#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2r h LEU 39 N 0.00 0.61 -0.35 0.99 5.85 -2.03 -2.93 115.31 117.46 2i2r h LEU 39 Ca 0.00 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.32 2i2r h LEU 39 Cb 0.00 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.86 2i2r h LEU 39 CO 0.00 0.88 0.00 -0.08 -0.34 0.00 0.00 178.44 178.90 2i2r h GLU 40 N 0.35 0.00 0.35 1.25 4.81 -2.01 -1.64 114.58 117.69 2i2r h GLU 40 Ca 0.07 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 2i2r h GLU 40 Cb 0.64 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.02 2i2r h GLU 40 CO 0.04 0.00 -0.17 1.96 -0.73 0.00 0.00 179.01 180.11 2i2r h GLN 41 N 0.00 -0.45 -0.98 1.92 7.50 -1.99 -3.00 115.11 118.10 2i2r h GLN 41 Ca 0.00 0.03 0.19 0.00 0.50 0.00 0.00 58.65 59.37 2i2r h GLN 41 Cb 0.68 0.10 -0.09 0.00 0.05 0.00 0.00 27.48 28.22 2i2r h GLN 41 CO 0.00 -0.14 0.61 -0.07 -1.50 0.00 0.00 178.83 177.73 2i2r h LEU 42 N -0.95 0.69 -0.31 1.46 3.38 -1.30 0.27 115.31 118.54 2i2r h LEU 42 Ca -0.05 0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.02 2i2r h LEU 42 Cb 0.52 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 2i2r h LEU 42 CO 0.08 0.26 0.15 -0.08 0.09 0.00 0.00 178.44 178.94 2i2r h GLU 43 N 0.68 0.31 0.49 1.13 4.81 -1.38 -1.27 114.58 119.35 2i2r h GLU 43 Ca 0.55 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.73 2i2r h GLU 43 Cb 0.96 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.27 2i2r h GLU 43 CO -0.32 0.20 -0.24 0.00 -0.73 0.00 0.00 179.01 177.93 2i2r h ALA 44 N 1.16 -0.66 -0.07 2.92 0.00 -0.63 -3.34 119.26 118.64 2i2r h ALA 44 Ca 0.13 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2i2r h ALA 44 Cb 0.05 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2i2r h ALA 44 CO -0.09 -0.70 0.00 0.00 0.00 0.00 0.00 179.25 178.46 2i2r n GLN 45 N -5.25 1.23 -4.19 0.00 10.64 0.66 -4.81 117.38 115.64 2i2r n GLN 45 Ca -0.10 -0.27 -0.16 0.00 -1.83 0.00 0.00 57.00 54.64 2i2r n GLN 45 Cb 0.31 -1.21 -0.07 0.00 -0.86 0.00 0.00 30.24 28.41 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 -1.69 0.00 -1.29 -0.39 -4.23 -0.48 -4.98 115.64 102.57 2i2r s THR 46 Ca 0.05 -1.84 0.11 0.00 -1.18 0.00 0.00 61.69 58.83 2i2r s THR 46 Cb 0.03 -2.53 0.45 0.00 1.34 0.00 0.00 72.50 71.79 2i2r s THR 46 CO 0.03 0.00 1.31 0.59 -0.54 0.00 0.00 174.62 176.00 2i2r n ASN 47 N -1.26 3.17 -4.83 3.99 5.03 -1.26 -4.79 115.26 115.31 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 -0.46 -0.06 0.00 -1.02 0.00 0.00 39.78 38.87 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 3.34 0.64 3.10 0.08 -1.26 -5.07 117.98 117.08 2i2r s PHE 48 Ca 0.32 0.17 -0.09 0.00 0.12 0.00 0.00 56.93 57.45 2i2r s PHE 48 Cb 0.21 -1.70 -0.00 0.00 -0.57 0.00 0.00 43.02 40.96 2i2r s PHE 48 CO 0.16 0.56 1.01 0.95 -0.10 0.00 0.00 175.22 177.79 2i2r s THR 49 N -1.39 3.87 0.22 0.64 -4.23 -1.26 -4.56 115.64 108.93 2i2r s THR 49 Ca 0.30 0.41 -0.08 0.00 -1.18 0.00 0.00 61.69 61.14 2i2r s THR 49 Cb -0.12 -3.58 0.16 0.00 1.34 0.00 0.00 72.50 70.30 2i2r s THR 49 CO 0.22 -0.70 1.77 0.11 -0.54 0.00 0.00 174.62 175.49 2i2r h LYS 50 N -0.40 0.54 -0.32 3.99 1.57 -1.93 0.13 116.57 120.16 2i2r h LYS 50 Ca -0.45 -0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.37 2i2r h LYS 50 Cb 1.24 -0.12 -0.08 0.00 0.08 0.00 0.00 32.23 33.34 2i2r h LYS 50 CO 0.62 0.36 -0.32 -0.09 -0.57 0.00 0.00 179.45 179.45 2i2r h ARG 51 N 0.56 -0.28 -0.24 3.15 2.43 -2.00 -1.85 114.38 116.14 2i2r h ARG 51 Ca 0.33 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.51 2i2r h ARG 51 Cb 0.34 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2i2r h ARG 51 CO -0.26 -0.19 0.11 0.93 -1.51 0.00 0.00 179.97 179.05 2i2r h GLU 52 N -0.29 0.35 -0.35 0.20 5.08 -1.69 -2.68 114.58 115.20 2i2r h GLU 52 Ca 0.15 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.48 2i2r h GLU 52 Cb 0.54 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 2i2r h GLU 52 CO -0.48 0.36 0.23 -0.07 -1.00 0.00 0.00 179.01 178.05 2i2r h LEU 53 N 0.26 0.34 -0.05 1.33 3.38 -0.73 -1.10 115.31 118.74 2i2r h LEU 53 Ca 0.08 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2i2r h LEU 53 Cb 0.12 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2i2r h LEU 53 CO -0.01 0.24 -0.00 1.56 0.09 0.00 0.00 178.44 180.32 2i2r h GLN 54 N 0.40 0.10 -0.71 1.13 4.20 -1.00 0.17 115.11 119.40 2i2r h GLN 54 Ca 0.14 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.84 2i2r h GLN 54 Cb 0.07 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.79 2i2r h GLN 54 CO -0.03 0.40 0.44 0.28 -0.67 0.00 0.00 178.83 179.25 2i2r h VAL 55 N -0.22 1.10 0.09 -0.54 2.07 -1.24 0.29 116.25 117.80 2i2r h VAL 55 Ca 0.01 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 2i2r h VAL 55 Cb 0.36 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 2i2r h VAL 55 CO 0.00 0.16 -0.04 -0.07 0.02 0.00 0.00 177.57 177.64 2i2r h LEU 56 N 0.87 -0.10 -0.64 2.57 3.38 -1.11 0.13 115.31 120.41 2i2r h LEU 56 Ca 0.28 -0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.24 2i2r h LEU 56 Cb 0.01 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.73 2i2r h LEU 56 CO -0.11 0.02 0.32 0.22 0.09 0.00 0.00 178.44 178.99 2i2r h TYR 57 N -0.21 0.59 -0.35 1.13 3.20 0.14 0.11 116.97 121.57 2i2r h TYR 57 Ca -0.01 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 2i2r h TYR 57 Cb 0.18 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 2i2r h TYR 57 CO -0.04 0.25 0.07 0.00 -1.64 0.00 0.00 178.16 176.80 2i2r h ARG 58 N 0.59 0.51 0.45 1.82 3.08 -0.03 0.35 114.38 121.16 2i2r h ARG 58 Ca 0.30 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.25 2i2r h ARG 58 Cb 0.26 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 2i2r h ARG 58 CO -0.22 0.49 -0.34 0.78 -1.07 0.00 0.00 179.97 179.60 2i2r h GLY 59 N 0.75 -1.05 0.20 0.04 0.00 0.55 -2.89 103.07 