#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a7q s ASN 1954N 0.00 5.22 0.50 6.41 0.01 -1.26 -5.09 114.94 120.73 3a7q s ASN 1954Ca 0.00 -3.80 -0.23 0.00 -0.71 0.00 0.00 52.86 48.12 3a7q s ASN 1954Cb 0.00 -1.73 -0.06 0.00 0.41 0.00 0.00 41.25 39.87 3a7q s ASN 1954CO 0.00 -0.12 1.30 -2.16 -1.51 0.00 0.00 177.10 174.61 3a7q s PRO 1955N -1.41 3.44 0.21 -0.60 0.04 -1.26 -4.62 135.00 130.81 3a7q s PRO 1955Ca 0.26 2.11 -0.32 0.00 0.04 0.00 0.00 61.00 63.08 3a7q s PRO 1955Cb -0.06 -2.38 -0.13 0.00 0.04 0.00 0.00 34.50 31.98 3a7q s PRO 1955CO -0.15 -0.91 1.60 0.28 0.04 0.00 0.00 177.00 177.86 3a7q n VAL 1956N -0.70 0.32 -0.09 -0.36 0.31 -1.26 -4.38 118.33 112.17 3a7q n VAL 1956Ca 0.08 -0.08 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 3a7q n VAL 1956Cb 0.45 -1.75 -0.09 0.00 -0.91 0.00 0.00 33.84 31.55 3a7q n VAL 1956CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3a7q n LEU 1957N 3.19 2.96 -3.71 7.52 4.77 0.75 -4.99 117.00 127.50 3a7q n LEU 1957Ca 0.14 -0.10 -0.11 0.00 -0.03 0.00 0.00 56.01 55.91 3a7q n LEU 1957Cb 0.33 -0.66 -0.11 0.00 -2.33 0.00 0.00 43.42 40.65 3a7q n LEU 1957CO 0.64 0.81 0.06 -0.22 -1.33 0.00 0.00 177.39 177.35 3a7q s LEU 1958N -6.11 0.09 -0.03 2.23 0.20 -0.59 -4.96 118.68 109.51 3a7q s LEU 1958Ca -0.25 0.86 -0.01 0.00 0.69 0.00 0.00 54.13 55.42 3a7q s LEU 1958Cb 0.07 1.36 0.03 0.00 -0.43 0.00 0.00 46.19 47.21 3a7q s LEU 1958CO 0.43 -0.18 0.04 -0.22 -0.29 0.00 0.00 176.35 176.14 3a7q s LEU 1959N 1.00 0.57 -0.19 -0.68 2.96 -1.24 -0.77 118.68 120.32 3a7q s LEU 1959Ca -0.06 0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 53.87 3a7q s LEU 1959Cb -0.07 -0.12 0.10 0.00 0.50 0.00 0.00 46.19 46.60 3a7q s LEU 1959CO -0.08 -0.19 0.27 -0.62 -1.32 0.00 0.00 176.35 174.40 3a7q s ASP 1960N 1.67 0.84 0.00 3.68 3.68 -0.52 -4.92 116.67 121.10 3a7q s ASP 1960Ca -0.01 0.10 0.27 0.00 2.13 0.00 0.00 52.55 55.03 3a7q s ASP 1960Cb -0.12 0.64 0.87 0.00 -1.45 0.00 0.00 42.92 42.86 3a7q s ASP 1960CO -0.03 -0.30 1.64 0.35 0.13 0.00 0.00 175.17 176.96 3a7q n THR 1961N 5.34 0.02 -1.85 1.71 -2.24 -1.26 -1.52 114.28 114.47 3a7q n THR 1961Ca -0.05 -0.31 -0.04 0.00 -2.27 0.00 0.00 64.05 61.38 3a7q n THR 1961Cb 0.50 0.68 -0.01 0.00 -2.10 0.00 0.00 70.33 69.40 3a7q n THR 1961CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3a7q n PHE 1962N 0.42 -1.34 1.71 4.78 3.01 -1.26 -4.60 117.46 120.18 3a7q n PHE 1962Ca 0.18 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.79 3a7q n PHE 1962Cb 0.40 -1.56 0.71 0.00 -0.01 0.00 0.00 39.48 39.02 3a7q n PHE 1962CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 3a7q n ASP 1963N -0.63 0.84 -2.78 4.37 8.00 -1.26 -3.21 116.55 121.89 3a7q n ASP 1963Ca -0.05 -1.27 -0.10 0.00 0.71 0.00 0.00 54.79 54.09 3a7q n ASP 1963Cb 0.35 -0.00 0.08 0.00 -0.02 0.00 0.00 41.12 41.53 3a7q n ASP 1963CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 3a7q n PHE 1964N -0.35 -2.00 0.00 1.24 -1.74 -1.26 -4.83 117.46 108.52 3a7q n PHE 1964Ca 0.21 -2.35 0.00 0.00 -0.56 0.00 0.00 57.45 54.75 3a7q n PHE 1964Cb 0.25 1.18 0.00 0.00 1.52 0.00 0.00 39.48 42.43 3a7q n PHE 1964CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3a7q n GLY 1965N 0.03 2.33 3.88 4.97 0.00 -1.20 -5.06 105.19 110.14 3a7q n GLY 1965Ca 0.06 -1.81 -0.29 0.00 0.00 0.00 0.00 46.02 43.98 3a7q n GLY 1965CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3a7q s PRO 1966N -3.60 2.07 -0.34 1.61 0.04 -1.26 -4.46 135.00 129.06 3a7q s PRO 1966Ca 0.00 0.23 -0.21 0.00 0.04 0.00 0.00 61.00 61.05 3a7q s PRO 1966Cb 0.00 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.59 3a7q s PRO 1966CO 0.00 -1.55 0.69 0.50 0.04 0.00 0.00 177.00 176.68 3a7q s ARG 1967N -5.48 3.80 0.28 4.56 3.52 -1.26 -4.97 118.95 119.40 3a7q s ARG 1967Ca 0.61 0.26 0.02 0.00 -0.13 0.00 0.00 55.73 56.49 3a7q s ARG 1967Cb -0.12 -3.77 0.58 0.00 -1.56 0.00 0.00 34.95 30.08 3a7q s ARG 1967CO 0.50 -0.71 1.81 1.05 -0.81 0.00 0.00 175.30 177.15 3a7q h GLU 1968N 8.34 0.87 0.00 5.12 4.11 -1.95 -1.95 114.58 129.12 3a7q h GLU 1968Ca -0.26 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.12 3a7q h GLU 1968Cb 1.11 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.16 3a7q h GLU 1968CO 0.85 0.57 0.00 -0.44 0.07 0.00 0.00 179.01 180.06 3a7q h ASP 1969N 0.89 0.00 -0.61 3.06 3.32 -2.02 -2.70 116.42 118.36 3a7q h ASP 1969Ca 0.51 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.51 3a7q h ASP 1969Cb 0.60 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 3a7q h ASP 1969CO -0.30 0.00 0.20 0.78 -1.72 0.00 0.00 179.24 178.20 3a7q h ASN 1970N 0.00 0.87 -3.88 6.45 2.35 -1.75 -3.43 115.58 116.19 3a7q h ASN 1970Ca 0.00 -0.20 -0.68 0.00 -0.55 0.00 0.00 56.30 54.87 3a7q h ASN 1970Cb 0.43 -0.23 -0.21 0.00 0.05 0.00 0.00 38.32 38.36 3a7q h ASN 1970CO 0.00 0.84 -0.77 0.26 -1.65 0.00 0.00 177.43 176.11 3a7q s TRP 1971N -5.44 2.68 -0.16 1.19 0.52 -1.02 -0.71 118.94 116.01 3a7q s TRP 1971Ca -0.13 -0.17 -0.07 0.00 0.02 0.00 0.00 56.10 55.75 3a7q s TRP 1971Cb 0.13 -1.54 -0.24 0.00 -1.15 0.00 0.00 33.47 30.67 3a7q s TRP 1971CO 0.81 0.27 0.22 1.19 0.02 0.00 0.00 176.95 179.46 3a7q n PHE 1972N 1.72 0.98 -3.83 -1.98 3.01 0.17 -4.71 117.46 112.82 3a7q n PHE 1972Ca -0.16 0.23 -0.12 0.00 1.01 0.00 0.00 57.45 58.41 3a7q n PHE 1972Cb 0.52 -1.12 -0.11 0.00 -0.01 0.00 0.00 39.48 38.76 3a7q n PHE 1972CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3a7q s PHE 1973N -2.53 -0.10 -0.38 1.38 0.08 -1.10 -4.99 117.98 110.34 3a7q s PHE 1973Ca -0.26 0.23 0.11 0.00 0.12 0.00 0.00 56.93 57.14 3a7q s PHE 1973Cb 0.07 0.02 0.34 0.00 -0.57 0.00 0.00 43.02 42.88 3a7q s PHE 1973CO 0.72 -0.17 0.74 2.48 -0.10 0.00 0.00 175.22 178.88 3a7q n TYR 1974N 2.37 -0.09 -1.91 0.36 0.18 -1.26 0.85 117.16 117.66 3a7q n TYR 1974Ca -0.17 -3.67 -0.41 0.00 1.88 0.00 0.00 57.90 55.52 3a7q n TYR 1974Cb 0.57 -0.27 -0.02 0.00 -0.38 0.00 0.00 39.34 39.24 3a7q n TYR 1974CO 0.00 0.00 0.00 -1.25 -2.08 0.00 0.00 176.86 173.53 3a7q s PRO 1975N -2.12 4.21 0.00 -3.48 0.04 -1.04 -1.83 135.00 130.78 3a7q s PRO 1975Ca 0.38 2.42 0.00 0.00 0.04 0.00 0.00 61.00 63.84 3a7q s PRO 1975Cb 0.33 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.79 3a7q s PRO 1975CO -0.08 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 176.85 3a7q n GLY 1976N 2.32 0.89 3.88 0.56 0.00 -1.20 -2.01 105.19 109.63 3a7q n GLY 1976Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 3a7q n GLY 1976CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3a7q s GLY 1977N -1.62 2.28 0.10 -0.02 0.00 -0.76 -3.89 107.32 103.42 3a7q s GLY 1977Ca 0.00 -0.41 -0.06 0.00 0.00 0.00 0.00 44.72 44.25 3a7q s GLY 1977CO 0.00 -0.27 0.14 -1.31 0.00 0.00 0.00 173.10 171.66 3a7q s ASN 1978N -2.25 0.21 -0.16 1.64 0.01 0.21 -4.96 114.94 109.64 3a7q s ASN 1978Ca 0.42 -0.85 -0.14 0.00 -0.71 0.00 0.00 52.86 51.57 3a7q s ASN 1978Cb -0.12 0.32 -0.05 0.00 0.41 0.00 0.00 41.25 41.82 3a7q s ASN 1978CO 0.22 -0.74 0.31 -0.63 -1.51 0.00 0.00 177.10 174.76 3a7q s ILE 1979N -3.92 5.29 -1.02 0.60 -1.09 -1.26 -0.35 121.20 119.45 3a7q s ILE 1979Ca 0.11 0.59 0.00 0.00 -2.23 0.00 0.00 60.65 59.11 3a7q s ILE 1979Cb 0.06 -3.65 0.00 0.00 -1.58 0.00 0.00 42.46 37.28 3a7q s ILE 1979CO -0.07 0.37 0.00 0.61 -1.23 0.00 0.00 174.94 174.63 3a7q n GLY 1980N 3.43 -0.62 3.39 6.18 0.00 -0.42 -4.95 105.19 112.20 3a7q n GLY 1980Ca -0.11 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 44.99 3a7q n GLY 1980CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a7q s LEU 1981N 0.00 3.11 -0.07 0.99 1.02 -1.26 -0.42 118.68 122.05 3a7q s LEU 1981Ca 0.00 -0.28 0.04 0.00 0.02 0.00 0.00 54.13 53.91 3a7q s LEU 1981Cb 0.00 -1.79 0.00 0.00 0.02 0.00 0.00 46.19 44.42 3a7q s LEU 1981CO 0.00 0.03 -0.19 -0.47 0.02 0.00 0.00 176.35 175.74 3a7q s TYR 1982N 1.18 2.06 -0.88 0.29 5.04 -1.26 -4.91 117.35 118.87 3a7q s TYR 1982Ca 0.03 -0.75 -0.05 0.00 -2.44 0.00 0.00 57.07 53.86 3a7q s TYR 1982Cb -0.15 -1.40 -0.01 0.00 0.35 0.00 0.00 41.96 40.76 3a7q s TYR 1982CO 0.00 -0.30 0.71 0.00 -1.34 0.00 0.00 175.55 174.63 3a7q n PRO 1984N -2.66 0.59 -3.53 0.00 -0.04 -1.26 -4.64 135.00 123.45 3a7q n PRO 1984Ca -0.11 -0.65 -0.14 0.00 -0.04 0.00 0.00 63.50 62.56 3a7q n PRO 1984Cb 0.58 -2.01 -0.04 0.00 -0.04 0.00 0.00 33.50 31.99 3a7q n PRO 1984CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3a7q s TYR 1985N 4.04 -0.46 0.14 0.54 2.02 -1.26 -5.15 117.35 117.22 3a7q s TYR 1985Ca 0.12 0.46 0.00 0.00 -0.37 0.00 0.00 57.07 57.28 3a7q s TYR 1985Cb 0.04 0.40 0.00 0.00 -0.40 0.00 0.00 41.96 42.00 3a7q s TYR 1985CO -0.01 -0.70 0.00 0.45 -1.57 0.00 0.00 175.55 173.73 3a7q n SER 1986N 0.21 0.57 -0.07 2.29 2.88 -1.26 -2.79 113.62 115.45 3a7q n SER 1986Ca -0.18 0.22 -0.14 0.00 -1.33 0.00 0.00 58.87 57.44 3a7q n SER 1986Cb 0.61 -0.07 -0.05 0.00 -0.75 0.00 0.00 64.21 63.96 3a7q n SER 1986CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3a7q n ASP 1994N -3.33 1.51 -4.73 -3.46 10.43 -1.26 -4.08 116.55 111.63 3a7q n ASP 1994Ca 0.00 0.25 -0.41 0.00 2.57 0.00 0.00 54.79 57.20 3a7q n ASP 1994Cb 0.00 -0.59 -0.04 0.00 1.84 0.00 0.00 41.12 42.33 3a7q n ASP 1994CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 3a7q s SER 1995N -6.35 7.41 0.24 -2.24 0.01 -1.26 -4.38 113.70 107.14 3a7q s SER 1995Ca -0.23 1.70 0.01 0.00 1.31 0.00 0.00 55.95 58.73 3a7q s SER 1995Cb 0.07 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.69 3a7q s SER 1995CO 0.32 -0.11 0.13 0.00 0.41 0.00 0.00 173.24 173.99 3a7q s ALA 1996N 0.27 1.54 -0.58 1.44 0.00 0.44 -4.60 121.76 120.27 3a7q s ALA 1996Ca 0.47 -1.79 -0.20 0.00 0.00 0.00 0.00 51.96 50.44 3a7q s ALA 1996Cb -0.22 1.22 0.08 0.00 0.00 0.00 0.00 23.12 24.20 3a7q s ALA 1996CO 0.28 -0.53 0.76 1.41 0.00 0.00 0.00 175.76 177.69 3a7q s MET 1997N -4.03 3.10 -0.13 0.00 1.75 -0.69 -1.30 119.30 117.99 3a7q s MET 1997Ca 0.38 -1.03 -0.08 0.00 -1.25 0.00 0.00 55.69 53.71 3a7q s MET 1997Cb 0.07 -4.20 -0.04 0.00 2.84 0.00 0.00 34.83 33.49 3a7q s MET 1997CO 0.14 -1.52 0.16 0.08 -0.65 0.00 0.00 175.02 173.22 3a7q s VAL 1998N 3.08 5.46 -0.47 10.11 1.01 0.53 -1.88 120.40 138.24 3a7q s VAL 1998Ca 0.16 0.25 -0.02 0.00 0.00 0.00 0.00 61.98 62.38 3a7q s VAL 1998Cb -0.20 -3.44 0.13 0.00 0.00 0.00 0.00 36.38 32.86 3a7q s VAL 1998CO 0.09 0.57 0.26 -0.36 0.00 0.00 0.00 175.10 175.66 3a7q s PHE 1999N -0.68 3.53 0.22 5.22 0.08 0.18 -0.61 117.98 125.90 3a7q s PHE 1999Ca 0.14 -2.63 -0.28 0.00 0.12 0.00 0.00 56.93 54.28 3a7q s PHE 1999Cb -0.12 -3.15 -0.09 0.00 -0.57 0.00 0.00 43.02 39.09 3a7q s PHE 1999CO 0.03 -0.91 0.89 0.08 -0.10 0.00 0.00 175.22 175.20 3a7q s VAL 2000N 0.66 4.17 0.17 -0.44 1.01 -1.25 -2.34 120.40 122.37 3a7q s VAL 2000Ca 0.12 1.96 -0.26 0.00 0.00 0.00 0.00 61.98 63.81 3a7q s VAL 2000Cb -0.22 -4.27 0.01 0.00 0.00 0.00 0.00 36.38 31.91 3a7q s VAL 2000CO -0.04 0.51 1.44 -1.20 0.00 0.00 0.00 175.10 175.81 3a7q n SER 2001N 1.52 -0.89 0.28 3.32 7.64 -1.26 -2.01 113.62 122.23 3a7q n SER 2001Ca -0.03 1.65 0.17 0.00 1.01 0.00 0.00 58.87 61.67 3a7q n SER 2001Cb 0.48 -0.26 0.94 0.00 -1.01 0.00 0.00 64.21 64.36 3a7q n SER 2001CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3a7q h ASN 2002N 0.00 0.00 -2.66 6.43 7.08 -1.89 -3.42 115.58 121.12 3a7q h ASN 2002Ca 0.20 0.00 -0.53 0.00 -3.08 0.00 0.00 56.30 52.88 3a7q h ASN 2002Cb 0.43 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 36.69 3a7q h ASN 2002CO -0.89 0.00 1.02 -0.70 -2.08 0.00 0.00 177.43 174.78 3a7q s GLU 2003N -4.55 4.19 0.33 4.14 2.56 -0.85 -4.84 118.70 119.67 3a7q s GLU 2003Ca -0.05 2.37 -0.26 0.00 0.00 0.00 0.00 54.97 57.03 3a7q s GLU 2003Cb 0.15 -3.61 -0.10 0.00 2.00 0.00 0.00 34.13 32.57 3a7q s GLU 2003CO 0.52 -0.75 0.98 0.08 -0.56 0.00 0.00 175.26 175.52 3a7q s VAL 2004N 2.69 4.05 0.00 3.70 1.01 -1.26 -4.89 120.40 125.70 3a7q s VAL 2004Ca 0.75 1.72 0.00 0.00 0.00 0.00 0.00 61.98 64.45 3a7q s VAL 2004Cb -0.41 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.01 3a7q s VAL 2004CO 0.33 0.16 0.00 0.61 0.00 0.00 0.00 175.10 176.20 3a7q n GLY 2005N 0.64 -1.82 3.74 4.51 0.00 0.50 -4.82 105.19 107.94 3a7q n GLY 2005Ca 0.02 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 3a7q n GLY 2005CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3a7q s GLU 2006N 0.00 4.27 -0.46 1.61 2.12 -1.26 -1.16 118.70 123.82 3a7q s GLU 2006Ca 0.00 2.28 -0.08 0.00 0.36 0.00 0.00 54.97 57.53 3a7q s GLU 2006Cb 0.00 -3.13 0.11 0.00 0.26 0.00 0.00 34.13 31.38 3a7q s GLU 2006CO 0.00 -0.44 0.31 -1.01 -0.54 0.00 0.00 175.26 173.59 3a7q s HIS 2007N 0.23 3.44 0.15 5.30 3.76 0.11 -3.27 115.29 125.01 3a7q s HIS 2007Ca 0.61 -1.92 -0.24 0.00 -0.15 0.00 0.00 55.06 53.36 3a7q s HIS 2007Cb -0.42 -3.40 0.08 0.00 1.11 0.00 0.00 32.58 29.95 3a7q s HIS 2007CO 0.40 -0.98 1.03 -1.54 -0.85 0.00 0.00 174.74 172.81 3a7q s SER 2008N 2.49 -0.08 -0.08 1.40 1.04 -0.85 -2.08 113.70 115.54 3a7q s SER 2008Ca 0.06 -0.50 -0.04 0.00 0.48 0.00 0.00 55.95 55.95 3a7q s SER 2008Cb -0.25 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.37 3a7q s SER 2008CO -0.01 -0.88 0.19 -0.51 0.98 0.00 0.00 173.24 173.01 3a7q s ILE 2009N -2.69 -0.04 -0.09 -1.02 2.07 -0.92 -2.48 121.20 116.03 3a7q s ILE 2009Ca 0.17 0.16 0.04 0.00 -1.41 0.00 0.00 60.65 59.61 3a7q s ILE 2009Cb -0.01 -0.31 0.00 0.00 0.13 0.00 0.00 42.46 42.27 3a7q s ILE 2009CO 0.03 0.07 -0.22 -0.89 -1.91 0.00 0.00 174.94 172.02 3a7q s THR 2010N 1.18 1.88 0.92 4.00 2.01 0.25 -1.45 115.64 124.42 3a7q s THR 2010Ca -0.09 -0.92 -0.12 0.00 0.31 0.00 0.00 61.69 60.87 3a7q s THR 2010Cb -0.11 -1.63 0.14 0.00 0.01 0.00 0.00 72.50 70.92 3a7q s THR 2010CO -0.07 0.52 1.10 0.42 -0.69 0.00 0.00 174.62 175.90 3a7q s THR 2011N 0.32 2.44 1.09 -0.82 -4.23 0.08 0.46 115.64 114.98 3a7q s THR 2011Ca -0.16 0.14 -0.17 0.00 -1.18 0.00 0.00 61.69 60.32 3a7q s THR 2011Cb -0.17 -2.70 0.24 0.00 1.34 0.00 0.00 72.50 71.22 3a7q s THR 2011CO 0.07 -0.19 1.17 0.00 -0.54 0.00 0.00 174.62 175.14 3a7q s ARG 2012N -5.01 -0.35 0.19 3.99 1.70 0.12 -4.01 118.95 115.58 3a7q s ARG 2012Ca 0.64 -0.09 -0.30 0.00 -0.47 0.00 0.00 55.73 55.51 3a7q s ARG 2012Cb -0.17 -1.70 -0.08 0.00 -0.57 0.00 0.00 34.95 32.43 3a7q s ARG 2012CO 0.56 -3.13 1.17 -0.51 -1.08 0.00 0.00 175.30 172.32 3a7q s ASP 2013N -4.16 7.14 -0.01 -2.89 1.01 -1.26 -4.51 116.67 111.98 3a7q s ASP 2013Ca 0.71 2.21 0.03 0.00 0.71 0.00 0.00 52.55 56.21 3a7q s ASP 2013Cb -0.09 -2.61 -0.00 0.00 1.01 0.00 0.00 42.92 41.23 3a7q s ASP 2013CO 0.55 -0.32 -0.10 -0.76 0.21 0.00 0.00 175.17 174.75 3a7q s LEU 2014N -0.41 1.95 -0.77 1.23 1.43 0.40 -4.89 118.68 117.61 3a7q s LEU 2014Ca 0.51 -0.18 -0.24 0.00 -1.03 0.00 0.00 54.13 53.19 3a7q s LEU 2014Cb -0.32 -0.53 0.06 0.00 0.03 0.00 0.00 46.19 45.43 3a7q s LEU 2014CO 0.37 0.11 1.19 -0.44 0.23 0.00 0.00 176.35 177.80 3a7q s SER 2015N -0.10 6.26 0.12 2.29 0.01 -1.26 -0.18 113.70 120.83 3a7q s SER 2015Ca 0.02 -0.92 0.02 0.00 1.31 0.00 0.00 55.95 56.38 3a7q s SER 2015Cb -0.05 -2.50 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 3a7q s SER 2015CO -0.00 -1.59 0.21 0.68 0.41 0.00 0.00 173.24 172.95 3a7q s VAL 2016N 4.79 5.09 0.09 3.43 -7.23 -0.82 -4.96 120.40 120.80 3a7q s VAL 2016Ca 0.32 -0.68 0.01 0.00 -1.81 0.00 0.00 61.98 59.82 3a7q s VAL 2016Cb -0.10 -3.56 -0.01 0.00 0.56 0.00 0.00 36.38 33.28 3a7q s VAL 2016CO 0.07 -0.00 0.05 -0.46 -0.31 0.00 0.00 175.10 174.46 3a7q n ASN 2017N -0.15 0.40 -0.47 4.85 0.23 -1.26 -1.96 115.26 116.91 3a7q n ASN 2017Ca -0.07 -1.54 0.38 0.00 -0.53 0.00 0.00 54.58 52.82 3a7q n ASN 2017Cb 0.53 0.34 0.68 0.00 -2.08 0.00 0.00 39.78 39.25 3a7q n ASN 2017CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3a7q h GLU 2018N 0.00 0.09 -0.33 -3.83 4.81 -1.88 -2.25 114.58 111.18 3a7q h GLU 2018Ca -0.07 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3a7q h GLU 2018Cb 0.30 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.66 3a7q h GLU 2018CO 0.10 0.06 0.00 0.09 -0.73 0.00 0.00 179.01 178.53 3a7q n ASN 2019N -4.47 3.36 -4.70 1.04 3.02 -1.26 -3.93 115.26 108.31 3a7q n ASN 2019Ca 0.36 -1.98 -0.41 0.00 -0.03 0.00 0.00 54.58 52.52 3a7q n ASN 2019Cb 1.47 -0.21 -0.04 0.00 -0.61 0.00 0.00 39.78 40.39 3a7q n ASN 2019CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3a7q s THR 2020N -1.51 4.92 0.25 3.41 2.01 -0.84 -0.19 115.64 123.69 3a7q s THR 2020Ca 0.36 1.77 0.11 0.00 0.31 0.00 0.00 61.69 64.24 3a7q s THR 2020Cb 0.22 -4.19 -0.05 0.00 0.01 0.00 0.00 72.50 68.49 3a7q s THR 2020CO 0.30 0.15 -0.12 0.27 -0.69 0.00 0.00 174.62 174.54 3a7q s ILE 2021N 1.24 2.93 -0.13 1.82 -4.36 0.27 -1.28 121.20 121.68 3a7q s ILE 2021Ca 0.44 -2.06 -0.00 0.00 -0.26 0.00 0.00 60.65 58.77 3a7q s ILE 2021Cb -0.19 -2.52 -0.01 0.00 1.25 0.00 0.00 42.46 40.99 3a7q s ILE 2021CO 0.21 -0.30 -0.13 -0.63 0.24 0.00 0.00 174.94 174.33 3a7q s ILE 2022N -2.20 3.08 -0.02 8.37 1.09 0.66 -2.41 121.20 129.77 3a7q s ILE 2022Ca 0.28 -0.65 0.02 0.00 -1.10 0.00 0.00 60.65 59.20 3a7q s ILE 2022Cb -0.07 -2.30 0.00 0.00 -1.06 0.00 0.00 42.46 39.04 3a7q s ILE 2022CO 0.16 0.52 -0.05 -1.58 -0.10 0.00 0.00 174.94 173.89 3a7q s GLN 2023N 0.40 0.53 0.14 2.79 0.74 0.93 -1.03 119.66 124.16 3a7q s GLN 2023Ca -0.10 -0.16 -0.25 0.00 0.05 0.00 0.00 55.36 54.90 3a7q s GLN 2023Cb -0.16 -0.54 0.07 0.00 1.10 0.00 0.00 33.01 33.48 3a7q s GLN 2023CO 0.05 0.06 0.84 -0.59 -0.55 0.00 0.00 175.29 175.10 3a7q s PHE 2024N 0.20 -0.26 0.09 1.67 -0.12 -0.68 0.52 117.98 119.40 3a7q s PHE 2024Ca -0.02 -0.01 0.04 0.00 -0.05 0.00 0.00 56.93 56.88 3a7q s PHE 2024Cb -0.06 0.61 -0.04 0.00 -0.63 0.00 0.00 43.02 42.90 3a7q s PHE 2024CO -0.00 -0.83 0.07 -1.21 -0.05 0.00 0.00 175.22 173.19 3a7q s GLU 2025N -3.43 2.81 0.00 1.99 2.02 0.30 -0.72 118.70 121.66 3a7q s GLU 2025Ca 0.08 -0.74 -0.19 0.00 0.02 0.00 0.00 54.97 54.14 3a7q s GLU 2025Cb -0.02 -2.68 0.04 0.00 0.10 0.00 0.00 34.13 31.57 3a7q s GLU 2025CO -0.02 0.55 0.42 -1.50 0.02 0.00 0.00 175.26 174.73 3a7q s ILE 2026N -1.41 0.05 -0.08 -1.63 2.07 -0.75 -1.06 121.20 118.39 3a7q s ILE 2026Ca 0.29 -0.38 -0.03 0.00 -1.41 0.00 0.00 60.65 59.12 3a7q s ILE 2026Cb -0.12 -0.82 0.04 0.00 0.13 0.00 0.00 42.46 41.69 3a7q s ILE 2026CO 0.21 -0.21 0.15 0.21 -1.91 0.00 0.00 174.94 173.39 3a7q s ASN 2027N -1.57 0.60 -0.30 4.50 3.84 -0.63 -1.39 114.94 119.98 3a7q s ASN 2027Ca -0.10 0.30 -0.00 0.00 0.21 0.00 0.00 52.86 53.27 3a7q s ASN 2027Cb -0.02 0.22 0.06 0.00 -0.55 0.00 0.00 41.25 40.96 3a7q s ASN 2027CO 0.03 -0.22 -0.00 -0.69 -2.79 0.00 0.00 177.10 173.42 3a7q s VAL 2028N 2.05 2.78 0.00 -5.21 1.01 -1.26 -1.90 120.40 117.86 3a7q s VAL 2028Ca 0.01 -1.57 0.00 0.00 0.00 0.00 0.00 61.98 60.42 3a7q s VAL 2028Cb -0.12 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.60 3a7q s VAL 2028CO -0.06 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.48 3a7q n GLY 2029N 4.55 2.57 4.24 4.51 0.00 -0.25 -3.38 105.19 117.42 3a7q n GLY 2029Ca -0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 3a7q n GLY 2029CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a7q n SER 2031N -2.67 -1.16 -0.74 0.00 3.41 -1.26 -4.91 113.62 106.28 3a7q n SER 2031Ca 0.04 -2.90 0.07 0.00 -0.26 0.00 0.00 58.87 55.81 3a7q n SER 2031Cb 0.51 2.25 0.17 0.00 -0.26 0.00 0.00 64.21 66.88 3a7q n SER 2031CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3a7q n THR 2032N -0.57 0.86 -2.82 6.66 -2.24 -1.26 -3.47 114.28 111.43 3a7q n THR 2032Ca 0.02 -0.93 -0.43 0.00 -2.27 0.00 0.00 64.05 60.45 3a7q n THR 2032Cb 0.57 0.61 -0.04 0.00 -2.10 0.00 0.00 70.33 69.37 3a7q n THR 2032CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3a7q s ASP 2033N -1.02 6.18 -0.04 3.42 1.01 -1.26 -4.90 116.67 120.05 3a7q s ASP 2033Ca 0.26 -0.95 -0.30 0.00 0.71 0.00 0.00 52.55 52.27 3a7q s ASP 2033Cb 0.14 -2.44 -0.04 0.00 1.01 0.00 0.00 42.92 41.60 3a7q s ASP 2033CO 0.19 -1.48 1.22 -0.44 0.21 0.00 0.00 175.17 174.87 3a7q s SER 2034N 3.70 7.03 0.03 0.27 0.01 -1.25 -3.27 113.70 120.21 3a7q s SER 2034Ca 0.24 1.86 -0.02 0.00 1.31 0.00 0.00 55.95 59.34 3a7q s SER 2034Cb -0.16 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.49 3a7q s SER 2034CO 0.10 -0.59 0.00 -0.55 0.41 0.00 0.00 173.24 172.61 3a7q s SER 2035N 1.51 0.27 -0.02 2.44 0.15 -1.09 -4.49 113.70 112.47 3a7q s SER 2035Ca 0.57 -0.60 0.18 0.00 0.70 0.00 0.00 55.95 56.80 3a7q s SER 2035Cb -0.26 0.15 0.55 0.00 -1.71 0.00 0.00 66.02 64.76 3a7q s SER 2035CO 0.23 -0.41 1.46 -1.54 1.20 0.00 0.00 173.24 174.18 3a7q n SER 2036N 1.11 3.46 -4.57 5.45 3.41 -1.25 -4.00 113.62 117.22 3a7q n SER 2036Ca -0.21 -2.09 -0.34 0.00 -0.26 0.00 0.00 58.87 55.97 3a7q n SER 2036Cb 0.57 -0.44 -0.11 0.00 -0.26 0.00 0.00 64.21 63.97 3a7q n SER 2036CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3a7q s ALA 2037N -1.34 3.12 -1.24 7.33 0.00 -1.26 -4.56 121.76 123.82 3a7q s ALA 2037Ca 0.41 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.54 3a7q s ALA 2037Cb 0.23 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.80 3a7q s ALA 2037CO 0.26 0.34 1.02 -0.25 0.00 0.00 0.00 175.76 177.12 3a7q n ASP 2038N 3.07 -2.77 -4.78 0.00 8.00 -1.26 -4.77 116.55 114.04 3a7q n ASP 2038Ca -0.18 -0.62 -0.29 0.00 0.71 0.00 0.00 54.79 54.41 3a7q n ASP 2038Cb 0.53 -5.05 0.12 0.00 -0.02 0.00 0.00 41.12 36.70 3a7q n ASP 2038CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3a7q s PRO 2039N -5.57 1.46 -0.26 -0.24 0.04 -1.26 -4.77 135.00 124.39 3a7q s PRO 2039Ca 0.11 0.49 -0.10 0.00 0.04 0.00 0.00 61.00 61.53 3a7q s PRO 2039Cb -0.05 -1.86 -0.05 0.00 0.04 0.00 0.00 34.50 32.59 3a7q s PRO 2039CO 0.74 -2.02 0.17 0.08 0.04 0.00 0.00 177.00 176.00 3a7q s VAL 2040N -3.18 5.19 -0.19 -0.36 1.01 -0.15 -4.30 120.40 118.43 3a7q s VAL 2040Ca 0.63 0.13 -0.08 0.00 0.00 0.00 0.00 61.98 62.65 3a7q s VAL 2040Cb -0.15 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 3a7q s VAL 2040CO 0.54 0.29 0.08 -0.13 0.00 0.00 0.00 175.10 175.88 3a7q s ARG 2041N 1.55 4.02 -0.24 2.72 0.52 0.16 0.44 118.95 128.12 3a7q s ARG 2041Ca 0.07 -0.32 -0.18 0.00 -0.52 0.00 0.00 55.73 54.78 3a7q s ARG 2041Cb -0.15 -3.28 -0.03 0.00 0.52 0.00 0.00 34.95 32.01 3a7q s ARG 2041CO 0.08 0.25 0.52 -1.17 0.02 0.00 0.00 175.30 175.01 3a7q s LEU 2042N 0.45 4.08 0.14 2.53 2.96 -0.28 -0.49 118.68 128.08 3a7q s LEU 2042Ca 0.04 0.59 0.01 0.00 -0.22 0.00 0.00 54.13 54.55 3a7q s LEU 2042Cb -0.12 -2.69 -0.04 0.00 0.50 0.00 0.00 46.19 43.83 3a7q s LEU 2042CO 0.00 -0.25 -0.01 -1.61 -1.32 0.00 0.00 176.35 173.15 3a7q s GLU 2043N 2.09 0.97 0.18 1.98 2.02 -0.70 -1.62 118.70 123.62 3a7q s GLU 2043Ca 0.22 -1.44 0.04 0.00 0.02 0.00 0.00 54.97 53.81 3a7q s GLU 2043Cb -0.16 -0.15 -0.05 0.00 0.10 0.00 0.00 34.13 33.88 3a7q s GLU 2043CO 0.09 -0.12 -0.05 -0.59 0.02 0.00 0.00 175.26 174.62 3a7q s PHE 2044N -3.72 1.34 -0.03 1.61 -0.12 0.65 -2.00 117.98 115.71 3a7q s PHE 2044Ca 0.19 -0.86 -0.00 0.00 -0.05 0.00 0.00 56.93 56.21 3a7q s PHE 2044Cb 0.06 -0.73 0.03 0.00 -0.63 