#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 3.23 0.16 0.00 0.00 -1.26 -4.14 105.19 103.18 2i2r n GLY 4 Ca 0.00 -0.93 0.04 0.00 0.00 0.00 0.00 46.02 45.13 2i2r n GLY 4 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2i2r h VAL 5 N 3.37 0.90 -0.94 1.61 -1.51 -2.07 -3.16 116.25 114.44 2i2r h VAL 5 Ca 0.00 -1.90 0.24 0.00 -1.23 0.00 0.00 66.70 63.81 2i2r h VAL 5 Cb 1.70 2.18 -0.06 0.00 -2.13 0.00 0.00 31.29 32.98 2i2r h VAL 5 CO 0.36 0.44 0.64 0.00 -1.23 0.00 0.00 177.57 177.78 2i2r h ALA 6 N 1.55 2.41 0.00 5.19 0.00 -2.04 0.20 119.26 126.56 2i2r h ALA 6 Ca -0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2i2r h ALA 6 Cb 1.14 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2i2r h ALA 6 CO 0.06 -0.72 0.00 0.00 0.00 0.00 0.00 179.25 178.59 2i2r n ALA 7 N -2.57 2.28 -0.00 0.00 0.00 -1.20 -2.73 120.51 116.30 2i2r n ALA 7 Ca 0.21 -0.13 0.10 0.00 0.00 0.00 0.00 53.44 53.62 2i2r n ALA 7 Cb 0.83 -1.39 -0.15 0.00 0.00 0.00 0.00 19.45 18.73 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 -1.19 0.11 -0.33 0.00 7.02 0.06 -4.57 117.44 118.54 2i2r n TRP 8 Ca 0.14 0.03 0.04 0.00 -1.02 0.00 0.00 57.50 56.69 2i2r n TRP 8 Cb 0.15 -0.57 0.22 0.00 -2.42 0.00 0.00 31.31 28.69 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 0.95 -2.59 -0.99 3.38 -1.55 -2.39 115.31 112.12 2i2r h LEU 9 Ca -0.02 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2i2r h LEU 9 Cb 1.05 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 2i2r h LEU 9 CO 0.00 0.59 0.09 1.55 0.09 0.00 0.00 178.44 180.77 2i2r h PRO 10 N 1.07 0.00 -0.07 1.13 0.13 -1.80 0.69 132.00 133.14 2i2r h PRO 10 Ca 0.42 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.43 2i2r h PRO 10 Cb 0.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.36 2i2r h PRO 10 CO -0.17 0.00 -0.50 0.74 -0.23 0.00 0.00 178.00 177.84 2i2r h PHE 11 N 0.00 0.22 0.46 1.56 0.05 -1.75 0.12 116.94 117.60 2i2r h PHE 11 Ca 0.02 -0.07 -0.02 0.00 3.82 0.00 0.00 57.97 61.71 2i2r h PHE 11 Cb 0.21 -0.04 0.00 0.00 2.00 0.00 0.00 35.95 38.12 2i2r h PHE 11 CO 0.00 0.65 -0.22 0.00 -0.18 0.00 0.00 178.31 178.56 2i2r h ALA 12 N 1.34 -0.62 -1.05 2.45 0.00 0.09 -3.28 119.26 118.19 2i2r h ALA 12 Ca 0.00 -0.14 0.31 0.00 0.00 0.00 0.00 54.91 55.08 2i2r h ALA 12 Cb 0.94 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 2i2r h ALA 12 CO 0.07 -0.58 0.80 0.07 0.00 0.00 0.00 179.25 179.62 2i2r h ARG 13 N -1.16 0.00 -0.52 0.00 0.11 -0.36 0.39 114.38 112.84 2i2r h ARG 13 Ca -0.06 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.00 2i2r h ARG 13 Cb 0.48 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.54 2i2r h ARG 13 CO 0.10 0.00 0.26 0.00 0.10 0.00 0.00 179.97 180.43 2i2r h ALA 14 N 1.39 1.48 -0.00 0.08 0.00 -1.03 -2.78 119.26 118.41 2i2r h ALA 14 Ca 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2i2r h ALA 14 Cb 2.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.67 2i2r h ALA 14 CO -0.01 0.42 -0.05 0.00 0.00 0.00 0.00 179.25 179.61 2i2r n ALA 15 N -2.46 2.65 -0.06 0.00 0.00 0.14 -3.63 120.51 117.14 2i2r n ALA 15 Ca 0.04 -0.22 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 2i2r n ALA 15 Cb 0.12 -1.41 -0.09 0.00 0.00 0.00 0.00 19.45 18.06 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 3.67 0.00 0.00 0.00 0.00 -1.56 -3.47 119.26 117.89 2i2r h ALA 16 Ca 0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 2i2r h ALA 16 Cb 0.