100.66 2i2r h GLY 59 Ca 0.12 0.46 0.07 0.00 0.00 0.00 0.00 47.33 47.98 2i2r h GLY 59 CO -0.00 -0.34 -0.15 -2.75 0.00 0.00 0.00 176.54 173.29 2i2r h PHE 60 N -0.77 -0.37 0.00 5.60 3.57 -0.44 -2.00 116.94 122.53 2i2r h PHE 60 Ca -0.06 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2i2r h PHE 60 Cb 0.64 0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.59 2i2r h PHE 60 CO -0.11 -0.23 0.00 1.17 -2.23 0.00 0.00 178.31 176.91 2i2r n LYS 61 N -5.33 0.15 -0.05 1.11 0.00 0.12 -1.53 118.16 112.62 2i2r n LYS 61 Ca 0.01 0.54 -0.13 0.00 0.00 0.00 0.00 58.31 58.73 2i2r n LYS 61 Cb 0.24 -1.89 -0.14 0.00 0.00 0.00 0.00 35.03 33.24 2i2r n LYS 61 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2i2r n ASN 62 N -2.19 0.98 0.18 3.14 3.02 -0.79 -2.99 115.26 116.62 2i2r n ASN 62 Ca 0.00 0.18 0.03 0.00 -0.03 0.00 0.00 54.58 54.77 2i2r n ASN 62 Cb 0.11 0.07 0.32 0.00 -0.61 0.00 0.00 39.78 39.67 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 0.01 0.00 -2.72 3.52 4.39 -0.88 -3.40 114.58 115.51 2i2r h GLU 63 Ca -0.43 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.12 2i2r h GLU 63 Cb 2.07 0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 30.43 2i2r h GLU 63 CO 0.04 0.43 -0.42 0.00 -1.16 0.00 0.00 179.01 177.90 2i2r h PRO 65 N 7.85 0.97 0.00 0.00 0.11 -1.75 -3.24 132.00 135.94 2i2r h PRO 65 Ca -0.23 -0.40 0.00 0.00 0.11 0.00 0.00 66.00 65.48 2i2r h PRO 65 Cb 1.13 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2i2r h PRO 65 CO 0.20 1.07 0.00 0.45 -0.21 0.00 0.00 178.00 179.51 2i2r n SER 66 N -4.11 0.00 0.00 -2.05 2.88 -1.26 -4.76 113.62 104.31 2i2r n SER 66 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2i2r n SER 66 Cb 0.45 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 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 -0.77 2.98 3.17 0.46 0.00 -1.22 -4.98 105.19 104.82 2i2r n GLY 67 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.32 2.39 -0.41 1.61 -7.23 -1.26 -4.13 120.40 110.05 2i2r s VAL 68 Ca 0.00 -0.84 -0.18 0.00 -1.81 0.00 0.00 61.98 59.15 2i2r s VAL 68 Cb 0.00 -2.04 0.02 0.00 0.56 0.00 0.00 36.38 34.92 2i2r s VAL 68 CO 0.00 0.50 0.47 -0.69 -0.31 0.00 0.00 175.10 175.07 2i2r s VAL 69 N 1.33 5.04 0.59 1.32 1.01 -0.92 -4.96 120.40 123.81 2i2r s VAL 69 Ca 0.05 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.89 2i2r s VAL 69 Cb -0.13 -4.04 0.11 0.00 0.00 0.00 0.00 36.38 32.32 2i2r s VAL 69 CO -0.10 -0.39 0.80 -0.46 0.00 0.00 0.00 175.10 174.94 2i2r n ASN 70 N 5.70 1.30 0.09 3.32 6.94 -1.26 -2.30 115.26 129.06 2i2r n ASN 70 Ca -0.06 -2.05 -0.03 0.00 -0.02 0.00 0.00 54.58 52.42 2i2r n ASN 70 Cb 0.48 -0.50 0.19 0.00 -2.36 0.00 0.00 39.78 37.58 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 0.23 -0.10 -3.83 4.81 -1.96 -2.06 114.58 111.66 2i2r h GLU 71 Ca -0.27 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 58.82 2i2r h GLU 71 Cb 1.04 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 2i2r h GLU 71 CO 0.31 0.67 0.01 -0.44 -0.73 0.00 0.00 179.01 178.83 2i2r h ASP 72 N 0.19 0.17 -0.62 1.04 5.19 -1.99 0.33 116.42 120.73 2i2r h ASP 72 Ca 0.01 -0.28 0.07 0.00 -0.62 0.00 0.00 57.03 56.21 2i2r h ASP 72 Cb 0.93 -0.05 -0.06 0.00 0.18 0.00 0.00 39.33 40.33 2i2r h ASP 72 CO 0.07 0.41 0.29 0.71 -3.12 0.00 0.00 179.24 177.61 2i2r h THR 73 N -0.07 0.87 -0.42 0.35 1.35 -1.93 -1.92 112.91 111.14 2i2r h THR 73 Ca 0.03 -0.18 0.08 0.00 -0.55 0.00 0.00 66.41 65.79 2i2r h THR 73 Cb 0.32 0.29 -0.08 0.00 -1.73 0.00 0.00 68.15 66.95 2i2r h THR 73 CO 0.00 0.10 -0.11 0.15 -0.25 0.00 0.00 175.52 175.41 2i2r h PHE 74 N 0.53 -0.23 0.79 4.73 3.04 -0.67 0.43 116.94 125.57 2i2r h PHE 74 Ca 0.30 0.04 -0.04 0.00 3.98 0.00 0.00 57.97 62.25 2i2r h PHE 74 Cb 0.28 0.17 0.00 0.00 2.56 0.00 0.00 35.95 38.96 2i2r h PHE 74 CO -0.12 -0.18 -0.44 0.87 -2.02 0.00 0.00 178.31 176.42 2i2r h LYS 75 N -0.00 -1.10 0.00 1.11 1.79 -0.17 -3.10 116.57 115.09 2i2r h LYS 75 Ca 0.20 0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.75 2i2r h LYS 75 Cb 0.31 0.25 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 2i2r h LYS 75 CO -0.44 -0.73 0.00 -0.56 -1.08 0.00 0.00 179.45 176.64 2i2r h GLN 76 N -1.14 0.00 0.00 3.15 3.07 -0.92 0.43 115.11 119.70 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 0.90 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.46 2i2r h GLN 76 CO 0.14 0.00 0.00 0.82 0.09 0.00 0.00 178.83 179.88 2i2r h ILE 77 N 0.00 0.00 0.00 1.86 2.04 -0.08 -2.82 117.51 118.51 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 0.36 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 2i2r h ILE 77 CO 0.00 0.00 -1.37 -1.22 0.00 0.00 0.00 178.15 175.56 2i2r n TYR 78 N -2.81 0.00 -0.34 1.37 4.02 0.10 -4.31 117.16 115.19 2i2r n TYR 78 Ca 0.01 0.00 0.27 0.00 -0.01 0.00 0.00 57.90 58.17 2i2r n TYR 78 Cb 0.28 -0.21 0.53 0.00 -0.02 0.00 0.00 39.34 39.91 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 2.29 2.08 0.11 -0.72 0.00 -1.16 0.32 119.26 122.19 2i2r h ALA 79 Ca 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2i2r h ALA 79 Cb 0.66 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2i2r h ALA 79 CO 0.00 -0.75 -0.05 1.96 0.00 0.00 0.00 179.25 180.40 2i2r h GLN 80 N 0.20 -0.15 -0.02 0.00 7.50 -1.75 -3.35 115.11 117.55 2i2r h GLN 80 Ca 0.78 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.94 2i2r h GLN 80 Cb 1.92 0.03 -0.00 0.00 0.05 0.00 0.00 27.48 29.48 2i2r h GLN 80 CO -0.64 0.35 -0.01 1.19 -1.50 0.00 0.00 178.83 178.22 2i2r n PHE 81 N -4.87 0.01 -4.30 2.96 0.99 0.10 -4.02 117.46 108.32 2i2r n PHE 81 Ca -0.08 0.03 -0.18 0.00 -0.00 0.00 0.00 57.45 57.22 2i2r n PHE 81 Cb 0.28 -0.51 -0.14 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 -5.03 0.92 0.00 1.38 0.40 -1.23 -5.13 117.98 109.30 2i2r s PHE 82 Ca -0.00 -0.28 0.00 0.00 -0.60 0.00 0.00 56.93 56.05 