A0A087WRL4_MOUSE Loading...

PDZ domain containing 2

AlphaFold DB , UniProt , Accession A0A087WRL4, Species MOUSE (Mus musculus, Mouse), Gene Pdzd2, Length 363 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.8Very low50Low219 Ų219189.5 Ų189.5100%1.07989%0.887SS**  0130.40-55.4172.8-160.700108.1
2L45.5Very low49.5Very low177 Ų177184 Ų18493%0.92788%0.876SS**  trans-112.6111.3170.8-10366.2000109
3R55.6Low48.7Very low218 Ų218187.2 Ų187.282%0.82388%0.877SS**  trans-90.1106.4174.8-67-176.5179.3-175.20.5108.9F5R3-F5 PolarHBondContact O-N 3.31Å
4R65.3Low47.8Very low248 Ų248184.6 Ų184.694%0.93687%0.872SS**PPolyproline II helixtrans-72.8117.4171-71-172.8-179.7-176.71109.2
5F53.1Low47.1Very low200 Ų200176.3 Ų176.388%0.87785%0.854SS**PPolyproline II helixtrans-69.2127.6168.3-83.2-105.4000109.7R3R3-F5 PolarHBondContact O-N 3.31Å
6K62Low46.5Very low207 Ų207175.3 Ų175.390%0.985%0.854SS**PPolyproline II helixtrans-81.9131.9157.8-90-168.6170.9-173.50108.3
7Q51.9Low46Very low198 Ų198171.5 Ų171.593%0.92585%0.85SS**PPolyproline II helixtrans-71.6154.3170.3-74.7-176-1900111
8K41.8Very low45.4Very low171 Ų171165.9 Ų165.974%0.74384%0.843SS**  trans-109114.1-169.8-172.3-168.1-172.3-164.50109H10K8-H10 WeakPolarHBondContact CE-NE2 3.18Å; K8-H10 PolarHBondContact NZ-NE2 3.42Å
9A47.9Very low45.1Very low101 Ų101165.5 Ų165.584%0.83584%0.843SS**  trans-80.4128.6173.600000110.5
10H43.5Very low44.6Very low164 Ų164162.4 Ų162.476%0.75984%0.837SS**  trans-137.9125.8160.7-88.6-90.6000106.4K8K8-H10 WeakPolarHBondContact CE-NE2 3.18Å; K8-H10 PolarHBondContact NZ-NE2 3.42Å
11L40.2Very low44.4Very low182 Ų182160.1 Ų160.195%0.95384%0.836SS**  trans-133117.6160.4-147.978000106.9
12T44.1Very low44.2Very low123 Ų123158.3 Ų158.376%0.75582%0.824SS**  trans-95.4137.7-170.844.80000111.4
13Y38.9Very low44.8Very low226 Ų226155.7 Ų155.789%0.88682%0.818SS**  trans-67.5127.3169.1176.1-85.4000111.2
14N36.3Very low43.7Very low151 Ų151148.6 Ų148.681%0.80781%0.813SS**  trans-158.9160149.9-158.89.7000108.9
15G36.4Very low42.3Very low59 Ų59146.4 Ų146.461%0.60881%0.813SS**  trans-143.3-170.2177.200000112.1
16N38Very low41.7Very low160 Ų160143.3 Ų143.386%0.85681%0.811SS**  trans165.7164.8139-165.122.3000112
17S37.5Very low41.1Very low111 Ų111139 Ų13978%0.77680%0.804SS**  trans71.8140.516672.20000118.9
18G36.4Very low40.2Very low71 Ų71135.2 Ų135.273%0.73280%0.795SS**  cis139.589.5-25.100000117.7
19N38.3Very low40.2Very low158 Ų158134.6 Ų134.685%0.84580%0.799SS**  trans177.1165.9156.948.420000108
20S36.7Very low39.7Very low103 Ų103137.7 Ų137.772%0.7280%0.796SS**  cis-150.5149.85.5-155.20000112.8
21S38.6Very low39.8Very low115 Ų115137.1 Ų137.180%0.80480%0.798SS**  trans54.2134.1146.4-49.20000124.8
22E39.8Very low39.7Very low181 Ų181131.9 Ų131.985%0.84679%0.788SS**  trans-62.8-173.1165.5-67.1-177.8110.800116.6
23P57.9Low39.8Very low123 Ų123132.8 Ų132.880%0.79979%0.788SS**  cis-134.3-177.1-4133.7-16.3000113.1
24G33.3Very low40.3Very low69 Ų69130.3 Ų130.371%0.71179%0.785SS**  trans162.6123.5154.800000119.1
25E35.3Very low40.6Very low201 Ų201128 Ų12894%0.93978%0.776SS**  trans64151.6144.9-53-167.2154.500122.7
26T42Very low41.2Very low136 Ų136130.6 Ų130.683%0.83479%0.785SS**  trans-132.1138.9171.253.90000110.4
27P47.5Very low42Very low116 Ų116131.9 Ų131.975%0.75378%0.783SS**  -134.7139.3122.38.414.3000111.8
28T34.6Very low42.9Very low119 Ų119136.1 Ų136.173%0.7379%0.787SS**  77.4106.580.1-52.90000114.6
29L41.6Very low43.7Very low158 Ų158136.4 Ų136.483%0.82779%0.79SS**  trans53.3125.8154.5-59.1172.8000121.1
30E35.8Very low44.9Very low166 Ų166138 Ų13878%0.77679%0.79SS**  -161.5167.8117.1-112.4-51.7127.300111.2
31L45.7Very low46Very low151 Ų151144.7 Ų144.779%0.79180%0.799SS**  trans-86.5156.9179.9-74.797000113.1
32G38Very low47.3Very low73 Ų73144 Ų14475%0.75379%0.79SS**  trans-157.657.3-176.900000113.9Q34G32-Q34 PolarHBondContact O-N 3.12Å; G32-Q34 VanDerWaalsContact O-N 3.16Å
33D46.9Very low48.7Very low141 Ų141145 Ų14575%0.75479%0.787SS**  trans-64.5109.5177.3-106.2-42.6000112.1
34Q50.4Low49.3Very low174 Ų174148.3 Ų148.381%0.81379%0.788SS**  trans-13697.1167.9-80.6-61-17.300112G32 S36G32-Q34 PolarHBondContact O-N 3.12Å; G32-Q34 VanDerWaalsContact O-N 3.16Å; Q34-S36 PolarHBondContact O-N 3.42Å
35T42.2Very low50.4Low102 Ų102153.2 Ų153.263%0.62679%0.79SS**  trans-77.593.5-172.664.90000113.1K37T35-K37 PolarHBondContact O-N 3.4Å
36S48.3Very low51.3Low114 Ų114146.9 Ų146.980%0.79778%0.779SS**  trans-88.782.5169.447.90000111.4Q34 K38Q34-S36 PolarHBondContact O-N 3.42Å; S36-K38 VanDerWaalsContact C-N 3.33Å; S36-K38 PolarHBondContact O-N 2.99Å
37K54.2Low52.4Low188 Ų188146.7 Ų146.782%0.81778%0.777SS**  trans-67.276.6-174.2-67177.9-177.9171.80113.5T35 G39T35-K37 PolarHBondContact O-N 3.4Å; K37-G39 PolarHBondContact O-N 3.04Å; K37-G39 VanDerWaalsContact O-N 3.08Å
38K56.8Low52.9Low200 Ų200148.2 Ų148.287%0.8778%0.778SS**  trans-68.6103177.3-149172.1-168.9174.40110.5S36 K40S36-K38 VanDerWaalsContact C-N 3.33Å; S36-K38 PolarHBondContact O-N 2.99Å; K38-K40 PolarHBondContact O-N 3.28Å
39G54.1Low53.8Low77 Ų77147.7 Ų147.779%0.79478%0.778SS**  trans-63.992.7-169.200000115.2K37 R41K37-G39 PolarHBondContact O-N 3.04Å; K37-G39 VanDerWaalsContact O-N 3.08Å; G39-R41 PolarHBondContact O-N 2.7Å
40K63.3Low54.8Low191 Ų191150.6 Ų150.683%0.8378%0.779SS**  trans-70.495171.4-69.8-179178.8177.30110.5K38 T42K38-K40 PolarHBondContact O-N 3.28Å; K40-T42 VanDerWaalsContact C-N 3.26Å; K40-T42 PolarHBondContact O-N 3.23Å
41R59.4Low55.3Low243 Ų243148.6 Ų148.692%0.91778%0.78SS**  trans-68.577.4175-172.5178.1178172.9-0.7111.3G39 R43G39-R41 PolarHBondContact O-N 2.7Å; R41-R43 PolarHBondContact O-N 3.16Å
42T66.8Low55.3Low101 Ų101145.8 Ų145.862%0.6278%0.779SS**  trans-65.6121.4175.154.80000110.2K40 K44K40-T42 VanDerWaalsContact C-N 3.26Å; K40-T42 PolarHBondContact O-N 3.23Å; T42-K44 PolarHBondContact O-N 3.34Å
43R67.8Low56.3Low203 Ų203150.1 Ų150.177%0.76678%0.783SS**  trans-72.2116170.3-66.5177.572.5-144.15107.5R41 F45R41-R43 PolarHBondContact O-N 3.16Å; R43-F45 PolarHBondContact O-N 3.42Å
44K70.6Confident56.4Low191 Ų191151 Ų15183%0.8379%0.786SS**  trans-72.3111.1171.2-63.9-67.6-176.2173.30108.1T42T42-K44 PolarHBondContact O-N 3.34Å
45F57.5Low56.3Low173 Ų173152 Ų15276%0.75979%0.787SS**  trans-73.5123.1165.7-70.1-92000107.9R43R43-F45 PolarHBondContact O-N 3.42Å
46G54.6Low56.3Low68 Ų68151.4 Ų151.470%0.70179%0.793SS**  trans-77.1119.9173.200000109.9I48G46-I48 PolarHBondContact O-N 3.2Å
47V63.6Low56.7Low131 Ų131151.5 Ų151.579%0.79479%0.791SS**  trans-77115.9171.4178.70000108S49V47-S49 PolarHBondContact O-N 3.11Å
48I57.8Low56.1Low149 Ų149151.7 Ų151.776%0.76480%0.795SS**  trans-95.386.2177.4-54.5177.4000108.5G46 R50G46-I48 PolarHBondContact O-N 3.2Å; I48-R50 HydrophobicContact CG2-CG 4.5Å
49S55.1Low55.3Low107 Ų107149.4 Ų149.475%0.74879%0.792SS**  trans-72.6129.5165-57.70000109.4V47V47-S49 PolarHBondContact O-N 3.11Å
50R61.3Low54.7Low220 Ų220150.7 Ų150.783%0.8379%0.789SS**  trans-108.1145.7164.5-74.7-170.8173.7-164.9-1.5109.3I48I48-R50 HydrophobicContact CG2-CG 4.5Å
51P46.7Very low53.7Low123 Ų123151.2 Ų151.280%0.79979%0.791SS**PPolyproline II helixtrans-74.4156-167.730.4-36.4000112.8
52A46.6Very low52.6Low93 Ų93144.1 Ų144.177%0.76978%0.778SS**PPolyproline II helixtrans-66.2142166.200000110.5I54A52-I54 PolarHBondContact O-N 2.88Å
53I58Low51.1Low163 Ų163146.2 Ų146.284%0.83679%0.786SS**PPolyproline II helixtrans-75.5120.4173.7-64.8173.4000108.3K55I53-K55 PolarHBondContact O-N 2.91Å
54I49.3Very low49.8Very low160 Ų160142.1 Ų142.182%0.82179%0.789SS**PPolyproline II helixtrans-70117.3175.1-59.7171.6000108.2A52A52-I54 PolarHBondContact O-N 2.88Å
55K48.7Very low48.1Very low195 Ų195136.7 Ų136.785%0.84879%0.787SS**PPolyproline II helixtrans-86.3125.6157.9-73.6-171.1174.3-173.20108.1I53I53-K55 PolarHBondContact O-N 2.91Å
56A41.2Very low47.2Very low90 Ų90134.4 Ų134.474%0.74479%0.791SS**PPolyproline II helixtrans-76.4147.6165.500000109.8
57P56.8Low46.4Very low115 Ų115138.6 Ų138.675%0.74780%0.797SS**PPolyproline II helixtrans-89.8158.617536.9-34.3000112
58E42.3Very low45.2Very low193 Ų193139 Ų13990%0.90280%0.8SS**  trans-145.9157.6133.7-77.6-146.813200108.6
59D39.4Very low44.3Very low151 Ų151135.7 Ų135.781%0.80780%0.795SS**  trans-85.9153.6-164.3-60.1-93.6000113.6
60S43.1Very low43.5Very low105 Ų105138.6 Ų138.673%0.73480%0.802SS**  170.2162.970.647.20000113.1
61K40.8Very low42.5Very low202 Ų202135.2 Ų135.288%0.87880%0.801SS**  trans16.8139146.1-73.3169-177171.30119.4
62S36Very low43Very low93 Ų93133.9 Ų133.965%0.6579%0.792SS**  cis-171157.12148.40000115.7
63N35.8Very low42.4Very low145 Ų145134.6 Ų134.678%0.77579%0.792SS**  trans70.3146.8146-66.13.4000121.8
64S41.3Very low41.6Very low118 Ų118132.6 Ų132.683%0.82579%0.792SS**  trans48.2121.5156.652.40000119.1
65G33.8Very low41.2Very low77 Ų77133.7 Ų133.779%0.79479%0.793SS**  cis103.986.6-3.400000115
66C38.6Very low40.7Very low125 Ų125130.8 Ų130.885%0.84579%0.786SS**  trans-165.1134151.653.80000110
67D38.7Very low40.9Very low156 Ų156133.4 Ų133.483%0.83478%0.784SS**  trans-74.2148.7157.7-59.9-91000109.9
68T38.3Very low39.9Very low139 Ų139135.5 Ų135.585%0.85379%0.788SS**  trans-174.8138138.1-74.40000107.2
69A39.8Very low39.5Very low80 Ų80129 Ų12966%0.66177%0.773SS**  trans-92.2152.7170.400000109.8
70D37.3Very low39.5Very low168 Ų168129 Ų12990%0.89878%0.779SS**  trans-169.2151.3136.6-93.7-28.3000111.5
71D41.1Very low39Very low149 Ų149130.7 Ų130.780%0.79778%0.779SS**  trans-130.3164.7172.8-158.925.8000104
72P55.5Low39.1Very low94 Ų94125.3 Ų125.361%0.6177%0.767SS**  cis-135.4-173.4-2.435-12.9000114.7
73S35Very low39.1Very low109 Ų109128.4 Ų128.476%0.76277%0.772SS**  trans55.9124.314265.60000122.3
74S40.1Very low39.6Very low121 Ų121129.1 Ų129.185%0.84678%0.775SS**  trans-151.6129.2143.261.40000110.7
75E42.8Very low39.1Very low182 Ų182126.3 Ų126.385%0.8576%0.764SS**  trans-91.7-162.5172-60.5-168.3118.500111.6
76L38.1Very low39.4Very low134 Ų134130.9 Ų130.970%0.70277%0.771SS**  trans93.681.6162.2-47.3-170.8000118.8
77E44.4Very low39.3Very low146 Ų146128.5 Ų128.568%0.68277%0.767SS**  59.8156.4111.383.8-159.9152.800124.6
78N35.8Very low39.2Very low158 Ų158129.3 Ų129.385%0.84577%0.765SS**  trans66.4141.6177.7-58.9-42.9000116.9
79G34.1Very low39.2Very low56 Ų56126.9 Ų126.958%0.57776%0.759SS**  cis154.4157.1-0.300000110.6
80T38.2Very low38.9Very low153 Ų153132.1 Ų132.194%0.93977%0.767SS**  trans65.5154.6174.764.90000118.1
81D34.3Very low38.8Very low139 Ų139131.9 Ų131.974%0.74376%0.761SS**  cis-169.4167.4-27.9177.648.3000109.3