0.00 0.00 43.02 41.75 3a7q s PHE 2044CO 0.00 -0.02 0.03 0.45 -0.05 0.00 0.00 175.22 175.64 3a7q s SER 2045N -3.21 0.41 0.00 1.98 0.15 0.15 -2.22 113.70 110.95 3a7q s SER 2045Ca 0.22 0.03 0.20 0.00 0.70 0.00 0.00 55.95 57.09 3a7q s SER 2045Cb 0.04 -0.12 0.56 0.00 -1.71 0.00 0.00 66.02 64.79 3a7q s SER 2045CO 0.04 -0.15 1.47 0.54 1.20 0.00 0.00 173.24 176.33 3a7q n ARG 2046N 4.45 2.46 -1.01 5.44 1.74 -1.26 -0.18 116.66 128.30 3a7q n ARG 2046Ca -0.22 -2.27 0.04 0.00 -0.77 0.00 0.00 57.85 54.63 3a7q n ARG 2046Cb 0.50 -1.49 0.06 0.00 -1.02 0.00 0.00 32.46 30.51 3a7q n ARG 2046CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3a7q n ASP 2047N 1.35 1.06 -2.62 0.55 5.68 -1.26 -4.98 116.55 116.33 3a7q n ASP 2047Ca 0.21 -2.48 -0.13 0.00 -0.50 0.00 0.00 54.79 51.89 3a7q n ASP 2047Cb 0.53 -0.34 0.06 0.00 -1.14 0.00 0.00 41.12 40.23 3a7q n ASP 2047CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3a7q n PHE 2048N -0.08 -1.63 -1.05 2.11 3.72 -1.26 -2.83 117.46 116.43 3a7q n PHE 2048Ca 0.08 0.65 -0.02 0.00 -0.05 0.00 0.00 57.45 58.12 3a7q n PHE 2048Cb 0.93 -3.96 -0.01 0.00 -0.94 0.00 0.00 39.48 35.50 3a7q n PHE 2048CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a7q n GLY 2049N -1.24 0.50 0.18 1.37 0.00 -1.26 -4.92 105.19 99.82 3a7q n GLY 2049Ca -0.13 -0.22 -0.12 0.00 0.00 0.00 0.00 46.02 45.55 3a7q n GLY 2049CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a7q h ALA 2050N 0.00 0.37 -2.34 4.61 0.00 -1.94 -3.45 119.26 116.51 3a7q h ALA 2050Ca -0.04 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.43 3a7q h ALA 2050Cb 0.33 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 17.87 3a7q h ALA 2050CO 0.05 0.20 -0.66 0.95 0.00 0.00 0.00 179.25 179.80 3a7q s THR 2051N -4.71 0.16 0.07 0.00 -4.23 -1.26 -5.13 115.64 100.53 3a7q s THR 2051Ca -0.13 -1.85 0.03 0.00 -1.18 0.00 0.00 61.69 58.56 3a7q s THR 2051Cb 0.08 -1.79 -0.03 0.00 1.34 0.00 0.00 72.50 72.10 3a7q s THR 2051CO 0.77 -0.72 -0.10 0.26 -0.54 0.00 0.00 174.62 174.30 3a7q s TRP 2052N -3.98 0.91 0.00 3.99 0.52 -1.26 -4.58 118.94 114.54 3a7q s TRP 2052Ca 0.16 -0.57 -0.01 0.00 0.02 0.00 0.00 56.10 55.70 3a7q s TRP 2052Cb 0.08 -0.52 -0.01 0.00 -1.15 0.00 0.00 33.47 31.87 3a7q s TRP 2052CO -0.04 -0.04 0.01 -1.01 0.02 0.00 0.00 176.95 175.90 3a7q s HIS 2053N -1.82 0.11 0.07 -1.98 3.76 -0.94 -4.95 115.29 109.53 3a7q s HIS 2053Ca -0.03 -0.22 -0.32 0.00 -0.15 0.00 0.00 55.06 54.34 3a7q s HIS 2053Cb -0.07 -0.09 -0.11 0.00 1.11 0.00 0.00 32.58 33.42 3a7q s HIS 2053CO 0.00 -0.12 1.82 1.28 -0.85 0.00 0.00 174.74 176.87 3a7q n LEU 2054N 2.24 3.74 -0.20 0.89 4.77 -1.26 -0.25 117.00 126.92 3a7q n LEU 2054Ca -0.19 0.99 -0.07 0.00 -0.03 0.00 0.00 56.01 56.72 3a7q n LEU 2054Cb 0.57 -1.48 0.03 0.00 -2.33 0.00 0.00 43.42 40.21 3a7q n LEU 2054CO 0.22 0.04 1.05 0.25 -1.33 0.00 0.00 177.39 177.63 3a7q h LEU 2055N 8.47 0.73 -7.79 2.23 5.85 -1.61 -3.35 115.31 119.84 3a7q h LEU 2055Ca -0.47 -0.09 -0.68 0.00 0.84 0.00 0.00 57.88 57.48 3a7q h LEU 2055Cb 1.24 -0.18 -0.36 0.00 0.37 0.00 0.00 40.66 41.72 3a7q h LEU 2055CO 0.94 0.61 -0.63 -0.22 -0.34 0.00 0.00 178.44 178.80 3a7q s LEU 2056N -9.96 4.95 1.31 2.25 2.96 -1.26 -4.98 118.68 113.94 3a7q s LEU 2056Ca -0.13 -2.02 -0.20 0.00 -0.22 0.00 0.00 54.13 51.56 3a7q s LEU 2056Cb 0.13 -1.74 0.31 0.00 0.50 0.00 0.00 46.19 45.39 3a7q s LEU 2056CO 0.77 -0.46 0.71 -0.81 -1.32 0.00 0.00 176.35 175.25 3a7q n PRO 2057N 4.46 -3.86 -4.07 0.98 -0.04 -1.26 0.73 135.00 131.95 3a7q n PRO 2057Ca -0.01 -1.14 -0.33 0.00 -0.04 0.00 0.00 63.50 61.98 3a7q n PRO 2057Cb 0.42 -1.81 -0.07 0.00 -0.04 0.00 0.00 33.50 32.00 3a7q n PRO 2057CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3a7q s LEU 2058N -5.38 3.94 0.00 1.53 0.20 -1.26 -3.56 118.68 114.15 3a7q s LEU 2058Ca 0.58 0.15 0.00 0.00 0.69 0.00 0.00 54.13 55.55 3a7q s LEU 2058Cb -0.12 -2.35 0.00 0.00 -0.43 0.00 0.00 46.19 43.29 3a7q s LEU 2058CO 0.51 0.25 0.00 0.00 -0.29 0.00 0.00 176.35 176.82 3a7q s HIS 2074N 2.39 2.28 -0.21 0.00 0.09 -1.26 -5.00 115.29 113.58 3a7q s HIS 2074Ca 0.00 -1.27 -0.27 0.00 -0.00 0.00 0.00 55.06 53.52 3a7q s HIS 2074Cb 0.00 -1.64 0.09 0.00 -0.00 0.00 0.00 32.58 31.02 3a7q s HIS 2074CO 0.00 -0.67 0.81 -3.38 -0.00 0.00 0.00 174.74 171.50 3a7q s HIS 2075N 1.35 -0.64 0.80 1.40 0.00 -1.26 -4.82 115.29 112.13 3a7q s HIS 2075Ca 0.03 1.43 -0.14 0.00 -3.00 0.00 0.00 55.06 53.38 3a7q s HIS 2075Cb -0.13 0.34 0.06 0.00 -4.00 0.00 0.00 32.58 28.85 3a7q s HIS 2075CO -0.10 -0.39 1.06 -0.35 -1.00 0.00 0.00 174.74 173.96 3a7q n PRO 2076N 1.96 0.18 -1.40 -0.38 -0.04 -1.26 -4.42 135.00 129.64 3a7q n PRO 2076Ca -0.14 0.13 -0.29 0.00 -0.04 0.00 0.00 63.50 63.16 3a7q n PRO 2076Cb 0.56 -2.32 0.15 0.00 -0.04 0.00 0.00 33.50 31.85 3a7q n PRO 2076CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3a7q s SER 2077N -2.01 3.27 0.00 3.54 1.04 -1.23 -4.69 113.70 113.62 3a7q s SER 2077Ca 0.71 1.09 -0.05 0.00 0.48 0.00 0.00 55.95 58.18 3a7q s SER 2077Cb -0.30 -1.71 -0.22 0.00 0.10 0.00 0.00 66.02 63.89 3a7q s SER 2077CO 0.53 -2.71 3.04 -1.54 0.98 0.00 0.00 173.24 173.54 3a7q n SER 2078N -3.89 4.28 -4.34 7.02 3.41 0.23 -4.81 113.62 115.52 3a7q n SER 2078Ca 0.06 -2.30 -0.32 0.00 -0.26 0.00 0.00 58.87 56.05 3a7q n SER 2078Cb 0.58 -1.16 -0.15 0.00 -0.26 0.00 0.00 64.21 63.22 3a7q n SER 2078CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3a7q s THR 2079N 1.36 2.54 -0.32 6.66 2.01 -1.26 -1.12 115.64 125.51 3a7q s THR 2079Ca 0.54 -0.88 0.03 0.00 0.31 0.00 0.00 61.69 61.69 3a7q s THR 2079Cb 0.26 -1.98 0.09 0.00 0.01 0.00 0.00 72.50 70.87 3a7q s THR 2079CO 0.00 0.56 0.01 -0.31 -0.69 0.00 0.00 174.62 174.19 3a7q s TYR 2080N -0.12 3.60 0.52 4.92 2.02 0.17 -4.94 117.35 123.52 3a7q s TYR 2080Ca -0.03 -2.75 -0.09 0.00 -0.37 0.00 0.00 57.07 53.83 3a7q s TYR 2080Cb -0.14 -2.61 -0.04 0.00 -0.40 0.00 0.00 41.96 38.76 3a7q s TYR 2080CO 0.04 -0.93 0.88 0.71 -1.57 0.00 0.00 175.55 174.68 3a7q s TYR 2081N 0.98 3.56 0.25 2.71 2.02 -1.26 -0.97 117.35 124.64 3a7q s TYR 2081Ca 0.04 1.06 -0.30 0.00 -0.37 0.00 0.00 57.07 57.50 3a7q s TYR 2081Cb -0.19 -2.50 -0.09 0.00 -0.40 0.00 0.00 41.96 38.77 3a7q s TYR 2081CO -0.07 -0.40 1.03 0.00 -1.57 0.00 0.00 175.55 174.55 3a7q s ALA 2082N -2.83 3.37 0.00 3.71 0.00 -1.26 -3.97 121.76 120.79 3a7q s ALA 2082Ca 0.51 0.77 0.00 0.00 0.00 0.00 0.00 51.96 53.25 3a7q s ALA 2082Cb -0.10 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.74 3a7q s ALA 2082CO 0.45 -0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.61 3a7q n GLY 2083N 1.39 2.58 0.35 0.00 0.00 -1.20 -2.67 105.19 105.63 3a7q n GLY 2083Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 3a7q n GLY 2083CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3a7q h THR 2084N 0.00 0.23 -3.79 2.61 2.02 -1.81 -3.41 112.91 108.76 3a7q h THR 2084Ca 0.00 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.87 3a7q h THR 2084Cb 0.00 0.23 -0.29 0.00 -1.74 0.00 0.00 68.15 66.35 3a7q h THR 2084CO 0.00 0.00 -0.75 0.42 0.37 0.00 0.00 175.52 175.56 3a7q s THR 2085N -5.97 0.28 0.13 3.16 -4.23 -1.26 -4.22 115.64 103.53 3a7q s THR 2085Ca -0.15 -0.12 -0.24 0.00 -1.18 0.00 0.00 61.69 59.99 3a7q s THR 2085Cb 0.11 -0.26 -0.03 0.00 1.34 0.00 0.00 72.50 73.66 3a7q s THR 2085CO 0.66 0.10 1.64 -0.61 -0.54 0.00 0.00 174.62 175.87 3a7q h GLN 2086N 6.27 -0.31 -7.54 3.99 4.15 -1.79 -3.42 115.11 116.46 3a7q h GLN 2086Ca -0.30 0.02 -0.47 0.00 0.77 0.00 0.00 58.65 58.67 3a7q h GLN 2086Cb 1.19 0.07 0.11 0.00 0.21 0.00 0.00 27.48 29.06 3a7q h GLN 2086CO 0.50 -0.21 0.37 0.20 -1.93 0.00 0.00 178.83 177.76 3a7q s GLY 2087N -2.60 1.59 0.58 2.39 0.00 -1.26 -4.16 107.32 103.87 3a7q s GLY 2087Ca -0.15 -0.53 -0.20 0.00 0.00 0.00 0.00 44.72 43.84 3a7q s GLY 2087CO 0.67 -0.04 1.29 0.79 0.00 0.00 0.00 173.10 175.81 3a7q n TRP 2088N -3.43 2.01 -3.94 1.90 7.02 -1.12 -4.84 117.44 115.05 3a7q n TRP 2088Ca 0.07 0.43 -0.11 0.00 -1.02 0.00 0.00 57.50 56.88 3a7q n TRP 2088Cb 0.59 -2.31 -0.13 0.00 -2.42 0.00 0.00 31.31 27.05 3a7q n TRP 2088CO 0.00 0.00 0.00 -0.98 -2.02 0.00 0.00 177.69 174.69 3a7q s ARG 2089N -2.99 0.17 0.24 -0.99 1.70 -0.49 -4.73 118.95 111.85 3a7q s ARG 2089Ca 0.75 -0.30 -0.30 0.00 -0.47 0.00 0.00 55.73 55.42 3a7q s ARG 2089Cb -0.41 0.02 -0.09 0.00 -0.57 0.00 0.00 34.95 33.90 3a7q s ARG 2089CO 0.46 -0.02 1.00 0.50 -1.08 0.00 0.00 175.30 176.17 3a7q s ARG 2090N -0.69 4.77 0.04 3.89 3.52 -1.26 -1.81 118.95 127.40 3a7q s ARG 2090Ca -0.07 1.60 0.04 0.00 -0.13 0.00 0.00 55.73 57.16 3a7q s ARG 2090Cb -0.05 -3.26 -0.02 0.00 -1.56 0.00 0.00 34.95 30.06 3a7q s ARG 2090CO -0.00 0.38 -0.11 -1.21 -0.81 0.00 0.00 175.30 173.55 3a7q s GLU 2091N -1.13 0.72 -0.05 5.12 0.41 0.10 -4.99 118.70 118.88 3a7q s GLU 2091Ca 0.43 -0.72 -0.03 0.00 -0.41 0.00 0.00 54.97 54.24 3a7q s GLU 2091Cb -0.28 -0.65 0.03 0.00 -1.78 0.00 0.00 34.13 31.45 3a7q s GLU 2091CO 0.35 0.15 0.12 0.54 -0.49 0.00 0.00 175.26 175.93 3a7q s VAL 2092N -1.00 -0.03 -0.07 2.63 0.11 -1.26 -1.69 120.40 119.09 3a7q s VAL 2092Ca -0.03 0.11 0.05 0.00 -2.93 0.00 0.00 61.98 59.19 3a7q s VAL 2092Cb -0.08 -0.19 -0.01 0.00 -1.53 0.00 0.00 36.38 34.57 3a7q s VAL 2092CO 0.01 0.04 -0.24 -0.69 -3.33 0.00 0.00 175.10 170.90 3a7q s VAL 2093N 0.71 1.98 -0.85 2.04 1.01 -0.20 -4.99 120.40 120.08 3a7q s VAL 2093Ca -0.05 -1.01 -0.17 0.00 0.00 0.00 0.00 61.98 60.75 3a7q s VAL 2093Cb -0.07 -1.69 0.17 0.00 0.00 0.00 0.00 36.38 34.79 3a7q s VAL 2093CO -0.03 0.55 0.93 -2.28 0.00 0.00 0.00 175.10 174.27 3a7q s HIS 2094N 0.02 3.39 0.15 5.22 2.46 -1.26 -0.24 115.29 125.03 3a7q s HIS 2094Ca -0.08 -1.62 -0.23 0.00 0.47 0.00 0.00 55.06 53.61 3a7q s HIS 2094Cb -0.15 -4.06 0.03 0.00 -0.13 0.00 0.00 32.58 28.27 3a7q s HIS 2094CO 0.05 -1.25 1.63 0.35 -2.47 0.00 0.00 174.74 173.04 3a7q h PHE 2095N 8.40 -0.66 0.00 3.88 3.57 -1.53 -2.90 116.94 127.71 3a7q h PHE 2095Ca 0.09 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.63 3a7q h PHE 2095Cb 1.04 0.33 0.00 0.00 2.79 0.00 0.00 35.95 40.10 3a7q h PHE 2095CO 1.08 -0.32 0.00 0.78 -2.23 0.00 0.00 178.31 177.62 3a7q h GLY 2096N -0.25 0.00 1.70 2.40 0.00 -1.48 0.74 103.07 106.18 3a7q h GLY 2096Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.22 3a7q h GLY 2096CO -0.39 0.00 -1.20 1.70 0.00 0.00 0.00 176.54 176.65 3a7q h LYS 2097N 0.00 0.12 0.06 4.80 3.64 -1.63 -3.38 116.57 120.18 3a7q h LYS 2097Ca 0.00 -0.20 -0.35 0.00 -1.27 0.00 0.00 60.65 58.83 3a7q h LYS 2097Cb 0.19 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.04 3a7q h LYS 2097CO 0.00 1.04 -1.97 1.28 -2.27 0.00 0.00 179.45 177.54 3a7q n LEU 2098N -3.39 2.45 -4.40 5.20 4.77 -0.58 -5.00 117.00 116.05 3a7q n LEU 2098Ca -0.06 0.21 -0.28 0.00 -0.03 0.00 0.00 56.01 55.85 3a7q n LEU 2098Cb 0.99 -1.02 -0.12 0.00 -2.33 0.00 0.00 43.42 40.93 3a7q n LEU 2098CO 0.49 0.71 -0.55 -1.00 -1.33 0.00 0.00 177.39 175.71 3a7q s HIS 2099N -2.50 2.29 0.84 -1.77 3.76 0.25 -5.12 115.29 113.03 3a7q s HIS 2099Ca -0.28 -0.37 -0.12 0.00 -0.15 0.00 0.00 55.06 54.14 3a7q s HIS 2099Cb 0.08 -1.20 0.10 0.00 1.11 0.00 0.00 32.58 32.67 3a7q s HIS 2099CO 0.67 0.40 1.17 -0.51 -0.85 0.00 0.00 174.74 175.61 3a7q s LEU 2100N -2.29 3.03 0.85 0.89 1.02 -1.26 -4.19 118.68 116.73 3a7q s LEU 2100Ca 0.16 2.23 -0.11 0.00 0.02 0.00 0.00 54.13 56.44 3a7q s LEU 2100Cb -0.09 -4.57 0.11 0.00 0.02 0.00 0.00 46.19 41.65 3a7q s LEU 2100CO 0.07 -2.74 1.09 0.00 0.02 0.00 0.00 176.35 174.79 3a7q s ALA 2101N -2.42 1.77 0.00 4.21 0.00 -1.26 -4.88 121.76 119.18 3a7q s ALA 2101Ca 0.69 0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.79 3a7q s ALA 2101Cb -0.25 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.62 3a7q s ALA 2101CO 0.53 -2.20 0.00 0.41 0.00 0.00 0.00 175.76 174.51 3a7q n GLY 2102N -0.97 -0.34 3.64 0.00 0.00 -0.83 -5.00 105.19 101.70 3a7q n GLY 2102Ca 0.08 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.01 3a7q n GLY 2102CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3a7q s SER 2103N -1.61 6.90 0.03 1.61 0.15 -1.26 -1.95 113.70 117.58 3a7q s SER 2103Ca 0.00 1.10 0.02 0.00 0.70 0.00 0.00 55.95 57.77 3a7q s SER 2103Cb 0.00 -2.48 -0.02 0.00 -1.71 0.00 0.00 66.02 61.81 3a7q s SER 2103CO 0.00 -0.62 -0.07 -0.69 1.20 0.00 0.00 173.24 173.06 3a7q s VAL 2104N 3.06 0.51 -0.05 4.45 1.01 0.75 -4.62 120.40 125.50 3a7q s VAL 2104Ca 0.39 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.49 3a7q s VAL 2104Cb -0.15 -0.55 -0.03 0.00 0.00 0.00 0.00 36.38 35.66 3a7q s VAL 2104CO 0.08 -0.28 -0.10 -0.60 0.00 0.00 0.00 175.10 174.21 3a7q s ARG 2105N -1.27 2.63 0.18 2.72 3.52 0.74 -0.46 118.95 127.01 3a7q s ARG 2105Ca -0.08 -0.62 0.10 0.00 -0.13 0.00 0.00 55.73 55.00 3a7q s ARG 2105Cb -0.08 -2.50 -0.04 0.00 -1.56 0.00 0.00 34.95 30.77 3a7q s ARG 2105CO 0.00 0.64 -0.21 -0.06 -0.81 0.00 0.00 175.30 174.86 3a7q s PHE 2106N -0.80 2.06 0.16 5.12 0.08 -1.26 0.32 117.98 123.66 3a7q s PHE 2106Ca 0.12 -0.41 -0.17 0.00 0.12 0.00 0.00 56.93 56.60 3a7q s PHE 2106Cb -0.11 -1.03 0.03 0.00 -0.57 0.00 0.00 43.02 41.35 3a7q s PHE 2106CO 0.02 0.41 0.46 -0.98 -0.10 0.00 0.00 175.22 175.03 3a7q s ARG 2107N -2.69 1.22 -0.33 0.44 1.70 -0.85 -0.75 118.95 117.71 3a7q s ARG 2107Ca 0.18 -0.78 0.01 0.00 -0.47 0.00 0.00 55.73 54.66 3a7q s ARG 2107Cb -0.07 0.50 0.08 0.00 -0.57 0.00 0.00 34.95 34.89 3a7q s ARG 2107CO 0.08 -0.50 0.04 -1.58 -1.08 0.00 0.00 175.30 172.26 3a7q s TRP 2108N -3.84 3.49 -0.11 5.89 0.51 -0.53 -1.72 118.94 122.63 3a7q s TRP 2108Ca 0.06 -2.43 0.00 0.00 -2.12 0.00 0.00 56.10 51.61 3a7q s TRP 2108Cb 0.01 -2.57 -0.02 0.00 -0.81 0.00 0.00 33.47 30.08 3a7q s TRP 2108CO -0.08 -0.90 -0.13 -0.47 -0.51 0.00 0.00 176.95 174.86 3a7q s TYR 2109N 1.09 2.80 -0.13 -1.98 5.04 0.36 -2.16 117.35 122.37 3a7q s TYR 2109Ca 0.02 -0.53 -0.14 0.00 -2.44 0.00 0.00 57.07 53.98 3a7q s TYR 2109Cb -0.20 -1.80 -0.05 0.00 0.35 0.00 0.00 41.96 40.25 3a7q s TYR 2109CO -0.05 -0.12 -0.28 0.94 -1.34 0.00 0.00 175.55 174.70 3a7q n GLN 2110N 3.27 0.43 -3.66 4.97 7.27 -0.88 0.40 117.38 129.18 3a7q n GLN 2110Ca -0.18 0.17 0.00 0.00 0.07 0.00 0.00 57.00 57.06 3a7q n GLN 2110Cb 0.53 -1.25 0.00 0.00 2.41 0.00 0.00 30.24 31.93 3a7q n GLN 2110CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3a7q n GLY 2111N 1.85 -1.10 3.26 1.69 0.00 -1.20 -4.70 105.19 104.99 3a7q n GLY 2111Ca -0.12 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 44.52 3a7q n GLY 2111CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3a7q s PHE 2112N -3.00 2.84 -0.26 1.61 2.19 -1.26 0.06 117.98 120.17 3a7q s PHE 2112Ca 0.00 -1.10 0.03 0.00 0.33 0.00 0.00 56.93 56.19 3a7q s PHE 2112Cb 0.00 -1.96 0.06 0.00 -1.31 0.00 0.00 43.02 39.81 3a7q s PHE 2112CO 0.00 -0.54 -0.10 0.71 1.83 0.00 0.00 175.22 177.12 3a7q s TYR 2113N 1.08 3.11 0.77 10.12 2.02 -0.31 -4.91 117.35 129.23 3a7q s TYR 2113Ca -0.00 -2.22 -0.15 0.00 -0.37 0.00 0.00 57.07 54.33 3a7q s TYR 2113Cb -0.14 -1.87 0.05 0.00 -0.40 0.00 0.00 41.96 39.59 3a7q s TYR 2113CO -0.03 -0.86 1.11 -2.30 -1.57 0.00 0.00 175.55 171.90 3a7q n PRO 2114N 4.47 0.39 -1.68 -1.71 -0.02 -1.26 -0.37 135.00 134.81 3a7q n PRO 2114Ca -0.14 0.20 -0.44 0.00 -2.02 0.00 0.00 63.50 61.10 3a7q n PRO 2114Cb 0.42 -2.36 -0.02 0.00 -0.02 0.00 0.00 33.50 31.52 3a7q n PRO 2114CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a7q n ALA 2115N -2.89 1.25 0.00 3.55 0.00 -1.26 -1.94 120.51 119.23 3a7q n ALA 2115Ca 0.13 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.97 3a7q n ALA 2115Cb 0.50 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.67 3a7q n ALA 2115CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a7q n GLY 2116N 1.67 2.99 3.50 0.00 0.00 -1.26 -5.07 105.19 107.03 3a7q n GLY 2116Ca 0.09 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 3a7q n GLY 2116CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3a7q n SER 2117N 0.57 -0.19 -3.26 1.61 7.64 -0.82 -4.97 113.62 114.20 3a7q n SER 2117Ca 0.00 0.95 -0.25 0.00 1.01 0.00 0.00 58.87 60.58 3a7q n SER 2117Cb 0.00 -1.19 -0.07 0.00 -1.01 0.00 0.00 64.21 61.94 3a7q n SER 2117CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3a7q n GLN 2118N 0.41 1.54 -1.69 1.43 6.02 -1.26 -4.64 117.38 119.20 3a7q n GLN 2118Ca 0.11 -3.85 -0.32 0.00 -0.01 0.00 0.00 57.00 52.93 3a7q n GLN 2118Cb 0.39 -1.69 0.05 0.00 1.02 0.00 0.00 30.24 30.01 3a7q n GLN 2118CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3a7q s PRO 2119N -1.90 2.90 0.32 -1.09 0.04 -1.26 -4.96 135.00 129.06 3a7q s PRO 2119Ca 0.38 1.14 -0.28 0.00 0.04 0.00 0.00 61.00 62.27 3a7q s PRO 2119Cb 0.19 -1.98 -0.13 0.00 0.04 0.00 0.00 34.50 32.62 3a7q s PRO 2119CO -0.07 -1.14 1.29 1.55 0.04 0.00 0.00 177.00 178.67 3a7q n VAL 2120N -2.76 1.85 -2.29 -0.36 3.14 -1.26 -4.31 118.33 112.34 3a7q n VAL 2120Ca 0.09 -0.46 -0.37 0.00 -2.96 0.00 0.00 64.34 60.63 3a7q n VAL 2120Cb 0.53 -1.52 -0.01 0.00 -1.06 0.00 0.00 33.84 31.78 3a7q n VAL 2120CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 3a7q s THR 2121N -0.94 3.18 0.22 1.55 2.01 -1.26 -4.70 115.64 115.69 3a7q s THR 2121Ca 0.57 0.88 -0.08 0.00 0.31 0.00 0.00 61.69 63.37 3a7q s THR 2121Cb -0.59 -3.45 -0.02 0.00 0.01 0.00 0.00 72.50 68.46 3a7q s THR 2121CO 0.60 -0.02 0.33 -1.66 -0.69 0.00 0.00 174.62 173.19 3a7q s TRP 2122N -1.57 0.62 -0.14 4.92 1.48 -0.99 -1.10 118.94 122.17 3a7q s TRP 2122Ca 0.63 -0.94 -0.18 0.00 -1.06 0.00 0.00 56.10 54.55 3a7q s TRP 2122Cb -0.28 -0.09 0.05 0.00 -1.16 0.00 0.00 33.47 31.99 3a7q s TRP 2122CO 0.34 -0.83 0.49 0.00 -4.06 0.00 0.00 176.95 172.88 3a7q s ALA 2123N -4.05 -1.21 0.21 2.67 0.00 -0.80 0.49 121.76 119.06 3a7q s ALA 2123Ca 0.27 1.21 0.07 0.00 0.00 0.00 0.00 51.96 53.50 3a7q s ALA 2123Cb 0.03 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 3a7q s ALA 2123CO 0.08 -0.25 0.10 0.96 0.00 0.00 0.00 175.76 176.65 3a7q s ILE 2124N -0.17 4.16 0.13 0.00 -4.36 -0.79 -1.61 121.20 118.57 3a7q s ILE 2124Ca -0.04 -1.37 -0.07 0.00 -0.26 0.00 0.00 60.65 58.92 3a7q s ILE 2124Cb -0.03 -3.17 -0.01 0.00 1.25 0.00 0.00 42.46 40.50 3a7q s ILE 2124CO 0.02 -0.22 0.20 -0.62 0.24 0.00 0.00 174.94 174.57 3a7q s ASP 2125N -3.36 0.14 -0.94 4.36 -1.08 -0.22 -1.70 116.67 113.87 3a7q s ASP 2125Ca 0.31 -0.89 -0.10 0.00 -0.52 0.00 0.00 52.55 51.35 3a7q s ASP 2125Cb -0.09 0.37 0.00 0.00 -1.46 0.00 0.00 42.92 41.75 3a7q s ASP 2125CO 0.22 -0.80 0.69 0.59 0.52 0.00 0.00 175.17 176.39 3a7q n ASN 2126N -0.13 -5.60 -4.63 -0.34 3.02 -1.11 -0.54 115.26 105.93 3a7q n ASN 2126Ca -0.09 -0.82 -0.39 0.00 -0.03 0.00 0.00 54.58 53.26 3a7q n ASN 2126Cb 0.63 -3.00 -0.09 0.00 -0.61 0.00 0.00 39.78 36.71 3a7q n ASN 2126CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3a7q s VAL 2127N -3.18 5.20 -0.14 2.41 1.01 -0.58 -3.89 120.40 121.24 3a7q s VAL 2127Ca 0.19 0.55 0.02 0.00 0.00 0.00 0.00 61.98 62.74 3a7q s VAL 2127Cb -0.08 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.64 3a7q s VAL 2127CO 0.86 0.20 -0.20 -0.47 0.00 0.00 0.00 175.10 175.50 3a7q s TYR 2128N 1.77 2.50 -0.18 5.22 5.04 0.18 -1.44 117.35 130.44 3a7q s TYR 2128Ca 0.15 -1.29 0.01 0.00 -2.44 0.00 0.00 57.07 53.50 3a7q s TYR 2128Cb -0.15 -1.73 0.02 0.00 0.35 0.00 0.00 41.96 40.45 3a7q s TYR 2128CO 0.09 -0.62 -0.18 0.42 -1.34 0.00 0.00 175.55 173.92 3a7q s ILE 2129N 0.97 1.98 -1.43 3.14 1.01 0.05 -0.05 121.20 126.88 3a7q s ILE 2129Ca -0.04 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.67 3a7q s ILE 2129Cb -0.15 -1.82 0.00 0.00 0.01 0.00 0.00 42.46 40.50 3a7q s ILE 2129CO -0.04 0.49 0.00 0.61 0.00 0.00 0.00 174.94 176.00 3a7q n GLY 2130N 4.63 -0.99 3.69 6.18 0.00 -1.01 -0.17 105.19 117.52 3a7q n GLY 2130Ca -0.20 -0.85 -0.45 0.00 0.00 0.00 0.00 46.02 44.53 3a7q n GLY 2130CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3a7q n PRO 2131N 0.00 2.26 -1.72 1.61 -0.04 -1.26 -0.57 135.00 135.28 3a7q n PRO 2131Ca 0.00 0.81 -0.38 0.00 -0.04 0.00 0.00 63.50 63.89 3a7q n PRO 2131Cb 0.00 -2.56 0.05 0.00 -0.04 0.00 0.00 33.50 30.95 3a7q n PRO 2131CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3a7q n GLN 2132N 2.86 1.53 -1.40 0.54 10.64 0.74 -3.24 117.38 129.04 3a7q n GLN 2132Ca 0.14 0.57 -0.30 0.00 -1.83 0.00 0.00 57.00 55.57 3a7q n GLN 2132Cb 0.31 -2.50 0.23 0.00 -0.86 0.00 0.00 30.24 27.42 3a7q n GLN 2132CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3a7q s GLU 2134N -5.67 4.54 -0.85 0.00 2.12 -1.26 -3.09 118.70 114.48 3a7q s GLU 2134Ca 0.74 1.86 0.00 0.00 0.36 0.00 0.00 54.97 57.93 3a7q s GLU 2134Cb -0.06 -3.21 0.00 0.00 0.26 0.00 0.00 34.13 31.12 3a7q s GLU 2134CO 0.55 0.03 0.00 0.39 -0.54 0.00 0.00 175.26 175.69 3a7q n GLU 2135N 1.86 -1.58 -1.59 4.30 -0.58 -1.26 -1.12 120.64 120.67 3a7q n GLU 2135Ca 0.02 0.60 -0.19 0.00 -0.42 0.00 0.00 57.16 57.17 3a7q n GLU 2135Cb 0.45 -4.66 -0.08 0.00 -0.57 0.00 0.00 31.44 26.58 3a7q n GLU 2135CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3a7q n MET 2136N -0.87 -1.32 -1.76 3.49 2.81 -1.18 -1.31 117.12 116.99 3a7q n MET 2136Ca -0.08 1.15 -0.15 0.00 -1.81 0.00 0.00 57.70 56.80 3a7q n MET 2136Cb 0.39 -5.46 -0.04 0.00 -0.71 0.00 0.00 33.22 27.40 3a7q n MET 2136CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3a7q n TYR 2138N -3.09 -0.21 -0.48 0.00 4.01 -0.42 -1.35 117.16 115.61 3a7q n TYR 2138Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 3a7q n TYR 2138Cb 0.55 -2.15 0.00 0.00 -0.31 0.00 0.00 39.34 37.44 3a7q n TYR 2138CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3a7q n GLY 2139N 0.12 1.47 2.32 2.72 0.00 -1.18 -3.30 105.19 107.34 3a7q n GLY 2139Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 3a7q n GLY 2139CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3a7q n HIS 2140N -2.00 3.07 -3.63 1.61 8.25 -0.46 -4.65 115.22 117.41 3a7q n HIS 2140Ca 0.00 -2.65 -0.01 0.00 -0.26 0.00 0.00 57.72 54.79 3a7q n HIS 2140Cb 0.00 -0.47 -0.02 0.00 1.12 0.00 0.00 29.99 30.62 3a7q n HIS 2140CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3a7q s GLY 2141N -3.10 -0.24 0.10 -1.41 0.00 -1.25 -0.40 107.32 101.01 3a7q s GLY 2141Ca 0.52 1.78 -0.11 0.00 0.00 0.00 0.00 44.72 46.90 3a7q s GLY 2141CO -0.10 0.57 0.45 -0.56 0.00 0.00 0.00 173.10 173.46 3a7q s SER 2142N -2.16 6.70 -0.26 1.64 0.01 -0.36 -4.86 113.70 114.42 3a7q s SER 2142Ca 0.12 0.89 -0.12 0.00 1.31 0.00 0.00 55.95 58.15 3a7q s SER 2142Cb 0.00 -2.21 -0.05 0.00 0.21 0.00 0.00 66.02 63.97 3a7q s SER 2142CO -0.03 0.15 0.25 0.00 0.41 0.00 0.00 173.24 174.03 3a7q s ILE 2144N 1.64 5.24 0.00 0.00 -1.09 0.07 -4.69 121.20 122.36 3a7q s ILE 2144Ca 0.10 -0.11 0.00 0.00 -2.23 0.00 0.00 60.65 58.41 3a7q s ILE 2144Cb -0.15 -3.75 0.00 0.00 -1.58 0.00 0.00 42.46 36.97 3a7q s ILE 2144CO 0.09 -0.04 0.00 0.59 -1.23 0.00 0.00 174.94 174.35 3a7q n ASN 2145N 5.21 -2.84 0.00 3.58 3.02 -1.26 -2.19 115.26 120.78 3a7q n ASN 2145Ca -0.11 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.44 3a7q n ASN 2145Cb 0.50 -2.58 0.00 0.00 -0.61 0.00 0.00 