#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bt4 s SER 1603N 0.00 5.74 0.50 0.55 1.04 -1.26 -4.79 113.70 115.48 2bt4 s SER 1603Ca 0.00 -0.17 0.15 0.00 0.48 0.00 0.00 55.95 56.41 2bt4 s SER 1603Cb 0.00 -1.03 1.20 0.00 0.10 0.00 0.00 66.02 66.30 2bt4 s SER 1603CO 0.00 -0.69 2.11 -0.07 0.98 0.00 0.00 173.24 175.57 2bt4 h LEU 1604N 0.61 0.09 -0.73 2.42 4.07 -1.78 -2.77 115.31 117.22 2bt4 h LEU 1604Ca -0.43 -0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.42 2bt4 h LEU 1604Cb 1.27 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.97 2bt4 h LEU 1604CO 0.51 0.07 -0.11 0.00 -1.08 0.00 0.00 178.44 177.82 2bt4 h ALA 1605N 1.92 0.92 0.00 1.53 0.00 -1.93 -3.27 119.26 118.44 2bt4 h ALA 1605Ca 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2bt4 h ALA 1605Cb 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2bt4 h ALA 1605CO -0.01 0.63 -0.98 0.09 0.00 0.00 0.00 179.25 178.98 2bt4 n ASN 1606N -4.15 0.66 -3.58 0.00 3.02 -1.06 -4.99 115.26 105.15 2bt4 n ASN 1606Ca 0.01 -0.42 -0.14 0.00 -0.03 0.00 0.00 54.58 54.01 2bt4 n ASN 1606Cb 0.38 0.82 -0.06 0.00 -0.61 0.00 0.00 39.78 40.31 2bt4 n ASN 1606CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bt4 s ALA 1607N -3.13 -1.85 0.71 5.41 0.00 -1.11 -4.98 121.76 116.82 2bt4 s ALA 1607Ca 0.05 1.63 -0.13 0.00 0.00 0.00 0.00 51.96 53.52 2bt4 s ALA 1607Cb 0.15 -0.68 0.03 0.00 0.00 0.00 0.00 23.12 22.62 2bt4 s ALA 1607CO 0.81 -0.32 1.10 -1.25 0.00 0.00 0.00 175.76 176.09 2bt4 s PRO 1608N -0.62 2.56 -0.12 0.00 0.04 -1.26 -4.20 135.00 131.39 2bt4 s PRO 1608Ca -0.04 1.25 -0.28 0.00 0.04 0.00 0.00 61.00 61.97 2bt4 s PRO 1608Cb -0.02 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.58 2bt4 s PRO 1608CO 0.03 -1.42 0.92 0.42 0.04 0.00 0.00 177.00 177.00 2bt4 s ILE 1609N -2.66 4.84 -0.08 0.56 1.01 0.46 -1.07 121.20 124.26 2bt4 s ILE 1609Ca 0.63 1.86 -0.30 0.00 0.00 0.00 0.00 60.65 62.85 2bt4 s ILE 1609Cb -0.18 -4.23 -0.02 0.00 0.01 0.00 0.00 42.46 38.03 2bt4 s ILE 1609CO 0.49 0.04 1.11 -0.32 0.00 0.00 0.00 174.94 176.26 2bt4 s MET 1610N 1.93 4.39 -0.23 2.79 -2.45 -0.65 -0.76 119.30 124.32 2bt4 s MET 1610Ca 0.44 1.54 0.01 0.00 -1.25 0.00 0.00 55.69 56.43 2bt4 s MET 1610Cb -0.18 -3.55 0.04 0.00 1.25 0.00 0.00 34.83 32.39 2bt4 s MET 1610CO 0.16 -0.38 -0.13 0.42 1.05 0.00 0.00 175.02 176.14 2bt4 s ILE 1611N 2.11 2.30 -0.09 10.11 1.01 -0.11 -0.95 121.20 135.59 2bt4 s ILE 1611Ca 0.52 -1.21 0.02 0.00 0.00 0.00 0.00 60.65 59.98 2bt4 s ILE 1611Cb -0.22 -2.16 -0.02 0.00 0.01 0.00 0.00 42.46 40.07 2bt4 s ILE 1611CO 0.20 0.25 -0.14 -0.76 0.00 0.00 0.00 174.94 174.50 2bt4 s LEU 1612N 1.23 2.74 -0.07 2.97 1.43 0.43 -1.01 118.68 126.41 2bt4 s LEU 1612Ca -0.01 -0.25 0.03 0.00 -1.03 0.00 0.00 54.13 52.87 2bt4 s LEU 1612Cb -0.16 -1.58 0.01 0.00 0.03 0.00 0.00 46.19 44.48 2bt4 s LEU 1612CO -0.08 0.26 -0.16 0.20 0.23 0.00 0.00 176.35 176.80 2bt4 s ASN 1613N -0.25 2.16 0.20 2.29 0.01 -0.56 -0.63 114.94 118.16 2bt4 s ASN 1613Ca 0.01 -0.37 0.00 0.00 -0.71 0.00 0.00 52.86 51.79 2bt4 s ASN 1613Cb -0.13 -0.87 0.00 0.00 0.41 0.00 0.00 41.25 40.66 2bt4 s ASN 1613CO 0.03 0.10 0.00 0.61 -1.51 0.00 0.00 177.10 176.33 2bt4 n GLY 1614N 3.54 0.24 3.76 0.66 0.00 0.42 -1.69 105.19 112.12 2bt4 n GLY 1614Ca -0.21 -1.81 -0.38 0.00 0.00 0.00 0.00 46.02 43.62 2bt4 n GLY 1614CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bt4 s PRO 1615N -0.04 3.49 0.00 1.61 0.04 -1.10 -2.99 135.00 136.01 2bt4 s PRO 1615Ca 0.00 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.15 2bt4 s PRO 1615Cb 0.00 -2.41 0.00 0.00 0.04 0.00 0.00 34.50 32.13 2bt4 s PRO 1615CO 0.00 -0.87 0.00 0.09 0.04 0.00 0.00 177.00 176.26 2bt4 n ASN 1616N -0.62 0.00 0.19 6.66 3.02 -1.26 -4.57 115.26 118.68 2bt4 n ASN 1616Ca 0.08 0.00 0.14 0.00 -0.03 0.00 0.00 54.58 54.77 2bt4 n ASN 1616Cb 0.45 0.00 0.62 0.00 -0.61 0.00 0.00 39.78 40.24 2bt4 n ASN 1616CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2bt4 h LEU 1617N 0.00 0.00 -2.15 3.41 3.38 -1.91 -0.51 115.31 117.53 2bt4 h LEU 1617Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 2bt4 h LEU 1617Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2bt4 h LEU 1617CO 0.00 0.00 0.29 -0.55 0.09 0.00 0.00 178.44 178.27 2bt4 h ASN 1618N 0.00 0.00 -0.62 -0.43 -1.07 -1.88 -2.07 115.58 109.51 2bt4 h ASN 1618Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 2bt4 h ASN 1618Cb 0.32 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.57 2bt4 h ASN 1618CO 0.00 0.00 0.00 0.18 0.07 0.00 0.00 177.43 177.68 2bt4 n LEU 1619N -3.44 3.61 -4.65 6.14 4.77 -0.20 -4.74 117.00 118.49 2bt4 n LEU 1619Ca 0.02 -1.75 -0.45 0.00 -0.03 0.00 0.00 56.01 53.79 2bt4 n LEU 1619Cb 0.41 -0.41 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2bt4 n LEU 1619CO 0.23 0.88 0.95 -0.11 -1.33 0.00 0.00 177.39 178.00 2bt4 n LEU 1620N 1.49 2.80 0.00 2.23 7.94 -0.78 -1.88 117.00 128.80 2bt4 n LEU 1620Ca 0.22 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.27 2bt4 n LEU 1620Cb 0.58 -1.39 0.00 0.00 0.53 0.00 0.00 43.42 43.15 2bt4 n LEU 