2i2r s PHE 82 Cb 0.01 -0.56 0.00 0.00 0.51 0.00 0.00 43.02 42.97 2i2r s PHE 82 CO 0.02 -0.01 0.00 -0.35 0.70 0.00 0.00 175.22 175.58 2i2r n PRO 83 N 2.28 0.00 -2.82 0.24 -0.04 -1.26 -4.25 135.00 129.16 2i2r n PRO 83 Ca -0.17 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.88 2i2r n PRO 83 Cb 0.56 -0.32 0.01 0.00 -0.04 0.00 0.00 33.50 33.71 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 2.59 -4.46 0.54 1.44 -1.26 -4.94 115.22 109.13 2i2r n HIS 84 Ca 0.00 -2.64 -0.22 0.00 -2.01 0.00 0.00 57.72 52.85 2i2r n HIS 84 Cb 0.00 -1.19 -0.11 0.00 0.12 0.00 0.00 29.99 28.82 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 -1.63 2.01 -0.27 -1.39 0.00 -1.26 -4.81 107.32 99.97 2i2r s GLY 85 Ca 0.36 -2.02 0.02 0.00 0.00 0.00 0.00 44.72 43.08 2i2r s GLY 85 CO -0.03 -1.85 -0.06 -0.35 0.00 0.00 0.00 173.10 170.81 2i2r s ASP 86 N -3.49 4.31 -0.16 1.64 -1.08 0.52 -4.92 116.67 113.49 2i2r s ASP 86 Ca 0.33 -1.46 0.15 0.00 -0.52 0.00 0.00 52.55 51.06 2i2r s ASP 86 Cb 0.07 -1.43 0.72 0.00 -1.46 0.00 0.00 42.92 40.82 2i2r s ASP 86 CO 0.14 -0.24 1.62 0.00 0.52 0.00 0.00 175.17 177.21 2i2r n ALA 87 N 4.49 3.41 -0.02 3.66 0.00 -1.26 -1.98 120.51 128.80 2i2r n ALA 87 Ca -0.10 -1.62 -0.10 0.00 0.00 0.00 0.00 53.44 51.62 2i2r n ALA 87 Cb 0.43 -1.07 -0.03 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 3.80 -0.99 -0.10 0.00 0.87 -1.91 -1.45 113.55 113.76 2i2r h SER 88 Ca 0.00 0.15 -0.16 0.00 -1.23 0.00 0.00 61.79 60.55 2i2r h SER 88 Cb 1.61 0.43 -0.01 0.00 -0.44 0.00 0.00 62.40 64.00 2i2r h SER 88 CO 0.33 -0.34 -0.49 0.71 -0.53 0.00 0.00 176.83 176.51 2i2r h THR 89 N -0.36 1.30 -0.57 2.23 1.35 -1.87 -2.99 112.91 112.00 2i2r h THR 89 Ca 0.11 -1.69 -0.07 0.00 -0.55 0.00 0.00 66.41 64.20 2i2r h THR 89 Cb 0.54 1.63 -0.02 0.00 -1.73 0.00 0.00 68.15 68.57 2i2r h THR 89 CO -0.38 0.54 0.06 0.22 -0.25 0.00 0.00 175.52 175.71 2i2r h TYR 90 N 0.53 1.03 -0.93 4.73 3.20 -1.69 -2.76 116.97 121.08 2i2r h TYR 90 Ca 0.03 -0.16 0.24 0.00 3.14 0.00 0.00 58.73 61.98 2i2r h TYR 90 Cb 1.04 -0.28 -0.17 0.00 1.54 0.00 0.00 36.73 38.86 2i2r h TYR 90 CO 0.05 0.91 0.03 0.00 -1.64 0.00 0.00 178.16 177.51 2i2r h ALA 91 N 0.99 1.07 -0.51 1.82 0.00 -1.11 0.29 119.26 121.81 2i2r h ALA 91 Ca 0.17 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2i2r h ALA 91 Cb 0.46 0.54 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 2i2r h ALA 91 CO 0.02 -0.52 0.33 1.25 0.00 0.00 0.00 179.25 180.33 2i2r h HIS 92 N 0.05 0.65 -0.24 0.00 -0.00 -1.48 0.52 115.15 114.65 2i2r h HIS 92 Ca 0.55 0.01 -0.17 0.00 -0.00 0.00 0.00 60.37 60.76 2i2r h HIS 92 Cb 1.09 -0.22 -0.00 0.00 -0.00 0.00 0.00 27.41 28.28 2i2r h HIS 92 CO -0.48 0.43 -0.52 1.88 -0.00 0.00 0.00 177.93 179.24 2i2r h TYR 93 N 0.69 0.87 -0.74 5.26 -1.99 -1.13 -2.20 116.97 117.73 2i2r h TYR 93 Ca 0.19 -0.30 -0.04 0.00 2.00 0.00 0.00 58.73 60.57 2i2r h TYR 93 Cb -0.06 -0.17 -0.03 0.00 2.00 0.00 0.00 36.73 38.47 2i2r h TYR 93 CO -0.03 1.07 0.30 1.25 -0.00 0.00 0.00 178.16 180.75 2i2r h LEU 94 N 0.55 1.02 0.68 3.88 5.85 0.01 -2.65 115.31 124.65 2i2r h LEU 94 Ca 0.02 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 2i2r h LEU 94 Cb 1.09 -0.26 0.01 0.00 0.37 0.00 0.00 40.66 41.86 2i2r h LEU 94 CO 0.11 0.91 -0.33 0.15 -0.34 0.00 0.00 178.44 178.94 2i2r h PHE 95 N 1.07 -0.84 -0.02 1.25 3.57 0.47 -2.54 116.94 119.89 2i2r h PHE 95 Ca 0.25 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 2i2r h PHE 95 Cb 0.20 0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 2i2r h PHE 95 CO 0.02 -0.52 0.01 0.27 -2.23 0.00 0.00 178.31 175.85 2i2r n ASN 96 N -4.49 1.62 0.03 0.41 0.23 -0.87 -0.32 115.26 111.88 2i2r n ASN 96 Ca -0.11 -2.04 -0.09 0.00 -0.53 0.00 0.00 54.58 51.81 2i2r n ASN 96 Cb 0.36 -0.51 -0.13 0.00 -2.08 0.00 0.00 39.78 37.42 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 2.05 0.49 -3.00 -2.53 0.00 -1.07 -3.44 119.26 111.76 2i2r h ALA 97 Ca 0.01 -1.14 0.00 0.00 0.00 0.00 0.00 54.91 53.77 2i2r h ALA 97 Cb 0.68 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2i2r h ALA 97 CO 0.02 1.36 0.00 1.19 0.00 0.00 0.00 179.25 181.82 2i2r n PHE 98 N -3.26 0.00 -2.54 0.00 3.01 0.57 -4.72 117.46 110.52 2i2r n PHE 98 Ca -0.09 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.35 2i2r n PHE 98 Cb 1.00 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 40.46 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 -1.41 0.04 4.37 9.92 -1.24 -4.82 116.55 123.41 2i2r n ASP 99 Ca 0.00 0.42 -0.00 0.00 -0.53 0.00 0.00 54.79 54.68 2i2r n ASP 99 Cb 0.00 -1.32 0.29 0.00 -0.64 0.00 0.00 41.12 39.45 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 -0.02 1.22 0.00 -3.53 2.02 -1.92 0.22 112.91 110.89 2i2r h THR 100 Ca -0.05 -0.94 -0.08 0.00 0.77 0.00 0.00 66.41 66.11 2i2r h THR 100 Cb 1.04 1.15 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 2i2r h THR 100 CO 0.07 0.31 -0.37 0.74 0.37 0.00 0.00 175.52 176.63 2i2r h THR 101 N 0.40 0.94 -5.54 3.16 2.02 -1.94 -3.48 112.91 108.47 2i2r h THR 101 Ca 0.08 -1.44 -0.35 0.00 0.77 0.00 0.00 66.41 65.46 2i2r h THR 101 Cb 0.45 1.86 0.14 0.00 -1.74 0.00 0.00 68.15 68.87 2i2r h THR 101 CO 0.03 0.36 -0.68 0.00 0.37 0.00 0.00 175.52 175.60 2i2r n GLN 102 N -3.63 -7.06 -0.94 6.66 1.13 0.76 -4.94 117.38 109.37 2i2r n GLN 102 Ca -0.01 0.79 -0.10 0.00 -1.94 0.00 0.00 57.00 55.75 2i2r n GLN 102 Cb 0.48 -5.70 0.21 0.00 0.11 0.00 0.00 30.24 25.33 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 -4.51 2.78 0.00 5.09 5.66 -1.26 -4.95 114.28 117.09 2i2r n THR 103 Ca -0.11 -2.33 0.00 0.00 -3.05 0.00 0.00 64.05 58.56 2i2r n THR 103 Cb 0.60 -0.37 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 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 -1.01 1.13 3.24 1.09 0.00 -1.26 -4.90 105.19 103.48 2i2r n GLY 104 Ca 0.42 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.30 