A0A5K4FD58_SCHMA Loading...

Myosin motor domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FD58, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,426 aa.

						>A0A5K4FD58_SCHMA|A0A5K4FD58
MNESVCDSEVKVARLHKAIFGKNFAFGLQKKDQSLHVSEKPVKSYEEVRICLPAYEKPIVPSISPDTVVANHVKGNFSHTQLPHFKVHLKKHSDSSYGIFLRRGLLVHRFHLTNDGFILENRSEVLLTDYGVQNSSCGLLPGDYLVAVGDKPVGSISRNEVVHLIRSTDLYLSLTVQSLPEFTDFFYRLVLVPQSALENLKIEQEYVHDNFYHITPVSVRGYAVKYGSFKNLYLYLQKVKPDTFENSSVDTVHTIERKPNDNNNDNEYVQSVYHEDNNQTDFPVWITFKQGYVSGKFLGSLPNGRCRVIILPGQEVIEVNSEDVERANPPRFDRVDDLIKLRYINESSVTHSFIQRYGSGLIFTYASGINLISINPMMPLNIYSDKVMDLFTNCQVRYDMPPHVYSVAQLILARLKRRLFYSIVNMEQQQNHMNGNPVYHLPCSISQQVLCLLGRSGSGKTHISNDVFTYMIYQSEKSINHFNHSNNDGNNSIISNKINECRLRALFNMLDSFTCSRIILNTNGSRALRLFSLEFANIHSLPIVNQPEDISLIVTGLTTRLLLFERSRVTDRPEGEPNFHIFYYMLAGLDEGSRRELFLTDLDVPNLFMTRLHRPEDKISAKKFWQQLCHDAELLQFDIKNEWLTGGITRLLAVIYHLGCAGYCNEINEENLLYFTNYQSAQYAAYLLHCSLDTLNELIFNPVLRKPTTNHHHHHLNENNNDNQNCIKWTAKYCLHAFVQDLYNMIVDILISLINRCLSTSKSDLSSQFNVAAQLILVDPVGFQIPYSTTSLISSSTSVSSPTAKLSSESNEMHKTGNFTDLIFNYAYECFNQLYFDSNILLDEQRLKHDGLTSPIPYENFCRTKNILNFMDNTTLSTTPNSFPYKNLTTTNNDVYNNTVFPGLFCLLDSVAQNGDFSQLYDTLSQMYQTQRKLYENRDLRSIRRFKRNGSSFVLNHNLSTTPIEYAPNWSWFTPYHRSSASLKKLINFLEQSSVASLRMIVSLLKYKEDYLSSFLPNSSSHIGVYSEVKSIMDTLTRSLYDCAAHNASYNPNDPGSGFNDGGPPSGMHWIHCFLPVSTAGLCELNEEIPINQLMQINYPSNDRLTNDDNHINNNDINHNTSNSFLFELMKRYPNKNLVLSPARICVNLIRAQIRGIELINTLQAVKQSYPDRLSLKEFCNRFVSLLPNSSKIRELKQNESLNKSIVHEILNSLHYSPETFQLGSNNIYLRTFIIPQLIHRLSYSPELSIDQELIHVQPDCKSYIIDCSNEQQVIITEDKINPHIVQKYTNAKEHAYNIEINEKQINASPSVESNKNNTVYEIGSVPILKVDNDSTIHCEKSETLKSTMMKSEELEPTNKEHVNSQSATMIDKEVTLSKRGKCSISISRDTDPNQTYKCGSIILVGSSETIKPNPEDNNVEAENNSMIVNKEIRLVNPTSHNSSSLNMSTEVEPKPNTQPITITYDSIGNDLNVELKDMNKQVKPRKSTLHSSFFTDNESEKQIVIQTNRSTPSFDTPESHQNSQQKVQTNLLSQEVCPGQFQSNSLLNNKTGGILQNDINKPVTPDMPSITQLAIKLENDNQLNHSDSELIKIKLEYSKALERIKELEAMSNDLKCKLSALTIENAHYKQNCDRARSDLELAEENRIQAEQQTKVINLKLEQAEKRHLLLLESLKNASGQDIHNNTTAEYTILYPDAPEPLLTELNQLRSANQLLTLQLTDLQNTIGDLKKDLETAYANHQKAEKTIEKLRIDITRIQDEYEADYEANRTANQVKLRQLEEAMHIVQEENTRLTRDKHQLELEVSTLNLELSNASNDGDIEHKLRKELKIIKSLLAEKEALIIELSSNPSDSQSQIKKLRDRVDELDELNEILNRQKRALQSDLDEIQQQLASALRTQKEFEEDLFRSKRQLLDLQNQFTDQEEAHKETRDKLQNATASLTIKEATIQAQIQEIDEFLIERKKMQTQIDELKLKLNTNNIDQVPRSELERLEAKIREFEQRLDIETSNRVRIQYSLDRAKETIDQLTNERDKLIIIEANEREQNRKLSRQLREAQQDENEATRRATTAQRRAEEAQMDANKAMHEALCSRAEMNALLRRTQDLEALVKSKQNDSDYEDLLNCNSSGEDLILNKFTKGSQDFLLRSNSKYRNRLLRGSHQLRLLNRAFSDDNLPYFPNRLSDHLSTTIKNGQSSYYKSSIDNKNFENSKEYSTKDKPDNSILLPQARSVSPFVSLSKNNHNFTGNNCLYTNKLISSEDRFFNASNYTSMNSFETTNTCDHNIDSTNNNDSNNSNDQTCNKPNGSLIFSSNIRVLTSPKFKQTVTIQRVQSDHICKPNMDVVSIADSINSINNNDKLPAIPYNNHSSIDSQNNDINDNIPTTTTITITSSEVTARNESPSVLLSSTESFRNLDHLHKTNLEIHYHGE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	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
1	M	29	Very low	26.5	Very low	223 Å²	223	112.2 Å²	112.2	100%	1.099	62%	0.619	S	S	*	*				0	76.6	0	-45.8	-54	-152.8	0	0	107
2	N	25.1	Very low	26.4	Very low	130 Å²	130	114.7 Å²	114.7	70%	0.695	64%	0.639	S	S	*	*			cis	72.7	100.4	48.7	-61.9	81.8	0	0	0	113.3
3	E	22.9	Very low	26.3	Very low	155 Å²	155	112.8 Å²	112.8	72%	0.724	65%	0.648	S	S	*	*				60.4	97.2	120.9	-68.6	149.7	156.2	0	0	121.4
4	S	23.8	Very low	26.5	Very low	106 Å²	106	122.8 Å²	122.8	74%	0.741	67%	0.669	S	S	*	*				62.5	153	107.1	69.3	0	0	0	0	125.1
5	V	27.4	Very low	26.3	Very low	130 Å²	130	124.7 Å²	124.7	79%	0.788	68%	0.677	S	S	*	*			trans	93.4	159.9	159.9	-167.5	0	0	0	0	117.2
6	C	26.5	Very low	26.2	Very low	98 Å²	98	128.3 Å²	128.3	66%	0.662	69%	0.688	S	S	*	*			trans	-123.6	164.2	-140.7	-49.5	0	0	0	0	116.4
7	D	27.9	Very low	26	Very low	112 Å²	112	132.2 Å²	132.2	60%	0.599	70%	0.697	S	S	*	*			trans	69.8	139.5	135.6	-91.2	-8.9	0	0	0	121.9	I1821 K1824	D7-I1821 HydrophobicContact CB-CG1 4.37Å; D7-K1824 IonicContact OD1-NZ 2.82Å; D7-K1824 PolarHBondContact OD1-NZ 2.85Å; D7-K1824 IonicContact OD2-NZ 3.79Å; D7-K1824 PolarHBondContact OD2-NZ 3.14Å
8	S	27	Very low	26.1	Very low	50 Å²	50	129.8 Å²	129.8	35%	0.35	70%	0.699	S	S	.	*			cis	-148.7	-125.9	15.2	-56	0	0	0	0	116.2	D1820 K1824	S8-D1820 WeakPolarHBondContact CB-O 3.02Å; S8-D1820 PolarHBondContact OG-O 2.96Å; S8-K1824 VanDerWaalsContact CB-CE 3.49Å; S8-K1824 WeakPolarHBondContact OG-CD 3.14Å; S8-K1824 WeakPolarHBondContact OG-CE 3.38Å; S8-K1824 PolarHBondContact OG-NZ 3.48Å
9	E	26.5	Very low	25.9	Very low	52 Å²	52	130.6 Å²	130.6	24%	0.243	70%	0.702	C	S	.	*			cis	-162.5	-170.4	-0.8	-136.8	-175.2	-155.9	0	0	117.3	D1820 I1821 H1823 K1824	E9-D1820 HydrophobicContact CB-CB 4.29Å; E9-D1820 VanDerWaalsContact CD-C 3.42Å; E9-D1820 VanDerWaalsContact CD-O 3.27Å; E9-D1820 WeakPolarHBondContact CG-O 3.42Å; E9-I1821 PolarHBondContact OE1-N 2.68Å; E9-H1823 VanDerWaalsContact OE1-C 3.28Å; E9-H1823 VanDerWaalsContact OE1-CA 3.24Å; E9-H1823 WeakPolarHBondContact OE1-CA 3.49Å; E9-H1823 WeakPolarHBondContact OE1-CB 3.07Å; E9-H1823 PolarHBondContact OE1-N 2.98Å; E9-H1823 WeakPolarHBondContact OE2-CB 3.25Å; E9-K1824 HydrophobicContact CG-CB 3.7Å; E9-K1824 HydrophobicContact CG-CG 3.89Å; E9-K1824 PolarHBondContact OE1-N 3.3Å
10	V	29	Very low	26	Very low	77 Å²	77	134.7 Å²	134.7	47%	0.467	71%	0.713	S	S	.	*			trans	65.4	62.3	150.8	165.3	0	0	0	0	121	H1823	V10-H1823 HydrophobicContact CG2-CB 4.36Å; V10-H1823 VanDerWaalsContact CG2-CD2 3.47Å; V10-H1823 WeakPolarHBondContact CG2-CD2 3.07Å
11	K	25.9	Very low	26	Very low	101 Å²	101	130.8 Å²	130.8	44%	0.439	71%	0.706	S	S	.	*			trans	-61.5	147.1	164.1	-45.3	172.4	-171.1	177.6	0	114.7	K1827 E1828 I1831	K11-K1827 VanDerWaalsContact O-CD 3.31Å; K11-K1827 WeakPolarHBondContact O-CD 3.39Å; K11-K1827 WeakPolarHBondContact O-CE 3.34Å; K11-K1827 PolarHBondContact O-NZ 3.28Å; K11-K1827 VanDerWaalsContact O-NZ 3.12Å; K11-E1828 IonicContact NZ-OE1 2.76Å; K11-E1828 PolarHBondContact NZ-OE1 3.5Å; K11-I1831 HydrophobicContact CD-CD1 4.29Å
12	V	25.4	Very low	26	Very low	142 Å²	142	129.5 Å²	129.5	86%	0.861	69%	0.694	S	S	*	*				-172.2	-156.2	125.4	-148	0	0	0	0	110.7
13	A	25.7	Very low	26.1	Very low	91 Å²	91	128.8 Å²	128.8	75%	0.752	69%	0.69	S	S	*	*			trans	-158.1	167	-163.3	0	0	0	0	0	118
14	R	28.4	Very low	26.3	Very low	252 Å²	252	129.8 Å²	129.8	95%	0.951	69%	0.692	S	S	*	*			trans	-161.5	147.8	145.5	-119.7	179.9	-175.3	174.2	1.9	112.5
15	L	24.2	Very low	26.4	Very low	151 Å²	151	128.3 Å²	128.3	79%	0.791	69%	0.686	S	S	*	*			trans	-90.5	135.4	179.7	-91	70.5	0	0	0	113.3
16	H	23.8	Very low	26.4	Very low	183 Å²	183	132.6 Å²	132.6	85%	0.847	70%	0.695	S	S	*	*				-170.2	169.5	108.8	-117.2	89.7	0	0	0	113.8	A18	H16-A18 PolarHBondContact O-N 3.2Å
17	K	24.1	Very low	26.4	Very low	194 Å²	194	131 Å²	131	84%	0.843	70%	0.695	S	S	*	*			trans	-75.4	116.3	-173.2	-70.5	175.3	176.1	172.8	0	114.4
18	A	26.7	Very low	26.3	Very low	89 Å²	89	133.1 Å²	133.1	74%	0.736	71%	0.705	S	S	*	*			trans	62.1	173	130.9	0	0	0	0	0	121.6	H16	H16-A18 PolarHBondContact O-N 3.2Å
19	I	23.4	Very low	26.1	Very low	146 Å²	146	137.2 Å²	137.2	75%	0.749	72%	0.719	S	S	*	*			trans	77.1	110.5	167.4	-52.3	166	0	0	0	116.8
20	F	28.2	Very low	26.1	Very low	211 Å²	211	142.8 Å²	142.8	93%	0.925	74%	0.742	S	S	*	*				-166.7	135.5	117.6	-95	-67.9	0	0	0	108.9
21	G	25.1	Very low	26	Very low	54 Å²	54	146.6 Å²	146.6	56%	0.557	75%	0.752	S	S	*	*			cis	136.6	129.4	-8	0	0	0	0	0	113.4
22	K	28.2	Very low	26	Very low	195 Å²	195	146.2 Å²	146.2	85%	0.848	76%	0.755	S	S	*	*			trans	165.5	143.5	161.7	-95.2	156.6	-175.9	179.8	0	108.1
23	N	28.5	Very low	25.9	Very low	115 Å²	115	147.7 Å²	147.7	62%	0.615	75%	0.753	S	S	*	*			cis	-165.2	160.2	-14.1	-101	2.6	0	0	0	105.2
24	F	27.6	Very low	25.9	Very low	177 Å²	177	148.7 Å²	148.7	78%	0.776	75%	0.754	S	S	*	*			cis	-145.3	146	0.2	-95.6	-42.4	0	0	0	105.9
25	A	25	Very low	25.8	Very low	74 Å²	74	143.6 Å²	143.6	61%	0.612	75%	0.745	S	S	*	*				81.7	146.1	66.5	0	0	0	0	0	115.6
26	F	28.2	Very low	25.9	Very low	221 Å²	221	144.2 Å²	144.2	97%	0.969	74%	0.744	S	S	*	*			trans	68.3	146.6	-166.2	-64.2	-89.2	0	0	0	116.3
27	G	26.6	Very low	26	Very low	64 Å²	64	141.1 Å²	141.1	66%	0.66	74%	0.737	S	S	*	*			cis	161.2	116.4	-13.2	0	0	0	0	0	116.1
28	L	24.7	Very low	26.1	Very low	157 Å²	157	135.7 Å²	135.7	82%	0.822	72%	0.724	S	S	*	*			trans	61.5	123.4	155.8	-70.6	164.3	0	0	0	121.8
29	Q	23.4	Very low	26	Very low	136 Å²	136	140.1 Å²	140.1	64%	0.636	73%	0.729	S	S	*	*			trans	72.4	142.1	138.5	-71.2	-172.5	12.1	0	0	122.4
30	K	26	Very low	26	Very low	168 Å²	168	142.6 Å²	142.6	73%	0.73	73%	0.734	S	S	*	*			trans	71.7	149.8	149.2	-72.5	158.6	179	155.6	0	117.1
31	K	26.1	Very low	26.1	Very low	157 Å²	157	138 Å²	138	68%	0.683	73%	0.726	S	S	*	*			cis	-162.2	161.7	-20.1	-126.3	-178.1	163.8	-75	0	109.4
32	D	26	Very low	26	Very low	94 Å²	94	141.1 Å²	141.1	50%	0.503	73%	0.734	S	S	.	*			trans	44.2	114.5	147.1	-53.7	-17.6	0	0	0	122.7
33	Q	24	Very low	25.8	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	73%	0.729	S	S	*	*				79	154.3	119.9	-64.8	175.5	12.4	0	0	123.1
34	S	26.4	Very low	25.8	Very low	112 Å²	112	140.5 Å²	140.5	78%	0.783	74%	0.741	S	S	*	*			trans	82.5	143.2	164.6	77.7	0	0	0	0	118.6
35	L	24.8	Very low	25.6	Very low	144 Å²	144	142 Å²	142	75%	0.754	74%	0.743	S	S	*	*			cis	-168.8	152	-39.2	-121.9	160.5	0	0	0	108.7
36	H	27.2	Very low	25.5	Very low	165 Å²	165	147.9 Å²	147.9	76%	0.764	76%	0.758	S	S	*	*			trans	109.4	120.8	174	-66.2	-75.1	0	0	0	115.1
37	V	26.9	Very low	25.2	Very low	117 Å²	117	145.9 Å²	145.9	71%	0.709	75%	0.752	S	S	*	*			cis	75.9	120.9	36.2	-177.3	0	0	0	0	111.1
38	S	24.5	Very low	25.1	Very low	80 Å²	80	148.8 Å²	148.8	56%	0.559	76%	0.756	S	S	*	*			cis	-157.7	166.9	-4.6	53.1	0	0	0	0	113.7
39	E	26.2	Very low	25	Very low	182 Å²	182	152.6 Å²	152.6	85%	0.85	76%	0.76	S	S	*	*			trans	73.1	153.8	141.2	-78.5	145.1	-172.4	0	0	123.8
40	K	22	Very low	25.1	Very low	198 Å²	198	152.9 Å²	152.9	86%	0.861	76%	0.764	S	S	*	*			trans	-83.8	-179.3	179.9	-61.7	177.4	178.8	175.8	0	109
41	P	30.4	Very low	25	Very low	114 Å²	114	150.5 Å²	150.5	74%	0.74	77%	0.767	S	S	*	*			cis	-156.2	176.9	23.6	44.3	-21.7	0	0	0	121.5
42	V	22.7	Very low	24.8	Very low	120 Å²	120	151 Å²	151	73%	0.727	78%	0.777	S	S	*	*			trans	86.1	119.8	137.8	143.7	0	0	0	0	122.1
43	K	23.6	Very low	24.8	Very low	174 Å²	174	152 Å²	152	76%	0.757	79%	0.788	S	S	*	*			trans	60	109.7	150.5	-66.5	176.4	-175.4	-179.2	0	121.6
44	S	28.5	Very low	24.8	Very low	123 Å²	123	148.2 Å²	148.2	86%	0.86	79%	0.786	S	S	*	*				-139.9	162.6	110.4	55.8	0	0	0	0	109.3
45	Y	23.7	Very low	24.8	Very low	210 Å²	210	154.2 Å²	154.2	82%	0.824	79%	0.793	S	S	*	*			trans	-124.2	131.1	-173.7	-92.2	-110.8	0	0	0	110.2
46	E	23.2	Very low	24.8	Very low	197 Å²	197	156 Å²	156	92%	0.921	80%	0.798	S	S	*	*			trans	-164.9	176.6	151.6	-121.6	163.3	-152.8	0	0	111.9
47	E	22	Very low	24.6	Very low	178 Å²	178	157 Å²	157	83%	0.832	80%	0.8	S	S	*	*			trans	-67.6	139.7	-159.1	-52.4	-178.6	115.1	0	0	116.8
48	V	25.6	Very low	24.6	Very low	125 Å²	125	157.1 Å²	157.1	76%	0.758	80%	0.803	S	S	*	*			trans	-140.4	121.6	151.6	175.9	0	0	0	0	110.8	I50	V48-I50 HydrophobicContact CG1-CD1 4.1Å; V48-I50 HydrophobicContact CG1-CG1 3.85Å
49	R	21.4	Very low	24.6	Very low	237 Å²	237	160.7 Å²	160.7	89%	0.894	81%	0.814	S	S	*	*			trans	-91.3	117	164.8	-66.8	170.3	172.7	166.4	-3.7	109.8
50	I	25.2	Very low	24.5	Very low	143 Å²	143	157.9 Å²	157.9	73%	0.733	81%	0.81	S	S	*	*			trans	-136	116.1	162.8	-68.3	-176.8	0	0	0	111.3	V48	V48-I50 HydrophobicContact CG1-CD1 4.1Å; V48-I50 HydrophobicContact CG1-CG1 3.85Å
51	C	23.9	Very low	24.8	Very low	117 Å²	117	153.9 Å²	153.9	79%	0.791	80%	0.804	S	S	*	*			trans	26.8	104.9	149.1	-50.2	0	0	0	0	119.8
52	L	22.6	Very low	24.5	Very low	169 Å²	169	153.8 Å²	153.8	89%	0.885	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70.2	139.6	139.1	-77.4	164.8	0	0	0	109.1
53	P	26.7	Very low	24.7	Very low	115 Å²	115	155.8 Å²	155.8	75%	0.747	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-73.9	159.2	173.9	31.9	-34.6	0	0	0	111.6
54	A	22.5	Very low	24.8	Very low	92 Å²	92	151.7 Å²	151.7	76%	0.76	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-71.3	143.7	-176.2	0	0	0	0	0	113
55	Y	27.2	Very low	24.7	Very low	238 Å²	238	151.5 Å²	151.5	93%	0.933	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-99.4	139.8	148.7	-103.4	-87.7	0	0	0	109.1