82S41.6Very low38.8Very low89 Ų89131.5 Ų131.562%0.62276%0.758SS**  trans67.9151.8161.4-77.40000118.2
83E36.1Very low37.8Very low159 Ų159134.1 Ų134.174%0.74376%0.762SS**  cis-161.4174.8-19.6-156.2-165.9104.900108.5
84L47.2Very low37.7Very low160 Ų160136 Ų13684%0.83876%0.763SS**  trans71.6145.5170.1-49.6173.8000117.5
85G31.1Very low37.2Very low59 Ų59133.3 Ų133.361%0.60876%0.755SS**  cis162.8135-900000113.1
86N40.3Very low38Very low173 Ų173130 Ų13093%0.92575%0.749SS**  trans64.5135.1176.9-51-23.3000116.8
87G35.3Very low37.7Very low74 Ų74130.6 Ų130.676%0.76375%0.753SS**  cis117.1100.6-12.200000115.4
88H36.8Very low37.3Very low174 Ų174128.9 Ų128.981%0.80676%0.757SS**  trans-158.4145.3146.7-144.7-82.2000112.1
89A37.9Very low37.2Very low87 Ų87129.1 Ų129.172%0.71976%0.758SS**  trans-150.2154.5170.900000109.3
90F34.6Very low37.3Very low190 Ų190134.7 Ų134.783%0.83377%0.766SS**  trans-168175.2147.864.6-90.7000110
91E33.9Very low37Very low164 Ų164133.1 Ų133.177%0.76675%0.752SS**  trans-142.9171.9-163.9-154.1-179.8-157.700110.8
92L40.9Very low37.1Very low140 Ų140132.9 Ų132.973%0.73376%0.755SS**  trans75117.2161-59.6175.6000121.7
93E35.3Very low36.6Very low150 Ų150133.3 Ų133.370%0.70176%0.764SS**  64.6114118.4-155.5-163.1114.200122.1
94N32.8Very low36.4Very low147 Ų147129.1 Ų129.179%0.78676%0.764SS**  172159.5117.7-98.7-83.9000112.7
95G30.2Very low36.3Very low66 Ų66127.9 Ų127.968%0.6877%0.765SS**  trans-122.1-155.7175.100000112.6
96P58.6Low36.2Very low111 Ų111132.8 Ų132.872%0.72177%0.772SS**  cis-138.4-150.4-5.141.2-19.7000114
97N31.7Very low36.2Very low148 Ų148130.8 Ų130.879%0.79176%0.761SS**  trans81.9150.4171.7-49.8-38.6000116.6
98S36.7Very low36Very low109 Ų109133.1 Ų133.176%0.76275%0.752SS**  cis-139.2139.48-74.70000109.5
99L34.2Very low35.7Very low163 Ų163133.3 Ų133.385%0.85375%0.745SS**  76.7127.470.7-166.372.5000116.5
100K36.6Very low35.8Very low174 Ų174134 Ų13476%0.75775%0.745SS**  trans76.3156.7173.3100-171.4-167.6104.20116.4
101D31.4Very low35.8Very low120 Ų120132.4 Ų132.464%0.64274%0.74SS**  cis-152.7167.810.1-109.6-20.9000109.2
102V35.3Very low35.9Very low134 Ų134129.4 Ų129.481%0.81274%0.743SS**  cis-149.9-78.8-11.155.20000113.7
103A31.4Very low35.4Very low97 Ų97128.1 Ų128.180%0.80274%0.737SS**  trans-157.9173.1-171.200000114.2
104G32.9Very low35.5Very low72 Ų72130.1 Ų130.174%0.74274%0.738SS**  trans-138.4159.2176.900000115.4
105P45.6Very low35.3Very low133 Ų133131.9 Ų131.986%0.86474%0.742SS**  trans-134.5-179.916028.5-7.7000113.4
106H28.9Very low35.4Very low163 Ų163133.2 Ų133.276%0.75575%0.746SS**  cis-178.6143.9-34.3-175.3-133.6000109.3
107L39.3Very low34.1Very low131 Ų131135.7 Ų135.769%0.68675%0.748SS**  trans66.7167.2169-74.6175.5000118.5
108E30.4Very low34.1Very low123 Ų123133.5 Ų133.558%0.57574%0.736SS**  cis-152.2154.714.7-147.2-180-148.100116.7
109R32.1Very low33.7Very low178 Ų178138.1 Ų138.167%0.67274%0.737SS**  trans59.9158.9151.2-94.7173.6-116.8-102.6-2.8120.4
110S38.1Very low33.8Very low102 Ų102136.7 Ų136.771%0.71373%0.734SS**  cis-159.81601.841.40000107.6
111E36.4Very low34Very low155 Ų155133.5 Ų133.572%0.72473%0.732SS**  cis152.8171.9-7.1-96.2179.8123.200106.8
112A34.2Very low33.9Very low101 Ų101137.1 Ų137.184%0.83574%0.742SS**  trans79.5139.3170.900000119.9
113D31.9Very low33.6Very low114 Ų114135.3 Ų135.361%0.6173%0.731SS**  cis-168.3163.7-20.4-148.5-18.6000113.7
114R37.6Very low33.3Very low192 Ų192139.7 Ų139.773%0.72574%0.735SS**  trans65.6101.4158.9-55.8-156.3168.556.237.8126.3
115E28.2Very low33.1Very low183 Ų183140.4 Ų140.486%0.85573%0.734SS**  28.2156.7114.4-70.9-175.6102.500127.6
116A32.9Very low33.4Very low94 Ų94139 Ų13978%0.77773%0.725SS**  trans78149.6147.900000121.2
117E30Very low33.5Very low163 Ų163139 Ų13976%0.76273%0.73SS**  cis-164.1159.4-31.9-134.3-154.3147.500112.1
118L31.2Very low33Very low102 Ų102137.2 Ų137.253%0.53473%0.728SS.*  trans62.8141.5149.3-75.1167.9000127
119R28.4Very low33Very low206 Ų206138.5 Ų138.578%0.77774%0.739SS**  trans85.695.5141.4-75.1162.7-172.31466.7124
120V36.7Very low33.1Very low133 Ų133135.5 Ų135.581%0.80675%0.745SS**  14.9129.8109.5-167.10000116.2
121P41.4Very low33.1Very low108 Ų108137.2 Ų137.270%0.70175%0.746SS**  -155.9154.465.341.5-20.4000121.6
122K29.7Very low33Very low195 Ų195136.9 Ų136.985%0.84875%0.75SS**  50.7141.9125.3-138.6179-180-1750119.5
123T28.4Very low33.5Very low97 Ų97140.3 Ų140.360%0.59575%0.745SS**  17214479.6-73.40000114.3
124E25.8Very low33.7Very low188 Ų188145.6 Ų145.688%0.87976%0.757SS**  trans69.2165.2156.2-79.3149.6-145.700124.8
125A28.7Very low33.8Very low87 Ų87147.5 Ų147.572%0.71976%0.764SS**  trans-157.4-149.4-176.600000106
126P51.3Low34.4Very low104 Ų104148.6 Ų148.668%0.67577%0.767SS**  cis-135.5-164.2-23.126.7-0.8000113.1
127L31.4Very low34.6Very low163 Ų163150 Ų15085%0.85377%0.771SS**  trans72.8167.9162.1-36.5178.4000116.5
128S29Very low35.3Very low94 Ų94151.9 Ų151.966%0.65778%0.776SS**  cis-150.9161.33.161.80000113.3
129D28.6Very low35.6Very low150 Ų150154.1 Ų154.180%0.80280%0.795SS**  trans33.9130.8146.6-60.4-43.7000122.9
130S35.1Very low36Very low114 Ų114147.9 Ų147.980%0.79779%0.794SS**  -177.4165.689.2-165.50000113.3
131N38.3Very low36.5Very low138 Ų138151.7 Ų151.774%0.73880%0.8SS**  trans-101.8154.4176.4-63.8-105.9000111
132D33.6Very low36.6Very low149 Ų149152.4 Ų152.480%0.79780%0.802SS**  -154.6166.5126.2-146.9-10000113.4
133K44.4Very low37.4Very low172 Ų172150.7 Ų150.775%0.74880%0.802SS**  trans-119.6142.1-170.6-60.7162.2-176.6163.90111.4
134R36.3Very low38Very low226 Ų226154.2 Ų154.285%0.85381%0.81SS**  trans174.8155153.2-101.1179.2-75.6-173.6-1.4109
135R39.8Very low39.2Very low231 Ų231154.1 Ų154.187%0.87281%0.809SS**  cis-159.6151.9-32-148.9173.6-179168.2-0.7107.2
136F40.8Very low39.9Very low207 Ų207154.3 Ų154.391%0.90881%0.805SS**  trans-72.2151.8-173-56.3-89.5000115.5
137S37.3Very low39.6Very low124 Ų124154.6 Ų154.687%0.86781%0.81SS**  trans-145.1154.1142.462.20000109.9
138K45.6Very low40.1Very low201 Ų201152.3 Ų152.387%0.87480%0.799SS**  trans-156.9101.4-164.5178.8-173174.8-179.20113.2
139T38Very low40.8Very low150 Ų150153.2 Ų153.292%0.9281%0.805SS**  trans-155.2151.8169450000107.9
140G34.8Very low41.7Very low74 Ų74152.8 Ų152.876%0.76380%0.802SS**  cis-166162.4-7.500000108.7
141K47.9Very low42.5Very low214 Ų214151 Ų15193%0.9379%0.794SS**  trans-91.1127.2-177-65.1-174.5178.8-174.80112
142T44.8Very low42.9Very low122 Ų122153.5 Ų153.575%0.74879%0.793SS**  trans-127.4127.5157.6460000108.8
143N45.5Very low44.2Very low159 Ų159155 Ų15585%0.8580%0.795SS**  trans-98.4108.9-177.2-16728.5000109
144F41.7Very low44.9Very low172 Ų172150 Ų15075%0.75478%0.775SS**  trans-126.5124173.9-85.1-83.9000109.7S146F144-S146 VanDerWaalsContact C-N 3.26Å; F144-S146 PolarHBondContact O-N 3.06Å
145Q51.1Low46Very low185 Ų185144.9 Ų144.986%0.86477%0.768SS**  trans-76.779.1170.9-71.6177.1-33.400109.3S147Q145-S147 PolarHBondContact O-N 3.28Å; Q145-S147 VanDerWaalsContact O-N 3.17Å
146S41.9Very low47.8Very low91 Ų91134.6 Ų134.664%0.63673%0.734SS**  trans-7398.9161.7-67.60000108.2F144 D148F144-S146 VanDerWaalsContact C-N 3.26Å; F144-S146 PolarHBondContact O-N 3.06Å; S146-D148 PolarHBondContact O-N 2.78Å
147S46.3Very low50.2Low110 Ų110134.1 Ų134.177%0.76973%0.726SS**  trans-73.950.7170.1-59.20000111.4Q145 S149Q145-S147 PolarHBondContact O-N 3.28Å; Q145-S147 VanDerWaalsContact O-N 3.17Å; S147-S149 PolarHBondContact O-N 2.93Å
148D40.7Very low52.9Low116 Ų116133 Ų13362%0.6271%0.71SS**  trans-74.865168-81.5-52.9000109.2S146 L150S146-D148 PolarHBondContact O-N 2.78Å; D148-L150 PolarHBondContact O-N 3.08Å
149S44.5Very low55.2Low112 Ų112125.9 Ų125.978%0.78368%0.678SS**  trans-73.944158.567.70000110.3S147 A151S147-S149 PolarHBondContact O-N 2.93Å; S149-A151 VanDerWaalsContact C-N 3.26Å; S149-A151 PolarHBondContact O-N 3.31Å
150L46.3Very low58Low141 Ų141126.4 Ų126.474%0.73867%0.667SS**  trans-64.498.7156.4-67.8179.7000104.7D148 R152D148-L150 PolarHBondContact O-N 3.08Å; L150-R152 PolarHBondContact O-N 2.82Å
151A53.1Low60.9Low78 Ų78123 Ų12365%0.64563%0.631SS**  trans-51.8120.9-173.900000108.9S149 E153S149-A151 VanDerWaalsContact C-N 3.26Å; S149-A151 PolarHBondContact O-N 3.31Å; A151-E153 PolarHBondContact O-N 3.26Å
152R46.5Very low63.2Low190 Ų190118 Ų11872%0.71761%0.611SS**  trans-51.6119.1165.1-80.3165.345.9140.1-4.4106.1L150 E154L150-R152 PolarHBondContact O-N 2.82Å; R152-E154 HydrophobicContact CB-CG 3.99Å; R152-E154 IonicContact CZ-OE1 2.91Å; R152-E154 IonicContact NE-OE1 2.7Å; R152-E154 PolarHBondContact NE-OE1 3.24Å; R152-E154 IonicContact NH2-OE1 3Å; R152-E154 PolarHBondContact NH2-OE1 3.3Å; R152-E154 PolarHBondContact O-N 3.32Å
153E60.5Low65.6Low179 Ų179112.5 Ų112.584%0.83658%0.577SS**  trans-74.677.3176.9-163.2169.4-165.200106.8A151 V155A151-E153 PolarHBondContact O-N 3.26Å; E153-V155 HydrophobicContact CG-CG2 4.12Å; E153-V155 WeakPolarHBondContact O-CG2 3.39Å; E153-V155 PolarHBondContact O-N 3.04Å
154E59.1Low68Low69 Ų69110.3 Ų110.332%0.32257%0.565SS.*  trans-74.580.2178-74.5169.1161.800107.2R152 G156R152-E154 HydrophobicContact CB-CG 3.99Å; R152-E154 IonicContact CZ-OE1 2.91Å; R152-E154 IonicContact NE-OE1 2.7Å; R152-E154 PolarHBondContact NE-OE1 3.24Å; R152-E154 IonicContact NH2-OE1 3Å; R152-E154 PolarHBondContact NH2-OE1 3.3Å; R152-E154 PolarHBondContact O-N 3.32Å; E154-G156 PolarHBondContact O-N 3.45Å
155V60.8Low70.5Confident117 Ų117105 Ų10571%0.70954%0.542SS*.  trans-6381.5179.6-172.20000109.2E153E153-V155 HydrophobicContact CG-CG2 4.12Å; E153-V155 WeakPolarHBondContact O-CG2 3.39Å; E153-V155 PolarHBondContact O-N 3.04Å
156G76.6Confident72.5Confident16 Ų1699.1 Ų99.117%0.16551%0.514CS..  trans-72-177.7169.200000111.3E154 I158 S243E154-G156 PolarHBondContact O-N 3.45Å; G156-I158 PolarHBondContact O-N 2.96Å; G156-S243 CarbonylContact C-O 3.57Å; G156-S243 WeakPolarHBondContact CA-O 3.25Å
157R90.6Very high74.8Confident196 Ų196100.1 Ų100.174%0.7452%0.521SS*.  trans-63.8131.7-174.5-172.7-171.8-68-157.8-3110.4W159 A242 S243R157-W159 HydrophobicContact CB-CE3 4.05Å; R157-W159 HydrophobicContact CB-CZ3 4.1Å; R157-W159 HydrophobicContact CG-CE3 3.85Å; R157-W159 HydrophobicContact CG-CZ3 4.37Å; R157-W159 VanDerWaalsContact O-CE3 3.24Å; R157-W159 WeakPolarHBondContact O-CZ3 3.34Å; R157-A242 WeakPolarHBondContact O-CA 3.41Å; R157-S243 PolarHBondContact O-N 2.72Å
158I94.1Very high76.8Confident101 Ų10199.7 Ų99.752%0.51851%0.51SS..EExtended strand (participates in β ladder)trans-100.6133.8165.6-52.5-177.6000108.8G156 L211 V240 V241 A242G156-I158 PolarHBondContact O-N 2.96Å; I158-L211 HydrophobicContact CD1-CD1 4.17Å; I158-L211 HydrophobicContact CG2-CD1 4.09Å; I158-V240 HydrophobicContact CG2-CG1 3.93Å; I158-V241 CarbonylContact C-O 3.5Å; I158-V241 VanDerWaalsContact CA-O 3.3Å; I158-V241 WeakPolarHBondContact CA-O 3.46Å; I158-A242 HydrophobicContact CG1-CB 3.94Å