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 1.24 -0.28 1.61 0.15 -1.26 -4.99 113.70 110.17 2i2r s SER 105 Ca 0.00 -1.17 -0.12 0.00 0.70 0.00 0.00 55.95 55.35 2i2r s SER 105 Cb 0.00 0.11 -0.04 0.00 -1.71 0.00 0.00 66.02 64.38 2i2r s SER 105 CO 0.00 -0.57 0.25 0.68 1.20 0.00 0.00 173.24 174.80 2i2r s VAL 106 N -3.65 5.27 0.45 4.45 -7.23 -0.97 -4.85 120.40 113.87 2i2r s VAL 106 Ca 0.24 0.24 -0.06 0.00 -1.81 0.00 0.00 61.98 60.59 2i2r s VAL 106 Cb 0.06 -3.59 -0.04 0.00 0.56 0.00 0.00 36.38 33.36 2i2r s VAL 106 CO 0.04 0.20 0.77 -1.59 -0.31 0.00 0.00 175.10 174.21 2i2r s LYS 107 N 1.85 3.60 0.27 4.82 -2.85 -1.26 -2.17 119.74 124.00 2i2r s LYS 107 Ca 0.09 0.26 -0.02 0.00 -1.00 0.00 0.00 55.97 55.29 2i2r s LYS 107 Cb -0.16 -2.39 0.57 0.00 -2.06 0.00 0.00 37.83 33.79 2i2r s LYS 107 CO 0.11 -0.14 1.64 0.35 0.10 0.00 0.00 175.35 177.41 2i2r h PHE 108 N 0.54 0.16 -0.88 1.78 3.57 -1.99 -1.85 116.94 118.28 2i2r h PHE 108 Ca -0.47 0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.16 2i2r h PHE 108 Cb 1.20 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 39.94 2i2r h PHE 108 CO 0.59 -0.22 0.57 1.05 -2.23 0.00 0.00 178.31 178.07 2i2r h GLU 109 N 0.16 0.92 0.28 1.11 9.09 -1.95 0.08 114.58 124.27 2i2r h GLU 109 Ca 0.48 -0.06 -0.01 0.00 0.05 0.00 0.00 59.36 59.83 2i2r h GLU 109 Cb 0.91 -0.21 -0.00 0.00 -1.65 0.00 0.00 28.75 27.80 2i2r h GLU 109 CO -0.66 0.61 -0.17 -0.44 0.05 0.00 0.00 179.01 178.40 2i2r h ASP 110 N 0.95 -0.43 -0.80 3.06 3.32 -1.73 -2.12 116.42 118.67 2i2r h ASP 110 Ca 0.39 0.03 0.18 0.00 0.02 0.00 0.00 57.03 57.64 2i2r h ASP 110 Cb 0.28 0.13 -0.11 0.00 0.22 0.00 0.00 39.33 39.84 2i2r h ASP 110 CO -0.15 -0.28 0.28 0.15 -1.72 0.00 0.00 179.24 177.52 2i2r h PHE 111 N -0.43 0.45 0.08 4.55 3.57 -0.83 -1.03 116.94 123.29 2i2r h PHE 111 Ca -0.03 0.04 -0.26 0.00 3.53 0.00 0.00 57.97 61.26 2i2r h PHE 111 Cb 0.36 -0.07 0.01 0.00 2.79 0.00 0.00 35.95 39.03 2i2r h PHE 111 CO -0.09 -0.04 -1.13 -0.39 -2.23 0.00 0.00 178.31 174.43 2i2r h VAL 112 N 0.35 1.44 0.29 1.41 -1.51 -1.10 -2.24 116.25 114.89 2i2r h VAL 112 Ca 0.47 -2.77 -0.01 0.00 -1.23 0.00 0.00 66.70 63.16 2i2r h VAL 112 Cb 0.81 2.72 -0.00 0.00 -2.13 0.00 0.00 31.29 32.69 2i2r h VAL 112 CO -0.50 0.82 -0.18 0.74 -1.23 0.00 0.00 177.57 177.22 2i2r h THR 113 N 0.15 0.63 -0.84 7.19 2.02 -1.10 0.69 112.91 121.65 2i2r h THR 113 Ca -0.12 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.22 2i2r h THR 113 Cb 1.81 0.63 -0.16 0.00 -1.74 0.00 0.00 68.15 68.70 2i2r h THR 113 CO 0.19 0.00 -0.26 0.00 0.37 0.00 0.00 175.52 175.82 2i2r h ALA 114 N 0.24 0.42 -0.33 6.16 0.00 -1.24 0.10 119.26 124.61 2i2r h ALA 114 Ca -0.03 0.30 -0.15 0.00 0.00 0.00 0.00 54.91 55.03 2i2r h ALA 114 Cb 0.37 0.72 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2i2r h ALA 114 CO 0.03 -0.47 -0.41 -0.07 0.00 0.00 0.00 179.25 178.33 2i2r h LEU 115 N -0.02 0.87 -1.41 0.00 3.38 -1.03 -0.50 115.31 116.58 2i2r h LEU 115 Ca 0.38 -0.40 0.02 0.00 0.09 0.00 0.00 57.88 57.97 2i2r h LEU 115 Cb 0.61 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2i2r h LEU 115 CO -0.87 1.16 0.41 -1.28 0.09 0.00 0.00 178.44 177.96 2i2r h SER 116 N 0.66 0.67 0.19 -0.43 0.87 0.19 0.71 113.55 116.41 2i2r h SER 116 Ca 0.05 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 2i2r h SER 116 Cb 0.98 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 2i2r h SER 116 CO 0.09 0.47 -0.09 0.40 -0.53 0.00 0.00 176.83 177.17 2i2r h ILE 117 N 0.78 0.74 -0.17 2.23 2.04 -0.50 -1.75 117.51 120.87 2i2r h ILE 117 Ca 0.24 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.02 2i2r h ILE 117 Cb 0.00 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 2i2r h ILE 117 CO -0.06 0.19 -0.03 -0.07 0.00 0.00 0.00 178.15 178.18 2i2r h LEU 118 N -0.89 0.23 0.00 1.44 4.07 -0.82 0.30 115.31 119.63 2i2r h LEU 118 Ca -0.03 -0.03 -0.01 0.00 0.08 0.00 0.00 57.88 57.89 2i2r h LEU 118 Cb 0.51 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.18 2i2r h LEU 118 CO 0.04 0.31 -1.98 0.18 -1.08 0.00 0.00 178.44 175.91 2i2r n LEU 119 N -4.36 0.03 0.00 1.67 4.77 0.22 -4.75 117.00 114.57 2i2r n LEU 119 Ca -0.00 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2i2r n LEU 119 Cb 0.20 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2i2r n LEU 119 CO 0.37 0.01 -0.16 0.54 -1.33 0.00 0.00 177.39 176.82 2i2r n ARG 120 N -2.29 3.33 -0.51 3.23 5.12 -0.73 -5.08 116.66 119.73 2i2r n ARG 120 Ca -0.05 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.58 2i2r n ARG 120 Cb 0.59 -0.66 0.24 0.00 -1.16 0.00 0.00 32.46 31.48 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 0.92 -1.80 3.73 -0.13 0.00 0.09 -4.98 105.19 103.02 2i2r n GLY 121 Ca 0.00 -1.10 -0.34 0.00 0.00 0.00 0.00 46.02 44.58 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 -2.43 2.40 0.20 2.61 -1.32 -1.26 -4.73 115.64 111.12 2i2r s THR 122 Ca 0.68 0.20 -0.14 0.00 -1.21 0.00 0.00 61.69 61.22 2i2r s THR 122 Cb -0.25 -2.81 0.22 0.00 -1.51 0.00 0.00 72.50 68.14 2i2r s THR 122 CO 0.64 -0.10 1.63 0.58 -2.21 0.00 0.00 174.62 175.17 2i2r h VAL 123 N -0.10 0.40 -0.59 5.08 2.07 -1.93 0.17 116.25 121.34 2i2r h VAL 123 Ca -0.48 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.16 2i2r h VAL 123 Cb 1.29 0.40 -0.11 0.00 -1.52 0.00 0.00 31.29 31.34 2i2r h VAL 123 CO 0.51 0.00 -0.22 -0.74 0.02 0.00 0.00 177.57 177.14 2i2r h HIS 124 N -0.00 -0.53 -0.41 1.57 -0.00 -1.98 0.40 115.15 114.20 2i2r h HIS 124 Ca 0.29 0.06 -0.05 0.00 -0.00 0.00 0.00 60.37 60.67 2i2r h HIS 124 Cb 0.44 0.32 -0.02 0.00 -0.00 0.00 0.00 27.41 28.16 2i2r h HIS 124 CO -0.50 -0.31 0.05 0.93 -0.00 0.00 0.00 177.93 178.11 2i2r h GLU 125 N -0.07 0.70 -0.66 5.26 5.08 -1.25 0.31 114.58 123.95 2i2r h GLU 125 Ca 0.27 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 2i2r h