56	E	24.8	Very low	24.7	Very low	181 Å²	181	148.4 Å²	148.4	85%	0.846	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-84.8	163.7	-166.6	-63	-173.8	113.4	0	0	113.5
57	K	22.6	Very low	24.8	Very low	186 Å²	186	145.1 Å²	145.1	81%	0.809	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-67.7	134.7	-179.7	-57.1	166.2	-177.8	171.7	0	110.3	I59	K57-I59 PolarHBondContact O-N 3.43Å
58	P	27.4	Very low	25	Very low	121 Å²	121	143.4 Å²	143.4	79%	0.786	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-62.4	124.3	145.4	29.1	-30.8	0	0	0	107.5	V60	P58-V60 PolarHBondContact O-N 3.32Å
59	I	25.1	Very low	24.9	Very low	154 Å²	154	144.3 Å²	144.3	79%	0.79	80%	0.798	S	S	*	*			trans	-71.5	115	-177.5	-66.2	169.9	0	0	0	108.8	K57 P61	K57-I59 PolarHBondContact O-N 3.43Å; I59-P61 WeakPolarHBondContact O-CD 3.3Å
60	V	24.2	Very low	25	Very low	124 Å²	124	136.4 Å²	136.4	75%	0.752	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-71.4	119.2	164.8	177.8	0	0	0	0	107.8	P58 S62	P58-V60 PolarHBondContact O-N 3.32Å; V60-S62 PolarHBondContact O-N 2.82Å
61	P	26.6	Very low	25	Very low	113 Å²	113	135.3 Å²	135.3	73%	0.734	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-66.1	121.2	169.3	28	-32.5	0	0	0	108.6	I59 I63	I59-P61 WeakPolarHBondContact O-CD 3.3Å; P61-I63 PolarHBondContact O-N 3.17Å
62	S	24.7	Very low	25.1	Very low	113 Å²	113	137.1 Å²	137.1	79%	0.79	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-73.2	123.3	-170.6	53.6	0	0	0	0	112.9	V60	V60-S62 PolarHBondContact O-N 2.82Å
63	I	27.9	Very low	25.4	Very low	161 Å²	161	133.7 Å²	133.7	83%	0.826	76%	0.761	S	S	*	*			trans	-119.3	150.2	161.4	-61.7	-179.1	0	0	0	108	P61	P61-I63 PolarHBondContact O-N 3.17Å
64	S	25.9	Very low	25.5	Very low	88 Å²	88	134.4 Å²	134.4	62%	0.615	75%	0.753	S	S	*	*			trans	-64.6	146	-162	45.5	0	0	0	0	115.9	D66	S64-D66 PolarHBondContact O-N 3.46Å
65	P	25.8	Very low	26.1	Very low	120 Å²	120	132.2 Å²	132.2	78%	0.779	74%	0.739	S	S	*	*	S	Bend	trans	-86.2	57.2	-172.4	38	-38.8	0	0	0	114.1
66	D	23.2	Very low	26.4	Very low	144 Å²	144	125.3 Å²	125.3	77%	0.77	72%	0.718	S	S	*	*	S	Bend	trans	-135.4	31.2	-175.9	-92.1	-52.1	0	0	0	114.6	S64	S64-D66 PolarHBondContact O-N 3.46Å
67	T	24.8	Very low	27.1	Very low	129 Å²	129	117.8 Å²	117.8	79%	0.791	68%	0.683	S	S	*	*			trans	-151.5	23	175.1	-24	0	0	0	0	116.2	V69	T67-V69 PolarHBondContact O-N 3.21Å
68	V	26.1	Very low	27.8	Very low	141 Å²	141	112.1 Å²	112.1	86%	0.855	67%	0.666	S	S	*	*			trans	-100.5	53.8	-175.6	-163.6	0	0	0	0	112.6
69	V	24.5	Very low	28.4	Very low	144 Å²	144	110.1 Å²	110.1	87%	0.873	65%	0.647	S	S	*	*	S	Bend	trans	-137.4	73.2	177.2	-170	0	0	0	0	110.8	T67	T67-V69 PolarHBondContact O-N 3.21Å
70	A	23.3	Very low	29.2	Very low	71 Å²	71	107.8 Å²	107.8	59%	0.587	64%	0.64	S	S	*	*	S	Bend	trans	-161.5	-46.7	175.3	0	0	0	0	0	116.3	H72	A70-H72 PolarHBondContact O-N 3.5Å
71	N	24.8	Very low	30.4	Very low	121 Å²	121	109.8 Å²	109.8	65%	0.647	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	25.7	-143.5	-82.7	-17.2	0	0	0	118.6
72	H	26.8	Very low	31.7	Very low	155 Å²	155	105.7 Å²	105.7	72%	0.718	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	-2	177.3	-72.2	-50.4	0	0	0	116.2	A70 P312	A70-H72 PolarHBondContact O-N 3.5Å; H72-P312 HydrophobicContact CB-CB 3.89Å; H72-P312 HydrophobicContact CB-CG 3.6Å; H72-P312 WeakPolarHBondContact O-CD 3.42Å
73	V	27.9	Very low	33.2	Very low	96 Å²	96	103.7 Å²	103.7	58%	0.582	60%	0.597	S	S	*	*	S	Bend	trans	-77.7	-37.9	179.7	-155.5	0	0	0	0	111.4	G75 P312	V73-G75 PolarHBondContact O-N 2.87Å; V73-P312 HydrophobicContact CB-CG 4.11Å; V73-P312 HydrophobicContact CG2-CG 3.48Å; V73-P312 VanDerWaalsContact CG2-CG 3.48Å
74	K	29.1	Very low	35.1	Very low	131 Å²	131	100.1 Å²	100.1	57%	0.57	58%	0.576	S	S	*	*	S	Bend	trans	-66.2	120.1	175.3	-52.9	179.5	-178.7	173.7	0	106.3	N76 H111	K74-N76 PolarHBondContact O-N 2.89Å; K74-H111 WeakPolarHBondContact CB-CE1 3.44Å; K74-H111 WeakPolarHBondContact CB-NE2 3.34Å
75	G	35.5	Very low	37.1	Very low	45 Å²	45	96.4 Å²	96.4	46%	0.464	55%	0.549	S	S	.	.			trans	-63.2	86.9	172.6	0	0	0	0	0	108.9	V73 F77 H111	V73-G75 PolarHBondContact O-N 2.87Å; G75-F77 PolarHBondContact O-N 2.97Å; G75-H111 VanDerWaalsContact C-ND1 3.31Å; G75-H111 PolarHBondContact O-ND1 2.9Å
76	N	32.9	Very low	39.2	Very low	93 Å²	93	93 Å²	93	50%	0.497	52%	0.522	S	S	.	.	B	Isolated β-bridge	trans	-55.3	113.9	167.6	-84.5	-40.5	0	0	0	105.7	K74 S78 H111	K74-N76 PolarHBondContact O-N 2.89Å; N76-S78 PolarHBondContact O-N 3.4Å; N76-H111 PolarHBondContact OD1-CE1 3.5Å
77	F	40.9	Very low	41.6	Very low	23 Å²	23	86.2 Å²	86.2	10%	0.101	49%	0.486	C	S	.	.			trans	-66.1	86	152.5	-71.3	-98.1	0	0	0	104.6	G75 H79 R109 F110 L112 I118 I354	G75-F77 PolarHBondContact O-N 2.97Å; F77-H79 VanDerWaalsContact C-N 3.34Å; F77-H79 PolarHBondContact O-N 3.34Å; F77-R109 WeakPolarHBondContact CB-O 3.45Å; F77-F110 WeakPolarHBondContact CD2-O 3.21Å; F77-F110 PolarHBondContact N-O 3.22Å; F77-L112 HydrophobicContact CE2-CB 4.27Å; F77-I118 HydrophobicContact CE2-CG2 3.91Å; F77-I118 HydrophobicContact CZ-CD1 4.22Å; F77-I118 HydrophobicContact CZ-CG1 4.21Å; F77-I118 HydrophobicContact CZ-CG2 4.07Å; F77-I354 HydrophobicContact CZ-CG2 4.34Å
78	S	36.6	Very low	43.9	Very low	67 Å²	67	82 Å²	82	47%	0.469	46%	0.457	S	S	.	.			trans	-59.1	102.5	179.1	40.2	0	0	0	0	106.9	N76 T80 R334	N76-S78 PolarHBondContact O-N 3.4Å; S78-T80 PolarHBondContact O-N 3.45Å; S78-R334 PolarHBondContact O-NH2 2.92Å
79	H	40	Very low	46.2	Very low	80 Å²	80	75.6 Å²	75.6	37%	0.37	42%	0.418	S	S	.	.			trans	-62.1	91.6	158.6	-80.9	-78.5	0	0	0	105.7	F77 Q81 H108	F77-H79 VanDerWaalsContact C-N 3.34Å; F77-H79 PolarHBondContact O-N 3.34Å; H79-Q81 PolarHBondContact O-N 3.08Å; H79-H108 AromaticContact CE1-ND1 3.74Å; H79-H108 AromaticContact NE2-ND1 3.54Å
80	T	42.1	Very low	48.4	Very low	105 Å²	105	72.5 Å²	72.5	64%	0.644	39%	0.393	S	S	*	.			trans	-45.9	102.1	131.1	39.4	0	0	0	0	104.9	S78 L82	S78-T80 PolarHBondContact O-N 3.45Å; T80-L82 PolarHBondContact O-N 3.07Å
81	Q	48.3	Very low	51	Low	166 Å²	166	71.9 Å²	71.9	78%	0.776	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-53.8	120.4	179.8	-73.7	175.5	-49	0	0	106.2	H79	H79-Q81 PolarHBondContact O-N 3.08Å
82	L	55	Low	53.2	Low	27 Å²	27	70.4 Å²	70.4	14%	0.141	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-60.5	131.5	-178.8	-72.2	167.2	0	0	0	106.7	T80 H84 Q177 S178 P180 T183	T80-L82 PolarHBondContact O-N 3.07Å; L82-H84 PolarHBondContact O-N 3.27Å; L82-Q177 HydrophobicContact CB-CG 3.86Å; L82-Q177 PolarHBondContact O-NE2 3.38Å; L82-S178 VanDerWaalsContact CD1-O 3.27Å; L82-S178 WeakPolarHBondContact CD1-O 3.38Å; L82-P180 HydrophobicContact CD1-CG 4.34Å; L82-T183 HydrophobicContact CD2-CG2 3.8Å
83	P	56.7	Low	55.1	Low	70 Å²	70	69.4 Å²	69.4	46%	0.455	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-57.1	137.1	-175.5	19.4	-30.6	0	0	0	110.5	F85	P83-F85 HydrophobicContact CB-CE1 4.47Å; P83-F85 HydrophobicContact CB-CE2 4.29Å; P83-F85 HydrophobicContact CB-CZ 4.08Å; P83-F85 HydrophobicContact CG-CE1 4.38Å; P83-F85 HydrophobicContact CG-CE2 3.94Å; P83-F85 HydrophobicContact CG-CZ 3.63Å; P83-F85 VanDerWaalsContact O-CD2 3.27Å; P83-F85 WeakPolarHBondContact O-CD2 3.45Å; P83-F85 VanDerWaalsContact O-CE2 3.22Å; P83-F85 WeakPolarHBondContact O-CE2 3.47Å
84	H	67.9	Low	57.2	Low	86 Å²	86	69.9 Å²	69.9	40%	0.398	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	138.5	168.2	-64.4	97.7	0	0	0	108.3	L82 T175 Q177	L82-H84 PolarHBondContact O-N 3.27Å; H84-T175 HydrophobicContact CB-CG2 4.05Å; H84-Q177 PolarHBondContact CE1-NE2 2.91Å; H84-Q177 PolarHBondContact NE2-NE2 3.21Å
85	F	67.2	Low	59.1	Low	10 Å²	10	67.9 Å²	67.9	4%	0.044	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.2	-179	-57.5	-87.7	0	0	0	109.3	P83 T175 V176 R188	P83-F85 HydrophobicContact CB-CE1 4.47Å; P83-F85 HydrophobicContact CB-CE2 4.29Å; P83-F85 HydrophobicContact CB-CZ 4.08Å; P83-F85 HydrophobicContact CG-CE1 4.38Å; P83-F85 HydrophobicContact CG-CE2 3.94Å; P83-F85 HydrophobicContact CG-CZ 3.63Å; P83-F85 VanDerWaalsContact O-CD2 3.27Å; P83-F85 WeakPolarHBondContact O-CD2 3.45Å; P83-F85 VanDerWaalsContact O-CE2 3.22Å; P83-F85 WeakPolarHBondContact O-CE2 3.47Å; F85-T175 WeakPolarHBondContact O-CA 3.41Å; F85-V176 HydrophobicContact CB-CG2 4.13Å; F85-V176 PolarHBondContact N-O 2.94Å; F85-V176 PolarHBondContact O-N 3.01Å; F85-R188 HydrophobicContact CD1-CB 4.5Å; F85-R188 HydrophobicContact CE1-CB 3.95Å; F85-R188 HydrophobicContact CZ-CB 4.3Å
86	K	70.2	Confident	60.9	Low	48 Å²	48	67.8 Å²	67.8	21%	0.209	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	123.1	164.8	-101.6	-179	172.7	174.5	0	109.5	D150 L174 T175 I202	K86-D150 IonicContact NZ-OD1 2.92Å; K86-D150 PolarHBondContact NZ-OD1 2.99Å; K86-L174 CarbonylContact C-O 3.59Å; K86-L174 WeakPolarHBondContact CA-O 3.43Å; K86-T175 HydrophobicContact CG-CG2 4.47Å; K86-T175 WeakPolarHBondContact CG-OG1 3.39Å; K86-I202 WeakPolarHBondContact O-CA 3.42Å; K86-I202 WeakPolarHBondContact O-CG2 3.5Å
87	V	73.1	Confident	62.9	Low	2 Å²	2	63.8 Å²	63.8	1%	0.012	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.1	177.4	178.8	0	0	0	0	107.8	L89 C137 L139 L174 V176	V87-L89 HydrophobicContact CG1-CD2 4.3Å; V87-C137 WeakPolarHBondContact CG1-O 3.41Å; V87-L139 HydrophobicContact CB-CD2 4.3Å; V87-L139 HydrophobicContact CG1-CD2 4.16Å; V87-L139 HydrophobicContact CG1-CG 4.26Å; V87-L139 HydrophobicContact CG2-CD2 4.31Å; V87-L174 PolarHBondContact N-O 3.27Å; V87-L174 PolarHBondContact O-N 3.39Å; V87-V176 HydrophobicContact CG2-CG2 3.99Å
88	H	73.5	Confident	64.4	Low	41 Å²	41	63.3 Å²	63.3	19%	0.19	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	146.8	178.6	-74.6	-126.2	0	0	0	110.5	L172 S173 L200 K201	H88-L172 CarbonylContact C-O 3.52Å; H88-L172 WeakPolarHBondContact CA-O 3.43Å; H88-S173 PolarHBondContact CD2-OG 3.19Å; H88-S173 PolarHBondContact CE1-OG 3.04Å; H88-S173 PolarHBondContact NE2-OG 3.44Å; H88-L200 HydrophobicContact CB-CD2 4.3Å; H88-L200 WeakPolarHBondContact O-CD2 3.47Å; H88-L200 WeakPolarHBondContact O-CG 3.28Å; H88-K201 PolarHBondContact CD2-O 3.31Å
89	L	74.4	Confident	66.3	Low	6 Å²	6	61.6 Å²	61.6	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	132.2	-173.6	-61.4	172.9	0	0	0	110.2	V87 Y97 I99 C137 L139 Y171 L172 L174	V87-L89 HydrophobicContact CG1-CD2 4.3Å; L89-Y97 HydrophobicContact CB-CD1 3.9Å; L89-I99 HydrophobicContact CD1-CD1 4.01Å; L89-I99 HydrophobicContact CD1-CG2 3.66Å; L89-C137 HydrophobicContact CD2-CB 3.61Å; L89-C137 WeakPolarHBondContact CD2-O 3.45Å; L89-L139 HydrophobicContact CD1-CD1 4.44Å; L89-Y171 WeakPolarHBondContact O-CA 3.04Å; L89-L172 HydrophobicContact CB-CB 4.31Å; L89-L172 HydrophobicContact CD1-CD2 4.12Å; L89-L172 PolarHBondContact N-O 3.07Å; L89-L172 PolarHBondContact O-N 3.27Å; L89-L174 HydrophobicContact CD1-CD1 3.54Å; L89-L174 HydrophobicContact CD1-CG 4.2Å
90	K	71.3	Confident	68.1	Low	79 Å²	79	63.2 Å²	63.2	34%	0.343	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	144.2	166.4	-160.5	-172.3	-159	106.9	0	109.8	L170 Y171 N199	K90-L170 WeakPolarHBondContact CA-O 3.45Å; K90-Y171 HydrophobicContact CB-CD1 4.17Å; K90-Y171 HydrophobicContact CB-CE1 3.92Å; K90-Y171 HydrophobicContact CD-CE1 4.24Å; K90-Y171 HydrophobicContact CG-CD1 4.13Å; K90-Y171 HydrophobicContact CG-CE1 3.6Å; K90-Y171 PolarHBondContact NZ-OH 2.96Å; K90-N199 HydrophobicContact CB-CB 4.2Å; K90-N199 WeakPolarHBondContact CD-OD1 3.47Å; K90-N199 PolarHBondContact NZ-OD1 3.39Å
91	K	76.9	Confident	69.8	Low	59 Å²	59	59.4 Å²	59.4	26%	0.257	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-67.3	137.8	167.6	-141.4	160.5	-173.2	166.4	0	110.1	S95 S96 Y97 T168 D169 L170	K91-S95 WeakPolarHBondContact CE-O 3.44Å; K91-S95 WeakPolarHBondContact CG-O 3.27Å; K91-S96 CarbonylContact C-O 3.55Å; K91-S96 WeakPolarHBondContact CA-O 3.31Å; K91-Y97 HydrophobicContact CB-CD1 4.27Å; K91-Y97 HydrophobicContact CB-CE1 3.8Å; K91-Y97 HydrophobicContact CD-CE1 4.4Å; K91-Y97 HydrophobicContact CD-CE2 3.95Å; K91-Y97 HydrophobicContact CG-CD1 4.45Å; K91-Y97 HydrophobicContact CG-CD2 4.37Å; K91-Y97 HydrophobicContact CG-CE1 4.06Å; K91-Y97 HydrophobicContact CG-CE2 3.97Å; K91-T168 PolarHBondContact NZ-O 3.32Å; K91-D169 WeakPolarHBondContact CD-O 3.4Å; K91-D169 PolarHBondContact NZ-O 2.94Å; K91-L170 PolarHBondContact N-O 3.19Å
