0.02 0.70 -0.30 1.33 3.38 -0.77 0.35 115.31 119.98 2i2r h LEU 53 Ca 0.03 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2i2r h LEU 53 Cb 0.22 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2i2r h LEU 53 CO -0.00 0.37 0.16 1.56 0.09 0.00 0.00 178.44 180.61 2i2r h GLN 54 N 0.75 0.42 -0.43 1.13 4.20 -1.01 0.22 115.11 120.38 2i2r h GLN 54 Ca 0.44 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 59.09 2i2r h GLN 54 Cb 0.64 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 2i2r h GLN 54 CO -0.20 0.37 0.23 0.28 -0.67 0.00 0.00 178.83 178.83 2i2r h VAL 55 N 0.36 1.17 -0.28 -0.54 2.07 -0.81 0.76 116.25 118.98 2i2r h VAL 55 Ca 0.10 -0.45 0.02 0.00 0.82 0.00 0.00 66.70 67.19 2i2r h VAL 55 Cb 0.08 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2i2r h VAL 55 CO -0.02 0.18 0.15 -0.07 0.02 0.00 0.00 177.57 177.83 2i2r h LEU 56 N 0.56 0.22 -0.59 2.57 3.38 -0.86 -0.50 115.31 120.09 2i2r h LEU 56 Ca 0.15 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.18 2i2r h LEU 56 Cb 0.08 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 2i2r h LEU 56 CO -0.02 0.17 0.32 0.22 0.09 0.00 0.00 178.44 179.21 2i2r h TYR 57 N 0.31 0.58 -0.12 1.13 3.20 0.23 0.76 116.97 123.05 2i2r h TYR 57 Ca 0.11 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.95 2i2r h TYR 57 Cb 0.03 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 2i2r h TYR 57 CO -0.09 0.28 -0.21 0.00 -1.64 0.00 0.00 178.16 176.50 2i2r h ARG 58 N 0.60 0.20 0.42 1.82 3.08 -0.55 0.57 114.38 120.52 2i2r h ARG 58 Ca 0.26 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.24 2i2r h ARG 58 Cb 0.16 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2i2r h ARG 58 CO -0.17 0.40 -0.20 0.78 -1.07 0.00 0.00 179.97 179.71 2i2r h GLY 59 N 0.85 -0.59 0.83 0.04 0.00 -0.13 -3.03 103.07 101.04 2i2r h GLY 59 Ca 0.03 0.22 0.02 0.00 0.00 0.00 0.00 47.33 47.60 2i2r h GLY 59 CO 0.03 -0.21 -0.04 -2.75 0.00 0.00 0.00 176.54 173.57 2i2r h PHE 60 N -0.76 -0.09 0.00 5.60 3.57 -0.17 -2.76 116.94 122.33 2i2r h PHE 60 Ca -0.06 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.45 2i2r h PHE 60 Cb 0.53 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.32 2i2r h PHE 60 CO -0.00 -0.06 0.00 -0.22 -2.23 0.00 0.00 178.31 175.79 2i2r h LYS 61 N -0.05 0.00 0.03 1.11 3.11 0.07 -0.62 116.57 120.22 2i2r h LYS 61 Ca 0.04 0.00 -0.32 0.00 -2.81 0.00 0.00 60.65 57.56 2i2r h LYS 61 Cb 0.10 0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 31.28 2i2r h LYS 61 CO -0.08 0.00 -1.84 0.09 -2.81 0.00 0.00 179.45 174.81 2i2r n ASN 62 N -2.71 1.09 0.16 4.20 3.02 -1.07 -2.89 115.26 117.07 2i2r n ASN 62 Ca -0.01 0.33 0.04 0.00 -0.03 0.00 0.00 54.58 54.90 2i2r n ASN 62 Cb 0.10 -0.16 0.18 0.00 -0.61 0.00 0.00 39.78 39.29 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 -2.80 3.52 4.39 -0.87 -3.40 114.58 115.44 2i2r h GLU 63 Ca -0.34 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.18 2i2r h GLU 63 Cb 2.03 0.00 -0.30 0.00 -0.10 0.00 0.00 28.75 30.38 2i2r h GLU 63 CO 0.07 0.46 -0.47 0.00 -1.16 0.00 0.00 179.01 177.92 2i2r h PRO 65 N 7.98 0.88 0.00 0.00 0.11 -1.75 -3.23 132.00 135.99 2i2r h PRO 65 Ca -0.21 -0.40 0.00 0.00 0.11 0.00 0.00 66.00 65.51 2i2r h PRO 65 Cb 1.13 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2i2r h PRO 65 CO 0.18 1.04 0.00 0.45 -0.21 0.00 0.00 178.00 179.47 2i2r n SER 66 N -4.09 0.00 0.00 -2.05 2.88 -1.26 -4.73 113.62 104.37 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 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 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 -0.96 2.96 3.22 0.46 0.00 -1.22 -4.98 105.19 104.67 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 -1.41 2.64 -0.42 1.61 -7.23 -1.26 -4.19 120.40 110.13 2i2r s VAL 68 Ca 0.00 -0.76 -0.16 0.00 -1.81 0.00 0.00 61.98 59.25 2i2r s VAL 68 Cb 0.00 -2.14 0.02 0.00 0.56 0.00 0.00 36.38 34.82 2i2r s VAL 68 CO 0.00 0.50 0.38 -0.69 -0.31 0.00 0.00 175.10 174.98 2i2r s VAL 69 N 1.20 5.16 0.62 1.32 1.01 -0.78 -4.96 120.40 123.96 2i2r s VAL 69 Ca 0.02 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.52 2i2r s VAL 69 Cb -0.14 -4.00 0.12 0.00 0.00 0.00 0.00 36.38 32.36 2i2r s VAL 69 CO -0.06 -0.38 0.85 -0.46 0.00 0.00 0.00 175.10 175.05 2i2r n ASN 70 N 5.42 1.26 0.06 3.32 6.94 -1.26 -2.30 115.26 128.70 2i2r n ASN 70 Ca -0.09 -2.04 -0.04 0.00 -0.02 0.00 0.00 54.58 52.39 2i2r n ASN 70 Cb 0.47 -0.54 0.17 0.00 -2.36 0.00 0.00 39.78 37.53 2i2r n ASN 70 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 2i2r h GLU 71 N 0.00 0.34 -0.14 -3.83 4.81 -1.96 -1.93 114.58 111.87 2i2r h GLU 71 Ca -0.28 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 2i2r h GLU 71 Cb 1.07 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 2i2r h GLU 71 CO 0.31 0.72 0.04 -0.44 -0.73 0.00 0.00 179.01 178.92 2i2r h ASP 72 N 0.28 0.21 -0.69 1.04 5.19 -1.98 0.50 116.42 120.95 2i2r h ASP 72 Ca 0.02 -0.21 0.04 0.00 -0.62 0.00 0.00 57.03 56.27 2i2r h ASP 72 Cb 0.89 -0.05 -0.05 0.00 0.18 0.00 0.00 39.33 40.30 2i2r h ASP 72 CO 0.07 0.36 0.42 0.71 -3.12 0.00 0.00 179.24 177.68 2i2r h THR 73 N 0.04 1.05 -0.36 0.35 1.35 -1.92 -1.77 112.91 111.66 2i2r h THR 73 Ca 0.05 -0.28 0.07 0.00 -0.55 0.00 0.00 66.41 65.70 2i2r h THR 73 Cb 0.23 0.18 -0.07 0.00 -1.73 0.00 0.00 68.15 66.76 2i2r h THR 73 CO -0.00 0.15 -0.08 0.15 -0.25 0.00 0.00 175.52 175.48 2i2r h PHE 74 N 0.80 -0.17 0.71 4.73 3.04 -0.51 0.37 116.94 125.90 2i2r h PHE 74 Ca 0.29 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 62.24 2i2r h PHE 74 Cb 0.08 0.13 -0.00 0.00 2.56 0.00 0.00 35.95 38.73 2i2r h PHE 74 CO -0.05 -0.15 -0.42 0.87 -2.02 0.00 0.00 178.31 176.54 2i2r h LYS 75 N 0.01 -1.01 0.00 1.11 1.79 0.20 -3.15 116.57 115.51 2i2r h LYS 75 Ca 0.17 0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 2i2r h LYS 75 Cb 0.26 0.23 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 2i2r h LYS 75 CO -0.36 -0.68 0.00 -0.56 -1.08 0.00 0.00 179.45 176.77 2i2r h GLN 76 N -1.05 0.00 0.00 3.15 3.07 -1.02 0.35 115.11 119.61 2i2r h GLN 76 Ca -0.10 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.64 2i2r h GLN 76 Cb 0.84 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.40 2i2r h GLN 76 CO 0.11 0.00 -0.04 0.82 0.09 0.00 0.00 178.83 179.80 2i2r h ILE 77 N 0.00 0.13 0.00 1.86 2.04 -0.23 -2.82 117.51 118.48 2i2r h ILE 77 Ca 0.00 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.32 2i2r h ILE 77 Cb 0.29 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 2i2r h ILE 77 CO 0.00 0.04 -1.28 -1.22 0.00 0.00 0.00 178.15 175.69 2i2r n TYR 78 N -3.18 0.00 -0.35 1.37 4.02 0.08 -4.29 117.16 114.81 2i2r n TYR 78 Ca -0.00 0.00 0.25 0.00 -0.01 0.00 0.00 57.90 58.14 2i2r n TYR 78 Cb 0.29 -0.15 0.50 0.00 -0.02 0.00 0.00 39.34 39.96 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 2.65 2.11 0.13 -0.72 0.00 -1.19 0.49 119.26 122.72 2i2r h ALA 79 Ca 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2i2r h ALA 79 Cb 0.64 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2i2r h ALA 79 CO 0.00 -0.68 -0.06 1.96 0.00 0.00 0.00 179.25 180.47 2i2r h GLN 80 N 0.32 -0.17 -0.07 0.00 7.50 -1.75 -3.37 115.11 117.57 2i2r h GLN 80 Ca 0.72 0.01 0.01 0.00 0.50 0.00 0.00 58.65 59.89 2i2r h GLN 80 Cb 1.75 0.04 -0.01 0.00 0.05 0.00 0.00 27.48 29.30 2i2r h GLN 80 CO -0.51 0.29 -0.02 1.19 -1.50 0.00 0.00 178.83 178.28 2i2r n PHE 81 N -4.91 0.02 -4.33 2.96 0.99 0.16 -4.03 117.46 108.33 2i2r n PHE 81 Ca -0.08 0.09 -0.22 0.00 -0.00 0.00 0.00 57.45 57.24 2i2r n PHE 81 Cb 0.27 -0.54 -0.13 0.00 -1.00 0.00 0.00 39.48 38.09 2i2r n PHE 81 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.76 176.17 2i2r s PHE 82 N -5.08 1.55 0.00 1.38 -0.00 -1.23 -5.13 117.98 109.46 2i2r s PHE 82 Ca -0.01 -0.41 0.00 0.00 -0.00 0.00 0.00 56.93 56.51 2i2r s PHE 82 Cb 0.02 -0.88 0.00 0.00 -0.00 0.00 0.00 43.02 42.16 2i2r s PHE 82 CO 0.06 0.12 0.00 -0.35 -0.00 0.00 0.00 175.22 175.05 2i2r n PRO 83 N 1.41 0.00 -2.97 1.99 -0.04 -1.26 -4.35 135.00 129.78 2i2r n PRO 83 Ca -0.19 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.86 2i2r n PRO 83 Cb 0.54 -0.38 0.00 0.00 -0.04 0.00 0.00 33.50 33.62 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 -4.45 0.54 1.44 -1.26 -4.95 115.22 109.05 2i2r n HIS 84 Ca 0.00 -2.75 -0.22 0.00 -2.01 0.00 0.00 57.72 52.74 2i2r n HIS 84 Cb 0.00 -1.16 -0.10 0.00 0.12 0.00 0.00 29.99 28.85 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 -1.83 2.10 -0.26 -1.39 0.00 -1.26 -5.13 107.32 99.55 2i2r s GLY 85 Ca 0.34 -2.00 0.01 0.00 0.00 0.00 0.00 44.72 43.07 2i2r s GLY 85 CO 0.05 -1.81 -0.03 -0.35 0.00 0.00 0.00 173.10 170.96 2i2r s ASP 86 N -3.49 4.02 -0.15 1.64 -1.08 0.11 -4.94 116.67 112.79 2i2r s ASP 86 Ca 0.36 -1.37 0.14 0.00 -0.52 0.00 0.00 52.55 51.16 2i2r s ASP 86 Cb 0.08 -1.22 0.68 0.00 -1.46 0.00 0.00 42.92 41.00 2i2r s ASP 86 CO 0.15 -0.27 1.57 0.00 0.52 0.00 0.00 175.17 177.14 2i2r n ALA 87 N 4.62 3.35 0.03 3.66 0.00 -1.26 -2.04 120.51 128.87 2i2r n ALA 87 Ca -0.09 -1.53 -0.11 0.00 0.00 0.00 0.00 53.44 51.71 2i2r n ALA 87 Cb 0.43 -1.07 -0.05 0.00 0.00 0.00 0.00 19.45 18.77 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 3.60 -1.01 -0.63 0.00 0.87 -1.91 -0.93 113.55 113.54 2i2r h SER 88 Ca 0.00 0.14 -0.09 0.00 -1.23 0.00 0.00 61.79 60.61 2i2r h SER 88 Cb 1.54 0.42 -0.02 0.00 -0.44 0.00 0.00 62.40 63.89 2i2r h SER 88 CO 0.31 -0.38 0.06 0.71 -0.53 0.00 0.00 176.83 177.01 2i2r h THR 89 N -0.45 1.26 -0.64 2.23 1.35 -1.88 -2.99 112.91 111.79 2i2r h THR 89 Ca 0.08 -1.08 -0.04 0.00 -0.55 0.00 0.00 66.41 64.81 2i2r h THR 89 Cb 0.56 0.70 -0.03 0.00 -1.73 0.00 0.00 68.15 67.66 2i2r h THR 89 CO -0.31 0.40 0.23 0.22 -0.25 0.00 0.00 175.52 175.81 2i2r h TYR 90 N 1.00 1.01 -0.88 4.73 3.20 -1.67 -2.76 116.97 121.60 2i2r h TYR 90 Ca 0.19 -0.09 0.24 0.00 3.14 0.00 0.00 58.73 62.21 2i2r h TYR 90 Cb 0.48 -0.30 -0.15 0.00 1.54 0.00 0.00 36.73 38.31 2i2r h TYR 90 CO 0.03 0.81 0.19 0.00 -1.64 0.00 0.00 178.16 177.55 2i2r h ALA 91 N 1.09 1.24 -0.47 1.82 0.00 -1.02 0.18 119.26 122.10 2i2r h ALA 91 Ca 0.21 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2i2r h ALA 91 Cb 0.25 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2i2r h ALA 91 CO -0.01 -0.49 0.30 1.25 0.00 0.00 0.00 179.25 180.30 2i2r h HIS 92 N 0.16 0.60 -0.31 0.00 -0.00 -1.50 0.32 115.15 114.42 2i2r h HIS 92 Ca 0.55 0.01 -0.15 0.00 -0.00 0.00 0.00 60.37 60.78 2i2r h HIS 92 Cb 1.12 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 28.32 2i2r h HIS 92 CO -0.30 0.39 -0.40 1.88 -0.00 0.00 0.00 177.93 179.49 2i2r h TYR 93 N 0.63 0.90 -0.63 5.26 -1.99 -1.12 -2.57 116.97 117.45 2i2r h TYR 93 Ca 0.17 -0.27 -0.06 0.00 2.00 0.00 0.00 58.73 60.57 2i2r h TYR 93 Cb -0.06 -0.19 -0.03 0.00 2.00 0.00 0.00 36.73 38.46 2i2r h TYR 93 CO -0.04 1.03 0.17 1.25 -0.00 0.00 0.00 178.16 180.57 2i2r h LEU 94 N 0.61 0.94 0.34 3.88 5.85 -0.43 -2.70 115.31 123.80 2i2r h LEU 94 Ca 0.05 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 2i2r h LEU 94 Cb 0.95 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2i2r h LEU 94 CO 0.09 0.92 -0.19 0.15 -0.34 0.00 0.00 178.44 179.06 2i2r h PHE 95 N 0.91 -0.52 0.00 1.25 3.57 -0.05 -2.54 116.94 119.57 2i2r h PHE 95 Ca 0.20 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2i2r h PHE 95 Cb 0.33 0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.26 2i2r h PHE 95 CO 0.02 -0.30 0.00 0.27 -2.23 0.00 0.00 178.31 176.08 2i2r n ASN 96 N -3.47 0.94 0.06 0.41 0.23 -1.00 -0.57 115.26 111.86 2i2r n ASN 96 Ca -0.06 -1.77 -0.11 0.00 -0.53 0.00 0.00 54.58 52.11 2i2r n ASN 96 Cb 0.20 -0.44 -0.13 0.00 -2.08 0.00 0.00 39.78 37.33 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 1.89 0.32 -3.00 -2.53 0.00 -1.10 -3.44 119.26 111.40 2i2r h ALA 97 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 54.91 53.91 2i2r h ALA 97 Cb 0.46 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2i2r h ALA 97 CO 0.00 1.20 0.00 1.19 0.00 0.00 0.00 179.25 181.64 2i2r n PHE 98 N -3.38 0.00 -3.17 0.00 3.01 0.27 -4.72 117.46 109.47 2i2r n PHE 98 Ca -0.07 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.25 2i2r n PHE 98 Cb 0.99 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.43 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 -1.27 0.07 4.37 9.92 -1.23 -4.82 116.55 123.59 2i2r n ASP 99 Ca 0.00 -0.09 -0.02 0.00 -0.53 0.00 0.00 54.79 54.15 2i2r n ASP 99 Cb 0.00 -1.19 0.24 0.00 -0.64 0.00 0.00 41.12 39.52 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 -0.29 1.28 0.00 -3.53 2.02 -1.92 0.66 112.91 111.13 2i2r h THR 100 Ca -0.20 -1.35 -0.09 0.00 0.77 0.00 0.00 66.41 65.54 2i2r h THR 100 Cb 1.12 1.52 -0.01 0.00 -1.74 0.00 0.00 68.15 69.04 2i2r h THR 100 CO 0.30 0.41 -0.42 0.74 0.37 0.00 0.00 175.52 176.93 2i2r h THR 101 N 0.27 1.14 -5.10 3.16 2.02 -1.94 -3.48 112.91 108.98 2i2r h THR 101 Ca 0.03 -1.51 -0.32 0.00 0.77 0.00 0.00 66.41 65.38 2i2r h THR 101 Cb 0.72 1.85 0.12 0.00 -1.74 0.00 0.00 68.15 69.10 2i2r h THR 101 CO 0.05 0.41 -0.59 0.00 0.37 0.00 0.00 175.52 175.76 2i2r n GLN 102 N -3.81 -6.51 -0.93 6.66 1.13 0.22 -4.95 117.38 109.19 2i2r n GLN 102 Ca -0.01 0.71 -0.08 0.00 -1.94 0.00 0.00 57.00 55.68 2i2r n GLN 102 Cb 0.48 -5.36 0.24 0.00 0.11 0.00 0.00 30.24 25.71 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 -4.41 2.81 0.00 5.09 5.66 -1.26 -4.95 114.28 117.22 2i2r n THR 103 Ca -0.05 -2.04 0.00 0.00 -3.05 0.00 0.00 64.05 58.91 2i2r n THR 103 Cb 0.57 -0.36 0.00 0.00 -1.55 0.00 0.00 70.33 68.99 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 -0.71 1.22 3.19 1.09 0.00 -1.26 -4.91 105.19 103.81 2i2r n GLY 104 Ca 0.41 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 46.23 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 1.08 -0.35 1.61 0.15 -1.26 -4.98 113.70 109.95 2i2r s SER 105 Ca 0.00 -1.07 -0.15 0.00 0.70 0.00 0.00 55.95 55.43 2i2r s SER 105 Cb 0.00 0.12 -0.01 0.00 -1.71 0.00 0.00 66.02 64.42 2i2r s SER 105 CO 0.00 -0.52 0.34 0.68 1.20 0.00 0.00 173.24 174.94 2i2r s VAL 106 N -3.68 5.19 0.60 4.45 -7.23 -0.97 -4.87 120.40 113.89 2i2r s VAL 106 Ca 0.16 -0.04 -0.06 0.00 -1.81 0.00 0.00 61.98 60.23 2i2r s VAL 106 Cb 0.06 -3.82 0.01 0.00 0.56 0.00 0.00 36.38 33.19 2i2r s VAL 106 CO -0.02 -0.10 0.92 -1.59 -0.31 0.00 0.00 175.10 174.00 2i2r s LYS 107 N 1.96 2.89 0.26 4.82 -2.85 -1.26 -1.87 119.74 123.69 2i2r s LYS 107 Ca 0.10 0.02 -0.02 0.00 -1.00 0.00 0.00 55.97 55.07 2i2r s LYS 107 Cb -0.17 -2.25 0.45 0.00 -2.06 0.00 0.00 37.83 33.80 2i2r s LYS 107 CO 0.11 -0.74 1.81 0.35 0.10 0.00 0.00 175.35 176.99 2i2r h PHE 108 N -0.22 0.93 -0.72 1.78 3.57 -1.99 -2.30 116.94 117.99 2i2r h PHE 108 Ca -0.45 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.11 2i2r h PHE 108 Cb 1.26 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 39.67 2i2r h PHE 108 CO 0.47 0.36 0.47 1.05 -2.23 0.00 0.00 178.31 178.44 2i2r h GLU 109 N 0.83 0.84 0.34 1.11 9.09 -1.95 0.14 114.58 124.98 2i2r h GLU 109 Ca 0.43 -0.05 -0.02 0.00 0.05 0.00 0.00 59.36 59.77 2i2r h GLU 109 Cb 0.42 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 27.34 2i2r h GLU 109 CO -0.26 0.55 -0.16 -0.44 0.05 0.00 0.00 179.01 178.75 2i2r h ASP 110 N 0.86 -0.39 -0.75 3.06 3.32 -1.81 -2.28 116.42 118.43 2i2r h ASP 110 Ca 0.29 -0.02 0.17 0.00 0.02 0.00 0.00 57.03 57.49 2i2r h ASP 110 Cb 0.07 0.10 -0.11 0.00 0.22 0.00 0.00 39.33 39.61 2i2r h ASP 110 CO -0.08 -0.24 0.18 0.15 -1.72 0.00 0.00 179.24 177.52 2i2r h PHE 111 N -0.50 0.27 0.02 4.55 3.57 -0.84 -1.10 116.94 122.92 2i2r h PHE 111 Ca -0.05 0.04 -0.22 0.00 3.53 0.00 0.00 