1620CO 0.16 -0.66 0.00 0.61 -1.11 0.00 0.00 177.39 176.39 2bt4 n GLY 1621N 2.06 3.01 0.08 -3.96 0.00 -1.18 -3.92 105.19 101.28 2bt4 n GLY 1621Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 2bt4 n GLY 1621CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2bt4 n GLN 1622N -1.94 0.32 -3.73 1.61 6.02 -0.79 -4.79 117.38 114.07 2bt4 n GLN 1622Ca 0.00 -0.17 -0.07 0.00 -0.01 0.00 0.00 57.00 56.76 2bt4 n GLN 1622Cb 0.00 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.75 2bt4 n GLN 1622CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2bt4 s ARG 1623N -2.80 1.45 -1.47 -1.09 1.70 -1.26 -5.01 118.95 110.47 2bt4 s ARG 1623Ca 0.17 -0.75 -0.07 0.00 -0.47 0.00 0.00 55.73 54.61 2bt4 s ARG 1623Cb 0.18 0.52 0.05 0.00 -0.57 0.00 0.00 34.95 35.14 2bt4 s ARG 1623CO 0.61 -0.66 0.72 1.04 -1.08 0.00 0.00 175.30 175.93 2bt4 n GLN 1624N -0.43 -4.35 0.31 3.89 1.13 -1.26 -4.78 117.38 111.88 2bt4 n GLN 1624Ca -0.07 0.51 0.18 0.00 -1.94 0.00 0.00 57.00 55.68 2bt4 n GLN 1624Cb 0.61 -5.07 1.02 0.00 0.11 0.00 0.00 30.24 26.90 2bt4 n GLN 1624CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 2bt4 h PRO 1625N -1.87 0.00 0.00 -1.09 0.13 -1.92 0.36 132.00 127.62 2bt4 h PRO 1625Ca -0.60 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.48 2bt4 h PRO 1625Cb 1.37 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.50 2bt4 h PRO 1625CO 0.65 0.01 -0.22 0.93 -0.23 0.00 0.00 178.00 179.13 2bt4 h GLU 1626N 0.00 0.00 0.00 0.86 3.07 -1.89 -0.34 114.58 116.29 2bt4 h GLU 1626Ca -0.00 0.00 -0.40 0.00 -0.50 0.00 0.00 59.36 58.46 2bt4 h GLU 1626Cb 0.02 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 27.86 2bt4 h GLU 1626CO 0.00 0.22 -2.47 -0.89 -1.40 0.00 0.00 179.01 174.47 2bt4 n ILE 1627N -4.02 1.48 0.17 3.13 5.41 -0.53 -4.76 119.36 120.24 2bt4 n ILE 1627Ca -0.02 -0.53 0.02 0.00 1.00 0.00 0.00 62.75 63.22 2bt4 n ILE 1627Cb 0.30 -1.49 0.00 0.00 -0.71 0.00 0.00 39.64 37.74 2bt4 n ILE 1627CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2bt4 n TYR 1628N -3.42 0.00 0.00 1.39 4.02 0.00 -4.49 117.16 114.67 2bt4 n TYR 1628Ca -0.47 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.42 2bt4 n TYR 1628Cb 0.97 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.29 2bt4 n TYR 1628CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bt4 n GLY 1629N 0.57 -0.31 0.70 2.72 0.00 -0.14 -4.72 105.19 104.01 2bt4 n GLY 1629Ca 0.02 -1.78 0.08 0.00 0.00 0.00 0.00 46.02 44.34 2bt4 n GLY 1629CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bt4 n SER 1630N -0.97 2.51 -4.77 1.61 3.41 -1.26 -4.25 113.62 109.90 2bt4 n SER 1630Ca 0.00 -1.73 -0.37 0.00 -0.26 0.00 0.00 58.87 56.51 2bt4 n SER 1630Cb 0.00 -0.05 -0.02 0.00 -0.26 0.00 0.00 64.21 63.88 2bt4 n SER 1630CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2bt4 s ASP 1631N -1.32 6.38 0.66 4.04 1.01 -1.26 -4.68 116.67 121.51 2bt4 s ASP 1631Ca 0.21 2.23 -0.04 0.00 0.71 0.00 0.00 52.55 55.66 2bt4 s ASP 1631Cb 0.14 -2.60 0.06 0.00 1.01 0.00 0.00 42.92 41.54 2bt4 s ASP 1631CO 0.21 -0.76 0.94 0.42 0.21 0.00 0.00 175.17 176.19 2bt4 s THR 1632N -1.57 2.38 0.39 -1.27 -4.23 -1.26 -3.11 115.64 106.97 2bt4 s THR 1632Ca 0.61 -0.42 0.11 0.00 -1.18 0.00 0.00 61.69 60.80 2bt4 s THR 1632Cb -0.27 -2.95 0.15 0.00 1.34 0.00 0.00 72.50 70.77 2bt4 s THR 1632CO 0.33 0.00 1.91 0.25 -0.54 0.00 0.00 174.62 176.57 2bt4 h LEU 1633N -0.41 0.16 -0.88 4.79 5.85 -1.80 -0.97 115.31 122.05 2bt4 h LEU 1633Ca -0.43 -0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.19 2bt4 h LEU 1633Cb 1.30 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.27 2bt4 h LEU 1633CO 0.55 0.36 0.07 0.00 -0.34 0.00 0.00 178.44 179.07 2bt4 h ALA 1634N 1.66 1.08 -0.62 1.25 0.00 -1.93 0.51 119.26 121.21 2bt4 h ALA 1634Ca 0.03 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 2bt4 h ALA 1634Cb 0.42 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2bt4 h ALA 1634CO 0.03 0.59 0.02 -0.44 0.00 0.00 0.00 179.25 179.45 2bt4 h ASP 1635N 0.84 1.06 -0.57 0.00 3.32 -1.59 -1.34 116.42 118.14 2bt4 h ASP 1635Ca 0.17 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 2bt4 h ASP 1635Cb 0.41 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 2bt4 h ASP 1635CO 0.01 1.09 0.27 0.58 -1.72 0.00 0.00 179.24 179.48 2bt4 h VAL 1636N 1.00 1.21 -0.87 -1.35 2.07 -0.78 -1.01 116.25 116.51 2bt4 h VAL 1636Ca 0.18 -0.59 0.01 0.00 0.82 0.00 0.00 66.70 67.12 2bt4 h VAL 1636Cb 0.54 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2bt4 h VAL 1636CO 0.03 0.24 0.58 -0.08 0.02 0.00 0.00 177.57 178.35 2bt4 h GLU 1637N 0.78 1.15 -0.53 1.57 4.81 -0.31 -1.10 114.58 120.94 2bt4 h GLU 1637Ca 0.20 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.27 2bt4 h GLU 1637Cb 0.12 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 2bt4 h GLU 1637CO -0.02 0.76 -0.02 0.00 -0.73 0.00 0.00 179.01 178.99 2bt4 h ALA 1638N 1.32 0.95 -0.87 2.92 0.00 -0.90 -1.07 119.26 121.61 2bt4 h ALA 1638Ca 0.32 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2bt4 h ALA 1638Cb -0.14 