159W95.5Very high79.3Confident52 Ų5294.8 Ų94.820%0.19749%0.487CS..EExtended strand (participates in β ladder)trans-144.1174.4174.467.694.7000112.6R157 M161 R203 V240 V241R157-W159 HydrophobicContact CB-CE3 4.05Å; R157-W159 HydrophobicContact CB-CZ3 4.1Å; R157-W159 HydrophobicContact CG-CE3 3.85Å; R157-W159 HydrophobicContact CG-CZ3 4.37Å; R157-W159 VanDerWaalsContact O-CE3 3.24Å; R157-W159 WeakPolarHBondContact O-CZ3 3.34Å; W159-M161 HydrophobicContact CZ2-CE 4.29Å; W159-R203 VanDerWaalsContact CZ2-O 3.25Å; W159-R203 WeakPolarHBondContact CZ2-O 3.35Å; W159-V240 WeakPolarHBondContact O-CA 3.48Å; W159-V241 HydrophobicContact CH2-CG1 4.13Å; W159-V241 HydrophobicContact CZ2-CB 4.21Å; W159-V241 HydrophobicContact CZ2-CG1 3.81Å; W159-V241 PolarHBondContact N-O 3.17Å; W159-V241 PolarHBondContact O-N 3.3Å
160K95.3Very high81.6Confident161 Ų16190 Ų9070%0.745%0.453SS*.EExtended strand (participates in β ladder)trans-112.1143.7172.2-52.7-163.4177.9-179.10110.5R203 L239 V240K160-R203 PolarHBondContact O-NH2 3.31Å; K160-L239 WeakPolarHBondContact CA-O 3.19Å; K160-V240 HydrophobicContact CD-CG2 4.31Å; K160-V240 HydrophobicContact CG-CG2 4.13Å
161M95.8Very high83.9Confident3 Ų383.6 Ų83.62%0.01542%0.42CS..EExtended strand (participates in β ladder)trans-137.5161.6171.463.7174.262.700109.9W159 L163 R203 L204 L239 V241W159-M161 HydrophobicContact CZ2-CE 4.29Å; M161-L163 HydrophobicContact SD-CD1 4.08Å; M161-L163 HydrophobicContact SD-CG 4.24Å; M161-R203 HydrophobicContact CE-CB 4.25Å; M161-R203 WeakPolarHBondContact CE-O 3.49Å; M161-L204 HydrophobicContact CE-CB 3.91Å; M161-L204 HydrophobicContact CE-CD1 3.98Å; M161-L204 HydrophobicContact CE-CG 4.46Å; M161-L204 HydrophobicContact SD-CB 4.27Å; M161-L204 HydrophobicContact SD-CD1 4.43Å; M161-L204 HydrophobicContact SD-CD2 4.48Å; M161-L239 HydrophobicContact CG-CB 3.81Å; M161-L239 HydrophobicContact CG-CD1 4.04Å; M161-L239 PolarHBondContact N-O 2.95Å; M161-L239 PolarHBondContact O-N 3.33Å; M161-L239 HydrophobicContact SD-CB 4.47Å; M161-L239 HydrophobicContact SD-CD1 4.27Å; M161-V241 HydrophobicContact CE-CG2 3.95Å; M161-V241 HydrophobicContact CG-CG2 4.3Å; M161-V241 HydrophobicContact SD-CG2 4.18Å
162E96.1Very high86Confident109 Ų10981.4 Ų81.451%0.50940%0.398SS..EExtended strand (participates in β ladder)trans-130.3126.6173.6-56.2-170.5137.900107.1V237 Q238E162-V237 WeakPolarHBondContact CA-O 3.21Å; E162-Q238 HydrophobicContact CG-CG 4.13Å; E162-Q238 WeakPolarHBondContact OE1-CG 3.17Å; E162-Q238 PolarHBondContact OE1-NE2 3.5Å
163L96Very high88.3Confident6 Ų677.4 Ų77.43%0.03139%0.387CS..EExtended strand (participates in β ladder)trans-122.3130.8-179.2-66.9179.1000109.5M161 K165 L170 A198 D201 V237 L239M161-L163 HydrophobicContact SD-CD1 4.08Å; M161-L163 HydrophobicContact SD-CG 4.24Å; L163-K165 PolarHBondContact O-N 2.8Å; L163-L170 HydrophobicContact CB-CD2 3.79Å; L163-L170 HydrophobicContact CD1-CD2 4.44Å; L163-A198 HydrophobicContact CD1-CB 3.85Å; L163-D201 HydrophobicContact CD2-CB 3.44Å; L163-D201 VanDerWaalsContact CD2-CB 3.44Å; L163-V237 PolarHBondContact N-O 3.42Å; L163-V237 PolarHBondContact O-N 2.91Å; L163-L239 HydrophobicContact CB-CD1 4.23Å; L163-L239 HydrophobicContact CD1-CD1 3.9Å; L163-L239 HydrophobicContact CG-CD1 4.03Å
164L95.4Very high90Very high113 Ų11369.9 Ų69.959%0.59235%0.353SS*.EExtended strand (participates in β ladder)trans-73.2123.2170.3-174.466.8000109A197 M236L164-A197 WeakPolarHBondContact O-CB 3.47Å; L164-M236 HydrophobicContact CD1-CG 4.26Å
165K94.6Very high91.6Very high61 Ų6168.6 Ų68.627%0.26535%0.352SS..  trans-80.5120.2177.3-173.5-169.8167.9-61.70110.7L163 L170 A233 G235 V237L163-K165 PolarHBondContact O-N 2.8Å; K165-L170 HydrophobicContact CB-CD2 3.98Å; K165-L170 HydrophobicContact CG-CD2 4.32Å; K165-L170 HydrophobicContact CG-CG 4.41Å; K165-A233 WeakPolarHBondContact CD-O 3.41Å; K165-A233 WeakPolarHBondContact CE-O 3.25Å; K165-G235 WeakPolarHBondContact CB-O 3.46Å; K165-G235 PolarHBondContact N-O 3.29Å; K165-V237 HydrophobicContact CB-CG2 3.97Å
166E92.6Very high93.2Very high60 Ų6063.3 Ų63.328%0.2832%0.321SS..BIsolated β-bridgetrans-86.6-176178.4-71.9165.2-10800112.3D168 G169 A197 R200E166-D168 PolarHBondContact O-N 2.79Å; E166-G169 PolarHBondContact N-O 2.8Å; E166-G169 PolarHBondContact O-N 3.31Å; E166-A197 VanDerWaalsContact OE1-CA 3.27Å; E166-A197 WeakPolarHBondContact OE1-CA 3.44Å; E166-A197 VanDerWaalsContact OE1-CB 3.25Å; E166-A197 WeakPolarHBondContact OE1-CB 3.49Å; E166-A197 PolarHBondContact OE1-N 3.26Å; E166-R200 VanDerWaalsContact CD-NH1 3.32Å; E166-R200 IonicContact OE1-CZ 2.62Å; E166-R200 VanDerWaalsContact OE1-CZ 3.26Å; E166-R200 IonicContact OE1-NH1 3.86Å; E166-R200 PolarHBondContact OE1-NH1 3.11Å; E166-R200 IonicContact OE1-NH2 3.39Å; E166-R200 PolarHBondContact OE1-NH2 3.07Å; E166-R200 IonicContact OE2-CZ 3.26Å; E166-R200 IonicContact OE2-NH1 3Å; E166-R200 PolarHBondContact OE2-NH1 2.87Å; E166-R200 IonicContact OE2-NH2 2.72Å; E166-R200 PolarHBondContact OE2-NH2 3.43Å
167S89.9Confident94Very high112 Ų11262.6 Ų62.678%0.78331%0.314SS*.THydrogen-bonded Turntrans-47.5-48.4167.150.10000111.2G169S167-G169 PolarHBondContact O-N 2.87Å
168D88.1Confident94.1Very high101 Ų10161.9 Ų61.954%0.5431%0.311SS..THydrogen-bonded Turntrans-78.56-177.8-69.539.9000112.8E166 K193E166-D168 PolarHBondContact O-N 2.79Å; D168-K193 IonicContact OD2-NZ 3.37Å; D168-K193 PolarHBondContact OD2-NZ 3.3Å
169G92.8Very high93.7Very high14 Ų1460.5 Ų60.514%0.14432%0.322CS..BIsolated β-bridgetrans80.7-138.6-175.200000112.5E166 S167E166-G169 PolarHBondContact N-O 2.8Å; E166-G169 PolarHBondContact O-N 3.31Å; S167-G169 PolarHBondContact O-N 2.87Å
170L94.6Very high93.3Very high11 Ų1159.8 Ų59.86%0.05833%0.325CS..THydrogen-bonded Turntrans-93.5-5.3-179.4-65.8173.7000113.2L163 K165 I172 A198 L230 V237L163-L170 HydrophobicContact CB-CD2 3.79Å; L163-L170 HydrophobicContact CD1-CD2 4.44Å; K165-L170 HydrophobicContact CB-CD2 3.98Å; K165-L170 HydrophobicContact CG-CD2 4.32Å; K165-L170 HydrophobicContact CG-CG 4.41Å; L170-I172 HydrophobicContact CB-CD1 4.42Å; L170-I172 HydrophobicContact CB-CG1 4.16Å; L170-I172 HydrophobicContact CD1-CD1 4.45Å; L170-A198 WeakPolarHBondContact O-CB 3.33Å; L170-A198 PolarHBondContact O-N 3.46Å; L170-A198 VanDerWaalsContact O-N 3.08Å; L170-L230 HydrophobicContact CD1-CD2 3.83Å; L170-V237 HydrophobicContact CD1-CB 4.4Å; L170-V237 HydrophobicContact CD1-CG1 4.18Å; L170-V237 HydrophobicContact CD1-CG2 4.49Å; L170-V237 HydrophobicContact CD2-CB 4.11Å; L170-V237 HydrophobicContact CD2-CG2 3.99Å
171G94.6Very high92.7Very high6 Ų662.6 Ų62.66%0.06234%0.337CS..SBendtrans67.533.6-175.200000114K193G171-K193 WeakPolarHBondContact O-CB 3.32Å; G171-K193 PolarHBondContact O-N 3.01Å
172I95.8Very high92Very high32 Ų3273.4 Ų73.416%0.16438%0.378CS..EExtended strand (participates in β ladder)trans-127.9148.1178.165.9179.2000111.8L170 V174 A198 L204 L210 L230L170-I172 HydrophobicContact CB-CD1 4.42Å; L170-I172 HydrophobicContact CB-CG1 4.16Å; L170-I172 HydrophobicContact CD1-CD1 4.45Å; I172-V174 HydrophobicContact CD1-CG1 4.3Å; I172-A198 HydrophobicContact CG2-CB 3.42Å; I172-A198 VanDerWaalsContact CG2-CB 3.42Å; I172-L204 HydrophobicContact CD1-CD2 4.43Å; I172-L204 HydrophobicContact CG2-CD2 3.76Å; I172-L210 HydrophobicContact CD1-CD1 4Å; I172-L230 HydrophobicContact CD1-CD2 4.22Å
173Q95.3Very high91.5Very high107 Ų10769.3 Ų69.350%0.536%0.361SS..EExtended strand (participates in β ladder)trans-108.4145.4162.8-63.7-178.615.100109.7V189 T190 Q191Q173-V189 WeakPolarHBondContact O-CA 3.35Å; Q173-T190 WeakPolarHBondContact CB-OG1 3.38Å; Q173-T190 PolarHBondContact O-N 3.37Å; Q173-T190 PolarHBondContact O-OG1 2.93Å; Q173-Q191 HydrophobicContact CB-CB 4.07Å; Q173-Q191 HydrophobicContact CG-CB 4.21Å; Q173-Q191 PolarHBondContact N-O 3.35Å
174V95.4Very high91Very high21 Ų2171.6 Ų71.613%0.12738%0.377CS..EExtended strand (participates in β ladder)trans-129.5153.8-179.8-630000111I172 I187 V188 L210 H223 V227 L230I172-V174 HydrophobicContact CD1-CG1 4.3Å; V174-I187 HydrophobicContact CB-CG2 3.77Å; V174-I187 HydrophobicContact CG1-CG2 4.09Å; V174-I187 HydrophobicContact CG2-CG2 4.09Å; V174-V188 CarbonylContact C-O 3.47Å; V174-V188 VanDerWaalsContact CA-O 3.31Å; V174-V188 WeakPolarHBondContact CA-O 3.37Å; V174-L210 HydrophobicContact CG1-CD1 3.72Å; V174-H223 PolarHBondContact O-CE1 3.19Å; V174-H223 VanDerWaalsContact O-CE1 3.29Å; V174-V227 HydrophobicContact CG2-CG2 4.15Å; V174-L230 HydrophobicContact CG1-CD1 4.19Å; V174-L230 HydrophobicContact CG2-CD1 3.77Å
175S94.6Very high90.5Very high41 Ų4172.4 Ų72.429%0.28738%0.377SS..EExtended strand (participates in β ladder)trans-139.3-174.4169.5760000110.5I187 V188 T190S175-I187 CarbonylContact O-C 3.58Å; S175-I187 WeakPolarHBondContact O-CA 3.3Å; S175-V188 PolarHBondContact N-O 3.29Å; S175-V188 PolarHBondContact O-N 2.58Å; S175-T190 WeakPolarHBondContact OG-CG2 3.19Å
176G93.8Very high90.4Very high7 Ų770.2 Ų70.27%0.07237%0.37CS..EExtended strand (participates in β ladder)trans94.4-150-179.600000112.6S183 A186G176-S183 CarbonylContact C-O 3.56Å; G176-S183 WeakPolarHBondContact CA-O 3.4Å; G176-A186 CarbonylContact C-O 3.57Å; G176-A186 WeakPolarHBondContact CA-O 3.24Å
177G92.4Very high90.5Very high1 Ų167.3 Ų67.31%0.0136%0.357CS..  trans77.5174.9-175.600000114G179 S180 S183 P184 A186 L221G177-G179 PolarHBondContact O-N 3.14Å; G177-G179 VanDerWaalsContact O-N 3.15Å; G177-S180 VanDerWaalsContact O-CB 3.22Å; G177-S180 WeakPolarHBondContact O-CB 3.37Å; G177-S180 PolarHBondContact O-N 3.37Å; G177-S183 PolarHBondContact N-O 3.47Å; G177-P184 CarbonylContact C-O 3.55Å; G177-P184 CarbonylContact O-C 3.5Å; G177-P184 WeakPolarHBondContact O-CA 2.99Å; G177-A186 PolarHBondContact N-O 2.8Å; G177-L221 CarbonylContact C-O 3.57Å; G177-L221 VanDerWaalsContact CA-O 3.22Å; G177-L221 WeakPolarHBondContact CA-O 3.39Å
178R92.6Very high90.8Very high180 Ų18062.8 Ų62.868%0.67933%0.325SS*.THydrogen-bonded Turntrans-56.6114.5-171.3-160.8177.871142.9-0.2112.3P184 L221R178-P184 VanDerWaalsContact CA-O 3.28Å; R178-P184 WeakPolarHBondContact CA-O 3.43Å; R178-P184 PolarHBondContact N-O 2.86Å; R178-L221 PolarHBondContact N-O 3.4Å
179G85.9Confident91.1Very high72 Ų7258 Ų5874%0.74230%0.299SS*.THydrogen-bonded Turntrans101.2-8.2-177.200000114.9G177G177-G179 PolarHBondContact O-N 3.14Å; G177-G179 VanDerWaalsContact O-N 3.15Å