GLU 125 Cb 0.49 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 2i2r h GLU 125 CO -0.64 0.74 0.16 0.87 -1.00 0.00 0.00 179.01 179.14 2i2r h LYS 126 N 0.54 1.05 -0.26 2.33 1.57 -0.12 -1.25 116.57 120.44 2i2r h LYS 126 Ca 0.12 -0.25 -0.12 0.00 -1.87 0.00 0.00 60.65 58.53 2i2r h LYS 126 Cb 0.39 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 2i2r h LYS 126 CO 0.01 0.95 -0.29 -0.07 -0.57 0.00 0.00 179.45 179.47 2i2r h LEU 127 N 0.98 0.71 -1.23 2.94 3.38 0.11 -2.31 115.31 119.89 2i2r h LEU 127 Ca 0.21 -0.49 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 2i2r h LEU 127 Cb 0.37 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2i2r h LEU 127 CO 0.00 1.05 0.16 -0.09 0.09 0.00 0.00 178.44 179.65 2i2r h ARG 128 N 0.38 0.70 -0.68 1.13 2.43 -0.31 -0.63 114.38 117.40 2i2r h ARG 128 Ca 0.04 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2i2r h ARG 128 Cb 0.87 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.26 2i2r h ARG 128 CO 0.07 0.60 0.35 2.35 -1.51 0.00 0.00 179.97 181.83 2i2r h TRP 129 N 0.68 0.96 -0.49 2.20 7.01 -0.99 -1.30 115.95 124.02 2i2r h TRP 129 Ca 0.16 -0.04 -0.12 0.00 2.11 0.00 0.00 58.89 61.01 2i2r h TRP 129 Cb 0.19 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 26.93 2i2r h TRP 129 CO 0.01 0.70 -0.16 1.15 -2.79 0.00 0.00 178.44 177.35 2i2r h THR 130 N 0.94 1.27 -0.64 2.65 2.02 -0.81 -2.91 112.91 115.42 2i2r h THR 130 Ca 0.24 -1.31 0.04 0.00 0.77 0.00 0.00 66.41 66.14 2i2r h THR 130 Cb 0.08 1.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 2i2r h THR 130 CO -0.03 0.45 0.38 0.15 0.37 0.00 0.00 175.52 176.84 2i2r h PHE 131 N 0.83 0.71 0.00 3.16 3.57 -0.70 -1.05 116.94 123.46 2i2r h PHE 131 Ca 0.12 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 2i2r h PHE 131 Cb 0.72 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 2i2r h PHE 131 CO 0.05 0.39 -0.18 -0.91 -2.23 0.00 0.00 178.31 175.43 2i2r h ASN 132 N 0.74 0.00 -0.23 0.41 2.35 -1.16 0.21 115.58 117.90 2i2r h ASN 132 Ca 0.26 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.91 2i2r h ASN 132 Cb 0.06 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 2i2r h ASN 132 CO -0.12 0.18 -0.25 0.25 -1.65 0.00 0.00 177.43 175.84 2i2r h LEU 133 N 0.00 0.63 -0.37 1.61 5.85 -1.05 -3.28 115.31 118.70 2i2r h LEU 133 Ca -0.00 -0.48 -0.11 0.00 0.84 0.00 0.00 57.88 58.12 2i2r h LEU 133 Cb 0.43 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2i2r h LEU 133 CO 0.02 0.98 -0.21 1.88 -0.34 0.00 0.00 178.44 180.78 2i2r h TYR 134 N 0.28 0.91 -0.59 1.25 0.05 -0.58 -3.36 116.97 114.94 2i2r h TYR 134 Ca 0.03 -0.24 -0.39 0.00 0.05 0.00 0.00 58.73 58.19 2i2r h TYR 134 Cb 0.81 -0.21 -0.05 0.00 1.01 0.00 0.00 36.73 38.30 2i2r h TYR 134 CO 0.08 0.99 1.22 0.34 -1.05 0.00 0.00 178.16 179.73 2i2r s ASP 135 N -6.52 5.39 0.11 3.88 2.15 0.00 -4.77 116.67 116.91 2i2r s ASP 135 Ca -0.12 -1.64 -0.25 0.00 0.43 0.00 0.00 52.55 50.97 2i2r s ASP 135 Cb 0.10 -2.58 -0.09 0.00 -0.30 0.00 0.00 42.92 40.04 2i2r s ASP 135 CO 0.83 -2.67 1.67 0.40 -0.17 0.00 0.00 175.17 175.24 2i2r h ILE 136 N 6.27 0.63 -0.12 4.11 2.04 -1.80 -2.79 117.51 125.84 2i2r h ILE 136 Ca 0.24 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.10 2i2r h ILE 136 Cb 0.94 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 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 -5.29 1.34 -3.40 1.72 2.04 -1.26 -4.94 115.26 105.47 2i2r n ASN 137 Ca -0.06 -2.09 -0.32 0.00 -0.44 0.00 0.00 54.58 51.67 2i2r n ASN 137 Cb 0.21 -0.34 0.03 0.00 -2.53 0.00 0.00 39.78 37.15 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 -2.83 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 -0.44 0.00 -0.13 4.39 5.68 -1.26 -5.03 116.55 119.77 2i2r n ASP 139 Ca -0.06 -1.00 -0.02 0.00 -0.50 0.00 0.00 54.79 53.21 2i2r n ASP 139 Cb 0.64 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.61 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 0.52 2.94 6.12 0.00 -1.26 -5.00 105.19 108.52 2i2r n GLY 140 Ca 0.00 -0.38 -0.23 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.95 1.16 -0.26 1.61 2.02 -1.26 -4.00 117.35 114.67 2i2r s TYR 141 Ca 0.00 -0.43 -0.07 0.00 -0.37 0.00 0.00 57.07 56.19 2i2r s TYR 141 Cb 0.00 -0.94 -0.02 0.00 -0.40 0.00 0.00 41.96 40.60 2i2r s TYR 141 CO 0.00 -0.29 0.07 0.42 -1.57 0.00 0.00 175.55 174.18 2i2r s ILE 142 N 1.04 4.26 0.20 2.71 1.01 -0.56 -4.76 121.20 125.09 2i2r s ILE 142 Ca -0.08 -0.24 0.09 0.00 0.00 0.00 0.00 60.65 60.41 2i2r s ILE 142 Cb -0.14 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.27 2i2r s ILE 142 CO -0.00 0.31 -0.08 0.54 0.00 0.00 0.00 174.94 175.70 2i2r s ASN 143 N 1.60 4.30 0.30 3.58 4.22 -1.26 -1.95 114.94 125.72 2i2r s ASN 143 Ca 0.06 -0.61 -0.01 0.00 -2.14 0.00 0.00 52.86 50.16 2i2r s ASN 143 Cb -0.15 -0.74 0.66 0.00 1.28 0.00 0.00 41.25 42.30 2i2r s ASN 143 CO 0.03 0.08 1.54 2.29 -2.04 0.00 0.00 177.10 179.00 2i2r n LYS 144 N -0.20 -0.08 -0.37 3.55 -0.00 -1.26 -0.33 118.16 119.47 2i2r n LYS 144 Ca -0.09 1.49 0.01 0.00 -0.00 0.00 0.00 58.31 59.71 2i2r n LYS 144 Cb 0.56 -2.33 0.07 0.00 -0.00 0.00 0.00 35.03 33.34 2i2r n LYS 144 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2i2r h GLU 145 N 0.00 -0.00 0.00 -1.58 4.39 -1.96 -2.00 114.58 113.43 2i2r h GLU 145 Ca 0.56 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.26 2i2r h GLU 145 Cb 1.