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2i2r h ALA 16 CO 0.00 0.01 0.19 0.44 0.00 0.00 0.00 179.25 179.89 2i2r n ILE 17 N -4.66 0.00 0.00 0.00 -0.00 -1.24 -2.52 119.36 110.95 2i2r n ILE 17 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.68 2i2r n ILE 17 Cb 0.35 -0.06 0.00 0.00 -0.00 0.00 0.00 39.64 39.92 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 0.92 1.07 0.00 3.28 0.00 -1.26 -5.06 105.19 104.14 2i2r n GLY 18 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.00 1.61 4.27 -1.05 -5.29 117.44 116.98 2i2r n TRP 19 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 2i2r n TRP 19 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 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 0.00 0.00 -2.67 1.56 -1.26 -5.03 117.12 109.72 2i2r n MET 20 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 2i2r n MET 20 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 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 35 N 8.34 -0.78 0.00 6.12 4.05 -1.26 -5.11 115.26 126.62 2i2r n ASN 35 Ca 0.00 -0.04 0.00 0.00 0.45 0.00 0.00 54.58 54.99 2i2r n ASN 35 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 2i2r n ASN 35 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 2i2r n LYS 36 N -0.82 0.00 -2.81 1.20 5.02 -1.26 -5.09 118.16 114.40 2i2r n LYS 36 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 2i2r n LYS 36 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.04 2i2r n LYS 36 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2i2r n ARG 37 N 0.00 0.76 -1.18 1.97 0.00 -1.26 -5.15 116.66 111.79 2i2r n ARG 37 Ca 0.00 -1.94 -0.40 0.00 -0.00 0.00 0.00 57.85 55.51 2i2r n ARG 37 Cb 0.00 -1.44 -0.02 0.00 0.00 0.00 0.00 32.46 31.00 2i2r n ARG 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2i2r n GLN 38 N 1.69 0.00 -3.39 -0.14 -0.00 -1.26 -4.93 117.38 109.34 2i2r n GLN 38 Ca 0.11 0.00 -0.35 0.00 -0.00 0.00 0.00 57.00 56.76 2i2r n GLN 38 Cb 0.61 -0.85 -0.06 0.00 -0.00 0.00 0.00 30.24 29.94 2i2r n GLN 38 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2i2r s ASP 39 N -0.85 6.80 0.19 2.61 2.15 -1.26 -5.11 116.67 121.19 2i2r s ASP 39 Ca 0.54 1.03 0.10 0.00 0.43 0.00 0.00 52.55 54.65 2i2r s ASP 39 Cb -0.76 -2.27 -0.04 0.00 -0.30 0.00 0.00 42.92 39.55 2i2r s ASP 39 CO 0.49 0.12 -0.20 -1.61 -0.17 0.00 0.00 175.17 173.80 2i2r s GLU 40 N -1.93 1.39 0.06 4.34 2.02 -1.26 -5.02 118.70 118.29 2i2r s GLU 40 Ca 0.37 -1.49 -0.24 0.00 0.02 0.00 0.00 54.97 53.62 2i2r s GLU 40 Cb -0.15 -1.50 -0.06 0.00 0.10 0.00 0.00 34.13 32.53 2i2r s GLU 40 CO 0.19 0.30 0.74 -0.51 0.02 0.00 0.00 175.26 176.00 2i2r s LEU 41 N -2.81 4.47 0.20 1.80 1.02 -1.26 -0.85 118.68 121.24 2i2r s LEU 41 Ca 0.19 1.44 0.07 0.00 0.02 0.00 0.00 54.13 55.85 2i2r s LEU 41 Cb -0.06 -3.19 -0.04 0.00 0.02 0.00 0.00 46.19 42.92 2i2r s LEU 41 CO 0.08 0.06 0.09 0.27 0.02 0.00 0.00 176.35 176.87 2i2r s ILE 42 N -0.25 4.10 -0.23 -0.59 -4.36 0.16 -4.90 121.20 115.12 2i2r s ILE 42 Ca 0.37 -1.36 -0.00 0.00 -0.26 0.00 0.00 60.65 59.39 2i2r s ILE 42 Cb -0.21 -3.12 0.03 0.00 1.25 0.00 0.00 42.46 40.41 2i2r s ILE 42 CO 0.23 -0.19 -0.10 -0.69 0.24 0.00 0.00 174.94 174.43 2i2r s VAL 43 N -1.89 2.60 -0.45 8.37 1.01 -1.26 -1.98 120.40 126.80 2i2r s VAL 43 Ca 0.30 -1.07 -0.09 0.00 0.00 0.00 0.00 61.98 61.12 2i2r s VAL 43 Cb -0.09 -2.30 0.10 0.00 0.00 0.00 0.00 36.38 34.10 2i2r s VAL 43 CO 0.22 0.25 0.30 -0.76 0.00 0.00 0.00 175.10 175.11 2i2r s LEU 44 N 1.29 5.45 -0.25 3.92 1.43 0.34 -2.55 118.68 128.32 2i2r s LEU 44 Ca 0.00 -1.76 -0.29 0.00 -1.03 0.00 0.00 54.13 51.05 2i2r s LEU 44 Cb -0.16 -1.99 -0.00 0.00 0.03 0.00 0.00 46.19 44.06 2i2r s LEU 44 CO -0.06 -0.62 1.28 0.21 0.23 0.00 0.00 176.35 177.38 2i2r s ASN 45 N 2.40 6.79 -0.40 2.29 3.84 0.15 0.05 114.94 130.06 2i2r s ASN 45 Ca 0.05 1.40 0.03 0.00 0.21 0.00 0.00 52.86 54.54 2i2r s ASN 45 Cb -0.25 -2.54 0.12 0.00 -0.55 0.00 0.00 41.25 38.03 2i2r s ASN 45 CO 0.00 -0.94 0.15 -0.69 -2.79 0.00 0.00 177.10 172.83 2i2r s VAL 46 N 3.99 1.93 -0.23 -5.21 1.01 0.10 -1.03 120.40 120.96 2i2r s VAL 46 Ca 0.55 -2.48 0.00 0.00 0.00 0.00 0.00 61.98 60.05 2i2r s VAL 46 Cb -0.18 -2.39 0.00 0.00 0.00 0.00 0.00 36.38 33.80 2i2r s VAL 46 CO 0.19 -0.73 0.00 -1.54 0.00 0.00 0.00 175.10 173.02 2i2r n SER 47 N 3.91 -5.66 0.00 3.32 3.41 -0.70 -2.27 113.62 115.64 2i2r n SER 47 Ca 0.04 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 2i2r n SER 47 Cb 0.38 -3.35 0.00 0.00 -0.26 0.00 0.00 64.21 60.98 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 