#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gpr s ARG 2003N 0.00 2.38 0.57 -4.13 3.52 -1.26 -4.99 118.95 115.04 3gpr s ARG 2003Ca 0.00 -1.06 -0.16 0.00 -0.13 0.00 0.00 55.73 54.39 3gpr s ARG 2003Cb 0.00 -2.37 -0.05 0.00 -1.56 0.00 0.00 34.95 30.97 3gpr s ARG 2003CO 0.00 0.47 1.03 0.00 -0.81 0.00 0.00 175.30 176.00 3gpr s PRO 2005N -4.14 -1.64 0.90 0.00 0.04 -1.26 -4.87 135.00 124.03 3gpr s PRO 2005Ca 0.62 0.17 -0.13 0.00 0.04 0.00 0.00 61.00 61.69 3gpr s PRO 2005Cb -0.14 -1.53 0.04 0.00 0.04 0.00 0.00 34.50 32.91 3gpr s PRO 2005CO 0.36 -4.04 0.56 2.41 0.04 0.00 0.00 177.00 176.33 3gpr n THR 2006N -5.03 0.45 -1.96 1.26 -1.04 -1.26 -2.41 114.28 104.29 3gpr n THR 2006Ca 0.11 -0.21 -0.04 0.00 -2.04 0.00 0.00 64.05 61.87 3gpr n THR 2006Cb 0.59 -0.72 -0.01 0.00 -1.82 0.00 0.00 70.33 68.37 3gpr n THR 2006CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 3gpr n THR 2007N -3.44 -0.13 -4.04 12.58 5.66 -1.26 -4.90 114.28 118.75 3gpr n THR 2007Ca 0.08 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.77 3gpr n THR 2007Cb 0.53 -0.56 -0.16 0.00 -1.55 0.00 0.00 70.33 68.59 3gpr n THR 2007CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 175.07 172.28 3gpr s TRP 2008N -1.90 2.37 1.15 1.09 0.52 -1.01 -4.86 118.94 116.30 3gpr s TRP 2008Ca 0.00 -1.41 -0.13 0.00 0.02 0.00 0.00 56.10 54.58 3gpr s TRP 2008Cb 0.00 -1.68 0.27 0.00 -1.15 0.00 0.00 33.47 30.92 3gpr s TRP 2008CO 0.00 -0.72 1.04 -1.12 0.02 0.00 0.00 176.95 176.17 3gpr s SER 2009N 1.42 1.14 -0.23 2.95 0.01 0.25 -4.69 113.70 114.56 3gpr s SER 2009Ca 0.03 1.49 -0.20 0.00 1.31 0.00 0.00 55.95 58.58 3gpr s SER 2009Cb -0.14 -2.26 0.06 0.00 0.21 0.00 0.00 66.02 63.90 3gpr s SER 2009CO -0.11 -4.10 0.61 0.00 0.41 0.00 0.00 173.24 170.06 3gpr s ALA 2010N -2.52 -1.52 -0.07 1.44 0.00 -1.26 -2.75 121.76 115.08 3gpr s ALA 2010Ca 0.68 1.77 -0.09 0.00 0.00 0.00 0.00 51.96 54.32 3gpr s ALA 2010Cb -0.24 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.81 3gpr s ALA 2010CO 0.64 -0.29 -0.18 -1.13 0.00 0.00 0.00 175.76 174.79 3gpr n SER 2011N 2.95 1.26 0.00 0.00 3.41 -1.13 -5.03 113.62 115.09 3gpr n SER 2011Ca -0.15 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 3gpr n SER 2011Cb 0.56 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3gpr n SER 2011CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3gpr n LYS 2012N -3.75 0.00 0.00 4.33 4.81 -1.26 -4.98 118.16 117.31 3gpr n LYS 2012Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 3gpr n LYS 2012Cb 0.27 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.32 3gpr n LYS 2012CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3gpr n LEU 2013N 0.00 0.00 -4.47 3.14 4.77 -1.26 -4.97 117.00 114.21 3gpr n LEU 2013Ca 0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 3gpr n LEU 2013Cb 0.00 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 40.99 3gpr n LEU 2013CO 0.00 0.00 -0.35 -0.31 -1.33 0.00 0.00 177.39 175.40 3gpr s TYR 2014N -0.43 2.08 0.12 -1.77 1.51 -1.26 0.08 117.35 117.69 3gpr s TYR 2014Ca 0.00 -0.69 0.10 0.00 -1.01 0.00 0.00 57.07 55.47 3gpr s TYR 2014Cb 0.00 -1.24 -0.04 0.00 -0.11 0.00 0.00 41.96 40.57 3gpr s TYR 2014CO 0.00 0.32 -0.25 0.00 -1.11 0.00 0.00 175.55 174.51 3gpr s TYR 2016N -1.08 0.82 -0.30 0.00 1.51 -1.11 -3.78 117.35 113.42 3gpr s TYR 2016Ca 0.11 -0.47 -0.16 0.00 -1.01 0.00 0.00 57.07 55.54 3gpr s TYR 2016Cb -0.10 -0.48 0.17 0.00 -0.11 0.00 0.00 41.96 41.44 3gpr s TYR 2016CO 0.05 -0.04 1.06 0.21 -1.11 0.00 0.00 175.55 175.72 3gpr s LYS 2017N -1.55 0.26 0.81 -0.62 2.20 -1.26 -0.58 119.74 119.00 3gpr s LYS 2017Ca -0.07 0.53 -0.11 0.00 -0.36 0.00 0.00 55.97 55.96 3gpr s LYS 2017Cb -0.10 0.19 0.10 0.00 -1.51 0.00 0.00 37.83 36.52 3gpr s LYS 2017CO 0.01 -0.07 1.15 -1.25 -0.36 0.00 0.00 175.35 174.83 3gpr s PRO 2018N 1.77 1.72 -0.15 4.03 0.04 -1.26 -3.22 135.00 137.92 3gpr s PRO 2018Ca -0.06 -0.18 -0.05 0.00 0.04 0.00 0.00 61.00 60.75 3gpr s PRO 2018Cb -0.04 -2.01 0.07 0.00 0.04 0.00 0.00 34.50 32.56 3gpr s PRO 2018CO -0.15 -1.66 0.31 -0.06 0.04 0.00 0.00 177.00 175.48 3gpr s PHE 2019N -3.53 -0.54 0.16 0.56 0.08 -1.04 -5.00 117.98 108.68 3gpr s PHE 2019Ca 0.64 1.11 -0.09 0.00 0.12 0.00 0.00 