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 2i2r h GLU 145 CO -0.95 -0.00 -1.32 -0.85 -1.16 0.00 0.00 179.01 174.73 2i2r n GLU 146 N -5.52 0.56 -0.06 2.33 0.28 0.55 -3.50 120.64 115.28 2i2r n GLU 146 Ca 0.12 -0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.99 2i2r n GLU 146 Cb 0.43 -1.69 -0.01 0.00 1.43 0.00 0.00 31.44 31.60 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 0.80 -0.37 3.44 4.05 -1.23 -2.75 114.93 118.87 2i2r h MET 147 Ca 0.00 -0.48 0.06 0.00 -0.28 0.00 0.00 59.70 59.00 2i2r h MET 147 Cb 0.95 0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 31.74 2i2r h MET 147 CO 0.00 1.11 0.05 0.52 0.23 0.00 0.00 176.91 178.82 2i2r h MET 148 N 0.63 0.16 -0.44 0.39 2.86 -1.45 -1.15 114.93 115.91 2i2r h MET 148 Ca 0.02 -0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.75 2i2r h MET 148 Cb 1.09 -0.04 -0.09 0.00 0.06 0.00 0.00 31.60 32.63 2i2r h MET 148 CO 0.11 0.10 -0.15 -0.44 1.06 0.00 0.00 176.91 177.59 2i2r h ASP 149 N 0.16 -0.55 0.30 1.22 3.45 -1.57 0.69 116.42 120.12 2i2r h ASP 149 Ca 0.18 0.15 -0.01 0.00 0.43 0.00 0.00 57.03 57.77 2i2r h ASP 149 Cb 0.23 0.33 0.00 0.00 -0.56 0.00 0.00 39.33 39.33 2i2r h ASP 149 CO -0.26 -0.19 -0.15 0.40 -1.57 0.00 0.00 179.24 177.47 2i2r h ILE 150 N -0.06 0.70 -0.21 0.35 1.08 -1.13 0.11 117.51 118.36 2i2r h ILE 150 Ca 0.21 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.68 2i2r h ILE 150 Cb 0.38 0.70 -0.01 0.00 -3.07 0.00 0.00 36.82 34.82 2i2r h ILE 150 CO -0.48 0.00 0.10 0.58 -0.69 0.00 0.00 178.15 177.66 2i2r h VAL 151 N -0.41 1.14 -0.50 1.67 2.07 -1.00 0.73 116.25 119.95 2i2r h VAL 151 Ca -0.04 -0.40 0.08 0.00 0.82 0.00 0.00 66.70 67.17 2i2r h VAL 151 Cb 0.31 1.01 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 2i2r h VAL 151 CO 0.06 0.13 0.10 0.11 0.02 0.00 0.00 177.57 178.00 2i2r h LYS 152 N 0.21 0.23 -0.29 1.57 1.57 -0.82 -0.07 116.57 118.96 2i2r h LYS 152 Ca 0.07 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 2i2r h LYS 152 Cb 0.12 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2i2r h LYS 152 CO -0.01 0.15 0.08 0.00 -0.57 0.00 0.00 179.45 179.10 2i2r h ALA 153 N 1.39 1.61 0.09 3.86 0.00 0.03 0.13 119.26 126.37 2i2r h ALA 153 Ca 0.25 -0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.83 2i2r h ALA 153 Cb 0.33 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.02 2i2r h ALA 153 CO -0.33 0.30 -0.92 0.82 0.00 0.00 0.00 179.25 179.12 2i2r h ILE 154 N 0.40 1.39 -0.94 0.00 2.04 -0.55 -2.92 117.51 116.93 2i2r h ILE 154 Ca 0.10 -2.36 0.12 0.00 1.00 0.00 0.00 64.86 63.72 2i2r h ILE 154 Cb 0.14 2.80 -0.08 0.00 -0.74 0.00 0.00 36.82 38.94 2i2r h ILE 154 CO -0.01 0.69 0.57 1.88 0.00 0.00 0.00 178.15 181.28 2i2r h TYR 155 N -0.02 1.02 -0.55 1.37 -1.99 -0.51 0.19 116.97 116.48 2i2r h TYR 155 Ca -0.14 0.03 -0.05 0.00 2.00 0.00 0.00 58.73 60.58 2i2r h TYR 155 Cb 1.65 -0.32 -0.02 0.00 2.00 0.00 0.00 36.73 40.04 2i2r h TYR 155 CO 0.15 0.39 0.17 -0.44 -0.00 0.00 0.00 178.16 178.43 2i2r h ASP 156 N 0.89 0.80 -0.22 3.88 3.32 -0.82 0.35 116.42 124.63 2i2r h ASP 156 Ca 0.47 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.30 2i2r h ASP 156 Cb 0.48 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2i2r h ASP 156 CO -0.27 0.80 0.10 -0.03 -1.72 0.00 0.00 179.24 178.12 2i2r h MET 157 N 0.77 0.32 0.00 3.56 1.85 -0.55 0.15 114.93 121.03 2i2r h MET 157 Ca 0.18 -0.05 -0.03 0.00 -0.61 0.00 0.00 59.70 59.18 2i2r h MET 157 Cb 0.29 -0.06 -0.00 0.00 0.43 0.00 0.00 31.60 32.26 2i2r h MET 157 CO -0.00 0.36 -0.14 0.52 -0.40 0.00 0.00 176.91 177.24 2i2r h MET 158 N 0.22 0.00 0.00 0.39 2.86 -0.58 -3.28 114.93 114.54 2i2r h MET 158 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2i2r h MET 158 Cb 0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.81 2i2r h MET 158 CO -0.01 0.14 0.00 0.41 1.06 0.00 0.00 176.91 178.51 2i2r n GLY 159 N 1.12 0.43 3.77 8.32 0.00 0.05 -4.86 105.19 114.03 2i2r n GLY 159 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2i2r n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2r s ALA 160 N -2.16 2.49 0.34 4.61 0.00 -0.84 -4.97 121.76 121.24 2i2r s ALA 160 Ca 0.00 0.51 -0.26 0.00 0.00 0.00 0.00 51.96 52.21 2i2r s ALA 160 Cb 0.00 -3.30 -0.10 0.00 0.00 0.00 0.00 23.12 19.72 2i2r s ALA 160 CO 0.00 -1.24 1.00 0.71 0.00 0.00 0.00 175.76 176.22 2i2r s TYR 161 N -2.39 3.55 -0.25 0.00 4.12 -1.26 -4.65 117.35 116.48 2i2r s TYR 161 Ca 0.66 1.73 0.01 0.00 0.02 0.00 0.00 57.07 59.50 2i2r s TYR 161 Cb -0.20 -3.03 0.30 0.00 -1.52 0.00 0.00 41.96 37.51 2i2r s TYR 161 CO 0.42 -0.14 1.59 2.41 0.02 0.00 0.00 175.55 179.85 2i2r n THR 162 N 0.46 2.25 -2.58 -0.71 -1.04 -1.26 -4.41 114.28 106.99 2i2r n THR 162 Ca 0.02 -1.12 -0.01 0.00 -2.04 0.00 0.00 64.05 60.90 2i2r n THR 162 Cb 0.49 -0.88 0.03 0.00 -1.82 0.00 0.00 70.33 68.14 2i2r n THR 162 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2i2r n TYR 163 N -0.16 -0.57 -0.57 -1.42 4.02 -1.26 -4.83 117.16 112.37 2i2r n TYR 163 Ca 0.30 -0.57 -0.29 0.00 -0.01 0.00 0.00 57.90 57.33 2i2r n TYR 163 Cb 0.96 0.93 0.24 0.00 -0.02 0.00 0.00 39.34 41.44 2i2r n TYR 163 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 2i2r s PRO 164 N 0.04 -0.56 0.02 -0.72 0.02 -1.26 -4.96 135.00 127.58 2i2r s PRO 164 Ca 0.03 0.99 -0.08 0.00 0.02 0.00 0.00 61.00 61.96 2i2r s PRO 164 Cb 0.11 -1.58 -0.03 0.00 0.02 0.00 0.00 34.50 33.02 2i2r s PRO 164 CO -0.03 -3.53 1.13 -0.24 -0.33 0.00 0.00 177.00 174.00 2i2r h VAL 165 N -2.49 0.00 -2.55 3.83 3.04 -2.03 -3.38 116.25 112.68 2i2r h VAL 165 Ca -0.58 0.00 -0.56 0.00 -1.01 0.00 0.00 66.70 64.55 2i2r h VAL 165 Cb 1.32 0.00 -0.03 0.00 -2.01 0.00 0.00 31.29 30.57 2i2r h VAL 165 CO 0.48 0.00 1.29 -1.48 -1.01 0.00 0.00 177.57 176.85 2i2r s LEU 166 N -6.09 3.47 0.36 3.16 0.05 -1.26 -4.91 118.68 113.46 2i2r s LEU 166 Ca -0.04 1.12 0.04 0.00 0.05 0.00 0.00 54.13 55.31 2i2r s LEU 166 Cb 0.01 -3.32 0.68 0.00 -2.05 0.00 0.00 46.19 41.51 2i2r s LEU 166 CO 0.14 -1.84 1.97 0.00 -0.55 0.00 0.00 176.35 176.07 2i2r h ALA 167 N 13.31 1.52 0.00 1.48 0.00 -1.97 -3.01 119.26 130.58 2i2r h ALA 167 Ca -0.32 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2i2r h ALA 167 Cb 1.17 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2i2r h ALA 167 CO 1.07 0.38 0.28 -0.85 0.00 0.00 0.00 179.25 180.13 2i2r n GLU 