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.40 2bt4 h ALA 1638CO -0.07 0.63 0.57 -0.07 0.00 0.00 0.00 179.25 180.31 2bt4 h LEU 1639N 0.85 0.97 -0.57 0.00 3.38 -0.74 -2.51 115.31 116.70 2bt4 h LEU 1639Ca 0.15 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.97 2bt4 h LEU 1639Cb 0.54 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2bt4 h LEU 1639CO 0.03 0.69 -0.35 0.00 0.09 0.00 0.00 178.44 178.90 2bt4 h VAL 1641N 0.64 1.20 -0.06 0.00 2.07 -1.02 0.39 116.25 119.46 2bt4 h VAL 1641Ca 0.06 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 2bt4 h VAL 1641Cb 0.89 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 2bt4 h VAL 1641CO 0.08 0.21 -0.13 0.50 0.02 0.00 0.00 177.57 178.24 2bt4 h LYS 1642N 1.13 0.20 -0.53 1.57 3.64 -1.21 -0.97 116.57 120.40 2bt4 h LYS 1642Ca 0.32 -0.13 0.02 0.00 -1.27 0.00 0.00 60.65 59.58 2bt4 h LYS 1642Cb -0.10 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.70 2bt4 h LYS 1642CO -0.08 0.72 0.33 0.00 -2.27 0.00 0.00 179.45 178.15 2bt4 h ALA 1643N 0.48 0.68 -0.65 5.00 0.00 -0.69 0.36 119.26 124.44 2bt4 h ALA 1643Ca 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2bt4 h ALA 1643Cb 0.71 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2bt4 h ALA 1643CO 0.03 0.06 0.06 0.00 0.00 0.00 0.00 179.25 179.40 2bt4 h ALA 1644N 1.22 0.88 0.00 0.00 0.00 -0.88 -2.81 119.26 117.68 2bt4 h ALA 1644Ca 0.21 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 2bt4 h ALA 1644Cb -0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2bt4 h ALA 1644CO -0.07 0.67 -0.22 0.00 0.00 0.00 0.00 179.25 179.63 2bt4 h ALA 1645N 1.04 1.53 0.00 0.00 0.00 -0.57 0.15 119.26 121.40 2bt4 h ALA 1645Ca 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bt4 h ALA 1645Cb 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2bt4 h ALA 1645CO 0.02 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.54 2bt4 n ALA 1646N -2.45 1.55 -1.14 0.00 0.00 0.06 -2.15 120.51 116.39 2bt4 n ALA 1646Ca -0.02 0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.50 2bt4 n ALA 1646Cb 0.28 -1.27 0.09 0.00 0.00 0.00 0.00 19.45 18.56 2bt4 n ALA 1646CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2bt4 n HIS 1647N -1.80 0.00 -1.38 0.00 8.25 -0.08 -5.00 115.22 115.21 2bt4 n HIS 1647Ca 0.02 -0.70 0.00 0.00 -0.26 0.00 0.00 57.72 56.79 2bt4 n HIS 1647Cb 0.16 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.16 2bt4 n HIS 1647CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bt4 n GLY 1648N -0.98 0.44 3.56 -1.41 0.00 -0.85 -4.99 105.19 100.96 2bt4 n GLY 1648Ca 0.10 -0.94 -0.27 0.00 0.00 0.00 0.00 46.02 44.90 2bt4 n GLY 1648CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bt4 s GLY 1649N -2.94 2.77 0.19 -0.02 0.00 0.33 -4.19 107.32 103.44 2bt4 s GLY 1649Ca 0.00 -0.99 0.01 0.00 0.00 0.00 0.00 44.72 43.74 2bt4 s GLY 1649CO 0.00 -1.89 0.03 -0.51 0.00 0.00 0.00 173.10 170.74 2bt4 s THR 1650N -3.13 0.54 0.18 0.90 -4.23 -1.26 -2.99 115.64 105.65 2bt4 s THR 1650Ca 0.19 -1.98 0.08 0.00 -1.18 0.00 0.00 61.69 58.80 2bt4 s THR 1650Cb 0.01 -2.23 -0.04 0.00 1.34 0.00 0.00 72.50 71.58 2bt4 s THR 1650CO 0.13 -0.35 -0.15 0.68 -0.54 0.00 0.00 174.62 174.38 2bt4 s VAL 1651N -3.75 1.71 -0.29 2.29 -7.23 -1.26 -0.41 120.40 111.46 2bt4 s VAL 1651Ca 0.27 -2.07 0.01 0.00 -1.81 0.00 0.00 61.98 58.38 2bt4 s VAL 1651Cb 0.07 -1.93 0.09 0.00 0.56 0.00 0.00 36.38 35.17 2bt4 s VAL 1651CO 0.06 -0.50 0.03 -0.62 -0.31 0.00 0.00 175.10 173.76 2bt4 s ASP 1652N -3.03 4.14 -0.20 4.85 -1.08 0.06 -4.83 116.67 116.58 2bt4 s ASP 1652Ca 0.19 -1.61 -0.06 0.00 -0.52 0.00 0.00 52.55 50.56 2bt4 s ASP 1652Cb -0.03 -1.17 -0.03 0.00 -1.46 0.00 0.00 42.92 40.23 2bt4 s ASP 1652CO 0.06 -0.34 0.02 0.12 0.52 0.00 0.00 175.17 175.55 2bt4 s PHE 1653N 1.35 3.09 0.04 -5.34 5.36 -1.26 -0.93 117.98 120.29 2bt4 s PHE 1653Ca 0.05 -0.29 0.00 0.00 -0.96 0.00 0.00 56.93 55.72 2bt4 s PHE 1653Cb -0.18 -2.08 -0.03 0.00 -0.34 0.00 0.00 43.02 40.39 2bt4 s PHE 1653CO -0.13 -0.13 -0.04 1.03 -1.46 0.00 0.00 175.22 174.49 2bt4 s ARG 1654N 0.83 0.50 0.01 10.12 0.52 -0.18 -4.98 118.95 125.76 2bt4 s ARG 1654Ca 0.01 -0.91 0.00 0.00 -0.52 0.00 0.00 55.73 54.32 2bt4 s ARG 1654Cb -0.14 0.05 -0.01 0.00 0.52 0.00 0.00 34.95 35.37 2bt4 s ARG 1654CO 0.02 -0.05 -0.02 -1.14 0.02 0.00 0.00 175.30 174.13 2bt4 s GLN 1655N -2.55 0.18 -0.05 3.54 -0.44 -1.26 -1.50 119.66 117.58 2bt4 s GLN 1655Ca -0.04 -0.20 -0.18 0.00 -2.50 0.00 0.00 55.36 52.44 2bt4 s GLN 1655Cb -0.02 -0.09 0.04 0.00 -1.64 0.00 0.00 33.01 31.30 2bt4 s GLN 1655CO -0.04 0.02 0.40 0.45 0.50 0.00 0.00 175.29 176.61 2bt4 s SER 1656N -0.40 -0.33 0.00 6.67 0.15 -0.68 -4.97 113.70 114.14 2bt4 s SER 1656Ca -0.03 0.36 0.29 0.00 0.70 0.00 0.00 55.95 57.27 2bt4 s SER 1656Cb -0.03 0.47 1.29 0.00 -1.71 0.00 0.00 66.02 66.04 2bt4 s SER 1656CO -0.00 -0.41 1.88 0.59 1.20 0.00 0.00 173.24 176.50 2bt4 n ASN 1657N 1.54 0.82 -4.38 5.45 3.02 -1.26 -2.72 115.26 117.74 2bt4 n ASN 1657Ca -0.19 -1.09 -0.36 0.00 -0.03 0.00 0.00 54.58 52.91 2bt4 n ASN 1657Cb 0.56 -0.01 -0.13 0.00 -0.61 0.00 