180S87.9Confident91.2Very high38 Ų3859.9 Ų59.927%0.26631%0.308SS..  trans-66.2137173177.50000112G177 R182 S183 P184G177-S180 VanDerWaalsContact O-CB 3.22Å; G177-S180 WeakPolarHBondContact O-CB 3.37Å; G177-S180 PolarHBondContact O-N 3.37Å; S180-R182 VanDerWaalsContact C-N 3.28Å; S180-R182 PolarHBondContact O-N 2.92Å; S180-R182 PolarHBondContact OG-N 2.83Å; S180-S183 PolarHBondContact OG-N 2.85Å; S180-P184 WeakPolarHBondContact O-CB 3.45Å
181K82.9Confident91.2Very high220 Ų22064 Ų6496%0.95733%0.327SS*.SBendtrans-68.6-22.5176.1-64.9-178.1-179.6177.40113.9
182R81.1Confident91.2Very high229 Ų22965.2 Ų65.286%0.86433%0.333SS*.SBendtrans-102.8-41.9-173.6-161.6176.3-166.5173.54.2112.7S180S180-R182 VanDerWaalsContact C-N 3.28Å; S180-R182 PolarHBondContact O-N 2.92Å; S180-R182 PolarHBondContact OG-N 2.83Å
183S85.3Confident91.2Very high23 Ų2368.8 Ų68.816%0.16135%0.347CS..  trans-139.774.8-176.4-550000110.1G176 G177 S180 H185G176-S183 CarbonylContact C-O 3.56Å; G176-S183 WeakPolarHBondContact CA-O 3.4Å; G177-S183 PolarHBondContact N-O 3.47Å; S180-S183 PolarHBondContact OG-N 2.85Å; S183-H185 PolarHBondContact O-N 2.92Å; S183-H185 VanDerWaalsContact O-N 3.15Å
184P84.4Confident91.2Very high55 Ų5571.4 Ų71.436%0.35736%0.359SS..SBendtrans-68.9-9.7-171.625.8-34.9000115.2G177 R178 S180G177-P184 CarbonylContact C-O 3.55Å; G177-P184 CarbonylContact O-C 3.5Å; G177-P184 WeakPolarHBondContact O-CA 2.99Å; R178-P184 VanDerWaalsContact CA-O 3.28Å; R178-P184 WeakPolarHBondContact CA-O 3.43Å; R178-P184 PolarHBondContact N-O 2.86Å; S180-P184 WeakPolarHBondContact O-CB 3.45Å
185H86.4Confident91.1Very high129 Ų12972.3 Ų72.360%0.59737%0.373SS*.SBendtrans-126.2-10.6-177.1-57.7121.1000114.4S183 V219 G220S183-H185 PolarHBondContact O-N 2.92Å; S183-H185 VanDerWaalsContact O-N 3.15Å; H185-V219 WeakPolarHBondContact O-CA 3.46Å; H185-G220 PolarHBondContact O-N 3Å
186A91.9Very high91.1Very high15 Ų1570.7 Ų70.712%0.12436%0.362CS..  trans-124.5148-173.700000111.5G176 G177 V188 E209G176-A186 CarbonylContact C-O 3.57Å; G176-A186 WeakPolarHBondContact CA-O 3.24Å; G177-A186 PolarHBondContact N-O 2.8Å; A186-V188 HydrophobicContact CB-CG2 4.3Å; A186-E209 WeakPolarHBondContact CB-OE2 3.42Å
187I95.8Very high91.2Very high0 Ų070.7 Ų70.70%036%0.362CS..EExtended strand (participates in β ladder)trans-99.6115.7173.4-59.4-63.4000107.4V174 S175 E209 L210 L218 A226V174-I187 HydrophobicContact CB-CG2 3.77Å; V174-I187 HydrophobicContact CG1-CG2 4.09Å; V174-I187 HydrophobicContact CG2-CG2 4.09Å; S175-I187 CarbonylContact O-C 3.58Å; S175-I187 WeakPolarHBondContact O-CA 3.3Å; I187-E209 CarbonylContact O-C 3.53Å; I187-E209 WeakPolarHBondContact O-CA 3.42Å; I187-L210 HydrophobicContact CG2-CB 4.46Å; I187-L210 HydrophobicContact CG2-CD1 4.46Å; I187-L210 PolarHBondContact O-N 3.47Å; I187-L218 HydrophobicContact CB-CD1 4.22Å; I187-L218 HydrophobicContact CG1-CB 4.01Å; I187-L218 HydrophobicContact CG1-CD1 4.28Å; I187-L218 HydrophobicContact CG2-CD1 4.35Å; I187-A226 HydrophobicContact CD1-CB 3.48Å; I187-A226 VanDerWaalsContact CD1-CB 3.48Å; I187-A226 HydrophobicContact CG1-CB 3.63Å; I187-A226 HydrophobicContact CG2-CB 4.35Å
188V94.6Very high91.3Very high17 Ų1770.6 Ų70.610%0.10336%0.361CS..EExtended strand (participates in β ladder)trans-116.4133.6-168.3-169.40000110.6V174 S175 A186 T190 E209V174-V188 CarbonylContact C-O 3.47Å; V174-V188 VanDerWaalsContact CA-O 3.31Å; V174-V188 WeakPolarHBondContact CA-O 3.37Å; S175-V188 PolarHBondContact N-O 3.29Å; S175-V188 PolarHBondContact O-N 2.58Å; A186-V188 HydrophobicContact CB-CG2 4.3Å; V188-T190 PolarHBondContact O-N 2.83Å; V188-E209 HydrophobicContact CG1-CG 4.47Å; V188-E209 HydrophobicContact CG2-CG 4.05Å
189V95.3Very high91.4Very high1 Ų166.4 Ų66.41%0.00635%0.349CS..EExtended strand (participates in β ladder)trans-68.3120.3176.8179.40000110Q173 V192 L204 G207 D208 L210Q173-V189 WeakPolarHBondContact O-CA 3.35Å; V189-V192 HydrophobicContact CG1-CG2 3.99Å; V189-L204 HydrophobicContact CG2-CD1 4.17Å; V189-L204 HydrophobicContact CG2-CD2 4.21Å; V189-L204 HydrophobicContact CG2-CG 4.28Å; V189-G207 PolarHBondContact O-N 2.99Å; V189-D208 PolarHBondContact N-O 2.87Å; V189-L210 HydrophobicContact CG2-CD1 4.36Å; V189-L210 HydrophobicContact CG2-CD2 3.92Å; V189-L210 HydrophobicContact CG2-CG 4.04Å
190T94.4Very high91.9Very high53 Ų5370.2 Ų70.233%0.32534%0.341SS..EExtended strand (participates in β ladder)trans-102.1-22.2-179.351.40000114Q173 S175 V188 L206Q173-T190 WeakPolarHBondContact CB-OG1 3.38Å; Q173-T190 PolarHBondContact O-N 3.37Å; Q173-T190 PolarHBondContact O-OG1 2.93Å; S175-T190 WeakPolarHBondContact OG-CG2 3.19Å; V188-T190 PolarHBondContact O-N 2.83Å; T190-L206 VanDerWaalsContact O-CD1 3.25Å; T190-L206 WeakPolarHBondContact O-CD1 3.43Å; T190-L206 WeakPolarHBondContact O-CG 3.41Å
191Q94.6Very high92.2Very high98 Ų9871 Ų7146%0.45834%0.342SS..EExtended strand (participates in β ladder)trans-157.1145.3175.5-165.7177.88.800109.3Q173Q173-Q191 HydrophobicContact CB-CB 4.07Å; Q173-Q191 HydrophobicContact CG-CB 4.21Å; Q173-Q191 PolarHBondContact N-O 3.35Å
192V95.5Very high92.7Very high31 Ų3163 Ų6319%0.18832%0.322CS..EExtended strand (participates in β ladder)trans-111129.9165.5-170.50000107.4V189 A198 H199V189-V192 HydrophobicContact CG1-CG2 3.99Å; V192-A198 HydrophobicContact CG1-CB 3.93Å; V192-H199 HydrophobicContact CG1-CB 3.88Å
193K95.6Very high93.3Very high107 Ų10757.5 Ų57.547%0.46530%0.301SS..  trans-76.4121.1179179.6-175.3170.71750109.1D168 G171 G195 G196 H199D168-K193 IonicContact OD2-NZ 3.37Å; D168-K193 PolarHBondContact OD2-NZ 3.3Å; G171-K193 WeakPolarHBondContact O-CB 3.32Å; G171-K193 PolarHBondContact O-N 3.01Å; K193-G195 PolarHBondContact O-N 3.13Å; K193-G196 PolarHBondContact O-N 2.99Å; K193-H199 VanDerWaalsContact O-CB 3.25Å; K193-H199 WeakPolarHBondContact O-CB 3.5Å
194E95.2Very high93.7Very high161 Ų16156.8 Ų56.875%0.75230%0.296SS*.THydrogen-bonded Turntrans-51.6136.6172.4-169.4173.1-174.300111.5G196E194-G196 PolarHBondContact O-N 3.41Å; E194-G196 VanDerWaalsContact O-N 3.09Å
195G93.4Very high94.1Very high40 Ų4057.4 Ų57.441%0.41230%0.301SS..THydrogen-bonded Turntrans70.8-11.5-174.900000116.9K193 H199 R200K193-G195 PolarHBondContact O-N 3.13Å; G195-H199 PolarHBondContact N-CD2 2.93Å; G195-H199 VanDerWaalsContact N-CD2 3.33Å; G195-R200 WeakPolarHBondContact O-CD 3.46Å; G195-R200 WeakPolarHBondContact O-CG 3.29Å; G195-R200 PolarHBondContact O-NH1 2.82Å
196G94.4Very high94.5Very high7 Ų757.2 Ų57.27%0.07230%0.304CS..SBendtrans-77.5166.1178.100000114.1K193 E194 A198 H199 R200K193-G196 PolarHBondContact O-N 2.99Å; E194-G196 PolarHBondContact O-N 3.41Å; E194-G196 VanDerWaalsContact O-N 3.09Å; G196-A198 PolarHBondContact O-N 2.97Å; G196-H199 WeakPolarHBondContact O-CA 3.41Å; G196-H199 WeakPolarHBondContact O-CB 3.31Å; G196-H199 PolarHBondContact O-N 3.38Å; G196-R200 PolarHBondContact O-N 3.29Å
197A94.8Very high94.5Very high7 Ų757.2 Ų57.26%0.05831%0.305CS..Hα-helixtrans-41.9-56.2-175.100000114.6L164 E166 H199 R200 D201L164-A197 WeakPolarHBondContact O-CB 3.47Å; E166-A197 VanDerWaalsContact OE1-CA 3.27Å; E166-A197 WeakPolarHBondContact OE1-CA 3.44Å; E166-A197 VanDerWaalsContact OE1-CB 3.25Å; E166-A197 WeakPolarHBondContact OE1-CB 3.49Å; E166-A197 PolarHBondContact OE1-N 3.26Å; A197-H199 VanDerWaalsContact C-N 3.32Å; A197-H199 PolarHBondContact O-N 3.33Å; A197-R200 PolarHBondContact O-N 3.41Å; A197-D201 PolarHBondContact O-N 2.92Å
198A95.4Very high94.4Very high0 Ų057.4 Ų57.40%031%0.306CS..Hα-helixtrans-65.2-30.1-179.700000114.1L163 L170 I172 V192 G196 G202 L204L163-A198 HydrophobicContact CD1-CB 3.85Å; L170-A198 WeakPolarHBondContact O-CB 3.33Å; L170-A198 PolarHBondContact O-N 3.46Å; L170-A198 VanDerWaalsContact O-N 3.08Å; I172-A198 HydrophobicContact CG2-CB 3.42Å; I172-A198 VanDerWaalsContact CG2-CB 3.42Å; V192-A198 HydrophobicContact CG1-CB 3.93Å; G196-A198 PolarHBondContact O-N 2.97Å; A198-G202 PolarHBondContact O-N 2.72Å; A198-L204 HydrophobicContact CB-CD2 4.08Å
199H95.6Very high94.4Very high92 Ų9258.9 Ų58.943%0.42631%0.312SS..Hα-helixtrans-73.2-37.8175.1-179.393.2000111.6V192 K193 G195 G196 A197 G202V192-H199 HydrophobicContact CG1-CB 3.88Å; K193-H199 VanDerWaalsContact O-CB 3.25Å; K193-H199 WeakPolarHBondContact O-CB 3.5Å; G195-H199 PolarHBondContact N-CD2 2.93Å; G195-H199 VanDerWaalsContact N-CD2 3.33Å; G196-H199 WeakPolarHBondContact O-CA 3.41Å; G196-H199 WeakPolarHBondContact O-CB 3.31Å; G196-H199 PolarHBondContact O-N 3.38Å; A197-H199 VanDerWaalsContact C-N 3.32Å; A197-H199 PolarHBondContact O-N 3.33Å; H199-G202 PolarHBondContact O-N 3Å
200R95.1Very high94.4Very high152 Ų15259 Ų5957%0.57431%0.312SS*.Hα-helixtrans-74.9-27.6179-58-162.6-47.8-91.2-6.3113.5E166 G195 G196 A197E166-R200 VanDerWaalsContact CD-NH1 3.32Å; E166-R200 IonicContact OE1-CZ 2.62Å; E166-R200 VanDerWaalsContact OE1-CZ 3.26Å; E166-R200 IonicContact OE1-NH1 3.86Å; E166-R200 PolarHBondContact OE1-NH1 3.11Å; E166-R200 IonicContact OE1-NH2 3.39Å; E166-R200 PolarHBondContact OE1-NH2 3.07Å; E166-R200 IonicContact OE2-CZ 3.26Å; E166-R200 IonicContact OE2-NH1 3Å; E166-R200 PolarHBondContact OE2-NH1 2.87Å; E166-R200 IonicContact OE2-NH2 2.72Å; E166-R200 PolarHBondContact OE2-NH2 3.43Å; G195-R200 WeakPolarHBondContact O-CD 3.46Å; G195-R200 WeakPolarHBondContact O-CG 3.29Å; G195-R200 PolarHBondContact O-NH1 2.82Å; G196-R200 PolarHBondContact O-N 3.29Å; A197-R200 PolarHBondContact O-N 3.41Å
201D94.5Very high94.5Very high54 Ų5458.1 Ų58.129%0.28931%0.306SS..Hα-helixtrans-74.4-36.7166.1168.695.2000111.5L163 A197 R203L163-D201 HydrophobicContact CD2-CB 3.44Å; L163-D201 VanDerWaalsContact CD2-CB 3.44Å; A197-D201 PolarHBondContact O-N 2.92Å; D201-R203 PolarHBondContact O-N 2.82Å; D201-R203 VanDerWaalsContact O-N 3.12Å; D201-R203 WeakPolarHBondContact OD1-CD 3.25Å; D201-R203 IonicContact OD1-NH1 3.52Å; D201-R203 PolarHBondContact OD1-NH1 2.62Å; D201-R203 WeakPolarHBondContact OD2-CB 3.27Å; D201-R203 WeakPolarHBondContact OD2-CD 3.46Å; D201-R203 WeakPolarHBondContact OD2-CG 3.38Å; D201-R203 PolarHBondContact OD2-N 3.2Å
202G93.6Very high94.6Very high51 Ų5154.9 Ų54.953%0.52629%0.293SS..  trans72.5-1.3170.600000115.5A198 H199 L204A198-G202 PolarHBondContact O-N 2.72Å; H199-G202 PolarHBondContact O-N 3Å; G202-L204 VanDerWaalsContact C-N 3.33Å
