#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2r n GLY 4 N 0.00 2.97 0.19 0.00 0.00 -1.26 -4.20 105.19 102.88 2i2r n GLY 4 Ca 0.00 -0.87 0.07 0.00 0.00 0.00 0.00 46.02 45.22 2i2r n GLY 4 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2i2r h VAL 5 N 3.73 0.63 -0.73 1.61 3.04 -2.06 -3.12 116.25 119.35 2i2r h VAL 5 Ca 0.00 -1.58 0.17 0.00 -1.01 0.00 0.00 66.70 64.28 2i2r h VAL 5 Cb 1.57 2.07 -0.04 0.00 -2.01 0.00 0.00 31.29 32.88 2i2r h VAL 5 CO 0.29 0.32 0.50 0.00 -1.01 0.00 0.00 177.57 177.67 2i2r h ALA 6 N 1.68 2.30 0.00 3.17 0.00 -2.03 -0.11 119.26 124.27 2i2r h ALA 6 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2i2r h ALA 6 Cb 1.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2i2r h ALA 6 CO 0.04 -0.51 0.00 0.00 0.00 0.00 0.00 179.25 178.78 2i2r n ALA 7 N -2.57 2.43 0.09 0.00 0.00 -1.18 -2.81 120.51 116.47 2i2r n ALA 7 Ca 0.14 -0.16 0.10 0.00 0.00 0.00 0.00 53.44 53.53 2i2r n ALA 7 Cb 0.62 -1.42 -0.15 0.00 0.00 0.00 0.00 19.45 18.50 2i2r n ALA 7 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2i2r n TRP 8 N -1.05 0.00 0.19 0.00 7.02 -0.06 -4.62 117.44 118.93 2i2r n TRP 8 Ca 0.18 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 56.71 2i2r n TRP 8 Cb 0.11 -0.41 0.49 0.00 -2.42 0.00 0.00 31.31 29.07 2i2r n TRP 8 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 2i2r h LEU 9 N 0.00 0.08 -2.17 -0.99 3.38 -1.54 -2.50 115.31 111.58 2i2r h LEU 9 Ca 0.00 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2i2r h LEU 9 Cb 0.88 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 2i2r h LEU 9 CO 0.00 0.22 -0.07 1.55 0.09 0.00 0.00 178.44 180.23 2i2r h PRO 10 N 0.08 0.00 0.00 1.13 0.13 -1.77 0.64 132.00 132.21 2i2r h PRO 10 Ca 0.02 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.07 2i2r h PRO 10 Cb 0.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.39 2i2r h PRO 10 CO 0.02 0.07 -0.39 0.74 -0.23 0.00 0.00 178.00 178.20 2i2r h PHE 11 N 0.00 0.00 0.23 1.56 0.05 -1.77 -0.17 116.94 116.83 2i2r h PHE 11 Ca -0.00 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.78 2i2r h PHE 11 Cb 0.21 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.16 2i2r h PHE 11 CO 0.00 0.39 -0.11 0.00 -0.18 0.00 0.00 178.31 178.42 2i2r h ALA 12 N 1.61 -0.30 -1.17 2.45 0.00 -1.42 -3.33 119.26 117.10 2i2r h ALA 12 Ca -0.00 -0.14 0.33 0.00 0.00 0.00 0.00 54.91 55.10 2i2r h ALA 12 Cb 0.78 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 2i2r h ALA 12 CO 0.05 -0.31 0.82 0.07 0.00 0.00 0.00 179.25 179.88 2i2r h ARG 13 N -1.03 0.09 -0.76 0.00 0.11 -0.78 0.16 114.38 112.17 2i2r h ARG 13 Ca -0.03 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 60.04 2i2r h ARG 13 Cb 0.37 -0.02 -0.04 0.00 1.11 0.00 0.00 29.97 31.39 2i2r h ARG 13 CO 0.05 0.06 0.45 0.00 0.10 0.00 0.00 179.97 180.63 2i2r h ALA 14 N 1.46 1.37 0.00 0.08 0.00 -1.13 -2.66 119.26 118.37 2i2r h ALA 14 Ca 0.59 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.41 2i2r h ALA 14 Cb 2.13 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.61 2i2r h ALA 14 CO -0.09 0.54 0.00 0.00 0.00 0.00 0.00 179.25 179.70 2i2r n ALA 15 N -2.42 2.32 0.05 0.00 0.00 0.57 -3.17 120.51 117.85 2i2r n ALA 15 Ca 0.08 -0.12 -0.20 0.00 0.00 0.00 0.00 53.44 53.20 2i2r n ALA 15 Cb 0.07 -1.43 -0.14 0.00 0.00 0.00 0.00 19.45 17.94 2i2r n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i2r h ALA 16 N 3.21 -0.08 -0.12 0.00 0.00 -1.54 -3.47 119.26 117.27 2i2r h ALA 16 Ca 0.00 -0.68 -0.37 0.00 0.00 0.00 0.00 54.91 53.85 2i2r h ALA 16 Cb 0.29 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.08 2i2r h ALA 16 CO 0.00 0.38 1.74 0.44 0.00 0.00 0.00 179.25 181.80 2i2r n ILE 17 N -4.13 -0.00 0.00 0.00 -0.00 -1.19 -2.29 119.36 111.74 2i2r n ILE 17 Ca -0.13 -0.37 0.00 0.00 -0.00 0.00 0.00 62.75 62.25 2i2r n ILE 17 Cb 0.81 -0.49 0.00 0.00 -0.00 0.00 0.00 39.64 39.96 2i2r n ILE 17 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2i2r n GLY 18 N 5.96 -0.05 0.00 3.28 0.00 -1.26 -5.11 105.19 108.01 2i2r n GLY 18 Ca 0.64 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.66 2i2r n GLY 18 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2i2r n TRP 19 N 0.00 0.00 -0.61 1.61 4.27 -0.97 -5.29 117.44 116.44 2i2r n TRP 19 Ca 0.00 0.00 0.08 0.00 -3.89 0.00 0.00 57.50 