0.00 39.78 39.60 2bt4 n ASN 1657CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2bt4 s HIS 1658N -2.16 3.05 0.15 3.10 3.76 -1.26 -4.71 115.29 117.22 2bt4 s HIS 1658Ca 0.37 -0.72 -0.21 0.00 -0.15 0.00 0.00 55.06 54.36 2bt4 s HIS 1658Cb 0.21 -2.19 0.04 0.00 1.11 0.00 0.00 32.58 31.75 2bt4 s HIS 1658CO 0.39 -0.47 1.64 1.49 -0.85 0.00 0.00 174.74 176.95 2bt4 h GLU 1659N 8.19 -0.17 0.00 1.40 4.81 -2.00 -1.78 114.58 125.03 2bt4 h GLU 1659Ca -0.38 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.82 2bt4 h GLU 1659Cb 1.16 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 2bt4 h GLU 1659CO 0.59 -0.11 -0.19 0.78 -0.73 0.00 0.00 179.01 179.34 2bt4 h GLY 1660N -0.18 0.00 1.22 1.92 0.00 -2.00 -1.73 103.07 102.30 2bt4 h GLY 1660Ca 0.15 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.32 2bt4 h GLY 1660CO -0.39 0.00 -0.43 -2.09 0.00 0.00 0.00 176.54 173.64 2bt4 h GLU 1661N 0.00 0.85 -0.48 4.80 4.81 -1.76 -1.48 114.58 121.31 2bt4 h GLU 1661Ca -0.00 -0.47 -0.02 0.00 -0.13 0.00 0.00 59.36 58.74 2bt4 h GLU 1661Cb 0.36 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 2bt4 h GLU 1661CO 0.03 1.11 0.20 -0.07 -0.73 0.00 0.00 179.01 179.54 2bt4 h LEU 1662N 0.68 0.62 -0.39 1.64 3.38 -0.86 -0.13 115.31 120.26 2bt4 h LEU 1662Ca 0.05 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 2bt4 h LEU 1662Cb 1.01 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 2bt4 h LEU 1662CO 0.10 0.56 -0.02 0.58 0.09 0.00 0.00 178.44 179.75 2bt4 h VAL 1663N 0.68 1.26 -0.40 1.22 2.07 -1.06 -0.75 116.25 119.28 2bt4 h VAL 1663Ca 0.17 -1.05 0.05 0.00 0.82 0.00 0.00 66.70 66.69 2bt4 h VAL 1663Cb 0.13 1.16 -0.05 0.00 -1.52 0.00 0.00 31.29 31.01 2bt4 h VAL 1663CO -0.02 0.35 0.13 0.44 0.02 0.00 0.00 177.57 178.49 2bt4 h ASP 1664N 0.53 0.12 0.06 0.57 3.32 -0.87 -0.92 116.42 119.24 2bt4 h ASP 1664Ca 0.11 0.05 -0.09 0.00 0.02 0.00 0.00 57.03 57.12 2bt4 h ASP 1664Cb 0.51 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 2bt4 h ASP 1664CO 0.02 0.10 -0.26 -0.50 -1.72 0.00 0.00 179.24 176.88 2bt4 h TRP 1665N 0.28 0.37 -0.68 4.55 6.55 -0.75 -1.71 115.95 124.55 2bt4 h TRP 1665Ca 0.19 -0.07 -0.07 0.00 0.95 0.00 0.00 58.89 59.89 2bt4 h TRP 1665Cb 0.18 -0.09 -0.03 0.00 -0.86 0.00 0.00 29.16 28.36 2bt4 h TRP 1665CO -0.16 0.57 0.17 0.82 -1.05 0.00 0.00 178.44 178.79 2bt4 h ILE 1666N 0.30 1.26 -0.63 1.49 2.04 -0.26 -0.75 117.51 120.95 2bt4 h ILE 1666Ca 0.04 -0.96 -0.02 0.00 1.00 0.00 0.00 64.86 64.92 2bt4 h ILE 1666Cb 0.63 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 2bt4 h ILE 1666CO 0.05 0.37 0.30 0.45 0.00 0.00 0.00 178.15 179.31 2bt4 h HIS 1667N 1.03 0.89 -0.46 1.37 3.86 -0.79 -0.91 115.15 120.14 2bt4 h HIS 1667Ca 0.22 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.37 2bt4 h HIS 1667Cb 0.37 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.54 2bt4 h HIS 1667CO 0.03 0.66 0.20 1.49 0.86 0.00 0.00 177.93 181.17 2bt4 h GLU 1668N 0.90 0.68 -0.58 2.45 4.81 -1.04 -3.09 114.58 118.71 2bt4 h GLU 1668Ca 0.22 -0.11 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 2bt4 h GLU 1668Cb 0.10 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 2bt4 h GLU 1668CO -0.03 0.60 0.16 0.00 -0.73 0.00 0.00 179.01 179.01 2bt4 h ALA 1669N 1.05 1.19 -0.82 2.92 0.00 -0.60 -1.45 119.26 121.55 2bt4 h ALA 1669Ca 0.16 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 55.03 2bt4 h ALA 1669Cb 0.16 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 2bt4 h ALA 1669CO -0.02 0.56 0.54 -0.09 0.00 0.00 0.00 179.25 180.25 2bt4 h ARG 1670N 0.86 0.45 0.00 0.00 2.43 -1.09 -1.48 114.38 115.55 2bt4 h ARG 1670Ca 0.19 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2bt4 h ARG 1670Cb 0.28 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2bt4 h ARG 1670CO -0.00 0.30 -1.86 1.28 -1.51 0.00 0.00 179.97 178.17 2bt4 n LEU 1671N -4.50 0.05 0.00 3.80 4.77 -0.70 -4.74 117.00 115.68 2bt4 n LEU 1671Ca 0.16 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2bt4 n LEU 1671Cb 0.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 2bt4 n LEU 1671CO 0.32 0.01 0.04 0.59 -1.33 0.00 0.00 177.39 177.02 2bt4 n ASN 1672N -2.16 0.16 -4.40 -1.43 3.02 -0.63 -5.08 115.26 104.74 2bt4 n ASN 1672Ca -0.03 -0.50 -0.21 0.00 -0.03 0.00 0.00 54.58 53.81 2bt4 n ASN 1672Cb 0.51 0.53 -0.10 0.00 -0.61 0.00 0.00 39.78 40.11 2bt4 n ASN 1672CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2bt4 s HIS 1673N -0.53 1.92 -1.18 3.10 3.76 -0.59 -4.47 115.29 117.29 2bt4 s HIS 1673Ca 0.00 -0.58 0.25 0.00 -0.15 0.00 0.00 55.06 54.58 2bt4 s HIS 1673Cb 0.00 -0.97 0.50 0.00 1.11 0.00 0.00 32.58 33.23 2bt4 s HIS 1673CO 0.00 0.39 1.41 0.00 -0.85 0.00 0.00 174.74 175.69 2bt4 n GLY 1675N 1.46 -0.45 2.93 0.00 0.00 -1.26 -4.34 105.19 103.53 2bt4 n GLY 1675Ca 0.07 -0.98 -0.22 0.00 0.00 0.00 0.00 46.02 44.89 2bt4 n GLY 1675CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bt4 s ILE 1676N -2.00 0.75 -0.24 -0.61 1.01 -0.45 -1.63 121.20 118.02 2bt4 s ILE 1676Ca 0.00 -0.23 -0.07 0.00 0.00 0.00 0.00 60.65 60.35 2bt4 s ILE 