203R93.4Very high94.6Very high115 Ų11553.4 Ų53.443%0.43428%0.284SS..  trans-91.28-178.5-55.7157.153.9-144.31113.4W159 K160 M161 D201W159-R203 VanDerWaalsContact CZ2-O 3.25Å; W159-R203 WeakPolarHBondContact CZ2-O 3.35Å; K160-R203 PolarHBondContact O-NH2 3.31Å; M161-R203 HydrophobicContact CE-CB 4.25Å; M161-R203 WeakPolarHBondContact CE-O 3.49Å; D201-R203 PolarHBondContact O-N 2.82Å; D201-R203 VanDerWaalsContact O-N 3.12Å; D201-R203 WeakPolarHBondContact OD1-CD 3.25Å; D201-R203 IonicContact OD1-NH1 3.52Å; D201-R203 PolarHBondContact OD1-NH1 2.62Å; D201-R203 WeakPolarHBondContact OD2-CB 3.27Å; D201-R203 WeakPolarHBondContact OD2-CD 3.46Å; D201-R203 WeakPolarHBondContact OD2-CG 3.38Å; D201-R203 PolarHBondContact OD2-N 3.2Å
204L94.2Very high94.6Very high8 Ų851 Ų514%0.04228%0.276CS..  trans-122.3127.5178.8-17063.5000110.1M161 I172 V189 A198 G202 D208 L210 V241M161-L204 HydrophobicContact CE-CB 3.91Å; M161-L204 HydrophobicContact CE-CD1 3.98Å; M161-L204 HydrophobicContact CE-CG 4.46Å; M161-L204 HydrophobicContact SD-CB 4.27Å; M161-L204 HydrophobicContact SD-CD1 4.43Å; M161-L204 HydrophobicContact SD-CD2 4.48Å; I172-L204 HydrophobicContact CD1-CD2 4.43Å; I172-L204 HydrophobicContact CG2-CD2 3.76Å; V189-L204 HydrophobicContact CG2-CD1 4.17Å; V189-L204 HydrophobicContact CG2-CD2 4.21Å; V189-L204 HydrophobicContact CG2-CG 4.28Å; A198-L204 HydrophobicContact CB-CD2 4.08Å; G202-L204 VanDerWaalsContact C-N 3.33Å; L204-D208 HydrophobicContact CD1-CB 3.93Å; L204-L210 HydrophobicContact CD1-CD2 4.25Å; L204-V241 HydrophobicContact CD1-CG1 3.74Å; L204-V241 HydrophobicContact CD1-CG2 4.11Å
205S93.1Very high94.6Very high67 Ų6746.4 Ų46.447%0.46927%0.272SS..  trans-118.2163.3-175.5-68.70000112.9G207 D208S205-G207 PolarHBondContact O-N 2.92Å; S205-D208 PolarHBondContact N-OD2 3.39Å; S205-D208 WeakPolarHBondContact O-CB 3.37Å; S205-D208 PolarHBondContact O-N 2.95Å
206L93.9Very high94.7Very high125 Ų12549.7 Ų49.765%0.65428%0.277SS*.THydrogen-bonded Turntrans-64.9127.3169.8-169.4165.8000109.2T190T190-L206 VanDerWaalsContact O-CD1 3.25Å; T190-L206 WeakPolarHBondContact O-CD1 3.43Å; T190-L206 WeakPolarHBondContact O-CG 3.41Å
207G92Very high94.7Very high15 Ų1554.6 Ų54.616%0.15530%0.3CS..THydrogen-bonded Turntrans97.6-7.4-17800000114.6V189 S205V189-G207 PolarHBondContact O-N 2.99Å; S205-G207 PolarHBondContact O-N 2.92Å
208D94.3Very high94.7Very high4 Ų454.2 Ų54.22%0.02130%0.298CS..  trans-68.8142.2170.2-70.2-20.3000111V189 L204 S205 V241 S243V189-D208 PolarHBondContact N-O 2.87Å; L204-D208 HydrophobicContact CD1-CB 3.93Å; S205-D208 PolarHBondContact N-OD2 3.39Å; S205-D208 WeakPolarHBondContact O-CB 3.37Å; S205-D208 PolarHBondContact O-N 2.95Å; D208-V241 HydrophobicContact CB-CG1 3.72Å; D208-S243 WeakPolarHBondContact OD1-CA 3.09Å; D208-S243 WeakPolarHBondContact OD1-CB 3.42Å; D208-S243 PolarHBondContact OD1-OG 3.17Å
209E94.8Very high94.5Very high49 Ų4957.7 Ų57.723%0.22932%0.318CS..EExtended strand (participates in β ladder)trans-100.6125.8-179.4-50.3-160.6165.800111A186 I187 V188 V241 A242A186-E209 WeakPolarHBondContact CB-OE2 3.42Å; I187-E209 CarbonylContact O-C 3.53Å; I187-E209 WeakPolarHBondContact O-CA 3.42Å; V188-E209 HydrophobicContact CG1-CG 4.47Å; V188-E209 HydrophobicContact CG2-CG 4.05Å; E209-V241 WeakPolarHBondContact O-CA 3.48Å; E209-A242 PolarHBondContact N-O 3.29Å; E209-A242 PolarHBondContact O-N 3.36Å
210L95.6Very high94.2Very high2 Ų254.8 Ų54.81%0.0131%0.314CS..EExtended strand (participates in β ladder)trans-84.4113.1176.6-54.5-174.7000109.5I172 V174 I187 V189 L204 I213 L218 L239 V241I172-L210 HydrophobicContact CD1-CD1 4Å; V174-L210 HydrophobicContact CG1-CD1 3.72Å; I187-L210 HydrophobicContact CG2-CB 4.46Å; I187-L210 HydrophobicContact CG2-CD1 4.46Å; I187-L210 PolarHBondContact O-N 3.47Å; V189-L210 HydrophobicContact CG2-CD1 4.36Å; V189-L210 HydrophobicContact CG2-CD2 3.92Å; V189-L210 HydrophobicContact CG2-CG 4.04Å; L204-L210 HydrophobicContact CD1-CD2 4.25Å; L210-I213 HydrophobicContact CD1-CD1 4.34Å; L210-L218 HydrophobicContact CB-CD1 3.77Å; L210-L239 HydrophobicContact CD1-CD2 4.33Å; L210-L239 HydrophobicContact CD2-CD2 4.05Å; L210-V241 HydrophobicContact CD2-CG2 3.89Å
211L95.4Very high94.2Very high35 Ų3549.7 Ų49.718%0.18330%0.297CS..EExtended strand (participates in β ladder)trans-91.4-41.8-178.3-58.8-176.3000112.4I158 L218 V219 V240 A242I158-L211 HydrophobicContact CD1-CD1 4.17Å; I158-L211 HydrophobicContact CG2-CD1 4.09Å; L211-L218 PolarHBondContact O-N 3.08Å; L211-V219 HydrophobicContact CD2-CG2 4.01Å; L211-V240 HydrophobicContact CB-CG1 4.5Å; L211-V240 PolarHBondContact N-O 3.23Å; L211-A242 HydrophobicContact CD1-CB 4.04Å; L211-A242 HydrophobicContact CG-CB 4.26Å
212V96.4Very high94.2Very high31 Ų3148.2 Ų48.219%0.18829%0.292CS..EExtended strand (participates in β ladder)trans-143.7140.9-174.6-175.40000110.4G215 H216 L217 L239 V240V212-G215 VanDerWaalsContact CG1-C 3.49Å; V212-H216 CarbonylContact C-O 3.55Å; V212-H216 VanDerWaalsContact CA-O 3.24Å; V212-H216 WeakPolarHBondContact CA-O 3.32Å; V212-H216 WeakPolarHBondContact CG1-O 3.16Å; V212-L217 HydrophobicContact CG2-CD1 4.04Å; V212-L239 WeakPolarHBondContact O-CA 3.18Å; V212-V240 HydrophobicContact CB-CB 3.83Å; V212-V240 HydrophobicContact CB-CG2 3.76Å; V212-V240 HydrophobicContact CG1-CG2 4.41Å; V212-V240 HydrophobicContact CG2-CB 4.09Å; V212-V240 HydrophobicContact CG2-CG2 4.15Å; V212-V240 PolarHBondContact N-O 3.08Å; V212-V240 PolarHBondContact O-N 3.3Å
213I96.7Very high94.3Very high0 Ų049.6 Ų49.60%028%0.284CS..EExtended strand (participates in β ladder)trans-130.2123.5171.2-65.6-177.6000109.9L210 G215 H216 L218 I229 L230 V237 Q238 L239L210-I213 HydrophobicContact CD1-CD1 4.34Å; I213-G215 PolarHBondContact O-N 2.86Å; I213-G215 VanDerWaalsContact O-N 3.14Å; I213-H216 PolarHBondContact N-O 3.07Å; I213-H216 VanDerWaalsContact O-CB 3.3Å; I213-H216 WeakPolarHBondContact O-CB 3.34Å; I213-H216 PolarHBondContact O-N 2.91Å; I213-H216 PolarHBondContact O-ND1 2.79Å; I213-L218 HydrophobicContact CD1-CD1 3.76Å; I213-L218 HydrophobicContact CG1-CD1 3.92Å; I213-L218 HydrophobicContact CG1-CG 4.46Å; I213-I229 HydrophobicContact CB-CG2 3.99Å; I213-I229 HydrophobicContact CG2-CG2 3.96Å; I213-L230 HydrophobicContact CD1-CD1 4.43Å; I213-L230 HydrophobicContact CD1-CD2 3.41Å; I213-L230 VanDerWaalsContact CD1-CD2 3.41Å; I213-L230 HydrophobicContact CD1-CG 3.6Å; I213-V237 HydrophobicContact CG2-CG1 3.66Å; I213-Q238 CarbonylContact C-O 3.53Å; I213-Q238 WeakPolarHBondContact CA-O 3.42Å; I213-L239 HydrophobicContact CD1-CD2 4.11Å; I213-L239 HydrophobicContact CG1-CD2 4.02Å; I213-L239 HydrophobicContact CG1-CG 4.34Å
214N95.4Very high94.4Very high55 Ų5551.6 Ų51.629%0.29430%0.298SS..THydrogen-bonded Turntrans46.344.7-178.8-70.5-0.1000112.6H216 V237 Q238N214-H216 VanDerWaalsContact C-N 3.28Å; N214-H216 PolarHBondContact O-N 2.85Å; N214-H216 PolarHBondContact O-ND1 3.2Å; N214-V237 WeakPolarHBondContact OD1-CA 3.22Å; N214-Q238 PolarHBondContact N-O 2.86Å; N214-Q238 PolarHBondContact OD1-N 3.33Å
215G94Very high94.4Very high66 Ų6655.5 Ų55.568%0.6832%0.317SS*.THydrogen-bonded Turntrans79.7-10.5-176.700000116.4V212 I213V212-G215 VanDerWaalsContact CG1-C 3.49Å; I213-G215 PolarHBondContact O-N 2.86Å; I213-G215 VanDerWaalsContact O-N 3.14Å
216H95.7Very high94.5Very high109 Ų10952.3 Ų52.351%0.50529%0.294SS..EExtended strand (participates in β ladder)trans-85.1118.7179.5-57.975.1000110.7V212 I213 N214 I229V212-H216 CarbonylContact C-O 3.55Å; V212-H216 VanDerWaalsContact CA-O 3.24Å; V212-H216 WeakPolarHBondContact CA-O 3.32Å; V212-H216 WeakPolarHBondContact CG1-O 3.16Å; I213-H216 PolarHBondContact N-O 3.07Å; I213-H216 VanDerWaalsContact O-CB 3.3Å; I213-H216 WeakPolarHBondContact O-CB 3.34Å; I213-H216 PolarHBondContact O-N 2.91Å; I213-H216 PolarHBondContact O-ND1 2.79Å; N214-H216 VanDerWaalsContact C-N 3.28Å; N214-H216 PolarHBondContact O-N 2.85Å; N214-H216 PolarHBondContact O-ND1 3.2Å; H216-I229 HydrophobicContact CB-CD1 4.12Å; H216-I229 HydrophobicContact CB-CG2 4.21Å
217L95.3Very high94.6Very high109 Ų10948.5 Ų48.557%0.57128%0.276SS*.EExtended strand (participates in β ladder)trans-69.8127175.4-175.173.7000110.3V212 V219 L221V212-L217 HydrophobicContact CG2-CD1 4.04Å; L217-V219 HydrophobicContact CD1-CB 4.19Å; L217-V219 HydrophobicContact CD1-CG2 3.88Å; L217-V219 HydrophobicContact CD2-CB 4.39Å; L217-V219 HydrophobicContact CG-CB 4.11Å; L217-V219 HydrophobicContact CG-CG2 4.32Å; L217-L221 WeakPolarHBondContact O-CD1 3.49Å
218L94.4Very high94.8Very high0 Ų050.2 Ų50.20%029%0.289CS..  trans-92.1-17.7178.1-60.8-173.4000113.7I187 L210 L211 I213 G220 L221 A226 I229I187-L218 HydrophobicContact CB-CD1 4.22Å; I187-L218 HydrophobicContact CG1-CB 4.01Å; I187-L218 HydrophobicContact CG1-CD1 4.28Å; I187-L218 HydrophobicContact CG2-CD1 4.35Å; L210-L218 HydrophobicContact CB-CD1 3.77Å; L211-L218 PolarHBondContact O-N 3.08Å; I213-L218 HydrophobicContact CD1-CD1 3.76Å; I213-L218 HydrophobicContact CG1-CD1 3.92Å; I213-L218 HydrophobicContact CG1-CG 4.46Å; L218-G220 PolarHBondContact O-N 3.38Å; L218-L221 HydrophobicContact CD2-CD1 4.14Å; L218-L221 WeakPolarHBondContact O-CB 3.39Å; L218-L221 PolarHBondContact O-N 3.07Å; L218-L221 VanDerWaalsContact O-N 3.08Å; L218-A226 HydrophobicContact CD2-CB 4.12Å; L218-I229 HydrophobicContact CD2-CB 4.42Å; L218-I229 HydrophobicContact CD2-CD1 3.75Å; L218-I229 HydrophobicContact CD2-CG2 4.34Å
219V92Very high94.8Very high72 Ų7251.3 Ų51.344%0.43629%0.294SS..THydrogen-bonded Turntrans-60121.7-176.3-177.40000110.4H185 L211 L217 L221H185-V219 WeakPolarHBondContact O-CA 3.46Å; L211-V219 HydrophobicContact CD2-CG2 4.01Å; L217-V219 HydrophobicContact CD1-CB 4.19Å; L217-V219 HydrophobicContact CD1-CG2 3.88Å; L217-V219 HydrophobicContact CD2-CB 4.39Å; L217-V219 HydrophobicContact CG-CB 4.11Å; L217-V219 HydrophobicContact CG-CG2 4.32Å; V219-L221 VanDerWaalsContact C-N 3.32Å; V219-L221 PolarHBondContact O-N 3.25Å
220G89Confident94.8Very high32 Ų3250.1 Ų50.133%0.3329%0.289SS..THydrogen-bonded Turntrans80.5-2.5-178.800000116.3H185 L218H185-G220 PolarHBondContact O-N 3Å; L218-G220 PolarHBondContact O-N 3.38Å
221L93.8Very high94.7Very high44 Ų4459.3 Ų59.323%0.2332%0.324CS..  trans-71.5156.9170.5-61.6-171.1000111.3G177 R178 L217 L218 V219 E225 I229G177-L221 CarbonylContact C-O 3.57Å; G177-L221 VanDerWaalsContact CA-O 3.22Å; G177-L221 WeakPolarHBondContact CA-O 3.39Å; R178-L221 PolarHBondContact N-O 3.4Å; L217-L221 WeakPolarHBondContact O-CD1 3.49Å; L218-L221 HydrophobicContact CD2-CD1 4.14Å; L218-L221 WeakPolarHBondContact O-CB 3.39Å; L218-L221 PolarHBondContact O-N 3.07Å; L218-L221 VanDerWaalsContact O-N 3.08Å; V219-L221 VanDerWaalsContact C-N 3.32Å; V219-L221 PolarHBondContact O-N 3.25Å; L221-E225 HydrophobicContact CB-CB 4.16Å; L221-E225 HydrophobicContact CD1-CB 4.3Å; L221-I229 HydrophobicContact CD1-CD1 3.51Å