56.93 58.72 3gpr s PHE 2019Cb -0.09 0.06 0.03 0.00 -0.57 0.00 0.00 43.02 42.44 3gpr s PHE 2019CO 0.48 -0.41 1.53 0.87 -0.10 0.00 0.00 175.22 177.59 3gpr h LYS 2020N 8.25 0.91 -5.65 0.44 1.79 -1.94 -3.21 116.57 117.16 3gpr h LYS 2020Ca -0.15 -0.43 -0.62 0.00 -2.18 0.00 0.00 60.65 57.27 3gpr h LYS 2020Cb 1.11 -0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.71 3gpr h LYS 2020CO 0.14 1.09 1.52 -0.85 -1.08 0.00 0.00 179.45 180.27 3gpr n GLU 2021N -4.08 0.45 -1.68 3.15 0.28 -1.26 -4.44 120.64 113.06 3gpr n GLU 2021Ca -0.01 0.09 -0.42 0.00 -0.16 0.00 0.00 57.16 56.65 3gpr n GLU 2021Cb 0.50 -2.03 -0.03 0.00 1.43 0.00 0.00 31.44 31.31 3gpr n GLU 2021CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3gpr n LYS 2022N 8.20 2.81 -3.77 3.44 5.02 -1.26 -4.62 118.16 127.98 3gpr n LYS 2022Ca 0.52 1.03 -0.13 0.00 -2.02 0.00 0.00 58.31 57.71 3gpr n LYS 2022Cb 0.13 -2.95 -0.10 0.00 -0.02 0.00 0.00 35.03 32.10 3gpr n LYS 2022CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3gpr s LYS 2023N 3.52 0.46 0.83 1.97 1.02 0.03 -4.63 119.74 122.94 3gpr s LYS 2023Ca 0.85 0.23 -0.13 0.00 0.02 0.00 0.00 55.97 56.95 3gpr s LYS 2023Cb -0.47 0.21 0.09 0.00 -0.52 0.00 0.00 37.83 37.14 3gpr s LYS 2023CO 0.40 -0.08 1.13 0.25 -0.92 0.00 0.00 175.35 176.13 3gpr n THR 2024N 2.40 1.54 -0.35 2.17 -2.24 -1.26 -2.78 114.28 113.76 3gpr n THR 2024Ca -0.16 -0.17 -0.03 0.00 -2.27 0.00 0.00 64.05 61.43 3gpr n THR 2024Cb 0.57 -1.12 0.11 0.00 -2.10 0.00 0.00 70.33 67.79 3gpr n THR 2024CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 3gpr h TRP 2025N -1.12 1.24 -0.68 4.78 7.01 -1.78 0.16 115.95 125.57 3gpr h TRP 2025Ca -0.45 0.00 0.04 0.00 2.11 0.00 0.00 58.89 60.59 3gpr h TRP 2025Cb 1.29 -0.41 -0.05 0.00 -2.10 0.00 0.00 29.16 27.90 3gpr h TRP 2025CO 0.46 0.81 0.41 0.97 -2.79 0.00 0.00 178.44 178.30 3gpr h ILE 2026N 1.31 1.05 0.00 2.65 -0.00 -1.91 0.27 117.51 120.88 3gpr h ILE 2026Ca 0.34 -0.27 -0.23 0.00 -0.00 0.00 0.00 64.86 64.70 3gpr h ILE 2026Cb -0.08 0.20 -0.04 0.00 -0.00 0.00 0.00 36.82 36.90 3gpr h ILE 2026CO -0.07 0.14 -1.24 1.05 -0.00 0.00 0.00 178.15 178.04 3gpr h GLU 2027N 0.78 0.00 0.00 2.19 4.11 -1.85 -3.29 114.58 116.53 3gpr h GLU 2027Ca 0.28 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.61 3gpr h GLU 2027Cb 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3gpr h GLU 2027CO -0.13 0.78 -0.50 0.00 0.07 0.00 0.00 179.01 179.22 3gpr h ALA 2028N 1.04 0.96 0.00 1.06 0.00 -0.37 -2.29 119.26 119.65 3gpr h ALA 2028Ca -0.11 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.29 3gpr h ALA 2028Cb 1.83 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 3gpr h ALA 2028CO 0.11 0.63 -0.26 1.49 0.00 0.00 0.00 179.25 181.21 3gpr h GLU 2029N 0.00 0.00 -0.00 0.00 4.57 -0.54 -3.12 114.58 115.49 3gpr h GLU 2029Ca -0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 3gpr h GLU 2029Cb 1.03 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.62 3gpr h GLU 2029CO 0.07 0.26 -0.89 0.54 -1.18 0.00 0.00 179.01 177.81 3gpr n ARG 2030N -3.39 0.60 -0.06 1.92 5.12 -1.11 -4.37 116.66 115.36 3gpr n ARG 2030Ca 0.00 -0.07 -0.14 0.00 -1.93 0.00 0.00 57.85 55.71 3gpr n ARG 2030Cb 0.46 -1.42 -0.06 0.00 -1.16 0.00 0.00 32.46 30.28 3gpr n ARG 2030CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 3gpr h PHE 2031N 0.17 0.73 -0.73 -1.55 -0.00 -1.35 -3.10 116.94 111.11 3gpr h PHE 2031Ca 0.00 -0.26 0.07 0.00 -0.00 0.00 0.00 57.97 57.78 3gpr h PHE 2031Cb 0.48 -0.14 -0.05 0.00 -0.00 0.00 0.00 35.95 36.25 3gpr h PHE 2031CO 0.00 1.00 0.48 0.00 -0.00 0.00 0.00 178.31 179.79 3gpr h ALA 2033N 1.61 1.05 0.00 0.00 0.00 -0.24 0.17 119.26 121.85 3gpr h ALA 2033Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3gpr h ALA 2033Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3gpr h ALA 2033CO -0.11 -0.05 -0.98 0.87 0.00 0.00 0.00 179.25 178.98 3gpr h LYS 2034N 0.00 0.00 -0.06 0.00 1.57 -1.03 -3.37 116.57 113.69 3gpr h LYS 2034Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3gpr h LYS 2034Cb 0.11 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 3gpr h LYS 2034CO 0.00 0.00 -0.01 1.96 -0.57 0.00 0.00 179.45 180.83 3gpr h GLN 2035N 0.00 0.12 0.00 3.15 1.08 -0.60 -3.48 