53.69 2i2r n TRP 19 Cb 0.00 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 29.93 2i2r n TRP 19 CO 0.00 0.00 0.00 -0.12 -2.29 0.00 0.00 177.69 175.28 2i2r n MET 20 N 0.00 -1.28 0.00 -2.67 1.56 -1.26 -5.03 117.12 108.43 2i2r n MET 20 Ca 0.00 0.90 0.00 0.00 -0.27 0.00 0.00 57.70 58.33 2i2r n MET 20 Cb 0.00 -1.54 0.00 0.00 2.15 0.00 0.00 33.22 33.83 2i2r n MET 20 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 2i2r n ASN 24 N -2.81 0.00 -3.70 6.12 2.85 -1.26 -5.13 115.26 111.34 2i2r n ASN 24 Ca -0.01 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.37 2i2r n ASN 24 Cb 0.28 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.27 2i2r n ASN 24 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2i2r n PRO 26 N -0.38 0.00 0.00 0.00 -0.03 -1.26 -4.81 135.00 128.52 2i2r n PRO 26 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 63.50 63.37 2i2r n PRO 26 Cb 0.62 0.00 0.00 0.00 -0.03 0.00 0.00 33.50 34.09 2i2r n PRO 26 CO 0.00 0.00 0.00 -0.25 -0.03 0.00 0.00 175.50 175.22 2i2r n ASP 33 N 0.00 0.00 0.00 2.55 8.00 -1.26 -4.43 116.55 121.41 2i2r n ASP 33 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2i2r n ASP 33 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2i2r n ASP 33 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2i2r n LYS 34 N 0.00 0.00 -0.00 -1.24 4.76 -1.26 -4.73 118.16 115.69 2i2r n LYS 34 Ca 0.00 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.49 2i2r n LYS 34 Cb 0.00 -0.49 0.28 0.00 -1.84 0.00 0.00 35.03 32.98 2i2r n LYS 34 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2i2r n ASN 35 N -3.00 0.03 -3.29 4.39 0.23 -1.26 -4.69 115.26 107.68 2i2r n ASN 35 Ca 0.00 -1.70 -0.30 0.00 -0.53 0.00 0.00 54.58 52.04 2i2r n ASN 35 Cb 0.48 -0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.16 2i2r n ASN 35 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2i2r n LYS 36 N -0.63 2.60 -2.04 -3.83 5.02 -1.26 -4.94 118.16 113.07 2i2r n LYS 36 Ca 0.07 -1.79 -0.42 0.00 -2.02 0.00 0.00 58.31 54.15 2i2r n LYS 36 Cb 0.04 -2.65 -0.03 0.00 -0.02 0.00 0.00 35.03 32.37 2i2r n LYS 36 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2i2r s ARG 37 N 3.13 4.26 0.39 1.97 1.81 -1.26 -4.93 118.95 124.32 2i2r s ARG 37 Ca 0.51 2.22 -0.25 0.00 -1.72 0.00 0.00 55.73 56.49 2i2r s ARG 37 Cb 0.13 -3.28 -0.12 0.00 -0.45 0.00 0.00 34.95 31.24 2i2r s ARG 37 CO -0.03 -0.55 0.96 1.04 -0.68 0.00 0.00 175.30 176.04 2i2r n GLN 38 N 4.26 1.28 -2.86 3.54 6.02 -1.26 -4.90 117.38 123.45 2i2r n GLN 38 Ca 0.13 0.46 -0.38 0.00 -0.01 0.00 0.00 57.00 57.20 2i2r n GLN 38 Cb 0.41 -1.94 -0.06 0.00 1.02 0.00 0.00 30.24 29.66 2i2r n GLN 38 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2i2r s ASP 39 N -0.71 7.34 0.18 1.08 3.68 -1.26 -5.08 116.67 121.89 2i2r s ASP 39 Ca 0.62 1.75 0.10 0.00 2.13 0.00 0.00 52.55 57.14 2i2r s ASP 39 Cb -0.59 -2.54 -0.04 0.00 -1.45 0.00 0.00 42.92 38.29 2i2r s ASP 39 CO 0.58 0.02 -0.21 -1.61 0.13 0.00 0.00 175.17 174.08 2i2r s GLU 40 N -1.79 1.37 0.06 4.34 2.02 -1.26 -5.02 118.70 118.41 2i2r s GLU 40 Ca 0.46 -1.45 -0.26 0.00 0.02 0.00 0.00 54.97 53.74 2i2r s GLU 40 Cb -0.20 -1.54 -0.06 0.00 0.10 0.00 0.00 34.13 32.44 2i2r s GLU 40 CO 0.25 0.32 0.79 -0.51 0.02 0.00 0.00 175.26 176.13 2i2r s LEU 41 N -2.65 4.46 0.25 1.80 1.02 -1.26 -0.71 118.68 121.60 2i2r s LEU 41 Ca 0.17 1.51 0.07 0.00 0.02 0.00 0.00 54.13 55.90 2i2r s LEU 41 Cb -0.07 -3.28 -0.04 0.00 0.02 0.00 0.00 46.19 42.82 2i2r s LEU 41 CO 0.08 0.02 0.17 0.27 0.02 0.00 0.00 176.35 176.91 2i2r s ILE 42 N -0.12 4.34 -0.20 -0.59 -4.36 0.16 -4.89 121.20 115.54 2i2r s ILE 42 Ca 0.39 -1.44 0.01 0.00 -0.26 0.00 0.00 60.65 59.36 2i2r s ILE 42 Cb -0.21 -3.33 0.03 0.00 1.25 0.00 0.00 42.46 40.19 2i2r s ILE 42 CO 0.24 -0.34 -0.17 -0.69 0.24 0.00 0.00 174.94 174.23 2i2r s VAL 43 N -2.13 2.21 -0.44 8.37 1.01 -1.26 -1.95 120.40 126.21 2i2r s VAL 43 Ca 0.33 -1.04 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 2i2r s VAL 43 Cb -0.08 -2.01 0.11 0.00 0.00 0.00 0.00 36.38 34.40 2i2r s VAL 43 CO 0.24 0.41 0.27 -0.76 0.00 0.00 0.00 175.10 175.27 2i2r s LEU 44 N 1.27 5.41 -0.28 3.92 1.43 0.26 -2.85 118.68 127.83 2i2r s LEU 44 Ca 0.02 -1.87 -0.29 0.00 -1.03 0.00 0.00 54.13 50.96 2i2r s LEU 44 Cb -0.15 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.13 