57.97 61.28 2i2r h PHE 111 Cb 0.38 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.11 2i2r h PHE 111 CO -0.04 -0.10 -0.96 -0.39 -2.23 0.00 0.00 178.31 174.59 2i2r h VAL 112 N 0.26 1.47 0.24 1.41 -1.51 -0.77 -2.07 116.25 115.29 2i2r h VAL 112 Ca 0.43 -2.67 -0.00 0.00 -1.23 0.00 0.00 66.70 63.23 2i2r h VAL 112 Cb 0.74 2.54 -0.01 0.00 -2.13 0.00 0.00 31.29 32.44 2i2r h VAL 112 CO -0.53 0.78 -0.19 0.74 -1.23 0.00 0.00 177.57 177.15 2i2r h THR 113 N 0.14 0.59 -0.71 7.19 2.02 -1.08 0.65 112.91 121.71 2i2r h THR 113 Ca -0.07 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.25 2i2r h THR 113 Cb 1.62 0.59 -0.13 0.00 -1.74 0.00 0.00 68.15 68.48 2i2r h THR 113 CO 0.15 0.00 -0.18 0.00 0.37 0.00 0.00 175.52 175.86 2i2r h ALA 114 N 0.28 0.46 -0.16 6.16 0.00 -1.21 0.31 119.26 125.10 2i2r h ALA 114 Ca -0.01 0.27 -0.14 0.00 0.00 0.00 0.00 54.91 55.03 2i2r h ALA 114 Cb 0.39 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2i2r h ALA 114 CO -0.01 -0.42 -0.51 -0.07 0.00 0.00 0.00 179.25 178.24 2i2r h LEU 115 N -0.00 0.49 -1.09 0.00 3.38 -1.11 -0.04 115.31 116.94 2i2r h LEU 115 Ca 0.34 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2i2r h LEU 115 Cb 0.52 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 2i2r h LEU 115 CO -0.73 0.91 0.58 -1.28 0.09 0.00 0.00 178.44 178.01 2i2r h SER 116 N 0.35 1.04 0.02 -0.43 0.87 0.29 0.47 113.55 116.17 2i2r h SER 116 Ca 0.01 -0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.54 2i2r h SER 116 Cb 1.01 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 2i2r h SER 116 CO 0.09 0.77 -0.01 0.40 -0.53 0.00 0.00 176.83 177.55 2i2r h ILE 117 N 1.22 1.40 -0.04 2.23 2.04 -0.30 -1.31 117.51 122.75 2i2r h ILE 117 Ca 0.33 -1.34 -0.06 0.00 1.00 0.00 0.00 64.86 64.78 2i2r h ILE 117 Cb -0.12 2.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 2i2r h ILE 117 CO -0.07 0.34 -0.27 -0.07 0.00 0.00 0.00 178.15 178.09 2i2r h LEU 118 N -0.61 0.07 0.00 1.44 4.07 -0.63 -1.75 115.31 117.89 2i2r h LEU 118 Ca -0.00 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.94 2i2r h LEU 118 Cb 0.58 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.30 2i2r h LEU 118 CO 0.00 0.34 -1.55 0.18 -1.08 0.00 0.00 178.44 176.33 2i2r n LEU 119 N -4.20 0.13 0.00 1.67 4.77 0.13 -4.80 117.00 114.70 2i2r n LEU 119 Ca -0.02 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 2i2r n LEU 119 Cb 0.33 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 2i2r n LEU 119 CO 0.38 0.03 -0.15 0.54 -1.33 0.00 0.00 177.39 176.87 2i2r n ARG 120 N -1.93 2.04 -0.49 3.23 5.12 -0.59 -4.26 116.66 119.78 2i2r n ARG 120 Ca -0.02 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.61 2i2r n ARG 120 Cb 0.38 -0.65 0.25 0.00 -1.16 0.00 0.00 32.46 31.29 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 1.09 -2.37 3.74 -0.13 0.00 -0.65 -4.99 105.19 101.89 2i2r n GLY 121 Ca 0.00 -1.15 -0.34 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.33 2.58 0.18 2.61 -1.32 -1.26 -4.74 115.64 111.36 2i2r s THR 122 Ca 0.65 0.30 -0.17 0.00 -1.21 0.00 0.00 61.69 61.27 2i2r s THR 122 Cb -0.22 -2.91 0.14 0.00 -1.51 0.00 0.00 72.50 68.00 2i2r s THR 122 CO 0.65 -0.14 1.65 0.58 -2.21 0.00 0.00 174.62 175.15 2i2r h VAL 123 N 0.06 0.48 -0.70 5.08 2.07 -1.96 0.12 116.25 121.40 2i2r h VAL 123 Ca -0.48 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.17 2i2r h VAL 123 Cb 1.29 0.48 -0.13 0.00 -1.52 0.00 0.00 31.29 31.40 2i2r h VAL 123 CO 0.52 0.00 -0.24 -0.74 0.02 0.00 0.00 177.57 177.13 2i2r h HIS 124 N -0.04 -0.57 -0.51 1.57 -0.00 -1.98 0.32 115.15 113.94 2i2r h HIS 124 Ca 0.23 0.07 -0.06 0.00 -0.00 0.00 0.00 60.37 60.61 2i2r h HIS 124 Cb 0.38 0.36 -0.02 0.00 -0.00 0.00 0.00 27.41 28.13 2i2r h HIS 124 CO -0.43 -0.34 0.09 0.93 -0.00 0.00 0.00 177.93 178.19 2i2r h GLU 125 N -0.05 0.83 -0.44 5.26 5.08 -1.33 0.19 114.58 124.13 2i2r h GLU 125 Ca 0.32 -0.22 -0.13 0.00 -1.00 0.00 0.00 59.36 58.33 2i2r h GLU 125 Cb 0.54 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2i2r h GLU 125 CO -0.74 0.82 -0.21 0.87 -1.00 0.00 0.00 179.01 178.74 2i2r h LYS 126 N 0.71 0.93 -0.22 2.33 1.57 -0.30 -1.27 116.57 120.31 2i2r h LYS 126 Ca 0.16 -0.40 -0.05 0.00 -1.87 0.00 0.00 60.65 58.48 2i2r h LYS 126 Cb 0.38 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2i2r h LYS 126 CO 0.01 1.06 -0.06 -0.07 -0.57 0.00 0.00 179.45 179.82 2i2r h LEU 127 N 0.76 0.45 -1.28 2.94 3.38 -0.21 -2.33 115.31 119.01 2i2r h LEU 127 Ca 0.10 -0.38 0.03 0.00 0.09 0.00 0.00 57.88 57.73 2i2r h LEU 127 Cb 0.78 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 2i2r h LEU 127 CO 0.06 0.72 0.50 -0.09 0.09 0.00 0.00 178.44 179.72 2i2r h ARG 128 N 0.17 0.91 -0.61 1.13 2.43 -0.55 -0.48 114.38 117.38 2i2r h ARG 128 Ca 0.06 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2i2r h ARG 128 Cb 0.53 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.85 2i2r h ARG 128 CO 0.02 0.60 0.37 2.35 -1.51 0.00 0.00 179.97 181.81 2i2r h TRP 129 N 0.94 0.79 -0.49 2.20 7.01 -0.99 -1.29 115.95 124.12 2i2r h TRP 129 Ca 0.30 0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.25 2i2r h TRP 129 Cb 0.04 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 