115.11 115.37 3gpr h GLN 2035Ca 0.00 -0.04 0.09 0.00 -1.45 0.00 0.00 58.65 57.24 3gpr h GLN 2035Cb 0.98 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.39 3gpr h GLN 2035CO 0.00 0.45 0.42 0.00 -0.95 0.00 0.00 178.83 178.75 3gpr n ALA 2036N -2.31 -2.05 -1.77 3.87 0.00 -1.20 -5.09 120.51 111.96 3gpr n ALA 2036Ca -0.07 -0.92 -0.40 0.00 0.00 0.00 0.00 53.44 52.04 3gpr n ALA 2036Cb 0.22 0.59 0.00 0.00 0.00 0.00 0.00 19.45 20.26 3gpr n ALA 2036CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3gpr s GLU 2037N -2.05 4.01 -1.45 0.00 2.12 -1.26 -2.26 118.70 117.80 3gpr s GLU 2037Ca 0.18 2.45 -0.10 0.00 0.36 0.00 0.00 54.97 57.86 3gpr s GLU 2037Cb -0.03 -2.88 0.06 0.00 0.26 0.00 0.00 34.13 31.54 3gpr s GLU 2037CO 0.06 -0.57 0.76 0.09 -0.54 0.00 0.00 175.26 175.06 3gpr n ASN 2038N 0.29 -4.97 -4.56 -1.70 3.02 -1.26 -4.62 115.26 101.45 3gpr n ASN 2038Ca 0.02 -0.51 -0.41 0.00 -0.03 0.00 0.00 54.58 53.65 3gpr n ASN 2038Cb 0.41 -4.01 -0.03 0.00 -0.61 0.00 0.00 39.78 35.53 3gpr n ASN 2038CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3gpr s GLY 2039N -2.97 1.19 0.23 7.41 0.00 -0.96 -4.50 107.32 107.72 3gpr s GLY 2039Ca 0.49 -2.09 0.11 0.00 0.00 0.00 0.00 44.72 43.23 3gpr s GLY 2039CO 0.60 2.68 -0.17 0.30 0.00 0.00 0.00 173.10 176.51 3gpr s HIS 2040N 5.12 2.41 0.99 1.90 3.76 -1.02 0.12 115.29 128.58 3gpr s HIS 2040Ca 0.44 -0.30 -0.13 0.00 -0.15 0.00 0.00 55.06 54.91 3gpr s HIS 2040Cb -0.02 -1.12 0.08 0.00 1.11 0.00 0.00 32.58 32.64 3gpr s HIS 2040CO -0.05 0.60 0.49 1.28 -0.85 0.00 0.00 174.74 176.21 3gpr n LEU 2041N -0.25 -0.12 -4.55 0.89 4.77 -1.26 -1.64 117.00 114.84 3gpr n LEU 2041Ca -0.09 0.23 -0.40 0.00 -0.03 0.00 0.00 56.01 55.72 3gpr n LEU 2041Cb 0.58 -1.21 0.02 0.00 -2.33 0.00 0.00 43.42 40.48 3gpr n LEU 2041CO 0.35 -3.28 0.37 0.55 -1.33 0.00 0.00 177.39 174.06 3gpr n VAL 2042N -3.95 2.47 -3.37 4.08 3.14 0.00 -4.56 118.33 116.14 3gpr n VAL 2042Ca 0.06 -0.50 -0.18 0.00 -2.96 0.00 0.00 64.34 60.76 3gpr n VAL 2042Cb 0.55 -0.93 -0.08 0.00 -1.06 0.00 0.00 33.84 32.31 3gpr n VAL 2042CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 3gpr s SER 2043N -0.94 1.35 0.09 6.55 0.15 -1.26 -1.99 113.70 117.65 3gpr s SER 2043Ca 0.66 -1.51 -0.33 0.00 0.70 0.00 0.00 55.95 55.48 3gpr s SER 2043Cb -0.53 0.49 -0.12 0.00 -1.71 0.00 0.00 66.02 64.16 3gpr s SER 2043CO 0.55 -0.28 1.78 -0.38 1.20 0.00 0.00 173.24 176.11 3gpr n ILE 2044N 4.38 0.32 -0.08 6.45 2.08 -1.26 -4.92 119.36 126.34 3gpr n ILE 2044Ca 0.09 -0.06 -0.08 0.00 0.56 0.00 0.00 62.75 63.27 3gpr n ILE 2044Cb 0.45 -1.93 -0.04 0.00 -0.75 0.00 0.00 39.64 37.38 3gpr n ILE 2044CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 3gpr h GLY 2045N 8.05 0.00 0.00 7.39 0.00 -2.00 -3.50 103.07 113.01 3gpr h GLY 2045Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3gpr h GLY 2045CO 0.93 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.91 3gpr n SER 2046N -4.59 0.46 -0.03 0.19 7.64 -1.26 -5.04 113.62 110.98 3gpr n SER 2046Ca -0.12 -0.04 -0.17 0.00 1.01 0.00 0.00 58.87 59.56 3gpr n SER 2046Cb 0.33 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.47 3gpr n SER 2046CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3gpr h ALA 2047N 1.00 0.35 0.20 -0.43 0.00 -1.99 -2.49 119.26 115.90 3gpr h ALA 2047Ca 0.00 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 3gpr h ALA 2047Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3gpr h ALA 2047CO 0.00 0.69 -0.10 0.00 0.00 0.00 0.00 179.25 179.84 3gpr h ALA 2048N 0.59 -0.27 0.00 0.00 0.00 -2.00 -1.66 119.26 115.92 3gpr h ALA 2048Ca -0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3gpr h ALA 2048Cb 1.35 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 3gpr h ALA 2048CO 0.15 -0.62 -0.10 1.49 0.00 0.00 0.00 179.25 180.17 3gpr h GLU 2049N -0.33 0.00 0.21 0.00 4.81 -1.97 -2.72 114.58 114.59 3gpr h GLU 2049Ca -0.03 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 3gpr h GLU 2049Cb 0.