2i2r s LEU 44 CO -0.10 -0.61 1.42 0.21 0.23 0.00 0.00 176.35 177.50 2i2r s ASN 45 N 2.25 6.53 -0.39 2.29 3.84 0.17 -0.31 114.94 129.33 2i2r s ASN 45 Ca 0.06 1.31 0.03 0.00 0.21 0.00 0.00 52.86 54.47 2i2r s ASN 45 Cb -0.24 -2.54 0.11 0.00 -0.55 0.00 0.00 41.25 38.03 2i2r s ASN 45 CO -0.02 -1.18 0.12 -0.69 -2.79 0.00 0.00 177.10 172.55 2i2r s VAL 46 N 4.78 2.10 -0.54 -5.21 1.01 0.13 -0.92 120.40 121.75 2i2r s VAL 46 Ca 0.62 -2.49 0.00 0.00 0.00 0.00 0.00 61.98 60.11 2i2r s VAL 46 Cb -0.19 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.66 2i2r s VAL 46 CO 0.26 -0.68 0.00 -1.54 0.00 0.00 0.00 175.10 173.14 2i2r n SER 47 N 3.98 -5.84 0.00 3.32 3.41 -0.64 -2.01 113.62 115.84 2i2r n SER 47 Ca 0.04 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.77 2i2r n SER 47 Cb 0.39 -3.78 0.00 0.00 -0.26 0.00 0.00 64.21 60.55 2i2r n SER 47 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2i2r n GLY 48 N 0.60 3.15 3.66 5.00 0.00 -1.26 -5.06 105.19 111.28 2i2r n GLY 48 Ca -0.05 -0.59 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 2i2r n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i2r n ARG 49 N 0.00 2.83 -2.94 1.61 5.12 -0.85 -4.90 116.66 117.53 2i2r n ARG 49 Ca 0.00 1.03 -0.44 0.00 -1.93 0.00 0.00 57.85 56.52 2i2r n ARG 49 Cb 0.00 -3.00 -0.03 0.00 -1.16 0.00 0.00 32.46 28.27 2i2r n ARG 49 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2i2r s ARG 50 N 4.49 3.45 0.38 5.56 0.52 -1.26 0.22 118.95 132.31 2i2r s ARG 50 Ca 0.89 -1.55 -0.26 0.00 -0.52 0.00 0.00 55.73 54.30 2i2r s ARG 50 Cb -0.44 -4.70 -0.09 0.00 0.52 0.00 0.00 34.95 30.24 2i2r s ARG 50 CO 0.42 -1.75 1.14 -0.06 0.02 0.00 0.00 175.30 175.08 2i2r s PHE 51 N 2.90 3.17 -0.02 -0.53 0.08 0.57 -4.86 117.98 119.29 2i2r s PHE 51 Ca 0.28 1.58 0.03 0.00 0.12 0.00 0.00 56.93 58.95 2i2r s PHE 51 Cb -0.09 -3.34 -0.00 0.00 -0.57 0.00 0.00 43.02 39.01 2i2r s PHE 51 CO -0.04 -1.11 -0.12 -0.65 -0.10 0.00 0.00 175.22 173.20 2i2r s GLN 52 N -2.21 1.09 0.09 0.44 -0.21 -1.26 0.92 119.66 118.51 2i2r s GLN 52 Ca 0.55 -0.41 -0.19 0.00 0.02 0.00 0.00 55.36 55.33 2i2r s GLN 52 Cb -0.29 -1.02 0.05 0.00 1.00 0.00 0.00 33.01 32.75 2i2r s GLN 52 CO 0.37 0.20 0.47 -0.08 -2.12 0.00 0.00 175.29 174.13 2i2r s THR 53 N -0.05 0.05 0.19 -0.19 -1.32 -0.82 -4.99 115.64 108.50 2i2r s THR 53 Ca 0.00 -0.37 -0.30 0.00 -1.21 0.00 0.00 61.69 59.81 2i2r s THR 53 Cb -0.07 -1.05 -0.08 0.00 -1.51 0.00 0.00 72.50 69.79 2i2r s THR 53 CO 0.00 -0.20 1.18 0.26 -2.21 0.00 0.00 174.62 173.65 2i2r s TRP 54 N -3.19 3.45 0.19 9.09 0.52 -1.26 0.36 118.94 128.09 2i2r s TRP 54 Ca -0.01 1.46 -0.17 0.00 0.02 0.00 0.00 56.10 57.39 2i2r s TRP 54 Cb 0.00 -3.40 0.15 0.00 -1.15 0.00 0.00 33.47 29.07 2i2r s TRP 54 CO -0.08 -1.10 1.62 -0.09 0.02 0.00 0.00 176.95 177.33 2i2r h ARG 55 N 5.16 -0.09 -1.01 4.98 2.43 -1.26 0.49 114.38 125.08 2i2r h ARG 55 Ca -0.45 0.01 0.27 0.00 -0.81 0.00 0.00 59.98 59.00 2i2r h ARG 55 Cb 1.21 0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 30.66 2i2r h ARG 55 CO 0.74 -0.06 0.60 1.79 -1.51 0.00 0.00 179.97 181.53 2i2r h THR 56 N -0.09 0.47 -0.74 0.20 1.35 -1.92 0.18 112.91 112.35 2i2r h THR 56 Ca 0.24 -0.17 0.09 0.00 -0.55 0.00 0.00 66.41 66.01 2i2r h THR 56 Cb 0.46 -0.07 -0.05 0.00 -1.73 0.00 0.00 68.15 66.76 2i2r h THR 56 CO -0.57 0.09 0.49 0.74 -0.25 0.00 0.00 175.52 176.02 2i2r h THR 57 N 0.50 0.96 0.19 6.82 2.02 -0.38 -1.69 112.91 121.32 2i2r h THR 57 Ca 0.67 -0.23 -0.32 0.00 0.77 0.00 0.00 66.41 67.30 2i2r h THR 57 Cb 1.37 0.22 0.03 0.00 -1.74 0.00 0.00 68.15 68.03 2i2r h THR 57 CO -0.49 0.12 -1.36 -0.07 0.37 0.00 0.00 175.52 174.09 2i2r h LEU 58 N 0.68 0.84 -1.85 2.58 3.38 -0.62 -3.27 115.31 117.05 2i2r h LEU 58 Ca 0.34 -0.84 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2i2r h LEU 58 Cb 0.42 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2i2r h LEU 58 CO -0.12 1.64 0.10 -0.33 0.09 0.00 0.00 178.44 179.82 2i2r h GLU 59 N 0.21 0.00 -0.84 1.13 5.08 -0.55 -3.09 114.58 116.52 2i2r h GLU 59 Ca -0.22 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.23 2i2r h GLU 59 Cb 2.04 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 31.23 2i2r h GLU 59 CO 0.26 0.00 0.55 -0.09 -1.00 0.00 0.00 179.01 178.72 2i2r h ARG 60 N 0.00 0.79 -3.01 