92	H	70.3	Confident	71.1	Confident	89 Å²	89	54.7 Å²	54.7	41%	0.412	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-87.2	171.8	176.1	-85.2	-67.1	0	0	0	111.4	D94 S95 S96 N134	H92-D94 WeakPolarHBondContact CB-OD1 3.4Å; H92-D94 PolarHBondContact O-N 2.98Å; H92-S95 PolarHBondContact O-N 2.66Å; H92-S96 PolarHBondContact N-O 3.46Å; H92-N134 PolarHBondContact NE2-OD1 2.86Å
93	S	68	Low	71.9	Confident	134 Å²	134	55.3 Å²	55.3	94%	0.937	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-15.1	177.2	48.6	0	0	0	0	114.3	S95	S93-S95 PolarHBondContact O-N 3.5Å
94	D	70.6	Confident	72.3	Confident	106 Å²	106	52.1 Å²	52.1	57%	0.567	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	8.9	171	71	-12.9	0	0	0	113.1	H92 S96	H92-D94 WeakPolarHBondContact CB-OD1 3.4Å; H92-D94 PolarHBondContact O-N 2.98Å; D94-S96 PolarHBondContact O-N 2.89Å; D94-S96 VanDerWaalsContact O-N 3.11Å; D94-S96 WeakPolarHBondContact OD1-CA 3.39Å; D94-S96 VanDerWaalsContact OD1-CB 3.26Å; D94-S96 WeakPolarHBondContact OD1-CB 3.36Å; D94-S96 PolarHBondContact OD1-N 3.31Å; D94-S96 PolarHBondContact OD1-OG 3.45Å; D94-S96 WeakPolarHBondContact OD2-CB 3.49Å; D94-S96 PolarHBondContact OD2-OG 2.99Å
95	S	69.5	Low	72.2	Confident	90 Å²	90	49.7 Å²	49.7	63%	0.629	26%	0.262	S	S	*	.	S	Bend	trans	60.3	7.7	-171.6	-60.8	0	0	0	0	115.6	K91 H92 S93	K91-S95 WeakPolarHBondContact CE-O 3.44Å; K91-S95 WeakPolarHBondContact CG-O 3.27Å; H92-S95 PolarHBondContact O-N 2.66Å; S93-S95 PolarHBondContact O-N 3.5Å
96	S	74.1	Confident	72.1	Confident	42 Å²	42	49.4 Å²	49.4	29%	0.294	26%	0.261	S	S	.	.	S	Bend	trans	-91.4	168.3	174	92.8	0	0	0	0	111.4	K91 H92 D94 G98	K91-S96 CarbonylContact C-O 3.55Å; K91-S96 WeakPolarHBondContact CA-O 3.31Å; H92-S96 PolarHBondContact N-O 3.46Å; D94-S96 PolarHBondContact O-N 2.89Å; D94-S96 VanDerWaalsContact O-N 3.11Å; D94-S96 WeakPolarHBondContact OD1-CA 3.39Å; D94-S96 VanDerWaalsContact OD1-CB 3.26Å; D94-S96 WeakPolarHBondContact OD1-CB 3.36Å; D94-S96 PolarHBondContact OD1-N 3.31Å; D94-S96 PolarHBondContact OD1-OG 3.45Å; D94-S96 WeakPolarHBondContact OD2-CB 3.49Å; D94-S96 PolarHBondContact OD2-OG 2.99Å; S96-G98 PolarHBondContact OG-N 2.87Å
97	Y	75.2	Confident	71.6	Confident	10 Å²	10	48.1 Å²	48.1	4%	0.039	26%	0.257	C	S	.	.			trans	-96.3	8.1	167.5	-70.2	-84.7	0	0	0	112.5	L89 K91 I99 N134 I165 T168 D169 L172	L89-Y97 HydrophobicContact CB-CD1 3.9Å; K91-Y97 HydrophobicContact CB-CD1 4.27Å; K91-Y97 HydrophobicContact CB-CE1 3.8Å; K91-Y97 HydrophobicContact CD-CE1 4.4Å; K91-Y97 HydrophobicContact CD-CE2 3.95Å; K91-Y97 HydrophobicContact CG-CD1 4.45Å; K91-Y97 HydrophobicContact CG-CD2 4.37Å; K91-Y97 HydrophobicContact CG-CE1 4.06Å; K91-Y97 HydrophobicContact CG-CE2 3.97Å; Y97-I99 VanDerWaalsContact C-N 3.32Å; Y97-I99 PolarHBondContact O-N 3.35Å; Y97-N134 PolarHBondContact O-ND2 2.97Å; Y97-I165 HydrophobicContact CD2-CG2 4Å; Y97-I165 HydrophobicContact CE2-CG2 4.39Å; Y97-I165 VanDerWaalsContact CE2-O 3.25Å; Y97-I165 WeakPolarHBondContact CE2-O 3.44Å; Y97-T168 PolarHBondContact OH-O 3.38Å; Y97-T168 PolarHBondContact OH-OG1 3.13Å; Y97-D169 PolarHBondContact OH-O 3.04Å; Y97-L172 HydrophobicContact CD1-CB 3.7Å; Y97-L172 HydrophobicContact CD1-CD2 3.95Å; Y97-L172 HydrophobicContact CD2-CB 4.48Å; Y97-L172 HydrophobicContact CD2-CD2 3.72Å; Y97-L172 HydrophobicContact CE1-CB 3.41Å; Y97-L172 VanDerWaalsContact CE1-CB 3.41Å; Y97-L172 HydrophobicContact CE1-CD2 4.32Å; Y97-L172 HydrophobicContact CE2-CB 4.24Å; Y97-L172 HydrophobicContact CE2-CD2 4.11Å; Y97-L172 HydrophobicContact CG-CB 4.22Å; Y97-L172 HydrophobicContact CG-CD2 3.62Å
98	G	71.4	Confident	71	Confident	12 Å²	12	50.3 Å²	50.3	12%	0.124	27%	0.267	C	S	.	.	S	Bend	trans	59.5	37.8	-176.9	0	0	0	0	0	113.9	S96 G131 N134	S96-G98 PolarHBondContact OG-N 2.87Å; G98-G131 WeakPolarHBondContact O-CA 3.44Å; G98-G131 PolarHBondContact O-N 3.05Å; G98-N134 WeakPolarHBondContact O-CB 3.5Å; G98-N134 PolarHBondContact O-ND2 2.96Å
99	I	77.1	Confident	70.3	Confident	31 Å²	31	49.1 Å²	49.1	16%	0.159	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	153.5	179.8	64.2	176.9	0	0	0	111.4	L89 Y97 D129 L139 L172 L174	L89-I99 HydrophobicContact CD1-CD1 4.01Å; L89-I99 HydrophobicContact CD1-CG2 3.66Å; Y97-I99 VanDerWaalsContact C-N 3.32Å; Y97-I99 PolarHBondContact O-N 3.35Å; I99-D129 WeakPolarHBondContact CA-O 3.27Å; I99-L139 HydrophobicContact CB-CD1 4.3Å; I99-L139 HydrophobicContact CG2-CD1 3.52Å; I99-L172 HydrophobicContact CD1-CD2 4.14Å; I99-L174 HydrophobicContact CD1-CD1 4.05Å
100	F	76.8	Confident	69.2	Low	114 Å²	114	53.2 Å²	53.2	50%	0.5	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.6	172.8	-77.4	-89.2	0	0	0	110.7	T128 D129	F100-T128 WeakPolarHBondContact O-CA 3.5Å; F100-D129 PolarHBondContact N-O 3.11Å; F100-D129 PolarHBondContact O-N 3.38Å
101	L	77.8	Confident	68.4	Low	26 Å²	26	51.3 Å²	51.3	14%	0.136	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	124.3	166	-72	169.6	0	0	0	109.6	L126 L127 T128 L145 R158 V161 V162 I165	L101-L126 HydrophobicContact CD2-CB 4.49Å; L101-L127 WeakPolarHBondContact CA-O 3.48Å; L101-T128 HydrophobicContact CD2-CG2 3.49Å; L101-T128 VanDerWaalsContact CD2-CG2 3.49Å; L101-L145 HydrophobicContact CD2-CD2 3.97Å; L101-R158 PolarHBondContact O-NH2 3.3Å; L101-V161 HydrophobicContact CD1-CG1 4.15Å; L101-V162 HydrophobicContact CD1-CG2 3.81Å; L101-I165 HydrophobicContact CD1-CD1 3.83Å
102	R	75.3	Confident	67.5	Low	66 Å²	66	50.6 Å²	50.6	25%	0.249	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	159.1	167.1	72.4	-178.8	-175.5	106.8	-5.9	110.8	L127 D129 N381	R102-L127 HydrophobicContact CG-CB 3.85Å; R102-L127 HydrophobicContact CG-CD1 4.35Å; R102-L127 PolarHBondContact N-O 3.42Å; R102-L127 PolarHBondContact O-N 2.9Å; R102-D129 IonicContact NE-OD2 2.8Å; R102-D129 PolarHBondContact NE-OD2 3.19Å; R102-N381 PolarHBondContact NH1-OD1 3.16Å; R102-N381 PolarHBondContact NH2-OD1 3.44Å
103	R	72.8	Confident	66.9	Low	40 Å²	40	48.6 Å²	48.6	15%	0.151	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	146.2	173.2	-77.7	164.4	133.8	173	-4.9	110.7	E124 L126 S1599	R103-E124 IonicContact CZ-OE2 2.65Å; R103-E124 IonicContact NE-OE2 2.81Å; R103-E124 PolarHBondContact NE-OE2 3.19Å; R103-E124 IonicContact NH2-OE2 3.21Å; R103-E124 PolarHBondContact NH2-OE2 3.03Å; R103-L126 HydrophobicContact CG-CD2 4.23Å; R103-S1599 WeakPolarHBondContact CD-OG 3.43Å; R103-S1599 PolarHBondContact NE-OG 3.03Å; R103-S1599 PolarHBondContact NH1-O 2.92Å
104	G	65.7	Low	66	Low	3 Å²	3	50.5 Å²	50.5	3%	0.031	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	153	-172.2	0	0	0	0	0	111.8	V125	G104-V125 WeakPolarHBondContact CA-O 3.47Å; G104-V125 PolarHBondContact N-O 3.37Å; G104-V125 PolarHBondContact O-N 3.17Å
105	L	64.3	Low	65.1	Low	35 Å²	35	51.4 Å²	51.4	18%	0.183	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	112.2	178.7	-170.3	152.6	0	0	0	107.9	V107 R122 L1596 K1600	L105-V107 HydrophobicContact CD2-CG2 3.37Å; L105-R122 HydrophobicContact CD2-CB 4.3Å; L105-R122 HydrophobicContact CD2-CG 4.29Å; L105-L1596 HydrophobicContact CB-CD1 3.95Å; L105-L1596 HydrophobicContact CB-CD2 4.42Å; L105-L1596 HydrophobicContact CD1-CD1 4.02Å; L105-L1596 HydrophobicContact CD1-CD2 3.64Å; L105-L1596 HydrophobicContact CD1-CG 4.06Å; L105-L1596 HydrophobicContact CG-CD1 3.99Å; L105-L1596 HydrophobicContact CG-CD2 3.58Å; L105-L1596 HydrophobicContact CG-CG 4.27Å; L105-K1600 VanDerWaalsContact CD1-NZ 3.29Å
106	L	65.4	Low	64.5	Low	5 Å²	5	47.4 Å²	47.4	3%	0.026	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	120.2	175.7	169.4	54.2	0	0	0	109	H108 R122 S123 V125 Y144 L179 P180	L106-H108 WeakPolarHBondContact CD2-NE2 3.49Å; L106-R122 WeakPolarHBondContact O-CA 3.31Å; L106-S123 PolarHBondContact N-O 3.45Å; L106-S123 PolarHBondContact O-N 2.93Å; L106-S123 PolarHBondContact O-OG 3.01Å; L106-V125 HydrophobicContact CB-CG1 3.87Å; L106-V125 HydrophobicContact CB-CG2 3.94Å; L106-V125 HydrophobicContact CD2-CG1 3.69Å; L106-V125 HydrophobicContact CG-CG1 4.46Å; L106-Y144 HydrophobicContact CD2-CD1 4.4Å; L106-Y144 HydrophobicContact CD2-CE1 4.19Å; L106-L179 HydrophobicContact CB-CD2 4.11Å; L106-L179 HydrophobicContact CD1-CD2 3.87Å; L106-L179 HydrophobicContact CG-CD2 4.45Å; L106-P180 HydrophobicContact CD1-CG 3.75Å
107	V	60.6	Low	63.8	Low	20 Å²	20	46.7 Å²	46.7	12%	0.121	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	105.2	176.2	-168.7	0	0	0	0	109.4	L105 R109 E120 R122 M378	L105-V107 HydrophobicContact CD2-CG2 3.37Å; V107-R109 HydrophobicContact CG1-CG 4.06Å; V107-E120 HydrophobicContact CG1-CB 4.35Å; V107-E120 VanDerWaalsContact CG1-CD 3.45Å; V107-E120 HydrophobicContact CG1-CG 3.57Å; V107-R122 HydrophobicContact CG1-CG 4.44Å; V107-R122 HydrophobicContact CG2-CG 4.47Å; V107-M378 HydrophobicContact CG2-CE 4.46Å; V107-M378 HydrophobicContact CG2-SD 4.3Å
108	H	59.4	Low	63.2	Low	48 Å²	48	46.4 Å²	46.4	22%	0.222	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	136	167.9	-76.6	-88.5	0	0	0	110.3	H79 L106 F110 E120 N121	H79-H108 AromaticContact CE1-ND1 3.74Å; H79-H108 AromaticContact NE2-ND1 3.54Å; L106-H108 WeakPolarHBondContact CD2-NE2 3.49Å; H108-F110 HydrophobicContact CB-CD2 4.41Å; H108-F110 HydrophobicContact CB-CE1 4.36Å; H108-F110 HydrophobicContact CB-CE2 3.5Å; H108-F110 HydrophobicContact CB-CZ 3.48Å; H108-F110 VanDerWaalsContact CB-CZ 3.48Å; H108-E120 CarbonylContact O-C 3.59Å; H108-E120 WeakPolarHBondContact O-CA 3.41Å; H108-N121 HydrophobicContact CB-CB 4.5Å; H108-N121 PolarHBondContact N-O 3.08Å; H108-N121 PolarHBondContact O-N 2.59Å
109	R	59.7	Low	62.5	Low	17 Å²	17	50.2 Å²	50.2	6%	0.064	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	104.3	-171.9	-86.6	174.8	175.6	-165.7	-4.8	109.2	F77 V107 I118 L119 E120 Y357 G358 P1142	F77-R109 WeakPolarHBondContact CB-O 3.45Å; V107-R109 HydrophobicContact CG1-CG 4.06Å; R109-I118 HydrophobicContact CB-CG2 3.59Å; R109-I118 HydrophobicContact CG-CG2 3.72Å; R109-L119 WeakPolarHBondContact CA-O 3.42Å; R109-E120 HydrophobicContact CG-CG 3.74Å; R109-E120 IonicContact CZ-OE1 3.26Å; R109-E120 IonicContact NE-OE1 2.86Å; R109-E120 PolarHBondContact NE-OE1 3.35Å; R109-E120 IonicContact NH2-OE1 2.76Å; R109-E120 PolarHBondContact NH2-OE1 3.1Å; R109-Y357 PolarHBondContact NH1-O 3.48Å; R109-G358 WeakPolarHBondContact CB-O 3.29Å; R109-G358 WeakPolarHBondContact CD-O 3.18Å; R109-P1142 PolarHBondContact NH2-O 3.18Å
110	F	51.2	Low	61.7	Low	91 Å²	91	50.7 Å²	50.7	40%	0.399	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-41.3	-158.7	-63.3	-90.9	0	0	0	115.6	F77 H108 L119 N121	F77-F110 WeakPolarHBondContact CD2-O 3.21Å; F77-F110 PolarHBondContact N-O 3.22Å; H108-F110 HydrophobicContact CB-CD2 4.41Å; H108-F110 HydrophobicContact CB-CE1 4.36Å; H108-F110 HydrophobicContact CB-CE2 3.5Å; H108-F110 HydrophobicContact CB-CZ 3.48Å; H108-F110 VanDerWaalsContact CB-CZ 3.48Å; F110-L119 PolarHBondContact N-O 3.36Å; F110-N121 HydrophobicContact CE2-CB 3.62Å; F110-N121 HydrophobicContact CZ-CB 4.24Å
111	H	54.8	Low	60.8	Low	39 Å²	39	46.5 Å²	46.5	18%	0.181	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	142.6	-175	-82.7	-41.1	0	0	0	111.4	K74 G75 N76 I118 L119	K74-H111 WeakPolarHBondContact CB-CE1 3.44Å; K74-H111 WeakPolarHBondContact CB-NE2 3.34Å; G75-H111 VanDerWaalsContact C-ND1 3.31Å; G75-H111 PolarHBondContact O-ND1 2.9Å; N76-H111 PolarHBondContact OD1-CE1 3.5Å; H111-I118 CarbonylContact O-C 3.15Å; H111-I118 VanDerWaalsContact O-CA 3.28Å; H111-I118 WeakPolarHBondContact O-CA 3.31Å; H111-L119 HydrophobicContact CB-CD1 4.3Å; H111-L119 PolarHBondContact O-N 2.92Å
112	L	57.3	Low	60.2	Low	45 Å²	45	48.6 Å²	48.6	24%	0.236	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	125.7	164.6	-169.3	79.5	0	0	0	108.4	F77 I118 I354 I1145	F77-L112 HydrophobicContact CE2-CB 4.27Å; L112-I118 HydrophobicContact CD1-CG1 3.56Å; L112-I354 HydrophobicContact CD2-CD1 4.46Å; L112-I354 HydrophobicContact CD2-CG2 4.11Å; L112-I1145 HydrophobicContact CD1-CG2 3.79Å