0.46 3.00 3.68 5.00 0.00 -1.26 -5.05 105.19 111.01 2i2r n GLY 48 Ca -0.02 -0.57 -0.47 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 2.32 -2.97 1.61 5.12 -0.96 -4.89 116.66 116.89 2i2r n ARG 49 Ca 0.00 0.85 -0.44 0.00 -1.93 0.00 0.00 57.85 56.33 2i2r n ARG 49 Cb 0.00 -2.72 -0.04 0.00 -1.16 0.00 0.00 32.46 28.54 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 4.21 3.27 0.39 5.56 0.52 -1.26 0.00 118.95 131.64 2i2r s ARG 50 Ca 0.92 -1.34 -0.24 0.00 -0.52 0.00 0.00 55.73 54.56 2i2r s ARG 50 Cb -0.64 -4.46 -0.09 0.00 0.52 0.00 0.00 34.95 30.27 2i2r s ARG 50 CO 0.50 -1.70 1.02 -0.06 0.02 0.00 0.00 175.30 175.07 2i2r s PHE 51 N 3.07 3.34 -0.01 -0.53 0.08 0.11 -4.87 117.98 119.16 2i2r s PHE 51 Ca 0.22 1.66 0.02 0.00 0.12 0.00 0.00 56.93 58.96 2i2r s PHE 51 Cb -0.15 -3.06 0.00 0.00 -0.57 0.00 0.00 43.02 39.25 2i2r s PHE 51 CO 0.02 -0.42 -0.07 -0.65 -0.10 0.00 0.00 175.22 174.00 2i2r s GLN 52 N -2.51 0.65 0.14 0.44 -0.21 -1.26 0.13 119.66 117.04 2i2r s GLN 52 Ca 0.57 -0.23 -0.17 0.00 0.02 0.00 0.00 55.36 55.55 2i2r s GLN 52 Cb -0.20 -0.64 0.04 0.00 1.00 0.00 0.00 33.01 33.21 2i2r s GLN 52 CO 0.25 0.10 0.44 -0.08 -2.12 0.00 0.00 175.29 173.89 2i2r s THR 53 N 0.08 0.05 0.16 -0.19 -1.32 -0.84 -4.99 115.64 108.60 2i2r s THR 53 Ca -0.01 -0.50 -0.30 0.00 -1.21 0.00 0.00 61.69 59.67 2i2r s THR 53 Cb -0.06 -1.18 -0.08 0.00 -1.51 0.00 0.00 72.50 69.68 2i2r s THR 53 CO -0.00 -0.25 1.18 0.26 -2.21 0.00 0.00 174.62 173.60 2i2r s TRP 54 N -3.80 3.46 0.21 9.09 0.52 -1.26 0.35 118.94 127.51 2i2r s TRP 54 Ca 0.03 1.43 -0.10 0.00 0.02 0.00 0.00 56.10 57.49 2i2r s TRP 54 Cb 0.01 -3.40 0.29 0.00 -1.15 0.00 0.00 33.47 29.22 2i2r s TRP 54 CO -0.11 -1.11 1.71 -0.09 0.02 0.00 0.00 176.95 177.37 2i2r h ARG 55 N 5.47 0.29 -0.98 4.98 2.43 -1.34 0.35 114.38 125.57 2i2r h ARG 55 Ca -0.44 -0.02 0.18 0.00 -0.81 0.00 0.00 59.98 58.89 2i2r h ARG 55 Cb 1.21 -0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 30.60 2i2r h ARG 55 CO 0.75 0.19 0.59 1.79 -1.51 0.00 0.00 179.97 181.78 2i2r h THR 56 N 0.29 0.73 -0.93 0.20 1.35 -1.93 -0.90 112.91 111.73 2i2r h THR 56 Ca 0.31 -0.27 0.16 0.00 -0.55 0.00 0.00 66.41 66.07 2i2r h THR 56 Cb 0.45 -0.11 -0.10 0.00 -1.73 0.00 0.00 68.15 66.67 2i2r h THR 56 CO -0.38 0.14 0.53 0.74 -0.25 0.00 0.00 175.52 176.30 2i2r h THR 57 N 0.77 0.75 -0.07 6.82 2.02 -0.66 -1.76 112.91 120.79 2i2r h THR 57 Ca 0.55 -0.25 -0.19 0.00 0.77 0.00 0.00 66.41 67.29 2i2r h THR 57 Cb 0.81 -0.05 0.01 0.00 -1.74 0.00 0.00 68.15 67.19 2i2r h THR 57 CO -0.37 0.13 -0.70 -0.07 0.37 0.00 0.00 175.52 174.89 2i2r h LEU 58 N 0.73 0.74 -1.12 2.58 3.38 -1.15 -3.18 115.31 117.29 2i2r h LEU 58 Ca 0.51 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2i2r h LEU 58 Cb 0.71 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2i2r h LEU 58 CO -0.35 1.31 0.13 -0.62 0.09 0.00 0.00 178.44 179.00 2i2r n GLU 59 N -4.09 0.11 -0.03 1.13 1.02 -0.70 -2.77 120.64 115.33 2i2r n GLU 59 Ca -0.09 0.60 0.02 0.00 -0.02 0.00 0.00 57.16 57.67 2i2r n GLU 59 Cb 0.71 -2.00 0.36 0.00 -0.02 0.00 0.00 31.44 30.49 2i2r n GLU 59 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2i2r h ARG 60 N 0.00 0.59 -3.03 3.49 2.43 -1.45 -3.12 114.38 113.30 2i2r h ARG 60 Ca 0.00 -0.06 -0.62 0.00 -0.81 0.00 0.00 59.98 58.49 2i2r h ARG 60 Cb 0.27 -0.12 -0.41 0.00 -0.42 0.00 0.00 29.97 29.29 2i2r h ARG 60 CO 0.00 0.46 -0.62 0.71 -1.51 0.00 0.00 179.97 179.01 2i2r s TYR 61 N -5.36 3.25 1.01 2.20 1.51 -1.11 -5.09 117.35 113.76 2i2r s TYR 61 Ca -0.08 -3.20 -0.13 0.00 -1.01 0.00 0.00 57.07 52.65 2i2r s TYR 61 Cb 0.17 -2.51 0.19 0.00 -0.11 0.00 0.00 41.96 39.70 2i2r s TYR 61 CO 0.75 -0.59 1.10 -1.25 -1.11 0.00 0.00 175.55 174.45 2i2r s PRO 62 N -1.17 0.37 -1.00 -1.71 0.04 -1.18 -3.18 135.00 127.17 2i2r s PRO 62 Ca 0.25 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.70 2i2r s PRO 62 Cb -0.06 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.74 2i2r s PRO 62 CO -0.15 -2.75 