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.63 3gpr h GLU 2049CO 0.05 0.10 -0.10 0.00 -0.73 0.00 0.00 179.01 178.32 3gpr h ALA 2050N 1.90 -0.29 0.00 2.92 0.00 -0.95 -2.97 119.26 119.87 3gpr h ALA 2050Ca -0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 3gpr h ALA 2050Cb 0.30 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3gpr h ALA 2050CO 0.01 -0.37 -0.01 -0.44 0.00 0.00 0.00 179.25 178.45 3gpr h ASP 2051N -0.88 0.00 -0.01 0.00 3.32 -1.22 -2.46 116.42 115.17 3gpr h ASP 2051Ca -0.03 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 3gpr h ASP 2051Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 3gpr h ASP 2051CO 0.05 0.01 -0.03 0.15 -1.72 0.00 0.00 179.24 177.69 3gpr h PHE 2052N 0.00 0.05 -0.99 4.55 3.57 -1.47 -3.22 116.94 119.43 3gpr h PHE 2052Ca -0.00 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.49 3gpr h PHE 2052Cb 0.05 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.73 3gpr h PHE 2052CO 0.00 0.64 0.66 1.25 -2.23 0.00 0.00 178.31 178.63 3gpr h LEU 2053N -0.54 1.13 -2.29 0.59 5.85 -1.28 -1.81 115.31 116.96 3gpr h LEU 2053Ca -0.00 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.71 3gpr h LEU 2053Cb 0.64 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 3gpr h LEU 2053CO 0.01 0.82 0.05 0.44 -0.34 0.00 0.00 178.44 179.42 3gpr h ASP 2054N 1.34 0.00 0.74 1.25 3.32 -1.57 -0.25 116.42 121.25 3gpr h ASP 2054Ca 0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.42 3gpr h ASP 2054Cb -0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.40 3gpr h ASP 2054CO -0.08 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.62 3gpr n LEU 2055N -4.03 0.62 -0.06 1.55 4.77 -0.68 -3.02 117.00 116.15 3gpr n LEU 2055Ca -0.02 0.65 -0.05 0.00 -0.03 0.00 0.00 56.01 56.56 3gpr n LEU 2055Cb 0.15 -0.56 -0.10 0.00 -2.33 0.00 0.00 43.42 40.58 3gpr n LEU 2055CO 0.29 -0.52 -0.89 0.52 -1.33 0.00 0.00 177.39 175.46 3gpr n VAL 2056N -2.19 0.80 0.38 4.08 0.31 -0.17 -4.19 118.33 117.35 3gpr n VAL 2056Ca 0.02 -0.51 0.13 0.00 -0.01 0.00 0.00 64.34 63.97 3gpr n VAL 2056Cb 0.23 -0.64 0.52 0.00 -0.91 0.00 0.00 33.84 33.04 3gpr n VAL 2056CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 3gpr h ILE 2057N 0.00 0.00 0.00 2.52 2.04 -1.30 -1.97 117.51 118.80 3gpr h ILE 2057Ca -0.32 -0.26 -0.12 0.00 1.00 0.00 0.00 64.86 65.17 3gpr h ILE 2057Cb 1.70 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.78 3gpr h ILE 2057CO 0.02 0.00 -2.04 0.52 0.00 0.00 0.00 178.15 176.65 3gpr n VAL 2058N -2.34 0.49 0.05 1.67 0.31 -1.17 -3.72 118.33 113.62 3gpr n VAL 2058Ca 0.02 -0.62 -0.00 0.00 -0.01 0.00 0.00 64.34 63.73 3gpr n VAL 2058Cb 0.23 -0.19 -0.07 0.00 -0.91 0.00 0.00 33.84 32.90 3gpr n VAL 2058CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3gpr h VAL 2059N 0.00 0.60 0.00 2.52 2.07 -1.66 -2.42 116.25 117.36 3gpr h VAL 2059Ca -0.17 -2.10 0.00 0.00 0.82 0.00 0.00 66.70 65.25 3gpr h VAL 2059Cb 1.40 2.13 0.00 0.00 -1.52 0.00 0.00 31.29 33.29 3gpr h VAL 2059CO 0.01 0.34 -0.86 0.59 0.02 0.00 0.00 177.57 177.67 3gpr n ASN 2060N -2.96 0.70 -0.01 0.57 4.13 -0.77 -4.62 115.26 112.31 3gpr n ASN 2060Ca -0.08 -0.51 -0.05 0.00 1.68 0.00 0.00 54.58 55.62 3gpr n ASN 2060Cb 0.84 0.71 -0.02 0.00 -1.54 0.00 0.00 39.78 39.77 3gpr n ASN 2060CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 3gpr n PHE 2061N -1.64 0.00 -3.08 3.10 3.01 -1.24 -5.04 117.46 112.56 3gpr n PHE 2061Ca 0.04 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.59 3gpr n PHE 2061Cb 0.37 -0.16 -0.02 0.00 -0.01 0.00 0.00 39.48 39.65 3gpr n PHE 2061CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 3gpr n ASP 2062N -3.36 -6.83 0.00 4.37 2.03 -0.91 -4.76 116.55 107.08 3gpr n ASP 2062Ca -0.08 0.75 0.00 0.00 0.52 0.00 0.00 54.79 55.98 3gpr n ASP 2062Cb 0.44 -2.11 0.00 0.00 -0.72 0.00 0.00 41.12 38.73 3gpr n ASP 2062CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 3gpr n LYS 2063N -2.98 0.00 -2.69 -0.67 0.00 -1.26 -4.11 118.16 106.45 3gpr n LYS 2063Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 58.31 58.29 3gpr n LYS 2063Cb 0.32 -1.77 0.00 0.00 0.00 0.00 0.00 35.03 33.58 3gpr n LYS 2063CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 3gpr n GLN 2064N -0.89 -1.32 -1.91 1.64 -0.06 -1.26 -4.99 117.38 108.59 3gpr n GLN 2064Ca 0.00 1.45 -0.01 0.00 -2.00 0.00 0.00 57.00 56.44 3gpr n GLN 2064Cb 0.00 -4.88 0.02 0.00 -4.06 0.00 0.00 30.24 21.32 3gpr n GLN 2064CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 