39.78 37.09 3a7q n ASN 2145CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a7q n GLY 2146N -0.15 0.60 0.00 7.41 0.00 -1.20 -4.71 105.19 107.15 3a7q n GLY 2146Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 3a7q n GLY 2146CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3a7q n THR 2147N -2.76 0.00 -4.73 2.61 -2.24 -0.93 -4.37 114.28 101.87 3a7q n THR 2147Ca 0.00 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.55 3a7q n THR 2147Cb 0.00 -0.55 -0.15 0.00 -2.10 0.00 0.00 70.33 67.53 3a7q n THR 2147CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3a7q s LYS 2148N -1.74 1.27 -0.09 -0.78 2.20 -1.11 -4.91 119.74 114.57 3a7q s LYS 2148Ca 0.00 -0.55 -0.02 0.00 -0.36 0.00 0.00 55.97 55.04 3a7q s LYS 2148Cb 0.00 -1.22 -0.03 0.00 -1.51 0.00 0.00 37.83 35.07 3a7q s LYS 2148CO 0.00 0.33 -0.02 0.00 -0.36 0.00 0.00 175.35 175.30 3a7q s ILE 2150N -0.67 5.00 0.21 0.00 1.01 0.82 -4.93 121.20 122.64 3a7q s ILE 2150Ca 0.10 -1.94 -0.31 0.00 0.00 0.00 0.00 60.65 58.50 3a7q s ILE 2150Cb -0.12 -4.19 -0.10 0.00 0.01 0.00 0.00 42.46 38.06 3a7q s ILE 2150CO 0.02 -0.90 1.55 0.00 0.00 0.00 0.00 174.94 175.62 3a7q n ASP 2152N 3.31 0.85 -4.68 0.00 8.00 0.46 -4.81 116.55 119.67 3a7q n ASP 2152Ca 0.11 0.86 -0.55 0.00 0.71 0.00 0.00 54.79 55.92 3a7q n ASP 2152Cb 0.38 -1.38 -0.07 0.00 -0.02 0.00 0.00 41.12 40.04 3a7q n ASP 2152CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 3a7q n PRO 2153N -0.69 1.26 0.00 -0.24 -0.04 -1.26 -0.97 135.00 133.06 3a7q n PRO 2153Ca 0.12 0.46 0.00 0.00 -0.04 0.00 0.00 63.50 64.05 3a7q n PRO 2153Cb 0.45 -2.15 0.00 0.00 -0.04 0.00 0.00 33.50 31.76 3a7q n PRO 2153CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3a7q n GLY 2154N 3.87 2.64 3.69 0.55 0.00 -1.26 -5.06 105.19 109.61 3a7q n GLY 2154Ca 0.24 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.94 3a7q n GLY 2154CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a7q s TYR 2155N -2.59 3.09 0.06 1.61 1.51 -0.15 -2.37 117.35 118.52 3a7q s TYR 2155Ca 0.00 0.08 0.00 0.00 -1.01 0.00 0.00 57.07 56.15 3a7q s TYR 2155Cb 0.00 -1.67 -0.00 0.00 -0.11 0.00 0.00 41.96 40.18 3a7q s TYR 2155CO 0.00 0.47 0.08 0.43 -1.11 0.00 0.00 175.55 175.41 3a7q n SER 2156N 1.32 -0.20 0.00 2.29 7.64 -1.12 -4.65 113.62 118.90 3a7q n SER 2156Ca -0.14 -1.37 0.00 0.00 1.01 0.00 0.00 58.87 58.37 3a7q n SER 2156Cb 0.53 0.41 0.00 0.00 -1.01 0.00 0.00 64.21 64.13 3a7q n SER 2156CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3a7q n GLY 2157N -0.11 -2.81 0.00 0.23 0.00 -1.26 -3.03 105.19 98.21 3a7q n GLY 2157Ca 0.01 -1.22 0.01 0.00 0.00 0.00 0.00 46.02 44.81 3a7q n GLY 2157CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3a7q n PRO 2158N -1.11 0.05 0.00 1.61 -0.02 -1.26 -0.78 135.00 133.50 3a7q n PRO 2158Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3a7q n PRO 2158Cb 0.00 -1.40 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 3a7q n PRO 2158CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 3a7q n THR 2159N -0.90 0.19 -1.43 3.45 5.66 -1.26 -4.38 114.28 115.61 3a7q n THR 2159Ca 0.01 -0.28 -0.15 0.00 -3.05 0.00 0.00 64.05 60.59 3a7q n THR 2159Cb 0.00 1.21 -0.06 0.00 -1.55 0.00 0.00 70.33 69.93 3a7q n THR 2159CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3a7q h LYS 2161N 0.00 0.42 -6.59 0.00 2.10 -1.76 -3.42 116.57 107.31 3a7q h LYS 2161Ca -0.30 -0.21 -0.53 0.00 -2.00 0.00 0.00 60.65 57.62 3a7q h LYS 2161Cb 0.95 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.30 3a7q h LYS 2161CO 0.44 0.76 0.64 0.96 -2.00 0.00 0.00 179.45 180.25 3a7q s ILE 2162N -4.41 3.48 -0.12 0.07 -4.36 -1.19 -4.96 121.20 109.72 3a7q s ILE 2162Ca -0.14 1.13 -0.00 0.00 -0.26 0.00 0.00 60.65 61.38 3a7q s ILE 2162Cb 0.06 -3.73 -0.02 0.00 1.25 0.00 0.00 42.46 40.02 3a7q s ILE 2162CO 0.76 0.13 -0.11 -0.55 0.24 0.00 0.00 174.94 175.41 3a7q s SER 2163N 0.71 4.19 0.53 4.36 0.15 -1.26 -2.78 113.70 119.60 3a7q s SER 2163Ca 0.59 -0.26 -0.20 0.00 0.70 0.00 0.00 55.95 56.79 3a7q s SER 2163Cb -0.34 -1.52 -0.07 0.00 -1.71 0.00 0.00 66.02 62.38 3a7q s SER 2163CO 0.33 0.20 1.10 0.28 1.20 0.00 0.00 173.24 176.35 3a7q s THR 2164N 0.14 3.39 -0.46 6.45 -1.32 -1.00 -4.86 115.64 117.98 3a7q s THR 2164Ca -0.06 0.86 -0.34 0.00 -1.21 0.00 0.00 61.69 60.94 3a7q s THR 2164Cb -0.15 -3.34 -0.13 0.00 -1.51 0.00 0.00 72.50 67.37 3a7q s THR 2164CO 0.04 -0.19 2.29 1.17 -2.21 0.00 0.00 174.62 175.72 3a7q n LYS 2165N -1.21 0.87 -2.05 7.08 3.00 -1.26 -4.94 118.16 119.63 3a7q n LYS 2165Ca 0.11 0.19 -0.32 0.00 -0.00 0.00 0.00 58.31 58.29 3a7q n LYS 2165Cb 0.51 -2.42 -0.00 0.00 0.00 0.00 0.00 35.03 33.13 3a7q n LYS 2165CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 3a7q s ASN 2166N 8.16 6.20 0.50 3.14 0.01 -1.26 -5.04 114.94 126.64 3a7q s ASN 2166Ca 1.12 1.56 -0.21 0.00 -0.71 0.00 0.00 52.86 54.62 3a7q s ASN 2166Cb -0.85 -2.50 -0.07 0.00 0.41 0.00 0.00 41.25 38.24 3a7q s ASN 2166CO 0.47 -0.89 1.14 -2.16 -1.51 0.00 0.00 177.10 174.15 3a7q s PRO 2167N -4.57 3.60 -0.17 -0.60 0.04 -1.26 -4.20 135.00 127.84 3a7q s PRO 2167Ca 0.58 1.66 0.16 0.00 0.04 0.00 0.00 61.00 63.45 3a7q s PRO 2167Cb -0.12 -2.21 0.73 0.00 0.04 0.00 0.00 34.50 32.94 3a7q s PRO 2167CO 0.43 -0.66 1.65 -0.40 0.04 0.00 0.00 177.00 178.05 3a7q n ASP 2168N -0.87 5.01 -3.78 6.66 3.85 -1.26 -0.83 116.55 125.34 3a7q n ASP 2168Ca 0.09 -2.70 -0.13 0.00 -0.71 0.00 0.00 54.79 51.35 3a7q n ASP 2168Cb 0.50 -0.61 -0.12 0.00 -1.35 0.00 0.00 41.12 39.54 3a7q n ASP 2168CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 3a7q s PHE 2169N -2.31 -0.27 -0.03 2.11 5.36 -1.26 -4.38 117.98 117.20 3a7q s PHE 2169Ca 0.51 0.66 -0.00 0.00 -0.96 0.00 0.00 56.93 57.14 3a7q s PHE 2169Cb 0.36 0.08 0.03 0.00 -0.34 0.00 0.00 43.02 43.15 3a7q s PHE 2169CO 0.19 -0.14 0.01 -1.17 -1.46 0.00 0.00 175.22 172.65 3a7q s LEU 2170N 0.33 0.99 -0.09 6.12 0.20 0.63 -4.97 118.68 121.90 3a7q s LEU 2170Ca -0.02 -0.00 -0.02 0.00 0.69 0.00 0.00 54.13 54.78 3a7q s LEU 2170Cb -0.03 -0.20 0.03 0.00 -0.43 0.00 0.00 46.19 45.56 3a7q s LEU 2170CO -0.01 -0.13 0.01 -0.75 -0.29 0.00 0.00 176.35 175.17 3a7q s LYS 2171N 1.22 0.60 -0.14 1.98 2.36 -1.26 -0.42 119.74 124.09 3a7q s LYS 2171Ca -0.07 0.04 -0.02 0.00 -2.55 0.00 0.00 55.97 53.38 3a7q s LYS 2171Cb -0.13 -1.12 0.04 0.00 -1.05 0.00 0.00 37.83 35.56 3a7q s LYS 2171CO -0.02 -0.35 -0.01 0.34 1.55 0.00 0.00 175.35 176.86 3a7q s ASP 2172N 1.96 2.34 0.12 1.43 3.68 0.24 -4.98 116.67 121.46 3a7q s ASP 2172Ca 0.04 -0.47 0.23 0.00 2.13 0.00 0.00 52.55 54.49 3a7q s ASP 2172Cb -0.13 -0.63 0.14 0.00 -1.45 0.00 0.00 42.92 40.85 3a7q s ASP 2172CO -0.06 -0.22 1.13 -0.90 0.13 0.00 0.00 175.17 175.26 3a7q n ASP 2173N 5.04 0.69 -0.26 -0.34 3.85 -1.26 -1.46 116.55 122.80 3a7q n ASP 2173Ca -0.09 0.08 -0.03 0.00 -0.71 0.00 0.00 54.79 54.03 3a7q n ASP 2173Cb 0.49 0.48 -0.01 0.00 -1.35 0.00 0.00 41.12 40.72 3a7q n ASP 2173CO 0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.20 176.68 3a7q n PHE 2174N -2.23 -0.01 2.00 2.11 3.72 -1.26 -4.60 117.46 117.19 3a7q n PHE 2174Ca 0.02 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.57 3a7q n PHE 2174Cb 0.47 -2.18 0.90 0.00 -0.94 0.00 0.00 39.48 37.73 3a7q n PHE 2174CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3a7q n GLU 2175N 0.41 1.01 0.00 -1.08 -0.58 -1.26 -4.63 120.64 114.50 3a7q n GLU 2175Ca -0.03 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 3a7q n GLU 2175Cb 0.51 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.90 3a7q n GLU 2175CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3a7q n GLY 2176N 0.98 0.83 0.66 0.62 0.00 -1.26 -5.00 105.19 102.01 3a7q n GLY 2176Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3a7q n GLY 2176CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3a7q n ASP 2181N 0.00 0.00 0.19 1.61 5.75 -1.26 -5.25 116.55 117.59 3a7q n ASP 2181Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 54.79 54.81 3a7q n ASP 2181Cb 0.00 0.00 0.42 0.00 -1.03 0.00 0.00 41.12 40.51 3a7q n ASP 2181CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 3a7q h ARG 2182N 0.00 0.05 -6.59 0.11 -0.00 -1.98 -3.43 114.38 102.54 3a7q h ARG 2182Ca 0.00 -0.01 -0.69 0.00 -0.50 0.00 0.00 59.98 58.77 3a7q h ARG 2182Cb 0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 29.97 29.71 3a7q h ARG 2182CO 0.00 0.30 -0.84 -0.06 0.00 0.00 0.00 179.97 179.37 3a7q s PHE 2183N -4.47 2.46 -0.11 3.04 0.08 -1.26 -1.04 117.98 116.69 3a7q s PHE 2183Ca -0.04 -0.33 -0.17 0.00 0.12 0.00 0.00 56.93 56.51 3a7q s PHE 2183Cb 0.15 -1.48 -0.27 0.00 -0.57 0.00 0.00 43.02 40.85 3a7q s PHE 2183CO 0.72 0.13 0.58 -0.07 -0.10 0.00 0.00 175.22 176.48 3a7q h LEU 2184N 4.98 0.35 -8.06 -0.37 3.38 -0.84 -3.46 115.31 111.30 3a7q h LEU 2184Ca -0.46 -0.85 -0.29 0.00 0.09 0.00 0.00 57.88 56.37 3a7q h LEU 2184Cb 1.14 -0.11 -0.24 0.00 0.09 0.00 0.00 40.66 41.54 3a7q h LEU 2184CO 0.47 1.56 -0.74 -1.48 0.09 0.00 0.00 178.44 178.33 3a7q s LEU 2185N -7.64 2.16 -0.48 1.67 0.05 -1.22 -5.00 118.68 108.23 3a7q s LEU 2185Ca -0.20 -0.37 0.03 0.00 0.05 0.00 0.00 54.13 53.64 3a7q s LEU 2185Cb 0.04 -0.20 0.14 0.00 -2.05 0.00 0.00 46.19 44.12 3a7q s LEU 2185CO 0.76 -0.10 0.27 -0.04 -0.55 0.00 0.00 176.35 176.68 3a7q s MET 2186N -1.02 1.53 -0.19 1.48 1.00 -1.26 -1.54 119.30 119.30 3a7q s MET 2186Ca -0.06 -2.26 -0.07 0.00 0.00 0.00 0.00 55.69 53.30 3a7q s MET 2186Cb -0.07 -2.63 -0.04 0.00 0.00 0.00 0.00 34.83 32.09 3a7q s MET 2186CO 0.00 -1.17 0.06 0.45 0.00 0.00 0.00 175.02 174.37 3a7q s SER 2187N 0.05 5.56 0.00 3.03 0.15 0.12 -4.53 113.70 118.08 3a7q s SER 2187Ca 0.19 0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.87 3a7q s SER 2187Cb -0.22 -1.96 0.00 0.00 -1.71 0.00 0.00 66.02 62.13 3a7q s SER 2187CO -0.02 0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.17 3a7q n GLY 2188N 3.75 0.70 3.35 9.45 0.00 -1.13 -0.98 105.19 120.34 3a7q n GLY 2188Ca -0.16 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 3a7q n GLY 2188CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3a7q s GLY 2189N -2.34 -0.41 0.30 -0.02 0.00 -1.26 -3.30 107.32 100.30 3a7q s GLY 2189Ca 0.00 1.73 0.03 0.00 0.00 0.00 0.00 44.72 46.48 3a7q s GLY 2189CO 0.00 1.98 0.46 0.54 0.00 0.00 0.00 173.10 176.08 3a7q s LYS 2190N 1.69 3.40 -0.18 2.90 1.02 -1.00 -4.80 119.74 122.77 3a7q s LYS 2190Ca -0.08 -0.61 -0.29 0.00 0.02 0.00 0.00 55.97 55.00 3a7q s LYS 2190Cb -0.08 -2.78 -0.01 0.00 -0.52 0.00 0.00 37.83 34.44 3a7q s LYS 2190CO -0.14 0.25 1.15 -2.14 -0.92 0.00 0.00 175.35 173.55 3a7q s PRO 2191N -4.16 4.27 0.15 -1.68 0.02 -1.26 -0.37 135.00 131.97 3a7q s PRO 2191Ca 0.38 1.53 0.01 0.00 0.02 0.00 0.00 61.00 62.94 3a7q s PRO 2191Cb -0.09 -3.68 -0.04 0.00 0.02 0.00 0.00 34.50 30.70 3a7q s PRO 2191CO 0.32 -0.62 -0.01 -1.12 -0.33 0.00 0.00 177.00 175.24 3a7q s SER 2192N 1.57 1.09 0.00 2.53 0.01 0.94 -4.90 113.70 114.94 3a7q s SER 2192Ca 0.50 -1.14 0.23 0.00 1.31 0.00 0.00 55.95 56.85 3a7q s SER 2192Cb -0.19 0.13 0.04 0.00 0.21 0.00 0.00 66.02 66.22 3a7q s SER 2192CO 0.12 -0.57 1.13 0.54 0.41 0.00 0.00 173.24 174.87 3a7q n ARG 2193N -0.18 1.38 -2.12 12.44 1.74 -1.26 0.20 116.66 128.85 3a7q n ARG 2193Ca -0.08 -1.13 -0.41 0.00 -0.77 0.00 0.00 57.85 55.46 3a7q n ARG 2193Cb 0.63 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.57 3a7q n ARG 2193CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3a7q s LYS 2194N -2.40 4.36 -0.51 5.56 1.02 -1.26 -3.29 119.74 123.22 3a7q s LYS 2194Ca 0.20 2.20 0.00 0.00 0.02 0.00 0.00 55.97 58.39 3a7q s LYS 2194Cb 0.18 -3.09 0.00 0.00 -0.52 0.00 0.00 37.83 34.41 3a7q s LYS 2194CO 0.53 -0.21 0.00 0.00 -0.92 0.00 0.00 175.35 174.75 3a7q n GLY 2196N -1.64 -0.73 0.02 0.00 0.00 -1.21 -4.93 105.19 96.70 3a7q n GLY 2196Ca -0.05 0.12 -0.01 0.00 0.00 0.00 0.00 46.02 46.08 3a7q n GLY 2196CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3a7q h ILE 2197N 1.24 0.00 -3.66 -0.61 5.03 -1.92 -3.47 117.51 114.12 3a7q h ILE 2197Ca -0.42 -0.26 -0.60 0.00 -0.12 0.00 0.00 64.86 63.46 3a7q h ILE 2197Cb 1.36 0.00 -0.11 0.00 -3.03 0.00 0.00 36.82 35.05 3a7q h ILE 2197CO 0.55 0.00 0.55 -0.76 -0.68 0.00 0.00 178.15 177.81 3a7q s LEU 2198N -5.46 4.04 0.00 1.44 1.43 -1.26 -4.93 118.68 113.94 3a7q s LEU 2198Ca -0.04 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 3a7q s LEU 2198Cb 0.01 -3.16 0.00 0.00 0.03 0.00 0.00 46.19 43.06 3a7q s LEU 2198CO 0.05 -1.04 0.47 -1.20 0.23 0.00 0.00 176.35 174.87 3a7q n SER 2199N 7.12 0.67 -0.01 2.29 7.64 -1.26 -2.78 113.62 127.29 3a7q n SER 2199Ca 0.06 -1.61 -0.17 0.00 1.01 0.00 0.00 58.87 58.15 3a7q n SER 2199Cb 0.48 -0.33 -0.13 0.00 -1.01 0.00 0.00 64.21 63.22 3a7q n SER 2199CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3a7q h SER 2200N 0.16 0.27 0.00 6.43 0.02 -1.99 -3.44 113.55 115.00 3a7q h SER 2200Ca 0.00 -0.94 0.00 0.00 -0.84 0.00 0.00 61.79 60.01 3a7q h SER 2200Cb 0.33 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.79 3a7q h SER 2200CO 0.00 1.19 0.00 0.61 -1.14 0.00 0.00 176.83 177.49 3a7q n GLY 2201N 1.55 1.59 3.76 -3.77 0.00 -1.12 -5.11 105.19 102.09 3a7q n GLY 2201Ca -0.12 0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 3a7q n GLY 2201CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a7q s ASN 2202N 2.00 5.39 0.33 1.61 -0.87 -1.26 -4.84 114.94 117.30 3a7q s ASN 2202Ca 0.00 2.27 0.03 0.00 -1.57 0.00 0.00 52.86 53.59 3a7q s ASN 2202Cb 0.00 -2.59 -0.04 0.00 -0.02 0.00 0.00 41.25 38.60 3a7q s ASN 2202CO 0.00 -1.45 0.12 0.54 -2.57 0.00 0.00 177.10 173.74 3a7q s ASN 2203N -1.75 2.01 -0.35 -1.22 2.20 0.13 -4.60 114.94 111.36 3a7q s ASN 2203Ca 0.75 -1.52 -0.15 0.00 -0.94 0.00 0.00 52.86 50.99 3a7q s ASN 2203Cb -0.27 0.28 -0.01 0.00 -2.00 0.00 0.00 41.25 39.25 3a7q s ASN 2203CO 0.31 -0.82 0.34 -0.22 -2.94 0.00 0.00 177.10 173.78 3a7q s LEU 2204N -3.45 4.48 -0.35 3.54 2.96 -0.46 -0.04 118.68 125.35 3a7q s LEU 2204Ca 0.33 -0.29 -0.09 0.00 -0.22 0.00 0.00 54.13 53.86 3a7q s LEU 2204Cb 0.06 -2.31 0.03 0.00 0.50 0.00 0.00 46.19 44.47 3a7q s LEU 2204CO 0.16 -0.33 0.15 0.12 -1.32 0.00 0.00 176.35 175.13 3a7q s PHE 2205N 1.97 3.24 -1.07 5.38 5.36 0.50 -2.12 117.98 131.24 3a7q s PHE 2205Ca 0.11 -1.15 -0.15 0.00 -0.96 0.00 0.00 56.93 54.77 3a7q s PHE 2205Cb -0.17 -2.35 0.17 0.00 -0.34 0.00 0.00 43.02 40.33 3a7q s PHE 2205CO 0.11 -0.67 1.25 -0.06 -1.46 0.00 0.00 175.22 174.39 3a7q s PHE 2206N 1.49 3.44 -0.11 10.12 0.08 -0.42 -2.37 117.98 130.20 3a7q s PHE 2206Ca 0.00 -1.89 0.03 0.00 0.12 0.00 0.00 56.93 55.20 3a7q s PHE 2206Cb -0.19 -4.23 -0.03 0.00 -0.57 0.00 0.00 43.02 37.99 3a7q s PHE 2206CO 0.05 -1.37 0.11 -1.71 -0.10 0.00 0.00 175.22 172.20 3a7q n ASN 2207N 5.64 1.02 -4.31 1.36 5.15 -1.24 -2.74 115.26 120.15 3a7q n ASN 2207Ca 0.29 -0.45 -0.30 0.00 -0.60 0.00 0.00 54.58 53.53 3a7q n ASN 2207Cb 0.45 1.03 0.16 0.00 -0.53 0.00 0.00 39.78 40.89 3a7q n ASN 2207CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3a7q s GLU 2208N -1.46 0.91 0.25 1.20 2.02 -1.21 -4.98 118.70 115.42 3a7q s GLU 2208Ca 0.01 -0.28 0.06 0.00 0.02 0.00 0.00 54.97 54.78 3a7q s GLU 2208Cb 0.02 -1.86 -0.03 0.00 0.10 0.00 0.00 34.13 32.35 3a7q s GLU 2208CO 0.12 -2.25 0.29 -0.51 0.02 0.00 0.00 175.26 172.93 3a7q s ASP 2209N -4.79 5.96 0.00 -0.19 1.01 -1.26 -4.86 116.67 112.54 3a7q s ASP 2209Ca 0.71 -0.08 0.00 0.00 0.71 0.00 0.00 52.55 53.89 3a7q s ASP 2209Cb -0.06 -1.63 0.00 0.00 1.01 0.00 0.00 42.92 42.24 3a7q s ASP 2209CO 0.52 -0.07 0.00 0.61 0.21 0.00 0.00 175.17 176.44 3a7q n GLY 2210N -1.32 0.79 3.42 0.21 0.00 0.18 -3.59 105.19 104.89 3a7q n GLY 2210Ca -0.08 -1.11 -0.34 0.00 0.00 0.00 0.00 46.02 44.49 3a7q n GLY 2210CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3a7q s LEU 2211N 0.00 3.13 -0.47 0.99 2.96 -1.26 -4.00 118.68 120.02 3a7q s LEU 2211Ca 0.00 -0.23 -0.10 0.00 -0.22 0.00 0.00 54.13 53.58 3a7q s LEU 2211Cb 0.00 -1.78 0.12 0.00 0.50 0.00 0.00 46.19 45.03 3a7q s LEU 2211CO 0.00 0.08 0.35 -0.13 -1.32 0.00 0.00 176.35 175.33 3a7q s ARG 2212N 0.89 2.51 -0.21 1.98 0.52 -1.26 -2.82 118.95 120.57 3a7q s ARG 2212Ca -0.00 -1.74 -0.19 0.00 -0.52 0.00 0.00 55.73 53.28 3a7q s ARG 2212Cb -0.14 -3.94 0.05 0.00 0.52 0.00 0.00 34.95 31.44 3a7q s ARG 2212CO 0.01 -1.19 0.55 1.41 0.02 0.00 0.00 175.30 176.11 3a7q s MET 2213N 1.38 0.64 -0.05 3.54 1.75 -0.15 -0.95 119.30 125.46 3a7q s MET 2213Ca 0.05 0.76 0.02 0.00 -1.25 0.00 0.00 55.69 55.28 3a7q s MET 2213Cb -0.26 0.31 0.01 0.00 2.84 0.00 0.00 34.83 37.73 3a7q s MET 2213CO -0.00 -0.08 -0.10 -1.17 -0.65 0.00 0.00 175.02 173.02 3a7q s LEU 2214N 0.29 1.65 -0.06 4.11 2.96 0.57 0.16 118.68 128.36 3a7q s LEU 2214Ca -0.00 -0.23 -0.00 0.00 -0.22 0.00 0.00 54.13 53.67 3a7q s LEU 2214Cb -0.04 -0.68 0.03 0.00 0.50 0.00 0.00 46.19 46.00 3a7q s LEU 2214CO 0.01 0.04 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.37 3a7q s VAL 2215N 0.51 0.43 0.78 1.68 1.01 -0.59 -0.72 120.40 123.49 3a7q s VAL 2215Ca -0.10 0.01 -0.11 0.00 0.00 0.00 0.00 61.98 61.78 3a7q s VAL 2215Cb -0.13 -0.53 0.06 0.00 0.00 0.00 0.00 36.38 35.78 3a7q s VAL 2215CO 0.02 0.24 1.10 0.42 0.00 0.00 0.00 175.10 176.87 3a7q s THR 2216N 1.44 3.13 0.86 3.92 -4.23 0.04 -0.30 115.64 120.50 3a7q s THR 2216Ca -0.03 0.37 -0.12 0.00 -1.18 0.00 0.00 61.69 60.73 3a7q s THR 2216Cb -0.13 -3.19 0.11 0.00 1.34 0.00 0.00 72.50 70.63 3a7q s THR 2216CO -0.03 -0.48 1.10 0.00 -0.54 0.00 0.00 174.62 174.67 3a7q s ARG 2217N -5.22 1.55 0.10 3.99 1.04 -0.20 -4.25 118.95 115.96 3a7q s ARG 2217Ca 0.60 0.68 -0.31 0.00 -1.04 0.00 0.00 55.73 55.66 3a7q s ARG 2217Cb -0.13 -1.85 -0.08 0.00 -2.04 0.00 0.00 34.95 30.84 3a7q s ARG 2217CO 0.53 -2.00 1.49 -0.51 -0.04 0.00 0.00 175.30 174.78 3a7q s ASP 2218N -3.68 6.72 0.11 -2.89 1.01 -1.26 -4.56 116.67 112.12 3a7q s ASP 2218Ca 0.62 2.41 0.10 0.00 0.71 0.00 0.00 52.55 56.39 3a7q s ASP 2218Cb -0.16 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.15 3a7q s ASP 2218CO 0.55 -0.76 -0.24 -0.76 0.21 0.00 0.00 175.17 174.18 3a7q s LEU 2219N 1.60 2.30 -0.56 1.23 1.43 0.20 -4.54 118.68 120.34 3a7q s LEU 2219Ca 0.68 -0.71 -0.26 0.00 -1.03 0.00 0.00 54.13 52.81 3a7q s LEU 2219Cb -0.39 -1.07 0.04 0.00 0.03 0.00 0.00 46.19 44.80 3a7q s LEU 2219CO 0.30 0.13 1.05 -0.62 0.23 0.00 0.00 176.35 177.44 3a7q s ASP 2220N -1.93 6.40 -0.08 2.29 2.15 -0.01 0.30 116.67 125.78 3a7q s ASP 2220Ca 0.10 -0.13 0.11 0.00 0.43 0.00 0.00 52.55 53.07 3a7q s ASP 2220Cb -0.10 -2.49 0.27 0.00 -0.30 0.00 0.00 42.92 40.31 3a7q s ASP 2220CO 0.05 -1.32 1.20 0.18 -0.17 0.00 0.00 175.17 175.10 3a7q n LEU 2221N 7.85 2.75 -0.09 -1.34 4.77 -0.53 -4.06 117.00 126.35 3a7q n LEU 2221Ca 0.05 -2.53 0.15 0.00 -0.03 0.00 0.00 56.01 53.65 3a7q n LEU 2221Cb 0.48 -0.29 0.54 0.00 -2.33 0.00 0.00 43.42 41.82 3a7q n LEU 2221CO 0.67 0.65 1.19 0.77 -1.33 0.00 0.00 177.39 179.34 3a7q h SER 2222N 0.89 0.30 0.00 -1.43 4.64 -1.85 -2.69 113.55 113.41 3a7q h SER 2222Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3a7q h SER 2222Cb 0.91 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 3a7q h SER 2222CO 0.05 0.17 -0.01 0.00 -0.87 0.00 0.00 176.83 176.17 3a7q n HIS 2223N -4.46 0.00 -2.01 4.77 1.44 -1.26 -4.82 115.22 108.88 3a7q n HIS 2223Ca 0.11 -0.46 -0.37 0.00 -2.01 0.00 0.00 57.72 54.99 3a7q n HIS 2223Cb 0.46 -0.05 0.03 0.00 0.12 0.00 0.00 29.99 30.55 3a7q n HIS 2223CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3a7q s ALA 2224N -1.01 2.68 -0.16 1.59 0.00 -1.01 -0.81 121.76 123.04 3a7q s ALA 2224Ca 0.03 1.06 0.14 0.00 0.00 0.00 0.00 51.96 53.19 3a7q s ALA 2224Cb 0.03 -3.46 -0.19 0.00 0.00 0.00 0.00 23.12 19.49 3a7q s ALA 2224CO 0.00 -1.11 0.04 -2.13 0.00 0.00 0.00 175.76 172.57 3a7q n ARG 2225N -1.26 1.35 -3.69 0.00 3.00 0.26 -4.65 116.66 111.67 3a7q n ARG 2225Ca 0.12 -0.00 -0.12 0.00 -0.00 0.00 0.00 57.85 57.85 3a7q n ARG 2225Cb 0.48 -1.41 -0.06 0.00 0.00 0.00 0.00 32.46 31.47 3a7q n ARG 2225CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.63 177.04 3a7q s PHE 2226N -2.39 -0.19 -0.07 -0.14 -0.12 -0.61 -2.16 117.98 112.30 3a7q s PHE 2226Ca -0.09 0.05 0.02 0.00 -0.05 0.00 0.00 56.93 56.86 3a7q s PHE 2226Cb 0.05 0.18 0.01 0.00 -0.63 0.00 0.00 43.02 42.63 3a7q s PHE 2226CO 0.64 -0.58 -0.12 0.54 -0.05 0.00 0.00 175.22 175.66 3a7q s VAL 2227N -2.82 1.13 0.04 -2.49 0.11 -0.20 -2.25 120.40 113.92 3a7q s VAL 2227Ca -0.03 -0.46 0.01 0.00 -2.93 0.00 0.00 61.98 58.57 3a7q s VAL 2227Cb -0.00 -1.05 -0.03 0.00 -1.53 0.00 0.00 36.38 33.78 3a7q s VAL 2227CO -0.05 0.36 -0.06 0.00 -3.33 0.00 0.00 175.10 172.02 3a7q s GLN 2228N 0.79 0.50 -0.02 1.54 -2.07 -0.05 -0.39 119.66 119.96 3a7q s GLN 2228Ca -0.12 -0.80 -0.30 0.00 -1.82 0.00 0.00 55.36 52.32 3a7q s GLN 2228Cb -0.15 -0.14 0.11 0.00 -1.09 0.00 0.00 33.01 31.74 3a7q s GLN 2228CO 0.02 0.00 1.11 -0.59 -1.32 0.00 0.00 175.29 174.51 3a7q s PHE 2229N -1.78 -0.15 -0.07 9.60 -0.12 0.09 -1.09 117.98 124.46 3a7q s PHE 2229Ca -0.09 0.01 -0.08 0.00 -0.05 0.00 0.00 56.93 56.72 3a7q s PHE 2229Cb -0.07 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.83 3a7q s PHE 2229CO -0.01 -0.44 0.21 -0.06 -0.05 0.00 0.00 175.22 174.87 3a7q s PHE 2230N -2.77 3.62 -0.13 3.49 0.08 0.22 -1.26 117.98 121.23 3a7q s PHE 2230Ca 0.11 0.62 -0.11 0.00 0.12 0.00 0.00 56.93 57.67 3a7q s PHE 2230Cb 0.01 -2.01 0.04 0.00 -0.57 0.00 0.00 43.02 40.48 3a7q s PHE 2230CO -0.04 0.70 0.35 1.41 -0.10 0.00 0.00 175.22 177.54 3a7q s MET 2231N -1.18 0.39 -0.03 0.44 -2.45 -0.20 -0.93 119.30 115.33 3a7q s MET 2231Ca 0.19 0.52 0.02 0.00 -1.25 0.00 0.00 55.69 55.18 3a7q s MET 2231Cb -0.13 0.15 0.01 0.00 1.25 0.00 0.00 34.83 36.11 3a7q s MET 2231CO 0.08 -0.07 -0.09 0.50 1.05 0.00 0.00 175.02 176.50 3a7q s ARG 2232N 0.40 1.04 -0.32 4.11 3.52 -0.53 -1.70 118.95 125.47 3a7q s ARG 2232Ca -0.02 -0.28 0.00 0.00 -0.13 0.00 0.00 55.73 55.30 3a7q s ARG 2232Cb -0.04 -0.96 0.07 0.00 -1.56 0.00 0.00 34.95 32.47 3a7q s ARG 2232CO -0.02 0.06 0.03 -0.51 -0.81 0.00 0.00 175.30 174.05 3a7q s LEU 2233N 0.39 4.25 0.00 -0.88 1.43 -0.97 -1.77 118.68 121.13 3a7q s LEU 2233Ca -0.06 -1.63 0.00 0.00 -1.03 0.00 0.00 54.13 51.41 3a7q s LEU 2233Cb -0.11 -1.69 0.00 0.00 0.03 0.00 0.00 46.19 44.43 3a7q s LEU 2233CO 0.01 -0.33 0.00 0.61 0.23 0.00 0.00 176.35 176.87 3a7q n GLY 2234N 4.50 2.70 2.38 -3.19 0.00 -0.77 -2.39 105.19 108.42 3a7q n GLY 2234Ca -0.08 -1.62 -0.22 0.00 0.00 0.00 0.00 46.02 44.10 3a7q n GLY 2234CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a7q n GLY 2236N 2.21 2.66 0.21 0.00 0.00 -1.26 -4.92 105.19 104.09 3a7q n GLY 2236Ca 0.24 -1.65 -0.15 0.00 0.00 0.00 0.00 46.02 44.46 3a7q n GLY 2236CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a7q h LYS 2237N 0.00 -0.45 0.00 1.61 1.79 -2.00 -3.47 116.57 114.04 3a7q h LYS 2237Ca -0.19 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.31 3a7q h LYS 2237Cb 0.89 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 3a7q h LYS 2237CO 0.27 -0.22 0.00 0.41 -1.08 0.00 0.00 179.45 178.83 3a7q n GLY 2238N -0.94 3.16 3.70 3.86 0.00 -1.26 -5.10 105.19 108.61 3a7q n GLY 2238Ca -0.10 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 3a7q n GLY 2238CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3a7q s VAL 2239N 3.94 4.86 0.40 1.61 -7.23 -1.26 -4.86 120.40 117.86 3a7q s VAL 2239Ca 0.00 2.01 -0.26 0.00 -1.81 0.00 0.00 61.98 61.91 3a7q s VAL 2239Cb 0.00 -4.30 -0.10 0.00 0.56 0.00 0.00 36.38 32.54 3a7q s VAL 2239CO 0.00 0.13 1.34 -2.65 -0.31 0.00 0.00 175.10 173.61 3a7q n PRO 2240N 4.15 2.16 -2.11 4.82 -0.02 -1.26 -4.96 135.00 137.78 3a7q n PRO 2240Ca 0.06 0.76 -0.33 0.00 -2.02 0.00 0.00 63.50 61.97 3a7q n PRO 2240Cb 0.50 -2.47 0.01 0.00 -0.02 0.00 0.00 33.50 31.52 3a7q n PRO 2240CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 3a7q s ASP 2241N -0.41 5.78 0.39 2.55 3.84 -1.26 -4.79 116.67 122.78 3a7q s ASP 2241Ca 0.59 1.89 0.06 0.00 -0.00 0.00 0.00 52.55 55.08 3a7q s ASP 2241Cb -0.50 -2.54 0.79 0.00 -1.38 0.00 0.00 42.92 39.29 3a7q s ASP 2241CO 0.60 -1.17 2.04 -0.65 -0.00 0.00 0.00 175.17 175.99 3a7q h PRO 2242N 0.64 0.63 0.00 2.11 0.11 -1.93 -2.72 132.00 130.83 3a7q h PRO 2242Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3a7q h PRO 2242Cb 1.23 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3a7q h PRO 2242CO 0.57 0.42 0.00 0.54 -0.21 0.00 0.00 178.00 179.32 3a7q n ARG 2243N -4.46 0.40 -2.26 1.05 1.74 -1.26 -4.74 116.66 107.13 3a7q n ARG 2243Ca 0.04 0.02 -0.42 0.00 -0.77 0.00 0.00 57.85 56.73 3a7q n ARG 2243Cb 0.06 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 29.97 3a7q n ARG 2243CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3a7q s SER 2244N -2.09 6.88 0.32 0.55 0.01 -1.03 -4.83 113.70 113.51 3a7q s SER 2244Ca 0.20 2.07 -0.27 0.00 1.31 0.00 0.00 55.95 59.26 3a7q s SER 2244Cb 0.09 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.67 3a7q s SER 2244CO 0.17 -0.70 1.00 -1.10 0.41 0.00 0.00 173.24 173.01 3a7q s GLN 2245N 2.36 4.54 0.88 12.44 -1.52 -1.26 -4.73 119.66 132.37 3a7q s GLN 2245Ca 0.63 1.48 -0.11 0.00 -1.95 0.00 0.00 55.36 55.41 3a7q s GLN 2245Cb -0.30 -2.88 0.12 0.00 -0.22 0.00 0.00 33.01 29.72 3a7q s GLN 2245CO 0.26 0.20 1.09 -2.14 -0.25 0.00 0.00 175.29 174.46 3a7q s PRO 2246N -1.91 1.41 -0.18 2.91 0.02 -1.26 -4.85 135.00 131.14 3a7q s PRO 2246Ca 0.50 1.00 -0.13 0.00 0.02 0.00 0.00 61.00 62.38 3a7q s PRO 2246Cb -0.23 -1.81 -0.05 0.00 0.02 0.00 0.00 34.50 32.43 3a7q s PRO 2246CO 0.29 -2.18 0.25 0.08 -0.33 0.00 0.00 177.00 175.11 3a7q s VAL 2247N -2.87 5.33 -0.21 3.83 1.01 -0.63 -4.07 120.40 122.80 3a7q s VAL 2247Ca 0.63 0.45 -0.06 0.00 0.00 0.00 0.00 61.98 63.00 3a7q s VAL 2247Cb -0.19 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 3a7q s VAL 2247CO 0.57 0.39 0.02 -0.76 0.00 0.00 0.00 175.10 175.33 3a7q s LEU 2248N 0.51 3.37 -0.32 3.92 1.43 0.79 -0.68 118.68 127.70 3a7q s LEU 2248Ca 0.14 -0.16 -0.14 0.00 -1.03 0.00 0.00 54.13 52.94 3a7q s LEU 2248Cb -0.13 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.21 3a7q s LEU 2248CO 0.02 0.06 0.31 -0.22 0.23 0.00 0.00 176.35 176.76 3a7q s LEU 2249N 1.02 4.35 0.17 1.79 2.96 -0.40 -1.13 118.68 127.43 3a7q s LEU 2249Ca 0.02 -0.18 0.03 0.00 -0.22 0.00 0.00 54.13 53.78 3a7q s LEU 2249Cb -0.14 -2.28 -0.05 0.00 0.50 0.00 0.00 46.19 44.22 3a7q s LEU 2249CO 0.02 -0.26 -0.03 -1.10 -1.32 0.00 0.00 176.35 173.67 3a7q s GLN 2250N 1.93 1.12 0.13 1.98 -0.21 -0.00 0.08 119.66 124.68 3a7q s GLN 2250Ca 0.10 -1.53 0.06 0.00 0.02 0.00 0.00 55.36 54.02 3a7q s GLN 2250Cb -0.17 -0.40 -0.04 0.00 1.00 0.00 0.00 33.01 33.40 3a7q s GLN 2250CO 0.11 -0.07 -0.14 1.52 -2.12 0.00 0.00 175.29 174.59 3a7q s TYR 2251N -3.54 1.44 -0.08 0.91 -0.85 -0.34 -0.47 117.35 114.41 3a7q s TYR 2251Ca 0.22 -0.56 -0.04 0.00 -0.52 0.00 0.00 57.07 56.17 3a7q s TYR 2251Cb 0.05 -0.74 0.04 0.00 0.38 0.00 0.00 41.96 41.69 3a7q s TYR 2251CO 0.03 0.16 0.18 0.45 -1.52 0.00 0.00 175.55 174.86 3a7q s SER 2252N -2.54 -0.05 0.00 -0.18 0.15 -0.57 -0.83 113.70 109.68 3a7q s SER 2252Ca 0.10 0.38 0.21 0.00 0.70 0.00 0.00 55.95 57.35 3a7q s SER 2252Cb -0.04 0.29 0.11 0.00 -1.71 0.00 0.00 66.02 64.66 3a7q s SER 2252CO 0.03 -0.17 1.12 0.18 1.20 0.00 0.00 173.24 175.61 3a7q n LEU 2253N 4.37 2.48 -2.55 3.45 4.77 -1.26 -1.32 117.00 126.95 3a7q n LEU 2253Ca -0.23 -0.91 -0.18 0.00 -0.03 0.00 0.00 56.01 54.66 3a7q n LEU 2253Cb 0.52 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.62 3a7q n LEU 2253CO 0.15 0.43 0.05 -0.46 -1.33 0.00 0.00 177.39 176.23 3a7q n ASN 2254N 0.76 3.18 -2.14 -1.43 6.94 -1.26 -4.87 115.26 116.43 3a7q n ASN 2254Ca 0.11 -3.21 -0.21 0.00 -0.02 0.00 0.00 54.58 51.26 3a7q n ASN 2254Cb 0.50 -0.48 -0.04 0.00 -2.36 0.00 0.00 39.78 37.40 3a7q n ASN 2254CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3a7q n GLY 2255N -0.32 0.29 0.02 4.83 0.00 -1.21 -2.24 105.19 106.56 3a7q n GLY 2255Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 3a7q n GLY 2255CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a7q n GLY 2256N -0.81 0.22 0.25 -0.02 0.00 -1.26 -4.84 105.19 98.73 3a7q n GLY 2256Ca -0.23 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 3a7q n GLY 2256CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3a7q h LEU 2257N 0.00 0.85 -8.00 0.99 3.38 -1.81 -3.44 115.31 107.29 3a7q h LEU 2257Ca 0.00 -0.37 -0.30 0.00 0.09 0.00 0.00 57.88 57.29 3a7q h LEU 2257Cb 0.00 -0.23 -0.26 0.00 0.09 0.00 0.00 40.66 40.26 3a7q h LEU 2257CO 0.00 1.03 -0.75 -0.94 0.09 0.00 0.00 178.44 177.88 3a7q s SER 2258N -6.48 0.69 -0.07 -0.43 1.04 -1.26 -5.13 113.70 102.06 3a7q s SER 2258Ca -0.12 -0.26 0.04 0.00 0.48 0.00 0.00 55.95 56.08 3a7q s SER 2258Cb 0.11 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.20 3a7q s SER 2258CO 0.83 -0.04 -0.19 0.26 0.98 0.00 0.00 173.24 175.09 3a7q s TRP 2259N -0.59 1.98 -0.09 5.02 0.52 -1.26 -4.37 118.94 120.15 3a7q s TRP 2259Ca -0.03 -0.70 -0.01 0.00 0.02 0.00 0.00 56.10 55.38 3a7q s TRP 2259Cb -0.05 -1.35 -0.03 0.00 -1.15 0.00 0.00 33.47 30.89 3a7q s TRP 2259CO 0.00 -0.28 -0.03 -1.12 0.02 0.00 0.00 176.95 175.53 3a7q s SER 2260N 0.29 4.91 0.23 2.95 0.01 -0.01 -4.72 113.70 117.36 3a7q s SER 2260Ca -0.12 0.02 -0.30 0.00 1.31 0.00 0.00 55.95 56.86 3a7q s SER 2260Cb -0.15 -1.42 -0.10 0.00 0.21 0.00 0.00 66.02 64.56 3a7q s SER 2260CO 0.05 0.33 1.48 -0.22 0.41 0.00 0.00 173.24 175.28 3a7q s LEU 2261N -0.58 4.38 -0.25 2.44 2.96 -1.26 -1.20 118.68 125.16 3a7q s LEU 2261Ca 0.09 2.66 -0.13 0.00 -0.22 0.00 0.00 54.13 56.53 3a7q s LEU 2261Cb -0.12 -3.62 -0.11 0.00 0.50 0.00 0.00 46.19 42.85 3a7q s LEU 2261CO 0.02 -0.74 -0.34 -0.11 -1.32 0.00 0.00 176.35 173.86 3a7q n LEU 2262N 2.75 1.84 -3.68 -0.68 0.00 0.11 -4.88 117.00 112.46 3a7q n LEU 2262Ca 0.09 0.32 -0.11 0.00 0.00 0.00 0.00 56.01 56.31 3a7q n LEU 2262Cb 0.40 -0.76 -0.09 0.00 0.00 0.00 0.00 43.42 42.97 3a7q n LEU 2262CO 0.61 0.47 0.21 -1.58 0.00 0.00 0.00 177.39 177.09 3a7q s GLN 2263N -2.51 0.58 0.07 1.96 2.00 -0.80 -5.02 119.66 115.94 3a7q s GLN 2263Ca -0.36 0.90 -0.20 0.00 -2.00 0.00 0.00 55.36 53.70 3a7q s GLN 2263Cb 0.13 0.15 -0.07 0.00 0.80 0.00 0.00 33.01 34.03 3a7q s GLN 2263CO 0.45 -0.12 0.59 -1.83 -0.50 0.00 0.00 175.29 173.88 3a7q s GLU 2264N 1.02 4.24 -0.29 1.67 -1.05 -1.26 -1.28 118.70 121.75 3a7q s GLU 2264Ca -0.06 0.77 0.03 0.00 -0.15 0.00 0.00 54.97 55.57 3a7q s GLU 2264Cb -0.06 -3.25 0.07 0.00 -0.44 0.00 0.00 34.13 30.46 3a7q s GLU 2264CO -0.09 0.61 -0.04 -0.06 0.95 0.00 0.00 175.26 176.62 3a7q s PHE 2265N -1.03 3.44 0.16 4.83 0.08 0.15 -5.00 117.98 120.62 3a7q s PHE 2265Ca 0.30 -2.52 -0.22 0.00 0.12 0.00 0.00 56.93 54.60 3a7q s PHE 2265Cb -0.20 -2.30 -0.08 0.00 -0.57 0.00 0.00 43.02 39.87 3a7q s PHE 2265CO 0.19 -0.90 0.71 -0.51 -0.10 0.00 0.00 175.22 174.61 3a7q s LEU 2266N 1.05 4.51 -0.01 -0.37 1.43 -1.26 -1.60 118.68 122.43 3a7q s LEU 2266Ca -0.02 1.48 -0.30 0.00 -1.03 0.00 0.00 54.13 54.26 3a7q s LEU 2266Cb -0.20 -3.28 -0.04 0.00 0.03 0.00 0.00 46.19 42.70 3a7q s LEU 2266CO -0.06 0.18 1.16 -0.36 0.23 0.00 0.00 176.35 177.50 3a7q s PHE 2267N -1.25 3.37 0.27 0.29 0.08 -1.26 -4.88 117.98 114.59 3a7q s PHE 2267Ca 0.36 1.34 -0.04 0.00 0.12 0.00 0.00 56.93 58.71 3a7q s PHE 2267Cb -0.20 -3.37 -0.02 0.00 -0.57 0.00 0.00 43.02 38.86 3a7q s PHE 2267CO 0.23 -1.06 0.34 -1.54 -0.10 0.00 0.00 175.22 173.09 3a7q s SER 2268N 1.24 0.46 0.64 1.36 1.04 -1.26 -4.97 113.70 112.20 3a7q s SER 2268Ca 0.56 -1.32 0.29 0.00 0.48 0.00 0.00 55.95 55.96 3a7q s SER 2268Cb -0.26 0.54 1.57 0.00 0.10 0.00 0.00 66.02 67.97 3a7q s SER 2268CO 0.25 -1.08 1.92 0.78 0.98 0.00 0.00 173.24 176.09 3a7q h ASN 2269N 2.32 0.00 -0.50 7.02 4.21 -1.96 -0.50 115.58 126.17 3a7q h ASN 2269Ca -0.30 0.00 -0.33 0.00 1.21 0.00 0.00 56.30 56.89 3a7q h ASN 2269Cb 1.25 0.00 -0.21 0.00 -1.12 0.00 0.00 38.32 38.23 3a7q h ASN 2269CO 0.42 0.00 -0.24 -1.54 -1.29 0.00 0.00 177.43 174.78 3a7q n SER 2270N -3.18 3.69 -0.06 5.81 3.41 -1.26 -4.68 113.62 117.35 3a7q n SER 2270Ca 0.01 -3.80 -0.05 0.00 -0.26 0.00 0.00 58.87 54.78 3a7q n SER 2270Cb 0.47 -0.58 -0.11 0.00 -0.26 0.00 0.00 64.21 63.73 3a7q n SER 2270CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3a7q n SER 2271N -0.98 1.63 -0.45 4.04 3.41 -0.20 -4.63 113.62 116.44 3a7q n SER 2271Ca 0.38 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.99 3a7q n SER 2271Cb 0.93 0.96 0.00 0.00 -0.26 0.00 0.00 64.21 65.85 3a7q n SER 2271CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3a7q n ASN 2272N -2.43 0.13 -4.12 4.04 5.15 -1.01 -2.28 115.26 114.73 3a7q n ASN 2272Ca -0.19 -0.28 -0.26 0.00 -0.60 0.00 0.00 54.58 53.24 3a7q n ASN 2272Cb 0.86 -0.06 -0.16 0.00 -0.53 0.00 0.00 39.78 39.89 3a7q n ASN 2272CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3a7q s VAL 2273N -1.10 1.43 0.15 3.44 1.01 -1.26 -4.90 120.40 119.17 3a7q s VAL 2273Ca 0.00 -0.70 -0.31 0.00 0.00 0.00 0.00 61.98 60.97 3a7q s VAL 2273Cb 0.00 -1.24 -0.09 0.00 0.00 0.00 0.00 36.38 35.05 3a7q s VAL 2273CO 0.00 0.41 1.48 -0.83 0.00 0.00 0.00 175.10 176.16 3a7q s GLY 2274N 0.16 1.81 0.14 4.51 0.00 -1.26 -4.56 107.32 108.13 3a7q s GLY 2274Ca -0.07 1.26 -0.11 0.00 0.00 0.00 0.00 44.72 45.80 3a7q s GLY 2274CO 0.03 2.47 0.30 1.09 0.00 0.00 0.00 173.10 177.00 3a7q s ARG 2275N 0.95 1.08 -0.16 2.90 1.70 -0.69 -4.98 118.95 119.75 3a7q s ARG 2275Ca 0.67 -1.00 -0.22 0.00 -0.47 0.00 0.00 55.73 54.71 3a7q s ARG 2275Cb -0.41 0.40 -0.03 0.00 -0.57 0.00 0.00 34.95 34.34 3a7q s ARG 2275CO 0.32 -0.39 0.66 -0.47 -1.08 0.00 0.00 175.30 174.33 3a7q s TYR 2276N -3.90 3.44 -0.17 5.89 5.04 -1.26 -1.03 117.35 125.36 3a7q s TYR 2276Ca 0.10 1.04 0.01 0.00 -2.44 0.00 0.00 57.07 55.78 3a7q s TYR 2276Cb 0.03 -2.80 0.02 0.00 0.35 0.00 0.00 41.96 39.56 3a7q s TYR 2276CO -0.06 -0.09 -0.19 0.42 -1.34 0.00 0.00 175.55 174.30 3a7q s ILE 2277N 1.56 1.95 -0.10 3.14 1.09 -0.39 -5.00 121.20 123.45 3a7q s ILE 2277Ca 0.32 -0.88 0.02 0.00 -1.10 0.00 0.00 60.65 59.01 3a7q s ILE 2277Cb -0.16 -1.77 0.01 0.00 -1.06 0.00 0.00 42.46 39.48 3a7q s ILE 2277CO 0.12 0.52 -0.16 0.00 -0.10 0.00 0.00 174.94 175.33 3a7q s ALA 2278N 1.29 1.71 0.04 9.38 0.00 -1.26 -0.73 121.76 132.18 3a7q s ALA 2278Ca 0.04 -0.73 0.07 0.00 0.00 0.00 0.00 51.96 51.34 3a7q s ALA 2278Cb -0.13 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.15 3a7q s ALA 2278CO -0.12 -0.03 -0.21 -0.51 0.00 0.00 0.00 175.76 174.90 3a7q s LEU 2279N 0.90 2.15 0.39 0.00 1.43 0.47 -5.01 118.68 119.02 3a7q s LEU 2279Ca -0.08 -0.51 -0.24 0.00 -1.03 0.00 0.00 54.13 52.27 3a7q s LEU 2279Cb -0.15 -0.99 -0.09 0.00 0.03 0.00 0.00 46.19 44.99 3a7q s LEU 2279CO -0.00 0.17 1.01 -1.61 0.23 0.00 0.00 176.35 176.15 3a7q s GLU 2280N -1.10 4.24 -0.16 1.70 2.02 -1.26 -1.03 118.70 123.11 3a7q s GLU 2280Ca 0.08 1.41 -0.29 0.00 0.02 0.00 0.00 54.97 56.19 3a7q s GLU 2280Cb -0.09 -2.52 -0.03 0.00 0.10 0.00 0.00 34.13 31.59 3a7q s GLU 2280CO 0.01 -0.06 1.46 1.41 0.02 0.00 0.00 175.26 178.11 3a7q s MET 2281N -2.54 4.09 0.57 1.61 -2.45 -0.92 -4.83 119.30 114.84 3a7q s MET 2281Ca 0.57 1.79 -0.19 0.00 -1.25 0.00 0.00 55.69 56.61 3a7q s MET 2281Cb -0.19 -3.90 -0.04 0.00 1.25 0.00 0.00 34.83 31.94 3a7q s MET 2281CO 0.24 -0.91 1.16 -1.25 1.05 0.00 0.00 175.02 175.31 3a7q s PRO 2282N 3.98 3.14 0.23 4.11 0.04 -1.26 -4.91 135.00 140.33 3a7q s PRO 2282Ca 0.64 1.69 -0.06 0.00 0.04 0.00 0.00 61.00 63.31 3a7q s PRO 2282Cb -0.25 -1.97 0.41 0.00 0.04 0.00 0.00 34.50 32.73 3a7q s PRO 2282CO 0.23 -1.04 1.70 1.25 0.04 0.00 0.00 177.00 179.18 3a7q h LEU 2283N 0.97 0.04 -1.40 -3.56 5.85 -1.99 -1.51 115.31 113.71 3a7q h LEU 2283Ca -0.50 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.35 3a7q h LEU 2283Cb 1.28 0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.48 3a7q h LEU 2283CO 0.56 -0.00 0.00 0.11 -0.34 0.00 0.00 178.44 178.76 3a7q h LYS 2284N 0.29 0.00 0.00 1.25 1.57 -2.03 -2.01 116.57 115.64 3a7q h LYS 2284Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 3a7q h LYS 2284Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 3a7q h LYS 2284CO -0.46 0.00 -0.39 0.00 -0.57 0.00 0.00 179.45 178.03 3a7q h ALA 2285N 2.10 0.77 -1.63 3.86 0.00 -1.64 -3.46 119.26 119.27 3a7q h ALA 2285Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 3a7q h ALA 2285Cb 0.26 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3a7q h ALA 2285CO 0.00 0.00 1.23 1.03 0.00 0.00 0.00 179.25 181.51 3a7q s ARG 2286N -3.19 3.08 0.11 0.00 0.52 -0.76 -4.71 118.95 114.01 3a7q s ARG 2286Ca 0.07 0.75 -0.25 0.00 -0.52 0.00 0.00 55.73 55.78 3a7q s ARG 2286Cb 0.11 -4.23 0.08 0.00 0.52 0.00 0.00 34.95 31.43 3a7q s ARG 2286CO 0.69 -2.18 0.69 -1.54 0.02 0.00 0.00 175.30 172.97 3a7q s SER 2287N 6.07 -0.50 0.00 0.23 1.04 -1.26 -4.77 113.70 114.51 3a7q s SER 2287Ca 0.64 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 57.06 3a7q s SER 2287Cb -0.14 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.51 3a7q s SER 2287CO 0.26 -0.87 0.43 0.61 0.98 0.00 0.00 173.24 174.65 3a7q n GLY 2288N -0.34 -0.04 2.71 7.32 0.00 -1.26 -1.45 105.19 112.13 3a7q n GLY 2288Ca -0.14 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 3a7q n GLY 2288CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3a7q n SER 2289N -0.23 -1.97 -4.70 1.61 2.88 -0.99 -4.02 113.62 106.20 3a7q n SER 2289Ca 0.00 -2.95 -0.33 0.00 -1.33 0.00 0.00 58.87 54.26 3a7q n SER 2289Cb 0.05 1.52 -0.09 0.00 -0.75 0.00 0.00 64.21 64.94 3a7q n SER 2289CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3a7q s THR 2290N 0.20 4.29 0.12 2.46 2.01 0.15 -4.46 115.64 120.40 3a7q s THR 2290Ca 0.20 -0.45 0.08 0.00 0.31 0.00 0.00 61.69 61.84 3a7q s THR 2290Cb 0.30 -2.88 -0.04 0.00 0.01 0.00 0.00 72.50 69.89 3a7q s THR 2290CO -0.08 0.46 -0.19 0.00 -0.69 0.00 0.00 174.62 174.11 3a7q s ARG 2291N -1.34 1.14 0.13 4.92 1.70 -0.43 0.62 118.95 125.68 3a7q s ARG 2291Ca 0.18 -1.22 0.10 0.00 -0.47 0.00 0.00 55.73 54.32 3a7q s ARG 2291Cb -0.11 -1.31 -0.04 0.00 -0.57 0.00 0.00 34.95 32.92 3a7q s ARG 2291CO 0.08 0.29 -0.24 -0.51 -1.08 0.00 0.00 175.30 173.84 3a7q s LEU 2292N -2.13 2.44 0.01 -1.89 1.43 -1.26 -1.51 118.68 115.77 3a7q s LEU 2292Ca 0.08 -0.69 -0.02 0.00 -1.03 0.00 0.00 54.13 52.48 3a7q s LEU 2292Cb -0.09 -1.32 -0.01 0.00 0.03 0.00 0.00 46.19 44.80 3a7q s LEU 2292CO 0.05 0.18 0.01 0.00 0.23 0.00 0.00 176.35 176.82 3a7q s ARG 2293N -2.10 0.29 -0.21 1.70 1.70 0.38 -0.78 118.95 119.93 3a7q s ARG 2293Ca 0.15 -0.44 -0.05 0.00 -0.47 0.00 0.00 55.73 54.92 3a7q s ARG 2293Cb -0.10 0.11 -0.02 0.00 -0.57 0.00 0.00 34.95 34.37 3a7q s ARG 2293CO 0.07 -0.05 -0.00 -1.58 -1.08 0.00 0.00 175.30 172.66 3a7q s TRP 2294N -1.15 3.01 -0.01 5.89 0.51 0.10 -0.82 118.94 126.46 3a7q s TRP 2294Ca -0.13 -0.62 0.00 0.00 -2.12 0.00 0.00 56.10 53.24 3a7q s TRP 2294Cb -0.08 -2.11 0.02 0.00 -0.81 0.00 0.00 33.47 30.49 3a7q s TRP 2294CO -0.00 -0.36 0.02 -0.46 -0.51 0.00 0.00 176.95 175.63 3a7q s TRP 2295N 1.26 0.04 -0.37 -1.98 -0.00 -0.29 -0.32 118.94 117.28 3a7q s TRP 2295Ca 0.04 0.08 -0.05 0.00 -0.00 0.00 0.00 56.10 56.17 3a7q s TRP 2295Cb -0.15 -0.17 0.07 0.00 -0.00 0.00 0.00 33.47 33.23 3a7q s TRP 2295CO 0.01 -0.06 0.15 -1.14 -0.00 0.00 0.00 176.95 175.90 3a7q s GLN 2296N 0.73 2.37 0.71 5.86 0.74 -0.13 -0.15 119.66 129.79 3a7q s GLN 2296Ca -0.06 -1.48 -0.16 0.00 0.05 0.00 0.00 55.36 53.71 3a7q s GLN 2296Cb -0.09 -3.51 0.02 0.00 1.10 0.00 0.00 33.01 30.53 3a7q s GLN 2296CO -0.02 -0.86 1.18 -2.30 -0.55 0.00 0.00 175.29 172.75 3a7q n PRO 2297N 4.72 0.69 -3.64 1.67 -0.02 -1.26 -4.40 135.00 132.76 3a7q n PRO 2297Ca -0.09 0.30 -0.06 0.00 -2.02 0.00 0.00 63.50 61.63 3a7q n PRO 2297Cb 0.43 -2.42 -0.07 0.00 -0.02 0.00 0.00 33.50 31.42 3a7q n PRO 2297CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3a7q s SER 2298N -1.66 -0.26 0.17 2.55 1.04 -1.26 -4.67 113.70 109.62 3a7q s SER 2298Ca 0.78 0.47 -0.14 0.00 0.48 0.00 0.00 55.95 57.53 3a7q s SER 2298Cb -0.35 0.46 0.12 0.00 0.10 0.00 0.00 66.02 66.36 3a7q s SER 2298CO 0.46 -0.11 1.76 -0.08 0.98 0.00 0.00 173.24 176.25 3a7q h GLU 2299N 3.47 0.35 0.00 4.02 4.57 -1.97 -3.34 114.58 121.68 3a7q h GLU 2299Ca -0.25 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 57.84 3a7q h GLU 2299Cb 1.18 -0.08 -0.14 0.00 -0.16 0.00 0.00 28.75 29.56 3a7q h GLU 2299CO 0.16 0.23 -0.61 0.27 -1.18 0.00 0.00 179.01 177.88 3a7q n ASN 2300N -4.98 1.18 -2.02 1.04 6.94 -1.26 -4.96 115.26 111.19 3a7q n ASN 2300Ca 0.04 -2.67 -0.20 0.00 -0.02 0.00 0.00 54.58 51.72 3a7q n ASN 2300Cb 0.16 -0.36 -0.04 0.00 -2.36 0.00 0.00 39.78 37.19 3a7q n ASN 2300CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3a7q n GLY 2301N -0.34 0.36 3.31 4.83 0.00 -1.25 -4.77 105.19 107.32 3a7q n GLY 2301Ca 0.10 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 3a7q n GLY 2301CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3a7q s HIS 2302N -2.91 2.22 0.07 1.61 5.04 -1.26 0.48 115.29 120.54 3a7q s HIS 2302Ca 0.00 -0.41 0.04 0.00 -1.54 0.00 0.00 55.06 53.15 3a7q s HIS 2302Cb 0.00 -1.35 -0.03 0.00 0.04 0.00 0.00 32.58 31.24 3a7q s HIS 2302CO 0.00 0.07 -0.12 -0.06 -2.34 0.00 0.00 174.74 172.29 3a7q s PHE 2303N -0.74 1.06 -0.18 3.88 0.08 -1.26 -4.74 117.98 116.08 3a7q s PHE 2303Ca 0.10 -0.50 -0.16 0.00 0.12 0.00 0.00 56.93 56.49 3a7q s PHE 2303Cb -0.10 -0.60 -0.22 0.00 -0.57 0.00 0.00 43.02 41.54 3a7q s PHE 2303CO 0.01 0.02 0.26 0.66 -0.10 0.00 0.00 175.22 176.07 3a7q n TYR 2304N 1.20 1.10 -4.26 0.36 4.01 -1.26 -4.91 117.16 113.40 3a7q n TYR 2304Ca -0.21 0.37 -0.18 0.00 -0.16 0.00 0.00 57.90 57.72 3a7q n TYR 2304Cb 0.55 -1.12 -0.15 0.00 -0.31 0.00 0.00 39.34 38.30 3a7q n TYR 2304CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3a7q s SER 2305N -6.94 0.89 1.08 7.72 1.04 -1.26 -4.98 113.70 111.25 3a7q s SER 2305Ca -0.27 -0.13 -0.08 0.00 0.48 0.00 0.00 55.95 55.95 3a7q s SER 2305Cb 0.06 -0.19 0.12 0.00 0.10 0.00 0.00 66.02 66.12 3a7q s SER 2305CO 0.66 0.06 0.49 -0.81 0.98 0.00 0.00 173.24 174.61 3a7q n PRO 2306N 3.17 -1.55 -3.70 4.02 -0.04 -1.26 -4.78 135.00 130.87 3a7q n PRO 2306Ca -0.16 -0.77 -0.10 0.00 -0.04 0.00 0.00 63.50 62.43 3a7q n PRO 2306Cb 0.56 -0.66 -0.05 0.00 -0.04 0.00 0.00 33.50 33.30 3a7q n PRO 2306CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 3a7q s TRP 2307N -1.94 -0.12 0.07 0.54 1.48 -1.11 -1.85 118.94 116.01 3a7q s TRP 2307Ca 0.30 -0.19 0.07 0.00 -1.06 0.00 0.00 56.10 55.22 3a7q s TRP 2307Cb -0.02 0.17 -0.03 0.00 -1.16 0.00 0.00 33.47 32.43 3a7q s TRP 2307CO 0.23 -0.64 -0.19 0.08 -4.06 0.00 0.00 176.95 172.37 3a7q s VAL 2308N -3.63 1.52 -0.05 -0.66 1.01 -0.73 -1.30 120.40 116.55 3a7q s VAL 2308Ca 0.02 -1.30 -0.04 0.00 0.00 0.00 0.00 61.98 60.66 3a7q s VAL 2308Cb 0.02 -1.36 0.02 0.00 0.00 0.00 0.00 36.38 35.05 3a7q s VAL 2308CO -0.10 0.02 0.13 -0.51 0.00 0.00 0.00 175.10 174.64 3a7q s ILE 2309N -0.99 -0.00 0.15 2.22 2.07 -0.90 -1.45 121.20 122.28 3a7q s ILE 2309Ca 0.05 0.02 -0.13 0.00 -1.41 0.00 0.00 60.65 59.18 3a7q s ILE 2309Cb -0.09 -0.19 0.01 0.00 0.13 0.00 0.00 42.46 42.32 3a7q s ILE 2309CO 0.03 0.01 0.36 -0.62 -1.91 0.00 0.00 174.94 172.80 3a7q s ASP 2310N 0.18 -0.09 -0.89 4.50 2.15 -0.11 -1.36 116.67 121.05 3a7q s ASP 2310Ca -0.01 -0.59 -0.06 0.00 0.43 0.00 0.00 52.55 52.32 3a7q s ASP 2310Cb -0.02 0.46 0.00 0.00 -0.30 0.00 0.00 42.92 43.07 3a7q s ASP 2310CO -0.00 -0.89 0.65 0.00 -0.17 0.00 0.00 175.17 174.75 3a7q n GLN 2311N -0.22 -1.33 -3.09 4.34 1.13 -1.18 0.71 117.38 117.74 3a7q n GLN 2311Ca -0.12 0.79 -0.40 0.00 -1.94 0.00 0.00 57.00 55.33 3a7q n GLN 2311Cb 0.63 -3.17 -0.06 0.00 0.11 0.00 0.00 30.24 27.75 3a7q n GLN 2311CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 3a7q s ILE 2312N -3.10 4.99 -0.03 5.09 1.01 -0.54 -3.78 121.20 124.85 3a7q s ILE 2312Ca 0.10 1.20 0.04 0.00 0.00 0.00 0.00 60.65 62.00 3a7q s ILE 2312Cb -0.05 -3.96 -0.01 0.00 0.01 0.00 0.00 42.46 38.46 3a7q s ILE 2312CO 0.87 0.07 -0.15 -0.76 0.00 0.00 0.00 174.94 174.97 3a7q s LEU 2313N 2.18 1.95 -0.02 2.97 1.02 -0.25 -0.59 118.68 125.94 3a7q s LEU 2313Ca 0.28 -0.30 0.03 0.00 0.02 0.00 0.00 54.13 54.16 3a7q s LEU 2313Cb -0.16 -0.85 0.00 0.00 0.02 0.00 0.00 46.19 45.21 3a7q s LEU 2313CO 0.10 0.16 -0.09 -0.63 0.02 0.00 0.00 176.35 175.90 3a7q s ILE 2314N -0.12 0.80 -0.77 -0.59 1.01 0.43 -0.87 121.20 121.09 3a7q s ILE 2314Ca 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.28 3a7q s ILE 2314Cb -0.09 -0.70 0.00 0.00 0.01 0.00 0.00 42.46 41.68 3a7q s ILE 2314CO 0.01 0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.80 3a7q n GLY 2315N 3.21 0.05 0.00 6.18 0.00 -0.95 -0.27 105.19 113.41 3a7q n GLY 2315Ca -0.17 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 44.90 3a7q n GLY 2315CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a7q n GLY 2316N 0.00 0.16 3.04 -0.02 0.00 -1.26 -0.57 105.19 106.54 3a7q n GLY 2316Ca 0.00 -1.97 -0.20 0.00 0.00 0.00 0.00 46.02 43.85 3a7q n GLY 2316CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a7q s ASN 2317N -0.60 1.24 0.09 1.61 0.01 -1.25 -4.17 114.94 111.87 3a7q s ASN 2317Ca 0.00 -0.19 -0.10 0.00 -0.71 0.00 0.00 52.86 51.86 3a7q s ASN 2317Cb 0.00 -0.18 -0.20 0.00 0.41 0.00 0.00 41.25 41.28 3a7q s ASN 2317CO 0.00 0.12 1.20 0.16 -1.51 0.00 0.00 177.10 177.07 3a7q h ILE 2318N 4.98 1.34 0.00 0.60 3.07 -1.24 -2.33 117.51 123.93 3a7q h ILE 2318Ca -0.32 -2.44 0.00 0.00 1.55 0.00 0.00 64.86 63.65 3a7q h ILE 2318Cb 1.17 2.52 0.00 0.00 -0.27 0.00 0.00 36.82 40.24 3a7q h ILE 2318CO 0.49 0.74 0.16 -0.24 -1.05 0.00 0.00 178.15 178.25 3a7q n SER 2319N -3.77 0.23 -2.37 2.16 2.88 -1.26 -4.82 113.62 106.67 3a7q n SER 2319Ca -0.10 0.51 -0.05 0.00 -1.33 0.00 0.00 58.87 57.90 3a7q n SER 2319Cb 0.91 -0.51 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 3a7q n SER 2319CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3a7q n GLY 2320N -1.32 -0.16 3.33 0.46 0.00 -0.88 -4.73 105.19 101.89 3a7q n