222S95.3Very high94.7Very high24 Ų2461.7 Ų61.717%0.16834%0.343CS..  trans-69.1163.1166.568.90000111.9E224 E225 A226S222-E224 VanDerWaalsContact C-N 3.3Å; S222-E224 PolarHBondContact O-N 2.77Å; S222-E225 WeakPolarHBondContact CB-OE2 3.3Å; S222-E225 PolarHBondContact N-OE2 2.85Å; S222-E225 PolarHBondContact O-N 3.06Å; S222-E225 VanDerWaalsContact OG-CD 3.28Å; S222-E225 VanDerWaalsContact OG-CG 3.31Å; S222-E225 WeakPolarHBondContact OG-CG 3.42Å; S222-E225 PolarHBondContact OG-N 3.09Å; S222-E225 PolarHBondContact OG-OE2 3.49Å; S222-A226 PolarHBondContact O-N 2.88Å; S222-A226 VanDerWaalsContact O-N 3.13Å
223H95Very high94.5Very high79 Ų7960.4 Ų60.437%0.36634%0.336SS..Hα-helixtrans-56.9-43.3175-17962.4000112.3V174 A226 V227V174-H223 PolarHBondContact O-CE1 3.19Å; V174-H223 VanDerWaalsContact O-CE1 3.29Å; H223-A226 PolarHBondContact O-N 2.91Å; H223-V227 WeakPolarHBondContact O-CB 3.45Å; H223-V227 VanDerWaalsContact O-CG2 3.32Å; H223-V227 WeakPolarHBondContact O-CG2 3.44Å; H223-V227 PolarHBondContact O-N 2.79Å
224E95.8Very high94.4Very high157 Ų15765.5 Ų65.573%0.73437%0.368SS*.Hα-helixtrans-65.8-41.5-178.2-66174.3-163.600112.1S222 V227 A228S222-E224 VanDerWaalsContact C-N 3.3Å; S222-E224 PolarHBondContact O-N 2.77Å; E224-V227 PolarHBondContact O-N 2.9Å; E224-A228 WeakPolarHBondContact O-CB 3.38Å; E224-A228 PolarHBondContact O-N 2.88Å
225E95.6Very high94.4Very high91 Ų9164.8 Ų64.843%0.42537%0.373SS..Hα-helixtrans-63.5-43.6175.3-71.2162.212800111.6L221 S222 A228 I229L221-E225 HydrophobicContact CB-CB 4.16Å; L221-E225 HydrophobicContact CD1-CB 4.3Å; S222-E225 WeakPolarHBondContact CB-OE2 3.3Å; S222-E225 PolarHBondContact N-OE2 2.85Å; S222-E225 PolarHBondContact O-N 3.06Å; S222-E225 VanDerWaalsContact OG-CD 3.28Å; S222-E225 VanDerWaalsContact OG-CG 3.31Å; S222-E225 WeakPolarHBondContact OG-CG 3.42Å; S222-E225 PolarHBondContact OG-N 3.09Å; S222-E225 PolarHBondContact OG-OE2 3.49Å; E225-A228 WeakPolarHBondContact O-CB 3.25Å; E225-A228 PolarHBondContact O-N 3.12Å; E225-I229 WeakPolarHBondContact O-CG1 3.28Å; E225-I229 PolarHBondContact O-N 3.17Å
226A95.3Very high94.5Very high0 Ų068.1 Ų68.10%037%0.373CS..Hα-helixtrans-65.8-39.9176.900000112.6I187 L218 S222 H223 I229 L230I187-A226 HydrophobicContact CD1-CB 3.48Å; I187-A226 VanDerWaalsContact CD1-CB 3.48Å; I187-A226 HydrophobicContact CG1-CB 3.63Å; I187-A226 HydrophobicContact CG2-CB 4.35Å; L218-A226 HydrophobicContact CD2-CB 4.12Å; S222-A226 PolarHBondContact O-N 2.88Å; S222-A226 VanDerWaalsContact O-N 3.13Å; H223-A226 PolarHBondContact O-N 2.91Å; A226-I229 PolarHBondContact O-N 2.87Å; A226-L230 WeakPolarHBondContact O-CB 3.39Å; A226-L230 PolarHBondContact O-N 2.99Å
227V94.9Very high94.5Very high44 Ų4463 Ų6327%0.26735%0.348SS..Hα-helixtrans-67.7-35.2173.9170.20000111.4V174 H223 E224 L230 R231V174-V227 HydrophobicContact CG2-CG2 4.15Å; H223-V227 WeakPolarHBondContact O-CB 3.45Å; H223-V227 VanDerWaalsContact O-CG2 3.32Å; H223-V227 WeakPolarHBondContact O-CG2 3.44Å; H223-V227 PolarHBondContact O-N 2.79Å; E224-V227 PolarHBondContact O-N 2.9Å; V227-L230 PolarHBondContact O-N 3.3Å; V227-R231 HydrophobicContact CG1-CG 4.36Å; V227-R231 WeakPolarHBondContact O-CB 3.39Å; V227-R231 VanDerWaalsContact O-CG 3.29Å; V227-R231 WeakPolarHBondContact O-CG 3.4Å; V227-R231 PolarHBondContact O-N 3.15Å
228A95.7Very high94.6Very high51 Ų5162.8 Ų62.842%0.42135%0.345SS..Hα-helixtrans-63.2-44.217300000111.5E224 E225 R231 S232E224-A228 WeakPolarHBondContact O-CB 3.38Å; E224-A228 PolarHBondContact O-N 2.88Å; E225-A228 WeakPolarHBondContact O-CB 3.25Å; E225-A228 PolarHBondContact O-N 3.12Å; A228-R231 PolarHBondContact O-N 3.44Å; A228-S232 WeakPolarHBondContact O-CB 3.22Å; A228-S232 PolarHBondContact O-N 2.92Å; A228-S232 PolarHBondContact O-OG 2.86Å
229I95.4Very high94.7Very high28 Ų2862.9 Ų62.914%0.14435%0.345CS..Hα-helixtrans-59.7-52174.2-67.4163.1000110.4I213 H216 L218 L221 E225 A226 R231 S232 A233I213-I229 HydrophobicContact CB-CG2 3.99Å; I213-I229 HydrophobicContact CG2-CG2 3.96Å; H216-I229 HydrophobicContact CB-CD1 4.12Å; H216-I229 HydrophobicContact CB-CG2 4.21Å; L218-I229 HydrophobicContact CD2-CB 4.42Å; L218-I229 HydrophobicContact CD2-CD1 3.75Å; L218-I229 HydrophobicContact CD2-CG2 4.34Å; L221-I229 HydrophobicContact CD1-CD1 3.51Å; E225-I229 WeakPolarHBondContact O-CG1 3.28Å; E225-I229 PolarHBondContact O-N 3.17Å; A226-I229 PolarHBondContact O-N 2.87Å; I229-R231 VanDerWaalsContact C-N 3.28Å; I229-R231 PolarHBondContact O-N 2.99Å; I229-S232 WeakPolarHBondContact CA-OG 3.31Å; I229-S232 PolarHBondContact O-N 2.86Å; I229-S232 VanDerWaalsContact O-N 3.11Å; I229-S232 PolarHBondContact O-OG 3.38Å; I229-A233 PolarHBondContact O-N 2.88Å; I229-A233 VanDerWaalsContact O-N 3.07Å
230L94.4Very high95Very high24 Ų2460.9 Ų60.913%0.12633%0.333CS..Hα-helixtrans-53.8-38.9175.8-84.2160.9000113.7L170 I172 V174 I213 A226 V227L170-L230 HydrophobicContact CD1-CD2 3.83Å; I172-L230 HydrophobicContact CD1-CD2 4.22Å; V174-L230 HydrophobicContact CG1-CD1 4.19Å; V174-L230 HydrophobicContact CG2-CD1 3.77Å; I213-L230 HydrophobicContact CD1-CD1 4.43Å; I213-L230 HydrophobicContact CD1-CD2 3.41Å; I213-L230 VanDerWaalsContact CD1-CD2 3.41Å; I213-L230 HydrophobicContact CD1-CG 3.6Å; A226-L230 WeakPolarHBondContact O-CB 3.39Å; A226-L230 PolarHBondContact O-N 2.99Å; V227-L230 PolarHBondContact O-N 3.3Å
231R94Very high95.3Very high194 Ų19459.4 Ų59.473%0.73232%0.318SS*.Hα-helixtrans-79-29.9178.4-73.1178.367.1-105.3-2.4113.3V227 A228 I229V227-R231 HydrophobicContact CG1-CG 4.36Å; V227-R231 WeakPolarHBondContact O-CB 3.39Å; V227-R231 VanDerWaalsContact O-CG 3.29Å; V227-R231 WeakPolarHBondContact O-CG 3.4Å; V227-R231 PolarHBondContact O-N 3.15Å; A228-R231 PolarHBondContact O-N 3.44Å; I229-R231 VanDerWaalsContact C-N 3.28Å; I229-R231 PolarHBondContact O-N 2.99Å
232S94.2Very high95.3Very high85 Ų8558 Ų5859%0.59431%0.313SS*.Hα-helixtrans-76-24.317871.80000113.1A228 I229A228-S232 WeakPolarHBondContact O-CB 3.22Å; A228-S232 PolarHBondContact O-N 2.92Å; A228-S232 PolarHBondContact O-OG 2.86Å; I229-S232 WeakPolarHBondContact CA-OG 3.31Å; I229-S232 PolarHBondContact O-N 2.86Å; I229-S232 VanDerWaalsContact O-N 3.11Å; I229-S232 PolarHBondContact O-OG 3.38Å
233A93.5Very high95.1Very high5 Ų558.7 Ų58.74%0.04132%0.317CS..  trans-65.4137.7175.500000111.7K165 I229 V237K165-A233 WeakPolarHBondContact CD-O 3.41Å; K165-A233 WeakPolarHBondContact CE-O 3.25Å; I229-A233 PolarHBondContact O-N 2.88Å; I229-A233 VanDerWaalsContact O-N 3.07Å; A233-V237 HydrophobicContact CB-CG1 4.06Å; A233-V237 HydrophobicContact CB-CG2 3.8Å
234T93.6Very high94.4Very high107 Ų10758.2 Ų58.266%0.65631%0.314SS*.  trans-141.1154.5-178.754.20000110.3
235G94.8Very high92.6Very high39 Ų3957.9 Ų57.940%0.40231%0.314SS..SBendtrans66.1-133.7-17600000112.2K165K165-G235 WeakPolarHBondContact CB-O 3.46Å; K165-G235 PolarHBondContact N-O 3.29Å
236M96Very high90.9Very high137 Ų13759.1 Ų59.168%0.67532%0.323SS*.EExtended strand (participates in β ladder)trans-75.4130.8174.6-59.4-174.4-158.300110.6L164L164-M236 HydrophobicContact CD1-CG 4.26Å
237V96.9Very high88.7Confident0 Ų061.7 Ų61.70%035%0.35CS..EExtended strand (participates in β ladder)trans-113.5115178.9-171.90000109.2E162 L163 K165 L170 I213 N214 A233 L239E162-V237 WeakPolarHBondContact CA-O 3.21Å; L163-V237 PolarHBondContact N-O 3.42Å; L163-V237 PolarHBondContact O-N 2.91Å; K165-V237 HydrophobicContact CB-CG2 3.97Å; L170-V237 HydrophobicContact CD1-CB 4.4Å; L170-V237 HydrophobicContact CD1-CG1 4.18Å; L170-V237 HydrophobicContact CD1-CG2 4.49Å; L170-V237 HydrophobicContact CD2-CB 4.11Å; L170-V237 HydrophobicContact CD2-CG2 3.99Å; I213-V237 HydrophobicContact CG2-CG1 3.66Å; N214-V237 WeakPolarHBondContact OD1-CA 3.22Å; A233-V237 HydrophobicContact CB-CG1 4.06Å; A233-V237 HydrophobicContact CB-CG2 3.8Å; V237-L239 HydrophobicContact CG1-CD1 4.26Å; V237-L239 HydrophobicContact CG1-CG 4.37Å; V237-L239 WeakPolarHBondContact O-CD1 3.15Å
238Q97.3Very high86.1Confident106 Ų10665.3 Ų65.350%0.49538%0.377SS..EExtended strand (participates in β ladder)trans-82.1120.4174.9-57.4-170.8-36.600109.3E162 I213 N214E162-Q238 HydrophobicContact CG-CG 4.13Å; E162-Q238 WeakPolarHBondContact OE1-CG 3.17Å; E162-Q238 PolarHBondContact OE1-NE2 3.5Å; I213-Q238 CarbonylContact C-O 3.53Å; I213-Q238 WeakPolarHBondContact CA-O 3.42Å; N214-Q238 PolarHBondContact N-O 2.86Å; N214-Q238 PolarHBondContact OD1-N 3.33Å
239L97Very high83.5Confident2 Ų271.4 Ų71.41%0.0140%0.397CS..EExtended strand (participates in β ladder)trans-114141.4174.4-55.7102.6000111.1K160 M161 L163 L210 V212 I213 V237 V241K160-L239 WeakPolarHBondContact CA-O 3.19Å; M161-L239 HydrophobicContact CG-CB 3.81Å; M161-L239 HydrophobicContact CG-CD1 4.04Å; M161-L239 PolarHBondContact N-O 2.95Å; M161-L239 PolarHBondContact O-N 3.33Å; M161-L239 HydrophobicContact SD-CB 4.47Å; M161-L239 HydrophobicContact SD-CD1 4.27Å; L163-L239 HydrophobicContact CB-CD1 4.23Å; L163-L239 HydrophobicContact CD1-CD1 3.9Å; L163-L239 HydrophobicContact CG-CD1 4.03Å; L210-L239 HydrophobicContact CD1-CD2 4.33Å; L210-L239 HydrophobicContact CD2-CD2 4.05Å; V212-L239 WeakPolarHBondContact O-CA 3.18Å; I213-L239 HydrophobicContact CD1-CD2 4.11Å; I213-L239 HydrophobicContact CG1-CD2 4.02Å; I213-L239 HydrophobicContact CG1-CG 4.34Å; V237-L239 HydrophobicContact CG1-CD1 4.26Å; V237-L239 HydrophobicContact CG1-CG 4.37Å; V237-L239 WeakPolarHBondContact O-CD1 3.15Å; L239-V241 HydrophobicContact CB-CG2 4Å
240V96.8Very high80.8Confident30 Ų3078 Ų7818%0.18243%0.427CS..EExtended strand (participates in β ladder)trans-108.7124.7162.9-172.50000107.5I158 W159 K160 L211 V212I158-V240 HydrophobicContact CG2-CG1 3.93Å; W159-V240 WeakPolarHBondContact O-CA 3.48Å; K160-V240 HydrophobicContact CD-CG2 4.31Å; K160-V240 HydrophobicContact CG-CG2 4.13Å; L211-V240 HydrophobicContact CB-CG1 4.5Å; L211-V240 PolarHBondContact N-O 3.23Å; V212-V240 HydrophobicContact CB-CB 3.83Å; V212-V240 HydrophobicContact CB-CG2 3.76Å; V212-V240 HydrophobicContact CG1-CG2 4.41Å; V212-V240 HydrophobicContact CG2-CB 4.09Å; V212-V240 HydrophobicContact CG2-CG2 4.15Å; V212-V240 PolarHBondContact N-O 3.08Å; V212-V240 PolarHBondContact O-N 3.3Å
241V95.9Very high78.3Confident0 Ų082 Ų820%046%0.457CS..EExtended strand (participates in β ladder)trans-127.8138.1-168-177.20000109.1I158 W159 M161 L204 D208 E209 L210 L239I158-V241 CarbonylContact C-O 3.5Å; I158-V241 VanDerWaalsContact CA-O 3.3Å; I158-V241 WeakPolarHBondContact CA-O 3.46Å; W159-V241 HydrophobicContact CH2-CG1 4.13Å; W159-V241 HydrophobicContact CZ2-CB 4.21Å; W159-V241 HydrophobicContact CZ2-CG1 3.81Å; W159-V241 PolarHBondContact N-O 3.17Å; W159-V241 PolarHBondContact O-N 3.3Å; M161-V241 HydrophobicContact CE-CG2 3.95Å; M161-V241 HydrophobicContact CG-CG2 4.3Å; M161-V241 HydrophobicContact SD-CG2 4.18Å; L204-V241 HydrophobicContact CD1-CG1 3.74Å; L204-V241 HydrophobicContact CD1-CG2 4.11Å; D208-V241 HydrophobicContact CB-CG1 3.72Å; E209-V241 WeakPolarHBondContact O-CA 3.48Å; L210-V241 HydrophobicContact CD2-CG2 3.89Å; L239-V241 HydrophobicContact CB-CG2 4Å