1676Cb 0.00 -0.74 -0.03 0.00 0.01 0.00 0.00 42.46 41.70 2bt4 s ILE 1676CO 0.00 0.28 0.06 -0.69 0.00 0.00 0.00 174.94 174.59 2bt4 s VAL 1677N 0.96 4.25 -0.12 2.92 1.01 -0.12 -1.14 120.40 128.15 2bt4 s VAL 1677Ca -0.10 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.69 2bt4 s VAL 1677Cb -0.15 -2.98 0.02 0.00 0.00 0.00 0.00 36.38 33.28 2bt4 s VAL 1677CO 0.00 0.35 -0.13 -0.51 0.00 0.00 0.00 175.10 174.82 2bt4 s ILE 1678N 1.52 1.37 -0.67 2.22 2.07 -0.18 -0.43 121.20 127.12 2bt4 s ILE 1678Ca 0.06 -0.54 -0.12 0.00 -1.41 0.00 0.00 60.65 58.64 2bt4 s ILE 1678Cb -0.15 -1.29 0.17 0.00 0.13 0.00 0.00 42.46 41.32 2bt4 s ILE 1678CO 0.03 0.42 0.59 0.21 -1.91 0.00 0.00 174.94 174.28 2bt4 s ASN 1679N 1.29 6.26 0.00 4.50 3.84 0.19 -1.01 114.94 130.01 2bt4 s ASN 1679Ca -0.01 -2.33 0.20 0.00 0.21 0.00 0.00 52.86 50.93 2bt4 s ASN 1679Cb -0.14 -2.14 0.90 0.00 -0.55 0.00 0.00 41.25 39.33 2bt4 s ASN 1679CO -0.06 -0.65 1.64 -2.65 -2.79 0.00 0.00 177.10 172.60 2bt4 n PRO 1680N 4.42 0.07 0.00 0.43 -0.02 -1.26 -0.44 135.00 138.21 2bt4 n PRO 1680Ca 0.02 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 2bt4 n PRO 1680Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 2bt4 n PRO 1680CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bt4 n ALA 1681N -1.45 0.00 0.24 3.55 0.00 -1.26 -1.88 120.51 119.71 2bt4 n ALA 1681Ca 0.06 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.64 2bt4 n ALA 1681Cb 0.22 0.00 0.80 0.00 0.00 0.00 0.00 19.45 20.47 2bt4 n ALA 1681CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bt4 h ALA 1682N -0.59 1.81 0.00 0.00 0.00 -1.93 0.17 119.26 118.72 2bt4 h ALA 1682Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bt4 h ALA 1682Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2bt4 h ALA 1682CO 0.00 -0.13 0.00 1.88 0.00 0.00 0.00 179.25 181.00 2bt4 h TYR 1683N 0.00 0.00 -0.91 0.00 0.99 -1.77 -1.79 116.97 113.50 2bt4 h TYR 1683Ca 0.04 0.00 0.11 0.00 2.00 0.00 0.00 58.73 60.88 2bt4 h TYR 1683Cb 0.21 0.00 -0.07 0.00 1.00 0.00 0.00 36.73 37.88 2bt4 h TYR 1683CO 0.00 0.00 0.58 0.77 -0.00 0.00 0.00 178.16 179.51 2bt4 h SER 1684N 0.00 0.79 1.05 3.88 0.02 -0.68 0.13 113.55 118.73 2bt4 h SER 1684Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2bt4 h SER 1684Cb 0.31 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.72 2bt4 h SER 1684CO 0.00 0.44 -0.78 0.45 -1.14 0.00 0.00 176.83 175.80 2bt4 h HIS 1685N 0.86 0.00 0.00 3.45 3.86 -1.50 0.81 115.15 122.63 2bt4 h HIS 1685Ca 0.43 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.64 2bt4 h HIS 1685Cb 0.49 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.96 2bt4 h HIS 1685CO -0.00 0.00 -0.85 0.25 0.86 0.00 0.00 177.93 178.19 2bt4 n THR 1686N -2.53 0.00 -3.31 2.45 -2.24 -0.95 -4.71 114.28 103.00 2bt4 n THR 1686Ca 0.01 -0.12 -0.46 0.00 -2.27 0.00 0.00 64.05 61.21 2bt4 n THR 1686Cb 0.51 0.58 -0.03 0.00 -2.10 0.00 0.00 70.33 69.29 2bt4 n THR 1686CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2bt4 s SER 1687N -1.92 6.48 0.38 3.42 0.15 -0.01 -4.83 113.70 117.37 2bt4 s SER 1687Ca -0.00 -2.23 0.09 0.00 0.70 0.00 0.00 55.95 54.51 2bt4 s SER 1687Cb 0.01 -2.22 0.77 0.00 -1.71 0.00 0.00 66.02 62.87 2bt4 s SER 1687CO 0.05 -0.73 1.92 0.58 1.20 0.00 0.00 173.24 176.26 2bt4 h VAL 1688N 5.34 1.17 -0.62 4.45 2.07 -1.94 -2.70 116.25 124.02 2bt4 h VAL 1688Ca -0.09 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.65 2bt4 h VAL 1688Cb 1.07 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.97 2bt4 h VAL 1688CO 0.90 0.24 0.31 0.00 0.02 0.00 0.00 177.57 179.04 2bt4 h ALA 1689N 1.64 0.80 -0.48 1.67 0.00 -1.97 0.21 119.26 121.12 2bt4 h ALA 1689Ca 0.05 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 2bt4 h ALA 1689Cb 0.35 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2bt4 h ALA 1689CO 0.02 0.34 -0.16 0.82 0.00 0.00 0.00 179.25 180.27 2bt4 h ILE 1690N 0.85 1.27 0.03 0.00 2.04 -1.88 -1.16 117.51 118.66 2bt4 h ILE 1690Ca 0.21 -1.31 0.03 0.00 1.00 0.00 0.00 64.86 64.79 2bt4 h ILE 1690Cb 0.09 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 2bt4 h ILE 1690CO -0.03 0.45 -0.25 0.25 0.00 0.00 0.00 178.15 178.57 2bt4 h LEU 1691N 0.81 -0.74 -1.61 1.44 5.85 -1.15 -0.65 115.31 119.25 2bt4 h LEU 1691Ca 0.12 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.98 2bt4 h LEU 1691Cb 0.73 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 2bt4 h LEU 1691CO 0.06 -0.33 0.33 0.44 -0.34 0.00 0.00 178.44 178.60 2bt4 h ASP 1692N -0.41 0.43 -0.23 1.25 3.32 -0.37 -0.22 116.42 120.19 2bt4 h ASP 1692Ca 0.05 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 2bt4 h ASP 1692Cb 0.48 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 2bt4 h ASP 1692CO -0.21 0.29 0.02 0.00 -1.72 0.00 0.00 179.24 177.62 2bt4 h ALA 1693N 1.72 0.31 -0.47 3.45 0.00 -0.63 -2.78 119.26 120.86 2bt4 h ALA 1693Ca 0.21 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2bt4 h ALA 1693Cb 0.21 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2bt4 h ALA 1693CO -0.06 0.02 0.15 -0.07 0.00 0.00 0.00 179.25 