GLY 2320Ca -0.01 0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 3a7q n GLY 2320CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3a7q n ASN 2321N 0.17 -2.41 -0.12 1.61 3.02 -1.26 -0.87 115.26 115.40 3a7q n ASN 2321Ca -0.05 0.12 0.11 0.00 -0.03 0.00 0.00 54.58 54.74 3a7q n ASN 2321Cb 0.13 -1.06 0.13 0.00 -0.61 0.00 0.00 39.78 38.37 3a7q n ASN 2321CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3a7q n THR 2322N -3.89 0.00 -3.90 3.41 -2.24 -1.26 -0.26 114.28 106.14 3a7q n THR 2322Ca 0.04 -0.06 -0.28 0.00 -2.27 0.00 0.00 64.05 61.48 3a7q n THR 2322Cb 0.58 0.64 -0.17 0.00 -2.10 0.00 0.00 70.33 69.28 3a7q n THR 2322CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3a7q s VAL 2323N -2.83 1.07 -0.21 2.28 1.01 -1.26 -3.88 120.40 116.59 3a7q s VAL 2323Ca 0.14 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.63 3a7q s VAL 2323Cb 0.17 -1.18 0.01 0.00 0.00 0.00 0.00 36.38 35.39 3a7q s VAL 2323CO 0.70 0.24 -0.10 -0.22 0.00 0.00 0.00 175.10 175.71 3a7q s LEU 2324N 1.67 2.66 0.03 3.92 0.20 -0.71 -5.04 118.68 121.42 3a7q s LEU 2324Ca 0.03 -0.56 0.04 0.00 0.69 0.00 0.00 54.13 54.33 3a7q s LEU 2324Cb -0.14 -1.63 -0.02 0.00 -0.43 0.00 0.00 46.19 43.97 3a7q s LEU 2324CO -0.08 -0.03 -0.12 -0.70 -0.29 0.00 0.00 176.35 175.13 3a7q s GLU 2325N 1.39 0.82 -0.24 1.98 2.12 -1.26 -1.40 118.70 122.11 3a7q s GLU 2325Ca 0.05 -0.65 -0.20 0.00 0.36 0.00 0.00 54.97 54.53 3a7q s GLU 2325Cb -0.14 -0.79 0.07 0.00 0.26 0.00 0.00 34.13 33.53 3a7q s GLU 2325CO -0.07 0.20 0.63 0.34 -0.54 0.00 0.00 175.26 175.82 3a7q s ASP 2326N -0.99 -0.72 0.00 -1.70 -1.08 0.71 -4.99 116.67 107.91 3a7q s ASP 2326Ca 0.00 1.31 0.11 0.00 -0.52 0.00 0.00 52.55 53.45 3a7q s ASP 2326Cb -0.07 1.28 0.15 0.00 -1.46 0.00 0.00 42.92 42.81 3a7q s ASP 2326CO 0.01 -0.22 0.96 -0.90 0.52 0.00 0.00 175.17 175.53 3a7q n ASP 2327N 3.23 2.20 -3.87 -0.34 5.75 -1.26 -0.88 116.55 121.37 3a7q n ASP 2327Ca -0.16 -1.60 -0.27 0.00 -0.01 0.00 0.00 54.79 52.75 3a7q n ASP 2327Cb 0.56 -0.06 0.02 0.00 -1.03 0.00 0.00 41.12 40.61 3a7q n ASP 2327CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3a7q n PHE 2328N 0.62 -2.02 0.11 2.11 3.72 -1.26 -4.57 117.46 116.18 3a7q n PHE 2328Ca 0.08 0.85 -0.03 0.00 -0.05 0.00 0.00 57.45 58.30 3a7q n PHE 2328Cb 0.32 -4.00 0.08 0.00 -0.94 0.00 0.00 39.48 34.94 3a7q n PHE 2328CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3a7q h SER 2329N -1.92 0.01 -3.42 4.37 4.64 -1.95 -3.36 113.55 111.90 3a7q h SER 2329Ca -0.60 -0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.29 3a7q h SER 2329Cb 1.37 -0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.32 3a7q h SER 2329CO 0.64 0.74 -0.67 0.42 -0.87 0.00 0.00 176.83 177.08 3a7q s THR 2330N -3.34 1.36 -0.62 2.95 -4.23 -1.26 -4.97 115.64 105.53 3a7q s THR 2330Ca -0.01 -2.09 0.05 0.00 -1.18 0.00 0.00 61.69 58.46 3a7q s THR 2330Cb 0.12 -2.33 0.15 0.00 1.34 0.00 0.00 72.50 71.78 3a7q s THR 2330CO 0.78 -0.37 0.38 -0.22 -0.54 0.00 0.00 174.62 174.66 3a7q s LEU 2331N -3.35 4.56 -0.07 4.79 2.96 -1.26 -4.95 118.68 121.36 3a7q s LEU 2331Ca 0.27 -3.46 -0.30 0.00 -0.22 0.00 0.00 54.13 50.43 3a7q s LEU 2331Cb 0.04 -1.63 -0.03 0.00 0.50 0.00 0.00 46.19 45.08 3a7q s LEU 2331CO 0.09 -0.15 1.15 -0.62 -1.32 0.00 0.00 176.35 175.50 3a7q s ASP 2332N -0.91 7.10 0.48 3.68 -1.08 -1.26 -4.94 116.67 119.74 3a7q s ASP 2332Ca 0.21 1.73 0.29 0.00 -0.52 0.00 0.00 52.55 54.26 3a7q s ASP 2332Cb -0.15 -2.56 0.92 0.00 -1.46 0.00 0.00 42.92 39.68 3a7q s ASP 2332CO -0.09 -0.55 1.81 0.28 0.52 0.00 0.00 175.17 177.14 3a7q h SER 2333N 7.38 0.00 0.17 -0.34 0.02 -1.95 -2.17 113.55 116.65 3a7q h SER 2333Ca -0.33 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.56 3a7q h SER 2333Cb 1.15 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.68 3a7q h SER 2333CO 0.88 0.00 -0.25 0.03 -1.14 0.00 0.00 176.83 176.35 3a7q h ARG 2334N 0.00 0.15 0.11 3.45 3.08 -1.94 -3.01 114.38 116.22 3a7q h ARG 2334Ca 0.00 -0.05 -0.26 0.00 0.07 0.00 0.00 59.98 59.74 3a7q h ARG 2334Cb 0.71 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.74 3a7q h ARG 2334CO 0.00 0.40 -1.32 0.87 -1.07 0.00 0.00 179.97 178.85 3a7q h LYS 2335N 0.14 0.24 -3.44 0.04 1.57 -1.94 -3.41 116.57 109.77 3a7q h LYS 2335Ca 0.02 -0.41 -0.70 0.00 -1.87 0.00 0.00 60.65 57.69 3a7q h LYS 2335Cb 0.53 0.15 -0.35 0.00 0.08 0.00 0.00 32.23 32.64 3a7q h LYS 2335CO 0.04 1.20 -0.22 -1.58 -0.57 0.00 0.00 179.45 178.31 3a7q s TRP 2336N -2.47 3.65 0.17 -1.35 0.52 -0.83 -0.57 118.94 118.06 3a7q s TRP 2336Ca -0.19 -2.86 -0.21 0.00 0.02 0.00 0.00 56.10 52.86 3a7q s TRP 2336Cb 0.04 -3.23 0.09 0.00 -1.15 0.00 0.00 33.47 29.21 3a7q s TRP 2336CO 0.77 -0.79 1.61 -0.07 0.02 0.00 0.00 176.95 178.49 3a7q h LEU 2337N 6.52 -0.92 -8.02 2.99 3.38 -1.14 -3.41 115.31 114.71 3a7q h LEU 2337Ca 0.08 0.18 -0.41 0.00 0.09 0.00 0.00 57.88 57.82 3a7q h LEU 2337Cb 0.88 0.45 -0.29 0.00 0.09 0.00 0.00 40.66 41.79 3a7q h LEU 2337CO 0.78 -0.29 -0.78 -0.76 0.09 0.00 0.00 178.44 177.48 3a7q s LEU 2338N -10.62 1.94 -0.37 1.67 1.43 -1.20 -4.99 118.68 106.53 3a7q s LEU 2338Ca -0.15 -0.17 0.12 0.00 -1.03 0.00 0.00 54.13 52.91 3a7q s LEU 2338Cb 0.14 -0.50 0.37 0.00 0.03 0.00 0.00 46.19 46.24 3a7q s LEU 2338CO 0.69 0.10 0.84 0.00 0.23 0.00 0.00 176.35 178.21 3a7q n HIS 2339N 2.99 -0.08 -1.72 0.29 1.44 -1.26 -0.89 115.22 115.99 3a7q n HIS 2339Ca -0.15 -3.35 -0.42 0.00 -2.01 0.00 0.00 57.72 51.79 3a7q n HIS 2339Cb 0.56 -0.10 -0.02 0.00 0.12 0.00 0.00 29.99 30.55 3a7q n HIS 2339CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 3a7q n PRO 2340N 0.19 2.58 -0.99 -1.40 -0.04 -1.02 -1.75 135.00 132.56 3a7q n PRO 2340Ca 0.19 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.56 3a7q n PRO 2340Cb 0.70 -2.69 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 3a7q n PRO 2340CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3a7q n GLY 2341N 2.53 0.90 3.72 0.55 0.00 -1.24 -2.29 105.19 109.36 3a7q n GLY 2341Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 3a7q n GLY 2341CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3a7q s GLY 2342N -1.99 1.93 -0.04 -0.02 0.00 -0.72 -3.95 107.32 102.53 3a7q s GLY 2342Ca 0.00 -0.76 0.04 0.00 0.00 0.00 0.00 44.72 44.00 3a7q s GLY 2342CO 0.00 -0.48 -0.17 -1.59 0.00 0.00 0.00 173.10 170.87 3a7q s THR 2343N -0.82 1.40 -0.53 0.90 2.01 0.29 -4.86 115.64 114.02 3a7q s THR 2343Ca 0.13 -0.69 -0.28 0.00 0.31 0.00 0.00 61.69 61.16 3a7q s THR 2343Cb -0.12 -1.20 -0.00 0.00 0.01 0.00 0.00 72.50 71.19 3a7q s THR 2343CO 0.03 0.40 1.63 -0.75 -0.69 0.00 0.00 174.62 175.23 3a7q s LYS 2344N 0.07 3.10 0.12 4.92 2.20 -1.26 -0.31 119.74 128.58 3a7q s LYS 2344Ca -0.04 0.69 -0.24 0.00 -0.36 0.00 0.00 55.97 56.02 3a7q s LYS 2344Cb -0.12 -4.22 0.08 0.00 -1.51 0.00 0.00 37.83 32.06 3a7q s LYS 2344CO 0.02 -2.16 0.65 0.00 -0.36 0.00 0.00 175.35 173.50 3a7q s MET 2345N 6.00 1.19 0.56 4.03 0.23 -0.73 -4.95 119.30 125.63 3a7q s MET 2345Ca 0.62 -0.39 -0.16 0.00 -1.03 0.00 0.00 55.69 54.73 3a7q s MET 2345Cb -0.14 0.55 -0.05 0.00 -1.53 0.00 0.00 34.83 33.66 3a7q s MET 2345CO 0.25 -0.51 1.03 -1.25 -2.03 0.00 0.00 175.02 172.51 3a7q s PRO 2346N -3.46 3.59 -0.27 3.16 0.04 -1.26 0.56 135.00 137.36 3a7q s PRO 2346Ca 0.01 1.08 -0.23 0.00 0.04 0.00 0.00 61.00 61.90 3a7q s PRO 2346Cb -0.01 -2.08 0.07 0.00 0.04 0.00 0.00 34.50 32.53 3a7q s PRO 2346CO -0.11 -0.58 0.70 0.54 0.04 0.00 0.00 177.00 177.60 3a7q s VAL 2347N -2.56 -0.00 -0.77 -0.36 0.11 -1.26 -4.87 120.40 110.68 3a7q s VAL 2347Ca 0.61 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 59.62 3a7q s VAL 2347Cb -0.13 -0.99 0.01 0.00 -1.53 0.00 0.00 36.38 33.74 3a7q s VAL 2347CO 0.35 0.00 0.60 0.00 -3.33 0.00 0.00 175.10 172.73 3a7q n GLY 2349N -1.31 0.40 3.50 0.00 0.00 -1.26 -4.75 105.19 101.77 3a7q n GLY 2349Ca -0.01 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.42 3a7q n GLY 2349CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3a7q s SER 2350N -2.53 1.09 -0.38 1.61 1.04 -1.16 -4.98 113.70 108.39 3a7q s SER 2350Ca 0.00 1.62 -0.20 0.00 0.48 0.00 0.00 55.95 57.85 3a7q s SER 2350Cb 0.00 -2.36 0.01 0.00 0.10 0.00 0.00 66.02 63.77 3a7q s SER 2350CO 0.00 -4.15 0.59 -0.89 0.98 0.00 0.00 173.24 169.77 3a7q s THR 2351N -2.46 4.92 0.00 2.02 2.01 -1.26 -4.90 115.64 115.97 3a7q s THR 2351Ca 0.68 0.36 0.00 0.00 0.31 0.00 0.00 61.69 63.04 3a7q s THR 2351Cb -0.25 -4.07 0.00 0.00 0.01 0.00 0.00 72.50 68.18 3a7q s THR 2351CO 0.64 -0.36 0.00 0.61 -0.69 0.00 0.00 174.62 174.82 3a7q n GLY 2352N 4.82 2.12 3.84 4.40 0.00 -1.26 -4.69 105.19 114.41 3a7q n GLY 2352Ca -0.03 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 3a7q n GLY 2352CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3a7q s ASP 2353N -4.00 6.79 0.40 1.61 1.11 -1.26 -4.10 116.67 117.23 3a7q s ASP 2353Ca 0.00 1.40 0.07 0.00 0.18 0.00 0.00 52.55 54.21 3a7q s ASP 2353Cb 0.00 -2.42 -0.07 0.00 1.07 0.00 0.00 42.92 41.49 3a7q s ASP 2353CO 0.00 -0.29 0.03 0.00 1.18 0.00 0.00 175.17 176.09 3a7q s ALA 2354N -2.11 3.21 -0.26 5.23 0.00 0.19 -4.43 121.76 123.60 3a7q s ALA 2354Ca 0.56 -2.26 -0.25 0.00 0.00 0.00 0.00 51.96 50.02 3a7q s ALA 2354Cb -0.10 0.06 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 3a7q s ALA 2354CO 0.18 -0.11 0.84 -1.17 0.00 0.00 0.00 175.76 175.51 3a7q s LEU 2355N -3.73 4.07 -0.07 0.00 2.96 -0.55 -1.78 118.68 119.59 3a7q s LEU 2355Ca 0.36 0.97 0.04 0.00 -0.22 0.00 0.00 54.13 55.28 3a7q s LEU 2355Cb 0.08 -3.20 -0.00 0.00 0.50 0.00 0.00 46.19 43.57 3a7q s LEU 2355CO 0.19 -0.56 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.75 3a7q s VAL 2356N 2.92 1.77 -0.96 1.68 1.01 0.58 -1.54 120.40 125.87 3a7q s VAL 2356Ca 0.35 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.41 3a7q s VAL 2356Cb -0.15 -1.53 0.24 0.00 0.00 0.00 0.00 36.38 34.94 3a7q s VAL 2356CO 0.09 0.50 0.88 -0.36 0.00 0.00 0.00 175.10 176.20 3a7q s PHE 2357N 0.16 4.01 -0.01 5.22 0.08 -0.06 0.11 117.98 127.49 3a7q s PHE 2357Ca -0.10 -2.95 0.01 0.00 0.12 0.00 0.00 56.93 54.00 3a7q s PHE 2357Cb -0.15 -3.40 -0.01 0.00 -0.57 0.00 0.00 43.02 38.89 3a7q s PHE 2357CO 0.05 -0.79 0.00 1.51 -0.10 0.00 0.00 175.22 175.89 3a7q n ILE 2358N 2.40 0.06 -1.40 0.64 3.06 -1.25 -2.94 119.36 119.92 3a7q n ILE 2358Ca 0.22 -0.03 -0.29 0.00 -2.50 0.00 0.00 62.75 60.15 3a7q n ILE 2358Cb 0.37 -0.88 0.18 0.00 0.54 0.00 0.00 39.64 39.86 3a7q n ILE 2358CO 0.00 0.00 0.00 -1.61 -2.50 0.00 0.00 176.55 172.44 3a7q s GLU 2359N -2.02 0.16 -0.15 9.51 2.02 -1.26 -4.88 118.70 122.09 3a7q s GLU 2359Ca -0.01 0.08 -0.29 0.00 0.02 0.00 0.00 54.97 54.77 3a7q s GLU 2359Cb 0.00 -1.74 -0.03 0.00 0.10 0.00 0.00 34.13 32.45 3a7q s GLU 2359CO 0.03 -2.82 1.53 0.21 0.02 0.00 0.00 175.26 174.23 3a7q s LYS 2360N -5.38 4.06 0.01 1.61 2.20 -1.26 -4.98 119.74 116.00 3a7q s LYS 2360Ca 0.68 1.85 -0.01 0.00 -0.36 0.00 0.00 55.97 58.13 3a7q s LYS 2360Cb -0.12 -3.94 -0.01 0.00 -1.51 0.00 0.00 37.83 32.26 3a7q s LYS 2360CO 0.55 -0.96 0.00 0.00 -0.36 0.00 0.00 175.35 174.58 3a7q s ALA 2361N 4.28 0.02 0.00 3.13 0.00 -1.26 -4.99 121.76 122.94 3a7q s ALA 2361Ca 0.67 -0.21 0.15 0.00 0.00 0.00 0.00 51.96 52.57 3a7q s ALA 2361Cb -0.27 0.05 0.23 0.00 0.00 0.00 0.00 23.12 23.13 3a7q s ALA 2361CO 0.25 -0.07 1.52 0.77 0.00 0.00 0.00 175.76 178.23 3a7q h SER 2362N 5.49 0.00 -3.82 0.00 0.02 -1.94 -3.47 113.55 109.83 3a7q h SER 2362Ca -0.27 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.48 3a7q h SER 2362Cb 1.21 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 63.48 3a7q h SER 2362CO 0.46 0.54 -0.56 -0.89 -1.14 0.00 0.00 176.83 175.24 3a7q s THR 2363N -3.15 0.00 -0.15 -2.27 2.01 -1.26 -4.93 115.64 105.89 3a7q s THR 2363Ca 0.02 -0.02 -0.02 0.00 0.31 0.00 0.00 61.69 61.98 3a7q s THR 2363Cb 0.09 -0.20 0.05 0.00 0.01 0.00 0.00 72.50 72.45 3a7q s THR 2363CO 0.74 -0.01 0.01 -0.13 -0.69 0.00 0.00 174.62 174.53 3a7q s ARG 2364N 0.02 0.81 0.16 4.92 0.52 -1.26 -3.60 118.95 120.53 3a7q s ARG 2364Ca -0.00 -0.28 -0.24 0.00 -0.52 0.00 0.00 55.73 54.69 3a7q s ARG 2364Cb -0.01 -1.74 0.06 0.00 0.52 0.00 0.00 34.95 33.78 3a7q s ARG 2364CO 0.00 -0.49 0.70 1.52 0.02 0.00 0.00 175.30 177.06 3a7q s TYR 2365N 1.84 -0.39 -0.05 -0.53 -0.85 -0.97 -1.84 117.35 114.56 3a7q s TYR 2365Ca 0.01 0.12 -0.01 0.00 -0.52 0.00 0.00 57.07 56.68 3a7q s TYR 2365Cb -0.15 0.60 0.03 0.00 0.38 0.00 0.00 41.96 42.82 3a7q s TYR 2365CO -0.07 -0.89 0.01 0.54 -1.52 0.00 0.00 175.55 173.61 3a7q s VAL 2366N -3.65 0.28 -0.16 -3.49 0.11 -0.88 -2.44 120.40 110.16 3a7q s VAL 2366Ca 0.05 0.13 -0.05 0.00 -2.93 0.00 0.00 61.98 59.19 3a7q s VAL 2366Cb -0.02 -0.42 -0.03 0.00 -1.53 0.00 0.00 36.38 34.37 3a7q s VAL 2366CO -0.06 0.22 -0.00 -0.69 -3.33 0.00 0.00 175.10 171.24 3a7q s VAL 2367N 1.69 4.22 0.69 2.04 1.01 -0.07 -2.04 120.40 127.94 3a7q s VAL 2367Ca 0.00 -0.24 -0.11 0.00 0.00 0.00 0.00 61.98 61.63 3a7q s VAL 2367Cb -0.13 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.39 3a7q s VAL 2367CO -0.04 0.49 1.07 0.42 0.00 0.00 0.00 175.10 177.04 3a7q s THR 2368N 0.26 3.94 0.96 3.92 -4.23 0.51 -1.51 115.64 119.50 3a7q s THR 2368Ca -0.00 0.63 -0.14 0.00 -1.18 0.00 0.00 61.69 61.00 3a7q s THR 2368Cb -0.13 -3.55 0.17 0.00 1.34 0.00 0.00 72.50 70.32 3a7q s THR 2368CO 0.02 -0.82 1.15 0.28 -0.54 0.00 0.00 174.62 174.71 3a7q s THR 2369N -3.22 1.95 -0.00 3.99 -1.32 0.26 -4.40 115.64 112.89 3a7q s THR 2369Ca 0.57 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.75 3a7q s THR 2369Cb -0.12 -2.73 -0.04 0.00 -1.51 0.00 0.00 72.50 68.10 3a7q s THR 2369CO 0.53 0.00 1.16 -1.81 -2.21 0.00 0.00 174.62 172.29 3a7q s ASP 2370N -4.07 7.11 0.25 8.08 1.01 -1.26 -4.49 116.67 123.30 3a7q s ASP 2370Ca 0.66 1.86 0.10 0.00 0.71 0.00 0.00 52.55 55.88 3a7q s ASP 2370Cb -0.13 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.18 3a7q s ASP 2370CO 0.54 -0.49 -0.18 0.27 0.21 0.00 0.00 175.17 175.52 3a7q s ILE 2371N 1.60 2.22 -0.18 0.77 -4.36 -0.81 -4.52 121.20 115.91 3a7q s ILE 2371Ca 0.56 -2.33 -0.22 0.00 -0.26 0.00 0.00 60.65 58.40 3a7q s ILE 2371Cb -0.26 -2.20 -0.02 0.00 1.25 0.00 0.00 42.46 41.22 3a7q s ILE 2371CO 0.25 -0.46 0.68 0.00 0.24 0.00 0.00 174.94 175.65 3a7q s ALA 2372N -2.65 3.52 -0.18 2.27 0.00 0.65 -1.19 121.76 124.18 3a7q s ALA 2372Ca 0.27 -0.17 -0.05 0.00 0.00 0.00 0.00 51.96 52.02 3a7q s ALA 2372Cb -0.04 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.03 3a7q s ALA 2372CO 0.12 -0.54 -0.01 0.08 0.00 0.00 0.00 175.76 175.41 3a7q s VAL 2373N 1.87 3.99 0.13 0.00 1.01 0.12 -4.35 120.40 123.17 3a7q s VAL 2373Ca 0.32 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.99 3a7q s VAL 2373Cb -0.16 -2.78 -0.00 0.00 0.00 0.00 0.00 36.38 33.44 3a7q s VAL 2373CO 0.11 0.46 0.03 -0.46 0.00 0.00 0.00 175.10 175.24 3a7q n ASN 2374N 3.89 1.51 -0.34 3.32 0.23 -1.26 -2.80 115.26 119.81 3a7q n ASN 2374Ca -0.17 -1.66 0.16 0.00 -0.53 0.00 0.00 54.58 52.38 3a7q n ASN 2374Cb 0.52 0.24 0.38 0.00 -2.08 0.00 0.00 39.78 38.84 3a7q n ASN 2374CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3a7q h GLU 2375N 0.00 0.62 -0.59 -3.83 5.08 -1.98 -2.44 114.58 111.43 3a7q h GLU 2375Ca -0.11 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3a7q h GLU 2375Cb 0.37 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3a7q h GLU 2375CO 0.17 0.41 0.00 -0.25 -1.00 0.00 0.00 179.01 178.34 3a7q n ASP 2376N -4.77 3.39 -4.79 1.42 9.92 -1.26 -4.92 116.55 115.55 3a7q n ASP 2376Ca 0.24 -2.17 -0.39 0.00 -0.53 0.00 0.00 54.79 51.94 3a7q n ASP 2376Cb 0.67 -0.44 -0.06 0.00 -0.64 0.00 0.00 41.12 40.65 3a7q n ASP 2376CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 3a7q s SER 2377N -0.90 7.14 0.03 -2.24 0.01 -0.92 -4.26 113.70 112.55 3a7q s SER 2377Ca 0.39 1.35 -0.05 0.00 1.31 0.00 0.00 55.95 58.94 3a7q s SER 2377Cb 0.22 -2.40 -0.01 0.00 0.21 0.00 0.00 66.02 64.04 3a7q s SER 2377CO 0.22 0.20 0.08 0.72 0.41 0.00 0.00 173.24 174.88 3a7q s PHE 2378N -0.84 0.19 -0.18 2.43 -0.12 -0.49 -0.99 117.98 117.97 3a7q s PHE 2378Ca 0.32 -0.45 -0.07 0.00 -0.05 0.00 0.00 56.93 56.68 3a7q s PHE 2378Cb -0.20 -0.14 -0.04 0.00 -0.63 0.00 0.00 43.02 42.01 3a7q s PHE 2378CO 0.21 -0.33 0.05 -1.17 -0.05 0.00 0.00 175.22 173.93 3a7q s LEU 2379N -1.91 3.68 -0.05 -1.99 0.20 0.75 -1.31 118.68 118.04 3a7q s LEU 2379Ca -0.08 0.01 -0.02 0.00 0.69 0.00 0.00 54.13 54.73 3a7q s LEU 2379Cb -0.03 -1.93 0.03 0.00 -0.43 0.00 0.00 46.19 43.83 3a7q s LEU 2379CO -0.03 0.15 0.06 -1.58 -0.29 0.00 0.00 176.35 174.66 3a7q s GLN 2380N 0.51 -0.03 0.04 1.98 0.74 0.14 0.32 119.66 123.36 3a7q s GLN 2380Ca 0.02 0.33 0.01 0.00 0.05 0.00 0.00 55.36 55.77 3a7q s GLN 2380Cb -0.13 -0.63 -0.03 0.00 1.10 0.00 0.00 33.01 33.33 3a7q s GLN 2380CO 0.01 -0.35 -0.06 0.96 -0.55 0.00 0.00 175.29 175.30 3a7q s ILE 2381N 2.16 0.40 -0.01 -2.34 -4.36 -0.75 0.15 121.20 116.46 3a7q s ILE 2381Ca 0.05 -1.23 -0.19 0.00 -0.26 0.00 0.00 60.65 59.02 3a7q s ILE 2381Cb -0.12 -0.76 -0.06 0.00 1.25 0.00 0.00 42.46 42.78 3a7q s ILE 2381CO -0.04 -0.55 0.53 -1.81 0.24 0.00 0.00 174.94 173.31 3a7q s ASP 2382N -1.90 6.90 0.05 4.36 1.11 0.12 -0.57 116.67 126.75 3a7q s ASP 2382Ca -0.07 1.08 0.05 0.00 0.18 0.00 0.00 52.55 53.78 3a7q s ASP 2382Cb -0.06 -2.32 -0.02 0.00 1.07 0.00 0.00 42.92 41.58 3a7q s ASP 2382CO -0.02 0.17 -0.14 0.12 1.18 0.00 0.00 175.17 176.49 3a7q s PHE 2383N -0.45 1.19 -0.09 4.23 5.36 -0.31 -1.87 117.98 126.05 3a7q s PHE 2383Ca 0.28 -0.39 -0.06 0.00 -0.96 0.00 0.00 56.93 55.80 3a7q s PHE 2383Cb -0.18 -0.70 0.03 0.00 -0.34 0.00 0.00 43.02 41.84 3a7q s PHE 2383CO 0.15 0.04 0.22 0.00 -1.46 0.00 0.00 175.22 174.17 3a7q s ALA 2384N -0.98 -0.52 0.00 11.12 0.00 -0.41 -1.92 121.76 129.04 3a7q s ALA 2384Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 51.96 52.70 3a7q s ALA 2384Cb -0.08 -0.45 0.00 0.00 0.00 0.00 0.00 23.12 22.59 3a7q s ALA 2384CO 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 175.76 175.64 3a7q n ALA 2385N 3.45 0.00 0.62 0.00 0.00 0.77 -0.33 120.51 125.02 3a7q n ALA 2385Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.39 3a7q n ALA 2385Cb 0.56 0.00 0.44 0.00 0.00 0.00 0.00 19.45 20.45 3a7q n ALA 2385CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3a7q n SER 2386N 0.00 0.68 -3.51 0.00 3.41 -1.05 -4.23 113.62 108.93 3a7q n SER 2386Ca 0.00 0.58 -0.20 0.00 -0.26 0.00 0.00 58.87 59.00 3a7q n SER 2386Cb 0.00 -0.76 0.06 0.00 -0.26 0.00 0.00 64.21 63.25 3a7q n SER 2386CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3a7q n SER 2388N -3.08 -4.47 -0.04 0.00 7.64 -1.26 -4.93 113.62 107.48 3a7q n SER 2388Ca -0.22 0.29 -0.11 0.00 1.01 0.00 0.00 58.87 59.84 3a7q n SER 2388Cb 0.65 -3.11 -0.09 0.00 -1.01 0.00 0.00 64.21 60.66 3a7q n SER 2388CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3a7q h VAL 2389N 0.00 1.23 -2.02 0.44 2.07 -1.87 -3.47 116.25 112.63 3a7q h VAL 2389Ca -0.26 -1.75 -0.61 0.00 0.82 0.00 0.00 66.70 64.89 3a7q h VAL 2389Cb 0.84 2.25 -0.14 0.00 -1.52 0.00 0.00 31.29 32.72 3a7q h VAL 2389CO 0.37 0.39 -0.70 0.28 0.02 0.00 0.00 177.57 177.93 3a7q s THR 2390N -2.47 2.34 -0.23 2.57 -1.32 -1.26 -5.04 115.64 110.22 3a7q s THR 2390Ca -0.14 -2.25 0.13 0.00 -1.21 0.00 0.00 61.69 58.22 3a7q s THR 2390Cb -0.01 -2.55 0.56 0.00 -1.51 0.00 0.00 72.50 68.98 3a7q s THR 2390CO 0.51 -0.26 1.50 -0.90 -2.21 0.00 0.00 174.62 173.25 3a7q n ASP 2391N -0.75 3.63 -4.75 8.08 3.85 -1.26 -4.91 116.55 120.44 3a7q n ASP 2391Ca -0.05 -3.27 -0.37 0.00 -0.71 0.00 0.00 54.79 50.39 3a7q n ASP 2391Cb 0.62 -0.60 0.03 0.00 -1.35 0.00 0.00 41.12 39.82 3a7q n ASP 2391CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.20 175.75 3a7q s SER 2392N -1.97 5.33 -0.43 -1.12 0.01 -1.26 -5.00 113.70 109.26 3a7q s SER 2392Ca 0.45 2.53 -0.17 0.00 1.31 0.00 0.00 55.95 60.07 3a7q s SER 2392Cb 0.38 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 64.02 3a7q s SER 2392CO 0.07 -1.51 0.43 0.00 0.41 0.00 0.00 173.24 172.64 3a7q s TYR 2394N 2.09 0.26 -0.02 0.00 -0.85 -1.26 -5.02 117.35 112.55 3a7q s TYR 2394Ca 0.11 -0.70 0.03 0.00 -0.52 0.00 0.00 57.07 55.99 3a7q s TYR 2394Cb -0.18 -0.13 -0.00 0.00 0.38 0.00 0.00 41.96 42.04 3a7q s TYR 2394CO 0.13 -0.53 -0.09 0.00 -1.52 0.00 0.00 175.55 173.54 3a7q s ALA 2395N -3.89 0.84 -0.25 9.51 0.00 -1.26 -0.69 121.76 126.02 3a7q s ALA 2395Ca 0.07 -0.36 -0.19 0.00 0.00 0.00 0.00 51.96 51.48 3a7q s ALA 2395Cb 0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 3a7q s ALA 2395CO -0.09 0.16 0.59 0.42 0.00 0.00 0.00 175.76 176.83 3a7q s ILE 2396N 0.06 5.02 0.41 0.00 -1.09 -0.27 -4.67 121.20 120.66 3a7q s ILE 2396Ca -0.01 1.05 -0.25 0.00 -2.23 0.00 0.00 60.65 59.21 3a7q s ILE 2396Cb -0.07 -3.90 -0.08 0.00 -1.58 0.00 0.00 42.46 36.83 3a7q s ILE 2396CO 0.00 0.05 1.17 -1.61 -1.23 0.00 0.00 174.94 173.32 3a7q s GLU 2397N 2.41 3.99 -0.15 2.79 0.41 0.80 -4.27 118.70 124.67 3a7q s GLU 2397Ca 0.24 1.82 -0.00 0.00 -0.41 0.00 0.00 54.97 56.62 3a7q s GLU 2397Cb -0.16 -2.61 0.04 0.00 -1.78 0.00 0.00 34.13 29.62 3a7q s GLU 2397CO 0.09 -0.37 -0.07 -1.17 -0.49 0.00 0.00 175.26 173.25 3a7q s LEU 2398N -2.62 1.56 0.31 1.80 2.96 -1.26 0.05 118.68 121.48 3a7q s LEU 2398Ca 0.59 -0.58 0.05 0.00 -0.22 0.00 0.00 54.13 53.96 3a7q s LEU 2398Cb -0.30 -0.93 -0.06 0.00 0.50 0.00 0.00 46.19 45.39 3a7q s LEU 2398CO 0.37 -0.16 0.02 -1.61 -1.32 0.00 0.00 176.35 173.66 3a7q s GLU 2399N 1.63 1.60 0.09 1.98 2.02 0.12 -1.78 118.70 124.35 3a7q s GLU 2399Ca 0.02 -1.86 0.02 0.00 0.02 0.00 0.00 54.97 53.17 3a7q s GLU 2399Cb -0.14 -0.95 -0.04 0.00 0.10 0.00 0.00 34.13 33.10 3a7q s GLU 2399CO -0.08 -0.11 -0.07 1.52 0.02 0.00 0.00 175.26 176.54 3a7q s TYR 2400N -3.21 0.87 -0.01 1.61 -0.85 0.68 -1.28 117.35 115.16 3a7q s TYR 2400Ca 0.34 -0.83 -0.01 0.00 -0.52 0.00 0.00 57.07 56.05 3a7q s TYR 2400Cb 0.07 -0.50 0.00 0.00 0.38 0.00 0.00 41.96 41.91 3a7q s TYR 2400CO 0.14 -0.13 0.02 0.45 -1.52 0.00 0.00 175.55 174.51 3a7q s SER 2401N -2.77 -0.00 0.00 -0.18 0.15 0.15 -1.32 113.70 109.73 3a7q s SER 2401Ca 0.08 0.00 0.06 0.00 0.70 0.00 0.00 55.95 56.79 3a7q s SER 2401Cb 0.02 0.05 0.03 0.00 -1.71 0.00 0.00 66.02 64.42 3a7q s SER 2401CO -0.04 -0.03 0.63 1.33 1.20 0.00 0.00 173.24 176.33 3a7q n VAL 2402N 2.94 0.00 -1.94 4.45 0.24 -1.26 -0.66 118.33 122.10 3a7q n VAL 2402Ca -0.13 -0.48 -0.23 0.00 -2.04 0.00 0.00 64.34 61.46 3a7q n VAL 2402Cb 0.59 1.11 0.04 0.00 -1.47 0.00 0.00 33.84 34.11 3a7q n VAL 2402CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3a7q n ASP 2403N 0.12 4.87 -2.83 -1.34 3.85 -1.26 -4.88 116.55 115.09 3a7q n ASP 2403Ca 0.03 -3.76 -0.20 0.00 -0.71 0.00 0.00 54.79 50.15 3a7q n ASP 2403Cb 0.15 -0.40 0.04 0.00 -1.35 0.00 0.00 41.12 39.56 3a7q n ASP 2403CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 3a7q n LEU 2404N -0.76 -2.73 -0.02 -2.12 4.77 -1.26 -2.50 117.00 112.38 3a7q n LEU 2404Ca 0.44 -0.31 -0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3a7q n LEU 2404Cb 