113	T	58.1	Low	59.7	Low	47 Å²	47	46.1 Å²	46.1	29%	0.288	23%	0.232	S	C	.	.			trans	-79.6	159.2	170.4	57.3	0	0	0	0	111.1	D115 G116 F117 L119	T113-D115 PolarHBondContact O-N 2.96Å; T113-D115 VanDerWaalsContact O-N 3.08Å; T113-G116 PolarHBondContact O-N 3.47Å; T113-F117 PolarHBondContact N-O 3.14Å; T113-F117 WeakPolarHBondContact OG1-CA 3.49Å; T113-F117 WeakPolarHBondContact OG1-CB 3.22Å; T113-F117 PolarHBondContact OG1-N 3.26Å; T113-F117 PolarHBondContact OG1-O 3.19Å; T113-L119 HydrophobicContact CG2-CD2 4.46Å; T113-L119 HydrophobicContact CG2-CG 4.49Å
114	N	50.1	Low	59.6	Low	174 Å²	174	45.8 Å²	45.8	93%	0.93	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.4	178.7	-64.3	0.4	0	0	0	113.2	G116	N114-G116 VanDerWaalsContact C-N 3.32Å
115	D	51.7	Low	60	Low	125 Å²	125	46.3 Å²	46.3	67%	0.668	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	5.8	178.5	-58.3	-49.9	0	0	0	114.3	T113 F117	T113-D115 PolarHBondContact O-N 2.96Å; T113-D115 VanDerWaalsContact O-N 3.08Å; D115-F117 HydrophobicContact CB-CD2 3.91Å; D115-F117 HydrophobicContact CB-CE2 3.84Å
116	G	57	Low	60.8	Low	5 Å²	5	45.3 Å²	45.3	5%	0.052	23%	0.229	C	C	.	.	S	Bend	trans	84.4	13.4	175.2	0	0	0	0	0	115.8	T113 N114 R1144 I1145	T113-G116 PolarHBondContact O-N 3.47Å; N114-G116 VanDerWaalsContact C-N 3.32Å; G116-R1144 WeakPolarHBondContact O-CA 3.38Å; G116-I1145 PolarHBondContact O-N 2.91Å
117	F	58.4	Low	61.4	Low	28 Å²	28	45 Å²	45	12%	0.123	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-86.4	128.6	170	-57	-91.4	0	0	0	110.3	T113 D115 L1138 R1144	T113-F117 PolarHBondContact N-O 3.14Å; T113-F117 WeakPolarHBondContact OG1-CA 3.49Å; T113-F117 WeakPolarHBondContact OG1-CB 3.22Å; T113-F117 PolarHBondContact OG1-N 3.26Å; T113-F117 PolarHBondContact OG1-O 3.19Å; D115-F117 HydrophobicContact CB-CD2 3.91Å; D115-F117 HydrophobicContact CB-CE2 3.84Å; F117-L1138 HydrophobicContact CD1-CD2 4.4Å; F117-L1138 HydrophobicContact CE1-CB 3.79Å; F117-L1138 HydrophobicContact CE1-CD1 4.11Å; F117-L1138 HydrophobicContact CE1-CD2 3.82Å; F117-L1138 HydrophobicContact CE1-CG 4.11Å; F117-L1138 HydrophobicContact CE2-CD1 4.09Å; F117-L1138 HydrophobicContact CZ-CB 3.75Å; F117-L1138 HydrophobicContact CZ-CD1 3.57Å; F117-L1138 HydrophobicContact CZ-CD2 4.16Å; F117-L1138 HydrophobicContact CZ-CG 4.04Å; F117-R1144 HydrophobicContact CD1-CB 4.2Å; F117-R1144 HydrophobicContact CD1-CG 3.84Å; F117-R1144 HydrophobicContact CE1-CB 4.47Å; F117-R1144 HydrophobicContact CE1-CG 3.92Å; F117-R1144 HydrophobicContact CG-CG 4.35Å; F117-R1144 HydrophobicContact CZ-CG 4.48Å; F117-R1144 VanDerWaalsContact CZ-NE 3.27Å
118	I	62.9	Low	62.2	Low	4 Å²	4	44.1 Å²	44.1	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	133.4	163	-53	168.6	0	0	0	107.5	F77 R109 H111 L112 E120 Y357 A1143 I1145	F77-I118 HydrophobicContact CE2-CG2 3.91Å; F77-I118 HydrophobicContact CZ-CD1 4.22Å; F77-I118 HydrophobicContact CZ-CG1 4.21Å; F77-I118 HydrophobicContact CZ-CG2 4.07Å; R109-I118 HydrophobicContact CB-CG2 3.59Å; R109-I118 HydrophobicContact CG-CG2 3.72Å; H111-I118 CarbonylContact O-C 3.15Å; H111-I118 VanDerWaalsContact O-CA 3.28Å; H111-I118 WeakPolarHBondContact O-CA 3.31Å; L112-I118 HydrophobicContact CD1-CG1 3.56Å; I118-E120 PolarHBondContact O-N 3.25Å; I118-Y357 HydrophobicContact CD1-CD1 4.1Å; I118-A1143 HydrophobicContact CB-CB 4.35Å; I118-A1143 WeakPolarHBondContact CB-O 3.37Å; I118-A1143 WeakPolarHBondContact CG1-O 3.37Å; I118-A1143 PolarHBondContact N-O 3.4Å; I118-A1143 WeakPolarHBondContact O-CB 3.18Å; I118-I1145 HydrophobicContact CD1-CG2 4.27Å; I118-I1145 HydrophobicContact CG1-CG2 4.45Å
119	L	57.2	Low	62.7	Low	92 Å²	92	42 Å²	42	48%	0.482	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	114.9	174.8	-66.6	179.3	0	0	0	110.3	R109 F110 H111 T113	R109-L119 WeakPolarHBondContact CA-O 3.42Å; F110-L119 PolarHBondContact N-O 3.36Å; H111-L119 HydrophobicContact CB-CD1 4.3Å; H111-L119 PolarHBondContact O-N 2.92Å; T113-L119 HydrophobicContact CG2-CD2 4.46Å; T113-L119 HydrophobicContact CG2-CG 4.49Å
120	E	60.6	Low	63.2	Low	40 Å²	40	42.3 Å²	42.3	19%	0.187	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132.2	177	-85	-174	-172	0	0	113.3	V107 H108 R109 I118 R122 A1143	V107-E120 HydrophobicContact CG1-CB 4.35Å; V107-E120 VanDerWaalsContact CG1-CD 3.45Å; V107-E120 HydrophobicContact CG1-CG 3.57Å; H108-E120 CarbonylContact O-C 3.59Å; H108-E120 WeakPolarHBondContact O-CA 3.41Å; R109-E120 HydrophobicContact CG-CG 3.74Å; R109-E120 IonicContact CZ-OE1 3.26Å; R109-E120 IonicContact NE-OE1 2.86Å; R109-E120 PolarHBondContact NE-OE1 3.35Å; R109-E120 IonicContact NH2-OE1 2.76Å; R109-E120 PolarHBondContact NH2-OE1 3.1Å; I118-E120 PolarHBondContact O-N 3.25Å; E120-R122 IonicContact OE2-CZ 3.82Å; E120-R122 VanDerWaalsContact OE2-CZ 3.25Å; E120-R122 IonicContact OE2-NE 3.79Å; E120-R122 PolarHBondContact OE2-NE 3.38Å; E120-R122 IonicContact OE2-NH2 2.74Å; E120-R122 PolarHBondContact OE2-NH2 2.94Å; E120-A1143 HydrophobicContact CB-CB 4.43Å; E120-A1143 HydrophobicContact CG-CB 3.64Å; E120-A1143 WeakPolarHBondContact OE1-CB 3.08Å
121	N	57.8	Low	63.6	Low	27 Å²	27	38.2 Å²	38.2	14%	0.144	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	146.8	150.2	-168.7	7.6	0	0	0	108.7	H108 F110 S1589	H108-N121 HydrophobicContact CB-CB 4.5Å; H108-N121 PolarHBondContact N-O 3.08Å; H108-N121 PolarHBondContact O-N 2.59Å; F110-N121 HydrophobicContact CE2-CB 3.62Å; F110-N121 HydrophobicContact CZ-CB 4.24Å; N121-S1589 PolarHBondContact OD1-O 3.17Å; N121-S1589 PolarHBondContact OD1-OG 3.16Å
122	R	64.6	Low	63.6	Low	70 Å²	70	43.1 Å²	43.1	26%	0.264	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	110	-179.4	-64.5	-176	-175.9	170.5	2.3	108.9	L105 L106 V107 E120 K1593 L1596	L105-R122 HydrophobicContact CD2-CB 4.3Å; L105-R122 HydrophobicContact CD2-CG 4.29Å; L106-R122 WeakPolarHBondContact O-CA 3.31Å; V107-R122 HydrophobicContact CG1-CG 4.44Å; V107-R122 HydrophobicContact CG2-CG 4.47Å; E120-R122 IonicContact OE2-CZ 3.82Å; E120-R122 VanDerWaalsContact OE2-CZ 3.25Å; E120-R122 IonicContact OE2-NE 3.79Å; E120-R122 PolarHBondContact OE2-NE 3.38Å; E120-R122 IonicContact OE2-NH2 2.74Å; E120-R122 PolarHBondContact OE2-NH2 2.94Å; R122-K1593 HydrophobicContact CB-CG 4.4Å; R122-K1593 WeakPolarHBondContact O-CG 3.43Å; R122-L1596 HydrophobicContact CB-CD2 4.16Å
123	S	64.3	Low	63.3	Low	13 Å²	13	50 Å²	50	9%	0.091	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.1	-177.4	39.2	0	0	0	0	111.8	L106	L106-S123 PolarHBondContact N-O 3.45Å; L106-S123 PolarHBondContact O-N 2.93Å; L106-S123 PolarHBondContact O-OG 3.01Å
124	E	70	Confident	62.9	Low	34 Å²	34	48.4 Å²	48.4	16%	0.159	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	134.7	162.2	169.6	116.3	-54.6	0	0	109.4	R103 I1592 L1596 S1599	R103-E124 IonicContact CZ-OE2 2.65Å; R103-E124 IonicContact NE-OE2 2.81Å; R103-E124 PolarHBondContact NE-OE2 3.19Å; R103-E124 IonicContact NH2-OE2 3.21Å; R103-E124 PolarHBondContact NH2-OE2 3.03Å; E124-I1592 HydrophobicContact CB-CG2 4.39Å; E124-L1596 HydrophobicContact CB-CB 3.81Å; E124-L1596 HydrophobicContact CB-CD1 4.13Å; E124-L1596 HydrophobicContact CB-CG 4.47Å; E124-S1599 WeakPolarHBondContact OE1-CB 3.4Å; E124-S1599 PolarHBondContact OE1-OG 3.39Å; E124-S1599 WeakPolarHBondContact OE2-CB 3.22Å; E124-S1599 PolarHBondContact OE2-OG 3.17Å; E124-S1599 VanDerWaalsContact OE2-OG 3.05Å
125	V	75.9	Confident	62.9	Low	14 Å²	14	42.9 Å²	42.9	9%	0.085	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.9	161.9	-66.5	0	0	0	0	110.7	G104 L106 L127 Y144 L179	G104-V125 WeakPolarHBondContact CA-O 3.47Å; G104-V125 PolarHBondContact N-O 3.37Å; G104-V125 PolarHBondContact O-N 3.17Å; L106-V125 HydrophobicContact CB-CG1 3.87Å; L106-V125 HydrophobicContact CB-CG2 3.94Å; L106-V125 HydrophobicContact CD2-CG1 3.69Å; L106-V125 HydrophobicContact CG-CG1 4.46Å; V125-L127 HydrophobicContact CG2-CD2 3.71Å; V125-L127 HydrophobicContact CG2-CG 4.33Å; V125-Y144 HydrophobicContact CB-CD2 4.02Å; V125-Y144 HydrophobicContact CB-CG 4.08Å; V125-Y144 HydrophobicContact CG1-CD2 3.83Å; V125-Y144 HydrophobicContact CG1-CE2 4.26Å; V125-Y144 HydrophobicContact CG1-CG 4.02Å; V125-Y144 HydrophobicContact CG2-CG 4.41Å; V125-L179 HydrophobicContact CG2-CD2 4.18Å
126	L	79.4	Confident	62.8	Low	13 Å²	13	40 Å²	40	7%	0.068	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	124.9	164.7	-79.6	164.5	0	0	0	108.8	L101 R103 Y144 L145 V153 R158 V161	L101-L126 HydrophobicContact CD2-CB 4.49Å; R103-L126 HydrophobicContact CG-CD2 4.23Å; L126-Y144 CarbonylContact O-C 3.55Å; L126-Y144 WeakPolarHBondContact O-CA 3.5Å; L126-L145 PolarHBondContact O-N 3.29Å; L126-V153 HydrophobicContact CD1-CG1 3.93Å; L126-R158 HydrophobicContact CD1-CB 4.19Å; L126-R158 HydrophobicContact CD1-CG 4.4Å; L126-R158 HydrophobicContact CD2-CB 4.13Å; L126-R158 HydrophobicContact CD2-CG 3.77Å; L126-V161 HydrophobicContact CD1-CB 4.31Å; L126-V161 HydrophobicContact CD1-CG1 4.33Å; L126-V161 HydrophobicContact CD1-CG2 4.05Å
127	L	78.5	Confident	62.9	Low	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	130.7	176.7	-57.8	177.5	0	0	0	110.4	L101 R102 V125 D143 L179	L101-L127 WeakPolarHBondContact CA-O 3.48Å; R102-L127 HydrophobicContact CG-CB 3.85Å; R102-L127 HydrophobicContact CG-CD1 4.35Å; R102-L127 PolarHBondContact N-O 3.42Å; R102-L127 PolarHBondContact O-N 2.9Å; V125-L127 HydrophobicContact CG2-CD2 3.71Å; V125-L127 HydrophobicContact CG2-CG 4.33Å; L127-D143 CarbonylContact C-O 3.53Å; L127-D143 WeakPolarHBondContact CA-O 3.33Å; L127-D143 WeakPolarHBondContact CD2-O 3.41Å; L127-L179 HydrophobicContact CD1-CD1 4.03Å; L127-L179 HydrophobicContact CD2-CD1 3.69Å; L127-L179 HydrophobicContact CD2-CD2 4.18Å; L127-L179 HydrophobicContact CD2-CG 3.87Å
128	T	78.1	Confident	62.8	Low	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	112.4	174	42.3	0	0	0	0	110	F100 L101 D143 L145 L174	F100-T128 WeakPolarHBondContact O-CA 3.5Å; L101-T128 HydrophobicContact CD2-CG2 3.49Å; L101-T128 VanDerWaalsContact CD2-CG2 3.49Å; T128-D143 PolarHBondContact N-O 3Å; T128-D143 WeakPolarHBondContact O-CB 3.2Å; T128-D143 WeakPolarHBondContact OG1-CB 3.44Å; T128-L145 HydrophobicContact CG2-CB 3.98Å; T128-L145 HydrophobicContact CG2-CD1 4.25Å; T128-L145 HydrophobicContact CG2-CD2 4.05Å; T128-L145 HydrophobicContact CG2-CG 4.33Å; T128-L174 HydrophobicContact CG2-CD1 4.35Å
129	D	70	Confident	63.1	Low	4 Å²	4	39.2 Å²	39.2	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	154.4	170.7	-62.6	-36.9	0	0	0	110.9	I99 F100 R102 P141 G142 K386	I99-D129 WeakPolarHBondContact CA-O 3.27Å; F100-D129 PolarHBondContact N-O 3.11Å; F100-D129 PolarHBondContact O-N 3.38Å; R102-D129 IonicContact NE-OD2 2.8Å; R102-D129 PolarHBondContact NE-OD2 3.19Å; D129-P141 WeakPolarHBondContact OD1-CA 3.31Å; D129-G142 PolarHBondContact OD1-N 2.96Å; D129-G142 VanDerWaalsContact OD1-N 3.1Å; D129-K386 HydrophobicContact CB-CD 3.78Å; D129-K386 IonicContact OD2-NZ 2.66Å; D129-K386 PolarHBondContact OD2-NZ 3.37Å
130	Y	69.7	Low	63.6	Low	23 Å²	23	35.9 Å²	35.9	9%	0.09	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	148.5	169.2	62.4	-97.8	0	0	0	112.6	C137 P141 K386 D389	Y130-C137 WeakPolarHBondContact CB-SG 3.45Å; Y130-P141 HydrophobicContact CE1-CG 3.84Å; Y130-K386 WeakPolarHBondContact O-CE 3.4Å; Y130-K386 PolarHBondContact OH-O 3.19Å; Y130-D389 WeakPolarHBondContact OH-CB 3.39Å
131	G	59.5	Low	63.9	Low	5 Å²	5	34 Å²	34	5%	0.052	19%	0.188	C	C	.	.			trans	-82.4	161.4	172.9	0	0	0	0	0	113.6	G98 Q133 N134	G98-G131 WeakPolarHBondContact O-CA 3.44Å; G98-G131 PolarHBondContact O-N 3.05Å; G131-Q133 PolarHBondContact O-N 3.31Å; G131-Q133 VanDerWaalsContact O-N 3.11Å; G131-N134 PolarHBondContact O-N 3.15Å
132	V	55.2	Low	64.3	Low	143 Å²	143	32.8 Å²	32.8	87%	0.867	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-34.4	-170.3	-177.5	0	0	0	0	113.6
133	Q	51	Low	64.9	Low	190 Å²	190	29.4 Å²	29.4	89%	0.888	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-7	179.4	-62.1	-173.2	-0.6	0	0	114.1	G131	G131-Q133 PolarHBondContact O-N 3.31Å; G131-Q133 VanDerWaalsContact O-N 3.11Å