2.33 2.43 -1.52 -3.08 114.38 112.32 2i2r h ARG 60 Ca 0.00 -0.05 -0.62 0.00 -0.81 0.00 0.00 59.98 58.50 2i2r h ARG 60 Cb 0.19 -0.18 -0.41 0.00 -0.42 0.00 0.00 29.97 29.15 2i2r h ARG 60 CO 0.00 0.52 -0.64 0.71 -1.51 0.00 0.00 179.97 179.05 2i2r s TYR 61 N -5.74 3.09 1.12 2.20 1.51 -1.17 -5.09 117.35 113.27 2i2r s TYR 61 Ca -0.10 -3.13 -0.15 0.00 -1.01 0.00 0.00 57.07 52.68 2i2r s TYR 61 Cb 0.20 -2.43 0.25 0.00 -0.11 0.00 0.00 41.96 39.88 2i2r s TYR 61 CO 0.79 -0.62 1.07 -1.25 -1.11 0.00 0.00 175.55 174.43 2i2r s PRO 62 N -1.01 -0.54 -1.13 -1.71 0.04 -1.17 -3.30 135.00 126.18 2i2r s PRO 62 Ca 0.25 0.39 0.00 0.00 0.04 0.00 0.00 61.00 61.67 2i2r s PRO 62 Cb -0.07 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.83 2i2r s PRO 62 CO -0.14 -3.36 0.00 -0.40 0.04 0.00 0.00 177.00 173.14 2i2r n ASP 63 N -4.59 -4.83 -4.20 6.66 3.85 -1.26 -4.82 116.55 107.36 2i2r n ASP 63 Ca 0.07 0.26 -0.28 0.00 -0.71 0.00 0.00 54.79 54.14 2i2r n ASP 63 Cb 0.57 -3.26 -0.16 0.00 -1.35 0.00 0.00 41.12 36.92 2i2r n ASP 63 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 2i2r s THR 64 N -2.21 1.64 0.00 2.12 -4.23 -1.21 -4.94 115.64 106.81 2i2r s THR 64 Ca 0.00 -0.86 0.00 0.00 -1.18 0.00 0.00 61.69 59.65 2i2r s THR 64 Cb 0.00 -1.38 0.00 0.00 1.34 0.00 0.00 72.50 72.46 2i2r s THR 64 CO 0.00 0.46 0.00 -0.11 -0.54 0.00 0.00 174.62 174.43 2i2r n LEU 65 N 2.82 0.00 0.01 4.79 0.00 -0.92 0.84 117.00 124.54 2i2r n LEU 65 Ca -0.16 0.00 -0.18 0.00 0.00 0.00 0.00 56.01 55.66 2i2r n LEU 65 Cb 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 43.42 43.85 2i2r n LEU 65 CO 0.24 0.00 0.20 -0.07 0.00 0.00 0.00 177.39 177.76 2i2r h LEU 66 N 0.00 0.81 -2.63 -1.96 4.07 -1.92 -2.83 115.31 110.86 2i2r h LEU 66 Ca 0.00 -0.70 -0.00 0.00 0.08 0.00 0.00 57.88 57.26 2i2r h LEU 66 Cb 0.00 -0.24 -0.00 0.00 1.08 0.00 0.00 40.66 41.50 2i2r h LEU 66 CO 0.00 1.40 -0.00 1.23 -1.08 0.00 0.00 178.44 179.98 2i2r h GLY 67 N 0.30 0.00 0.00 0.83 0.00 0.34 -3.45 103.07 101.09 2i2r h GLY 67 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.24 2i2r h GLY 67 CO 0.16 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.56 2i2r n SER 68 N -3.60 0.04 0.13 0.19 3.41 0.38 -4.25 113.62 109.92 2i2r n SER 68 Ca -0.03 -0.26 0.05 0.00 -0.26 0.00 0.00 58.87 58.37 2i2r n SER 68 Cb 0.08 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.07 2i2r n SER 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2i2r h THR 69 N 0.01 0.53 -0.88 6.66 1.03 -1.87 -3.38 112.91 115.01 2i2r h THR 69 Ca 0.00 -1.80 0.19 0.00 -0.01 0.00 0.00 66.41 64.79 2i2r h THR 69 Cb 0.00 2.18 -0.11 0.00 -1.07 0.00 0.00 68.15 69.14 2i2r h THR 69 CO 0.00 0.30 0.40 -0.08 -0.01 0.00 0.00 175.52 176.14 2i2r h GLU 70 N 0.00 0.46 0.00 0.00 4.81 -1.92 -0.39 114.58 117.54 2i2r h GLU 70 Ca -0.03 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2i2r h GLU 70 Cb 1.30 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.58 2i2r h GLU 70 CO 0.04 0.30 0.20 1.57 -0.73 0.00 0.00 179.01 180.40 2i2r h LYS 71 N 0.47 0.00 -0.14 1.92 2.10 -1.68 -1.13 116.57 118.11 2i2r h LYS 71 Ca 0.52 0.00 0.04 0.00 -2.00 0.00 0.00 60.65 59.22 2i2r h LYS 71 Cb 0.92 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.24 2i2r h LYS 71 CO -0.47 0.00 0.15 1.49 -2.00 0.00 0.00 179.45 178.61 2i2r h GLU 72 N 0.00 0.00 0.00 0.07 4.57 -1.37 0.11 114.58 117.96 2i2r h GLU 72 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2i2r h GLU 72 Cb 0.41 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 2i2r h GLU 72 CO 0.00 0.00 0.00 1.19 -1.18 0.00 0.00 179.01 179.02 2i2r n PHE 73 N -3.93 0.00 -0.02 0.92 3.72 -0.43 -2.64 117.46 115.08 2i2r n PHE 73 Ca 0.01 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.42 2i2r n PHE 73 Cb 0.26 -0.31 0.03 0.00 -0.94 0.00 0.00 39.48 38.52 2i2r n PHE 73 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2i2r n PHE 74 N -1.31 0.10 -3.06 1.38 3.01 0.37 -5.01 117.46 112.94 2i2r n PHE 74 Ca 0.07 -0.44 -0.39 0.00 1.01 0.00 0.00 57.45 57.70 2i2r n PHE 74 Cb 0.13 -0.04 -0.05 0.00 -0.01 0.00 0.00 39.48 39.51 2i2r n PHE 74 CO 0.00 0.00 0.00 0.12 1.01 0.00 0.00 176.76 177.89 2i2r s PHE 75 N -0.90 3.77 -0.27 1.38 2.19 -1.08 -1.05 117.98 122.02 2i2r s PHE 75 Ca 0.05 1.42 -0.08 0.00 0.33 0.00 0.00 56.93 58.65 2i2r s PHE 75 Cb 