0.00 -0.40 0.04 0.00 0.00 177.00 173.74 2i2r n ASP 63 N -4.17 -4.49 -4.17 6.66 3.85 -1.26 -4.84 116.55 108.14 2i2r n ASP 63 Ca 0.06 0.23 -0.25 0.00 -0.71 0.00 0.00 54.79 54.11 2i2r n ASP 63 Cb 0.58 -2.81 -0.16 0.00 -1.35 0.00 0.00 41.12 37.38 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 -2.23 1.43 0.00 2.12 -4.23 -1.19 -4.94 115.64 106.60 2i2r s THR 64 Ca 0.00 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.74 2i2r s THR 64 Cb 0.00 -1.20 0.00 0.00 1.34 0.00 0.00 72.50 72.64 2i2r s THR 64 CO 0.00 0.41 0.00 -0.11 -0.54 0.00 0.00 174.62 174.38 2i2r n LEU 65 N 2.73 0.00 0.02 4.79 0.00 -0.64 0.93 117.00 124.83 2i2r n LEU 65 Ca -0.15 0.00 -0.19 0.00 0.00 0.00 0.00 56.01 55.66 2i2r n LEU 65 Cb 0.54 0.00 -0.10 0.00 0.00 0.00 0.00 43.42 43.86 2i2r n LEU 65 CO 0.24 0.00 0.13 -0.07 0.00 0.00 0.00 177.39 177.69 2i2r h LEU 66 N 0.00 0.93 -2.46 -1.96 4.07 -1.92 -2.73 115.31 111.23 2i2r h LEU 66 Ca 0.00 -0.71 -0.00 0.00 0.08 0.00 0.00 57.88 57.25 2i2r h LEU 66 Cb 0.00 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 41.46 2i2r h LEU 66 CO 0.00 1.50 -0.02 1.23 -1.08 0.00 0.00 178.44 180.08 2i2r h GLY 67 N 0.43 0.00 0.00 0.83 0.00 0.43 -3.45 103.07 101.32 2i2r h GLY 67 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.22 2i2r h GLY 67 CO 0.19 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.59 2i2r n SER 68 N -3.25 0.18 0.10 0.19 3.41 0.56 -4.25 113.62 110.55 2i2r n SER 68 Ca -0.02 -0.11 0.01 0.00 -0.26 0.00 0.00 58.87 58.49 2i2r n SER 68 Cb 0.15 0.00 -0.02 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 0.75 -0.81 6.66 1.03 -1.87 -3.38 112.91 115.30 2i2r h THR 69 Ca 0.00 -2.17 0.19 0.00 -0.01 0.00 0.00 66.41 64.43 2i2r h THR 69 Cb 0.00 2.28 -0.12 0.00 -1.07 0.00 0.00 68.15 69.24 2i2r h THR 69 CO 0.00 0.43 0.22 -0.08 -0.01 0.00 0.00 175.52 176.08 2i2r h GLU 70 N 0.00 0.26 0.00 0.00 4.81 -1.92 0.59 114.58 118.31 2i2r h GLU 70 Ca -0.06 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 2i2r h GLU 70 Cb 1.47 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.79 2i2r h GLU 70 CO 0.06 0.17 0.27 1.57 -0.73 0.00 0.00 179.01 180.35 2i2r h LYS 71 N 0.27 0.00 0.00 1.92 2.10 -1.67 -0.09 116.57 119.10 2i2r h LYS 71 Ca 0.48 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 59.13 2i2r h LYS 71 Cb 0.90 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.23 2i2r h LYS 71 CO -0.57 0.00 -0.01 1.49 -2.00 0.00 0.00 179.45 178.36 2i2r h GLU 72 N 0.00 0.00 0.00 0.07 4.57 -1.18 1.00 114.58 119.04 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 0.54 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 2i2r h GLU 72 CO 0.00 0.01 0.00 1.19 -1.18 0.00 0.00 179.01 179.03 2i2r n PHE 73 N -3.81 0.00 -0.20 0.92 3.72 -0.05 -2.67 117.46 115.38 2i2r n PHE 73 Ca -0.03 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.39 2i2r n PHE 73 Cb 0.09 -0.21 0.03 0.00 -0.94 0.00 0.00 39.48 38.46 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 -1.21 0.03 -3.02 1.38 3.01 0.34 -5.01 117.46 112.98 2i2r n PHE 74 Ca 0.13 -0.59 -0.40 0.00 1.01 0.00 0.00 57.45 57.60 2i2r n PHE 74 Cb 0.15 -0.07 -0.05 0.00 -0.01 0.00 0.00 39.48 39.50 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 -1.33 3.73 -0.27 1.38 2.19 -1.09 -1.57 117.98 121.02 2i2r s PHE 75 Ca 0.07 1.43 -0.10 0.00 0.33 0.00 0.00 56.93 58.66 2i2r s PHE 75 Cb 0.06 -2.79 -0.05 0.00 -1.31 0.00 0.00 43.02 38.93 2i2r s PHE 75 CO 0.01 0.29 0.16 1.21 1.83 0.00 0.00 175.22 178.72 2i2r s ASN 76 N -0.09 5.83 0.17 6.13 3.84 -0.32 -4.96 114.94 125.54 2i2r s ASN 76 Ca 0.37 -0.05 -0.15 0.00 0.21 0.00 0.00 52.86 53.25 2i2r s ASN 76 Cb -0.20 -2.08 0.11 0.00 -0.55 0.00 0.00 41.25 38.53 2i2r s ASN 76 CO 0.22 -0.04 1.74 -0.08 -2.79 0.00 0.00 177.10 176.15 2i2r h GLU 77 N 8.31 0.25 0.00 0.43 4.57 -1.96 -0.35 114.58 125.83 2i2r h GLU 77 Ca -0.36 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.81 2i2r h GLU 77 Cb 1.19 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 2i2r