3gpr n ARG 2065N -1.22 0.25 -1.94 3.69 3.00 -1.26 -4.98 116.66 114.20 3gpr n ARG 2065Ca 0.03 -0.33 -0.29 0.00 -0.00 0.00 0.00 57.85 57.25 3gpr n ARG 2065Cb 0.46 0.06 0.06 0.00 0.00 0.00 0.00 32.46 33.04 3gpr n ARG 2065CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.63 179.15 3gpr s TYR 2066N 0.03 3.20 -0.47 -0.14 -0.85 -1.26 -4.98 117.35 112.87 3gpr s TYR 2066Ca 0.02 0.91 0.04 0.00 -0.52 0.00 0.00 57.07 57.52 3gpr s TYR 2066Cb 0.08 -3.16 0.20 0.00 0.38 0.00 0.00 41.96 39.45 3gpr s TYR 2066CO -0.02 -1.32 0.81 0.50 -1.52 0.00 0.00 175.55 174.00 3gpr s ARG 2067N -5.38 0.86 0.53 -3.49 3.52 -1.24 -4.02 118.95 109.72 3gpr s ARG 2067Ca 0.59 -0.83 0.09 0.00 -0.13 0.00 0.00 55.73 55.44 3gpr s ARG 2067Cb -0.11 -0.03 0.06 0.00 -1.56 0.00 0.00 34.95 33.31 3gpr s ARG 2067CO 0.50 -1.07 0.69 0.00 -0.81 0.00 0.00 175.30 174.62 3gpr s ALA 2068N 0.94 4.62 0.21 6.12 0.00 -0.95 -3.51 121.76 129.19 3gpr s ALA 2068Ca 0.28 -1.96 0.08 0.00 0.00 0.00 0.00 51.96 50.36 3gpr s ALA 2068Cb 0.03 -1.44 -0.04 0.00 0.00 0.00 0.00 23.12 21.67 3gpr s ALA 2068CO -0.06 -0.66 0.03 -1.58 0.00 0.00 0.00 175.76 173.48 3gpr s TRP 2069N -2.58 2.85 0.20 0.00 0.52 0.52 -0.66 118.94 119.78 3gpr s TRP 2069Ca 0.58 -0.15 0.06 0.00 0.02 0.00 0.00 56.10 56.60 3gpr s TRP 2069Cb -0.07 -1.34 -0.05 0.00 -1.15 0.00 0.00 33.47 30.87 3gpr s TRP 2069CO 0.36 0.55 -0.10 0.95 0.02 0.00 0.00 176.95 178.73 3gpr s THR 2070N -1.93 1.41 -1.35 2.01 -4.23 -1.25 -3.49 115.64 106.80 3gpr s THR 2070Ca 0.29 -2.12 -0.13 0.00 -1.18 0.00 0.00 61.69 58.56 3gpr s THR 2070Cb -0.08 -2.08 -0.04 0.00 1.34 0.00 0.00 72.50 71.64 3gpr s THR 2070CO 0.20 -0.57 2.43 0.61 -0.54 0.00 0.00 174.62 176.75 3gpr n GLY 2071N -0.35 3.94 2.65 3.99 0.00 -0.84 -4.79 105.19 109.79 3gpr n GLY 2071Ca -0.08 -1.42 -0.23 0.00 0.00 0.00 0.00 46.02 44.29 3gpr n GLY 2071CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gpr s LEU 2072N 1.07 0.23 0.00 0.99 2.96 -1.26 -4.93 118.68 117.74 3gpr s LEU 2072Ca 0.55 -0.36 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 3gpr s LEU 2072Cb 0.15 -0.14 0.00 0.00 0.50 0.00 0.00 46.19 46.70 3gpr s LEU 2072CO -0.04 -0.32 0.00 0.35 -1.32 0.00 0.00 176.35 175.02 3gpr n THR 2073N 5.29 0.00 -4.62 3.68 -2.24 -1.26 -2.88 114.28 112.25 3gpr n THR 2073Ca -0.06 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.43 3gpr n THR 2073Cb 0.49 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.59 3gpr n THR 2073CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3gpr s GLU 2074N -0.45 1.63 0.00 -0.78 2.02 -1.26 -5.00 118.70 114.87 3gpr s GLU 2074Ca 0.00 -1.22 0.00 0.00 0.02 0.00 0.00 54.97 53.77 3gpr s GLU 2074Cb 0.00 -1.96 0.00 0.00 0.10 0.00 0.00 34.13 32.27 3gpr s GLU 2074CO 0.00 0.48 0.00 0.54 0.02 0.00 0.00 175.26 176.30 3gpr n ARG 2075N 1.30 0.18 -0.48 1.61 1.74 -1.26 -4.93 116.66 114.83 3gpr n ARG 2075Ca -0.17 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 56.99 3gpr n ARG 2075Cb 0.52 0.00 0.28 0.00 -1.02 0.00 0.00 32.46 32.25 3gpr n ARG 2075CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3gpr n ASN 2076N -1.21 4.12 -2.86 0.55 3.02 -1.26 -4.89 115.26 112.74 3gpr n ASN 2076Ca 0.00 -2.58 -0.06 0.00 -0.03 0.00 0.00 54.58 51.91 3gpr n ASN 2076Cb 0.00 -0.49 0.01 0.00 -0.61 0.00 0.00 39.78 38.68 3gpr n ASN 2076CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3gpr n LEU 2077N 0.38 -7.57 -4.66 3.41 4.77 -1.26 -3.39 117.00 108.68 3gpr n LEU 2077Ca 0.21 0.40 -0.43 0.00 -0.03 0.00 0.00 56.01 56.17 3gpr n LEU 2077Cb 0.81 -3.33 -0.02 0.00 -2.33 0.00 0.00 43.42 38.55 3gpr n LEU 2077CO 0.18 -2.05 1.14 -0.75 -1.33 0.00 0.00 177.39 174.58 3gpr s LYS 2078N -2.66 4.23 1.34 3.23 2.20 -1.26 -3.36 119.74 123.46 3gpr s LYS 2078Ca 0.19 1.79 -0.18 0.00 -0.36 0.00 0.00 55.97 57.41 3gpr s LYS 2078Cb -0.05 -3.80 0.34 0.00 -1.51 0.00 0.00 37.83 32.81 3gpr s LYS 2078CO 0.74 -0.72 0.95 -1.58 -0.36 0.00 0.00 175.35 174.38 3gpr s TRP 2079N 3.53 0.18 0.22 4.03 0.52 -1.15 -4.92 118.94 121.34 3gpr s TRP 2079Ca 0.59 0.87 -0.03 0.00 0.02 0.00 0.00 56.10 57.56 3gpr s TRP 2079Cb -0.25 -2.93 0.21 0.00 -1.15 0.00 0.00 33.47 29.35 3gpr s TRP 2079CO 0.19 -4.65 1.61 1.79 0.02 0.00 0.00 