0.03 -2.73 -0.03 0.00 -1.31 0.00 0.00 43.02 38.98 2i2r s PHE 75 CO 0.04 0.37 0.10 1.21 1.83 0.00 0.00 175.22 178.77 2i2r s ASN 76 N -0.41 5.34 0.19 6.13 3.84 0.05 -4.95 114.94 125.15 2i2r s ASN 76 Ca 0.35 -0.24 -0.11 0.00 0.21 0.00 0.00 52.86 53.07 2i2r s ASN 76 Cb -0.20 -1.97 0.22 0.00 -0.55 0.00 0.00 41.25 38.75 2i2r s ASN 76 CO 0.22 -0.07 1.75 -0.08 -2.79 0.00 0.00 177.10 176.13 2i2r h GLU 77 N 8.28 0.36 0.00 0.43 4.57 -1.96 0.14 114.58 126.41 2i2r h GLU 77 Ca -0.37 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.79 2i2r h GLU 77 Cb 1.17 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.68 2i2r h GLU 77 CO 0.58 0.24 0.00 -0.25 -1.18 0.00 0.00 179.01 178.40 2i2r n ASP 78 N -5.00 0.00 0.13 1.04 8.00 -1.26 -3.64 116.55 115.81 2i2r n ASP 78 Ca 0.07 0.52 0.07 0.00 0.71 0.00 0.00 54.79 56.16 2i2r n ASP 78 Cb 0.23 -0.33 0.35 0.00 -0.02 0.00 0.00 41.12 41.35 2i2r n ASP 78 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2i2r n THR 79 N -1.50 0.93 -3.16 -3.53 -2.24 -1.25 -4.79 114.28 98.74 2i2r n THR 79 Ca 0.00 0.69 -0.23 0.00 -2.27 0.00 0.00 64.05 62.24 2i2r n THR 79 Cb 0.00 -1.69 0.04 0.00 -2.10 0.00 0.00 70.33 66.58 2i2r n THR 79 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2i2r n LYS 80 N -1.96 -5.54 -3.68 -0.78 3.00 0.48 -4.98 118.16 104.70 2i2r n LYS 80 Ca -0.01 0.89 -0.13 0.00 -0.00 0.00 0.00 58.31 59.06 2i2r n LYS 80 Cb 0.19 -5.79 -0.07 0.00 0.00 0.00 0.00 35.03 29.36 2i2r n LYS 80 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 2i2r s GLU 81 N -5.85 0.86 0.05 1.64 -1.05 -1.08 -4.93 118.70 108.35 2i2r s GLU 81 Ca 0.37 -0.28 -0.31 0.00 -0.15 0.00 0.00 54.97 54.60 2i2r s GLU 81 Cb -0.16 0.39 -0.05 0.00 -0.44 0.00 0.00 34.13 33.86 2i2r s GLU 81 CO 0.46 -0.28 1.22 0.71 0.95 0.00 0.00 175.26 178.32 2i2r s TYR 82 N -2.10 3.37 -0.12 4.83 1.51 -1.13 -0.77 117.35 122.94 2i2r s TYR 82 Ca -0.08 1.25 0.03 0.00 -1.01 0.00 0.00 57.07 57.26 2i2r s TYR 82 Cb -0.02 -3.45 0.01 0.00 -0.11 0.00 0.00 41.96 38.39 2i2r s TYR 82 CO 0.00 -1.40 -0.22 0.12 -1.11 0.00 0.00 175.55 172.94 2i2r s PHE 83 N 1.25 2.54 -0.12 2.71 5.36 -0.22 0.44 117.98 129.94 2i2r s PHE 83 Ca 0.59 -1.16 0.03 0.00 -0.96 0.00 0.00 56.93 55.43 2i2r s PHE 83 Cb -0.29 -1.72 0.00 0.00 -0.34 0.00 0.00 43.02 40.67 2i2r s PHE 83 CO 0.28 -0.50 -0.22 -0.06 -1.46 0.00 0.00 175.22 173.26 2i2r s PHE 84 N 0.60 2.63 -0.23 10.12 0.08 -0.10 -4.85 117.98 126.24 2i2r s PHE 84 Ca -0.13 -1.13 -0.01 0.00 0.12 0.00 0.00 56.93 55.78 2i2r s PHE 84 Cb -0.17 -1.77 0.16 0.00 -0.57 0.00 0.00 43.02 40.67 2i2r s PHE 84 CO 0.03 -0.48 1.99 -3.47 -0.10 0.00 0.00 175.22 173.19 2i2r n ASP 85 N 3.77 6.08 -5.02 1.36 2.03 -1.26 -1.62 116.55 121.89 2i2r n ASP 85 Ca -0.19 -2.88 -0.20 0.00 0.52 0.00 0.00 54.79 52.04 2i2r n ASP 85 Cb 0.52 -1.06 0.05 0.00 -0.72 0.00 0.00 41.12 39.91 2i2r n ASP 85 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2i2r s ARG 86 N -1.34 2.39 0.18 -0.67 1.81 -1.26 -4.94 118.95 115.12 2i2r s ARG 86 Ca 0.23 -1.61 -0.32 0.00 -1.72 0.00 0.00 55.73 52.31 2i2r s ARG 86 Cb 0.18 -2.61 -0.11 0.00 -0.45 0.00 0.00 34.95 31.96 2i2r s ARG 86 CO -0.00 -0.73 1.65 0.34 -0.68 0.00 0.00 175.30 175.87 2i2r s ASP 87 N -4.57 6.50 0.22 0.23 2.15 -1.26 -4.15 116.67 115.78 2i2r s ASP 87 Ca 0.58 2.72 0.11 0.00 0.43 0.00 0.00 52.55 56.39 2i2r s ASP 87 Cb -0.06 -2.59 0.05 0.00 -0.30 0.00 0.00 42.92 40.02 2i2r s ASP 87 CO 0.36 -0.90 1.43 1.55 -0.17 0.00 0.00 175.17 177.44 2i2r h PRO 88 N 6.97 0.00 0.39 4.34 0.13 -1.95 -3.25 132.00 138.62 2i2r h PRO 88 Ca -0.43 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.68 2i2r h PRO 88 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2i2r h PRO 88 CO 0.93 0.73 -0.19 1.49 -0.23 0.00 0.00 178.00 180.73 2i2r h GLU 89 N 0.00 -0.51 -0.87 0.86 4.57 -1.93 -3.18 114.58 113.52 2i2r h GLU 89 Ca -0.01 0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.23 2i2r h GLU 89 Cb 1.47 0.12 -0.05 0.00 -0.16 0.00 0.00 28.75 30.12 2i2r h GLU 89 CO 0.09 -0.24 0.57 0.28 -1.18 0.00 0.00 179.01 178.54 2i2r h VAL 90 N -0.71 1.19 -1.28 0.32 2.07 -1.99 -0.87 116.25 114.99 2i2r h VAL 90 Ca -0.05 -0.39 0.37 0.00 0.82 0.00 0.00 66.70 67.44 2i2r h VAL 90 Cb 0.50 -0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.17 2i2r h VAL 90 CO 0.09 0.21 0.98 