168 N -4.39 0.01 0.00 0.00 0.00 -1.26 -1.32 120.64 113.69 2i2r n GLU 168 Ca 0.03 0.30 0.13 0.00 0.00 0.00 0.00 57.16 57.63 2i2r n GLU 168 Cb 0.13 -1.83 0.43 0.00 0.00 0.00 0.00 31.44 30.17 2i2r n GLU 168 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2i2r n ASP 169 N -1.38 0.70 -4.67 -1.84 8.00 -1.14 -4.79 116.55 111.43 2i2r n ASP 169 Ca -0.00 -0.59 -0.50 0.00 0.71 0.00 0.00 54.79 54.42 2i2r n ASP 169 Cb 0.28 0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 41.39 2i2r n ASP 169 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2i2r n THR 170 N -0.96 0.24 0.44 -3.53 5.66 -0.43 -4.86 114.28 110.83 2i2r n THR 170 Ca 0.11 -0.04 0.13 0.00 -3.05 0.00 0.00 64.05 61.20 2i2r n THR 170 Cb 0.32 -1.47 0.48 0.00 -1.55 0.00 0.00 70.33 68.11 2i2r n THR 170 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2i2r h PRO 171 N 6.95 0.00 0.53 1.09 0.13 -1.90 0.73 132.00 139.54 2i2r h PRO 171 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 2i2r h PRO 171 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.40 2i2r h PRO 171 CO 0.90 0.00 -0.47 0.00 -0.23 0.00 0.00 178.00 178.20 2i2r h ARG 172 N 0.00 -0.95 -0.10 0.86 -0.00 -1.96 -1.45 114.38 110.78 2i2r h ARG 172 Ca 0.00 0.06 0.00 0.00 -0.50 0.00 0.00 59.98 59.54 2i2r h ARG 172 Cb 0.51 0.22 0.00 0.00 0.00 0.00 0.00 29.97 30.69 2i2r h ARG 172 CO 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 179.97 179.34 2i2r n GLN 173 N -5.33 0.17 -0.00 0.04 10.64 0.13 -1.76 117.38 121.27 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 0.44 -1.05 -0.00 0.00 -0.86 0.00 0.00 30.24 28.77 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 0.03 0.00 -0.20 2.61 -0.00 -0.51 -4.22 115.22 112.92 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 0.02 -0.02 0.08 0.00 -0.00 0.00 0.00 29.99 30.07 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 -0.34 3.57 2.07 -0.44 -2.91 116.25 119.46 2i2r h VAL 175 Ca -0.01 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.48 2i2r h VAL 175 Cb 1.02 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 2i2r h VAL 175 CO -0.00 0.38 0.22 0.44 0.02 0.00 0.00 177.57 178.63 2i2r h ASP 176 N 0.96 0.40 -0.53 0.57 3.32 -1.63 0.11 116.42 119.62 2i2r h ASP 176 Ca 0.19 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 2i2r h ASP 176 Cb 0.44 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 2i2r h ASP 176 CO 0.01 0.30 0.22 -0.37 -1.72 0.00 0.00 179.24 177.69 2i2r h VAL 177 N 0.46 1.21 0.82 -1.35 -1.51 -1.72 -0.75 116.25 113.41 2i2r h VAL 177 Ca 0.12 -0.67 -0.04 0.00 -1.23 0.00 0.00 66.70 64.88 2i2r h VAL 177 Cb -0.03 0.54 0.01 0.00 -2.13 0.00 0.00 31.29 29.67 2i2r h VAL 177 CO -0.03 0.26 -0.40 0.15 -1.23 0.00 0.00 177.57 176.33 2i2r h PHE 178 N 0.83 -1.03 -0.40 5.19 3.04 -1.16 -2.38 116.94 121.04 2i2r h PHE 178 Ca 0.19 -0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.11 2i2r h PHE 178 Cb 0.18 0.34 -0.02 0.00 2.56 0.00 0.00 35.95 39.01 2i2r h PHE 178 CO 0.01 -0.63 0.19 0.74 -2.02 0.00 0.00 178.31 176.60 2i2r h PHE 179 N -1.14 0.57 0.00 0.41 -1.00 -0.72 -0.18 116.94 114.88 2i2r h PHE 179 Ca -0.11 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.64 2i2r h PHE 179 Cb 0.85 -0.18 0.00 0.00 3.61 0.00 0.00 35.95 40.24 2i2r h PHE 179 CO -0.01 0.48 0.00 1.96 -1.61 0.00 0.00 178.31 179.12 2i2r h GLN 180 N 0.50 0.00 0.00 1.51 4.20 -1.16 0.10 115.11 120.26 2i2r h GLN 180 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 2i2r h GLN 180 Cb 0.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.90 2i2r h GLN 180 CO -0.02 0.00 -0.09 0.36 -0.67 0.00 0.00 178.83 178.42 2i2r n LYS 181 N -2.33 1.08 0.00 1.46 2.85 -0.90 -4.81 118.16 115.51 2i2r n LYS 181 Ca 0.00 -2.28 0.00 0.00 -1.05 0.00 0.00 58.31 54.98 2i2r n LYS 181 Cb 0.14 -1.32 0.00 0.00 -0.65 0.00 0.00 35.03 33.20 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 -1.17 0.00 -2.16 -1.58 0.00 -0.11 -4.99 117.12 107.11 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 0.64 -0.16 -0.04 0.00 0.00 0.00 0.00 33.22 33.67 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 -4.75 5.46 0.07 6.12 2.15 -0.03 -4.67 116.67 121.02 2i2r s ASP 183 Ca 0.00 -0.28 -0.31 0.00 0.43 0.00 0.00 52.55 52.39 2i2r s ASP 183 Cb 0.00 -2.55 -0.16 0.00 -0.30 0.00 0.00 42.92 39.92 2i2r s ASP 183 CO 0.00 -2.34 1.48 0.50 -0.17 0.00 0.00 175.17 174.63 2i2r h LYS 184 N 12.60 -0.91 -0.11 4.34 3.64 -1.90 -3.27 116.57 130.96 2i2r h LYS 184 Ca -0.10 0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.19 2i2r h LYS 184 Cb 1.08 0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 33.10 2i2r h LYS 184 CO 1.24 -0.61 -0.59 -2.95 -2.27 0.00 0.00 179.45 174.27 2i2r h ASN 185 N -0.95 0.42 0.00 4.20 -1.07 -1.94 -3.47 115.58 112.78 2i2r h ASN 185 Ca -0.07 -0.24 0.00 0.00 0.07 0.00 0.00 56.30 56.06 2i2r h ASN 185 Cb 0.79 -0.12 0.00 0.00 -2.07 0.00 0.00 38.32 36.92 2i2r h ASN 185 CO 0.01 0.92 0.00 0.29 0.07 0.00 0.00 177.43 178.72 2i2r n LYS 186 N -3.91 0.00 -0.18 4.14 4.01 -1.23 -5.00 118.16 115.98 2i2r n LYS 186 Ca -0.03 0.00 0.09 0.00 -0.51 0.00 0.00 58.31 57.86 2i2r n LYS 186 Cb 0.62 0.00 0.26 0.00 -0.51 0.00 0.00 35.03 35.40 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 0.00 2.44 -0.45 4.39 3.85 -1.26 -4.92 116.55 120.60 2i2r n ASP 187 Ca 0.00 -1.91 -0.06 0.00 -0.71 0.00 0.00 54.79 52.11 2i2r n ASP 187 Cb 0.00 -0.24 -0.03 0.00 -1.35 0.00 0.00 41.12 39.50 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 0.76 2.81 6.12 0.00 -1.26 -4.99 105.19 109.89 2i2r n GLY 188 Ca 0.17 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.96 0.32 -0.25 -0.61 -1.16 -1.26 -4.41 121.20 111.87 2i2r s ILE 189 Ca 0.00 0.07 -0.07 0.00 -0.51 0.00 0.00 60.65 60.14 2i2r s ILE 189 Cb 0.00 -0.43 -0.02 0.00 0.61 0.00 0.00 42.46 42.62 2i2r s ILE 189 CO 0.00 0.21 0.06 0.54 -2.81 0.00 0.00 174.94 172.94 2i2r