134	N	50.2	Low	65.7	Low	12 Å²	12	30.6 Å²	30.6	6%	0.064	17%	0.171	C	C	.	.			trans	-118.7	41.1	-156.9	-150	26.9	0	0	0	114.5	H92 Y97 G98 G131 S136 C137	H92-N134 PolarHBondContact NE2-OD1 2.86Å; Y97-N134 PolarHBondContact O-ND2 2.97Å; G98-N134 WeakPolarHBondContact O-CB 3.5Å; G98-N134 PolarHBondContact O-ND2 2.96Å; G131-N134 PolarHBondContact O-N 3.15Å; N134-S136 PolarHBondContact O-N 3.41Å; N134-C137 WeakPolarHBondContact O-CB 3.37Å; N134-C137 PolarHBondContact O-N 2.99Å; N134-C137 VanDerWaalsContact O-N 3.14Å; N134-C137 PolarHBondContact O-SG 3.17Å
135	S	48.4	Very low	66.5	Low	58 Å²	58	29.1 Å²	29.1	41%	0.406	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-3.4	-179.2	66.6	0	0	0	0	115.7
136	S	49.6	Very low	66.9	Low	66 Å²	66	29.9 Å²	29.9	46%	0.462	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-6.5	174.9	47	0	0	0	0	114.4	N134 G138	N134-S136 PolarHBondContact O-N 3.41Å; S136-G138 VanDerWaalsContact C-N 3.27Å; S136-G138 PolarHBondContact O-N 3.28Å; S136-G138 VanDerWaalsContact O-N 3.17Å
137	C	59.9	Low	67.2	Low	5 Å²	5	29.8 Å²	29.8	3%	0.034	17%	0.17	C	C	.	.	S	Bend	trans	-74.8	0.7	-168.6	69.7	0	0	0	0	116.7	V87 L89 Y130 N134 L139	V87-C137 WeakPolarHBondContact CG1-O 3.41Å; L89-C137 HydrophobicContact CD2-CB 3.61Å; L89-C137 WeakPolarHBondContact CD2-O 3.45Å; Y130-C137 WeakPolarHBondContact CB-SG 3.45Å; N134-C137 WeakPolarHBondContact O-CB 3.37Å; N134-C137 PolarHBondContact O-N 2.99Å; N134-C137 VanDerWaalsContact O-N 3.14Å; N134-C137 PolarHBondContact O-SG 3.17Å; C137-L139 PolarHBondContact O-N 3.18Å; C137-L139 VanDerWaalsContact O-N 3.12Å
138	G	57	Low	67.5	Low	9 Å²	9	30 Å²	30	9%	0.093	17%	0.171	C	C	.	.	S	Bend	trans	76	-9.7	176	0	0	0	0	0	116.5	S136 R188	S136-G138 VanDerWaalsContact C-N 3.27Å; S136-G138 PolarHBondContact O-N 3.28Å; S136-G138 VanDerWaalsContact O-N 3.17Å; G138-R188 PolarHBondContact O-NH1 3.13Å
139	L	67.5	Low	67.7	Low	5 Å²	5	31.1 Å²	31.1	3%	0.026	18%	0.183	C	C	.	.			trans	-78.8	146.4	170	-62.2	171.9	0	0	0	111.3	V87 L89 I99 C137 D143 L174 V176	V87-L139 HydrophobicContact CB-CD2 4.3Å; V87-L139 HydrophobicContact CG1-CD2 4.16Å; V87-L139 HydrophobicContact CG1-CG 4.26Å; V87-L139 HydrophobicContact CG2-CD2 4.31Å; L89-L139 HydrophobicContact CD1-CD1 4.44Å; I99-L139 HydrophobicContact CB-CD1 4.3Å; I99-L139 HydrophobicContact CG2-CD1 3.52Å; C137-L139 PolarHBondContact O-N 3.18Å; C137-L139 VanDerWaalsContact O-N 3.12Å; L139-D143 WeakPolarHBondContact CA-OD2 3.39Å; L139-L174 HydrophobicContact CD1-CD1 4.35Å; L139-L174 HydrophobicContact CD2-CD1 4.49Å; L139-V176 HydrophobicContact CD2-CG1 3.88Å; L139-V176 HydrophobicContact CD2-CG2 4.25Å
140	L	68	Low	67.9	Low	22 Å²	22	37.5 Å²	37.5	12%	0.115	22%	0.217	C	C	.	.			trans	-117.8	162.6	170.4	-62.6	179.1	0	0	0	110.2	G142 D143 F186 R188 L390	L140-G142 PolarHBondContact O-N 3.45Å; L140-D143 PolarHBondContact N-OD2 2.88Å; L140-D143 PolarHBondContact O-N 3.45Å; L140-F186 HydrophobicContact CB-CD1 4.4Å; L140-F186 HydrophobicContact CB-CE1 4.03Å; L140-F186 HydrophobicContact CD1-CD1 4.13Å; L140-R188 HydrophobicContact CD1-CG 3.97Å; L140-R188 VanDerWaalsContact CD1-NE 3.31Å; L140-L390 HydrophobicContact CD2-CD2 4.03Å
141	P	66.9	Low	68.3	Low	2 Å²	2	42.3 Å²	42.3	1%	0.013	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	133.4	-177.7	-12.1	27.2	0	0	0	110.3	D129 Y130 D143 K386 V387 L390	D129-P141 WeakPolarHBondContact OD1-CA 3.31Å; Y130-P141 HydrophobicContact CE1-CG 3.84Å; P141-D143 VanDerWaalsContact C-N 3.33Å; P141-K386 HydrophobicContact CB-CB 3.96Å; P141-K386 HydrophobicContact CG-CB 3.84Å; P141-K386 VanDerWaalsContact CG-O 3.24Å; P141-K386 WeakPolarHBondContact CG-O 3.32Å; P141-V387 HydrophobicContact CB-CG2 3.68Å; P141-V387 HydrophobicContact CG-CG2 3.96Å; P141-L390 HydrophobicContact CG-CD1 4.04Å; P141-L390 HydrophobicContact CG-CD2 4.43Å; P141-L390 HydrophobicContact CG-CG 4.27Å
142	G	67.2	Low	69.3	Low	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	20	-178.2	0	0	0	0	0	115	D129 L140 Y144 L179	D129-G142 PolarHBondContact OD1-N 2.96Å; D129-G142 VanDerWaalsContact OD1-N 3.1Å; L140-G142 PolarHBondContact O-N 3.45Å; G142-Y144 PolarHBondContact O-N 3.09Å; G142-L179 WeakPolarHBondContact O-CB 3.49Å; G142-L179 VanDerWaalsContact O-CG 3.27Å; G142-L179 WeakPolarHBondContact O-CG 3.34Å
143	D	75.9	Confident	70.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	131.6	151.5	-92.5	-34	0	0	0	109.3	L127 T128 L139 L140 P141 V176 R188	L127-D143 CarbonylContact C-O 3.53Å; L127-D143 WeakPolarHBondContact CA-O 3.33Å; L127-D143 WeakPolarHBondContact CD2-O 3.41Å; T128-D143 PolarHBondContact N-O 3Å; T128-D143 WeakPolarHBondContact O-CB 3.2Å; T128-D143 WeakPolarHBondContact OG1-CB 3.44Å; L139-D143 WeakPolarHBondContact CA-OD2 3.39Å; L140-D143 PolarHBondContact N-OD2 2.88Å; L140-D143 PolarHBondContact O-N 3.45Å; P141-D143 VanDerWaalsContact C-N 3.33Å; D143-V176 HydrophobicContact CB-CB 4.12Å; D143-V176 HydrophobicContact CB-CG1 4.36Å; D143-V176 HydrophobicContact CB-CG2 4.41Å; D143-R188 IonicContact OD1-CZ 2.87Å; D143-R188 IonicContact OD1-NH1 3.96Å; D143-R188 IonicContact OD1-NH2 2.85Å; D143-R188 PolarHBondContact OD1-NH2 3.12Å; D143-R188 IonicContact OD2-CZ 3.69Å; D143-R188 IonicContact OD2-NH1 3.25Å; D143-R188 PolarHBondContact OD2-NH1 3.03Å; D143-R188 IonicContact OD2-NH2 3.69Å; D143-R188 PolarHBondContact OD2-NH2 3.43Å
144	Y	81.9	Confident	71.2	Confident	37 Å²	37	33.9 Å²	33.9	15%	0.145	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	139.3	164.5	100.7	-108.1	0	0	0	110.7	L106 V125 L126 G142 V146 V176 Q177	L106-Y144 HydrophobicContact CD2-CD1 4.4Å; L106-Y144 HydrophobicContact CD2-CE1 4.19Å; V125-Y144 HydrophobicContact CB-CD2 4.02Å; V125-Y144 HydrophobicContact CB-CG 4.08Å; V125-Y144 HydrophobicContact CG1-CD2 3.83Å; V125-Y144 HydrophobicContact CG1-CE2 4.26Å; V125-Y144 HydrophobicContact CG1-CG 4.02Å; V125-Y144 HydrophobicContact CG2-CG 4.41Å; L126-Y144 CarbonylContact O-C 3.55Å; L126-Y144 WeakPolarHBondContact O-CA 3.5Å; G142-Y144 PolarHBondContact O-N 3.09Å; Y144-V146 HydrophobicContact CD2-CG2 4.1Å; Y144-V146 HydrophobicContact CE1-CG2 4.42Å; Y144-V146 HydrophobicContact CE2-CB 4.28Å; Y144-V146 HydrophobicContact CE2-CG2 3.47Å; Y144-V146 VanDerWaalsContact CE2-CG2 3.47Å; Y144-V146 PolarHBondContact O-N 3.35Å; Y144-V176 CarbonylContact O-C 3.52Å; Y144-V176 VanDerWaalsContact O-CA 3.25Å; Y144-V176 WeakPolarHBondContact O-CA 2.93Å; Y144-V176 WeakPolarHBondContact O-CB 3.42Å; Y144-Q177 HydrophobicContact CD1-CB 4.09Å; Y144-Q177 VanDerWaalsContact CD1-O 3.23Å; Y144-Q177 WeakPolarHBondContact CD1-O 3.44Å; Y144-Q177 HydrophobicContact CE1-CB 3.62Å; Y144-Q177 HydrophobicContact CE1-CG 3.92Å; Y144-Q177 PolarHBondContact N-O 2.94Å; Y144-Q177 PolarHBondContact O-N 2.86Å; Y144-Q177 PolarHBondContact OH-OE1 3.06Å
145	L	86.2	Confident	71.9	Confident	4 Å²	4	35.8 Å²	35.8	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	115.5	-175.8	-177	60.8	0	0	0	110.3	L101 L126 T128 A147 V148 V153 V161 L174 V176	L101-L145 HydrophobicContact CD2-CD2 3.97Å; L126-L145 PolarHBondContact O-N 3.29Å; T128-L145 HydrophobicContact CG2-CB 3.98Å; T128-L145 HydrophobicContact CG2-CD1 4.25Å; T128-L145 HydrophobicContact CG2-CD2 4.05Å; T128-L145 HydrophobicContact CG2-CG 4.33Å; L145-A147 WeakPolarHBondContact CD1-O 3.48Å; L145-V148 HydrophobicContact CD1-CG2 4.26Å; L145-V148 HydrophobicContact CD2-CG2 3.83Å; L145-V148 HydrophobicContact CG-CG2 4.35Å; L145-V153 HydrophobicContact CD2-CG1 4.41Å; L145-V153 HydrophobicContact CD2-CG2 4.06Å; L145-V153 HydrophobicContact CG-CB 4.37Å; L145-V153 HydrophobicContact CG-CG1 4.33Å; L145-V153 HydrophobicContact CG-CG2 3.95Å; L145-V161 HydrophobicContact CD2-CG1 3.8Å; L145-L174 HydrophobicContact CD1-CB 3.91Å; L145-L174 HydrophobicContact CD1-CD1 4.48Å; L145-L174 HydrophobicContact CD1-CD2 3.86Å; L145-L174 HydrophobicContact CD1-CG 4.3Å; L145-V176 HydrophobicContact CD1-CG1 4.08Å
146	V	85.8	Confident	73	Confident	30 Å²	30	34.9 Å²	34.9	18%	0.182	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-40.8	-176.6	-175.6	0	0	0	0	110.5	Y144 P152 V153 T175 Q177	Y144-V146 HydrophobicContact CD2-CG2 4.1Å; Y144-V146 HydrophobicContact CE1-CG2 4.42Å; Y144-V146 HydrophobicContact CE2-CB 4.28Å; Y144-V146 HydrophobicContact CE2-CG2 3.47Å; Y144-V146 VanDerWaalsContact CE2-CG2 3.47Å; Y144-V146 PolarHBondContact O-N 3.35Å; V146-P152 CarbonylContact O-C 3.55Å; V146-P152 VanDerWaalsContact O-CA 3.32Å; V146-P152 WeakPolarHBondContact O-CA 3.41Å; V146-V153 PolarHBondContact O-N 3.02Å; V146-T175 WeakPolarHBondContact CA-O 3.11Å; V146-T175 HydrophobicContact CB-CG2 4.43Å; V146-T175 WeakPolarHBondContact CB-O 3.27Å; V146-T175 PolarHBondContact N-O 3.32Å; V146-Q177 HydrophobicContact CG2-CB 3.49Å; V146-Q177 VanDerWaalsContact CG2-CB 3.49Å
147	A	85.6	Confident	74.2	Confident	11 Å²	11	34.2 Å²	34.2	9%	0.091	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154	177.8	0	0	0	0	0	112.7	L145 K151 L174 T175	L145-A147 WeakPolarHBondContact CD1-O 3.48Å; A147-K151 CarbonylContact C-O 3.53Å; A147-K151 WeakPolarHBondContact CA-O 3.4Å; A147-K151 VanDerWaalsContact CB-O 3.28Å; A147-K151 WeakPolarHBondContact CB-O 3.48Å; A147-L174 WeakPolarHBondContact O-CA 3.36Å; A147-T175 PolarHBondContact N-O 2.69Å; A147-T175 PolarHBondContact O-N 2.69Å
148	V	84.7	Confident	74.9	Confident	3 Å²	3	37 Å²	37	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.2	167.1	178.9	0	0	0	0	108.5	L145 D150 K151 V153 V161 L164 I165 L172 L174	L145-V148 HydrophobicContact CD1-CG2 4.26Å; L145-V148 HydrophobicContact CD2-CG2 3.83Å; L145-V148 HydrophobicContact CG-CG2 4.35Å; V148-D150 PolarHBondContact O-N 3.13Å; V148-K151 PolarHBondContact N-O 3.44Å; V148-K151 PolarHBondContact O-N 3.24Å; V148-V153 HydrophobicContact CG2-CG2 3.88Å; V148-V161 HydrophobicContact CG2-CG1 4.17Å; V148-L164 HydrophobicContact CG1-CB 4.21Å; V148-L164 HydrophobicContact CG1-CD2 4.12Å; V148-I165 HydrophobicContact CG1-CG1 4.24Å; V148-I165 HydrophobicContact CG2-CD1 4.47Å; V148-I165 HydrophobicContact CG2-CG1 4.32Å; V148-L172 HydrophobicContact CG1-CD1 3.63Å; V148-L174 HydrophobicContact CG1-CD2 4.34Å; V148-L174 HydrophobicContact CG2-CD2 3.9Å
149	G	80.8	Confident	75.8	Confident	25 Å²	25	42.9 Å²	42.9	26%	0.258	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	-125.7	-158.6	0	0	0	0	0	109.1	S173	G149-S173 PolarHBondContact N-O 2.88Å
150	D	75.8	Confident	76.3	Confident	137 Å²	137	47.9 Å²	47.9	73%	0.733	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	14.2	174.9	-49.8	-60.5	0	0	0	112.7	K86 V148	K86-D150 IonicContact NZ-OD1 2.92Å; K86-D150 PolarHBondContact NZ-OD1 2.99Å; V148-D150 PolarHBondContact O-N 3.13Å
151	K	77.1	Confident	76.9	Confident	124 Å²	124	46.9 Å²	46.9	54%	0.539	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	117.7	174.9	-71.4	-170.5	177	-175	0	111.3	A147 V148 I156 L164	A147-K151 CarbonylContact C-O 3.53Å; A147-K151 WeakPolarHBondContact CA-O 3.4Å; A147-K151 VanDerWaalsContact CB-O 3.28Å; A147-K151 WeakPolarHBondContact CB-O 3.48Å; V148-K151 PolarHBondContact N-O 3.44Å; V148-K151 PolarHBondContact O-N 3.24Å; K151-I156 HydrophobicContact CB-CD1 4.16Å; K151-L164 HydrophobicContact CD-CD1 4.08Å; K151-L164 HydrophobicContact CD-CD2 4.27Å
152	P	80.4	Confident	77.6	Confident	80 Å²	80	48.9 Å²	48.9	52%	0.519	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	144.6	178.1	28.4	-34.7	0	0	0	111.7	V146 I156	V146-P152 CarbonylContact O-C 3.55Å; V146-P152 VanDerWaalsContact O-CA 3.32Å; V146-P152 WeakPolarHBondContact O-CA 3.41Å; P152-I156 WeakPolarHBondContact O-CD1 3.35Å; P152-I156 WeakPolarHBondContact O-CG1 3.29Å
153	V	78	Confident	78.2	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.055	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-14.7	-173.9	162.7	0	0	0	0	113.3	L126 L145 V146 V148 S155 I156 V161	L126-V153 HydrophobicContact CD1-CG1 3.93Å; L145-V153 HydrophobicContact CD2-CG1 4.41Å; L145-V153 HydrophobicContact CD2-CG2 4.06Å; L145-V153 HydrophobicContact CG-CB 4.37Å; L145-V153 HydrophobicContact CG-CG1 4.33Å; L145-V153 HydrophobicContact CG-CG2 3.95Å; V146-V153 PolarHBondContact O-N 3.02Å; V148-V153 HydrophobicContact CG2-CG2 3.88Å; V153-S155 VanDerWaalsContact C-N 3.3Å; V153-S155 PolarHBondContact O-N 3.41Å; V153-I156 PolarHBondContact O-N 2.92Å; V153-V161 HydrophobicContact CB-CG2 4.44Å; V153-V161 HydrophobicContact CG1-CG2 3.89Å; V153-V161 HydrophobicContact CG2-CG1 4.42Å; V153-V161 HydrophobicContact CG2-CG2 3.96Å