0.15 0.02 0.00 0.00 177.57 179.01 2i2r h PHE 91 N 1.15 0.00 -0.53 1.57 3.57 -1.58 0.44 116.94 121.55 2i2r h PHE 91 Ca 0.33 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.90 2i2r h PHE 91 Cb -0.08 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 38.60 2i2r h PHE 91 CO -0.01 0.00 0.22 0.00 -2.23 0.00 0.00 178.31 176.28 2i2r h ARG 92 N 0.00 0.40 -0.08 1.11 3.08 -1.15 0.54 114.38 118.28 2i2r h ARG 92 Ca 0.61 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.60 2i2r h ARG 92 Cb 2.55 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 32.51 2i2r h ARG 92 CO -0.01 0.27 -0.08 0.00 -1.07 0.00 0.00 179.97 179.08 2i2r h VAL 94 N -0.22 0.47 0.07 0.00 2.07 -1.36 0.40 116.25 117.67 2i2r h VAL 94 Ca 0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 2i2r h VAL 94 Cb 0.59 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2i2r h VAL 94 CO 0.02 0.00 -0.03 0.25 0.02 0.00 0.00 177.57 177.83 2i2r h LEU 95 N -0.06 -0.08 -2.26 2.57 5.85 -0.77 -2.06 115.31 118.50 2i2r h LEU 95 Ca 0.22 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.97 2i2r h LEU 95 Cb 0.39 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 2i2r h LEU 95 CO -0.49 -0.04 0.21 0.78 -0.34 0.00 0.00 178.44 178.55 2i2r h ASN 96 N -0.11 0.00 -0.16 1.25 2.35 -0.02 0.14 115.58 119.03 2i2r h ASN 96 Ca -0.01 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.62 2i2r h ASN 96 Cb 0.09 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 2i2r h ASN 96 CO 0.02 0.00 -0.30 0.15 -1.65 0.00 0.00 177.43 175.64 2i2r h PHE 97 N 0.00 0.75 0.00 1.19 3.04 0.51 -2.25 116.94 120.18 2i2r h PHE 97 Ca 0.07 -0.19 -0.03 0.00 3.98 0.00 0.00 57.97 61.81 2i2r h PHE 97 Cb 0.50 -0.17 -0.00 0.00 2.56 0.00 0.00 35.95 38.83 2i2r h PHE 97 CO 0.00 0.88 -0.14 1.88 -2.02 0.00 0.00 178.31 178.91 2i2r h TYR 98 N 0.56 0.00 0.00 0.41 -1.99 -0.61 -3.38 116.97 111.95 2i2r h TYR 98 Ca 0.07 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.80 2i2r h TYR 98 Cb 0.80 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.53 2i2r h TYR 98 CO 0.04 0.14 0.00 0.54 -0.00 0.00 0.00 178.16 178.88 2i2r n ARG 99 N -3.35 0.00 -2.54 4.88 1.74 -0.88 -4.81 116.66 111.71 2i2r n ARG 99 Ca -0.00 0.20 -0.33 0.00 -0.77 0.00 0.00 57.85 56.95 2i2r n ARG 99 Cb 0.35 -0.66 -0.05 0.00 -1.02 0.00 0.00 32.46 31.08 2i2r n ARG 99 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2i2r s THR 100 N -0.45 4.41 0.63 0.55 -4.23 -1.03 -4.96 115.64 110.57 2i2r s THR 100 Ca 0.00 1.29 0.32 0.00 -1.18 0.00 0.00 61.69 62.13 2i2r s THR 100 Cb 0.00 -3.65 0.35 0.00 1.34 0.00 0.00 72.50 70.55 2i2r s THR 100 CO 0.00 -0.53 2.05 1.23 -0.54 0.00 0.00 174.62 176.83 2i2r h GLY 101 N 1.28 0.00 -4.84 3.99 0.00 -1.85 -3.39 103.07 98.26 2i2r h GLY 101 Ca -0.48 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.29 2i2r h GLY 101 CO 0.61 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.69 2i2r s LYS 102 N -4.33 4.32 -0.27 4.80 1.02 -1.26 -4.91 119.74 119.12 2i2r s LYS 102 Ca -0.04 0.77 -0.12 0.00 0.02 0.00 0.00 55.97 56.60 2i2r s LYS 102 Cb 0.12 -3.33 -0.05 0.00 -0.52 0.00 0.00 37.83 34.05 2i2r s LYS 102 CO 0.41 0.39 0.22 -1.17 -0.92 0.00 0.00 175.35 174.29 2i2r s LEU 103 N -0.30 4.05 0.01 3.17 2.96 -1.26 -4.08 118.68 123.22 2i2r s LEU 103 Ca 0.31 0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 54.31 2i2r s LEU 103 Cb -0.19 -2.19 -0.04 0.00 0.50 0.00 0.00 46.19 44.28 2i2r s LEU 103 CO 0.18 -0.05 0.09 -1.00 -1.32 0.00 0.00 176.35 174.25 2i2r s HIS 104 N 1.67 3.30 -0.44 5.38 3.76 -1.26 -3.12 115.29 124.58 2i2r s HIS 104 Ca 0.09 0.20 -0.19 0.00 -0.15 0.00 0.00 55.06 55.01 2i2r s HIS 104 Cb -0.15 -1.73 0.03 0.00 1.11 0.00 0.00 32.58 31.83 2i2r s HIS 104 CO 0.10 0.56 0.54 -0.47 -0.85 0.00 0.00 174.74 174.61 2i2r s TYR 105 N -1.23 3.11 -0.47 1.40 5.04 -1.26 -4.96 117.35 118.97 2i2r s TYR 105 Ca 0.24 -0.27 -0.27 0.00 -2.44 0.00 0.00 57.07 54.33 2i2r s TYR 105 Cb -0.12 -3.16 -0.08 0.00 0.35 0.00 0.00 41.96 38.96 2i2r s TYR 105 CO 0.15 -0.81 2.40 -0.35 -1.34 0.00 0.00 175.55 175.60 2i2r n PRO 106 N 5.93 1.13 0.00 4.97 -0.04 -1.26 -4.82 135.00 140.92 2i2r n PRO 106 Ca -0.05 0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2i2r n PRO 106 Cb 0.47 -3.26 0.00 0.00 -0.04 0.00 0.00 33.50 30.67 2i2r n PRO 106 