h GLU 77 CO 0.56 0.17 0.00 -0.25 -1.18 0.00 0.00 179.01 178.31 2i2r n ASP 78 N -5.06 0.00 0.11 1.04 8.00 -1.26 -3.43 116.55 115.95 2i2r n ASP 78 Ca 0.03 0.49 0.04 0.00 0.71 0.00 0.00 54.79 56.06 2i2r n ASP 78 Cb 0.17 -0.27 0.22 0.00 -0.02 0.00 0.00 41.12 41.22 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 -1.30 0.75 -3.78 -3.53 -2.24 -1.25 -4.75 114.28 98.18 2i2r n THR 79 Ca 0.00 0.66 -0.28 0.00 -2.27 0.00 0.00 64.05 62.16 2i2r n THR 79 Cb 0.00 -1.66 0.03 0.00 -2.10 0.00 0.00 70.33 66.60 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 -1.77 -5.72 -3.68 -0.78 3.00 -0.16 -4.97 118.16 104.07 2i2r n LYS 80 Ca -0.01 0.64 -0.13 0.00 -0.00 0.00 0.00 58.31 58.82 2i2r n LYS 80 Cb 0.31 -5.55 -0.07 0.00 0.00 0.00 0.00 35.03 29.72 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 -6.48 0.87 0.10 1.64 -1.05 -1.09 -4.92 118.70 107.76 2i2r s GLU 81 Ca 0.62 -0.30 -0.31 0.00 -0.15 0.00 0.00 54.97 54.84 2i2r s GLU 81 Cb -0.30 0.39 -0.06 0.00 -0.44 0.00 0.00 34.13 33.71 2i2r s GLU 81 CO 0.76 -0.29 1.22 0.71 0.95 0.00 0.00 175.26 178.62 2i2r s TYR 82 N -2.17 3.41 -0.07 4.83 1.51 -1.06 -1.18 117.35 122.63 2i2r s TYR 82 Ca -0.07 1.29 0.03 0.00 -1.01 0.00 0.00 57.07 57.31 2i2r s TYR 82 Cb -0.02 -3.45 0.00 0.00 -0.11 0.00 0.00 41.96 38.38 2i2r s TYR 82 CO -0.00 -1.40 -0.18 0.12 -1.11 0.00 0.00 175.55 172.99 2i2r s PHE 83 N 0.80 1.91 -0.08 2.71 5.36 -0.61 0.32 117.98 128.38 2i2r s PHE 83 Ca 0.58 -0.70 0.02 0.00 -0.96 0.00 0.00 56.93 55.87 2i2r s PHE 83 Cb -0.31 -1.32 0.01 0.00 -0.34 0.00 0.00 43.02 41.06 2i2r s PHE 83 CO 0.31 -0.30 -0.13 -0.06 -1.46 0.00 0.00 175.22 173.58 2i2r s PHE 84 N 0.40 1.63 -0.27 10.12 0.08 -0.20 -4.84 117.98 124.90 2i2r s PHE 84 Ca -0.14 -0.66 -0.01 0.00 0.12 0.00 0.00 56.93 56.25 2i2r s PHE 84 Cb -0.16 -1.19 0.16 0.00 -0.57 0.00 0.00 43.02 41.27 2i2r s PHE 84 CO 0.05 -0.34 2.08 -3.47 -0.10 0.00 0.00 175.22 173.44 2i2r n ASP 85 N 3.96 6.27 -5.00 1.36 2.03 -1.26 -1.72 116.55 122.18 2i2r n ASP 85 Ca -0.21 -2.95 -0.20 0.00 0.52 0.00 0.00 54.79 51.95 2i2r n ASP 85 Cb 0.52 -1.09 0.03 0.00 -0.72 0.00 0.00 41.12 39.86 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 -1.46 2.43 0.18 -0.67 1.81 -1.26 -4.93 118.95 115.04 2i2r s ARG 86 Ca 0.28 -1.60 -0.32 0.00 -1.72 0.00 0.00 55.73 52.37 2i2r s ARG 86 Cb 0.21 -2.57 -0.11 0.00 -0.45 0.00 0.00 34.95 32.03 2i2r s ARG 86 CO -0.01 -0.65 1.66 0.34 -0.68 0.00 0.00 175.30 175.96 2i2r s ASP 87 N -4.50 6.48 0.18 0.23 2.15 -1.26 -4.14 116.67 115.80 2i2r s ASP 87 Ca 0.55 2.74 0.07 0.00 0.43 0.00 0.00 52.55 56.35 2i2r s ASP 87 Cb -0.06 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 2i2r s ASP 87 CO 0.34 -0.91 1.40 1.55 -0.17 0.00 0.00 175.17 177.38 2i2r h PRO 88 N 6.96 0.03 0.54 4.34 0.13 -1.95 -3.28 132.00 138.77 2i2r h PRO 88 Ca -0.43 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 2i2r h PRO 88 Cb 1.20 0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.35 2i2r h PRO 88 CO 0.94 0.87 -0.26 1.49 -0.23 0.00 0.00 178.00 180.81 2i2r h GLU 89 N 0.02 -0.70 -0.83 0.86 4.57 -1.93 -3.14 114.58 113.43 2i2r h GLU 89 Ca -0.02 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2i2r h GLU 89 Cb 1.52 0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 30.22 2i2r h GLU 89 CO 0.12 -0.44 0.53 0.28 -1.18 0.00 0.00 179.01 178.32 2i2r h VAL 90 N -0.79 1.22 -1.16 0.32 2.07 -1.99 -0.81 116.25 115.10 2i2r h VAL 90 Ca -0.07 -0.43 0.33 0.00 0.82 0.00 0.00 66.70 67.35 2i2r h VAL 90 Cb 0.58 0.02 -0.06 0.00 -1.52 0.00 0.00 31.29 30.31 2i2r h VAL 90 CO 0.12 0.22 0.82 0.15 0.02 0.00 0.00 177.57 178.90 2i2r h PHE 91 N 1.13 0.11 -0.60 1.57 3.57 -1.60 0.29 116.94 121.41 2i2r h PHE 91 Ca 0.30 0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.93 2i2r h PHE 91 Cb -0.10 -0.03 -0.11 0.00 2.79 0.00 0.00 35.95 38.50 2i2r h PHE 91 CO 0.00 0.01 -0.08 0.00 -2.23 0.00 0.00 178.31 176.01 2i2r h ARG 92 N 0.06 0.05 -0.06 1.11 3.08 -1.10 0.69 114.38 118.21 2i2r h ARG 92 Ca 0.57 