179.30 2bt4 h LEU 1694N 0.19 0.64 -2.53 0.00 3.38 -0.40 -2.22 115.31 114.37 2bt4 h LEU 1694Ca 0.07 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.96 2bt4 h LEU 1694Cb 0.38 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2bt4 h LEU 1694CO 0.01 0.61 0.03 0.78 0.09 0.00 0.00 178.44 179.95 2bt4 h ASN 1695N 0.68 0.00 1.19 -0.43 2.35 -0.79 -0.11 115.58 118.48 2bt4 h ASN 1695Ca 0.16 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2bt4 h ASN 1695Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2bt4 h ASN 1695CO -0.01 0.00 0.00 0.35 -1.65 0.00 0.00 177.43 176.12 2bt4 n THR 1696N -3.70 0.68 -1.90 2.81 -2.24 -0.83 -4.30 114.28 104.80 2bt4 n THR 1696Ca -0.02 -0.09 -0.40 0.00 -2.27 0.00 0.00 64.05 61.26 2bt4 n THR 1696Cb 0.11 -0.80 -0.01 0.00 -2.10 0.00 0.00 70.33 67.53 2bt4 n THR 1696CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bt4 n ASP 1698N 2.65 3.33 0.00 0.00 8.00 -1.26 -1.46 116.55 127.81 2bt4 n ASP 1698Ca 0.61 1.02 0.00 0.00 0.71 0.00 0.00 54.79 57.13 2bt4 n ASP 1698Cb 0.27 -1.40 0.00 0.00 -0.02 0.00 0.00 41.12 39.97 2bt4 n ASP 1698CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bt4 n GLY 1699N 3.97 2.18 3.73 0.44 0.00 -1.26 -5.00 105.19 109.25 2bt4 n GLY 1699Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 2bt4 n GLY 1699CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bt4 s LEU 1700N 0.00 4.39 0.17 0.99 2.96 -0.53 -5.03 118.68 121.63 2bt4 s LEU 1700Ca 0.00 1.39 -0.30 0.00 -0.22 0.00 0.00 54.13 54.99 2bt4 s LEU 1700Cb 0.00 -3.23 -0.08 0.00 0.50 0.00 0.00 46.19 43.38 2bt4 s LEU 1700CO 0.00 -0.07 1.26 -2.84 -1.32 0.00 0.00 176.35 173.38 2bt4 s PRO 1701N 0.40 4.42 -0.06 0.98 0.02 -1.26 -4.94 135.00 134.56 2bt4 s PRO 1701Ca 0.40 1.96 0.01 0.00 0.02 0.00 0.00 61.00 63.39 2bt4 s PRO 1701Cb -0.20 -3.23 0.02 0.00 0.02 0.00 0.00 34.50 31.11 2bt4 s PRO 1701CO 0.22 -0.21 -0.08 0.08 -0.33 0.00 0.00 177.00 176.68 2bt4 s VAL 1702N 0.26 0.85 -0.11 3.83 1.01 -1.26 -1.35 120.40 123.63 2bt4 s VAL 1702Ca 0.56 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 62.26 2bt4 s VAL 1702Cb -0.34 -0.82 0.01 0.00 0.00 0.00 0.00 36.38 35.23 2bt4 s VAL 1702CO 0.36 0.30 -0.16 -0.69 0.00 0.00 0.00 175.10 174.90 2bt4 s VAL 1703N 0.86 1.57 -0.07 2.92 1.01 -0.30 -0.57 120.40 125.83 2bt4 s VAL 1703Ca -0.11 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.03 2bt4 s VAL 1703Cb -0.15 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 2bt4 s VAL 1703CO 0.01 0.45 0.38 -0.70 0.00 0.00 0.00 175.10 175.25 2bt4 s GLU 1704N 0.94 4.05 -0.07 2.72 2.12 0.28 -1.01 118.70 127.74 2bt4 s GLU 1704Ca -0.07 0.32 0.03 0.00 0.36 0.00 0.00 54.97 55.61 2bt4 s GLU 1704Cb -0.15 -3.31 0.01 0.00 0.26 0.00 0.00 34.13 30.94 2bt4 s GLU 1704CO -0.01 0.48 -0.15 0.08 -0.54 0.00 0.00 175.26 175.12 2bt4 s VAL 1705N -0.38 1.34 -0.14 3.70 1.01 -0.18 -0.63 120.40 125.12 2bt4 s VAL 1705Ca 0.22 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.61 2bt4 s VAL 1705Cb -0.15 -1.20 0.01 0.00 0.00 0.00 0.00 36.38 35.04 2bt4 s VAL 1705CO 0.10 0.40 -0.20 -1.00 0.00 0.00 0.00 175.10 174.40 2bt4 s HIS 1706N 0.52 2.53 0.16 5.22 3.76 -0.14 -4.05 115.29 123.29 2bt4 s HIS 1706Ca -0.14 -1.29 -0.14 0.00 -0.15 0.00 0.00 55.06 53.34 2bt4 s HIS 1706Cb -0.16 -1.74 0.05 0.00 1.11 0.00 0.00 32.58 31.84 2bt4 s HIS 1706CO 0.05 -0.61 1.75 0.82 -0.85 0.00 0.00 174.74 175.89 2bt4 h ILE 1707N 5.87 1.19 -3.56 0.60 2.04 -1.86 -1.86 117.51 119.93 2bt4 h ILE 1707Ca -0.34 -0.54 -0.49 0.00 1.00 0.00 0.00 64.86 64.50 2bt4 h ILE 1707Cb 1.18 0.59 0.03 0.00 -0.74 0.00 0.00 36.82 37.88 2bt4 h ILE 1707CO 0.55 0.21 0.10 -0.94 0.00 0.00 0.00 178.15 178.07 2bt4 s SER 1708N -5.89 6.28 -0.69 1.72 1.04 -1.26 -2.07 113.70 112.82 2bt4 s SER 1708Ca -0.13 0.93 -0.22 0.00 0.48 0.00 0.00 55.95 57.01 2bt4 s SER 1708Cb 0.12 -2.25 0.08 0.00 0.10 0.00 0.00 66.02 64.07 2bt4 s SER 1708CO 0.77 -0.56 0.98 0.21 0.98 0.00 0.00 173.24 175.62 2bt4 s ASN 1709N -4.04 6.23 0.40 7.02 3.84 -1.26 -2.20 114.94 124.94 2bt4 s ASN 1709Ca 0.47 -1.14 0.28 0.00 0.21 0.00 0.00 52.86 52.69 2bt4 s ASN 1709Cb -0.10 -2.41 1.39 0.00 -0.55 0.00 0.00 41.25 39.58 2bt4 s ASN 1709CO 0.44 -1.39 1.86 0.16 -2.79 0.00 0.00 177.10 175.38 2bt4 h ILE 1710N 5.97 0.00 0.00 -5.21 3.07 -1.91 -1.75 117.51 117.67 2bt4 h ILE 1710Ca -0.23 -0.14 0.00 0.00 1.55 0.00 0.00 64.86 66.04 2bt4 h ILE 1710Cb 1.06 0.87 0.00 0.00 -0.27 0.00 0.00 36.82 38.48 2bt4 h ILE 1710CO 1.17 0.00 0.00 1.41 -1.05 0.00 0.00 178.15 179.68 2bt4 n HIS 1711N -2.53 0.00 0.51 0.16 8.25 -1.26 -2.32 115.22 118.03 2bt4 n HIS 1711Ca -0.00 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.55 2bt4 n HIS 1711Cb 0.14 -0.44 0.13 0.00 1.12 0.00 0.00 29.99 30.93 2bt4 n HIS 1711CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2bt4 n GLN 1712N -1.44 2.01 -0.14 -0.41 6.02 -0.66 -4.99 117.38 117.76 2bt4 n GLN 1712Ca 0.06 -1.89 0.00 0.00 -0.01 0.00 0.00 57.00 55.17 2bt4 n GLN 1712Cb 0.22 -1.40 0.00 0.00 1.02 0.00 0.00 30.24 30.08 2bt4 n GLN 1712CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2bt4 