176.95 175.90 3gpr h THR 2080N -3.19 1.28 -0.02 2.01 1.35 -1.95 -3.24 112.91 109.15 3gpr h THR 2080Ca -0.53 -1.46 -0.01 0.00 -0.55 0.00 0.00 66.41 63.85 3gpr h THR 2080Cb 1.34 1.41 -0.00 0.00 -1.73 0.00 0.00 68.15 69.17 3gpr h THR 2080CO 0.38 0.47 -0.03 -0.55 -0.25 0.00 0.00 175.52 175.54 3gpr h ASN 2081N 0.55 0.06 0.00 5.36 -1.07 -2.03 -3.49 115.58 114.97 3gpr h ASN 2081Ca 0.06 -0.53 0.00 0.00 0.07 0.00 0.00 56.30 55.90 3gpr h ASN 2081Cb 0.83 -0.02 0.00 0.00 -2.07 0.00 0.00 38.32 37.06 3gpr h ASN 2081CO 0.07 0.58 0.00 0.61 0.07 0.00 0.00 177.43 178.76 3gpr n GLY 2082N 0.35 0.43 3.64 9.14 0.00 -1.23 -5.13 105.19 112.39 3gpr n GLY 2082Ca -0.08 0.15 -0.45 0.00 0.00 0.00 0.00 46.02 45.63 3gpr n GLY 2082CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gpr n ALA 2083N 0.00 0.43 -1.16 4.61 0.00 -1.26 -4.27 120.51 118.86 3gpr n ALA 2083Ca 0.00 0.41 -0.12 0.00 0.00 0.00 0.00 53.44 53.73 3gpr n ALA 2083Cb 0.00 -2.16 0.15 0.00 0.00 0.00 0.00 19.45 17.44 3gpr n ALA 2083CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3gpr n SER 2084N 1.64 -1.28 -4.52 0.00 7.64 -1.26 -2.96 113.62 112.88 3gpr n SER 2084Ca 0.10 -0.99 -0.43 0.00 1.01 0.00 0.00 58.87 58.56 3gpr n SER 2084Cb 0.31 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 3gpr n SER 2084CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3gpr n VAL 2085N -3.75 3.99 0.38 0.44 0.31 -1.21 -4.68 118.33 113.79 3gpr n VAL 2085Ca 0.09 -4.18 0.13 0.00 -0.01 0.00 0.00 64.34 60.38 3gpr n VAL 2085Cb 0.36 -2.38 0.30 0.00 -0.91 0.00 0.00 33.84 31.21 3gpr n VAL 2085CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 3gpr h SER 2086N 7.41 0.00 -3.29 4.52 4.64 -1.91 -3.42 113.55 121.51 3gpr h SER 2086Ca 0.43 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 61.10 3gpr h SER 2086Cb 0.86 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.59 3gpr h SER 2086CO 1.44 0.00 -0.84 -0.47 -0.87 0.00 0.00 176.83 176.10 3gpr s TYR 2087N -3.21 2.73 -0.17 4.77 6.04 -1.26 -5.10 117.35 121.15 3gpr s TYR 2087Ca 0.08 -1.71 0.01 0.00 0.04 0.00 0.00 57.07 55.48 3gpr s TYR 2087Cb 0.08 -1.83 0.01 0.00 -1.04 0.00 0.00 41.96 39.18 3gpr s TYR 2087CO 0.62 -0.79 -0.18 -2.00 -1.54 0.00 0.00 175.55 171.67 3gpr s GLU 2088N 1.30 3.08 -0.02 4.97 -6.30 -1.26 -4.95 118.70 115.52 3gpr s GLU 2088Ca 0.01 -0.79 0.10 0.00 -2.50 0.00 0.00 54.97 51.79 3gpr s GLU 2088Cb -0.15 -2.61 0.18 0.00 0.00 0.00 0.00 34.13 31.55 3gpr s GLU 2088CO -0.10 -0.14 1.08 -1.71 0.02 0.00 0.00 175.26 174.41 3gpr n ASN 2089N 4.45 0.60 -4.68 -1.70 4.05 -1.26 -5.08 115.26 111.64 3gpr n ASN 2089Ca -0.20 -2.19 -0.34 0.00 0.45 0.00 0.00 54.58 52.30 3gpr n ASN 2089Cb 0.51 -0.27 0.13 0.00 1.23 0.00 0.00 39.78 41.38 3gpr n ASN 2089CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 3gpr n LEU 2090N -0.03 4.25 0.32 1.20 4.77 -1.26 -4.84 117.00 121.40 3gpr n LEU 2090Ca 0.04 0.58 0.20 0.00 -0.03 0.00 0.00 56.01 56.81 3gpr n LEU 2090Cb 0.83 -1.50 1.07 0.00 -2.33 0.00 0.00 43.42 41.49 3gpr n LEU 2090CO -0.01 -1.77 1.14 0.22 -1.33 0.00 0.00 177.39 175.63 3gpr h TYR 2091N -0.91 0.00 -3.15 -1.77 -0.00 -2.06 -3.37 116.97 105.71 3gpr h TYR 2091Ca -0.46 0.00 -0.44 0.00 -0.00 0.00 0.00 58.73 57.82 3gpr h TYR 2091Cb 1.30 0.00 -0.40 0.00 -0.00 0.00 0.00 36.73 37.63 3gpr h TYR 2091CO 0.46 0.01 -0.75 -1.21 -0.00 0.00 0.00 178.16 176.67 3gpr s GLU 2092N -4.16 0.13 -0.01 1.82 2.02 -1.26 -5.12 118.70 112.12 3gpr s GLU 2092Ca -0.04 -0.01 -0.39 0.00 0.02 0.00 0.00 54.97 54.56 3gpr s GLU 2092Cb 0.13 -1.52 -0.18 0.00 0.10 0.00 0.00 34.13 32.66 3gpr s GLU 2092CO 0.46 -0.57 1.33 -2.30 0.02 0.00 0.00 175.26 174.20 3gpr n PRO 2093N 5.25 0.77 -2.83 0.39 -0.02 -1.26 -4.91 135.00 132.40 3gpr n PRO 2093Ca -0.06 0.28 -0.42 0.00 -2.02 0.00 0.00 63.50 61.28 3gpr n PRO 2093Cb 0.49 -1.88 -0.04 0.00 -0.02 0.00 0.00 33.50 32.05 3gpr n PRO 2093CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3gpr s TYR 2094N 0.83 3.36 -0.17 6.00 5.04 -1.26 -5.03 117.35 126.11 3gpr s TYR 2094Ca 0.89 1.27 0.01 0.00 -2.44 0.00 0.00 57.07 56.80 3gpr s TYR 2094Cb -1.08 -3.09 0.02 0.00 0.35 0.00 0.00 41.96 38.15 3gpr s TYR 2094CO 0.54 -0.36 -0.19 0.42 -1.34 0.00 0.00 175.55 174.61 3gpr s ILE 2095N 2.67 