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.59 2i2r h ARG 92 Cb 2.14 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 32.18 2i2r h ARG 92 CO -0.06 0.03 -0.05 0.00 -1.07 0.00 0.00 179.97 178.82 2i2r h VAL 94 N -0.29 0.62 -0.15 0.00 2.07 -1.29 0.24 116.25 117.45 2i2r h VAL 94 Ca 0.01 -0.06 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 2i2r h VAL 94 Cb 0.54 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 2i2r h VAL 94 CO 0.01 0.03 0.03 0.25 0.02 0.00 0.00 177.57 177.92 2i2r h LEU 95 N 0.18 0.23 -2.61 2.57 5.85 -0.57 -2.64 115.31 118.32 2i2r h LEU 95 Ca 0.28 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.77 2i2r h LEU 95 Cb 0.43 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 2i2r h LEU 95 CO -0.42 0.42 0.05 0.78 -0.34 0.00 0.00 178.44 178.94 2i2r h ASN 96 N 0.04 0.00 -0.12 1.25 2.35 0.61 0.13 115.58 119.83 2i2r h ASN 96 Ca 0.05 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.68 2i2r h ASN 96 Cb 0.28 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 2i2r h ASN 96 CO 0.00 0.00 -0.31 0.15 -1.65 0.00 0.00 177.43 175.62 2i2r h PHE 97 N 0.00 0.70 0.00 1.19 3.04 -0.20 -2.58 116.94 119.09 2i2r h PHE 97 Ca 0.01 -0.17 -0.06 0.00 3.98 0.00 0.00 57.97 61.73 2i2r h PHE 97 Cb 0.12 -0.16 -0.01 0.00 2.56 0.00 0.00 35.95 38.46 2i2r h PHE 97 CO 0.00 0.84 -0.28 1.88 -2.02 0.00 0.00 178.31 178.74 2i2r h TYR 98 N 0.52 0.00 0.00 0.41 -1.99 -0.68 -3.38 116.97 111.86 2i2r h TYR 98 Ca 0.06 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.79 2i2r h TYR 98 Cb 0.79 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.52 2i2r h TYR 98 CO 0.03 0.28 0.00 0.54 -0.00 0.00 0.00 178.16 179.01 2i2r n ARG 99 N -3.54 0.00 -2.40 4.88 1.74 -0.97 -4.78 116.66 111.58 2i2r n ARG 99 Ca -0.01 0.16 -0.33 0.00 -0.77 0.00 0.00 57.85 56.91 2i2r n ARG 99 Cb 0.43 -0.67 -0.03 0.00 -1.02 0.00 0.00 32.46 31.16 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 -0.36 4.22 0.60 0.55 -4.23 -0.99 -4.95 115.64 110.47 2i2r s THR 100 Ca 0.00 1.16 0.29 0.00 -1.18 0.00 0.00 61.69 61.96 2i2r s THR 100 Cb 0.00 -3.58 0.36 0.00 1.34 0.00 0.00 72.50 70.63 2i2r s THR 100 CO 0.00 -0.52 2.05 1.23 -0.54 0.00 0.00 174.62 176.84 2i2r h GLY 101 N 1.05 0.00 -4.50 3.99 0.00 -1.85 -3.38 103.07 98.37 2i2r h GLY 101 Ca -0.48 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.31 2i2r h GLY 101 CO 0.60 0.00 0.19 0.54 0.00 0.00 0.00 176.54 177.87 2i2r s LYS 102 N -4.57 4.52 -0.28 4.80 1.02 -1.26 -4.88 119.74 119.10 2i2r s LYS 102 Ca -0.04 1.11 -0.14 0.00 0.02 0.00 0.00 55.97 56.92 2i2r s LYS 102 Cb 0.15 -3.37 -0.04 0.00 -0.52 0.00 0.00 37.83 34.05 2i2r s LYS 102 CO 0.52 0.27 0.31 -1.17 -0.92 0.00 0.00 175.35 174.36 2i2r s LEU 103 N -0.02 4.05 -0.04 3.17 2.96 -1.26 -3.95 118.68 123.60 2i2r s LEU 103 Ca 0.40 0.16 -0.02 0.00 -0.22 0.00 0.00 54.13 54.45 2i2r s LEU 103 Cb -0.21 -2.32 -0.04 0.00 0.50 0.00 0.00 46.19 44.13 2i2r s LEU 103 CO 0.24 -0.15 0.08 -1.00 -1.32 0.00 0.00 176.35 174.21 2i2r s HIS 104 N 1.96 3.33 -0.44 5.38 3.76 -1.26 -3.23 115.29 124.79 2i2r s HIS 104 Ca 0.12 0.27 -0.20 0.00 -0.15 0.00 0.00 55.06 55.10 2i2r s HIS 104 Cb -0.16 -1.78 0.03 0.00 1.11 0.00 0.00 32.58 31.77 2i2r s HIS 104 CO 0.10 0.57 0.59 -0.47 -0.85 0.00 0.00 174.74 174.68 2i2r s TYR 105 N -1.13 3.09 -0.53 1.40 5.04 -1.26 -4.96 117.35 119.00 2i2r s TYR 105 Ca 0.20 -0.20 -0.26 0.00 -2.44 0.00 0.00 57.07 54.37 2i2r s TYR 105 Cb -0.12 -3.25 -0.08 0.00 0.35 0.00 0.00 41.96 38.86 2i2r s TYR 105 CO 0.11 -0.85 2.44 -0.35 -1.34 0.00 0.00 175.55 175.56 2i2r n PRO 106 N 6.08 0.96 0.00 4.97 -0.04 -1.26 -4.82 135.00 140.88 2i2r n PRO 106 Ca -0.04 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 2i2r n PRO 106 Cb 0.47 -3.30 0.00 0.00 -0.04 0.00 0.00 33.50 30.63 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 8.97 0.07 0.00 0.54 1.74 -1.26 -1.68 116.66 125.04 2i2r n ARG 107 Ca 0.39 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.47 2i2r n ARG 107 Cb 0.51 -1.32 