n ARG 1713N 1.15 3.23 -1.71 -1.09 1.74 -0.98 -5.06 116.66 113.94 2bt4 n ARG 1713Ca 0.14 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.81 2bt4 n ARG 1713Cb 0.51 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.96 2bt4 n ARG 1713CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2bt4 n GLU 1714N -0.06 2.03 -0.34 5.56 4.71 -1.26 -4.89 120.64 126.39 2bt4 n GLU 1714Ca 0.00 0.72 0.20 0.00 -0.01 0.00 0.00 57.16 58.07 2bt4 n GLU 1714Cb 0.00 -2.41 0.43 0.00 -1.01 0.00 0.00 31.44 28.45 2bt4 n GLU 1714CO 0.00 0.00 0.00 -1.35 0.09 0.00 0.00 177.13 175.87 2bt4 h PRO 1715N 2.23 0.48 0.00 3.49 0.11 -1.97 0.36 132.00 136.70 2bt4 h PRO 1715Ca -0.48 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 2bt4 h PRO 1715Cb 1.29 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2bt4 h PRO 1715CO 0.61 0.32 -0.22 0.27 -0.21 0.00 0.00 178.00 178.76 2bt4 h PHE 1716N 0.49 0.00 0.00 0.65 -5.15 -1.97 -1.89 116.94 109.08 2bt4 h PHE 1716Ca 0.66 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.43 2bt4 h PHE 1716Cb 1.39 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.56 2bt4 h PHE 1716CO -0.01 0.22 0.00 0.54 -2.00 0.00 0.00 178.31 177.07 2bt4 n ARG 1717N -3.65 0.28 0.17 6.09 1.74 0.12 -3.35 116.66 118.05 2bt4 n ARG 1717Ca -0.01 0.07 0.04 0.00 -0.77 0.00 0.00 57.85 57.18 2bt4 n ARG 1717Cb 0.35 -1.50 0.22 0.00 -1.02 0.00 0.00 32.46 30.51 2bt4 n ARG 1717CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2bt4 h HIS 1718N 0.00 0.00 -3.15 -1.55 3.86 -1.37 -3.44 115.15 109.50 2bt4 h HIS 1718Ca 0.00 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.55 2bt4 h HIS 1718Cb 0.25 0.00 -0.11 0.00 1.06 0.00 0.00 27.41 28.61 2bt4 h HIS 1718CO 0.00 0.44 -0.59 -1.01 0.86 0.00 0.00 177.93 177.64 2bt4 s HIS 1719N -3.36 3.25 -0.07 2.45 3.76 -1.21 -4.86 115.29 115.24 2bt4 s HIS 1719Ca 0.01 0.20 -0.01 0.00 -0.15 0.00 0.00 55.06 55.11 2bt4 s HIS 1719Cb 0.10 -1.74 0.03 0.00 1.11 0.00 0.00 32.58 32.07 2bt4 s HIS 1719CO 0.71 0.54 -0.00 0.45 -0.85 0.00 0.00 174.74 175.58 2bt4 s SER 1720N -1.58 1.55 0.34 1.40 0.15 -1.26 -4.26 113.70 110.03 2bt4 s SER 1720Ca 0.21 -0.09 0.01 0.00 0.70 0.00 0.00 55.95 56.78 2bt4 s SER 1720Cb -0.12 -0.45 0.59 0.00 -1.71 0.00 0.00 66.02 64.33 2bt4 s SER 1720CO 0.12 -0.18 1.99 1.88 1.20 0.00 0.00 173.24 178.25 2bt4 h TYR 1721N 8.23 0.86 -0.03 3.44 -1.99 -1.11 -2.97 116.97 123.40 2bt4 h TYR 1721Ca -0.22 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.49 2bt4 h TYR 1721Cb 1.13 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 39.56 2bt4 h TYR 1721CO 0.48 0.53 -0.18 0.28 -0.00 0.00 0.00 178.16 179.28 2bt4 h VAL 1722N 0.92 1.14 0.00 -2.88 2.07 -1.87 -1.76 116.25 113.88 2bt4 h VAL 1722Ca 0.26 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2bt4 h VAL 1722Cb -0.06 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2bt4 h VAL 1722CO -0.06 0.19 0.00 0.28 0.02 0.00 0.00 177.57 178.00 2bt4 h SER 1723N 0.04 0.00 1.07 0.57 0.02 -1.87 -0.71 113.55 112.67 2bt4 h SER 1723Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2bt4 h SER 1723Cb 0.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.88 2bt4 h SER 1723CO 0.02 0.00 0.00 1.56 -1.14 0.00 0.00 176.83 177.27 2bt4 h GLN 1724N 0.00 0.00 0.00 3.45 4.20 -1.45 -3.33 115.11 117.98 2bt4 h GLN 1724Ca 0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 2bt4 h GLN 1724Cb 0.16 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2bt4 h GLN 1724CO 0.00 0.00 -1.13 -2.13 -0.67 0.00 0.00 178.83 174.90 2bt4 n ARG 1725N -2.31 2.35 -1.68 1.46 3.00 -0.42 -5.03 116.66 114.02 2bt4 n ARG 1725Ca 0.03 0.00 -0.44 0.00 -0.00 0.00 0.00 57.85 57.45 2bt4 n ARG 1725Cb 0.32 -1.05 -0.02 0.00 0.00 0.00 0.00 32.46 31.71 2bt4 n ARG 1725CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2bt4 n ALA 1726N -2.26 1.23 -0.02 5.13 0.00 -0.41 -4.85 120.51 119.33 2bt4 n ALA 1726Ca -0.04 0.40 -0.11 0.00 0.00 0.00 0.00 53.44 53.69 2bt4 n ALA 1726Cb 0.56 -2.28 -0.06 0.00 0.00 0.00 0.00 19.45 17.67 2bt4 n ALA 1726CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2bt4 h ASP 1727N 3.96 0.16 -4.24 0.00 3.32 -1.18 -3.44 116.42 115.00 2bt4 h ASP 1727Ca -0.45 -0.17 -0.53 0.00 0.02 0.00 0.00 57.03 55.90 2bt4 h ASP 1727Cb 1.27 -0.04 -0.22 0.00 0.22 0.00 0.00 39.33 40.57 2bt4 h ASP 1727CO 0.74 0.28 -0.82 -0.83 -1.72 0.00 0.00 179.24 176.89 2bt4 s GLY 1728N -2.65 1.16 -0.05 2.75 0.00 -1.14 -5.06 107.32 102.33 2bt4 s GLY 1728Ca -0.14 -1.20 0.01 0.00 0.00 0.00 0.00 44.72 43.39 2bt4 s GLY 1728CO 0.69 -1.21 -0.05 0.14 0.00 0.00 0.00 173.10 172.67 2bt4 s VAL 1729N -1.20 0.60 -0.11 1.40 1.01 -1.26 -0.56 120.40 120.28 2bt4 s VAL 1729Ca 0.05 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 61.90 2bt4 s VAL 1729Cb -0.10 -0.63 0.02 0.00 0.00 0.00 0.00 36.38 35.67 2bt4 s VAL 1729CO 0.04 0.25 -0.15 -0.69 0.00 0.00 0.00 175.10 174.55 2bt4 s VAL 1730N 1.04 1.49 -0.00 2.92 1.01 0.19 -4.97 120.40 122.07 2bt4 s VAL 1730Ca -0.09 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.28 2bt4 s VAL 1730Cb -0.14 -1.37 -0.00 