26.82 2i2r h TRP 129 CO -0.00 0.53 0.09 1.15 -2.79 0.00 0.00 178.44 177.42 2i2r h THR 130 N 0.82 1.25 -0.57 2.65 2.02 -0.83 -2.78 112.91 115.48 2i2r h THR 130 Ca 0.22 -0.91 0.06 0.00 0.77 0.00 0.00 66.41 66.55 2i2r h THR 130 Cb -0.04 0.89 -0.05 0.00 -1.74 0.00 0.00 68.15 67.21 2i2r h THR 130 CO -0.04 0.33 0.27 0.15 0.37 0.00 0.00 175.52 176.59 2i2r h PHE 131 N 0.69 0.49 0.00 3.16 3.57 -0.70 -1.15 116.94 123.00 2i2r h PHE 131 Ca 0.15 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.62 2i2r h PHE 131 Cb 0.38 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2i2r h PHE 131 CO 0.03 0.21 -0.24 -0.91 -2.23 0.00 0.00 178.31 175.17 2i2r h ASN 132 N 0.51 0.00 -0.27 0.41 2.35 -1.12 0.50 115.58 117.96 2i2r h ASN 132 Ca 0.26 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.95 2i2r h ASN 132 Cb 0.21 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 2i2r h ASN 132 CO -0.20 0.24 -0.08 0.25 -1.65 0.00 0.00 177.43 175.99 2i2r h LEU 133 N 0.00 0.53 -0.51 1.61 5.85 -1.01 -3.25 115.31 118.53 2i2r h LEU 133 Ca -0.00 -0.38 -0.13 0.00 0.84 0.00 0.00 57.88 58.21 2i2r h LEU 133 Cb 0.43 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2i2r h LEU 133 CO 0.03 0.79 -0.19 1.88 -0.34 0.00 0.00 178.44 180.60 2i2r h TYR 134 N 0.27 1.15 -0.68 1.25 0.05 -0.48 -3.36 116.97 115.17 2i2r h TYR 134 Ca 0.07 -0.27 -0.45 0.00 0.05 0.00 0.00 58.73 58.12 2i2r h TYR 134 Cb 0.56 -0.27 -0.06 0.00 1.01 0.00 0.00 36.73 37.97 2i2r h TYR 134 CO 0.05 1.10 1.41 0.34 -1.05 0.00 0.00 178.16 180.01 2i2r s ASP 135 N -6.71 5.72 0.10 3.88 2.15 0.10 -4.74 116.67 117.17 2i2r s ASP 135 Ca -0.11 -1.75 -0.25 0.00 0.43 0.00 0.00 52.55 50.86 2i2r s ASP 135 Cb 0.12 -2.58 -0.11 0.00 -0.30 0.00 0.00 42.92 40.05 2i2r s ASP 135 CO 0.87 -2.32 1.68 0.40 -0.17 0.00 0.00 175.17 175.63 2i2r h ILE 136 N 6.20 0.66 -0.12 4.11 2.04 -1.79 -2.79 117.51 125.81 2i2r h ILE 136 Ca 0.27 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.13 2i2r h ILE 136 Cb 0.93 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 2i2r h ILE 136 CO 1.31 0.00 0.00 -0.46 0.00 0.00 0.00 178.15 179.00 2i2r n ASN 137 N -5.28 1.34 -3.40 1.72 2.04 -1.26 -4.94 115.26 105.49 2i2r n ASN 137 Ca -0.07 -2.09 -0.32 0.00 -0.44 0.00 0.00 54.58 51.66 2i2r n ASN 137 Cb 0.19 -0.34 0.03 0.00 -2.53 0.00 0.00 39.78 37.14 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 0.00 -3.83 4.01 -1.05 -4.96 118.16 110.36 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 -2.82 0.00 0.00 -0.51 0.00 0.00 35.03 31.98 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 -0.07 4.39 5.68 -1.26 -5.03 116.55 119.83 2i2r n ASP 139 Ca -0.06 -1.00 -0.01 0.00 -0.50 0.00 0.00 54.79 53.22 2i2r n ASP 139 Cb 0.64 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.62 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 0.47 2.98 6.12 0.00 -1.26 -5.00 105.19 108.50 2i2r n GLY 140 Ca 0.00 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.88 1.14 -0.24 1.61 4.12 -1.26 -3.98 117.35 116.86 2i2r s TYR 141 Ca 0.00 -0.38 -0.06 0.00 0.02 0.00 0.00 57.07 56.66 2i2r s TYR 141 Cb 0.00 -0.87 -0.01 0.00 -1.52 0.00 0.00 41.96 39.55 2i2r s TYR 141 CO 0.00 -0.22 0.02 0.42 0.02 0.00 0.00 175.55 175.79 2i2r s ILE 142 N 0.67 3.83 0.21 2.71 1.01 -0.52 -4.75 121.20 124.36 2i2r s ILE 142 Ca -0.12 -0.39 0.09 0.00 0.00 0.00 0.00 60.65 60.23 2i2r s ILE 142 Cb -0.14 -2.80 -0.04 0.00 0.01 0.00 0.00 42.46 39.49 2i2r s ILE 142 CO 0.02 0.34 -0.06 0.54 0.00 0.00 0.00 174.94 175.79 2i2r s ASN 143 N 1.54 4.40 0.29 3.58 4.22 -1.26 -1.89 114.94 125.81 2i2r s ASN 143 Ca 0.06 -0.58 -0.02 0.00 -2.14 0.00 0.00 52.86 50.17 2i2r s ASN 143 Cb -0.15 -0.79 0.62 0.00 1.28 0.00 0.00 41.25 42.21 2i2r s ASN 143 CO 0.00 0.07 1.58 0.07 -2.04 0.00 0.00 177.10 176.78 2i2r h LYS 144 N 2.57 0.02 -0.93 3.55 5.09 -1.99 0.98 116.57 125.86 2i2r h LYS 144 Ca -0.46 -0.00 0.15 0.00 0.09 0.00 0.00 60.65 60.43 2i2r h LYS 144 Cb 1.22 -0.00 -0.15 0.00 0.10 0.00 0.00 32.23 33.39 2i2r h LYS 144 CO 0.57 0.01 -0.35 0.39 -2.09 0.00 0.00 179.45 177.98 2i2r n GLU 145 N -5.51 -0.21 0.07 0.07 -0.58 -1.26 -1.91 120.64 111.31 2i2r n GLU 145 Ca 0.20 1.43 0.11 0.00 -0.42 0.00 0.00 57.16 58.48 2i2r n GLU 145 Cb 0.64 -2.12 -0.05 0.00 -0.57 0.00 0.00 31.44 29.33 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 -5.38 0.62 -0.15 3.49 0.28 0.29 -3.53 120.64 116.27 2i2r n GLU 146 Ca 0.10 0.03 -0.12 0.00 -0.16 0.00 0.00 57.16 57.01 2i2r n GLU 146 Cb 0.38 -1.74 -0.01 0.00 1.43 0.00 0.00 31.44 31.50 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 0.93 -0.41 3.44 4.05 -1.20 -2.74 114.93 119.00 2i2r h MET 147 Ca -0.01 -0.41 0.08 0.00 -0.28 0.00 0.00 59.70 59.08 2i2r h MET 147 Cb 1.02 -0.03 -0.07 0.00 -0.80 0.00 0.00 31.60 31.72 2i2r h MET 147 CO 0.00 1.07 -0.03 0.52 0.23 0.00 0.00 176.91 178.70 2i2r h MET 148 N 0.77 0.07 -0.35 0.39 2.86 -1.48 -1.30 114.93 115.89 2i2r h MET 148 Ca 0.10 -0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.81 2i2r h MET 148 Cb 0.79 -0.02 -0.08 0.00 0.06 0.00 0.00 31.60 32.35 2i2r h MET 148 CO 0.07 0.05 -0.21 -0.44 1.06 0.00 0.00 176.91 177.43 2i2r h ASP 149 N 0.08 -0.71 0.28 1.22 3.45 -1.57 -0.16 116.42 119.02 2i2r h ASP 149 Ca 