0.00 0.00 -1.02 0.00 0.00 32.46 30.63 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 0.80 0.00 -1.16 -1.55 0.18 -1.26 -5.10 117.16 109.06 2i2r n TYR 108 Ca 0.00 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.45 2i2r n TYR 108 Cb 0.03 0.09 0.12 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 -1.77 1.72 0.16 -3.48 0.41 -0.67 -4.96 118.70 110.10 2i2r s GLU 109 Ca 0.00 1.73 -0.30 0.00 -0.41 0.00 0.00 54.97 55.99 2i2r s GLU 109 Cb 0.00 -1.79 -0.07 0.00 -1.78 0.00 0.00 34.13 30.49 2i2r s GLU 109 CO 0.00 -2.15 1.08 0.00 -0.49 0.00 0.00 175.26 173.70 2i2r h ILE 111 N 3.80 0.00 -0.77 0.00 1.08 -1.93 -1.72 117.51 117.97 2i2r h ILE 111 Ca -0.44 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.20 2i2r h ILE 111 Cb 1.21 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.85 2i2r h ILE 111 CO 0.73 0.00 0.24 -1.28 -0.69 0.00 0.00 178.15 177.14 2i2r h SER 112 N -0.17 0.12 -0.94 1.72 0.87 -1.94 0.36 113.55 113.57 2i2r h SER 112 Ca 0.04 0.14 0.22 0.00 -1.23 0.00 0.00 61.79 60.96 2i2r h SER 112 Cb 0.28 0.16 -0.07 0.00 -0.44 0.00 0.00 62.40 62.33 2i2r h SER 112 CO -0.30 -0.00 0.62 0.00 -0.53 0.00 0.00 176.83 176.62 2i2r h ALA 113 N 1.61 2.24 0.00 6.23 0.00 -1.71 -2.56 119.26 125.07 2i2r h ALA 113 Ca 0.44 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2i2r h ALA 113 Cb 0.74 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2i2r h ALA 113 CO -0.49 -0.55 -1.35 0.98 0.00 0.00 0.00 179.25 177.85 2i2r n TYR 114 N -4.52 0.00 -0.04 0.00 9.36 -0.00 -3.75 117.16 118.20 2i2r n TYR 114 Ca 0.21 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.29 2i2r n TYR 114 Cb 0.75 -0.23 -0.08 0.00 -0.63 0.00 0.00 39.34 39.15 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 0.27 -0.74 2.98 3.32 -1.04 -2.14 116.42 119.07 2i2r h ASP 115 Ca 0.00 -0.51 0.14 0.00 0.02 0.00 0.00 57.03 56.68 2i2r h ASP 115 Cb 0.54 -0.08 -0.14 0.00 0.22 0.00 0.00 39.33 39.87 2i2r h ASP 115 CO 0.00 0.72 -0.24 0.44 -1.72 0.00 0.00 179.24 178.45 2i2r h ASP 116 N -0.18 -0.86 -0.26 6.45 3.45 -1.62 0.11 116.42 123.50 2i2r h ASP 116 Ca 0.01 0.23 -0.04 0.00 0.43 0.00 0.00 57.03 57.66 2i2r h ASP 116 Cb 0.66 0.52 -0.01 0.00 -0.56 0.00 0.00 39.33 39.93 2i2r h ASP 116 CO 0.03 -0.27 -0.00 -0.33 -1.57 0.00 0.00 179.24 177.10 2i2r h GLU 117 N -0.04 0.46 -0.78 3.56 4.39 -1.64 -2.45 114.58 118.08 2i2r h GLU 117 Ca 0.33 -0.15 0.05 0.00 0.34 0.00 0.00 59.36 59.94 2i2r h GLU 117 Cb 0.56 -0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 29.12 2i2r h GLU 117 CO -0.77 0.63 0.51 -0.07 -1.16 0.00 0.00 179.01 178.15 2i2r h LEU 118 N 0.24 0.78 -0.96 1.33 3.38 -0.46 -1.36 115.31 118.28 2i2r h LEU 118 Ca 0.07 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2i2r h LEU 118 Cb 0.42 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2i2r h LEU 118 CO 0.01 0.52 0.11 0.00 0.09 0.00 0.00 178.44 179.18 2i2r h ALA 119 N 1.56 1.15 0.36 1.53 0.00 -0.58 -1.94 119.26 121.34 2i2r h ALA 119 Ca 0.33 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2i2r h ALA 119 Cb 0.15 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2i2r h ALA 119 CO -0.11 0.57 -0.17 0.35 0.00 0.00 0.00 179.25 179.89 2i2r h PHE 120 N 0.83 -0.45 0.00 0.00 3.57 -0.79 -3.20 116.94 116.91 2i2r h PHE 120 Ca 0.18 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.67 2i2r h PHE 120 Cb 0.34 0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.23 2i2r h PHE 120 CO 0.02 -0.20 0.00 0.66 -2.23 0.00 0.00 178.31 176.56 2i2r n TYR 121 N -5.25 0.00 -0.93 0.41 4.01 -0.93 -4.82 117.16 109.65 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 0.24 -0.22 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 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 0.63 0.55 3.74 2.72 0.00 -0.98 -1.62 105.19 110.24 2i2r n GLY 122 Ca 0.13 -0.84 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 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 5.37 0.06 -0.61 1.09 -0.77 -4.72 121.20 119.63 2i2r s ILE 123 