154	G	69.3	Low	78.4	Confident	72 Å²	72	56.9 Å²	56.9	74%	0.742	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-30.8	-177.7	0	0	0	0	0	115.2
155	S	64.3	Low	78.5	Confident	52 Å²	52	56 Å²	56	36%	0.364	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-47.7	173.4	41.2	0	0	0	0	112.6	V153 E1579 K1595	V153-S155 VanDerWaalsContact C-N 3.3Å; V153-S155 PolarHBondContact O-N 3.41Å; S155-E1579 VanDerWaalsContact CB-OE1 3.24Å; S155-E1579 WeakPolarHBondContact CB-OE1 3.34Å; S155-K1595 PolarHBondContact O-NZ 3.09Å
156	I	71.5	Confident	78.2	Confident	39 Å²	39	65 Å²	65	20%	0.2	35%	0.354	C	S	.	.	S	Bend	trans	-68.8	141.2	-165.8	-54.7	-179.7	0	0	0	112.9	K151 P152 V153 E160 V161 L164	K151-I156 HydrophobicContact CB-CD1 4.16Å; P152-I156 WeakPolarHBondContact O-CD1 3.35Å; P152-I156 WeakPolarHBondContact O-CG1 3.29Å; V153-I156 PolarHBondContact O-N 2.92Å; I156-E160 HydrophobicContact CG2-CB 3.4Å; I156-E160 HydrophobicContact CG2-CG 4.46Å; I156-V161 HydrophobicContact CB-CG2 4.2Å; I156-V161 HydrophobicContact CG2-CG2 3.85Å; I156-L164 HydrophobicContact CD1-CD1 4.12Å
157	S	74.3	Confident	77.7	Confident	53 Å²	53	67 Å²	67	37%	0.371	37%	0.369	S	S	.	.			trans	-73.3	154.4	178.8	77.3	0	0	0	0	113.3	N159 E160 V161	S157-N159 PolarHBondContact O-N 3.17Å; S157-N159 VanDerWaalsContact O-N 3.09Å; S157-E160 WeakPolarHBondContact CB-OE2 3.48Å; S157-E160 PolarHBondContact N-OE2 3.27Å; S157-E160 PolarHBondContact O-N 3.31Å; S157-E160 WeakPolarHBondContact OG-CG 3.48Å; S157-E160 PolarHBondContact OG-N 3.14Å; S157-E160 PolarHBondContact OG-OE2 3.15Å; S157-V161 WeakPolarHBondContact O-CG2 3.5Å; S157-V161 PolarHBondContact O-N 3.11Å
158	R	74.4	Confident	77.1	Confident	64 Å²	64	68 Å²	68	24%	0.242	37%	0.374	C	S	.	.	H	α-helix	trans	-52.9	-35.1	177.4	-177.9	177.7	-177.5	176.4	0.7	113.2	L101 L126 V162 E1603	L101-R158 PolarHBondContact O-NH2 3.3Å; L126-R158 HydrophobicContact CD1-CB 4.19Å; L126-R158 HydrophobicContact CD1-CG 4.4Å; L126-R158 HydrophobicContact CD2-CB 4.13Å; L126-R158 HydrophobicContact CD2-CG 3.77Å; R158-V162 WeakPolarHBondContact O-CB 3.49Å; R158-V162 VanDerWaalsContact O-CG2 3.31Å; R158-V162 WeakPolarHBondContact O-CG2 3.32Å; R158-V162 PolarHBondContact O-N 2.92Å; R158-E1603 IonicContact CZ-OE1 3.41Å; R158-E1603 IonicContact NH1-OE1 2.7Å; R158-E1603 PolarHBondContact NH1-OE1 2.87Å; R158-E1603 IonicContact NH2-OE1 2.69Å; R158-E1603 PolarHBondContact NH2-OE1 3.41Å
159	N	77.3	Confident	76.5	Confident	132 Å²	132	74.1 Å²	74.1	71%	0.706	41%	0.407	S	S	*	.	H	α-helix	trans	-71.6	-41.1	-179.6	-68.7	-6.4	0	0	0	111.2	S157 V162 H163	S157-N159 PolarHBondContact O-N 3.17Å; S157-N159 VanDerWaalsContact O-N 3.09Å; N159-V162 PolarHBondContact O-N 3.4Å; N159-H163 WeakPolarHBondContact O-CB 3.44Å; N159-H163 PolarHBondContact O-N 3.35Å
160	E	78.1	Confident	76.2	Confident	110 Å²	110	77.9 Å²	77.9	51%	0.514	42%	0.42	S	S	.	.	H	α-helix	trans	-68.8	-36.1	174.4	-68	161.6	122.8	0	0	112	I156 S157 H163 L164	I156-E160 HydrophobicContact CG2-CB 3.4Å; I156-E160 HydrophobicContact CG2-CG 4.46Å; S157-E160 WeakPolarHBondContact CB-OE2 3.48Å; S157-E160 PolarHBondContact N-OE2 3.27Å; S157-E160 PolarHBondContact O-N 3.31Å; S157-E160 WeakPolarHBondContact OG-CG 3.48Å; S157-E160 PolarHBondContact OG-N 3.14Å; S157-E160 PolarHBondContact OG-OE2 3.15Å; E160-H163 CarbonylContact O-C 3.6Å; E160-H163 PolarHBondContact O-N 3.14Å; E160-L164 WeakPolarHBondContact O-CB 3.47Å; E160-L164 PolarHBondContact O-N 3.03Å
161	V	79.9	Confident	76.2	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-61	-45.4	171.5	174.4	0	0	0	0	110.9	L101 L126 L145 V148 V153 I156 S157 H163 L164 I165	L101-V161 HydrophobicContact CD1-CG1 4.15Å; L126-V161 HydrophobicContact CD1-CB 4.31Å; L126-V161 HydrophobicContact CD1-CG1 4.33Å; L126-V161 HydrophobicContact CD1-CG2 4.05Å; L145-V161 HydrophobicContact CD2-CG1 3.8Å; V148-V161 HydrophobicContact CG2-CG1 4.17Å; V153-V161 HydrophobicContact CB-CG2 4.44Å; V153-V161 HydrophobicContact CG1-CG2 3.89Å; V153-V161 HydrophobicContact CG2-CG1 4.42Å; V153-V161 HydrophobicContact CG2-CG2 3.96Å; I156-V161 HydrophobicContact CB-CG2 4.2Å; I156-V161 HydrophobicContact CG2-CG2 3.85Å; S157-V161 WeakPolarHBondContact O-CG2 3.5Å; S157-V161 PolarHBondContact O-N 3.11Å; V161-H163 VanDerWaalsContact C-N 3.3Å; V161-H163 PolarHBondContact O-N 3.39Å; V161-L164 WeakPolarHBondContact O-CB 3.29Å; V161-L164 PolarHBondContact O-N 2.87Å; V161-I165 HydrophobicContact CG1-CD1 3.94Å; V161-I165 WeakPolarHBondContact O-CB 3.28Å; V161-I165 WeakPolarHBondContact O-CD1 3.36Å; V161-I165 VanDerWaalsContact O-CG1 3.3Å; V161-I165 WeakPolarHBondContact O-CG1 3.37Å; V161-I165 PolarHBondContact O-N 2.78Å
162	V	81.4	Confident	76.3	Confident	44 Å²	44	69.4 Å²	69.4	27%	0.267	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-36.9	173.3	167.9	0	0	0	0	111.3	L101 R158 N159 I165 R166	L101-V162 HydrophobicContact CD1-CG2 3.81Å; R158-V162 WeakPolarHBondContact O-CB 3.49Å; R158-V162 VanDerWaalsContact O-CG2 3.31Å; R158-V162 WeakPolarHBondContact O-CG2 3.32Å; R158-V162 PolarHBondContact O-N 2.92Å; N159-V162 PolarHBondContact O-N 3.4Å; V162-I165 PolarHBondContact O-N 3.11Å; V162-R166 WeakPolarHBondContact O-CB 3.47Å; V162-R166 VanDerWaalsContact O-CG 3.3Å; V162-R166 WeakPolarHBondContact O-CG 3.47Å; V162-R166 PolarHBondContact O-N 2.76Å
163	H	79	Confident	76.4	Confident	132 Å²	132	66.5 Å²	66.5	61%	0.611	36%	0.356	S	S	*	.	H	α-helix	trans	-69.8	-37.6	176.9	-157.9	-44.3	0	0	0	112.3	N159 E160 V161 R166 S167	N159-H163 WeakPolarHBondContact O-CB 3.44Å; N159-H163 PolarHBondContact O-N 3.35Å; E160-H163 CarbonylContact O-C 3.6Å; E160-H163 PolarHBondContact O-N 3.14Å; V161-H163 VanDerWaalsContact C-N 3.3Å; V161-H163 PolarHBondContact O-N 3.39Å; H163-R166 PolarHBondContact O-N 2.87Å; H163-S167 VanDerWaalsContact O-CB 3.27Å; H163-S167 WeakPolarHBondContact O-CB 3.33Å; H163-S167 PolarHBondContact O-N 3.32Å; H163-S167 PolarHBondContact O-OG 3.41Å
164	L	81.6	Confident	76.7	Confident	36 Å²	36	66 Å²	66	19%	0.188	35%	0.354	C	S	.	.	H	α-helix	trans	-58.5	-51.7	171.5	-110.4	149.2	0	0	0	110.5	V148 K151 I156 E160 V161 R166 S167 T168	V148-L164 HydrophobicContact CG1-CB 4.21Å; V148-L164 HydrophobicContact CG1-CD2 4.12Å; K151-L164 HydrophobicContact CD-CD1 4.08Å; K151-L164 HydrophobicContact CD-CD2 4.27Å; I156-L164 HydrophobicContact CD1-CD1 4.12Å; E160-L164 WeakPolarHBondContact O-CB 3.47Å; E160-L164 PolarHBondContact O-N 3.03Å; V161-L164 WeakPolarHBondContact O-CB 3.29Å; V161-L164 PolarHBondContact O-N 2.87Å; L164-R166 VanDerWaalsContact C-N 3.3Å; L164-R166 PolarHBondContact O-N 3.09Å; L164-S167 WeakPolarHBondContact CA-OG 3.29Å; L164-S167 PolarHBondContact O-N 3.27Å; L164-S167 VanDerWaalsContact O-N 3.14Å; L164-S167 PolarHBondContact O-OG 3.5Å; L164-T168 PolarHBondContact O-N 3.09Å
165	I	82.4	Confident	77.5	Confident	19 Å²	19	63.7 Å²	63.7	10%	0.097	33%	0.325	C	S	.	.	H	α-helix	trans	-60.8	-35.8	176.5	-71.5	165.7	0	0	0	112.1	Y97 L101 V148 V161 V162 T168 L172	Y97-I165 HydrophobicContact CD2-CG2 4Å; Y97-I165 HydrophobicContact CE2-CG2 4.39Å; Y97-I165 VanDerWaalsContact CE2-O 3.25Å; Y97-I165 WeakPolarHBondContact CE2-O 3.44Å; L101-I165 HydrophobicContact CD1-CD1 3.83Å; V148-I165 HydrophobicContact CG1-CG1 4.24Å; V148-I165 HydrophobicContact CG2-CD1 4.47Å; V148-I165 HydrophobicContact CG2-CG1 4.32Å; V161-I165 HydrophobicContact CG1-CD1 3.94Å; V161-I165 WeakPolarHBondContact O-CB 3.28Å; V161-I165 WeakPolarHBondContact O-CD1 3.36Å; V161-I165 VanDerWaalsContact O-CG1 3.3Å; V161-I165 WeakPolarHBondContact O-CG1 3.37Å; V161-I165 PolarHBondContact O-N 2.78Å; V162-I165 PolarHBondContact O-N 3.11Å; I165-T168 PolarHBondContact O-OG1 2.87Å; I165-L172 HydrophobicContact CB-CD2 4.43Å; I165-L172 HydrophobicContact CG1-CD1 4Å; I165-L172 HydrophobicContact CG1-CD2 4.09Å; I165-L172 HydrophobicContact CG2-CD2 3.9Å
166	R	80	Confident	78.3	Confident	193 Å²	193	61.2 Å²	61.2	73%	0.728	31%	0.308	S	S	*	.	H	α-helix	trans	-73.8	-33	175.1	-76.5	175.1	173.8	-169.7	-4.2	112.9	V162 H163 L164	V162-R166 WeakPolarHBondContact O-CB 3.47Å; V162-R166 VanDerWaalsContact O-CG 3.3Å; V162-R166 WeakPolarHBondContact O-CG 3.47Å; V162-R166 PolarHBondContact O-N 2.76Å; H163-R166 PolarHBondContact O-N 2.87Å; L164-R166 VanDerWaalsContact C-N 3.3Å; L164-R166 PolarHBondContact O-N 3.09Å
167	S	76	Confident	78.6	Confident	71 Å²	71	60.4 Å²	60.4	50%	0.497	30%	0.303	S	S	.	.	H	α-helix	trans	-79	-10.3	-177.8	67.3	0	0	0	0	115.2	H163 L164	H163-S167 VanDerWaalsContact O-CB 3.27Å; H163-S167 WeakPolarHBondContact O-CB 3.33Å; H163-S167 PolarHBondContact O-N 3.32Å; H163-S167 PolarHBondContact O-OG 3.41Å; L164-S167 WeakPolarHBondContact CA-OG 3.29Å; L164-S167 PolarHBondContact O-N 3.27Å; L164-S167 VanDerWaalsContact O-N 3.14Å; L164-S167 PolarHBondContact O-OG 3.5Å
168	T	72	Confident	78.5	Confident	33 Å²	33	58 Å²	58	20%	0.202	29%	0.286	C	S	.	.			trans	-78.2	137.1	168.8	45.5	0	0	0	0	110.9	K91 Y97 L164 I165 L172	K91-T168 PolarHBondContact NZ-O 3.32Å; Y97-T168 PolarHBondContact OH-O 3.38Å; Y97-T168 PolarHBondContact OH-OG1 3.13Å; L164-T168 PolarHBondContact O-N 3.09Å; I165-T168 PolarHBondContact O-OG1 2.87Å; T168-L172 HydrophobicContact CG2-CD1 4.24Å
169	D	73.6	Confident	78.5	Confident	132 Å²	132	55 Å²	55	71%	0.706	28%	0.275	S	S	*	.	S	Bend	trans	-77	-82.3	-173.3	-66.3	-50.9	0	0	0	113.3	K91 Y97	K91-D169 WeakPolarHBondContact CD-O 3.4Å; K91-D169 PolarHBondContact NZ-O 2.94Å; Y97-D169 PolarHBondContact OH-O 3.04Å
170	L	74.1	Confident	78.2	Confident	103 Å²	103	49.5 Å²	49.5	54%	0.539	25%	0.247	S	C	.	.	S	Bend	trans	-96	-37.4	-179.9	-96.5	75	0	0	0	113.2	K90 K91	K90-L170 WeakPolarHBondContact CA-O 3.45Å; K91-L170 PolarHBondContact N-O 3.19Å
171	Y	74.9	Confident	77.9	Confident	84 Å²	84	45 Å²	45	33%	0.329	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.4	-168.1	-61.2	-62.5	0	0	0	112	L89 K90 E198 N199	L89-Y171 WeakPolarHBondContact O-CA 3.04Å; K90-Y171 HydrophobicContact CB-CD1 4.17Å; K90-Y171 HydrophobicContact CB-CE1 3.92Å; K90-Y171 HydrophobicContact CD-CE1 4.24Å; K90-Y171 HydrophobicContact CG-CD1 4.13Å; K90-Y171 HydrophobicContact CG-CE1 3.6Å; K90-Y171 PolarHBondContact NZ-OH 2.96Å; Y171-E198 WeakPolarHBondContact CE1-O 3.16Å; Y171-E198 VanDerWaalsContact CZ-O 3.3Å; Y171-E198 PolarHBondContact OH-O 3.49Å; Y171-N199 HydrophobicContact CE1-CB 4.17Å; Y171-N199 WeakPolarHBondContact CE1-OD1 3.43Å; Y171-N199 PolarHBondContact OH-OD1 3.19Å
172	L	80.3	Confident	77.7	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	116.8	180	170.4	66.3	0	0	0	108.2	H88 L89 Y97 I99 V148 I165 T168 L174	H88-L172 CarbonylContact C-O 3.52Å; H88-L172 WeakPolarHBondContact CA-O 3.43Å; L89-L172 HydrophobicContact CB-CB 4.31Å; L89-L172 HydrophobicContact CD1-CD2 4.12Å; L89-L172 PolarHBondContact N-O 3.07Å; L89-L172 PolarHBondContact O-N 3.27Å; Y97-L172 HydrophobicContact CD1-CB 3.7Å; Y97-L172 HydrophobicContact CD1-CD2 3.95Å; Y97-L172 HydrophobicContact CD2-CB 4.48Å; Y97-L172 HydrophobicContact CD2-CD2 3.72Å; Y97-L172 HydrophobicContact CE1-CB 3.41Å; Y97-L172 VanDerWaalsContact CE1-CB 3.41Å; Y97-L172 HydrophobicContact CE1-CD2 4.32Å; Y97-L172 HydrophobicContact CE2-CB 4.24Å; Y97-L172 HydrophobicContact CE2-CD2 4.11Å; Y97-L172 HydrophobicContact CG-CB 4.22Å; Y97-L172 HydrophobicContact CG-CD2 3.62Å; I99-L172 HydrophobicContact CD1-CD2 4.14Å; V148-L172 HydrophobicContact CG1-CD1 3.63Å; I165-L172 HydrophobicContact CB-CD2 4.43Å; I165-L172 HydrophobicContact CG1-CD1 4Å; I165-L172 HydrophobicContact CG1-CD2 4.09Å; I165-L172 HydrophobicContact CG2-CD2 3.9Å; T168-L172 HydrophobicContact CG2-CD1 4.24Å; L172-L174 HydrophobicContact CD1-CD2 3.86Å; L172-L174 HydrophobicContact CD2-CD2 4.01Å; L172-L174 HydrophobicContact CD2-CG 4.37Å; L172-L174 HydrophobicContact CG-CD2 3.79Å; L172-L174 HydrophobicContact CG-CG 4.13Å