0.20 0.15 -0.00 0.00 0.43 0.00 0.00 57.03 57.81 2i2r h ASP 149 Cb 0.30 0.36 -0.02 0.00 -0.56 0.00 0.00 39.33 39.42 2i2r h ASP 149 CO -0.36 -0.24 -0.25 0.40 -1.57 0.00 0.00 179.24 177.22 2i2r h ILE 150 N -0.16 0.47 -0.29 0.35 1.08 -1.12 0.20 117.51 118.05 2i2r h ILE 150 Ca 0.18 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.64 2i2r h ILE 150 Cb 0.43 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 34.64 2i2r h ILE 150 CO -0.45 0.00 0.17 0.58 -0.69 0.00 0.00 178.15 177.76 2i2r h VAL 151 N -0.55 1.11 -0.75 1.67 2.07 -1.08 -0.42 116.25 118.31 2i2r h VAL 151 Ca -0.01 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.28 2i2r h VAL 151 Cb 0.50 0.78 -0.06 0.00 -1.52 0.00 0.00 31.29 30.99 2i2r h VAL 151 CO -0.03 0.11 0.44 0.11 0.02 0.00 0.00 177.57 178.22 2i2r h LYS 152 N 0.36 0.78 -0.24 1.57 6.56 -0.94 0.35 116.57 125.01 2i2r h LYS 152 Ca 0.10 -0.05 -0.04 0.00 -1.06 0.00 0.00 60.65 59.61 2i2r h LYS 152 Cb 0.03 -0.18 -0.01 0.00 -0.57 0.00 0.00 32.23 31.50 2i2r h LYS 152 CO -0.02 0.52 -0.02 0.00 -2.06 0.00 0.00 179.45 177.87 2i2r h ALA 153 N 1.37 1.51 0.13 3.86 0.00 0.35 0.39 119.26 126.87 2i2r h ALA 153 Ca 0.33 -0.17 -0.20 0.00 0.00 0.00 0.00 54.91 54.87 2i2r h ALA 153 Cb 0.18 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.87 2i2r h ALA 153 CO -0.18 0.35 -0.94 0.82 0.00 0.00 0.00 179.25 179.30 2i2r h ILE 154 N 0.36 1.39 -0.78 0.00 2.04 -0.78 -2.94 117.51 116.79 2i2r h ILE 154 Ca 0.08 -2.49 0.17 0.00 1.00 0.00 0.00 64.86 63.62 2i2r h ILE 154 Cb 0.28 3.06 -0.11 0.00 -0.74 0.00 0.00 36.82 39.31 2i2r h ILE 154 CO 0.01 0.70 0.26 1.88 0.00 0.00 0.00 178.15 180.99 2i2r h TYR 155 N -0.40 0.42 -0.55 1.37 -1.99 -0.76 0.30 116.97 115.36 2i2r h TYR 155 Ca -0.18 0.04 0.01 0.00 2.00 0.00 0.00 58.73 60.60 2i2r h TYR 155 Cb 1.64 -0.06 -0.03 0.00 2.00 0.00 0.00 36.73 40.28 2i2r h TYR 155 CO 0.18 -0.04 0.36 -0.44 -0.00 0.00 0.00 178.16 178.22 2i2r h ASP 156 N 0.34 0.62 -0.40 3.88 3.32 -1.01 -3.47 116.42 119.69 2i2r h ASP 156 Ca 0.45 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.48 2i2r h ASP 156 Cb 0.77 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 2i2r h ASP 156 CO -0.49 0.44 0.22 0.24 -1.72 0.00 0.00 179.24 177.93 2i2r h MET 157 N 0.73 0.59 0.00 3.56 2.86 -0.32 0.36 114.93 122.71 2i2r h MET 157 Ca 0.21 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.75 2i2r h MET 157 Cb -0.07 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.47 2i2r h MET 157 CO -0.05 0.45 -0.19 1.05 1.06 0.00 0.00 176.91 179.23 2i2r h GLU 168 N 0.60 0.00 0.00 1.72 -0.00 -2.05 -3.30 114.58 111.55 2i2r h GLU 168 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.51 2i2r h GLU 168 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.79 2i2r h GLU 168 CO -0.02 0.19 0.00 -3.47 -0.00 0.00 0.00 179.01 175.71 2i2r n ASP 169 N -3.22 0.00 -4.78 3.06 -0.08 -1.26 -5.16 116.55 105.11 2i2r n ASP 169 Ca 0.02 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.95 2i2r n ASP 169 Cb 0.51 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.96 2i2r n ASP 169 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2i2r s THR 170 N 1.78 3.36 0.30 5.18 -1.32 -1.26 -4.96 115.64 118.71 2i2r s THR 170 Ca 0.00 0.88 0.30 0.00 -1.21 0.00 0.00 61.69 61.66 2i2r s THR 170 Cb 0.00 -3.37 0.32 0.00 -1.51 0.00 0.00 72.50 67.93 2i2r s THR 170 CO 0.00 -0.15 2.02 -0.65 -2.21 0.00 0.00 174.62 173.63 2i2r h PRO 171 N 1.49 0.00 0.52 7.08 0.11 -1.99 -3.03 132.00 136.18 2i2r h PRO 171 Ca -0.50 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.59 2i2r h PRO 171 Cb 1.25 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.36 2i2r h PRO 171 CO 0.58 0.11 -0.25 0.00 -0.21 0.00 0.00 178.00 178.23 2i2r h ARG 172 N 0.00 -0.67 -0.21 1.05 3.08 -1.97 -2.74 114.38 112.91 2i2r h ARG 172 Ca -0.00 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2i2r h ARG 172 Cb 0.44 0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2i2r h ARG 172 CO 0.01 -0.40 0.00 0.00 -1.07 0.00 0.00 179.97 178.52 2i2r n GLN 173 N -5.35 0.27 -0.00 0.04 10.64 -1.15 -1.98 117.38 119.85 2i2r n GLN 173 Ca -0.12 0.00 -0.00 0.00 -1.83 0.00 0.00 57.00 55.05 2i2r n GLN 173 Cb 0.31 -1.11 -0.00 0.00 -0.86 0.00 0.00 30.24 28.58 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 0.18 0.00 -0.26 2.61 -0.00 -1.06 -4.29 115.22 112.40 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 0.05 -0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.09 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 -0.51 3.57 2.07 -1.13 -2.91 116.25 118.60 2i2r h VAL 175 Ca -0.00 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.57 2i2r h VAL 175 Cb 1.00 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 2i2r h VAL 175 CO -0.00 0.37 0.34 0.44 0.02 0.00 0.00 177.57 178.74 2i2r h ASP 176 N 1.09 0.57 -0.63 0.57 3.32 -1.66 0.30 116.42 119.99 2i2r h ASP 176 Ca 0.23 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.21 2i2r h ASP 176 Cb 0.36 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 2i2r h ASP 176 CO -0.00 0.41 0.18 -0.37 -1.72 0.00 0.00 179.24 177.74 2i2r h VAL 177 N 0.68 1.25 0.57 -1.35 -1.51 -1.74 -0.38 116.25 113.78 2i2r h VAL 177 Ca 0.19 -0.89 -0.02 