0.93 -2.72 -0.00 0.00 -2.33 0.00 0.00 43.42 39.30 3a7q n LEU 2404CO 0.40 0.30 -0.00 0.61 -1.33 0.00 0.00 177.39 177.36 3a7q n GLY 2405N -1.54 0.45 0.01 -0.72 0.00 -1.26 -4.85 105.19 97.28 3a7q n GLY 2405Ca -0.08 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 45.97 3a7q n GLY 2405CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3a7q n LEU 2406N -0.02 0.06 -3.64 0.99 4.77 -1.04 -4.78 117.00 113.34 3a7q n LEU 2406Ca -0.00 0.51 -0.10 0.00 -0.03 0.00 0.00 56.01 56.39 3a7q n LEU 2406Cb 0.07 -0.50 -0.07 0.00 -2.33 0.00 0.00 43.42 40.59 3a7q n LEU 2406CO 0.00 -0.16 0.66 -0.94 -1.33 0.00 0.00 177.39 175.62 3a7q s SER 2407N -3.12 -0.52 -0.00 -1.43 1.04 -1.26 -5.11 113.70 103.30 3a7q s SER 2407Ca 0.10 1.01 0.08 0.00 0.48 0.00 0.00 55.95 57.62 3a7q s SER 2407Cb 0.13 1.03 -0.02 0.00 0.10 0.00 0.00 66.02 67.26 3a7q s SER 2407CO 0.39 -0.17 -0.25 0.26 0.98 0.00 0.00 173.24 174.44 3a7q s TRP 2408N 0.28 2.26 0.13 5.02 0.52 -1.26 -4.55 118.94 121.33 3a7q s TRP 2408Ca 0.02 -0.42 0.08 0.00 0.02 0.00 0.00 56.10 55.80 3a7q s TRP 2408Cb -0.05 -1.43 -0.04 0.00 -1.15 0.00 0.00 33.47 30.81 3a7q s TRP 2408CO -0.05 0.00 -0.19 -1.01 0.02 0.00 0.00 176.95 175.72 3a7q s HIS 2409N -0.65 1.76 0.24 -1.98 3.76 -0.43 -4.95 115.29 113.03 3a7q s HIS 2409Ca 0.10 -0.45 -0.30 0.00 -0.15 0.00 0.00 55.06 54.27 3a7q s HIS 2409Cb -0.10 -0.93 -0.09 0.00 1.11 0.00 0.00 32.58 32.58 3a7q s HIS 2409CO -0.00 0.24 1.15 -2.14 -0.85 0.00 0.00 174.74 173.14 3a7q s PRO 2410N -2.28 4.56 0.00 8.40 0.02 -1.26 -0.23 135.00 144.21 3a7q s PRO 2410Ca 0.10 1.86 -0.25 0.00 0.02 0.00 0.00 61.00 62.73 3a7q s PRO 2410Cb -0.08 -3.21 -0.15 0.00 0.02 0.00 0.00 34.50 31.08 3a7q s PRO 2410CO 0.05 0.05 1.14 1.25 -0.33 0.00 0.00 177.00 179.16 3a7q h LEU 2411N 4.48 -0.48 -8.66 -5.54 5.85 -1.65 -3.41 115.31 105.91 3a7q h LEU 2411Ca -0.46 -0.11 -0.67 0.00 0.84 0.00 0.00 57.88 57.48 3a7q h LEU 2411Cb 1.21 0.12 -0.17 0.00 0.37 0.00 0.00 40.66 42.19 3a7q h LEU 2411CO 0.70 -0.10 -0.20 -0.69 -0.34 0.00 0.00 178.44 177.82 3a7q s VAL 2412N -4.51 5.10 -0.12 1.05 1.01 -1.26 -4.93 120.40 116.73 3a7q s VAL 2412Ca -0.14 -0.06 -0.19 0.00 0.00 0.00 0.00 61.98 61.59 3a7q s VAL 2412Cb 0.02 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 3a7q s VAL 2412CO 0.48 -0.27 0.51 0.00 0.00 0.00 0.00 175.10 175.83 3a7q s ARG 2413N 2.16 4.33 -0.60 2.72 1.70 -1.26 -3.68 118.95 124.33 3a7q s ARG 2413Ca 0.13 0.50 -0.30 0.00 -0.47 0.00 0.00 55.73 55.60 3a7q s ARG 2413Cb -0.16 -3.45 -0.13 0.00 -0.57 0.00 0.00 34.95 30.64 3a7q s ARG 2413CO 0.13 0.11 2.44 -3.47 -1.08 0.00 0.00 175.30 173.42 3a7q n ASP 2414N 3.83 1.69 -3.98 -2.89 2.03 -1.26 -4.57 116.55 111.40 3a7q n ASP 2414Ca -0.06 -0.04 -0.18 0.00 0.52 0.00 0.00 54.79 55.02 3a7q n ASP 2414Cb 0.51 -1.30 -0.15 0.00 -0.72 0.00 0.00 41.12 39.46 3a7q n ASP 2414CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3a7q s LEU 2416N 0.09 2.04 0.00 0.00 1.43 -1.26 -2.03 118.68 118.95 3a7q s LEU 2416Ca -0.01 -1.16 0.00 0.00 -1.03 0.00 0.00 54.13 51.93 3a7q s LEU 2416Cb -0.06 0.13 0.00 0.00 0.03 0.00 0.00 46.19 46.29 3a7q s LEU 2416CO -0.00 -0.64 0.00 -0.81 0.23 0.00 0.00 176.35 175.13 3a7q n PRO 2417N -0.12 0.00 -0.09 1.29 -0.04 -1.26 -3.72 135.00 131.06 3a7q n PRO 2417Ca -0.07 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.25 3a7q n PRO 2417Cb 0.63 -1.42 -0.04 0.00 -0.04 0.00 0.00 33.50 32.64 3a7q n PRO 2417CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3a7q h THR 2418N 0.83 1.29 -4.11 0.52 1.35 -1.96 -3.46 112.91 107.37 3a7q h THR 2418Ca 0.00 -1.55 -0.13 0.00 -0.55 0.00 0.00 66.41 64.18 3a7q h THR 2418Cb 0.00 1.57 -0.17 0.00 -1.73 0.00 0.00 68.15 67.82 3a7q h THR 2418CO 0.00 0.50 -0.66 0.21 -0.25 0.00 0.00 175.52 175.33 3a7q s ASN 2419N -6.71 0.38 0.10 5.36 3.04 -1.24 -4.99 114.94 110.88 3a7q s ASN 2419Ca -0.12 -0.82 0.09 0.00 0.04 0.00 0.00 52.86 52.06 3a7q s ASN 2419Cb 0.09 0.18 0.45 0.00 -1.54 0.00 0.00 41.25 40.44 3a7q s ASN 2419CO 0.86 -0.52 1.28 0.52 -3.04 0.00 0.00 177.10 176.19 3a7q n VAL 2420N 0.53 1.54 0.32 -5.21 0.31 -1.26 -1.86 118.33 112.70 3a7q n VAL 2420Ca -0.17 0.51 0.02 0.00 -0.01 0.00 0.00 64.34 64.68 3a7q n VAL 2420Cb 0.59 -1.47 0.08 0.00 -0.91 0.00 0.00 33.84 32.14 3a7q n VAL 2420CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3a7q h GLU 2421N 0.00 0.00 -4.35 5.55 4.22 -1.95 -3.38 114.58 114.67 3a7q h GLU 2421Ca 0.00 0.00 -0.18 0.00 0.08 0.00 0.00 59.36 59.26 3a7q h GLU 2421Cb 0.06 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.14 3a7q h GLU 2421CO 0.00 0.00 -0.70 0.00 -2.18 0.00 0.00 179.01 176.13 3a7q n SER 2423N 0.54 1.03 -4.89 0.00 3.41 -1.26 -4.90 113.62 107.54 3a7q n SER 2423Ca -0.17 -0.10 -0.34 0.00 -0.26 0.00 0.00 58.87 58.00 3a7q n SER 2423Cb 0.59 0.41 -0.05 0.00 -0.26 0.00 0.00 64.21 64.90 3a7q n SER 2423CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3a7q s ARG 2424N -0.62 3.51 -0.05 4.33 1.81 -1.26 -4.69 118.95 121.98 3a7q s ARG 2424Ca 0.00 -0.20 0.04 0.00 -1.72 0.00 0.00 55.73 53.85 3a7q s ARG 2424Cb 0.00 -3.07 -0.00 0.00 -0.45 0.00 0.00 34.95 31.43 3a7q s ARG 2424CO 0.00 0.65 -0.17 0.71 -0.68 0.00 0.00 175.30 175.81 3a7q s TYR 2425N -1.33 1.72 0.09 -0.53 2.02 -1.26 -4.81 117.35 113.24 3a7q s TYR 2425Ca 0.28 -0.53 -0.27 0.00 -0.37 0.00 0.00 57.07 56.19 3a7q s TYR 2425Cb -0.13 -1.17 0.08 0.00 -0.40 0.00 0.00 41.96 40.34 3a7q s TYR 2425CO 0.18 -0.19 1.05 -3.38 -1.57 0.00 0.00 175.55 171.63 3a7q s HIS 2426N 0.14 -0.12 0.02 2.71 -3.43 -0.86 -4.98 115.29 108.77 3a7q s HIS 2426Ca -0.06 -0.12 0.02 0.00 -0.80 0.00 0.00 55.06 54.10 3a7q s HIS 2426Cb -0.12 0.61 -0.04 0.00 -1.43 0.00 0.00 32.58 31.59 3a7q s HIS 2426CO 0.03 -0.65 0.03 -0.51 -2.00 0.00 0.00 174.74 171.64 3a7q s LEU 2427N -2.91 3.66 0.18 5.38 1.43 -1.26 -1.10 118.68 124.04 3a7q s LEU 2427Ca 0.12 0.01 -0.22 0.00 -1.03 0.00 0.00 54.13 53.01 3a7q s LEU 2427Cb 0.00 -2.19 0.09 0.00 0.03 0.00 0.00 46.19 44.12 3a7q s LEU 2427CO -0.00 0.24 1.59 -0.61 0.23 0.00 0.00 176.35 177.80 3a7q h GLN 2428N 3.97 -0.20 -5.84 1.70 4.15 -1.80 -3.34 115.11 113.75 3a7q h GLN 2428Ca -0.48 0.01 -0.60 0.00 0.77 0.00 0.00 58.65 58.35 3a7q h GLN 2428Cb 1.17 0.04 -0.12 0.00 0.21 0.00 0.00 27.48 28.79 3a7q h GLN 2428CO 0.60 -0.13 0.95 1.03 -1.93 0.00 0.00 178.83 179.35 3a7q s ARG 2429N -5.97 3.30 -0.17 1.69 0.52 -1.26 -4.68 118.95 112.38 3a7q s ARG 2429Ca -0.14 -0.80 -0.10 0.00 -0.52 0.00 0.00 55.73 54.17 3a7q s ARG 2429Cb 0.15 -4.52 -0.22 0.00 0.52 0.00 0.00 34.95 30.88 3a7q s ARG 2429CO 0.68 -2.00 0.18 -0.89 0.02 0.00 0.00 175.30 173.29 3a7q n ILE 2430N 6.21 1.66 -2.00 1.52 2.08 -1.25 -4.68 119.36 122.90 3a7q n ILE 2430Ca 0.09 -0.47 -0.42 0.00 0.56 0.00 0.00 62.75 62.51 3a7q n ILE 2430Cb 0.48 -1.77 -0.01 0.00 -0.75 0.00 0.00 39.64 37.59 3a7q n ILE 2430CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 3a7q n LEU 2431N -3.74 5.77 -4.91 1.39 4.77 -1.26 -4.95 117.00 114.07 3a7q n LEU 2431Ca -0.36 -3.91 -0.31 0.00 -0.03 0.00 0.00 56.01 51.40 3a7q n LEU 2431Cb 0.94 -1.65 -0.04 0.00 -2.33 0.00 0.00 43.42 40.34 3a7q n LEU 2431CO 0.31 0.50 -0.08 -0.69 -1.33 0.00 0.00 177.39 176.11 3a7q s VAL 2432N 4.11 5.30 0.27 4.08 1.01 -1.26 -1.11 120.40 132.80 3a7q s VAL 2432Ca 0.51 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 62.32 3a7q s VAL 2432Cb 0.10 -3.63 0.01 0.00 0.00 0.00 0.00 36.38 32.86 3a7q s VAL 2432CO -0.00 0.09 1.66 0.77 0.00 0.00 0.00 175.10 177.62 3a7q h SER 2433N 2.95 0.28 0.06 3.32 4.64 -1.23 -2.18 113.55 121.38 3a7q h SER 2433Ca -0.45 -0.13 -0.09 0.00 -0.47 0.00 0.00 61.79 60.65 3a7q h SER 2433Cb 1.16 -0.08 0.01 0.00 -0.31 0.00 0.00 62.40 63.19 3a7q h SER 2433CO 0.74 0.70 -0.40 -2.24 -0.87 0.00 0.00 176.83 174.76 3a7q h ASP 2434N 0.21 0.26 -0.59 4.97 -0.00 -1.84 -1.97 116.42 117.45 3a7q h ASP 2434Ca 0.01 -0.92 0.07 0.00 -0.00 0.00 0.00 57.03 56.19 3a7q h ASP 2434Cb 0.90 -0.08 -0.06 0.00 -0.00 0.00 0.00 39.33 40.09 3a7q h ASP 2434CO 0.07 1.16 0.27 0.74 -0.00 0.00 0.00 179.24 181.48 3a7q h THR 2435N -0.60 0.88 -0.73 1.15 2.02 -1.96 -3.01 112.91 110.65 3a7q h THR 2435Ca -0.07 -0.17 -0.28 0.00 0.77 0.00 0.00 66.41 66.66 3a7q h THR 2435Cb 1.27 0.33 -0.17 0.00 -1.74 0.00 0.00 68.15 67.84 3a7q h THR 2435CO 0.08 0.09 0.31 0.49 0.37 0.00 0.00 175.52 176.86 3a7q n PHE 2436N -4.91 2.36 -0.29 3.16 3.72 -0.82 -4.68 117.46 116.01 3a7q n PHE 2436Ca 0.07 -1.40 -0.05 0.00 -0.05 0.00 0.00 57.45 56.02 3a7q n PHE 2436Cb 0.21 -0.71 0.00 0.00 -0.94 0.00 0.00 39.48 38.04 3a7q n PHE 2436CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 3a7q h ASN 2437N 1.98 -1.42 -0.89 4.37 -1.24 -1.21 0.22 115.58 117.38 3a7q h ASN 2437Ca 0.34 0.27 -0.56 0.00 0.71 0.00 0.00 56.30 57.06 3a7q h ASN 2437Cb 2.34 0.70 -0.05 0.00 0.73 0.00 0.00 38.32 42.04 3a7q h ASN 2437CO 0.76 -0.30 -0.34 -0.54 -1.29 0.00 0.00 177.43 175.72 3a7q s LYS 2438N -5.90 2.30 -0.06 6.67 1.02 -1.26 -2.10 119.74 120.41 3a7q s LYS 2438Ca -0.14 -1.90 -0.37 0.00 0.02 0.00 0.00 55.97 53.58 3a7q s LYS 2438Cb 0.17 -2.13 -0.15 0.00 -0.52 0.00 0.00 37.83 35.19 3a7q s LYS 2438CO 0.69 -0.47 1.63 0.91 -0.92 0.00 0.00 175.35 177.19 3a7q n TRP 2439N -1.65 1.99 -3.76 3.18 7.02 -1.26 -4.59 117.44 118.38 3a7q n TRP 2439Ca -0.01 0.41 -0.14 0.00 -1.02 0.00 0.00 57.50 56.74 3a7q n TRP 2439Cb 0.64 -2.48 -0.15 0.00 -2.42 0.00 0.00 31.31 26.90 3a7q n TRP 2439CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 3a7q s THR 2440N 2.34 -0.05 0.37 -0.99 2.01 -0.81 -4.97 115.64 113.55 3a7q s THR 2440Ca 0.90 0.17 -0.24 0.00 0.31 0.00 0.00 61.69 62.83 3a7q s THR 2440Cb -0.89 -0.20 -0.10 0.00 0.01 0.00 0.00 72.50 71.31 3a7q s THR 2440CO 0.53 0.07 0.94 -0.60 -0.69 0.00 0.00 174.62 174.87 3a7q s ARG 2441N 1.05 4.42 -0.05 4.92 3.52 -1.26 -1.16 118.95 130.39 3a7q s ARG 2441Ca -0.08 1.23 -0.01 0.00 -0.13 0.00 0.00 55.73 56.73 3a7q s ARG 2441Cb -0.11 -2.52 0.03 0.00 -1.56 0.00 0.00 34.95 30.78 3a7q s ARG 2441CO -0.05 0.14 0.02 -1.50 -0.81 0.00 0.00 175.30 173.10 3a7q s ILE 2442N -1.87 0.17 -0.17 4.11 2.07 0.27 -4.95 121.20 120.83 3a7q s ILE 2442Ca 0.55 0.21 0.01 0.00 -1.41 0.00 0.00 60.65 60.01 3a7q s ILE 2442Cb -0.14 -0.34 0.01 0.00 0.13 0.00 0.00 42.46 42.12 3a7q s ILE 2442CO 0.19 0.20 -0.19 -0.89 -1.91 0.00 0.00 174.94 172.34 3a7q s THR 2443N 1.76 2.19 -0.15 4.00 2.01 -1.26 -1.80 115.64 122.38 3a7q s THR 2443Ca 0.01 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.10 3a7q s THR 2443Cb -0.13 -1.91 0.02 0.00 0.01 0.00 0.00 72.50 70.50 3a7q s THR 2443CO -0.03 0.53 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.51 3a7q s LEU 2444N 1.10 1.84 0.22 4.42 1.43 0.15 -4.70 118.68 123.13 3a7q s LEU 2444Ca 0.00 -0.53 -0.31 0.00 -1.03 0.00 0.00 54.13 52.26 3a7q s LEU 2444Cb -0.14 -1.27 -0.11 0.00 0.03 0.00 0.00 46.19 44.70 3a7q s LEU 2444CO -0.08 -0.02 1.60 -2.84 0.23 0.00 0.00 176.35 175.24 3a7q s PRO 2445N 1.34 4.18 -0.16 1.29 0.02 -1.26 -0.18 135.00 140.23 3a7q s PRO 2445Ca 0.03 2.47 -0.29 0.00 0.02 0.00 0.00 61.00 63.23 3a7q s PRO 2445Cb -0.13 -3.10 -0.01 0.00 0.02 0.00 0.00 34.50 31.28 3a7q s PRO 2445CO -0.10 -0.63 1.14 -0.51 -0.33 0.00 0.00 177.00 176.57 3a7q s LEU 2446N 0.57 4.18 0.88 -5.54 1.43 -0.16 -4.89 118.68 115.16 3a7q s LEU 2446Ca 0.68 1.59 -0.12 0.00 -1.03 0.00 0.00 54.13 55.25 3a7q s LEU 2446Cb -0.46 -3.55 0.09 0.00 0.03 0.00 0.00 46.19 42.30 3a7q s LEU 2446CO 0.37 -0.65 0.95 -2.65 0.23 0.00 0.00 176.35 174.60 3a7q n PRO 2447N 5.98 -0.18 -0.13 1.29 -0.02 -1.26 -4.87 135.00 135.81 3a7q n PRO 2447Ca 0.12 0.01 -0.00 0.00 -2.02 0.00 0.00 63.50 61.61 3a7q n PRO 2447Cb 0.46 -2.24 0.26 0.00 -0.02 0.00 0.00 33.50 31.96 3a7q n PRO 2447CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3a7q h SER 2448N -1.41 0.74 0.06 2.55 4.64 -1.97 -0.44 113.55 117.72 3a7q h SER 2448Ca -0.44 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3a7q h SER 2448Cb 1.29 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3a7q h SER 2448CO 0.41 0.63 0.00 0.00 -0.87 0.00 0.00 176.83 177.00 3a7q n TYR 2449N -4.36 0.00 1.15 4.77 0.18 -1.26 -0.95 117.16 116.69 3a7q n TYR 2449Ca 0.05 0.00 0.12 0.00 1.88 0.00 0.00 57.90 59.95 3a7q n TYR 2449Cb 0.13 -0.06 0.21 0.00 -0.38 0.00 0.00 39.34 39.24 3a7q n TYR 2449CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 3a7q n THR 2450N -1.06 0.00 -2.56 -3.48 -2.24 -0.17 -4.90 114.28 99.87 3a7q n THR 2450Ca 0.13 -0.27 -0.43 0.00 -2.27 0.00 0.00 64.05 61.21 3a7q n THR 2450Cb 0.08 0.94 -0.02 0.00 -2.10 0.00 0.00 70.33 69.22 3a7q n THR 2450CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3a7q s ARG 2451N -2.31 3.82 0.35 -0.78 0.52 -0.13 -4.62 118.95 115.80 3a7q s ARG 2451Ca 0.25 0.83 -0.14 0.00 -0.52 0.00 0.00 55.73 56.16 3a7q s ARG 2451Cb 0.19 -3.87 0.03 0.00 0.52 0.00 0.00 34.95 31.82 3a7q s ARG 2451CO 0.47 -1.24 0.68 -1.54 0.02 0.00 0.00 175.30 173.68 3a7q s SER 2452N 2.46 0.14 0.41 0.23 1.04 -1.12 -4.97 113.70 111.90 3a7q s SER 2452Ca 0.50 -1.10 0.23 0.00 0.48 0.00 0.00 55.95 56.05 3a7q s SER 2452Cb -0.10 0.77 0.61 0.00 0.10 0.00 0.00 66.02 67.40 3a7q s SER 2452CO 0.26 -1.50 1.69 1.56 0.98 0.00 0.00 173.24 176.24 3a7q h GLN 2453N 2.05 0.00 -2.06 4.02 1.08 -1.86 0.36 115.11 118.70 3a7q h GLN 2453Ca -0.29 0.00 -0.49 0.00 -1.45 0.00 0.00 58.65 56.43 3a7q h GLN 2453Cb 1.25 0.00 -0.33 0.00 -0.05 0.00 0.00 27.48 28.35 3a7q h GLN 2453CO 0.37 0.22 -0.86 0.00 -0.95 0.00 0.00 178.83 177.61 3a7q s ALA 2454N -3.37 0.54 -0.20 3.87 0.00 -1.25 -3.19 121.76 118.18 3a7q s ALA 2454Ca 0.03 -1.93 -0.06 0.00 0.00 0.00 0.00 51.96 50.00 3a7q s ALA 2454Cb 0.08 -1.85 -0.03 0.00 0.00 0.00 0.00 23.12 21.32 3a7q s ALA 2454CO 0.66 -2.04 0.02 0.99 0.00 0.00 0.00 175.76 175.39 3a7q s THR 2455N 0.34 4.26 0.24 0.00 2.01 -0.33 -4.34 115.64 117.81 3a7q s THR 2455Ca 0.31 -0.21 0.08 0.00 0.31 0.00 0.00 61.69 62.18 3a7q s THR 2455Cb 0.01 -2.92 -0.04 0.00 0.01 0.00 0.00 72.50 69.56 3a7q s THR 2455CO -0.15 0.43 0.07 0.00 -0.69 0.00 0.00 174.62 174.28 3a7q s ARG 2456N 0.81 2.56 0.17 4.92 1.70 0.17 -1.93 118.95 127.36 3a7q s ARG 2456Ca 0.02 -1.21 0.11 0.00 -0.47 0.00 0.00 55.73 54.17 3a7q s ARG 2456Cb -0.14 -2.36 -0.04 0.00 -0.57 0.00 0.00 34.95 31.84 3a7q s ARG 2456CO 0.02 0.40 -0.24 -0.06 -1.08 0.00 0.00 175.30 174.34 3a7q s PHE 2457N -2.13 2.20 -0.04 5.89 0.08 -1.26 -0.68 117.98 122.04 3a7q s PHE 2457Ca 0.31 -0.38 -0.02 0.00 0.12 0.00 0.00 56.93 56.96 3a7q s PHE 2457Cb -0.08 -1.12 0.02 0.00 -0.57 0.00 0.00 43.02 41.28 3a7q s PHE 2457CO 0.22 0.43 0.10 0.50 -0.10 0.00 0.00 175.22 176.37 3a7q s ARG 2458N -2.52 0.07 -0.22 0.44 3.52 -0.40 -0.36 118.95 119.48 3a7q s ARG 2458Ca 0.18 0.24 -0.10 0.00 -0.13 0.00 0.00 55.73 55.92 3a7q s ARG 2458Cb -0.08 -0.10 -0.05 0.00 -1.56 0.00 0.00 34.95 33.16 3a7q s ARG 2458CO 0.08 -0.10 0.14 -1.58 -0.81 0.00 0.00 175.30 173.03 3a7q s TRP 2459N 0.70 3.32 -0.07 5.12 0.51 -0.87 0.13 118.94 127.79 3a7q s TRP 2459Ca -0.05 0.21 -0.00 0.00 -2.12 0.00 0.00 56.10 54.13 3a7q s TRP 2459Cb -0.07 -2.22 0.02 0.00 -0.81 0.00 0.00 33.47 30.39 3a7q s TRP 2459CO -0.03 0.12 -0.03 -1.58 -0.51 0.00 0.00 176.95 174.91 3a7q s HIS 2460N 0.82 0.87 -0.47 -1.98 2.46 0.11 -2.07 115.29 115.03 3a7q s HIS 2460Ca 0.07 -0.29 -0.17 0.00 0.47 0.00 0.00 55.06 55.13 3a7q s HIS 2460Cb -0.13 -0.84 0.05 0.00 -0.13 0.00 0.00 32.58 31.54 3a7q s HIS 2460CO 0.02 -0.31 0.47 -1.14 -2.47 0.00 0.00 174.74 171.32 3a7q s GLN 2461N 1.48 3.06 0.18 2.88 0.74 -0.76 -0.14 119.66 127.09 3a7q s GLN 2461Ca -0.02 -1.02 -0.30 0.00 0.05 0.00 0.00 55.36 54.07 3a7q s GLN 2461Cb -0.13 -4.07 -0.08 0.00 1.10 0.00 0.00 33.01 29.83 3a7q s GLN 2461CO -0.03 -1.02 1.25 -2.14 -0.55 0.00 0.00 175.29 172.79 3a7q s PRO 2462N 2.10 4.44 0.59 1.67 0.02 -1.26 -4.50 135.00 138.05 3a7q s PRO 2462Ca 0.10 1.95 -0.15 0.00 0.02 0.00 0.00 61.00 62.92 3a7q s PRO 2462Cb -0.20 -3.23 -0.04 0.00 0.02 0.00 0.00 34.50 31.05 3a7q s PRO 2462CO 0.10 -0.17 1.03 0.00 -0.33 0.00 0.00 177.00 177.63 3a7q s ALA 2463N 0.10 2.86 0.62 -1.55 0.00 -1.26 -4.37 121.76 118.15 3a7q s ALA 2463Ca 0.55 0.25 -0.14 0.00 0.00 0.00 0.00 51.96 52.62 3a7q s ALA 2463Cb -0.34 -3.18 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 3a7q s ALA 2463CO 0.37 -0.69 1.04 -1.25 0.00 0.00 0.00 175.76 175.24 3a7q s PRO 2464N -4.30 3.33 -0.20 0.00 0.04 -1.26 -5.20 135.00 127.42 3a7q s PRO 2464Ca 0.61 1.04 -0.22 0.00 0.04 0.00 0.00 61.00 62.47 3a7q s PRO 2464Cb -0.13 -2.04 0.06 0.00 0.04 0.00 0.00 34.50 32.42 3a7q s PRO 2464CO 0.39 -0.79 0.60 -0.59 0.04 0.00 0.00 177.00 176.64 3a7q s PHE 2465N -2.74 -0.64 0.66 0.56 -0.12 -1.26 -5.16 117.98 109.28 3a7q s PHE 2465Ca 0.60 1.49 -0.13 0.00 -0.05 0.00 0.00 56.93 58.85 3a7q s PHE 2465Cb -0.14 0.24 -0.01 0.00 -0.63 0.00 0.00 43.02 42.49 3a7q s PHE 2465CO 0.43 -0.35 1.06 -0.51 -0.05 0.00 0.00 175.22 175.80 3a7q s ASP 2466N 0.07 5.48 0.22 1.98 1.01 -1.26 -4.96 116.67 119.20 3a7q s ASP 2466Ca -0.02 1.70 -0.08 0.00 0.71 0.00 0.00 52.55 54.86 3a7q s ASP 2466Cb -0.04 -2.51 0.16 0.00 1.01 0.00 0.00 42.92 41.55 3a7q s ASP 2466CO 0.02 -1.38 1.78 0.50 0.21 0.00 0.00 175.17 176.31 3a7q h LYS 2467N -0.33 1.21 0.00 8.23 3.64 -1.93 -3.00 116.57 124.38 3a7q h LYS 2467Ca -0.45 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 58.72 3a7q h LYS 2467Cb 1.21 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 3a7q h LYS 2467CO 0.57 0.97 0.00 0.00 -2.27 0.00 0.00 179.45 178.71 3a7q n GLN 2468N -4.28 0.57 -1.87 1.90 0.00 -1.26 -3.69 117.38 108.75 3a7q n GLN 2468Ca 0.07 0.02 -0.41 0.00 0.00 0.00 0.00 57.00 56.69 3a7q n GLN 2468Cb 0.18 -1.50 -0.01 0.00 0.00 0.00 0.00 30.24 28.92 3a7q n GLN 2468CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 3a7q n GLN 2469N -1.07 3.67 -1.98 2.61 6.02 -1.14 -4.37 117.38 121.12 3a7q n GLN 2469Ca 0.14 -2.98 -0.31 0.00 -0.01 0.00 0.00 57.00 53.84 3a7q n GLN 2469Cb 0.10 -2.92 0.00 0.00 1.02 0.00 0.00 30.24 28.44 3a7q n GLN 2469CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3a7q s THR 2470N 1.13 4.60 0.27 5.09 -4.23 -1.24 -4.96 115.64 116.30 3a7q s THR 2470Ca 0.51 0.94 -0.15 0.00 -1.18 0.00 0.00 61.69 61.82 3a7q s THR 2470Cb 0.15 -3.79 0.01 0.00 1.34 0.00 0.00 72.50 70.21 3a7q s THR 2470CO -0.06 -1.00 0.58 -1.66 -0.54 0.00 0.00 174.62 171.94 3a7q s TRP 2471N -3.02 0.19 -0.11 3.99 1.48 -1.15 -2.51 118.94 117.80 3a7q s TRP 2471Ca 0.56 -0.59 -0.30 0.00 -1.06 0.00 0.00 56.10 54.72 3a7q s TRP 2471Cb -0.11 0.39 0.08 0.00 -1.16 0.00 0.00 33.47 32.67 3a7q s TRP 2471CO 0.48 -1.11 0.74 0.00 -4.06 0.00 0.00 176.95 173.00 3a7q s ALA 2472N -3.88 -1.80 0.14 2.67 0.00 0.55 -0.88 121.76 118.56 3a7q s ALA 2472Ca 0.18 1.51 0.09 0.00 0.00 0.00 0.00 51.96 53.74 3a7q s ALA 2472Cb -0.03 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 3a7q s ALA 2472CO 0.09 -0.35 -0.20 0.96 0.00 0.00 0.00 175.76 176.25 3a7q s ILE 2473N -0.84 1.85 0.24 0.00 -4.36 -0.59 -1.29 121.20 116.21 3a7q s ILE 2473Ca -0.07 -1.76 -0.17 0.00 -0.26 0.00 0.00 60.65 58.39 3a7q s ILE 2473Cb -0.01 -1.76 0.01 0.00 1.25 0.00 0.00 42.46 41.95 3a7q s ILE 2473CO 0.07 -0.17 0.56 -0.62 0.24 0.00 0.00 174.94 175.02 3a7q s ASP 2474N -2.32 -0.19 -1.33 4.36 -1.08 -0.78 -1.48 116.67 113.85 3a7q s ASP 2474Ca 0.12 -0.70 -0.07 0.00 -0.52 0.00 0.00 52.55 51.38 3a7q s ASP 2474Cb -0.08 0.63 0.00 0.00 -1.46 0.00 0.00 42.92 42.01 3a7q s ASP 2474CO 0.06 -1.18 0.52 0.59 0.52 0.00 0.00 175.17 175.68 3a7q n ASN 2475N -0.39 -1.69 -4.65 -0.34 3.02 -1.15 -0.70 115.26 109.36 3a7q n ASN 2475Ca -0.05 -1.02 -0.42 0.00 -0.03 0.00 0.00 54.58 53.06 3a7q n ASN 2475Cb 0.61 -3.07 -0.04 0.00 -0.61 0.00 0.00 39.78 36.67 3a7q n ASN 2475CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3a7q s VAL 2476N -3.82 4.82 -0.19 2.41 1.01 -0.06 -3.97 120.40 120.60 3a7q s VAL 2476Ca 0.14 1.65 0.00 0.00 0.00 0.00 0.00 61.98 63.77 3a7q s VAL 2476Cb -0.05 -4.15 0.04 0.00 0.00 0.00 0.00 36.38 32.22 3a7q s VAL 2476CO 0.89 -0.08 -0.09 -0.47 0.00 0.00 0.00 175.10 175.35 3a7q s TYR 2477N 2.81 2.19 -0.29 5.22 5.04 0.12 -0.20 117.35 132.23 3a7q s TYR 2477Ca 0.37 -1.42 -0.01 0.00 -2.44 0.00 0.00 57.07 53.57 3a7q s TYR 2477Cb -0.15 -1.54 0.05 0.00 0.35 0.00 0.00 41.96 40.66 3a7q s TYR 2477CO 0.08 -0.70 -0.01 0.42 -1.34 0.00 0.00 175.55 173.99 3a7q s ILE 2478N 1.47 2.91 -1.15 3.14 1.01 -0.49 0.27 121.20 128.35 3a7q s ILE 2478Ca -0.00 -1.38 0.00 0.00 0.00 0.00 0.00 60.65 59.27 3a7q s ILE 2478Cb -0.16 -2.66 0.00 0.00 0.01 0.00 0.00 42.46 39.65 3a7q s ILE 2478CO -0.08 -0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.39 3a7q n GLY 2479N 4.61 -1.25 0.28 6.18 0.00 -0.43 -1.73 105.19 112.85 3a7q n GLY 2479Ca -0.13 -0.89 0.08 0.00 0.00 0.00 0.00 46.02 45.07 3a7q n GLY 2479CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3a7q n ASP 2480N 0.67 1.90 0.12 1.61 5.75 -1.25 -1.40 116.55 123.94 3a7q n ASP 2480Ca 0.00 -3.08 0.11 0.00 -0.01 0.00 0.00 54.79 51.80 3a7q n ASP 2480Cb 0.00 -0.42 0.02 0.00 -1.03 0.00 0.00 41.12 39.69 3a7q n ASP 2480CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3a7q h GLY 2481N 0.23 0.00 -7.52 6.12 0.00 -1.91 -3.42 103.07 96.57 3a7q h GLY 2481Ca -0.01 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.66 3a7q h GLY 2481CO 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 176.54 175.93 3a7q s LEU 2483N 0.32 3.81 0.00 0.00 1.43 -1.26 -1.86 118.68 121.11 3a7q s LEU 2483Ca 0.14 2.55 0.00 0.00 -1.03 0.00 0.00 54.13 55.78 3a7q s LEU 2483Cb -0.22 -4.39 0.00 0.00 0.03 0.00 0.00 46.19 41.60 3a7q s LEU 2483CO -0.04 -1.48 0.00 0.47 0.23 0.00 0.00 176.35 175.53 3a7q n ASP 2484N -1.15 0.00 -1.29 2.29 8.00 -1.26 -4.02 116.55 119.12 3a7q n ASP 2484Ca 0.11 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.51 3a7q n ASP 2484Cb 0.47 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 3a7q n ASP 2484CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3a7q n MET 2485N -2.00 -1.35 -1.87 -1.24 2.81 -0.78 -2.38 117.12 110.31 3a7q n MET 2485Ca 0.00 0.46 -0.21 0.00 -1.81 0.00 0.00 57.70 56.15 3a7q n MET 2485Cb 0.00 -4.45 -0.06 0.00 -0.71 0.00 0.00 33.22 27.99 3a7q n MET 2485CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3a7q n SER 2487N -1.60 -3.30 0.00 0.00 7.64 -1.00 -2.05 113.62 113.31 3a7q n SER 2487Ca -0.22 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.66 3a7q n SER 2487Cb 0.69 -2.10 0.00 0.00 -1.01 0.00 0.00 64.21 61.79 3a7q n SER 2487CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3a7q n GLY 2488N -0.99 0.74 1.83 0.23 0.00 -1.16 -4.12 105.19 101.71 3a7q n GLY 2488Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 3a7q n GLY 2488CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3a7q n HIS 2489N -2.15 1.15 -3.83 1.61 8.25 -0.87 -4.42 115.22 114.97 3a7q n HIS 2489Ca 0.00 -1.67 0.01 0.00 -0.26 0.00 0.00 57.72 55.80 3a7q n HIS 2489Cb 0.00 -0.25 0.01 0.00 1.12 0.00 0.00 29.99 30.87 3a7q n HIS 2489CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3a7q s GLY 2490N -3.24 -0.21 0.10 -1.41 0.00 -1.25 -0.21 107.32 101.10 3a7q s GLY 2490Ca 0.38 0.24 0.10 0.00 0.00 0.00 0.00 44.72 45.43 3a7q s GLY 2490CO -0.05 2.95 -0.25 1.09 0.00 0.00 0.00 173.10 176.83 3a7q s ARG 2491N -2.23 1.42 -0.04 2.90 1.70 -0.17 -4.79 118.95 117.72 3a7q s ARG 2491Ca 0.22 -1.24 -0.30 0.00 -0.47 0.00 0.00 55.73 53.94 3a7q s ARG 2491Cb 0.01 -1.79 -0.02 0.00 -0.57 0.00 0.00 34.95 32.58 3a7q s ARG 2491CO -0.01 0.43 1.03 0.00 -1.08 0.00 0.00 175.30 175.67 3a7q s VAL 2493N 1.51 0.19 -0.77 0.00 1.01 0.14 -4.81 120.40 117.66 3a7q s VAL 2493Ca 0.51 -1.39 -0.03 0.00 0.00 0.00 0.00 61.98 61.07 3a7q s VAL 2493Cb -0.21 -1.15 0.00 0.00 0.00 0.00 0.00 36.38 35.02 3a7q s VAL 2493CO 0.24 -0.87 0.38 0.00 0.00 0.00 0.00 175.10 174.84 3a7q n GLN 2494N 4.51 -2.86 -1.02 2.72 6.02 -1.26 -2.89 117.38 122.60 3a7q n GLN 2494Ca 0.04 0.46 -0.01 0.00 -0.01 0.00 0.00 57.00 57.48 3a7q n GLN 2494Cb 0.39 -4.37 -0.00 0.00 1.02 0.00 0.00 30.24 27.28 3a7q n GLN 2494CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3a7q n GLY 2495N -1.17 0.47 3.16 1.08 0.00 -1.26 -5.03 105.19 102.44 3a7q n GLY 2495Ca -0.04 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.23 3a7q n GLY 2495CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a7q s SER 2496N -2.51 1.81 -0.00 1.61 0.01 -1.14 -4.77 113.70 108.71 3a7q s SER 2496Ca 0.00 -0.44 -0.27 0.00 1.31 0.00 0.00 55.95 56.55 3a7q s SER 2496Cb 0.00 -0.14 -0.04 0.00 0.21 0.00 0.00 66.02 66.06 3a7q s SER 2496CO 0.00 0.08 0.84 0.00 0.41 0.00 0.00 173.24 174.57 3a7q s VAL 2498N 0.64 4.57 0.54 0.00 1.01 -0.05 -4.94 120.40 122.18 3a7q s VAL 2498Ca 0.44 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.58 3a7q s VAL 2498Cb -0.20 -3.46 -0.07 0.00 0.00 0.00 0.00 36.38 32.65 3a7q s VAL 2498CO 0.24 -0.11 1.00 0.00 0.00 0.00 0.00 175.10 176.22 3a7q s ASP 2500N -3.33 5.44 0.77 0.00 1.01 0.70 -4.88 116.67 116.38 3a7q s ASP 2500Ca 0.58 1.81 -0.15 0.00 0.71 0.00 0.00 52.55 55.50 3a7q s ASP 2500Cb -0.10 -2.53 -0.00 0.00 1.01 0.00 0.00 42.92 41.30 3a7q s ASP 2500CO 0.37 -1.40 0.67 -1.84 0.21 0.00 0.00 175.17 173.18 3a7q n GLU 2501N -2.49 0.23 -0.89 8.23 0.00 -1.26 -1.90 120.64 122.56 3a7q n GLU 2501Ca 0.09 0.13 0.00 0.00 0.00 0.00 0.00 57.16 57.38 3a7q n GLU 2501Cb 0.53 -1.98 0.00 0.00 0.00 0.00 0.00 31.44 29.99 3a7q n GLU 2501CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 3a7q n GLN 2502N -1.41 -0.24 -4.45 3.44 1.13 -1.26 -4.99 117.38 109.60 3a7q n GLN 2502Ca 0.10 0.06 -0.20 0.00 -1.94 0.00 0.00 57.00 55.03 3a7q n GLN 2502Cb 0.50 -3.37 -0.14 0.00 0.11 0.00 0.00 30.24 27.34 3a7q n GLN 2502CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 3a7q s TRP 2503N -2.50 1.03 0.00 1.08 0.52 -0.80 0.14 118.94 118.41 3a7q s TRP 2503Ca 0.00 -0.23 0.00 0.00 0.02 0.00 0.00 56.10 55.89 3a7q s TRP 2503Cb 0.00 -0.65 0.00 0.00 -1.15 0.00 0.00 33.47 31.67 3a7q s TRP 2503CO 0.00 -0.01 0.00 0.41 0.02 0.00 0.00 176.95 177.37 3a7q n GLY 2504N 2.58 4.95 0.00 0.98 0.00 0.60 -4.59 105.19 109.72 3a7q n GLY 2504Ca -0.15 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.27 3a7q n GLY 2504CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a7q n GLY 2505N 0.74 -0.42 0.20 -0.02 0.00 -1.26 -2.97 105.19 101.46 3a7q n GLY 2505Ca 0.00 -1.70 0.05 0.00 0.00 0.00 0.00 46.02 44.37 3a7q n GLY 2505CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3a7q h LEU 2506N 0.00 0.00 -2.99 0.99 5.85 -1.99 -3.16 115.31 114.00 3a7q h LEU 2506Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3a7q h LEU 2506Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3a7q h LEU 2506CO 0.00 0.31 -0.00 -1.22 -0.34 0.00 0.00 178.44 177.19 3a7q n TYR 2507N -3.98 0.00 -3.37 1.25 4.01 -1.26 -4.24 117.16 109.58 3a7q n TYR 2507Ca -0.02 -0.69 -0.21 0.00 -0.16 0.00 0.00 57.90 56.82 3a7q n TYR 2507Cb 0.38 -0.09 0.06 0.00 -0.31 0.00 0.00 39.34 39.38 3a7q n TYR 2507CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3a7q n ASP 2509N -2.43 2.53 -4.27 0.00 5.75 -1.16 -4.61 116.55 112.37 3a7q n ASP 2509Ca -0.01 -1.92 -0.35 0.00 -0.01 0.00 0.00 54.79 52.50 3a7q n ASP 2509Cb 0.56 -0.14 -0.14 0.00 -1.03 0.00 0.00 41.12 40.37 3a7q n ASP 2509CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3a7q s GLU 2510N -0.96 3.24 0.31 0.11 8.01 -1.16 -5.03 118.70 123.22 3a7q s GLU 2510Ca 0.16 -0.71 -0.21 0.00 0.01 0.00 0.00 54.97 54.21 3a7q s GLU 2510Cb 0.08 -2.94 -0.09 0.00 -4.31 0.00 0.00 34.13 26.87 3a7q s GLU 2510CO 0.11 -0.23 0.84 -2.14 0.01 0.00 0.00 175.26 173.85 3a7q s PRO 2511N 1.43 4.32 0.21 0.39 0.02 -1.26 -0.29 135.00 139.82 3a7q s PRO 2511Ca 0.05 1.04 0.11 0.00 0.02 0.00 0.00 61.00 62.22 3a7q s PRO 2511Cb -0.14 -2.65 0.00 0.00 0.02 0.00 0.00 34.50 31.73 3a7q s PRO 2511CO -0.05 0.24 1.40 0.93 -0.33 0.00 0.00 177.00 179.19 3a7q h GLU 2512N 2.87 0.00 -4.99 5.54 4.39 0.85 -3.46 114.58 119.79 3a7q h GLU 2512Ca -0.48 0.00 -0.41 0.00 0.34 0.00 0.00 59.36 58.81 3a7q h GLU 2512Cb 1.19 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.70 3a7q h GLU 2512CO 0.64 0.76 -0.59 0.95 -1.16 0.00 0.00 179.01 179.61 3a7q s THR 2513N -2.95 0.68 -0.14 1.13 -4.23 -1.26 -5.05 115.64 103.82 3a7q s THR 2513Ca 0.02 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 58.23 3a7q s THR 2513Cb 0.10 -2.63 -0.04 0.00 1.34 0.00 0.00 72.50 71.27 3a7q s THR 2513CO 0.78 0.00 1.56 -0.44 -0.54 0.00 0.00 174.62 175.98 3a7q s SER 2514N -3.40 6.62 0.45 3.99 0.01 -1.26 -5.01 113.70 115.09 3a7q s SER 2514Ca 0.36 1.89 -0.22 0.00 1.31 0.00 0.00 55.95 59.29 3a7q s SER 2514Cb 0.07 -2.53 -0.08 0.00 0.21 0.00 0.00 66.02 63.69 3a7q s SER 2514CO 0.15 -1.02 1.10 -0.76 0.41 0.00 0.00 173.24 173.12 3a7q s LEU 2515N 4.37 4.00 0.44 2.44 1.43 -1.26 -5.00 118.68 125.10 3a7q s LEU 2515Ca 0.69 2.14 -0.25 0.00 -1.03 0.00 0.00 54.13 55.68 3a7q s LEU 2515Cb -0.28 -4.31 -0.08 0.00 0.03 0.00 0.00 46.19 41.55 3a7q s LEU 2515CO 0.26 -0.78 1.38 -2.16 0.23 0.00 0.00 176.35 175.28 3a7q s PRO 2516N -2.77 3.75 0.00 1.29 0.04 -1.26 -4.41 135.00 131.64 3a7q s PRO 2516Ca 0.63 2.32 0.23 0.00 0.04 0.00 0.00 61.00 64.22 3a7q s PRO 2516Cb -0.24 -2.67 0.62 0.00 0.04 0.00 0.00 34.50 32.25 3a7q s PRO 2516CO 0.29 -0.73 1.49 0.25 0.04 0.00 0.00 177.00 178.34 3a7q n THR 2517N -0.13 0.24 -3.68 1.26 -2.24 -1.26 -0.88 114.28 107.59 3a7q n THR 2517Ca 0.05 -0.47 -0.15 0.00 -2.27 0.00 0.00 64.05 61.21 3a7q n THR 2517Cb 0.43 0.73 -0.08 0.00 -2.10 0.00 0.00 70.33 69.31 3a7q n THR 2517CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3a7q s GLN 2518N -1.76 0.74 -0.13 -0.78 0.74 -1.26 -4.77 119.66 112.43 3a7q s GLN 2518Ca 0.34 0.26 -0.01 0.00 0.05 0.00 0.00 55.36 56.01 3a7q s GLN 2518Cb 0.20 0.35 0.04 0.00 1.10 0.00 0.00 33.01 34.69 3a7q s GLN 2518CO 0.29 -0.18 -0.03 -1.17 -0.55 0.00 0.00 175.29 173.65 3a7q s LEU 2519N -0.69 1.16 -0.09 3.68 0.20 -0.31 -4.99 118.68 117.64 3a7q s LEU 2519Ca -0.08 -0.44 0.02 0.00 0.69 0.00 0.00 54.13 54.33 3a7q s LEU 2519Cb -0.03 -0.72 0.01 0.00 -0.43 0.00 0.00 46.19 45.02 3a7q s LEU 2519CO 0.04 -0.19 -0.16 -0.75 -0.29 0.00 0.00 176.35 175.00 3a7q s LYS 2520N 1.78 2.24 -0.09 1.98 2.20 -1.26 0.52 119.74 127.11 3a7q s LYS 2520Ca 0.03 -0.59 -0.04 0.00 -0.36 0.00 0.00 55.97 55.02 3a7q s LYS 2520Cb -0.14 -1.83 0.05 0.00 -1.51 0.00 0.00 37.83 34.40 3a7q s LYS 2520CO -0.07 0.02 0.17 0.34 -0.36 0.00 0.00 175.35 175.45 3a7q s ASP 2521N 0.74 0.49 0.11 1.43 -1.08 -0.12 -5.01 116.67 113.23 3a7q s ASP 2521Ca -0.12 0.37 0.23 0.00 -0.52 0.00 0.00 52.55 52.51 3a7q s ASP 2521Cb -0.16 0.32 0.02 0.00 -1.46 0.00 0.00 42.92 41.64 3a7q s ASP 2521CO 0.02 -0.22 1.00 -0.46 0.52 0.00 0.00 175.17 176.03 3a7q n ASN 2522N 5.07 0.64 -3.76 -0.34 6.94 -1.26 -1.02 115.26 121.52 3a7q n ASN 2522Ca -0.10 0.07 -0.28 0.00 -0.02 0.00 0.00 54.58 54.25 3a7q n ASN 2522Cb 0.50 0.73 0.04 0.00 -2.36 0.00 0.00 39.78 38.70 3a7q n ASN 2522CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 3a7q n PHE 2523N -2.29 -2.47 0.82 -2.53 3.72 -1.26 -4.29 117.46 109.16 3a7q n PHE 2523Ca 0.01 0.92 0.11 0.00 -0.05 0.00 0.00 57.45 58.43 3a7q n PHE 2523Cb 0.50 -4.31 0.00 0.00 -0.94 0.00 0.00 39.48 34.73 3a7q n PHE 2523CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3a7q n ASN 2524N -2.86 0.72 -4.02 4.37 3.02 -1.26 -4.03 115.26 111.19 3a7q n ASN 2524Ca 0.03 -0.55 -0.23 0.00 -0.03 0.00 0.00 54.58 53.79 3a7q n ASN 2524Cb 0.54 0.83 -0.08 0.00 -0.61 0.00 0.00 39.78 40.45 3a7q n ASN 2524CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3a7q s ARG 2525N -3.08 1.82 0.16 3.52 0.52 -1.26 -4.93 118.95 115.70 3a7q s ARG 2525Ca 0.07 -2.08 -0.31 0.00 -0.52 0.00 0.00 55.73 52.88 3a7q s ARG 2525Cb 0.16 -0.41 -0.10 0.00 0.52 0.00 0.00 34.95 35.12 3a7q s ARG 2525CO 0.81 -0.47 1.51 0.00 0.02 0.00 0.00 175.30 177.17 3a7q s ALA 2526N -3.33 3.71 0.10 2.13 0.00 -1.26 -4.93 121.76 118.18 3a7q s ALA 2526Ca 0.29 1.30 -0.36 0.00 0.00 0.00 0.00 51.96 53.19 3a7q s ALA 2526Cb 0.03 -3.59 -0.17 0.00 0.00 0.00 0.00 23.12 19.40 3a7q s ALA 2526CO 0.17 -0.73 1.31 -2.30 0.00 0.00 0.00 175.76 174.21 3a7q n PRO 2527N 3.74 1.13 -3.94 0.00 -0.02 -1.26 -4.94 135.00 129.71 3a7q n PRO 2527Ca 0.12 0.41 -0.22 0.00 -2.02 0.00 0.00 63.50 61.79 3a7q n PRO 2527Cb 0.40 -2.03 -0.02 0.00 -0.02 0.00 0.00 33.50 31.82 3a7q n PRO 2527CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3a7q s SER 2528N 0.42 6.33 0.00 2.55 0.15 -1.26 -5.00 113.70 116.88 3a7q s SER 2528Ca 0.83 0.11 0.21 0.00 0.70 0.00 0.00 55.95 57.81 3a7q s SER 2528Cb -0.95 -1.88 0.99 0.00 -1.71 0.00 0.00 66.02 62.47 3a7q s SER 2528CO 0.48 -0.05 1.68 0.59 1.20 0.00 0.00 173.24 177.14 3a7q n ASN 2529N -1.19 0.00 -0.41 5.45 3.02 -1.26 -2.07 115.26 118.80 3a7q n ASN 2529Ca -0.08 0.26 0.14 0.00 -0.03 0.00 0.00 54.58 54.87 3a7q n ASN 2529Cb 0.56 -0.40 0.55 0.00 -0.61 0.00 0.00 39.78 39.88 3a7q n ASN 2529CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a7q n GLN 2530N -1.40 1.51 0.00 3.52 6.02 -1.26 -4.33 117.38 121.44 3a7q n GLN 2530Ca 0.07 -0.82 0.00 0.00 -0.01 0.00 0.00 57.00 56.24 3a7q n GLN 2530Cb 0.21 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.99 3a7q n GLN 2530CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3a7q n ASN 2531N -0.03 3.55 -4.12 1.08 3.02 -1.05 -4.88 115.26 112.83 3a7q n ASN 2531Ca 0.19 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.47 3a7q n ASN 2531Cb 0.33 0.03 -0.16 0.00 -0.61 0.00 0.00 39.78 39.36 3a7q n ASN 2531CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 3a7q s TRP 2532N -1.87 1.76 0.03 3.10 0.52 -0.88 -0.72 118.94 120.87 3a7q s TRP 2532Ca 0.00 -0.57 0.04 0.00 0.02 0.00 0.00 56.10 55.59 3a7q s TRP 2532Cb 0.00 -1.20 -0.24 0.00 -1.15 0.00 0.00 33.47 30.87 3a7q s TRP 2532CO 0.00 -0.22 0.95 -0.07 0.02 0.00 0.00 176.95 177.62 3a7q h LEU 2533N 6.47 0.16 -7.38 2.99 3.38 -1.04 -3.40 115.31 116.49 3a7q h LEU 2533Ca -0.31 -0.23 -0.19 0.00 0.09 0.00 0.00 57.88 57.25 3a7q h LEU 2533Cb 1.18 -0.05 -0.29 0.00 0.09 0.00 0.00 40.66 41.60 3a7q h LEU 2533CO 0.48 1.19 -0.47 -0.89 0.09 0.00 0.00 178.44 178.84 3a7q s THR 2534N -2.64 -0.03 -0.21 0.22 2.01 -1.17 -5.03 115.64 108.79 3a7q s THR 2534Ca -0.05 0.11 -0.03 0.00 0.31 0.00 0.00 61.69 62.03 3a7q s THR 2534Cb 0.08 -0.37 0.07 0.00 0.01 0.00 0.00 72.50 72.28 3a7q s THR 2534CO 0.83 0.04 0.04 -0.69 -0.69 0.00 0.00 174.62 174.16 3a7q s VAL 2535N 0.96 0.55 -0.06 3.82 1.01 -1.25 -1.60 120.40 123.83 3a7q s VAL 2535Ca -0.07 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.31 3a7q s VAL 2535Cb -0.08 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.18 3a7q s VAL 2535CO -0.06 -0.28 -0.22 -0.44 0.00 0.00 0.00 175.10 174.10 3a7q s SER 2536N 1.84 3.30 0.00 3.32 0.01 0.12 -4.71 113.70 117.58 3a7q s SER 2536Ca 0.00 -0.44 0.00 0.00 1.31 0.00 0.00 55.95 56.82 3a7q s SER 2536Cb -0.17 -0.83 0.00 0.00 0.21 0.00 0.00 66.02 65.23 3a7q s SER 2536CO -0.11 0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.42 3a7q n GLY 2537N 2.81 0.76 3.42 3.44 0.00 -0.98 -0.85 105.19 113.79 3a7q n GLY 2537Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 3a7q n GLY 2537CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3a7q s GLY 2538N -2.00 1.52 0.11 -0.02 0.00 -1.26 -1.72 107.32 103.95 3a7q s GLY 2538Ca 0.00 -1.23 -0.12 0.00 0.00 0.00 0.00 44.72 43.37 3a7q s GLY 2538CO 0.00 -1.12 0.30 -1.59 0.00 0.00 0.00 173.10 170.69 3a7q s LYS 2539N -1.39 0.98 0.20 2.90 -2.85 0.38 -4.94 119.74 115.03 3a7q s LYS 2539Ca 0.14 -0.85 -0.31 0.00 -1.00 0.00 0.00 55.97 53.94 3a7q s LYS 2539Cb -0.10 0.41 -0.11 0.00 -2.06 0.00 0.00 37.83 35.97 3a7q s LYS 2539CO 0.04 -0.35 1.62 -0.51 0.10 0.00 0.00 175.35 176.24 3a7q s LEU 2540N -2.84 4.37 0.20 2.77 1.43 -1.26 0.03 118.68 123.37 3a7q s LEU 2540Ca 0.05 2.74 -0.11 0.00 -1.03 0.00 0.00 54.13 55.78 3a7q s LEU 2540Cb 0.03 -3.60 -0.00 0.00 0.03 0.00 0.00 46.19 42.65 3a7q s LEU 2540CO -0.11 -0.88 0.38 -0.55 0.23 0.00 0.00 176.35 175.42 3a7q s SER 2541N 1.04 -0.04 -0.00 2.29 0.15 -0.95 -4.89 113.70 111.30 3a7q s SER 2541Ca 0.70 -0.87 0.06 0.00 0.70 0.00 0.00 55.95 56.54 3a7q s SER 2541Cb -0.46 0.51 -0.07 0.00 -1.71 0.00 0.00 66.02 64.29 3a7q s SER 2541CO 0.34 -1.00 0.25 0.35 1.20 0.00 0.00 173.24 174.38 3a7q n THR 2542N -0.30 0.00 -0.19 6.45 -2.24 -1.26 -2.74 114.28 114.00 3a7q n THR 2542Ca -0.05 -0.34 0.29 0.00 -2.27 0.00 0.00 64.05 61.68 3a7q n THR 2542Cb 0.63 0.95 0.56 0.00 -2.10 0.00 0.00 70.33 70.36 3a7q n THR 2542CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 3a7q h VAL 2543N 0.00 0.10 -0.01 2.28 2.07 -1.97 0.55 116.25 119.27 3a7q h VAL 2543Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3a7q h VAL 2543Cb 0.15 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 3a7q h VAL 2543CO 0.00 0.00 -0.31 0.00 0.02 0.00 0.00 177.57 177.28 3a7q n GLY 2545N 1.36 -0.88 3.63 0.00 0.00 0.19 -4.64 105.19 104.85 3a7q n GLY 2545Ca 0.11 -1.18 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 3a7q n GLY 2545CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a7q s ALA 2546N -1.33 3.32 -0.17 4.61 0.00 -1.26 -4.84 121.76 122.08 3a7q s ALA 2546Ca 0.00 0.33 -0.15 0.00 0.00 0.00 0.00 51.96 52.14 3a7q s ALA 2546Cb 0.00 -3.82 -0.11 0.00 0.00 0.00 0.00 23.12 19.19 3a7q s ALA 2546CO 0.00 -1.86 0.04 0.28 0.00 0.00 0.00 175.76 174.22 3a7q h VAL 2547N 6.05 0.48 0.00 0.00 2.07 -1.85 -3.46 116.25 119.54 3a7q h VAL 2547Ca -0.31 -1.59 0.00 0.00 0.82 0.00 0.00 66.70 65.62 3a7q h VAL 2547Cb 1.13 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 3a7q h VAL 2547CO 1.01 0.16 -0.17 0.00 0.02 0.00 0.00 177.57 178.60 3a7q n ALA 2548N -3.48 1.36 -3.58 1.67 0.00 -1.26 -4.79 120.51 110.44 3a7q n ALA 2548Ca -0.19 -0.24 -0.08 0.00 0.00 0.00 0.00 53.44 52.93 3a7q n ALA 2548Cb 0.46 0.03 -0.02 0.00 0.00 0.00 0.00 19.45 19.92 3a7q n ALA 2548CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3a7q s SER 2549N -4.84 -0.35 0.62 0.00 1.04 -1.26 -5.12 113.70 103.79 3a7q s SER 2549Ca -0.05 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.22 3a7q s SER 2549Cb 0.01 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.61 3a7q s SER 2549CO 0.07 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 174.07 3a7q n GLY 2550N -0.35 2.40 3.81 7.32 0.00 -1.26 -4.58 105.19 112.52 3a7q n GLY 2550Ca -0.09 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 3a7q n GLY 2550CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a7q s LEU 2551N 0.00 4.22 0.32 0.99 1.43 -1.26 -4.68 118.68 119.70 3a7q s LEU 2551Ca 0.00 1.64 0.09 0.00 -1.03 0.00 0.00 54.13 54.83 3a7q s LEU 2551Cb 0.00 -4.03 -0.05 0.00 0.03 0.00 0.00 46.19 42.14 3a7q s LEU 2551CO 0.00 -0.12 -0.01 0.00 0.23 0.00 0.00 176.35 176.45 3a7q s ALA 2552N -1.75 3.15 -0.50 4.21 0.00 -1.11 -4.46 121.76 121.30 3a7q s ALA 2552Ca 0.51 -1.89 -0.25 0.00 0.00 0.00 0.00 51.96 50.33 3a7q s ALA 2552Cb -0.15 -0.44 0.03 0.00 0.00 0.00 0.00 23.12 22.56 3a7q s ALA 2552CO 0.20 0.13 0.93 -1.17 0.00 0.00 0.00 175.76 175.85 3a7q s LEU 2553N -3.69 4.04 -0.18 0.00 2.96 -0.92 -2.25 118.68 118.64 3a7q s LEU 2553Ca 0.34 -0.07 -0.12 0.00 -0.22 0.00 0.00 54.13 54.06 3a7q s LEU 2553Cb -0.02 -3.05 -0.05 0.00 0.50 0.00 0.00 46.19 43.58 3a7q s LEU 2553CO 0.19 -1.12 0.22 -2.28 -1.32 0.00 0.00 176.35 172.04 3a7q s HIS 2554N 3.84 3.44 -0.37 5.38 5.65 0.10 -2.41 115.29 130.92 3a7q s HIS 2554Ca 0.34 0.48 -0.06 0.00 0.25 0.00 0.00 55.06 56.07 3a7q s HIS 2554Cb -0.11 -2.26 0.07 0.00 -1.18 0.00 0.00 32.58 29.09 3a7q s HIS 2554CO 0.24 0.26 0.16 -0.06 -0.65 0.00 0.00 174.74 174.69 3a7q s PHE 2555N 0.41 3.34 0.00 3.88 0.08 0.54 -0.47 117.98 125.77 3a7q s PHE 2555Ca 0.13 -1.68 0.00 0.00 0.12 0.00 0.00 56.93 55.49 3a7q s PHE 2555Cb -0.12 -2.66 0.00 0.00 -0.57 0.00 0.00 43.02 39.67 3a7q s PHE 2555CO 0.01 -0.82 0.76 -1.13 -0.10 0.00 0.00 175.22 173.94 3a7q n SER 2556N 4.79 0.00 -4.67 1.36 3.41 -0.90 -1.86 113.62 115.75 3a7q n SER 2556Ca -0.10 -1.58 -0.29 0.00 -0.26 0.00 0.00 58.87 56.64 3a7q n SER 2556Cb 0.43 -0.12 0.17 0.00 -0.26 0.00 0.00 64.21 64.43 3a7q n SER 2556CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3a7q s GLY 2557N -0.58 1.59 0.04 5.00 0.00 -0.70 -0.43 107.32 112.24 3a7q s GLY 2557Ca 0.00 -0.15 0.25 0.00 0.00 0.00 0.00 44.72 44.82 3a7q s GLY 2557CO 0.00 0.41 1.47 0.61 0.00 0.00 0.00 173.10 175.59 3a7q n GLY 2558N -0.80 -1.34 0.00 0.20 0.00 -1.26 -4.32 105.19 97.67 3a7q n GLY 2558Ca 0.06 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3a7q n GLY 2558CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a7q s SER 2560N 0.34 7.15 -0.30 0.00 0.01 -1.26 -5.00 113.70 114.64 3a7q s SER 2560Ca 0.00 1.80 0.01 0.00 1.31 0.00 0.00 55.95 59.07 3a7q s SER 2560Cb 0.00 -2.57 0.09 0.00 0.21 0.00 0.00 66.02 63.75 3a7q s SER 2560CO 0.00 -0.21 0.05 -0.13 0.41 0.00 0.00 173.24 173.36 3a7q s ARG 2561N -2.49 1.14 -0.14 12.44 0.52 -1.25 -2.32 118.95 126.85 3a7q s ARG 2561Ca 0.55 -1.29 -0.08 0.00 -0.52 0.00 0.00 55.73 54.39 3a7q s ARG 2561Cb -0.15 -2.50 0.05 0.00 0.52 0.00 0.00 34.95 32.87 3a7q s ARG 2561CO 0.20 -0.88 0.34 -1.17 0.02 0.00 0.00 175.30 173.81 3a7q s LEU 2562N 1.35 0.17 -0.09 2.53 2.96 -0.03 -1.40 118.68 124.18 3a7q s LEU 2562Ca 0.07 0.73 0.01 0.00 -0.22 0.00 0.00 54.13 54.72 3a7q s LEU 2562Cb -0.18 1.10 0.02 0.00 0.50 0.00 0.00 46.19 47.63 3a7q s LEU 2562CO -0.15 -0.18 -0.08 -0.22 -1.32 0.00 0.00 176.35 174.40 3a7q s LEU 2563N 1.24 1.31 -0.04 -0.68 2.96 0.12 -0.70 118.68 122.89 3a7q s LEU 2563Ca -0.09 -0.27 0.01 0.00 -0.22 0.00 0.00 54.13 53.56 3a7q s LEU 2563Cb -0.09 -0.77 0.02 0.00 0.50 0.00 0.00 46.19 45.86 3a7q s LEU 2563CO -0.10 -0.07 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.16 3a7q s VAL 2564N 1.29 0.33 0.49 1.68 1.01 -0.63 0.31 120.40 124.89 3a7q s VAL 2564Ca -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 61.98 61.88 3a7q s VAL 2564Cb -0.14 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 3a7q s VAL 2564CO -0.03 0.18 0.83 0.42 0.00 0.00 0.00 175.10 176.51 3a7q s THR 2565N 1.03 4.84 1.06 3.92 -4.23 0.39 -0.61 115.64 122.05 3a7q s THR 2565Ca -0.09 0.42 -0.12 0.00 -1.18 0.00 0.00 61.69 60.72 3a7q s THR 2565Cb -0.14 -3.84 0.23 0.00 1.34 0.00 0.00 72.50 70.09 3a7q s THR 2565CO -0.01 -0.84 1.08 0.68 -0.54 0.00 0.00 174.62 174.98 3a7q s VAL 2566N -2.76 2.03 0.16 2.29 -7.23 0.10 -4.30 120.40 110.70 3a7q s VAL 2566Ca 0.50 0.01 -0.31 0.00 -1.81 0.00 0.00 61.98 60.37 3a7q s VAL 2566Cb -0.10 -2.03 -0.09 0.00 0.56 0.00 0.00 36.38 34.71 3a7q s VAL 2566CO 0.44 -0.01 1.46 -1.81 -0.31 0.00 0.00 175.10 174.86 3a7q s ASP 2567N -2.55 6.71 -0.05 4.85 1.01 -1.26 -4.43 116.67 120.95 3a7q s ASP 2567Ca 0.68 2.50 0.06 0.00 0.71 0.00 0.00 52.55 56.50 3a7q s ASP 2567Cb -0.24 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 41.08 3a7q s ASP 2567CO 0.62 -0.72 -0.24 -0.76 0.21 0.00 0.00 175.17 174.29 3a7q s LEU 2568N 0.76 2.04 -0.72 1.23 1.43 0.12 -4.53 118.68 119.00 3a7q s LEU 2568Ca 0.65 -0.48 -0.27 0.00 -1.03 0.00 0.00 54.13 53.01 3a7q s LEU 2568Cb -0.40 -1.29 0.01 0.00 0.03 0.00 0.00 46.19 44.54 3a7q s LEU 2568CO 0.34 0.24 1.47 0.21 0.23 0.00 0.00 176.35 178.83 3a7q s ASN 2569N -0.19 5.90 -0.26 2.29 2.47 -0.05 0.74 114.94 125.84 3a7q s ASN 2569Ca -0.02 -0.29 0.12 0.00 0.42 0.00 0.00 52.86 53.09 3a7q s ASN 2569Cb -0.13 -2.55 0.61 0.00 -1.45 0.00 0.00 41.25 37.73 3a7q s ASN 2569CO 0.03 -2.00 1.58 0.18 -3.72 0.00 0.00 177.10 173.17 3a7q n LEU 2570N 10.41 4.79 -0.29 3.21 4.77 -0.14 -4.24 117.00 135.51 3a7q n LEU 2570Ca 0.10 -3.29 0.12 0.00 -0.03 0.00 0.00 56.01 52.91 3a7q n LEU 2570Cb 0.50 -0.65 0.28 0.00 -2.33 0.00 0.00 43.42 41.22 3a7q n LEU 2570CO 0.70 0.87 0.97 0.74 -1.33 0.00 0.00 177.39 179.35 3a7q h THR 2571N 1.89 0.39 -0.08 -5.08 2.02 -1.69 -2.55 112.91 107.81 3a7q h THR 2571Ca 0.16 -0.09 -0.04 0.00 0.77 0.00 0.00 66.41 67.21 3a7q h THR 2571Cb 1.85 0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 68.33 3a7q h THR 2571CO 0.47 0.05 -0.35 0.59 0.37 0.00 0.00 175.52 176.64 3a7q n ASN 2572N -5.16 1.98 -4.87 4.18 3.02 -1.26 -4.90 115.26 108.24 3a7q n ASN 2572Ca 0.21 -3.78 -0.35 0.00 -0.03 0.00 0.00 54.58 50.63 3a7q n ASN 2572Cb 0.64 -0.54 -0.05 0.00 -0.61 0.00 0.00 39.78 39.22 3a7q n ASN 2572CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a7q s ALA 2573N -3.20 3.72 -0.23 5.41 0.00 -0.96 -5.02 121.76 121.48 3a7q s ALA 2573Ca 0.39 -0.38 -0.04 0.00 0.00 0.00 0.00 51.96 51.93 3a7q s ALA 2573Cb 0.37 -2.27 -0.13 0.00 0.00 0.00 0.00 23.12 21.09 3a7q s ALA 2573CO -0.04 0.57 -0.25 0.39 0.00 0.00 0.00 175.76 176.43 3a7q n GLU 2574N 0.88 0.54 -3.96 0.00 1.02 -0.46 -4.85 120.64 113.82 3a7q n GLU 2574Ca -0.08 0.17 -0.10 0.00 -0.02 0.00 0.00 57.16 57.14 3a7q n GLU 2574Cb 0.52 -1.41 -0.07 0.00 -0.02 0.00 0.00 31.44 30.47 3a7q n GLU 2574CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 3a7q s PHE 2575N -2.44 0.39 -0.04 -0.32 -0.12 -1.01 -1.69 117.98 112.74 3a7q s PHE 2575Ca -0.32 -0.75 0.04 0.00 -0.05 0.00 0.00 56.93 55.86 3a7q s PHE 2575Cb 0.10 -0.04 -0.00 0.00 -0.63 0.00 0.00 43.02 42.45 3a7q s PHE 2575CO 0.47 -0.74 -0.16 -1.50 -0.05 0.00 0.00 175.22 173.25 3a7q s ILE 2576N -3.97 1.32 0.08 -4.49 2.07 -0.45 -2.88 121.20 112.87 3a7q s ILE 2576Ca 0.17 -0.66 -0.14 0.00 -1.41 0.00 0.00 60.65 58.62 3a7q s ILE 2576Cb 0.03 -1.13 0.02 0.00 0.13 0.00 0.00 42.46 41.51 3a7q s ILE 2576CO 0.00 0.38 0.31 0.00 -1.91 0.00 0.00 174.94 173.73 3a7q s GLN 2577N 0.03 0.90 -0.28 3.50 -2.07 0.22 -1.65 119.66 120.31 3a7q s GLN 2577Ca -0.03 -0.65 -0.32 0.00 -1.82 0.00 0.00 55.36 52.54 3a7q s GLN 2577Cb -0.11 0.39 0.18 0.00 -1.09 0.00 0.00 33.01 32.38 3a7q s GLN 2577CO 0.02 -0.31 1.35 -0.59 -1.32 0.00 0.00 175.29 174.44 3a7q s PHE 2578N -3.18 -0.04 0.24 9.60 -0.12 -1.01 0.01 117.98 123.48 3a7q s PHE 2578Ca -0.01 0.06 -0.10 0.00 -0.05 0.00 0.00 56.93 56.83 3a7q s PHE 2578Cb 0.01 0.50 -0.07 0.00 -0.63 0.00 0.00 43.02 42.82 3a7q s PHE 2578CO -0.07 -0.04 0.57 0.71 -0.05 0.00 0.00 175.22 176.33 3a7q s TYR 2579N -1.33 3.42 -0.17 3.49 