173	S	82.4	Confident	77.1	Confident	18 Å²	18	44.5 Å²	44.5	13%	0.126	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	132.9	168.1	-172	0	0	0	0	108.9	H88 G149	H88-S173 PolarHBondContact CD2-OG 3.19Å; H88-S173 PolarHBondContact CE1-OG 3.04Å; H88-S173 PolarHBondContact NE2-OG 3.44Å; G149-S173 PolarHBondContact N-O 2.88Å
174	L	84.3	Confident	76.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.9	173.1	-57	179.7	0	0	0	107.7	K86 V87 L89 I99 T128 L139 L145 A147 V148 L172 V176	K86-L174 CarbonylContact C-O 3.59Å; K86-L174 WeakPolarHBondContact CA-O 3.43Å; V87-L174 PolarHBondContact N-O 3.27Å; V87-L174 PolarHBondContact O-N 3.39Å; L89-L174 HydrophobicContact CD1-CD1 3.54Å; L89-L174 HydrophobicContact CD1-CG 4.2Å; I99-L174 HydrophobicContact CD1-CD1 4.05Å; T128-L174 HydrophobicContact CG2-CD1 4.35Å; L139-L174 HydrophobicContact CD1-CD1 4.35Å; L139-L174 HydrophobicContact CD2-CD1 4.49Å; L145-L174 HydrophobicContact CD1-CB 3.91Å; L145-L174 HydrophobicContact CD1-CD1 4.48Å; L145-L174 HydrophobicContact CD1-CD2 3.86Å; L145-L174 HydrophobicContact CD1-CG 4.3Å; A147-L174 WeakPolarHBondContact O-CA 3.36Å; V148-L174 HydrophobicContact CG1-CD2 4.34Å; V148-L174 HydrophobicContact CG2-CD2 3.9Å; L172-L174 HydrophobicContact CD1-CD2 3.86Å; L172-L174 HydrophobicContact CD2-CD2 4.01Å; L172-L174 HydrophobicContact CD2-CG 4.37Å; L172-L174 HydrophobicContact CG-CD2 3.79Å; L172-L174 HydrophobicContact CG-CG 4.13Å; L174-V176 HydrophobicContact CB-CG1 4.24Å
175	T	85.1	Confident	75.8	Confident	22 Å²	22	38.7 Å²	38.7	14%	0.135	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	120.9	163	-49.3	0	0	0	0	107.4	H84 F85 K86 V146 A147	H84-T175 HydrophobicContact CB-CG2 4.05Å; F85-T175 WeakPolarHBondContact O-CA 3.41Å; K86-T175 HydrophobicContact CG-CG2 4.47Å; K86-T175 WeakPolarHBondContact CG-OG1 3.39Å; V146-T175 WeakPolarHBondContact CA-O 3.11Å; V146-T175 HydrophobicContact CB-CG2 4.43Å; V146-T175 WeakPolarHBondContact CB-O 3.27Å; V146-T175 PolarHBondContact N-O 3.32Å; A147-T175 PolarHBondContact N-O 2.69Å; A147-T175 PolarHBondContact O-N 2.69Å
176	V	81.5	Confident	74.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	150.9	-179.4	-61.2	0	0	0	0	111	F85 V87 L139 D143 Y144 L145 L174	F85-V176 HydrophobicContact CB-CG2 4.13Å; F85-V176 PolarHBondContact N-O 2.94Å; F85-V176 PolarHBondContact O-N 3.01Å; V87-V176 HydrophobicContact CG2-CG2 3.99Å; L139-V176 HydrophobicContact CD2-CG1 3.88Å; L139-V176 HydrophobicContact CD2-CG2 4.25Å; D143-V176 HydrophobicContact CB-CB 4.12Å; D143-V176 HydrophobicContact CB-CG1 4.36Å; D143-V176 HydrophobicContact CB-CG2 4.41Å; Y144-V176 CarbonylContact O-C 3.52Å; Y144-V176 VanDerWaalsContact O-CA 3.25Å; Y144-V176 WeakPolarHBondContact O-CA 2.93Å; Y144-V176 WeakPolarHBondContact O-CB 3.42Å; L145-V176 HydrophobicContact CD1-CG1 4.08Å; L174-V176 HydrophobicContact CB-CG1 4.24Å
177	Q	78.6	Confident	72.9	Confident	23 Å²	23	33.4 Å²	33.4	11%	0.107	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	145.5	171.6	-178.6	-178.1	74	0	0	109.6	L82 H84 Y144 V146	L82-Q177 HydrophobicContact CB-CG 3.86Å; L82-Q177 PolarHBondContact O-NE2 3.38Å; H84-Q177 PolarHBondContact CE1-NE2 2.91Å; H84-Q177 PolarHBondContact NE2-NE2 3.21Å; Y144-Q177 HydrophobicContact CD1-CB 4.09Å; Y144-Q177 VanDerWaalsContact CD1-O 3.23Å; Y144-Q177 WeakPolarHBondContact CD1-O 3.44Å; Y144-Q177 HydrophobicContact CE1-CB 3.62Å; Y144-Q177 HydrophobicContact CE1-CG 3.92Å; Y144-Q177 PolarHBondContact N-O 2.94Å; Y144-Q177 PolarHBondContact O-N 2.86Å; Y144-Q177 PolarHBondContact OH-OE1 3.06Å; V146-Q177 HydrophobicContact CG2-CB 3.49Å; V146-Q177 VanDerWaalsContact CG2-CB 3.49Å
178	S	72	Confident	71.3	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.021	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	129.6	174.8	-65	0	0	0	0	114.1	L82 F186	L82-S178 VanDerWaalsContact CD1-O 3.27Å; L82-S178 WeakPolarHBondContact CD1-O 3.38Å; S178-F186 VanDerWaalsContact OG-CB 3.3Å; S178-F186 WeakPolarHBondContact OG-CB 3.41Å; S178-F186 WeakPolarHBondContact OG-CD2 3.44Å; S178-F186 WeakPolarHBondContact OG-CG 3.41Å
179	L	73.6	Confident	69.5	Low	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.153	C	C	.	.			trans	-62.3	139.5	158.6	-82.3	-178.9	0	0	0	111.2	L106 V125 L127 G142 E181 F182 T183 F186	L106-L179 HydrophobicContact CB-CD2 4.11Å; L106-L179 HydrophobicContact CD1-CD2 3.87Å; L106-L179 HydrophobicContact CG-CD2 4.45Å; V125-L179 HydrophobicContact CG2-CD2 4.18Å; L127-L179 HydrophobicContact CD1-CD1 4.03Å; L127-L179 HydrophobicContact CD2-CD1 3.69Å; L127-L179 HydrophobicContact CD2-CD2 4.18Å; L127-L179 HydrophobicContact CD2-CG 3.87Å; G142-L179 WeakPolarHBondContact O-CB 3.49Å; G142-L179 VanDerWaalsContact O-CG 3.27Å; G142-L179 WeakPolarHBondContact O-CG 3.34Å; L179-E181 VanDerWaalsContact C-N 3.35Å; L179-E181 PolarHBondContact O-N 3.38Å; L179-F182 HydrophobicContact CB-CD2 4.01Å; L179-F182 HydrophobicContact CD1-CD2 4.04Å; L179-F182 HydrophobicContact CD1-CE2 4.24Å; L179-F182 PolarHBondContact O-N 2.8Å; L179-T183 PolarHBondContact O-N 3.31Å; L179-F186 WeakPolarHBondContact O-CE2 3.5Å
180	P	70.4	Confident	67.5	Low	16 Å²	16	26 Å²	26	10%	0.104	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-55.7	-41.7	177.7	-28.5	36.4	0	0	0	114.5	L82 L106 F182 T183 S359	L82-P180 HydrophobicContact CD1-CG 4.34Å; L106-P180 HydrophobicContact CD1-CG 3.75Å; P180-F182 PolarHBondContact O-N 3.26Å; P180-T183 WeakPolarHBondContact CA-OG1 3.34Å; P180-T183 WeakPolarHBondContact O-CB 3.45Å; P180-T183 PolarHBondContact O-N 2.91Å; P180-T183 PolarHBondContact O-OG1 2.96Å; P180-S359 CarbonylContact C-O 3.53Å; P180-S359 VanDerWaalsContact CB-O 3.3Å; P180-S359 WeakPolarHBondContact CB-O 3.3Å
181	E	72.7	Confident	65.2	Low	14 Å²	14	22.8 Å²	22.8	7%	0.065	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-53.5	-26.5	175.2	-73.1	169.5	-125	0	0	113.5	L179 S359 L361 L380 N381 I382	L179-E181 VanDerWaalsContact C-N 3.35Å; L179-E181 PolarHBondContact O-N 3.38Å; E181-S359 PolarHBondContact N-O 3.14Å; E181-L361 WeakPolarHBondContact O-CD2 3.39Å; E181-L380 HydrophobicContact CG-CD2 4.39Å; E181-N381 PolarHBondContact OE2-N 3.03Å; E181-I382 HydrophobicContact CB-CG2 4.23Å
182	F	75.1	Confident	63	Low	1 Å²	1	20 Å²	20	0%	0.004	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-107.7	5.4	-175.1	-76.3	-76.4	0	0	0	113	L179 P180 D184 F185 F186 N381 I382 V387	L179-F182 HydrophobicContact CB-CD2 4.01Å; L179-F182 HydrophobicContact CD1-CD2 4.04Å; L179-F182 HydrophobicContact CD1-CE2 4.24Å; L179-F182 PolarHBondContact O-N 2.8Å; P180-F182 PolarHBondContact O-N 3.26Å; F182-D184 VanDerWaalsContact C-N 3.26Å; F182-D184 PolarHBondContact O-N 3.35Å; F182-D184 VanDerWaalsContact O-N 3.08Å; F182-F185 HydrophobicContact CB-CD2 4.33Å; F182-F185 AromaticContact CD1-CD2 3.83Å; F182-F185 HydrophobicContact CD1-CD2 3.83Å; F182-F185 HydrophobicContact CD1-CE2 4.01Å; F182-F185 HydrophobicContact CD1-CG 4.14Å; F182-F185 HydrophobicContact CD1-CZ 4.47Å; F182-F185 WeakPolarHBondContact O-CA 3.45Å; F182-F185 VanDerWaalsContact O-CB 3.3Å; F182-F185 WeakPolarHBondContact O-CB 3.13Å; F182-F185 WeakPolarHBondContact O-CD2 3.43Å; F182-F185 PolarHBondContact O-N 3.09Å; F182-F186 HydrophobicContact CB-CD2 3.76Å; F182-F186 HydrophobicContact CB-CE2 3.14Å; F182-F186 HydrophobicContact CB-CZ 3.64Å; F182-F186 HydrophobicContact CG-CE2 4.32Å; F182-F186 HydrophobicContact CG-CZ 4.45Å; F182-F186 WeakPolarHBondContact O-CD2 3.44Å; F182-F186 PolarHBondContact O-N 3.33Å; F182-N381 HydrophobicContact CE2-CB 3.91Å; F182-N381 HydrophobicContact CZ-CB 4.4Å; F182-I382 HydrophobicContact CD1-CG2 4.39Å; F182-I382 HydrophobicContact CE1-CB 4.37Å; F182-I382 HydrophobicContact CE1-CG2 4.03Å; F182-I382 HydrophobicContact CE2-CG2 4.38Å; F182-I382 HydrophobicContact CZ-CB 4.4Å; F182-I382 HydrophobicContact CZ-CG2 4.05Å; F182-V387 HydrophobicContact CE1-CG1 4.22Å; F182-V387 HydrophobicContact CE1-CG2 3.48Å; F182-V387 VanDerWaalsContact CE1-CG2 3.48Å; F182-V387 HydrophobicContact CZ-CG2 3.83Å
183	T	69.4	Low	60.5	Low	33 Å²	33	21.7 Å²	21.7	20%	0.202	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-47.2	-44.4	-175.7	-56.2	0	0	0	0	113.4	L82 L179 P180 F185 F186	L82-T183 HydrophobicContact CD2-CG2 3.8Å; L179-T183 PolarHBondContact O-N 3.31Å; P180-T183 WeakPolarHBondContact CA-OG1 3.34Å; P180-T183 WeakPolarHBondContact O-CB 3.45Å; P180-T183 PolarHBondContact O-N 2.91Å; P180-T183 PolarHBondContact O-OG1 2.96Å; T183-F185 PolarHBondContact O-N 3.14Å; T183-F186 PolarHBondContact O-N 3.11Å; T183-F186 VanDerWaalsContact O-N 3.11Å
184	D	69	Low	57.9	Low	25 Å²	25	27.2 Å²	27.2	13%	0.134	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-68	-18.4	-178.8	-69.2	-20.2	0	0	0	113.9	F182 R356 P401	F182-D184 VanDerWaalsContact C-N 3.26Å; F182-D184 PolarHBondContact O-N 3.35Å; F182-D184 VanDerWaalsContact O-N 3.08Å; D184-R356 IonicContact OD1-NH1 3.63Å; D184-R356 PolarHBondContact OD1-NH1 2.96Å; D184-R356 IonicContact OD2-CZ 3.22Å; D184-R356 VanDerWaalsContact OD2-CZ 3.26Å; D184-R356 IonicContact OD2-NH1 3.4Å; D184-R356 PolarHBondContact OD2-NH1 2.79Å; D184-R356 IonicContact OD2-NH2 3.73Å; D184-R356 PolarHBondContact OD2-NH2 3.21Å; D184-P401 HydrophobicContact CB-CB 3.84Å
185	F	64.5	Low	55.3	Low	21 Å²	21	33.1 Å²	33.1	9%	0.092	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-87	-13.8	175.7	-58.8	-107.8	0	0	0	112.7	F182 T183 V387 L390 F391 P401	F182-F185 HydrophobicContact CB-CD2 4.33Å; F182-F185 AromaticContact CD1-CD2 3.83Å; F182-F185 HydrophobicContact CD1-CD2 3.83Å; F182-F185 HydrophobicContact CD1-CE2 4.01Å; F182-F185 HydrophobicContact CD1-CG 4.14Å; F182-F185 HydrophobicContact CD1-CZ 4.47Å; F182-F185 WeakPolarHBondContact O-CA 3.45Å; F182-F185 VanDerWaalsContact O-CB 3.3Å; F182-F185 WeakPolarHBondContact O-CB 3.13Å; F182-F185 WeakPolarHBondContact O-CD2 3.43Å; F182-F185 PolarHBondContact O-N 3.09Å; T183-F185 PolarHBondContact O-N 3.14Å; F185-V387 HydrophobicContact CD1-CG1 4.5Å; F185-V387 HydrophobicContact CE1-CG1 3.68Å; F185-V387 HydrophobicContact CZ-CG1 4.1Å; F185-L390 HydrophobicContact CD1-CD1 3.76Å; F185-L390 HydrophobicContact CE1-CD1 4.39Å; F185-F391 HydrophobicContact CD1-CZ 4.44Å; F185-F391 HydrophobicContact CE1-CE1 4.48Å; F185-F391 AromaticContact CE1-CE2 3.63Å; F185-F391 HydrophobicContact CE1-CE2 3.63Å; F185-F391 AromaticContact CE1-CZ 3.44Å; F185-F391 HydrophobicContact CE1-CZ 3.44Å; F185-F391 VanDerWaalsContact CE1-CZ 3.44Å; F185-F391 HydrophobicContact CZ-CE2 4.2Å; F185-F391 AromaticContact CZ-CZ 3.89Å; F185-F391 HydrophobicContact CZ-CZ 3.89Å; F185-P401 HydrophobicContact CD1-CG 3.67Å; F185-P401 HydrophobicContact CD2-CG 4.36Å; F185-P401 HydrophobicContact CE1-CG 3.82Å; F185-P401 HydrophobicContact CE2-CG 4.48Å; F185-P401 HydrophobicContact CG-CG 3.97Å; F185-P401 HydrophobicContact CZ-CG 4.23Å
186	F	52.5	Low	52.7	Low	14 Å²	14	33.1 Å²	33.1	6%	0.061	18%	0.182	C	C	.	.			trans	-99.4	25.9	-166.5	-70.4	-57.2	0	0	0	115.7	L140 S178 L179 F182 T183 R188	L140-F186 HydrophobicContact CB-CD1 4.4Å; L140-F186 HydrophobicContact CB-CE1 4.03Å; L140-F186 HydrophobicContact CD1-CD1 4.13Å; S178-F186 VanDerWaalsContact OG-CB 3.3Å; S178-F186 WeakPolarHBondContact OG-CB 3.41Å; S178-F186 WeakPolarHBondContact OG-CD2 3.44Å; S178-F186 WeakPolarHBondContact OG-CG 3.41Å; L179-F186 WeakPolarHBondContact O-CE2 3.5Å; F182-F186 HydrophobicContact CB-CD2 3.76Å; F182-F186 HydrophobicContact CB-CE2 3.14Å; F182-F186 HydrophobicContact CB-CZ 3.64Å; F182-F186 HydrophobicContact CG-CE2 4.32Å; F182-F186 HydrophobicContact CG-CZ 4.45Å; F182-F186 WeakPolarHBondContact O-CD2 3.44Å; F182-F186 PolarHBondContact O-N 3.33Å; T183-F186 PolarHBondContact O-N 3.11Å; T183-F186 VanDerWaalsContact O-N 3.11Å; F186-R188 VanDerWaalsContact CD1-NH2 3.3Å; F186-R188 PolarHBondContact O-N 3.04Å
187	Y	48.2	Very low	50.3	Low	88 Å²	88	38.6 Å²	38.6	35%	0.345	21%	0.21	S	C	.	.			trans	-72.3	63.6	168.6	-72.2	-83.8	0	0	0	111.2	L189 Y233	Y187-L189 PolarHBondContact O-N 2.94Å; Y187-Y233 AromaticContact CD1-CD1 3.97Å; Y187-Y233 HydrophobicContact CD1-CD1 3.97Å; Y187-Y233 AromaticContact CD1-CD2 3.78Å; Y187-Y233 HydrophobicContact CD1-CD2 3.78Å; Y187-Y233 AromaticContact CD1-CE1 4Å; Y187-Y233 HydrophobicContact CD1-CE1 4Å; Y187-Y233 AromaticContact CD1-CE2 3.81Å; Y187-Y233 HydrophobicContact CD1-CE2 3.81Å; Y187-Y233 AromaticContact CD1-CG 3.87Å; Y187-Y233 HydrophobicContact CD1-CG 3.87Å; Y187-Y233 AromaticContact CD1-CZ 3.93Å; Y187-Y233 HydrophobicContact CE1-CE1 4.36Å; Y187-Y233 HydrophobicContact CG-CD2 4.39Å; Y187-Y233 HydrophobicContact CG-CG 4.42Å