0.00 -1.23 0.00 0.00 66.70 64.75 2i2r h VAL 177 Cb -0.06 0.56 -0.01 0.00 -2.13 0.00 0.00 31.29 29.64 2i2r h VAL 177 CO -0.05 0.34 -0.44 0.15 -1.23 0.00 0.00 177.57 176.34 2i2r h PHE 178 N 0.98 -1.20 -0.50 5.19 3.04 -1.24 -2.44 116.94 120.77 2i2r h PHE 178 Ca 0.21 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.14 2i2r h PHE 178 Cb 0.32 0.45 -0.02 0.00 2.56 0.00 0.00 35.95 39.26 2i2r h PHE 178 CO 0.02 -0.62 0.25 0.74 -2.02 0.00 0.00 178.31 176.68 2i2r h PHE 179 N -0.98 0.71 0.00 0.41 -1.00 -0.82 0.56 116.94 115.82 2i2r h PHE 179 Ca -0.07 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.67 2i2r h PHE 179 Cb 0.81 -0.22 0.00 0.00 3.61 0.00 0.00 35.95 40.15 2i2r h PHE 179 CO -0.16 0.55 0.00 1.04 -1.61 0.00 0.00 178.31 178.13 2i2r n GLN 180 N -4.62 0.18 -0.13 1.51 6.02 -0.16 -0.89 117.38 119.28 2i2r n GLN 180 Ca 0.02 0.48 0.08 0.00 -0.01 0.00 0.00 57.00 57.57 2i2r n GLN 180 Cb 0.11 -1.89 0.11 0.00 1.02 0.00 0.00 30.24 29.59 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 -2.23 1.14 0.00 -1.09 2.85 -0.89 -4.82 118.16 113.12 2i2r n LYS 181 Ca 0.01 -2.28 0.00 0.00 -1.05 0.00 0.00 58.31 54.99 2i2r n LYS 181 Cb 0.18 -1.32 0.00 0.00 -0.65 0.00 0.00 35.03 33.23 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 -1.18 0.00 -2.14 -1.58 0.00 0.14 -4.99 117.12 107.38 2i2r n MET 182 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 57.70 57.48 2i2r n MET 182 Cb 0.63 -0.19 -0.04 0.00 0.00 0.00 0.00 33.22 33.63 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 -4.72 5.42 0.08 6.12 2.15 -0.07 -4.69 116.67 120.96 2i2r s ASP 183 Ca 0.00 -0.24 -0.37 0.00 0.43 0.00 0.00 52.55 52.37 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 -2.38 1.56 0.50 -0.17 0.00 0.00 175.17 174.68 2i2r h LYS 184 N 12.75 -1.07 -0.00 4.34 3.64 -1.90 -3.23 116.57 131.09 2i2r h LYS 184 Ca -0.10 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2i2r h LYS 184 Cb 1.08 0.24 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 2i2r h LYS 184 CO 1.24 -0.72 -0.12 0.27 -2.27 0.00 0.00 179.45 177.85 2i2r n ASN 185 N -5.60 0.36 -0.40 4.20 6.94 -1.26 -4.93 115.26 114.57 2i2r n ASN 185 Ca -0.13 -0.37 -0.01 0.00 -0.02 0.00 0.00 54.58 54.04 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 -0.29 -0.19 -3.83 4.01 -1.22 -4.96 118.16 110.57 2i2r n LYS 186 Ca 0.13 0.06 0.09 0.00 -0.51 0.00 0.00 58.31 58.08 2i2r n LYS 186 Cb 0.29 -3.24 0.26 0.00 -0.51 0.00 0.00 35.03 31.82 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 2.44 -0.22 4.39 3.85 -1.26 -4.92 116.55 122.33 2i2r n ASP 187 Ca -0.01 -1.92 -0.03 0.00 -0.71 0.00 0.00 54.79 52.12 2i2r n ASP 187 Cb 0.51 -0.25 -0.01 0.00 -1.35 0.00 0.00 41.12 40.02 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 1.26 0.53 2.80 6.12 0.00 -1.26 -4.98 105.19 109.66 2i2r n GLY 188 Ca 0.16 -0.18 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.79 0.29 -0.24 -0.61 -1.16 -1.26 -4.38 121.20 112.05 2i2r s ILE 189 Ca 0.00 0.09 -0.06 0.00 -0.51 0.00 0.00 60.65 60.17 2i2r s ILE 189 Cb 0.00 -0.41 -0.02 0.00 0.61 0.00 0.00 42.46 42.64 2i2r s ILE 189 CO 0.00 0.20 0.02 0.54 -2.81 0.00 0.00 174.94 172.89 2i2r s VAL 190 N 1.43 3.85 0.46 4.00 0.11 -0.79 -4.90 120.40 124.56 2i2r s VAL 190 Ca -0.04 -0.35 0.05 0.00 -2.93 0.00 0.00 61.98 58.71 2i2r s VAL 190 Cb -0.13 -2.79 0.02 0.00 -1.53 0.00 0.00 36.38 31.94 2i2r s VAL 190 CO -0.03 0.36 0.63 0.42 -3.33 0.00 0.00 175.10 173.16 2i2r s THR 191 N 1.54 3.00 0.15 5.04 -4.23 -1.26 -1.43 115.64 118.45 2i2r s THR 191 Ca 0.06 -0.87 -0.17 0.00 -1.18 0.00 0.00 61.69 59.53 2i2r s THR 191 Cb -0.15 -3.04 0.01 0.00 1.34 0.00 0.00 72.50 70.65 2i2r s THR 191 CO 0.00 -0.02 1.77 0.25 -0.54 0.00 0.00 174.62 176.08 2i2r h LEU 192 N 0.46 0.24 -0.97 4.79 5.85 -1.99 0.15 115.31 123.84 2i2r h LEU 192 Ca -0.41 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.29 2i2r h LEU 192 Cb 1.28 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 2i2r h LEU 192 CO 0.48 0.18 0.34 0.44 -0.34 0.00 0.00 178.44 179.54 2i2r h ASP 193 N 0.34 0.98 -0.60 1.25 3.45 -1.95 0.48 116.42 120.38 2i2r h ASP 193 Ca 0.15 -0.12 -0.03 0.00 0.43 0.00 0.00 57.03 57.45 2i2r h ASP 193 Cb 0.06 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 38.56 2i2r h ASP 193 CO -0.11 0.84 0.24 -0.08 -1.57 0.00 0.00 179.24 178.56 2i2r h GLU 194 N 1.06 0.89 -0.08 3.56 4.81 -1.73 -1.32 114.58 121.77 2i2r h GLU 194 Ca 0.26 -0.16 -0.20 0.00 -0.13 0.00 0.00 59.36 59.12 2i2r h GLU 194 Cb 0.14 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2i2r h GLU 194 CO -0.03 0.77 -0.77 0.35 -0.73 0.00 0.00 179.01 178.59 2i2r h PHE 195 N 0.83 0.68 0.74 0.92 3.57 -0.08 -2.21 116.94 121.39 2i2r h PHE 195 Ca 0.20 -0.31 -0.04 0.00 3.53 0.00 0.00 57.97 61.35 2i2r h PHE 195 Cb 0.21 -0.10 0.01 0.00 2.79 0.00 0.00 35.95 38.85 2i2r h PHE 195 CO 0.01 1.09 -0.35 -0.07 -2.23 0.00 0.00 178.31 176.76 2i2r h LEU 196 N 0.33 -0.84 -1.70 0.59 3.38 0.04 -2.84 115.31 114.29 2i2r h LEU 196 Ca -0.04 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.00 2i2r h LEU 196 Cb 1.37 0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.32 2i2r h LEU 196 CO 0.14 -0.49 0.28 -0.33 0.09 0.00 0.00 178.44 178.13 2i2r h GLU 197 