s VAL 190 N 1.41 4.19 0.47 4.00 0.11 -0.82 -4.90 120.40 124.86 2i2r s VAL 190 Ca -0.04 -0.27 0.06 0.00 -2.93 0.00 0.00 61.98 58.80 2i2r s VAL 190 Cb -0.13 -2.98 0.03 0.00 -1.53 0.00 0.00 36.38 31.76 2i2r s VAL 190 CO -0.03 0.31 0.65 0.42 -3.33 0.00 0.00 175.10 173.12 2i2r s THR 191 N 1.59 2.83 0.14 5.04 -4.23 -1.26 -1.50 115.64 118.24 2i2r s THR 191 Ca 0.06 -0.90 -0.18 0.00 -1.18 0.00 0.00 61.69 59.48 2i2r s THR 191 Cb -0.15 -2.92 -0.03 0.00 1.34 0.00 0.00 72.50 70.74 2i2r s THR 191 CO 0.03 0.00 1.77 0.25 -0.54 0.00 0.00 174.62 176.13 2i2r h LEU 192 N 0.43 0.23 -1.08 4.79 5.85 -1.99 0.19 115.31 123.72 2i2r h LEU 192 Ca -0.40 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.28 2i2r h LEU 192 Cb 1.28 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 2i2r h LEU 192 CO 0.46 0.17 0.12 0.44 -0.34 0.00 0.00 178.44 179.29 2i2r h ASP 193 N 0.30 0.72 -0.54 1.25 3.45 -1.95 0.60 116.42 120.26 2i2r h ASP 193 Ca 0.11 -0.12 -0.03 0.00 0.43 0.00 0.00 57.03 57.41 2i2r h ASP 193 Cb 0.02 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 38.58 2i2r h ASP 193 CO -0.07 0.71 0.20 -0.08 -1.57 0.00 0.00 179.24 178.44 2i2r h GLU 194 N 0.75 0.81 -0.33 3.56 4.81 -1.69 -1.85 114.58 120.64 2i2r h GLU 194 Ca 0.17 -0.15 -0.17 0.00 -0.13 0.00 0.00 59.36 59.07 2i2r h GLU 194 Cb 0.28 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 2i2r h GLU 194 CO -0.00 0.72 -0.47 0.35 -0.73 0.00 0.00 179.01 178.88 2i2r h PHE 195 N 0.73 1.11 0.90 0.92 3.57 0.02 -2.38 116.94 121.81 2i2r h PHE 195 Ca 0.18 -0.37 -0.04 0.00 3.53 0.00 0.00 57.97 61.27 2i2r h PHE 195 Cb 0.22 -0.22 0.01 0.00 2.79 0.00 0.00 35.95 38.75 2i2r h PHE 195 CO 0.01 1.20 -0.43 -0.07 -2.23 0.00 0.00 178.31 176.79 2i2r h LEU 196 N 0.70 -1.02 -1.51 0.59 3.38 0.24 -2.79 115.31 114.91 2i2r h LEU 196 Ca 0.04 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2i2r h LEU 196 Cb 1.07 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 42.07 2i2r h LEU 196 CO 0.11 -0.68 0.19 -0.33 0.09 0.00 0.00 178.44 177.82 2i2r h GLU 197 N -1.31 0.52 -0.42 1.13 3.07 -1.45 -2.49 114.58 113.64 2i2r h GLU 197 Ca -0.12 -0.05 -0.07 0.00 -0.50 0.00 0.00 59.36 58.62 2i2r h GLU 197 Cb 0.93 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.71 2i2r h GLU 197 CO 0.20 0.40 -0.02 1.03 -1.40 0.00 0.00 179.01 179.22 2i2r h SER 198 N 0.53 0.65 0.63 1.42 0.87 -1.44 -2.94 113.55 113.27 2i2r h SER 198 Ca 0.14 -0.15 -0.27 0.00 -1.23 0.00 0.00 61.79 60.27 2i2r h SER 198 Cb 0.05 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 2i2r h SER 198 CO -0.02 0.74 -1.32 0.00 -0.53 0.00 0.00 176.83 175.70 2i2r h GLN 200 N 0.05 0.39 0.00 0.00 1.08 -1.43 -1.22 115.11 113.97 2i2r h GLN 200 Ca -0.16 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 56.99 2i2r h GLN 200 Cb 1.95 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 29.29 2i2r h GLN 200 CO 0.17 0.28 -0.12 0.93 -0.95 0.00 0.00 178.83 179.14 2i2r h GLU 201 N 0.40 0.00 -5.55 1.46 5.08 -1.55 -3.42 114.58 110.99 2i2r h GLU 201 Ca 0.10 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.84 2i2r h GLU 201 Cb 0.00 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.11 2i2r h GLU 201 CO -0.02 0.12 0.69 0.34 -1.00 0.00 0.00 179.01 179.14 2i2r s ASP 202 N -5.97 6.24 0.66 1.42 -1.08 -0.46 -4.92 116.67 112.55 2i2r s ASP 202 Ca 0.00 -1.06 0.23 0.00 -0.52 0.00 0.00 52.55 51.21 2i2r s ASP 202 Cb 0.10 -2.44 1.23 0.00 -1.46 0.00 0.00 42.92 40.35 2i2r s ASP 202 CO 0.59 -1.46 1.70 -2.24 0.52 0.00 0.00 175.17 174.28 2i2r h ASP 203 N 9.56 0.00 0.00 -0.34 3.04 -1.83 -2.31 116.42 124.54 2i2r h ASP 203 Ca -0.22 0.00 -0.21 0.00 -3.24 0.00 0.00 57.03 53.36 2i2r h ASP 203 Cb 1.06 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 39.31 2i2r h ASP 203 CO 1.20 0.00 -1.80 0.59 -2.04 0.00 0.00 179.24 177.18 2i2r n ASN 204 N -2.88 2.84 -0.88 4.15 3.02 -1.26 -3.68 115.26 116.57 2i2r n ASN 204 Ca -0.00 -0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 2i2r n ASN 204 Cb 0.57 -0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 2i2r n ASN 204 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2i2r n ILE 205 N -2.94 0.40 0.00 2.41 -0.00 -0.90 0.13 119.36 118.46 2i2r n ILE 205 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.50 2i2r n ILE 205 Cb 0.76 -0.64 0.00 0.00 -0.00 0.00 0.00 39.64 39.76 2i2r n ILE 205 CO 0.00 0.00 0.00 0.23 -0.00 0.00 0.00 176.55 176.78 2i2r n MET 206 N 0.62 0.00 -0.12 0.38 2.81 -1.02 -4.57 117.12 115.21 2i2r n MET 206 Ca 0.00 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.78 2i2r n MET 206 Cb 0.23 -0.57 -0.03 0.00 -0.71 0.00 0.00 33.22 32.14 2i2r n MET 206 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 2i2r h ARG 207 N 0.00 0.70 -1.63 0.03 2.43 -1.49 -0.08 114.38 114.34 2i2r h ARG 207 Ca 0.00 -0.28 0.47 0.00 -0.81 0.00 0.00 59.98 59.36 2i2r h ARG 207 Cb 0.48 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.93 2i2r h ARG 207 CO 0.00 0.87 1.21 1.03 -1.51 0.00 0.00 179.97 181.57 2i2r h SER 208 N 0.49 0.00 -0.83 -3.80 0.87 0.75 -2.89 113.55 108.14 2i2r h SER 208 Ca 0.09 0.00 -0.55 0.00 -1.23 0.00 0.00 61.79 60.10 2i2r h SER 208 Cb 0.62 0.00 -0.30 0.00 -0.44 0.00 0.00 62.40 62.28 2i2r h SER 208 CO 0.04 0.00 0.24 0.18 -0.53 0.00 0.00 176.83 176.76 2i2r n LEU 209 N -3.95 6.29 0.10 2.23 7.99 -0.05 -4.79 117.00 124.82 2i2r n LEU 209 Ca 0.36 -4.27 0.00 0.00 -0.01 0.00 0.00 56.01 52.10 2i2r n LEU 209 Cb 1.71 -0.74 0.00 0.00 -0.11 0.00 0.00 43.42 44.28 2i2r n LEU 209 CO 0.41 1.57 0.00 0.00 -1.51 0.00 0.00 177.39 177.86 2i2r n GLN 210 N -0.92 0.00 0.00 3.23 6.02 -1.09 -4.79 117.38 119.83 2i2r n GLN 210 Ca 0.53 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.52 2i2r n GLN 210 Cb 0.92 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.18 2i2r n GLN 210 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33