1.99 -0.59 3.14 -1.09 -1.26 -5.06 121.20 121.00 3gpr s ILE 2095Ca 0.39 -0.90 -0.26 0.00 -2.23 0.00 0.00 60.65 57.65 3gpr s ILE 2095Cb -0.16 -1.80 -0.10 0.00 -1.58 0.00 0.00 42.46 38.82 3gpr s ILE 2095CO 0.09 0.53 2.43 0.54 -1.23 0.00 0.00 174.94 177.30 3gpr n ARG 2096N 4.61 0.87 -2.65 2.79 1.74 -1.26 -4.92 116.66 117.84 3gpr n ARG 2096Ca -0.20 -0.19 -0.37 0.00 -0.77 0.00 0.00 57.85 56.32 3gpr n ARG 2096Cb 0.50 -3.38 -0.05 0.00 -1.02 0.00 0.00 32.46 28.51 3gpr n ARG 2096CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3gpr s LYS 2097N 8.45 4.36 -0.37 5.56 -0.14 -1.26 -4.69 119.74 131.65 3gpr s LYS 2097Ca 0.99 1.43 -0.09 0.00 -1.36 0.00 0.00 55.97 56.95 3gpr s LYS 2097Cb -0.23 -2.66 0.04 0.00 -1.68 0.00 0.00 37.83 33.31 3gpr s LYS 2097CO 0.24 0.05 0.17 0.00 -0.76 0.00 0.00 175.35 175.06 3gpr n PHE 2099N 4.90 0.03 -2.33 0.00 3.01 -1.14 -2.69 117.46 119.24 3gpr n PHE 2099Ca -0.12 0.23 0.00 0.00 1.01 0.00 0.00 57.45 58.58 3gpr n PHE 2099Cb 0.45 -1.89 0.00 0.00 -0.01 0.00 0.00 39.48 38.03 3gpr n PHE 2099CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 3gpr n VAL 2100N -4.40 0.00 -3.66 -4.37 0.24 0.76 -3.92 118.33 102.99 3gpr n VAL 2100Ca 0.09 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.29 3gpr n VAL 2100Cb 0.53 0.00 -0.08 0.00 -1.47 0.00 0.00 33.84 32.82 3gpr n VAL 2100CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3gpr s VAL 2101N 0.49 -0.01 0.07 3.34 0.11 0.16 -3.42 120.40 121.14 3gpr s VAL 2101Ca 0.00 0.02 -0.05 0.00 -2.93 0.00 0.00 61.98 59.02 3gpr s VAL 2101Cb 0.00 -0.88 -0.02 0.00 -1.53 0.00 0.00 36.38 33.95 3gpr s VAL 2101CO 0.00 0.01 0.09 -1.10 -3.33 0.00 0.00 175.10 170.77 3gpr s GLN 2102N 1.28 0.72 0.19 1.54 -0.21 -0.49 -2.24 119.66 120.45 3gpr s GLN 2102Ca -0.08 -1.04 -0.30 0.00 0.02 0.00 0.00 55.36 53.96 3gpr s GLN 2102Cb -0.06 0.28 -0.08 0.00 1.00 0.00 0.00 33.01 34.15 3gpr s GLN 2102CO -0.13 -0.19 1.15 -1.25 -2.12 0.00 0.00 175.29 172.74 3gpr s PRO 2103N -3.76 4.54 -0.39 2.91 0.04 -1.26 -1.85 135.00 135.24 3gpr s PRO 2103Ca 0.05 1.80 0.08 0.00 0.04 0.00 0.00 61.00 62.98 3gpr s PRO 2103Cb 0.06 -3.25 0.26 0.00 0.04 0.00 0.00 34.50 31.60 3gpr s PRO 2103CO -0.10 0.00 0.55 1.87 0.04 0.00 0.00 177.00 179.36 3gpr n TRP 2104N 2.34 -0.37 -2.42 0.56 -0.00 -1.17 -4.91 117.44 111.48 3gpr n TRP 2104Ca 0.03 -3.55 -0.01 0.00 -0.00 0.00 0.00 57.50 53.96 3gpr n TRP 2104Cb 0.45 -0.32 -0.01 0.00 -0.00 0.00 0.00 31.31 31.43 3gpr n TRP 2104CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 3gpr n GLU 2105N 1.31 -3.80 0.00 5.87 0.00 -1.26 -4.39 120.64 118.37 3gpr n GLU 2105Ca 0.21 2.80 0.00 0.00 0.00 0.00 0.00 57.16 60.18 3gpr n GLU 2105Cb 0.54 -3.71 0.00 0.00 0.00 0.00 0.00 31.44 28.27 3gpr n GLU 2105CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3gpr n GLY 2106N 1.92 1.80 0.00 8.31 0.00 -1.26 -4.79 105.19 111.16 3gpr n GLY 2106Ca -0.10 0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3gpr n GLY 2106CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gpr n LYS 2107N 0.00 0.99 -4.35 1.61 4.01 -1.26 -5.08 118.16 114.07 3gpr n LYS 2107Ca 0.00 0.00 -0.18 0.00 -0.51 0.00 0.00 58.31 57.62 3gpr n LYS 2107Cb 0.00 0.00 -0.10 0.00 -0.51 0.00 0.00 35.03 34.42 3gpr n LYS 2107CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 3gpr s SER 2108N -1.37 1.51 0.03 4.39 1.04 -1.26 -3.05 113.70 115.00 3gpr s SER 2108Ca 0.00 -1.38 -0.03 0.00 0.48 0.00 0.00 55.95 55.03 3gpr s SER 2108Cb 0.00 0.09 -0.02 0.00 0.10 0.00 0.00 66.02 66.20 3gpr s SER 2108CO 0.00 -0.69 0.03 -0.54 0.98 0.00 0.00 173.24 173.02 3gpr s LYS 2109N -3.99 0.47 -0.23 4.02 -0.14 -0.77 -4.87 119.74 114.23 3gpr s LYS 2109Ca 0.37 -0.75 -0.07 0.00 -1.36 0.00 0.00 55.97 54.16 3gpr s LYS 2109Cb 0.08 0.18 -0.03 0.00 -1.68 0.00 0.00 37.83 36.38 3gpr s LYS 2109CO 0.14 -0.10 0.05 -1.58 -0.76 0.00 0.00 175.35 173.10 3gpr s TRP 2110N -2.30 3.08 0.52 3.18 0.51 -1.26 -1.39 118.94 121.27 3gpr s TRP 2110Ca -0.08 -0.42 0.07 0.00 -2.12 0.00 0.00 56.10 53.55 3gpr s TRP 2110Cb -0.03 -2.18 0.04 0.00 -0.81 0.00 0.00 33.47 30.48 3gpr s TRP 2110CO -0.04 -0.30 0.50 0.71 -0.51 0.00 0.00 176.95 177.31 3gpr s TYR 2111N 1.37 1.87 -0.11 -1.98 2.02 -1.22 -4.83 117.35 114.45 