242A94.1Very high75.6Confident15 Ų1581.1 Ų81.112%0.12446%0.462CS..EExtended strand (participates in β ladder)trans-110.4122.7166.600000108.9R157 I158 E209 L211R157-A242 WeakPolarHBondContact O-CA 3.41Å; I158-A242 HydrophobicContact CG1-CB 3.94Å; E209-A242 PolarHBondContact N-O 3.29Å; E209-A242 PolarHBondContact O-N 3.36Å; L211-A242 HydrophobicContact CD1-CB 4.04Å; L211-A242 HydrophobicContact CG-CB 4.26Å
243S91.4Very high73.1Confident38 Ų3883.6 Ų83.627%0.26647%0.468SS..  trans-74.4140.9163.8-159.40000109.4G156 R157 D208G156-S243 CarbonylContact C-O 3.57Å; G156-S243 WeakPolarHBondContact CA-O 3.25Å; R157-S243 PolarHBondContact O-N 2.72Å; D208-S243 WeakPolarHBondContact OD1-CA 3.09Å; D208-S243 WeakPolarHBondContact OD1-CB 3.42Å; D208-S243 PolarHBondContact OD1-OG 3.17Å
244K79.3Confident70.8Confident69 Ų6989.7 Ų89.730%0.351%0.505SS..  trans-83.7119.8161.7-170.9162.3-170.3158.70108.4L246K244-L246 HydrophobicContact CB-CG 4.44Å; K244-L246 HydrophobicContact CD-CD2 4.08Å; K244-L246 HydrophobicContact CG-CD2 4.14Å; K244-L246 HydrophobicContact CG-CG 4.2Å; K244-L246 PolarHBondContact O-N 3.39Å
245M58.5Low68Low150 Ų15087.2 Ų87.274%0.73950%0.5SS*.  trans-73.277.8173.2-173.6178.3171.900109.5G247M245-G247 PolarHBondContact O-N 3.38Å
246L59.2Low65.1Low117 Ų11791.2 Ų91.261%0.61352%0.522SS*.  trans-65.7113.5174.4-70.7170.3000109.2K244K244-L246 HydrophobicContact CB-CG 4.44Å; K244-L246 HydrophobicContact CD-CD2 4.08Å; K244-L246 HydrophobicContact CG-CD2 4.14Å; K244-L246 HydrophobicContact CG-CG 4.2Å; K244-L246 PolarHBondContact O-N 3.39Å
247G49.3Very low62.2Low54 Ų5490.5 Ų90.556%0.55753%0.531SS*.  trans-55.1138.1154.800000109M245 E249M245-G247 PolarHBondContact O-N 3.38Å; G247-E249 VanDerWaalsContact C-N 3.33Å; G247-E249 PolarHBondContact O-N 2.89Å
248S40Very low59.4Low120 Ų120100 Ų10084%0.83958%0.575SS**  trans-74.978.7-169.255.90000112.6
249E42.6Very low56.5Low179 Ų179102.1 Ų102.184%0.83659%0.585SS**  trans-99.598.8177.4-68.1-67.5130.400111.3G247G247-E249 VanDerWaalsContact C-N 3.33Å; G247-E249 PolarHBondContact O-N 2.89Å
250E37.9Very low53.7Low166 Ų166107.9 Ų107.978%0.77663%0.625SS**  trans51.7105.2158.2-149.9165.311400120Q252E250-Q252 PolarHBondContact O-N 2.79Å
251S41.5Very low51.1Low110 Ų110115 Ų11577%0.76965%0.654SS**  trans-64116.1157.950.50000111.2D253S251-D253 VanDerWaalsContact C-N 3.34Å; S251-D253 PolarHBondContact O-N 2.68Å
252Q38.7Very low48.1Very low175 Ų175118.4 Ų118.482%0.81869%0.688SS**  trans-75.885.1169.1-68.2-160.2-44.400111.1E250E250-Q252 PolarHBondContact O-N 2.79Å
253D40.8Very low45.3Very low137 Ų137125.3 Ų125.373%0.73372%0.723SS**  trans-71.9125.1157.8-179.713.8000109.3S251 G255S251-D253 VanDerWaalsContact C-N 3.34Å; S251-D253 PolarHBondContact O-N 2.68Å; D253-G255 PolarHBondContact OD1-N 2.79Å
254V44.2Very low42.5Very low133 Ų133130.7 Ų130.781%0.80675%0.749SS**  trans-138.443.5170.5-160.70000109.7S256V254-S256 PolarHBondContact O-N 3.15Å
255G36.5Very low40.7Very low55 Ų55134.3 Ų134.357%0.56777%0.771SS**  trans-75.9115.916600000111.5D253D253-G255 PolarHBondContact OD1-N 2.79Å
256S33.3Very low39.5Very low122 Ų122135.9 Ų135.985%0.85378%0.777SS**  trans166.4115.8140.5-79.60000113.4V254V254-S256 PolarHBondContact O-N 3.15Å
257S34.8Very low38.4Very low123 Ų123135.1 Ų135.186%0.8678%0.781SS**  trans-157.774.4152.365.60000110.2
258E38.6Very low38.2Very low198 Ų198137.6 Ų137.693%0.92579%0.787SS**  trans-81.6133.2172.3-62.3-171.5131.600110.6
259E36.1Very low38Very low151 Ų151141 Ų14171%0.70679%0.787SS**  trans-113.3114.6163-177.5173.617800109.9K261E259-K261 IonicContact OE1-NZ 2.82Å; E259-K261 PolarHBondContact OE1-NZ 3.33Å
260S38.5Very low37.7Very low124 Ų124142 Ų14287%0.86779%0.792SS**  trans-156.8126.3161.8-830000110.2
261K42Very low37.5Very low180 Ų180137.9 Ų137.978%0.78379%0.794SS**  trans-96.1128.2-179.2-67.3168.9178.4108.90109.1E259E259-K261 IonicContact OE1-NZ 2.82Å; E259-K261 PolarHBondContact OE1-NZ 3.33Å
262G32.8Very low37.3Very low70 Ų70140.9 Ų140.972%0.72280%0.801SS**  trans-149.352-163.300000117.4
263N34.8Very low37.4Very low160 Ų160137 Ų13786%0.85679%0.793SS**  trans65.3139.2147.5-53.9-21.8000122.9
264N33Very low37.6Very low151 Ų151140.3 Ų140.381%0.80780%0.801SS**  trans100.4152.4143-138-1.4000119.8
265L42.5Very low37.9Very low146 Ų146141.2 Ų141.276%0.76480%0.798SS**  trans-111.6154.1-167.2-51.789.4000112
266E31.7Very low38.3Very low182 Ų182147.8 Ų147.885%0.8581%0.811SS**  -162172.2119.8-156.965.2123.400109.2
267S36.8Very low38.7Very low102 Ų102149.7 Ų149.771%0.71381%0.811SS**  trans-122.5-162.9179.7-50.50000110.4
268P46.1Very low38.9Very low105 Ų105153 Ų15368%0.68281%0.81SS**  cis-139164.2-15.638-19.4000117.2
269K34.5Very low38.8Very low193 Ų193149 Ų14984%0.83980%0.804SS**  trans70.2151.7140.6-78.3169.9-176.7173.90123.6
270Q36.4Very low39.2Very low200 Ų200152.9 Ų152.994%0.93581%0.812SS**  trans73.3136.7157.3-76.4177.1-15.400120.1
271G34.5Very low39.3Very low79 Ų79155.4 Ų155.481%0.81482%0.815SS**  trans151.672174.500000115.2S273G271-S273 PolarHBondContact O-N 2.88Å
272N36.7Very low39.3Very low172 Ų172152.4 Ų152.492%0.9282%0.817SS**  trans-74.3120.5174.6-104.8-39.7000111.2
273S41.2Very low39.7Very low94 Ų94152.7 Ų152.766%0.65782%0.82SS**  trans-147.7112.7162.7-169.70000113.1G271 M275G271-S273 PolarHBondContact O-N 2.88Å; S273-M275 PolarHBondContact O-N 3.42Å
274K44.9Very low39.8Very low207 Ų207148.4 Ų148.490%0.981%0.813SS**  trans-91.180.1173.6-73.4179.2178172.20110.7K276K274-K276 PolarHBondContact O-N 3.4Å
275M49.9Very low40.2Very low151 Ų151147.7 Ų147.774%0.74481%0.814SS**  trans-87.899.916958.7177.470.700111.7S273 L277S273-M275 PolarHBondContact O-N 3.42Å; M275-L277 PolarHBondContact O-N 3.47Å
276K44.9Very low39.9Very low194 Ų194149.9 Ų149.984%0.84382%0.82SS**  trans-88.483-179.7-169.9159.165.3175.90110.7K274 K278K274-K276 PolarHBondContact O-N 3.4Å; K276-K278 PolarHBondContact O-N 3.33Å
277L41.6Very low40.2Very low162 Ų162152.1 Ų152.185%0.84882%0.821SS**  trans-59.8114.9179-98.6164.6000111.4M275 S279M275-L277 PolarHBondContact O-N 3.47Å; L277-S279 PolarHBondContact O-N 3.36Å
278K39.5Very low40.3Very low191 Ų191154 Ų15483%0.8382%0.822SS**  trans-81.989.8179.3-65.7175.6-178.3173.30109.7K276 R280K276-K278 PolarHBondContact O-N 3.33Å; K278-R280 PolarHBondContact O-N 3.29Å
279S37.1Very low39.9Very low115 Ų115156.2 Ų156.280%0.80482%0.823SS**  trans-63.3106.7167.3-174.50000109.5L277L277-S279 PolarHBondContact O-N 3.36Å
280R43.7Very low40.2Very low232 Ų232151.1 Ų151.188%0.87581%0.812SS**  trans-90.8113.8169.5-93.5-178.6161.1155.1-7.3108K278 S282K278-R280 PolarHBondContact O-N 3.29Å; R280-S282 PolarHBondContact O-N 3.16Å; R280-S282 VanDerWaalsContact O-N 3.1Å
281L41.6Very low40.2Very low178 Ų178147.2 Ų147.293%0.93280%0.801SS**  trans-60112.2168.5-68168.7000109.2
282S41Very low40.2Very low117 Ų117152.4 Ų152.482%0.81880%0.804SS**  trans-117.9120.7164-171.20000107.1R280 G284R280-S282 PolarHBondContact O-N 3.16Å; R280-S282 VanDerWaalsContact O-N 3.1Å; S282-G284 PolarHBondContact O-N 2.8Å
283G40.4Very low40.8Very low76 Ų76151.8 Ų151.878%0.78480%0.796SS**  trans-81.5105.9-168.700000113.1
284G37.9Very low41.2Very low69 Ų69156.5 Ų156.571%0.71180%0.801SS**  trans-83119.4160.500000110.3S282S282-G284 PolarHBondContact O-N 2.8Å
285V41.7Very low40.9Very low137 Ų137153.8 Ų153.883%0.8380%0.796SS**  trans-100.9108.6174.4-179.70000108.6R287V285-R287 PolarHBondContact O-N 3.49Å
286H36.5Very low40.8Very low192 Ų192154.2 Ų154.289%0.88980%0.796SS**  trans-65.1132.7169-67.5-105.3000109.4
287R36.5Very low40.5Very low228 Ų228153.1 Ų153.186%0.8680%0.799SS**  trans-137.2123.7172.1176.9177.6172.7173.4-3107.9V285V285-R287 PolarHBondContact O-N 3.49Å
288L38.7Very low40.5Very low142 Ų142152.3 Ų152.374%0.74379%0.792SS**  trans-87.1147.8173.7-76.6167.6000110.9
289E38.9Very low40.8Very low152 Ų152149.4 Ų149.471%0.7179%0.79SS**  trans67.3153.2141.4-75.3-176.9-12700120.4
290S39.7Very low41.1Very low85 Ų85153.3 Ų153.359%0.59479%0.787SS**  cis-153.6164.70.6-126.60000113.7
291V37.8Very low41Very low119 Ų119149.5 Ų149.572%0.72179%0.785SS**  trans54.1117.61531790000120.5
292E33.8Very low40.8Very low187 Ų187144.7 Ų144.787%0.87478%0.778SS**  -166.892.5120-100.7167.1-153.900104.7
293E50.3Low41Very low159 Ų159145.6 Ų145.674%0.74377%0.773SS**  59.7136.993.9-153175.1-153.900114.7
294Y48.1Very low41.3Very low193 Ų193147.1 Ų147.176%0.75777%0.769SS**  trans65.3107.1-169.9-63-93.2000116.3
295N39.4Very low41.7Very low150 Ų150154.5 Ų154.580%0.80278%0.776SS**  -169.2116117.7-98.8-59.5000113.1
296E48.2Very low41.6Very low160 Ų160155.8 Ų155.875%0.74878%0.776SS**  trans33.7120.1148.5-54-167.2153.700122.5M298E296-M298 PolarHBondContact O-N 3.08Å
297L39.3Very low42.1Very low171 Ų171158.2 Ų158.290%0.89578%0.778SS**  trans-77.294.7165.1-70.1169.1000111.7V299L297-V299 PolarHBondContact O-N 3.03Å
298M41.4Very low42.1Very low145 Ų145156.4 Ų156.471%0.71478%0.781SS**  trans-76.681.3166-73.1-150.3-163.300112.1E296 R300E296-M298 PolarHBondContact O-N 3.08Å; M298-R300 PolarHBondContact O-N 2.88Å
299V45.6Very low42.3Very low130 Ų130157 Ų15779%0.78878%0.784SS**  trans-75112.8163179.90000108.7L297L297-V299 PolarHBondContact O-N 3.03Å
300R42.7Very low42.5Very low197 Ų197157.8 Ų157.874%0.74379%0.788SS**  trans-83.7126175-80.7-77.2167.5128.1-3.1111M298M298-R300 PolarHBondContact O-N 2.88Å
301N42.5Very low42.4Very low153 Ų153160 Ų16082%0.81880%0.797SS**SBendtrans72.2108.6161.7-48.3-9.7000115.9
302G36.7Very low42.6Very low76 Ų76158.9 Ų158.978%0.78480%0.795SS**  trans160.866.5172.900000114.4
303D45.5Very low43.3Very low136 Ų136162.4 Ų162.473%0.72780%0.8SS**  trans-72.5126.8170.3-177.615.5000109.6R305D303-R305 PolarHBondContact OD1-N 2.74Å
304P45.7Very low42.8Very low108 Ų108160.4 Ų160.470%0.70180%0.795SS**  -143.8108.3116.534.8-18.8000114.6I306P304-I306 PolarHBondContact O-N 2.8Å; P304-I306 VanDerWaalsContact O-N 3.16Å
305R46Very low42.9Very low225 Ų225155 Ų15585%0.84980%0.797SS**  trans2776.7132.6-62.5179.2165.3-155.2-3117.8D303D303-R305 PolarHBondContact OD1-N 2.74Å
306I39.8Very low43.3Very low164 Ų164157.5 Ų157.584%0.84180%0.795SS**  trans-125.5134.2152.4-67.4-173.3000109.9P304 M308P304-I306 PolarHBondContact O-N 2.8Å; P304-I306 VanDerWaalsContact O-N 3.16Å; I306-M308 PolarHBondContact O-N 2.78Å