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2i2r n ARG 107 N 8.91 0.17 0.00 0.54 1.74 -1.26 -1.85 116.66 124.91 2i2r n ARG 107 Ca 0.38 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.46 2i2r n ARG 107 Cb 0.49 -1.35 0.00 0.00 -1.02 0.00 0.00 32.46 30.58 2i2r n ARG 107 CO 0.00 0.00 0.00 2.48 -1.52 0.00 0.00 177.63 178.59 2i2r n TYR 108 N 0.81 0.00 -1.40 -1.55 0.18 -1.26 -5.10 117.16 108.84 2i2r n TYR 108 Ca 0.00 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.44 2i2r n TYR 108 Cb 0.08 0.07 0.10 0.00 -0.38 0.00 0.00 39.34 39.20 2i2r n TYR 108 CO 0.00 0.00 0.00 -1.21 -2.08 0.00 0.00 176.86 173.57 2i2r s GLU 109 N -1.68 2.09 0.17 -3.48 0.41 -0.77 -4.97 118.70 110.47 2i2r s GLU 109 Ca 0.00 1.74 -0.30 0.00 -0.41 0.00 0.00 54.97 56.00 2i2r s GLU 109 Cb 0.00 -1.83 -0.07 0.00 -1.78 0.00 0.00 34.13 30.45 2i2r s GLU 109 CO 0.00 -1.87 1.10 0.00 -0.49 0.00 0.00 175.26 174.00 2i2r h ILE 111 N 3.75 0.00 -0.63 0.00 1.08 -1.93 -1.97 117.51 117.81 2i2r h ILE 111 Ca -0.44 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.16 2i2r h ILE 111 Cb 1.21 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.86 2i2r h ILE 111 CO 0.73 0.00 0.03 -1.28 -0.69 0.00 0.00 178.15 176.93 2i2r h SER 112 N -0.18 -0.23 -1.07 1.72 0.87 -1.94 0.81 113.55 113.53 2i2r h SER 112 Ca 0.04 0.15 0.30 0.00 -1.23 0.00 0.00 61.79 61.05 2i2r h SER 112 Cb 0.28 0.26 -0.12 0.00 -0.44 0.00 0.00 62.40 62.38 2i2r h SER 112 CO -0.29 -0.10 0.67 0.00 -0.53 0.00 0.00 176.83 176.57 2i2r h ALA 113 N 1.57 2.18 0.00 6.23 0.00 -1.76 -2.32 119.26 125.16 2i2r h ALA 113 Ca 0.33 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.35 2i2r h ALA 113 Cb 0.54 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2i2r h ALA 113 CO -0.52 -0.68 -1.39 0.98 0.00 0.00 0.00 179.25 177.63 2i2r n TYR 114 N -4.77 0.00 -0.05 0.00 9.36 0.12 -3.66 117.16 118.15 2i2r n TYR 114 Ca 0.29 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.37 2i2r n TYR 114 Cb 0.97 -0.24 -0.07 0.00 -0.63 0.00 0.00 39.34 39.37 2i2r n TYR 114 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 2i2r h ASP 115 N 0.00 0.51 -0.57 2.98 3.32 -0.78 -2.20 116.42 119.68 2i2r h ASP 115 Ca 0.00 -0.54 0.11 0.00 0.02 0.00 0.00 57.03 56.62 2i2r h ASP 115 Cb 0.60 -0.15 -0.11 0.00 0.22 0.00 0.00 39.33 39.89 2i2r h ASP 115 CO 0.00 0.95 -0.24 0.44 -1.72 0.00 0.00 179.24 178.67 2i2r h ASP 116 N 0.08 -0.84 -0.43 6.45 3.45 -1.57 0.13 116.42 123.69 2i2r h ASP 116 Ca 0.01 0.20 -0.05 0.00 0.43 0.00 0.00 57.03 57.62 2i2r h ASP 116 Cb 0.85 0.46 -0.02 0.00 -0.56 0.00 0.00 39.33 40.07 2i2r h ASP 116 CO 0.06 -0.26 0.08 -0.33 -1.57 0.00 0.00 179.24 177.22 2i2r h GLU 117 N -0.10 0.71 -0.91 3.56 4.39 -1.62 -2.34 114.58 118.26 2i2r h GLU 117 Ca 0.26 -0.19 0.05 0.00 0.34 0.00 0.00 59.36 59.82 2i2r h GLU 117 Cb 0.50 -0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 29.01 2i2r h GLU 117 CO -0.63 0.74 0.59 -0.07 -1.16 0.00 0.00 179.01 178.48 2i2r h LEU 118 N 0.57 0.95 -0.87 1.33 3.38 -0.46 -1.43 115.31 118.79 2i2r h LEU 118 Ca 0.13 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2i2r h LEU 118 Cb 0.37 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2i2r h LEU 118 CO 0.01 0.63 0.39 0.00 0.09 0.00 0.00 178.44 179.56 2i2r h ALA 119 N 1.49 1.11 0.36 1.53 0.00 -0.45 -1.96 119.26 121.34 2i2r h ALA 119 Ca 0.38 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2i2r h ALA 119 Cb 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2i2r h ALA 119 CO -0.13 0.66 -0.17 0.35 0.00 0.00 0.00 179.25 179.96 2i2r h PHE 120 N 1.20 -0.45 0.00 0.00 3.57 -0.76 -3.12 116.94 117.38 2i2r h PHE 120 Ca 0.29 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.78 2i2r h PHE 120 Cb 0.13 0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.02 2i2r h PHE 120 CO 0.02 -0.25 0.00 0.66 -2.23 0.00 0.00 178.31 176.51 2i2r n TYR 121 N -5.28 0.00 -1.02 0.41 4.01 -0.88 -4.83 117.16 109.57 2i2r n TYR 121 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 2i2r n TYR 121 Cb 0.22 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 2i2r n TYR 121 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2i2r n GLY 122 N 0.86 0.50 3.71 2.72 0.00 -0.90 -2.17 105.19 109.91 2i2r n GLY 122 Ca 0.20 -0.90 -0.35 0.00 0.00 0.00 0.00 46.02 44.97 2i2r n GLY 122 