N -1.22 0.38 -0.45 1.13 5.08 -1.35 -2.48 114.58 115.67 2i2r h GLU 197 Ca -0.10 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.14 2i2r h GLU 197 Cb 0.76 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.91 2i2r h GLU 197 CO 0.17 0.25 -0.10 1.03 -1.00 0.00 0.00 179.01 179.35 2i2r h SER 198 N 0.39 0.79 0.64 1.42 0.87 -1.42 -2.98 113.55 113.27 2i2r h SER 198 Ca 0.17 -0.24 -0.27 0.00 -1.23 0.00 0.00 61.79 60.22 2i2r h SER 198 Cb 0.20 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 2i2r h SER 198 CO -0.04 0.92 -1.31 0.00 -0.53 0.00 0.00 176.83 175.86 2i2r h GLN 200 N 0.05 0.63 0.00 0.00 1.08 -1.48 -1.47 115.11 113.93 2i2r h GLN 200 Ca -0.15 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 56.99 2i2r h GLN 200 Cb 1.95 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 29.23 2i2r h GLN 200 CO 0.17 0.42 -0.10 0.93 -0.95 0.00 0.00 178.83 179.29 2i2r h GLU 201 N 0.65 0.00 -5.45 1.46 3.07 -1.55 -3.41 114.58 109.34 2i2r h GLU 201 Ca 0.18 0.00 -0.64 0.00 -0.50 0.00 0.00 59.36 58.40 2i2r h GLU 201 Cb -0.06 0.00 -0.15 0.00 -0.84 0.00 0.00 28.75 27.71 2i2r h GLU 201 CO -0.04 0.10 0.89 0.34 -1.40 0.00 0.00 179.01 178.90 2i2r s ASP 202 N -5.92 6.43 0.46 1.42 -1.08 -0.55 -4.91 116.67 112.51 2i2r s ASP 202 Ca -0.00 -1.50 0.37 0.00 -0.52 0.00 0.00 52.55 50.90 2i2r s ASP 202 Cb 0.11 -2.45 1.52 0.00 -1.46 0.00 0.00 42.92 40.64 2i2r s ASP 202 CO 0.57 -1.32 1.51 -0.90 0.52 0.00 0.00 175.17 175.55 2i2r n ASP 203 N 7.55 0.14 -0.11 -0.34 5.68 -1.26 -2.30 116.55 125.90 2i2r n ASP 203 Ca 0.16 1.22 -0.14 0.00 -0.50 0.00 0.00 54.79 55.53 2i2r n ASP 203 Cb 0.48 -0.60 -0.13 0.00 -1.14 0.00 0.00 41.12 39.73 2i2r n ASP 203 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2i2r n ASN 204 N -4.38 1.15 0.31 -1.12 3.02 -1.26 -3.35 115.26 109.63 2i2r n ASN 204 Ca 0.40 -0.07 0.17 0.00 -0.03 0.00 0.00 54.58 55.06 2i2r n ASN 204 Cb 1.66 0.27 0.99 0.00 -0.61 0.00 0.00 39.78 42.09 2i2r n ASN 204 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2i2r h ILE 205 N 0.00 0.35 0.20 2.41 1.08 -1.76 0.54 117.51 120.33 2i2r h ILE 205 Ca -0.54 -0.07 -0.32 0.00 -0.39 0.00 0.00 64.86 63.54 2i2r h ILE 205 Cb 2.03 1.05 0.02 0.00 -3.07 0.00 0.00 36.82 36.85 2i2r h ILE 205 CO -0.03 0.01 -1.44 0.24 -0.69 0.00 0.00 178.15 176.24 2i2r h MET 206 N 0.00 0.43 0.00 2.37 2.86 -1.63 -2.94 114.93 116.02 2i2r h MET 206 Ca -0.00 -0.73 -0.09 0.00 -2.06 0.00 0.00 59.70 56.82 2i2r h MET 206 Cb 0.05 0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 2i2r h MET 206 CO 0.00 1.34 -0.41 0.07 1.06 0.00 0.00 176.91 178.98 2i2r h ARG 207 N 0.12 0.00 0.19 1.72 -0.00 -1.38 -3.18 114.38 111.85 2i2r h ARG 207 Ca -0.23 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 59.74 2i2r h ARG 207 Cb 2.10 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 32.07 2i2r h ARG 207 CO 0.24 0.41 -0.09 1.03 -0.00 0.00 0.00 179.97 181.55 2i2r h SER 208 N 0.00 -0.22 -0.76 0.08 0.87 -0.94 -3.35 113.55 109.24 2i2r h SER 208 Ca -0.00 0.01 0.15 0.00 -1.23 0.00 0.00 61.79 60.72 2i2r h SER 208 Cb 0.83 0.06 -0.14 0.00 -0.44 0.00 0.00 62.40 62.71 2i2r h SER 208 CO 0.05 -0.16 -0.17 -0.07 -0.53 0.00 0.00 176.83 175.96 2i2r h LEU 209 N -0.26 -0.67 -0.03 2.23 3.38 -1.50 -3.29 115.31 115.17 2i2r h LEU 209 Ca -0.03 0.22 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 2i2r h LEU 209 Cb 0.20 0.46 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2i2r h LEU 209 CO 0.04 -0.24 -0.16 1.56 0.09 0.00 0.00 178.44 179.73 2i2r h GLN 210 N 0.01 0.16 -1.37 1.13 4.20 -1.68 -3.46 115.11 114.09 2i2r h GLN 210 Ca 0.37 -0.13 -0.19 0.00 0.06 0.00 0.00 58.65 58.76 2i2r h GLN 210 Cb 0.57 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 2i2r h GLN 210 CO -0.77 0.79 0.23 1.28 -0.67 0.00 0.00 178.83 179.69 2i2r n LEU 211 N -4.60 0.22 -4.56 1.46 7.99 -1.24 -4.49 117.00 111.78 2i2r n LEU 211 Ca -0.09 0.21 -0.13 0.00 -0.01 0.00 0.00 56.01 55.99 2i2r n LEU 211 Cb 0.42 -0.20 -0.08 0.00 -0.11 0.00 0.00 43.42 43.44 2i2r n LEU 211 CO 0.38 -0.18 1.24 0.33 -1.51 0.00 0.00 177.39 177.64 2i2r n PHE 212 N 1.33 1.11 -1.76 -1.77 7.35 -1.26 -4.91 117.46 117.55 2i2r n PHE 212 Ca 0.10 -0.02 -0.41 0.00 -0.76 0.00 0.00 57.45 56.35 2i2r n PHE 212 Cb -0.01 -2.54 -0.01 0.00 0.35 0.00 0.00 39.48 37.27 2i2r n PHE 212 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2i2r n GLN 213 N 8.66 2.67 -3.50 -4.13 10.64 -1.26 -4.99 117.38 125.46 2i2r n GLN 213 Ca 0.48 0.94 -0.23 0.00 -1.83 0.00 0.00 57.00 56.35 2i2r n GLN 213 Cb 0.42 -2.69 -0.13 0.00 -0.86 0.00 0.00 30.24 26.98 2i2r n GLN 213 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 2i2r s ASN 214 N 0.13 2.44 0.57 2.61 3.84 -1.26 -4.89 114.94 118.38 2i2r s ASN 214 Ca 0.58 -0.85 -0.14 0.00 0.21 0.00 0.00 52.86 52.66 2i2r s ASN 214 Cb -0.49 0.05 -0.05 0.00 -0.55 0.00 0.00 41.25 40.20 2i2r s ASN 214 CO 0.57 -0.39 1.02 -0.69 -2.79 0.00 0.00 177.10 174.82 2i2r s VAL 215 N 2.22 4.43 0.00 -5.21 1.01 -1.26 -5.26 120.40 116.33 2i2r s VAL 215 Ca 0.08 1.02 0.00 0.00 0.00 0.00 0.00 61.98 63.08 2i2r s VAL 215 Cb -0.15 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.54 2i2r s VAL 215 CO -0.27 -0.80 0.00 0.80 0.00 0.00 0.00 175.10 174.82