Ca 0.00 0.17 -0.30 0.00 -1.10 0.00 0.00 60.65 59.42 2i2r s ILE 123 Cb 0.00 -3.44 -0.05 0.00 -1.06 0.00 0.00 42.46 37.91 2i2r s ILE 123 CO 0.00 0.46 1.08 -0.76 -0.10 0.00 0.00 174.94 175.62 2i2r s LEU 124 N 0.19 4.40 0.06 2.97 2.01 -1.26 -4.31 118.68 122.75 2i2r s LEU 124 Ca 0.08 1.87 -0.10 0.00 0.01 0.00 0.00 54.13 55.99 2i2r s LEU 124 Cb -0.11 -3.58 -0.01 0.00 0.01 0.00 0.00 46.19 42.50 2i2r s LEU 124 CO -0.01 -0.31 0.52 -2.65 1.01 0.00 0.00 176.35 174.91 2i2r n PRO 125 N 3.57 -0.14 -2.76 1.29 -0.01 -1.26 -2.05 135.00 133.64 2i2r n PRO 125 Ca 0.06 0.51 -0.30 0.00 -0.01 0.00 0.00 63.50 63.77 2i2r n PRO 125 Cb 0.48 -0.76 -0.02 0.00 -0.01 0.00 0.00 33.50 33.20 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 -4.43 3.58 -0.11 -0.52 0.28 -1.26 -4.23 120.64 113.95 2i2r n GLU 126 Ca 0.01 -4.71 0.05 0.00 -0.16 0.00 0.00 57.16 52.35 2i2r n GLU 126 Cb 0.09 -2.28 0.16 0.00 1.43 0.00 0.00 31.44 30.85 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 -0.28 0.30 -1.96 3.84 5.41 -0.87 -4.96 119.36 120.84 2i2r n ILE 127 Ca 0.36 -0.32 -0.42 0.00 1.00 0.00 0.00 62.75 63.38 2i2r n ILE 127 Cb 0.42 0.16 -0.03 0.00 -0.71 0.00 0.00 39.64 39.48 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 -1.70 2.62 1.21 1.39 1.01 -1.26 -4.35 121.20 120.13 2i2r s ILE 128 Ca 0.19 0.48 -0.15 0.00 0.00 0.00 0.00 60.65 61.17 2i2r s ILE 128 Cb 0.10 -3.31 0.30 0.00 0.01 0.00 0.00 42.46 39.56 2i2r s ILE 128 CO 0.13 0.06 1.01 -0.83 0.00 0.00 0.00 174.94 175.31 2i2r s GLY 129 N 0.76 1.52 0.49 6.18 0.00 -1.20 -4.61 107.32 110.46 2i2r s GLY 129 Ca 0.65 -0.34 0.23 0.00 0.00 0.00 0.00 44.72 45.26 2i2r s GLY 129 CO 0.37 0.45 2.02 -0.55 0.00 0.00 0.00 173.10 175.39 2i2r h ASP 130 N -2.75 0.00 -0.08 1.64 5.19 -1.94 -1.82 116.42 116.65 2i2r h ASP 130 Ca -0.58 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 55.77 2i2r h ASP 130 Cb 1.34 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.83 2i2r h ASP 130 CO 0.47 0.16 -0.11 0.00 -3.12 0.00 0.00 179.24 176.64 2i2r n TYR 133 N -2.12 0.22 0.04 0.00 -0.00 -0.71 0.21 117.16 114.81 2i2r n TYR 133 Ca -0.07 0.10 -0.12 0.00 -0.00 0.00 0.00 57.90 57.81 2i2r n TYR 133 Cb 0.59 -0.67 -0.09 0.00 -0.00 0.00 0.00 39.34 39.18 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 -0.15 0.00 -3.48 4.39 -1.77 -2.94 114.58 110.63 2i2r h GLU 134 Ca 0.00 0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.65 2i2r h GLU 134 Cb 0.09 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2i2r h GLU 134 CO 0.00 0.28 -0.30 0.93 -1.16 0.00 0.00 179.01 178.76 2i2r h GLU 135 N -0.64 0.00 -0.05 2.33 4.39 -0.97 -2.79 114.58 116.85 2i2r h GLU 135 Ca -0.02 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.58 2i2r h GLU 135 Cb 0.50 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2i2r h GLU 135 CO 0.03 0.30 -0.43 -0.92 -1.16 0.00 0.00 179.01 176.82 2i2r h TYR 136 N 0.00 0.14 0.31 4.33 5.03 -0.35 -3.13 116.97 123.30 2i2r h TYR 136 Ca -0.00 -0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.25 2i2r h TYR 136 Cb 1.19 -0.03 0.00 0.00 1.55 0.00 0.00 36.73 39.45 2i2r h TYR 136 CO 0.00 0.54 -0.15 0.87 -1.32 0.00 0.00 178.16 178.10 2i2r h LYS 137 N 0.10 -0.40 0.00 1.82 1.79 -1.37 -3.23 116.57 115.28 2i2r h LYS 137 Ca 0.01 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2i2r h LYS 137 Cb 0.81 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.56 2i2r h LYS 137 CO 0.06 -0.27 0.00 -0.25 -1.08 0.00 0.00 179.45 177.91 2i2r n ASP 138 N -3.69 0.00 -2.35 0.86 9.92 -1.07 -1.23 116.55 118.99 2i2r n ASP 138 Ca -0.05 0.23 -0.01 0.00 -0.53 0.00 0.00 54.79 54.43 2i2r n ASP 138 Cb 0.16 -0.25 0.05 0.00 -0.64 0.00 0.00 41.12 40.44 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 -1.25 1.50 0.00 -1.24 1.85 -1.19 -5.10 116.66 111.24 2i2r n ARG 139 Ca 0.01 -3.21 0.00 0.00 -1.00 0.00 0.00 57.85 53.64 2i2r n ARG 139 Cb 0.01 -1.30 0.00 0.00 -1.05 0.00 0.00 32.46 30.12 2i2r n ARG 139 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25