0.00 0.00 0.00 0.00 36.38 34.87 2bt4 s VAL 1730CO -0.00 0.44 -0.05 0.00 0.00 0.00 0.00 175.10 175.48 2bt4 s ALA 1731N 1.09 0.43 -0.10 5.51 0.00 -1.26 -0.96 121.76 126.47 2bt4 s ALA 1731Ca -0.04 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.70 2bt4 s ALA 1731Cb -0.14 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.86 2bt4 s ALA 1731CO -0.03 0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.24 2bt4 n GLY 1732N 2.98 0.49 1.89 0.00 0.00 -0.70 -4.71 105.19 105.14 2bt4 n GLY 1732Ca -0.13 -0.56 0.06 0.00 0.00 0.00 0.00 46.02 45.38 2bt4 n GLY 1732CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bt4 n GLY 1734N 0.51 0.90 0.29 0.00 0.00 -0.88 -2.75 105.19 103.26 2bt4 n GLY 1734Ca 0.29 -0.82 0.18 0.00 0.00 0.00 0.00 46.02 45.68 2bt4 n GLY 1734CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2bt4 h VAL 1735N 0.00 0.07 -0.16 1.61 -1.51 -1.85 -0.76 116.25 113.65 2bt4 h VAL 1735Ca 0.00 -0.37 0.05 0.00 -1.23 0.00 0.00 66.70 65.14 2bt4 h VAL 1735Cb 0.00 1.34 -0.01 0.00 -2.13 0.00 0.00 31.29 30.50 2bt4 h VAL 1735CO 0.00 0.02 0.18 -0.61 -1.23 0.00 0.00 177.57 175.93 2bt4 h GLN 1736N 0.00 0.00 -1.00 5.19 4.15 -1.93 -1.71 115.11 119.81 2bt4 h GLN 1736Ca -0.00 0.00 0.19 0.00 0.77 0.00 0.00 58.65 59.61 2bt4 h GLN 1736Cb 0.34 0.00 -0.11 0.00 0.21 0.00 0.00 27.48 27.93 2bt4 h GLN 1736CO 0.00 0.00 0.60 0.78 -1.93 0.00 0.00 178.83 178.28 2bt4 h GLY 1737N 0.00 1.77 1.37 2.39 0.00 -0.95 0.21 103.07 107.85 2bt4 h GLY 1737Ca 0.08 -0.36 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 2bt4 h GLY 1737CO -0.00 -0.06 0.18 -0.97 0.00 0.00 0.00 176.54 175.69 2bt4 h TYR 1738N 0.76 0.82 -0.37 5.60 -1.99 -1.50 0.93 116.97 121.22 2bt4 h TYR 1738Ca 0.57 -0.06 -0.01 0.00 2.00 0.00 0.00 58.73 61.24 2bt4 h TYR 1738Cb 0.88 -0.25 -0.02 0.00 2.00 0.00 0.00 36.73 39.34 2bt4 h TYR 1738CO -0.01 0.66 0.19 0.28 -0.00 0.00 0.00 178.16 179.27 2bt4 h VAL 1739N 0.79 1.16 -0.78 -2.88 2.07 -0.77 -1.12 116.25 114.72 2bt4 h VAL 1739Ca 0.18 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 2bt4 h VAL 1739Cb 0.21 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 2bt4 h VAL 1739CO -0.01 0.16 0.29 -0.26 0.02 0.00 0.00 177.57 177.77 2bt4 h PHE 1740N 0.46 1.21 -0.52 1.57 0.05 -0.70 -0.17 116.94 118.83 2bt4 h PHE 1740Ca 0.13 -0.10 0.04 0.00 3.82 0.00 0.00 57.97 61.86 2bt4 h PHE 1740Cb 0.09 -0.36 -0.04 0.00 2.00 0.00 0.00 35.95 37.64 2bt4 h PHE 1740CO -0.02 0.92 0.28 0.78 -0.18 0.00 0.00 178.31 180.09 2bt4 h GLY 1741N 1.15 0.73 1.02 -1.45 0.00 -0.32 -0.29 103.07 103.91 2bt4 h GLY 1741Ca 0.26 -0.20 -0.06 0.00 0.00 0.00 0.00 47.33 47.33 2bt4 h GLY 1741CO -0.02 0.14 0.17 -2.08 0.00 0.00 0.00 176.54 174.75 2bt4 h VAL 1742N 0.55 1.25 -0.97 4.60 2.07 -0.82 -1.20 116.25 121.73 2bt4 h VAL 1742Ca 0.22 -0.88 0.05 0.00 0.82 0.00 0.00 66.70 66.90 2bt4 h VAL 1742Cb 0.10 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 30.47 2bt4 h VAL 1742CO -0.14 0.33 0.63 -0.33 0.02 0.00 0.00 177.57 178.08 2bt4 h GLU 1743N 0.89 1.15 -0.15 1.57 5.08 -0.71 -0.15 114.58 122.27 2bt4 h GLU 1743Ca 0.19 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2bt4 h GLU 1743Cb 0.33 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2bt4 h GLU 1743CO -0.00 0.76 -0.07 -0.09 -1.00 0.00 0.00 179.01 178.61 2bt4 h ARG 1744N 1.19 0.32 -1.00 2.33 9.65 -0.76 -1.54 114.38 124.56 2bt4 h ARG 1744Ca 0.40 -0.14 0.01 0.00 -1.10 0.00 0.00 59.98 59.16 2bt4 h ARG 1744Cb 0.06 -0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 28.58 2bt4 h ARG 1744CO -0.14 0.63 0.66 0.82 2.80 0.00 0.00 179.97 184.75 2bt4 h ILE 1745N -0.01 1.25 -0.78 1.20 1.08 -0.95 -0.31 117.51 118.98 2bt4 h ILE 1745Ca 0.03 -0.46 -0.02 0.00 -0.39 0.00 0.00 64.86 64.02 2bt4 h ILE 1745Cb 0.54 -0.22 -0.04 0.00 -3.07 0.00 0.00 36.82 34.03 2bt4 h ILE 1745CO 0.02 0.25 0.40 0.00 -0.69 0.00 0.00 178.15 178.13 2bt4 h ALA 1746N 1.37 1.23 -0.20 1.87 0.00 -0.87 0.40 119.26 123.05 2bt4 h ALA 1746Ca 0.37 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 2bt4 h ALA 1746Cb -0.14 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.33 2bt4 h ALA 1746CO -0.09 0.61 -0.41 0.00 0.00 0.00 0.00 179.25 179.36 2bt4 h ALA 1747N 1.33 0.92 0.08 0.00 0.00 -0.37 -3.20 119.26 118.02 2bt4 h ALA 1747Ca 0.27 -0.44 -0.29 0.00 0.00 0.00 0.00 54.91 54.46 2bt4 h ALA 1747Cb 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2bt4 h ALA 1747CO -0.04 0.63 -1.47 -0.07 0.00 0.00 0.00 179.25 178.30 2bt4 h LEU 1748N 0.38 0.26 -1.61 0.00 3.38 -0.29 -3.29 115.31 114.15 2bt4 h LEU 1748Ca 0.03 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2bt4 h LEU 1748Cb 0.89 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2bt4 h LEU 1748CO 0.08 1.31 0.00 0.00 0.09 0.00 0.00 178.44 179.91 2bt4 n ALA 1749N -2.60 2.84 -1.87 1.53 0.00 0.13 -5.04 120.51 115.51 2bt4 n ALA 1749Ca -0.14 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.76 2bt4 n ALA 1749Cb 1.03 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2bt4 n ALA 1749CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91