2.02 0.27 -1.10 117.35 123.96 3a7q s TYR 2579Ca 0.09 0.91 -0.11 0.00 -0.37 0.00 0.00 57.07 57.59 3a7q s TYR 2579Cb -0.01 -2.29 0.05 0.00 -0.40 0.00 0.00 41.96 39.31 3a7q s TYR 2579CO -0.06 0.25 0.42 0.12 -1.57 0.00 0.00 175.55 174.71 3a7q s PHE 2580N -1.83 -0.55 -0.00 2.71 5.36 0.61 -1.64 117.98 122.64 3a7q s PHE 2580Ca 0.48 1.23 -0.00 0.00 -0.96 0.00 0.00 56.93 57.67 3a7q s PHE 2580Cb -0.11 0.23 -0.00 0.00 -0.34 0.00 0.00 43.02 42.79 3a7q s PHE 2580CO 0.21 -0.30 0.01 1.41 -1.46 0.00 0.00 175.22 175.09 3a7q s MET 2581N 0.94 0.03 0.11 10.12 -2.45 -0.91 -0.80 119.30 126.35 3a7q s MET 2581Ca -0.06 -0.03 0.02 0.00 -1.25 0.00 0.00 55.69 54.37 3a7q s MET 2581Cb -0.06 0.01 -0.04 0.00 1.25 0.00 0.00 34.83 35.99 3a7q s MET 2581CO -0.08 -0.00 0.25 0.71 1.05 0.00 0.00 175.02 176.95 3a7q s TYR 2582N -0.09 3.49 -1.05 4.11 2.02 0.97 -0.96 117.35 125.84 3a7q s TYR 2582Ca -0.01 0.16 -0.12 0.00 -0.37 0.00 0.00 57.07 56.74 3a7q s TYR 2582Cb -0.01 -1.70 -0.03 0.00 -0.40 0.00 0.00 41.96 39.82 3a7q s TYR 2582CO -0.00 0.54 0.83 0.41 -1.57 0.00 0.00 175.55 175.77 3a7q n GLY 2583N -0.22 -1.11 0.20 0.71 0.00 -0.28 -4.66 105.19 99.84 3a7q n GLY 2583Ca -0.06 0.52 0.08 0.00 0.00 0.00 0.00 46.02 46.56 3a7q n GLY 2583CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a7q n LEU 2585N -3.28 0.00 -4.02 0.00 4.77 -1.26 -4.86 117.00 108.36 3a7q n LEU 2585Ca 0.01 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.70 3a7q n LEU 2585Cb 0.54 -0.19 -0.17 0.00 -2.33 0.00 0.00 43.42 41.28 3a7q n LEU 2585CO 0.35 -0.47 -0.49 -0.63 -1.33 0.00 0.00 177.39 174.83 3a7q s ILE 2586N -0.94 1.52 0.20 -0.08 -1.09 -1.26 -5.02 121.20 114.53 3a7q s ILE 2586Ca 0.00 -0.61 -0.33 0.00 -2.23 0.00 0.00 60.65 57.48 3a7q s ILE 2586Cb 0.00 -1.42 -0.14 0.00 -1.58 0.00 0.00 42.46 39.32 3a7q s ILE 2586CO 0.00 0.45 1.52 1.07 -1.23 0.00 0.00 174.94 176.75 3a7q n THR 2587N 4.65 0.39 -1.65 2.92 5.66 -1.26 -1.60 114.28 123.38 3a7q n THR 2587Ca -0.17 -0.10 -0.44 0.00 -3.05 0.00 0.00 64.05 60.29 3a7q n THR 2587Cb 0.50 -1.54 -0.01 0.00 -1.55 0.00 0.00 70.33 67.72 3a7q n THR 2587CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 3a7q n PRO 2588N 2.87 1.79 0.04 1.09 -0.02 -1.26 -4.55 135.00 134.96 3a7q n PRO 2588Ca 0.15 0.63 -0.22 0.00 -2.02 0.00 0.00 63.50 62.03 3a7q n PRO 2588Cb 0.30 -2.14 -0.14 0.00 -0.02 0.00 0.00 33.50 31.50 3a7q n PRO 2588CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3a7q h SER 2589N 2.60 0.50 -5.20 2.55 0.02 -1.94 -3.48 113.55 108.60 3a7q h SER 2589Ca -0.43 -0.90 -0.05 0.00 -0.84 0.00 0.00 61.79 59.56 3a7q h SER 2589Cb 1.31 -0.16 -0.10 0.00 0.14 0.00 0.00 62.40 63.58 3a7q h SER 2589CO 0.64 1.71 -0.11 0.54 -1.14 0.00 0.00 176.83 178.47 3a7q s ASN 2590N -7.16 -0.11 0.25 3.07 4.22 -1.26 -5.09 114.94 108.86 3a7q s ASN 2590Ca -0.18 -0.79 -0.08 0.00 -2.14 0.00 0.00 52.86 49.67 3a7q s ASN 2590Cb 0.05 0.56 0.41 0.00 1.28 0.00 0.00 41.25 43.55 3a7q s ASN 2590CO 0.81 -1.07 1.61 -0.09 -2.04 0.00 0.00 177.10 176.31 3a7q h ARG 2591N 2.29 0.04 0.00 3.55 2.43 -1.99 0.10 114.38 120.80 3a7q h ARG 2591Ca -0.28 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 3a7q h ARG 2591Cb 1.25 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 3a7q h ARG 2591CO 0.38 0.03 0.00 0.09 -1.51 0.00 0.00 179.97 178.96 3a7q n ASN 2592N -5.45 0.00 -0.33 -3.80 3.02 -1.26 -0.65 115.26 106.80 3a7q n ASN 2592Ca 0.13 0.28 0.13 0.00 -0.03 0.00 0.00 54.58 55.10 3a7q n ASN 2592Cb 0.46 -0.32 0.43 0.00 -0.61 0.00 0.00 39.78 39.74 3a7q n ASN 2592CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a7q n GLN 2593N -1.32 1.13 -2.02 3.52 6.02 0.36 -3.45 117.38 121.62 3a7q n GLN 2593Ca 0.01 -0.66 -0.42 0.00 -0.01 0.00 0.00 57.00 55.93 3a7q n GLN 2593Cb 0.03 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.77 3a7q n GLN 2593CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3a7q s GLY 2594N -2.32 2.01 0.14 1.08 0.00 0.18 -4.75 107.32 103.66 3a7q s GLY 2594Ca 0.29 1.30 -0.31 0.00 0.00 0.00 0.00 44.72 46.00 3a7q s GLY 2594CO 0.45 2.40 1.42 0.14 0.00 0.00 0.00 173.10 177.51 3a7q s VAL 2595N 0.58 3.11 -0.12 1.40 1.01 -1.24 -4.50 120.40 120.64 3a7q s VAL 2595Ca 0.64 0.82 -0.07 0.00 0.00 0.00 0.00 61.98 63.37 3a7q s VAL 2595Cb -0.41 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 3a7q s VAL 2595CO 0.37 0.08 0.14 -0.76 0.00 0.00 0.00 175.10 174.92 3a7q s LEU 2596N 0.85 4.38 -0.24 3.92 1.43 -0.73 -0.73 118.68 127.56 3a7q s LEU 2596Ca 0.64 0.46 -0.03 0.00 -1.03 0.00 0.00 54.13 54.17 3a7q s LEU 2596Cb -0.39 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 43.77 3a7q s LEU 2596CO 0.32 0.41 -0.04 -0.22 0.23 0.00 0.00 176.35 177.06 3a7q s LEU 2597N -1.03 3.09 0.17 1.79 2.96 0.46 -1.92 118.68 124.20 3a7q s LEU 2597Ca 0.15 -0.59 0.05 0.00 -0.22 0.00 0.00 54.13 53.53 3a7q s LEU 2597Cb -0.12 -1.73 -0.05 0.00 0.50 0.00 0.00 46.19 44.80 3a7q s LEU 2597CO 0.04 -0.08 -0.11 -1.61 -1.32 0.00 0.00 176.35 173.27 3a7q s GLU 2598N 1.43 1.15 0.13 1.98 2.02 -0.69 -0.08 118.70 124.65 3a7q s GLU 2598Ca 0.04 -1.50 0.06 0.00 0.02 0.00 0.00 54.97 53.58 3a7q s GLU 2598Cb -0.15 -0.77 -0.04 0.00 0.10 0.00 0.00 34.13 33.26 3a7q s GLU 2598CO -0.03 0.10 -0.14 1.52 0.02 0.00 0.00 175.26 176.73 3a7q s TYR 2599N -3.22 1.42 -0.01 1.61 -0.85 -0.32 -1.94 117.35 114.05 3a7q s TYR 2599Ca 0.19 -0.58 0.01 0.00 -0.52 0.00 0.00 57.07 56.17 3a7q s TYR 2599Cb 0.02 -0.73 0.00 0.00 0.38 0.00 0.00 41.96 41.63 3a7q s TYR 2599CO 0.03 0.16 -0.02 0.45 -1.52 0.00 0.00 175.55 174.65 3a7q s SER 2600N -2.62 0.29 -0.05 -0.18 0.15 -0.47 -0.49 113.70 110.33 3a7q s SER 2600Ca 0.11 -0.04 0.10 0.00 0.70 0.00 0.00 55.95 56.82 3a7q s SER 2600Cb -0.04 -0.06 0.25 0.00 -1.71 0.00 0.00 66.02 64.47 3a7q s SER 2600CO 0.03 0.00 1.20 1.33 1.20 0.00 0.00 173.24 177.00 3a7q n VAL 2601N 3.24 1.33 -2.70 4.45 0.24 -1.26 -1.43 118.33 122.19 3a7q n VAL 2601Ca -0.15 -1.30 -0.06 0.00 -2.04 0.00 0.00 64.34 60.78 3a7q n VAL 2601Cb 0.57 0.28 0.04 0.00 -1.47 0.00 0.00 33.84 33.26 3a7q n VAL 2601CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 3a7q n ASN 2602N -0.19 1.88 -1.07 -1.34 0.23 -1.26 -4.88 115.26 108.63 3a7q n ASN 2602Ca 0.10 -2.48 -0.11 0.00 -0.53 0.00 0.00 54.58 51.57 3a7q n ASN 2602Cb 0.48 -0.49 -0.02 0.00 -2.08 0.00 0.00 39.78 37.67 3a7q n ASN 2602CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3a7q n GLY 2603N -0.39 0.38 2.27 4.83 0.00 -1.26 -2.39 105.19 108.63 3a7q n GLY 2603Ca 0.12 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3a7q n GLY 2603CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a7q n GLY 2604N -1.25 0.70 0.19 -0.02 0.00 -1.26 -4.93 105.19 98.62 3a7q n GLY 2604Ca -0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 3a7q n GLY 2604CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3a7q h ILE 2605N 0.00 1.21 -4.14 -0.61 2.04 -1.75 -3.44 117.51 110.82 3a7q h ILE 2605Ca 0.00 -0.70 -0.49 0.00 1.00 0.00 0.00 64.86 64.68 3a7q h ILE 2605Cb 0.00 0.97 -0.27 0.00 -0.74 0.00 0.00 36.82 36.78 3a7q h ILE 2605CO 0.00 0.24 -0.81 0.42 0.00 0.00 0.00 178.15 178.00 3a7q s THR 2606N -5.39 1.21 -0.05 -0.27 -4.23 -1.26 -4.86 115.64 100.79 3a7q s THR 2606Ca -0.13 -0.86 0.07 0.00 -1.18 0.00 0.00 61.69 59.58 3a7q s THR 2606Cb 0.10 -1.05 -0.01 0.00 1.34 0.00 0.00 72.50 72.87 3a7q s THR 2606CO 0.75 0.18 -0.25 0.26 -0.54 0.00 0.00 174.62 175.02 3a7q s TRP 2607N -0.62 2.39 -0.20 3.99 0.52 -1.26 -4.37 118.94 119.40 3a7q s TRP 2607Ca 0.04 -0.64 -0.01 0.00 0.02 0.00 0.00 56.10 55.50 3a7q s TRP 2607Cb -0.07 -1.56 0.00 0.00 -1.15 0.00 0.00 33.47 30.69 3a7q s TRP 2607CO 0.01 -0.17 -0.12 -0.80 0.02 0.00 0.00 176.95 175.89 3a7q s ASN 2608N -0.28 3.77 0.22 2.95 0.01 0.36 -4.68 114.94 117.29 3a7q s ASN 2608Ca 0.00 -0.50 -0.32 0.00 -0.71 0.00 0.00 52.86 51.33 3a7q s ASN 2608Cb -0.13 -1.62 -0.12 0.00 0.41 0.00 0.00 41.25 39.79 3a7q s ASN 2608CO 0.02 0.00 1.64 -0.11 -1.51 0.00 0.00 177.10 177.15 3a7q n LEU 2609N 4.63 3.86 -0.09 0.60 7.94 -1.26 -1.17 117.00 131.51 3a7q n LEU 2609Ca -0.19 1.09 -0.15 0.00 -1.11 0.00 0.00 56.01 55.65 3a7q n LEU 2609Cb 0.51 -1.54 -0.08 0.00 0.53 0.00 0.00 43.42 42.84 3a7q n LEU 2609CO 0.28 0.04 -1.10 -0.11 -1.11 0.00 0.00 177.39 175.39 3a7q n LEU 2610N 3.29 2.40 -3.71 -1.96 7.94 0.89 -4.91 117.00 120.94 3a7q n LEU 2610Ca 0.14 0.02 -0.11 0.00 -1.11 0.00 0.00 56.01 54.95 3a7q n LEU 2610Cb 0.34 -0.59 -0.11 0.00 0.53 0.00 0.00 43.42 43.59 3a7q n LEU 2610CO 0.64 0.65 0.05 -0.32 -1.11 0.00 0.00 177.39 177.30 3a7q s MET 2611N -2.35 0.40 -0.32 1.96 0.00 -0.82 -5.02 119.30 113.15 3a7q s MET 2611Ca -0.25 0.72 -0.23 0.00 0.00 0.00 0.00 55.69 55.94 3a7q s MET 2611Cb 0.07 0.03 -0.00 0.00 0.00 0.00 0.00 34.83 34.94 3a7q s MET 2611CO 0.38 -0.13 0.75 -2.00 0.00 0.00 0.00 175.02 174.01 3a7q s GLU 2612N 1.09 3.91 -1.15 4.11 2.12 -1.26 -0.40 118.70 127.11 3a7q s GLU 2612Ca -0.07 0.46 -0.15 0.00 0.36 0.00 0.00 54.97 55.57 3a7q s GLU 2612Cb -0.07 -3.74 0.15 0.00 0.26 0.00 0.00 34.13 30.73 3a7q s GLU 2612CO -0.09 -0.68 1.40 0.42 -0.54 0.00 0.00 175.26 175.76 3a7q s ILE 2613N 2.89 4.87 0.37 -3.70 1.01 0.09 -4.98 121.20 121.76 3a7q s ILE 2613Ca 0.30 -2.32 -0.25 0.00 0.00 0.00 0.00 60.65 58.38 3a7q s ILE 2613Cb -0.14 -4.91 -0.13 0.00 0.01 0.00 0.00 42.46 37.29 3a7q s ILE 2613CO 0.13 -1.64 0.80 0.49 0.00 0.00 0.00 174.94 174.72 3a7q n PHE 2614N 6.13 0.45 -0.07 3.97 3.01 -1.26 -3.70 117.46 125.99 3a7q n PHE 2614Ca 0.35 0.64 -0.13 0.00 1.01 0.00 0.00 57.45 59.32 3a7q n PHE 2614Cb 0.44 -2.12 -0.06 0.00 -0.01 0.00 0.00 39.48 37.73 3a7q n PHE 2614CO 0.00 0.00 0.00 0.10 1.01 0.00 0.00 176.76 177.87 3a7q h TYR 2615N 1.32 0.53 0.00 1.38 -0.00 -1.92 -3.13 116.97 115.17 3a7q h TYR 2615Ca -0.40 -0.15 0.00 0.00 0.00 0.00 0.00 58.73 58.17 3a7q h TYR 2615Cb 1.37 -0.12 0.00 0.00 0.00 0.00 0.00 36.73 37.98 3a7q h TYR 2615CO 0.42 0.79 0.00 0.38 -0.00 0.00 0.00 178.16 179.75 3a7q h ASP 2616N 0.13 0.00 -3.76 0.10 2.03 -1.91 -3.44 116.42 109.56 3a7q h ASP 2616Ca 0.04 0.00 -0.45 0.00 -0.73 0.00 0.00 57.03 55.88 3a7q h ASP 2616Cb 0.68 0.00 0.15 0.00 -0.83 0.00 0.00 39.33 39.33 3a7q h ASP 2616CO 0.04 0.00 0.37 -1.10 -1.03 0.00 0.00 179.24 177.52 3a7q s GLN 2617N -3.23 0.92 -1.44 4.15 -1.52 -1.18 -4.48 119.66 112.89 3a7q s GLN 2617Ca 0.07 -0.48 -0.07 0.00 -1.95 0.00 0.00 55.36 52.93 3a7q s GLN 2617Cb 0.11 -1.94 0.04 0.00 -0.22 0.00 0.00 33.01 31.00 3a7q s GLN 2617CO 0.50 -2.19 0.79 0.66 -0.25 0.00 0.00 175.29 174.81 3a7q n TYR 2618N -3.57 -2.04 0.10 0.91 4.01 -1.26 -4.72 117.16 110.58 3a7q n TYR 2618Ca 0.15 0.86 -0.04 0.00 -0.16 0.00 0.00 57.90 58.70 3a7q n TYR 2618Cb 0.60 -4.07 0.04 0.00 -0.31 0.00 0.00 39.34 35.60 3a7q n TYR 2618CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3a7q h SER 2619N -1.94 0.01 -2.15 7.72 4.64 -1.83 0.28 113.55 120.28 3a7q h SER 2619Ca -0.60 -0.01 -0.55 0.00 -0.47 0.00 0.00 61.79 60.16 3a7q h SER 2619Cb 1.37 -0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.37 3a7q h SER 2619CO 0.63 0.79 -0.62 -1.59 -0.87 0.00 0.00 176.83 175.17 3a7q s LYS 2620N -3.21 2.35 0.05 4.77 -2.85 -1.26 -4.67 119.74 114.91 3a7q s LYS 2620Ca -0.00 -1.42 -0.33 0.00 -1.00 0.00 0.00 55.97 53.22 3a7q s LYS 2620Cb 0.11 -2.19 -0.12 0.00 -2.06 0.00 0.00 37.83 33.58 3a7q s LYS 2620CO 0.79 0.32 1.81 -2.30 0.10 0.00 0.00 175.35 176.07 3a7q n PRO 2621N -0.96 2.43 -4.35 1.78 -0.02 -1.26 -4.77 135.00 127.85 3a7q n PRO 2621Ca -0.06 0.88 -0.25 0.00 -2.02 0.00 0.00 63.50 62.06 3a7q n PRO 2621Cb 0.59 -2.74 -0.09 0.00 -0.02 0.00 0.00 33.50 31.25 3a7q n PRO 2621CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3a7q s GLY 2622N 2.95 2.06 -0.16 -1.23 0.00 0.02 -4.90 107.32 106.05 3a7q s GLY 2622Ca 0.86 -1.96 -0.05 0.00 0.00 0.00 0.00 44.72 43.57 3a7q s GLY 2622CO 0.43 -1.91 -0.00 -0.12 0.00 0.00 0.00 173.10 171.50 3a7q s PHE 2623N -2.52 3.11 -0.22 1.90 5.36 -1.26 -0.28 117.98 124.07 3a7q s PHE 2623Ca 0.34 -0.15 -0.04 0.00 -0.96 0.00 0.00 56.93 56.12 3a7q s PHE 2623Cb -0.00 -2.00 -0.01 0.00 -0.34 0.00 0.00 43.02 40.67 3a7q s PHE 2623CO 0.19 0.05 -0.03 0.08 -1.46 0.00 0.00 175.22 174.05 3a7q s VAL 2624N 0.33 3.54 -0.16 3.12 1.01 -0.26 -5.01 120.40 122.96 3a7q s VAL 2624Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.53 3a7q s VAL 2624Cb -0.13 -2.62 0.03 0.00 0.00 0.00 0.00 36.38 33.66 3a7q s VAL 2624CO 0.02 0.41 -0.09 0.21 0.00 0.00 0.00 175.10 175.65 3a7q s ASN 2625N 1.44 2.86 -0.04 3.32 3.84 -1.26 -2.41 114.94 122.69 3a7q s ASN 2625Ca 0.05 -0.63 0.05 0.00 0.21 0.00 0.00 52.86 52.55 3a7q s ASN 2625Cb -0.14 -1.06 -0.01 0.00 -0.55 0.00 0.00 41.25 39.48 3a7q s ASN 2625CO -0.02 -0.13 -0.21 -0.63 -2.79 0.00 0.00 177.10 173.32 3a7q s ILE 2626N 1.54 1.71 0.03 -5.21 1.01 -0.66 -5.02 121.20 114.61 3a7q s ILE 2626Ca 0.02 -0.88 -0.30 0.00 0.00 0.00 0.00 60.65 59.48 3a7q s ILE 2626Cb -0.14 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.84 3a7q s ILE 2626CO -0.09 0.48 1.05 -0.22 0.00 0.00 0.00 174.94 176.17 3a7q s LEU 2627N -0.14 4.38 0.16 2.97 2.96 -1.26 -1.34 118.68 126.40 3a7q s LEU 2627Ca -0.01 1.80 -0.31 0.00 -0.22 0.00 0.00 54.13 55.38 3a7q s LEU 2627Cb -0.12 -3.58 -0.10 0.00 0.50 0.00 0.00 46.19 42.89 3a7q s LEU 2627CO 0.02 -0.31 1.66 -0.76 -1.32 0.00 0.00 176.35 175.64 3a7q s LEU 2628N 0.92 4.37 0.67 -0.68 1.43 -0.68 -4.93 118.68 119.77 3a7q s LEU 2628Ca 0.54 2.69 -0.14 0.00 -1.03 0.00 0.00 54.13 56.19 3a7q s LEU 2628Cb -0.24 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.39 3a7q s LEU 2628CO 0.29 -0.90 1.08 -2.16 0.23 0.00 0.00 176.35 174.89 3a7q s PRO 2629N 1.62 2.88 0.33 1.29 0.04 -1.26 -4.94 135.00 134.96 3a7q s PRO 2629Ca 0.74 1.22 0.05 0.00 0.04 0.00 0.00 61.00 63.04 3a7q s PRO 2629Cb -0.45 -1.97 0.68 0.00 0.04 0.00 0.00 34.50 32.79 3a7q s PRO 2629CO 0.32 -1.17 1.89 -1.00 0.04 0.00 0.00 177.00 177.09 3a7q h PRO 2630N -0.19 0.83 0.00 0.56 0.13 -1.99 -1.05 132.00 130.29 3a7q h PRO 2630Ca -0.46 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3a7q h PRO 2630Cb 1.23 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3a7q h PRO 2630CO 0.55 0.55 0.00 -0.44 -0.23 0.00 0.00 178.00 178.43 3a7q h ASP 2631N 0.85 0.00 1.30 1.44 3.32 -2.03 -1.94 116.42 119.36 3a7q h ASP 2631Ca 0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.47 3a7q h ASP 2631Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 3a7q h ASP 2631CO -0.18 0.00 -0.26 0.00 -1.72 0.00 0.00 179.24 177.08 3a7q h ALA 2632N 2.11 0.83 -0.40 3.45 0.00 -1.55 -3.40 119.26 120.30 3a7q h ALA 2632Ca 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.21 3a7q h ALA 2632Cb 0.30 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.02 3a7q h ALA 2632CO 0.00 0.00 2.84 1.63 0.00 0.00 0.00 179.25 183.72 3a7q n LYS 2633N -2.32 4.18 -3.47 0.00 5.02 -0.73 -4.78 118.16 116.06 3a7q n LYS 2633Ca 0.04 -2.94 -0.21 0.00 -2.02 0.00 0.00 58.31 53.19 3a7q n LYS 2633Cb 0.45 -2.67 -0.01 0.00 -0.02 0.00 0.00 35.03 32.78 3a7q n LYS 2633CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3a7q s GLU 2634N 0.06 2.51 0.00 1.97 0.41 -1.26 -4.09 118.70 118.30 3a7q s GLU 2634Ca 0.60 -1.58 0.18 0.00 -0.41 0.00 0.00 54.97 53.76 3a7q s GLU 2634Cb 0.19 -2.42 0.83 0.00 -1.78 0.00 0.00 34.13 30.95 3a7q s GLU 2634CO -0.08 -0.35 1.55 0.44 -0.49 0.00 0.00 175.26 176.32 3a7q n ILE 2635N -1.71 0.62 -3.08 -1.63 -6.64 -1.26 -0.97 119.36 104.69 3a7q n ILE 2635Ca 0.05 0.16 -0.12 0.00 -1.77 0.00 0.00 62.75 61.06 3a7q n ILE 2635Cb 0.62 -0.86 -0.04 0.00 -1.44 0.00 0.00 39.64 37.92 3a7q n ILE 2635CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3a7q s ALA 2636N -2.77 -0.84 -0.09 -1.28 0.00 -1.22 -3.68 121.76 111.89 3a7q s ALA 2636Ca 0.13 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 51.05 3a7q s ALA 2636Cb 0.12 -2.28 -0.02 0.00 0.00 0.00 0.00 23.12 20.93 3a7q s ALA 2636CO 0.29 -2.15 -0.12 0.99 0.00 0.00 0.00 175.76 174.78 3a7q s THR 2637N 0.81 3.24 0.16 0.00 2.01 0.23 -4.45 115.64 117.64 3a7q s THR 2637Ca 0.27 -0.63 0.11 0.00 0.31 0.00 0.00 61.69 61.75 3a7q s THR 2637Cb -0.02 -2.32 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 3a7q s THR 2637CO -0.09 0.56 -0.24 0.00 -0.69 0.00 0.00 174.62 174.16 3a7q s ARG 2638N -0.31 1.40 0.16 4.92 1.70 -0.51 0.13 118.95 126.44 3a7q s ARG 2638Ca 0.03 -1.41 0.10 0.00 -0.47 0.00 0.00 55.73 53.98 3a7q s ARG 2638Cb -0.13 -1.76 -0.04 0.00 -0.57 0.00 0.00 34.95 32.45 3a7q s ARG 2638CO 0.03 0.40 -0.18 -0.06 -1.08 0.00 0.00 175.30 174.41 3a7q s PHE 2639N -1.42 2.49 0.00 5.89 0.08 -1.26 -1.37 117.98 122.39 3a7q s PHE 2639Ca 0.16 -0.28 0.01 0.00 0.12 0.00 0.00 56.93 56.94 3a7q s PHE 2639Cb -0.09 -1.27 -0.00 0.00 -0.57 0.00 0.00 43.02 41.09 3a7q s PHE 2639CO 0.07 0.45 -0.03 -0.98 -0.10 0.00 0.00 175.22 174.63 3a7q s ARG 2640N -2.47 0.27 -0.12 0.44 1.70 -0.82 -0.46 118.95 117.50 3a7q s ARG 2640Ca 0.20 -0.18 -0.01 0.00 -0.47 0.00 0.00 55.73 55.27 3a7q s ARG 2640Cb -0.09 -0.23 -0.02 0.00 -0.57 0.00 0.00 34.95 34.04 3a7q s ARG 2640CO 0.11 0.06 -0.10 -1.58 -1.08 0.00 0.00 175.30 172.72 3a7q s TRP 2641N -0.24 2.88 -0.11 5.89 0.51 0.15 -1.70 118.94 126.33 3a7q s TRP 2641Ca -0.00 -0.42 -0.11 0.00 -2.12 0.00 0.00 56.10 53.45 3a7q s TRP 2641Cb -0.02 -1.84 0.03 0.00 -0.81 0.00 0.00 33.47 30.82 3a7q s TRP 2641CO -0.00 -0.06 0.30 1.67 -0.51 0.00 0.00 176.95 178.35 3a7q s TRP 2642N 0.13 -0.32 -0.25 -1.98 1.48 -0.81 0.15 118.94 117.34 3a7q s TRP 2642Ca -0.04 0.78 -0.16 0.00 -1.06 0.00 0.00 56.10 55.62 3a7q s TRP 2642Cb -0.14 0.11 -0.03 0.00 -1.16 0.00 0.00 33.47 32.24 3a7q s TRP 2642CO 0.04 -0.17 0.42 -1.14 -4.06 0.00 0.00 176.95 172.04 3a7q s GLN 2643N 0.09 4.08 0.36 3.25 0.74 -0.49 -1.77 119.66 125.91 3a7q s GLN 2643Ca -0.01 0.17 0.15 0.00 0.05 0.00 0.00 55.36 55.72 3a7q s GLN 2643Cb -0.02 -3.62 0.66 0.00 1.10 0.00 0.00 33.01 31.14 3a7q s GLN 2643CO 0.01 -0.22 1.76 -1.35 -0.55 0.00 0.00 175.29 174.93 3a7q h PRO 2644N 7.87 0.00 -2.80 1.67 0.11 -1.79 -3.41 132.00 133.66 3a7q h PRO 2644Ca -0.32 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.67 3a7q h PRO 2644Cb 1.16 0.00 -0.22 0.00 0.11 0.00 0.00 31.00 32.05 3a7q h PRO 2644CO 0.69 0.42 -0.21 1.03 -0.21 0.00 0.00 178.00 179.72 3a7q s ARG 2645N -3.86 0.63 -0.04 1.05 1.81 -1.22 -5.04 118.95 112.27 3a7q s ARG 2645Ca -0.02 0.17 -0.29 0.00 -1.72 0.00 0.00 55.73 53.87 3a7q s ARG 2645Cb 0.13 0.29 0.11 0.00 -0.45 0.00 0.00 34.95 35.03 3a7q s ARG 2645CO 0.71 -0.15 0.92 -3.38 -0.68 0.00 0.00 175.30 172.72 3a7q s HIS 2646N -0.68 -0.35 -2.00 -0.53 -3.43 -1.26 -4.36 115.29 102.69 3a7q s HIS 2646Ca -0.08 0.31 0.12 0.00 -0.80 0.00 0.00 55.06 54.61 3a7q s HIS 2646Cb -0.04 0.52 0.71 0.00 -1.43 0.00 0.00 32.58 32.34 3a7q s HIS 2646CO 0.03 -0.49 1.27 -0.25 -2.00 0.00 0.00 174.74 173.30 3a7q n ASP 2647N -0.02 0.00 0.00 7.38 8.00 -1.26 -4.98 116.55 125.66 3a7q n ASP 2647Ca -0.09 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.26 3a7q n ASP 2647Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.71 3a7q n ASP 2647CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a7q n GLY 2648N 0.39 -0.44 3.63 0.44 0.00 -1.26 -4.89 105.19 103.06 3a7q n GLY 2648Ca 0.09 -2.11 -0.50 0.00 0.00 0.00 0.00 46.02 43.50 3a7q n GLY 2648CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3a7q n LEU 2649N 0.00 2.36 -2.25 0.99 7.94 -1.26 -1.11 117.00 123.67 3a7q n LEU 2649Ca 0.00 1.09 -0.15 0.00 -1.11 0.00 0.00 56.01 55.85 3a7q n LEU 2649Cb 0.00 -1.29 -0.02 0.00 0.53 0.00 0.00 43.42 42.65 3a7q n LEU 2649CO 0.00 -0.65 -0.18 0.47 -1.11 0.00 0.00 177.39 175.92 3a7q n ASP 2650N 3.35 -4.37 -4.23 1.96 8.00 0.43 -4.97 116.55 116.73 3a7q n ASP 2650Ca 0.19 0.18 -0.30 0.00 0.71 0.00 0.00 54.79 55.56 3a7q n ASP 2650Cb 0.23 -3.74 -0.16 0.00 -0.02 0.00 0.00 41.12 37.43 3a7q n ASP 2650CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3a7q s GLN 2651N -4.71 2.41 -1.00 -1.24 -0.21 -0.27 -4.15 119.66 110.48 3a7q s GLN 2651Ca 0.00 -0.82 -0.02 0.00 0.02 0.00 0.00 55.36 54.54 3a7q s GLN 2651Cb 0.00 -2.02 0.00 0.00 1.00 0.00 0.00 33.01 31.99 3a7q s GLN 2651CO 0.00 0.32 0.27 0.09 -2.12 0.00 0.00 175.29 173.85 3a7q n ASN 2652N 3.07 -4.29 -4.61 5.90 5.03 -0.63 -4.36 115.26 115.37 3a7q n ASN 2652Ca -0.18 -0.13 -0.28 0.00 0.87 0.00 0.00 54.58 54.86 3a7q n ASN 2652Cb 0.52 -3.25 0.21 0.00 -1.02 0.00 0.00 39.78 36.23 3a7q n ASN 2652CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.26 176.94 3a7q s ASP 2653N -2.71 1.96 0.13 6.41 1.47 -1.13 -4.64 116.67 118.16 3a7q s ASP 2653Ca 0.13 1.26 -0.20 0.00 1.18 0.00 0.00 52.55 54.92 3a7q s ASP 2653Cb -0.06 -1.97 0.05 0.00 -0.34 0.00 0.00 42.92 40.61 3a7q s ASP 2653CO 0.17 -3.55 0.51 -1.66 0.68 0.00 0.00 175.17 171.32 3a7q s TRP 2654N -2.80 -0.40 0.02 2.11 1.48 -0.78 -1.12 118.94 117.45 3a7q s TRP 2654Ca 0.67 0.18 -0.01 0.00 -1.06 0.00 0.00 56.10 55.88 3a7q s TRP 2654Cb -0.21 0.42 -0.02 0.00 -1.16 0.00 0.00 33.47 32.50 3a7q s TRP 2654CO 0.60 -0.77 -0.01 0.00 -4.06 0.00 0.00 176.95 172.72 3a7q s ALA 2655N -3.59 0.06 -0.03 2.67 0.00 -0.14 -0.34 121.76 120.38 3a7q s ALA 2655Ca 0.01 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 51.48 3a7q s ALA 2655Cb 0.00 0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.27 3a7q s ALA 2655CO -0.11 -0.16 -0.05 -1.50 0.00 0.00 0.00 175.76 173.94 3a7q s ILE 2656N -1.37 0.55 0.11 0.00 2.07 -1.01 -2.14 121.20 119.41 3a7q s ILE 2656Ca -0.15 -0.17 0.03 0.00 -1.41 0.00 0.00 60.65 58.96 3a7q s ILE 2656Cb -0.09 -0.55 -0.04 0.00 0.13 0.00 0.00 42.46 41.91 3a7q s ILE 2656CO -0.01 0.21 -0.09 -0.62 -1.91 0.00 0.00 174.94 172.52 3a7q s ASP 2657N 0.65 1.46 -1.01 4.50 3.68 -0.66 -2.17 116.67 123.13 3a7q s ASP 2657Ca -0.09 -0.88 -0.13 0.00 2.13 0.00 0.00 52.55 53.58 3a7q s ASP 2657Cb -0.12 0.02 -0.01 0.00 -1.45 0.00 0.00 42.92 41.36 3a7q s ASP 2657CO 0.00 -0.31 0.75 0.59 0.13 0.00 0.00 175.17 176.33 3a7q n ASN 2658N 0.32 -5.76 -4.73 -0.34 4.13 -1.16 -0.56 115.26 107.16 3a7q n ASN 2658Ca -0.14 -0.83 -0.41 0.00 1.68 0.00 0.00 54.58 54.88 3a7q n ASN 2658Cb 0.59 -3.49 -0.04 0.00 -1.54 0.00 0.00 39.78 35.30 3a7q n ASN 2658CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3a7q s VAL 2659N -3.29 4.52 -0.06 2.41 1.01 -0.19 -3.89 120.40 120.90 3a7q s VAL 2659Ca 0.31 2.06 -0.03 0.00 0.00 0.00 0.00 61.98 64.32 3a7q s VAL 2659Cb -0.11 -4.32 0.04 0.00 0.00 0.00 0.00 36.38 32.00 3a7q s VAL 2659CO 0.84 0.30 0.09 -0.22 0.00 0.00 0.00 175.10 176.12 3a7q s LEU 2660N 0.09 0.08 -0.23 3.92 2.96 0.10 -0.94 118.68 124.65 3a7q s LEU 2660Ca 0.47 0.11 0.02 0.00 -0.22 0.00 0.00 54.13 54.51 3a7q s LEU 2660Cb -0.23 -0.01 0.04 0.00 0.50 0.00 0.00 46.19 46.49 3a7q s LEU 2660CO 0.30 -0.26 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.31 3a7q s ILE 2661N 2.21 2.21 0.00 6.68 1.01 0.19 -0.61 121.20 132.88 3a7q s ILE 2661Ca 0.04 -1.33 0.00 0.00 0.00 0.00 0.00 60.65 59.37 3a7q s ILE 2661Cb -0.12 -2.15 0.00 0.00 0.01 0.00 0.00 42.46 40.20 3a7q s ILE 2661CO -0.04 0.20 0.00 -0.24 0.00 0.00 0.00 174.94 174.85