307R47.3Very low43.2Very low243 Ų243159.3 Ų159.392%0.91780%0.801SS**  trans-78.3104.8-177.9-54.3176.6-167.6-132.83.8109.2L309R307-L309 PolarHBondContact O-N 3.46Å
308M36.9Very low43.6Very low189 Ų189160.4 Ų160.493%0.93180%0.801SS**  trans-77.9113.1167.8-161.3171.175.100108.5I306I306-M308 PolarHBondContact O-N 2.78Å
309L42.9Very low44Very low154 Ų154158.7 Ų158.781%0.80680%0.803SS**  trans-71.3136.6-170.9-169.268.6000111.6R307 V311R307-L309 PolarHBondContact O-N 3.46Å; L309-V311 PolarHBondContact O-N 2.91Å; L309-V311 VanDerWaalsContact O-N 3.17Å
310E42.7Very low44.3Very low170 Ų170160.2 Ų160.279%0.79481%0.806SS**  trans-68.2107.8177.9-173.9178.9176.300111.1S312E310-S312 PolarHBondContact O-N 3Å
311V37.5Very low44.4Very low130 Ų130156.8 Ų156.879%0.78881%0.809SS**  trans-85.893.5173.4-810000110.6L309 R313L309-V311 PolarHBondContact O-N 2.91Å; L309-V311 VanDerWaalsContact O-N 3.17Å; V311-R313 PolarHBondContact O-N 3Å
312S42.7Very low44.6Very low96 Ų96158.2 Ų158.267%0.67181%0.811SS**  trans-53124.9176.4-53.70000111.9E310 D314E310-S312 PolarHBondContact O-N 3Å; S312-D314 PolarHBondContact O-N 3.06Å
313R48.6Very low45.3Very low261 Ų261161.7 Ų161.799%0.98581%0.811SS**  trans-78.762.8173.9-68.4-176.5174.6-174.7-0.6111.4V311V311-R313 PolarHBondContact O-N 3Å
314D39.9Very low45.3Very low118 Ų118162.6 Ų162.663%0.63182%0.815SS**  trans-94.8122.2177.2-16112.2000111.8S312 R316S312-D314 PolarHBondContact O-N 3.06Å; D314-R316 PolarHBondContact O-N 2.94Å; D314-R316 IonicContact OD2-NH2 3.29Å
315G50.6Low45Very low78 Ų78163.5 Ų163.580%0.80481%0.814SS**  trans-86.786.5-163.400000113.9
316R46.5Very low45.1Very low203 Ų203158.8 Ų158.877%0.76682%0.816SS**  trans-118.3143171.9-67.3-174.4-172.5164.310.9113.3D314D314-R316 PolarHBondContact O-N 2.94Å; D314-R316 IonicContact OD2-NH2 3.29Å
317K46.8Very low45.4Very low199 Ų199157 Ų15787%0.86581%0.813SS**  trans-65138.7-175.8-60.5-70.6-174.9176.30110.3S319K317-S319 PolarHBondContact O-N 3.19Å
318H47Very low45.5Very low194 Ų194149.5 Ų149.590%0.89881%0.81SS**  trans-66.599.9177.3-47.4-74.4000111.5
319S49.2Very low45.8Very low108 Ų108146.8 Ų146.876%0.75580%0.804SS**PPolyproline II helixtrans-79.4135.3156.251.80000109.1K317K317-S319 PolarHBondContact O-N 3.19Å
320L53.2Low46.1Very low163 Ų163145.6 Ų145.685%0.85381%0.809SS**PPolyproline II helixtrans-59.6139.6174.5-76.2161.2000110.8Q322L320-Q322 PolarHBondContact O-N 2.87Å
321P45.2Very low46.3Very low124 Ų124144 Ų14481%0.80580%0.802SS**PPolyproline II helixtrans-67.2125.317128.4-32.9000109.6
322Q47Very low47.1Very low183 Ų183145.3 Ų145.386%0.85580%0.799SS**PPolyproline II helixtrans-78.2124.7166.2-74.5-175.6-79.700109.2L320L320-Q322 PolarHBondContact O-N 2.87Å
323L51.4Low47.2Very low149 Ų149148.6 Ų148.678%0.7880%0.798SS**PPolyproline II helixtrans-73.9134.1167.7-167.678.9000109.1
324L44.9Very low47Very low155 Ų155143.5 Ų143.581%0.81279%0.785SS**  trans-139.189.7172.2-87.1171.1000109.5
325D38.3Very low47.9Very low127 Ų127145.2 Ų145.268%0.67979%0.793SS**  trans-83.5124.2166.5-74.7-48.6000109.9T327D325-T327 VanDerWaalsContact C-N 3.32Å; D325-T327 PolarHBondContact O-N 2.86Å
326S48.6Very low48.2Very low127 Ų127147.2 Ų147.289%0.88879%0.789SS**  trans-78.570.6-174.2-640000113.3
327T45.3Very low48.7Very low127 Ų127147 Ų14778%0.77979%0.794SS**  trans-128.1123.5162.254.10000110.7D325 T329D325-T327 VanDerWaalsContact C-N 3.32Å; D325-T327 PolarHBondContact O-N 2.86Å; T327-T329 PolarHBondContact O-N 3.03Å
328G51.3Low49.2Very low84 Ų84146.4 Ų146.487%0.86679%0.791SS**  trans-86.9103.3-165.600000114.3
329T41.8Very low49.2Very low132 Ų132142.9 Ų142.981%0.8179%0.788SS**  trans-130.5114.8150.450.40000109.4T327 Q331T327-T329 PolarHBondContact O-N 3.03Å; T329-Q331 PolarHBondContact O-N 3.35Å
330S49.3Very low49.4Very low129 Ų129144 Ų14490%0.90279%0.791SS**  trans-78.5105.7178.3-171.80000109.6
331Q47.9Very low49.4Very low138 Ų138146.4 Ų146.465%0.64579%0.788SS**  trans-98.7100.7176.4-164.2168.740.500109.6T329 Y333T329-Q331 PolarHBondContact O-N 3.35Å; Q331-Y333 HydrophobicContact CB-CD2 4.46Å; Q331-Y333 HydrophobicContact CB-CE2 3.9Å; Q331-Y333 VanDerWaalsContact CD-OH 3.26Å; Q331-Y333 HydrophobicContact CG-CD2 4.31Å; Q331-Y333 HydrophobicContact CG-CE2 3.64Å; Q331-Y333 WeakPolarHBondContact O-CD2 2.82Å; Q331-Y333 PolarHBondContact O-N 3.17Å; Q331-Y333 PolarHBondContact OE1-OH 3.36Å
332E53.4Low49.2Very low156 Ų156145.6 Ų145.673%0.72979%0.786SS**  trans-74.7112.1-178.5-170.7177.7170.600111.4H334E332-H334 IonicContact OE1-CE1 3.12Å; E332-H334 PolarHBondContact OE1-CE1 2.91Å; E332-H334 IonicContact OE1-ND1 3.4Å; E332-H334 PolarHBondContact OE1-ND1 3.38Å
333Y44Very low49.3Very low166 Ų166143.7 Ų143.765%0.65178%0.781SS**  trans-98.3100.9177.5-75.6-86.7000111.3Q331 I335Q331-Y333 HydrophobicContact CB-CD2 4.46Å; Q331-Y333 HydrophobicContact CB-CE2 3.9Å; Q331-Y333 VanDerWaalsContact CD-OH 3.26Å; Q331-Y333 HydrophobicContact CG-CD2 4.31Å; Q331-Y333 HydrophobicContact CG-CE2 3.64Å; Q331-Y333 WeakPolarHBondContact O-CD2 2.82Å; Q331-Y333 PolarHBondContact O-N 3.17Å; Q331-Y333 PolarHBondContact OE1-OH 3.36Å; Y333-I335 PolarHBondContact O-N 2.86Å
334H45.9Very low49.1Very low153 Ų153141.7 Ų141.771%0.70878%0.779SS**  trans-68101.2171.6-63.4-29.6000111.5E332 V336E332-H334 IonicContact OE1-CE1 3.12Å; E332-H334 PolarHBondContact OE1-CE1 2.91Å; E332-H334 IonicContact OE1-ND1 3.4Å; E332-H334 PolarHBondContact OE1-ND1 3.38Å; H334-V336 PolarHBondContact O-N 2.98Å
335I57.8Low49.3Very low155 Ų155140.7 Ų140.780%0.79578%0.78SS**  trans-75.789.9178.8-54.5178.7000110.5Y333 K337Y333-I335 PolarHBondContact O-N 2.86Å; I335-K337 PolarHBondContact O-N 3.49Å; I335-K337 VanDerWaalsContact O-N 3.11Å
336V57.9Low50Low120 Ų120140.5 Ų140.573%0.72778%0.784SS**  trans-67.8107.4174.9-177.90000110.6H334 K338H334-V336 PolarHBondContact O-N 2.98Å; V336-K338 VanDerWaalsContact C-N 3.33Å; V336-K338 PolarHBondContact O-N 3.24Å
337K56.4Low49.9Very low198 Ų198143.4 Ų143.486%0.86178%0.783SS**  trans-69.880.7176.6-72.9-177.4176.1176.10112.1I335 S339I335-K337 PolarHBondContact O-N 3.49Å; I335-K337 VanDerWaalsContact O-N 3.11Å; K337-S339 PolarHBondContact O-N 2.99Å
338K56.5Low49.7Very low186 Ų186143.8 Ų143.881%0.80978%0.784SS**  trans-69.7106.5169.847.3-171.9168.6-172.60111V336 T340V336-K338 VanDerWaalsContact C-N 3.33Å; V336-K338 PolarHBondContact O-N 3.24Å; K338-T340 PolarHBondContact O-N 2.7Å
339S48.2Very low49.8Very low120 Ų120148 Ų14884%0.83978%0.782SS**  trans-70.1112.8-179.1-174.90000111.8K337 R341K337-S339 PolarHBondContact O-N 2.99Å; S339-R341 PolarHBondContact O-N 3.3Å
340T53.1Low50Low133 Ų133146.2 Ų146.282%0.81677%0.774SS**  trans-84.7104.3172.349.50000110.2K338 S342K338-T340 PolarHBondContact O-N 2.7Å; T340-S342 PolarHBondContact O-N 3.49Å
341R52.2Low50.3Low212 Ų212145.4 Ų145.480%0.877%0.766SS**  trans-59.3120.6171.7179.9177-179.5-90.96.1109.7S339S339-R341 PolarHBondContact O-N 3.3Å
342S42.3Very low50.4Low107 Ų107150.2 Ų150.275%0.74878%0.778SS**  trans-56.6138.7178.9-174.30000111.9T340T340-S342 PolarHBondContact O-N 3.49Å
343L48.6Very low50.4Low143 Ų143153.9 Ų153.975%0.74979%0.786SS**  trans-125.2148.7163.9-71.3178.9000108.5
344S46.5Very low50.6Low108 Ų108154.1 Ų154.176%0.75580%0.797SS**  trans-74.7147.5-159.147.30000115.2T346S344-T346 PolarHBondContact O-N 3.1Å
345T49.3Very low50.6Low134 Ų134154.7 Ų154.782%0.82280%0.804SS**  trans-59.5123.2169.6162.10000113.1
346T53.9Low50Low123 Ų123158.2 Ų158.276%0.75581%0.807SS**  trans-149.8122.2150.548.80000110S344S344-T346 PolarHBondContact O-N 3.1Å
347H45.3Very low49.4Very low188 Ų188158.1 Ų158.187%0.8781%0.809SS**  trans30.7105.3163.3-96.877.1000119
348V42.5Very low49.1Very low134 Ų134153.4 Ų153.481%0.81280%0.801SS**  trans-91.4111.3157.9177.20000108.4
349E52.4Low48.9Very low174 Ų174151.4 Ų151.481%0.81380%0.804SS**  trans-82.5122.8170.7-170.9171.1178.600110P351E349-P351 WeakPolarHBondContact O-CD 3.44Å
350S45.4Very low49Very low94 Ų94151.9 Ų151.966%0.65780%0.796SS**  trans-67116.8-170.8-58.60000112.6W352S350-W352 PolarHBondContact O-N 3.01Å
351P57.3Low48.4Very low111 Ų111150.8 Ų150.872%0.72179%0.793SS**SBendtrans-80.435.3-169.634.7-38.6000114.3E349E349-P351 WeakPolarHBondContact O-CD 3.44Å
352W49.5Very low48.1Very low240 Ų240147.8 Ų147.891%0.90979%0.792SS**  trans-137.274.9179.4-65.9112.7000111.1S350S350-W352 PolarHBondContact O-N 3.01Å
353R54.4Low48.5Very low233 Ų233154 Ų15488%0.87981%0.814SS**  trans-107.4121162.8-77.3-161.6169.4-151.4-2.7111.1I355R353-I355 PolarHBondContact O-N 3.18Å
354L46.5Very low48.5Very low170 Ų170154.5 Ų154.589%0.8982%0.817SS**  trans-49.2128.9179.7-63.4159.1000111.9R356L354-R356 PolarHBondContact O-N 3.19Å; L354-R356 VanDerWaalsContact O-N 3.17Å
355I46.2Very low48.7Very low166 Ų166156.9 Ų156.985%0.85182%0.82SS**  trans-68.7110.1166.3-60.5172.5000107.5R353R353-I355 PolarHBondContact O-N 3.18Å
356R45.5Very low48.6Very low228 Ų228158.2 Ų158.286%0.8682%0.82SS**PPolyproline II helixtrans-80.5128.4162.6-67.4-172.5-178.1-174.51.1108.4L354 S358L354-R356 PolarHBondContact O-N 3.19Å; L354-R356 VanDerWaalsContact O-N 3.17Å; R356-S358 PolarHBondContact O-N 3.22Å
357P46.1Very low48.3Very low119 Ų119160.3 Ų160.377%0.77382%0.824SS**PPolyproline II helixtrans-66.9126.2166.228.4-32.3000109.1V359P357-V359 PolarHBondContact O-N 3.41Å
358S50.2Low48.5Very low99 Ų99158.6 Ų158.669%0.69282%0.821SS**PPolyproline II helixtrans-79118.7175.644.90000110.4R356 I360R356-S358 PolarHBondContact O-N 3.22Å; S358-I360 PolarHBondContact O-N 3.4Å; S358-I360 VanDerWaalsContact O-N 3.08Å
359V50.5Low48.9Very low143 Ų143160.2 Ų160.287%0.86782%0.822SS**  trans-70.6103.5167178.90000108P357 S361P357-V359 PolarHBondContact O-N 3.41Å; V359-S361 PolarHBondContact O-N 3.46Å
360I51.7Low48.6Very low130 Ų130159.2 Ų159.267%0.66782%0.823SS**  trans-84.7107.3170.7-65.4175.9000107.6S358 I362S358-I360 PolarHBondContact O-N 3.4Å; S358-I360 VanDerWaalsContact O-N 3.08Å; I360-I362 HydrophobicContact CG2-CD1 3.76Å; I360-I362 HydrophobicContact CG2-CG1 3.79Å
361S40.1Very low48.9Very low110 Ų110164.2 Ų164.277%0.76984%0.835SS**  trans-92.7123.3165.1-172.30000108.7V359V359-S361 PolarHBondContact O-N 3.46Å
362I45.3Very low48.2Very low149 Ų149168.7 Ų168.776%0.76485%0.845SS**  trans-131.3145.4169.3-64176000107.2I360I360-I362 HydrophobicContact CG2-CD1 3.76Å; I360-I362 HydrophobicContact CG2-CG1 3.79Å
363I52.4Low48.1Very low237 Ų237162.2 Ų162.2100%1.21584%0.839SS**  trans-82.40-165.6-57.7162.3000111.5

Retrieved 363 of 363 residues in 372.4 ms (Link to these results)