3gpr s TYR 2111Ca 0.05 -0.72 -0.04 0.00 -0.37 0.00 0.00 57.07 55.99 3gpr s TYR 2111Cb -0.15 -2.06 -0.04 0.00 -0.40 0.00 0.00 41.96 39.31 3gpr s TYR 2111CO 0.03 -0.56 0.05 0.15 -1.57 0.00 0.00 175.55 173.65 3gpr s LYS 2112N -4.34 3.30 0.03 -0.62 1.02 -1.26 -0.17 119.74 117.71 3gpr s LYS 2112Ca 0.45 -0.32 -0.11 0.00 0.02 0.00 0.00 55.97 56.01 3gpr s LYS 2112Cb -0.03 -2.98 0.01 0.00 -0.52 0.00 0.00 37.83 34.31 3gpr s LYS 2112CO 0.28 0.64 0.24 0.00 -0.92 0.00 0.00 175.35 175.58 3gpr s ALA 2113N -0.67 -0.50 0.23 5.17 0.00 -1.10 -4.93 121.76 119.97 3gpr s ALA 2113Ca 0.11 -0.13 -0.31 0.00 0.00 0.00 0.00 51.96 51.63 3gpr s ALA 2113Cb -0.12 0.27 -0.11 0.00 0.00 0.00 0.00 23.12 23.16 3gpr s ALA 2113CO 0.02 -0.36 1.55 0.34 0.00 0.00 0.00 175.76 177.31 3gpr s ASP 2114N -1.99 6.52 0.00 0.00 2.15 -1.26 -1.55 116.67 120.55 3gpr s ASP 2114Ca -0.06 2.76 0.00 0.00 0.43 0.00 0.00 52.55 55.68 3gpr s ASP 2114Cb -0.02 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 3gpr s ASP 2114CO -0.03 -0.83 0.23 0.00 -0.17 0.00 0.00 175.17 174.38 3gpr n GLU 2116N 0.56 3.40 -2.38 0.00 -0.58 -1.26 -4.46 120.64 115.92 3gpr n GLU 2116Ca 0.00 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.34 3gpr n GLU 2116Cb 0.12 -0.70 -0.04 0.00 -0.57 0.00 0.00 31.44 30.25 3gpr n GLU 2116CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 3gpr s GLU 2117N -1.35 4.51 -0.25 3.49 2.12 -0.91 -4.78 118.70 121.53 3gpr s GLU 2117Ca 0.00 1.90 -0.13 0.00 0.36 0.00 0.00 54.97 57.10 3gpr s GLU 2117Cb 0.00 -3.10 -0.04 0.00 0.26 0.00 0.00 34.13 31.24 3gpr s GLU 2117CO 0.00 0.07 0.28 0.15 -0.54 0.00 0.00 175.26 175.22 3gpr s LYS 2118N -1.63 4.05 0.00 4.30 1.02 -1.26 -4.16 119.74 122.06 3gpr s LYS 2118Ca 0.47 -0.09 0.00 0.00 0.02 0.00 0.00 55.97 56.37 3gpr s LYS 2118Cb -0.33 -3.60 0.00 0.00 -0.52 0.00 0.00 37.83 33.37 3gpr s LYS 2118CO 0.43 -0.12 0.00 0.09 -0.92 0.00 0.00 175.35 174.83 3gpr n ASN 2119N 4.83 0.00 -4.86 2.83 3.02 -1.12 -4.50 115.26 115.47 3gpr n ASN 2119Ca -0.11 -0.53 -0.30 0.00 -0.03 0.00 0.00 54.58 53.60 3gpr n ASN 2119Cb 0.51 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.73 3gpr n ASN 2119CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gpr s ALA 2120N -1.44 2.79 0.22 5.41 0.00 -1.23 -0.79 121.76 126.72 3gpr s ALA 2120Ca 0.00 -0.20 -0.11 0.00 0.00 0.00 0.00 51.96 51.65 3gpr s ALA 2120Cb 0.00 -3.07 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 3gpr s ALA 2120CO 0.00 -1.16 0.39 -0.59 0.00 0.00 0.00 175.76 174.40 3gpr s PHE 2121N -3.24 0.46 0.03 0.00 -0.71 -1.21 -0.35 117.98 112.96 3gpr s PHE 2121Ca 0.58 -0.80 0.06 0.00 -1.04 0.00 0.00 56.93 55.73 3gpr s PHE 2121Cb -0.12 0.05 -0.02 0.00 -1.21 0.00 0.00 43.02 41.72 3gpr s PHE 2121CO 0.53 -0.89 -0.17 -0.51 -1.34 0.00 0.00 175.22 172.84 3gpr s LEU 2122N -3.02 2.15 0.49 -1.99 1.43 -1.23 -2.48 118.68 114.03 3gpr s LEU 2122Ca 0.23 -0.46 0.06 0.00 -1.03 0.00 0.00 54.13 52.93 3gpr s LEU 2122Cb 0.01 -0.78 0.00 0.00 0.03 0.00 0.00 46.19 45.45 3gpr s LEU 2122CO 0.07 0.11 0.31 0.00 0.23 0.00 0.00 176.35 177.07 3gpr s LYS 2124N -4.13 0.13 -0.12 0.00 2.20 -0.65 -4.13 119.74 113.03 3gpr s LYS 2124Ca 0.36 0.07 -0.30 0.00 -0.36 0.00 0.00 55.97 55.73 3gpr s LYS 2124Cb -0.01 0.06 0.11 0.00 -1.51 0.00 0.00 37.83 36.48 3gpr s LYS 2124CO 0.21 -0.03 0.88 -0.59 -0.36 0.00 0.00 175.35 175.46 3gpr s PHE 2125N -0.65 -0.47 0.72 4.03 -0.71 -1.25 -2.42 117.98 117.23 3gpr s PHE 2125Ca 0.07 0.80 -0.14 0.00 -1.04 0.00 0.00 56.93 56.63 3gpr s PHE 2125Cb -0.02 0.44 0.04 0.00 -1.21 0.00 0.00 43.02 42.26 3gpr s PHE 2125CO -0.09 -0.44 1.15 -1.25 -1.34 0.00 0.00 175.22 173.24 3gpr s PRO 2126N -1.16 2.32 -0.12 1.99 0.04 -1.26 -2.71 135.00 134.10 3gpr s PRO 2126Ca -0.05 1.51 -0.25 0.00 0.04 0.00 0.00 61.00 62.26 3gpr s PRO 2126Cb -0.00 -1.88 -0.27 0.00 0.04 0.00 0.00 34.50 32.39 3gpr s PRO 2126CO 0.04 -1.64 0.70 0.87 0.04 0.00 0.00 177.00 177.01 3gpr h LYS 2127N -0.41 0.11 0.00 4.56 1.57 -0.72 -3.48 116.57 118.19 3gpr h LYS 2127Ca -0.46 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.14 3gpr h LYS 2127Cb 1.26 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.64 3gpr h LYS 2127CO 0.51 1.09 0.00 -2.30 -0.57 0.00 0.00 179.45 178.18