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2i2r s ILE 123 N -2.00 5.31 0.08 -0.61 1.09 -0.79 -4.72 121.20 119.57 2i2r s ILE 123 Ca 0.00 0.16 -0.30 0.00 -1.10 0.00 0.00 60.65 59.40 2i2r s ILE 123 Cb 0.00 -3.43 -0.05 0.00 -1.06 0.00 0.00 42.46 37.92 2i2r s ILE 123 CO 0.00 0.43 1.11 -0.76 -0.10 0.00 0.00 174.94 175.62 2i2r s LEU 124 N 0.46 4.41 0.05 2.97 2.01 -1.26 -4.31 118.68 123.01 2i2r s LEU 124 Ca 0.07 1.93 -0.10 0.00 0.01 0.00 0.00 54.13 56.04 2i2r s LEU 124 Cb -0.12 -3.58 -0.02 0.00 0.01 0.00 0.00 46.19 42.48 2i2r s LEU 124 CO -0.01 -0.33 0.53 -2.65 1.01 0.00 0.00 176.35 174.90 2i2r n PRO 125 N 3.46 -0.15 -2.77 1.29 -0.01 -1.26 -2.12 135.00 133.44 2i2r n PRO 125 Ca 0.06 0.52 -0.31 0.00 -0.01 0.00 0.00 63.50 63.76 2i2r n PRO 125 Cb 0.48 -0.76 -0.02 0.00 -0.01 0.00 0.00 33.50 33.18 2i2r n PRO 125 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 175.50 174.64 2i2r n GLU 126 N -4.38 3.79 -0.17 -0.52 0.28 -1.26 -4.22 120.64 114.16 2i2r n GLU 126 Ca 0.01 -4.72 0.05 0.00 -0.16 0.00 0.00 57.16 52.34 2i2r n GLU 126 Cb 0.09 -2.30 0.15 0.00 1.43 0.00 0.00 31.44 30.81 2i2r n GLU 126 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2i2r n ILE 127 N -0.24 0.44 -1.94 3.84 5.41 -0.90 -4.96 119.36 121.00 2i2r n ILE 127 Ca 0.37 -0.44 -0.42 0.00 1.00 0.00 0.00 62.75 63.26 2i2r n ILE 127 Cb 0.38 0.22 -0.02 0.00 -0.71 0.00 0.00 39.64 39.51 2i2r n ILE 127 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2i2r s ILE 128 N -1.56 2.53 1.14 1.39 1.01 -1.26 -4.32 121.20 120.13 2i2r s ILE 128 Ca 0.22 0.42 -0.13 0.00 0.00 0.00 0.00 60.65 61.17 2i2r s ILE 128 Cb 0.12 -3.27 0.27 0.00 0.01 0.00 0.00 42.46 39.59 2i2r s ILE 128 CO 0.15 0.06 1.04 -0.83 0.00 0.00 0.00 174.94 175.36 2i2r s GLY 129 N 0.61 1.54 0.51 6.18 0.00 -1.18 -4.61 107.32 110.38 2i2r s GLY 129 Ca 0.63 -0.21 0.22 0.00 0.00 0.00 0.00 44.72 45.36 2i2r s GLY 129 CO 0.41 0.51 2.11 -0.55 0.00 0.00 0.00 173.10 175.57 2i2r h ASP 130 N -2.52 0.00 -0.60 1.64 5.19 -1.94 -1.78 116.42 116.40 2i2r h ASP 130 Ca -0.61 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 55.77 2i2r h ASP 130 Cb 1.34 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.82 2i2r h ASP 130 CO 0.52 0.09 0.27 0.00 -3.12 0.00 0.00 179.24 177.00 2i2r n TYR 133 N -2.23 0.32 0.12 0.00 -0.00 -0.70 0.15 117.16 114.83 2i2r n TYR 133 Ca -0.12 0.15 -0.12 0.00 -0.00 0.00 0.00 57.90 57.81 2i2r n TYR 133 Cb 0.68 -0.74 -0.08 0.00 -0.00 0.00 0.00 39.34 39.20 2i2r n TYR 133 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.86 177.79 2i2r h GLU 134 N 0.00 -0.33 0.00 -3.48 4.39 -1.77 -3.01 114.58 110.38 2i2r h GLU 134 Ca 0.00 0.02 -0.11 0.00 0.34 0.00 0.00 59.36 59.61 2i2r h GLU 134 Cb 0.12 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2i2r h GLU 134 CO 0.00 0.02 -0.52 0.93 -1.16 0.00 0.00 179.01 178.28 2i2r h GLU 135 N -0.78 0.00 -0.12 2.33 4.39 -1.05 -2.75 114.58 116.60 2i2r h GLU 135 Ca -0.04 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.59 2i2r h GLU 135 Cb 0.51 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2i2r h GLU 135 CO 0.06 0.52 -0.25 -0.92 -1.16 0.00 0.00 179.01 177.26 2i2r h TYR 136 N 0.00 0.23 0.33 4.33 5.03 -0.41 -3.02 116.97 123.45 2i2r h TYR 136 Ca -0.01 -0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.25 2i2r h TYR 136 Cb 1.21 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 39.44 2i2r h TYR 136 CO 0.00 0.45 -0.16 0.87 -1.32 0.00 0.00 178.16 178.00 2i2r h LYS 137 N 0.19 -0.43 0.00 1.82 1.79 -1.37 -3.18 116.57 115.39 2i2r h LYS 137 Ca 0.03 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 2i2r h LYS 137 Cb 0.55 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 2i2r h LYS 137 CO 0.04 -0.29 0.00 -0.25 -1.08 0.00 0.00 179.45 177.87 2i2r n ASP 138 N -3.92 0.00 -2.26 0.86 9.92 -1.05 -1.13 116.55 118.97 2i2r n ASP 138 Ca -0.06 0.16 -0.00 0.00 -0.53 0.00 0.00 54.79 54.37 2i2r n ASP 138 Cb 0.18 -0.21 0.04 0.00 -0.64 0.00 0.00 41.12 40.49 2i2r n ASP 138 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 2i2r n ARG 139 N -1.21 1.31 0.00 -1.24 1.85 -1.15 -5.10 116.66 111.12 2i2r n ARG 139 Ca 0.01 -3.07 0.00 0.00 -1.00 0.00 0.00 57.85 53.80 2i2r n ARG 139 Cb 0.02 -1.15 0.00 0.00 -1.05 0.00 0.00 32.46 30.28 2i2r n ARG 139 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25