188	R	42.9	Very low	48.1	Very low	17 Å²	17	45 Å²	45	6%	0.064	24%	0.24	C	C	.	.			trans	-78.2	103.5	176.8	-71.7	-166.9	-162.3	157.7	39.8	110.9	F85 G138 L140 D143 F186 V190	F85-R188 HydrophobicContact CD1-CB 4.5Å; F85-R188 HydrophobicContact CE1-CB 3.95Å; F85-R188 HydrophobicContact CZ-CB 4.3Å; G138-R188 PolarHBondContact O-NH1 3.13Å; L140-R188 HydrophobicContact CD1-CG 3.97Å; L140-R188 VanDerWaalsContact CD1-NE 3.31Å; D143-R188 IonicContact OD1-CZ 2.87Å; D143-R188 IonicContact OD1-NH1 3.96Å; D143-R188 IonicContact OD1-NH2 2.85Å; D143-R188 PolarHBondContact OD1-NH2 3.12Å; D143-R188 IonicContact OD2-CZ 3.69Å; D143-R188 IonicContact OD2-NH1 3.25Å; D143-R188 PolarHBondContact OD2-NH1 3.03Å; D143-R188 IonicContact OD2-NH2 3.69Å; D143-R188 PolarHBondContact OD2-NH2 3.43Å; F186-R188 VanDerWaalsContact CD1-NH2 3.3Å; F186-R188 PolarHBondContact O-N 3.04Å; R188-V190 HydrophobicContact CB-CG2 4.34Å; R188-V190 HydrophobicContact CG-CG2 4.4Å
189	L	34.5	Very low	46.2	Very low	33 Å²	33	46.6 Å²	46.6	17%	0.173	25%	0.248	C	C	.	.			trans	-116.3	90.5	146.5	-78.9	161.9	0	0	0	107.3	Y187 Y233 L236 Q237	Y187-L189 PolarHBondContact O-N 2.94Å; L189-Y233 HydrophobicContact CD1-CD2 3.48Å; L189-Y233 VanDerWaalsContact CD1-CD2 3.48Å; L189-Y233 HydrophobicContact CD1-CE2 3.77Å; L189-Y233 HydrophobicContact CD1-CG 4.05Å; L189-Y233 VanDerWaalsContact CD1-O 3.29Å; L189-Y233 WeakPolarHBondContact CD1-O 3.44Å; L189-Y233 HydrophobicContact CG-CD2 3.95Å; L189-Y233 HydrophobicContact CG-CE2 4.37Å; L189-L236 HydrophobicContact CB-CB 3.62Å; L189-L236 HydrophobicContact CB-CD1 3.61Å; L189-L236 HydrophobicContact CB-CG 4.19Å; L189-L236 HydrophobicContact CD1-CB 3.59Å; L189-L236 HydrophobicContact CD2-CB 4.15Å; L189-L236 HydrophobicContact CG-CB 3.96Å; L189-L236 WeakPolarHBondContact O-CD1 3.36Å; L189-Q237 HydrophobicContact CD1-CG 4.2Å
190	V	30.6	Very low	44.2	Very low	31 Å²	31	48 Å²	48	19%	0.188	26%	0.255	C	S	.	.			trans	-91.5	133.1	-179	165.3	0	0	0	0	108.5	R188 V192 I202 V219	R188-V190 HydrophobicContact CB-CG2 4.34Å; R188-V190 HydrophobicContact CG-CG2 4.4Å; V190-V192 HydrophobicContact CG1-CG2 3.78Å; V190-I202 HydrophobicContact CB-CD1 4.1Å; V190-I202 HydrophobicContact CG1-CD1 3.87Å; V190-V219 HydrophobicContact CB-CG2 4.15Å; V190-V219 HydrophobicContact CG1-CG2 3.56Å; V190-V219 HydrophobicContact CG2-CG1 4.24Å; V190-V219 HydrophobicContact CG2-CG2 3.74Å
191	L	27.3	Very low	42.6	Very low	35 Å²	35	53.2 Å²	53.2	18%	0.183	28%	0.277	C	S	.	.			trans	-129.6	126.8	-171	-112	-159.9	0	0	0	105.5	I214 P216 L236	L191-I214 HydrophobicContact CD1-CG2 3.76Å; L191-I214 HydrophobicContact CD2-CG2 4.4Å; L191-P216 HydrophobicContact CB-CB 3.56Å; L191-P216 HydrophobicContact CB-CG 3.36Å; L191-P216 HydrophobicContact CD1-CB 3.88Å; L191-P216 HydrophobicContact CD1-CG 3.63Å; L191-P216 HydrophobicContact CD2-CG 3.51Å; L191-P216 HydrophobicContact CG-CB 4.16Å; L191-P216 HydrophobicContact CG-CG 3.62Å; L191-L236 HydrophobicContact CB-CD1 4.32Å; L191-L236 HydrophobicContact CD1-CD1 3.73Å; L191-L236 HydrophobicContact CD1-CD2 3.81Å; L191-L236 HydrophobicContact CD1-CG 4.14Å; L191-L236 HydrophobicContact CD2-CD2 4.03Å; L191-L236 HydrophobicContact CG-CD1 3.63Å; L191-L236 HydrophobicContact CG-CD2 3.76Å; L191-L236 HydrophobicContact CG-CG 4.27Å
192	V	28.2	Very low	40.9	Very low	25 Å²	25	55.4 Å²	55.4	15%	0.152	29%	0.288	C	S	.	.			trans	-126.2	134.4	-156	-174.1	0	0	0	0	114.3	V190 L200 I202 P216	V190-V192 HydrophobicContact CG1-CG2 3.78Å; V192-L200 HydrophobicContact CG1-CB 3.68Å; V192-L200 HydrophobicContact CG1-CD1 3.77Å; V192-L200 HydrophobicContact CG1-CG 4.3Å; V192-I202 HydrophobicContact CG2-CD1 4.46Å; V192-P216 VanDerWaalsContact C-CD 3.5Å; V192-P216 CarbonylContact C-O 3.12Å; V192-P216 WeakPolarHBondContact CA-O 3.16Å; V192-P216 WeakPolarHBondContact O-CD 3.32Å
193	P	28.1	Very low	38.9	Very low	35 Å²	35	60 Å²	60	23%	0.227	31%	0.31	C	S	.	.			trans	-75.3	152.2	-154.3	21.3	-29.8	0	0	0	115.6	S195 A196 L197 P216	P193-S195 PolarHBondContact O-N 3.37Å; P193-S195 VanDerWaalsContact O-N 3.16Å; P193-A196 HydrophobicContact CG-CB 4.11Å; P193-A196 CarbonylContact O-C 3.48Å; P193-A196 WeakPolarHBondContact O-CA 3.29Å; P193-A196 PolarHBondContact O-N 2.97Å; P193-L197 PolarHBondContact O-N 3.22Å; P193-P216 WeakPolarHBondContact CA-O 3.23Å; P193-P216 WeakPolarHBondContact CB-O 3.39Å; P193-P216 WeakPolarHBondContact CD-O 3.44Å
194	Q	26.5	Very low	37.2	Very low	134 Å²	134	63.5 Å²	63.5	63%	0.626	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-61.4	-26.6	-173.8	-155.9	172.7	10.2	0	0	114.1	A196 T215	Q194-A196 VanDerWaalsContact C-N 3.32Å; Q194-T215 HydrophobicContact CB-CG2 4.35Å; Q194-T215 HydrophobicContact CG-CG2 4.07Å
195	S	30	Very low	35.3	Very low	124 Å²	124	70.9 Å²	70.9	87%	0.867	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-82.7	-4.3	172.2	55.7	0	0	0	0	114.4	P193	P193-S195 PolarHBondContact O-N 3.37Å; P193-S195 VanDerWaalsContact O-N 3.16Å
196	A	32.1	Very low	33.4	Very low	23 Å²	23	80.5 Å²	80.5	19%	0.19	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-118.1	11.5	175	0	0	0	0	0	112.4	P193 Q194 E198 N199	P193-A196 HydrophobicContact CG-CB 4.11Å; P193-A196 CarbonylContact O-C 3.48Å; P193-A196 WeakPolarHBondContact O-CA 3.29Å; P193-A196 PolarHBondContact O-N 2.97Å; Q194-A196 VanDerWaalsContact C-N 3.32Å; A196-E198 PolarHBondContact O-N 3.2Å; A196-N199 VanDerWaalsContact O-CB 3.28Å; A196-N199 WeakPolarHBondContact O-CB 3.4Å; A196-N199 PolarHBondContact O-N 3.43Å; A196-N199 PolarHBondContact O-ND2 2.95Å
197	L	29.6	Very low	32.1	Very low	114 Å²	114	84.9 Å²	84.9	60%	0.597	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-19.1	-171.4	-150.5	74.8	0	0	0	113.8	P193 N199	P193-L197 PolarHBondContact O-N 3.22Å; L197-N199 PolarHBondContact O-N 3.44Å
198	E	33.5	Very low	31	Very low	159 Å²	159	88.7 Å²	88.7	74%	0.743	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-13.4	170	-62.2	-171.3	151.5	0	0	113.5	Y171 A196	Y171-E198 WeakPolarHBondContact CE1-O 3.16Å; Y171-E198 VanDerWaalsContact CZ-O 3.3Å; Y171-E198 PolarHBondContact OH-O 3.49Å; A196-E198 PolarHBondContact O-N 3.2Å
199	N	32.1	Very low	30	Very low	35 Å²	35	94.3 Å²	94.3	19%	0.187	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-18.1	-164.1	-52.4	-43.1	0	0	0	114.8	K90 Y171 A196 L197	K90-N199 HydrophobicContact CB-CB 4.2Å; K90-N199 WeakPolarHBondContact CD-OD1 3.47Å; K90-N199 PolarHBondContact NZ-OD1 3.39Å; Y171-N199 HydrophobicContact CE1-CB 4.17Å; Y171-N199 WeakPolarHBondContact CE1-OD1 3.43Å; Y171-N199 PolarHBondContact OH-OD1 3.19Å; A196-N199 VanDerWaalsContact O-CB 3.28Å; A196-N199 WeakPolarHBondContact O-CB 3.4Å; A196-N199 PolarHBondContact O-N 3.43Å; A196-N199 PolarHBondContact O-ND2 2.95Å; L197-N199 PolarHBondContact O-N 3.44Å
200	L	31.1	Very low	29.5	Very low	30 Å²	30	99 Å²	99	16%	0.157	50%	0.5	C	S	.	.			trans	-146.4	106.4	-168	-107.7	159.2	0	0	0	112.2	H88 V192 I202	H88-L200 HydrophobicContact CB-CD2 4.3Å; H88-L200 WeakPolarHBondContact O-CD2 3.47Å; H88-L200 WeakPolarHBondContact O-CG 3.28Å; V192-L200 HydrophobicContact CG1-CB 3.68Å; V192-L200 HydrophobicContact CG1-CD1 3.77Å; V192-L200 HydrophobicContact CG1-CG 4.3Å; L200-I202 HydrophobicContact CD2-CG1 4.24Å
201	K	36	Very low	29.2	Very low	127 Å²	127	102.8 Å²	102.8	55%	0.552	51%	0.514	S	S	*	.			trans	-98.7	146.6	156.3	-88.1	-176.2	152	-154.4	0	109.2	H88 E203	H88-K201 PolarHBondContact CD2-O 3.31Å; K201-E203 WeakPolarHBondContact CD-OE1 3.08Å; K201-E203 WeakPolarHBondContact CE-OE1 3.5Å; K201-E203 IonicContact NZ-OE1 2.75Å; K201-E203 PolarHBondContact NZ-OE1 3.03Å
202	I	37.1	Very low	29.1	Very low	60 Å²	60	110.5 Å²	110.5	31%	0.308	54%	0.542	S	S	.	.			trans	-130.6	109.8	165.9	-61.4	179.8	0	0	0	106	K86 V190 V192 L200	K86-I202 WeakPolarHBondContact O-CA 3.42Å; K86-I202 WeakPolarHBondContact O-CG2 3.5Å; V190-I202 HydrophobicContact CB-CD1 4.1Å; V190-I202 HydrophobicContact CG1-CD1 3.87Å; V192-I202 HydrophobicContact CG2-CD1 4.46Å; L200-I202 HydrophobicContact CD2-CG1 4.24Å
203	E	34.8	Very low	28.9	Very low	97 Å²	97	117.8 Å²	117.8	45%	0.453	57%	0.574	S	S	.	*			trans	-105.9	125.6	178.7	-71.8	172.3	176.1	0	0	108.4	K201	K201-E203 WeakPolarHBondContact CD-OE1 3.08Å; K201-E203 WeakPolarHBondContact CE-OE1 3.5Å; K201-E203 IonicContact NZ-OE1 2.75Å; K201-E203 PolarHBondContact NZ-OE1 3.03Å
204	Q	33.7	Very low	28.7	Very low	107 Å²	107	119.3 Å²	119.3	50%	0.5	58%	0.579	S	S	.	*			trans	-103.5	125.4	170.2	-74.2	-176.4	-19.2	0	0	108.3
205	E	27.4	Very low	28.7	Very low	180 Å²	180	116.8 Å²	116.8	84%	0.841	57%	0.573	S	S	*	*	S	Bend	trans	-72.2	147.4	161.8	-67	-173	127.6	0	0	109.5
206	Y	25.7	Very low	29	Very low	222 Å²	222	111.2 Å²	111.2	87%	0.871	53%	0.534	S	S	*	.	S	Bend	trans	70.4	74	-170.1	-58.2	-84.8	0	0	0	117.1
207	V	25.1	Very low	28.9	Very low	107 Å²	107	113 Å²	113	65%	0.648	54%	0.542	S	S	*	.				-170.2	155	121.8	134	0	0	0	0	111.7
208	H	23.9	Very low	29.1	Very low	167 Å²	167	109.4 Å²	109.4	77%	0.773	53%	0.527	S	S	*	.			trans	-51.6	158.7	-179.2	-86	-55.7	0	0	0	117.3
209	D	22.7	Very low	29.2	Very low	135 Å²	135	102.8 Å²	102.8	72%	0.722	50%	0.497	S	S	*	.	S	Bend	trans	-55.1	169.8	-177	-50.3	-94.7	0	0	0	117.1
210	N	24.1	Very low	29.4	Very low	132 Å²	132	105.4 Å²	105.4	71%	0.706	51%	0.505	S	S	*	.			trans	74.9	75.8	172.1	-57.4	-41.1	0	0	0	116.9
211	F	25	Very low	29.6	Very low	110 Å²	110	105.8 Å²	105.8	48%	0.482	52%	0.516	S	S	.	.			trans	-139.3	128.3	143.4	-110.7	-79.3	0	0	0	113.4	V239 P241	F211-V239 HydrophobicContact CD1-CG1 3.56Å; F211-V239 HydrophobicContact CD2-CG1 4.05Å; F211-V239 WeakPolarHBondContact CD2-O 3.42Å; F211-V239 HydrophobicContact CE1-CG1 3.5Å; F211-V239 VanDerWaalsContact CE1-CG1 3.5Å; F211-V239 HydrophobicContact CE2-CG1 4.01Å; F211-V239 WeakPolarHBondContact CE2-O 3.11Å; F211-V239 HydrophobicContact CG-CG1 3.85Å; F211-V239 HydrophobicContact CZ-CG1 3.75Å; F211-P241 HydrophobicContact CD2-CG 4.49Å; F211-P241 HydrophobicContact CE2-CB 4.29Å; F211-P241 HydrophobicContact CE2-CG 3.78Å; F211-P241 HydrophobicContact CZ-CG 4.47Å
212	Y	23.7	Very low	29.7	Very low	198 Å²	198	101.6 Å²	101.6	78%	0.776	50%	0.497	S	S	*	.			trans	-122.1	159.8	160.4	-79.1	-94.2	0	0	0	108
213	H	23.9	Very low	29.8	Very low	178 Å²	178	99.3 Å²	99.3	82%	0.824	49%	0.486	S	S	*	.			trans	77.5	61.9	171.1	-46.6	-77.5	0	0	0	119.6
214	I	24.8	Very low	29.8	Very low	67 Å²	67	98.2 Å²	98.2	34%	0.344	49%	0.486	S	S	.	.			trans	-135.2	133.8	146.6	-56.8	-175.5	0	0	0	109.6	L191 P216 V239	L191-I214 HydrophobicContact CD1-CG2 3.76Å; L191-I214 HydrophobicContact CD2-CG2 4.4Å; I214-P216 HydrophobicContact CG2-CG 4.43Å; I214-V239 HydrophobicContact CD1-CB 4.36Å; I214-V239 HydrophobicContact CD1-CG1 3.69Å; I214-V239 HydrophobicContact CD1-CG2 3.64Å
215	T	26.7	Very low	30.1	Very low	80 Å²	80	96.8 Å²	96.8	49%	0.491	48%	0.478	S	S	.	.			trans	-132.6	107.1	-165.1	48.5	0	0	0	0	113.5	Q194	Q194-T215 HydrophobicContact CB-CG2 4.35Å; Q194-T215 HydrophobicContact CG-CG2 4.07Å
216	P	36.4	Very low	30.5	Very low	7 Å²	7	90.5 Å²	90.5	5%	0.045	45%	0.447	C	S	.	.			trans	-137	140.8	-153.4	10.8	18.2	0	0	0	118.3	L191 V192 P193 I214 Y222	L191-P216 HydrophobicContact CB-CB 3.56Å; L191-P216 HydrophobicContact CB-CG 3.36Å; L191-P216 HydrophobicContact CD1-CB 3.88Å; L191-P216 HydrophobicContact CD1-CG 3.63Å; L191-P216 HydrophobicContact CD2-CG 3.51Å; L191-P216 HydrophobicContact CG-CB 4.16Å; L191-P216 HydrophobicContact CG-CG 3.62Å; V192-P216 VanDerWaalsContact C-CD 3.5Å; V192-P216 CarbonylContact C-O 3.12Å; V192-P216 WeakPolarHBondContact CA-O 3.16Å; V192-P216 WeakPolarHBondContact O-CD 3.32Å; P193-P216 WeakPolarHBondContact CA-O 3.23Å; P193-P216 WeakPolarHBondContact CB-O 3.39Å; P193-P216 WeakPolarHBondContact CD-O 3.44Å; I214-P216 HydrophobicContact CG2-CG 4.43Å; P216-Y222 WeakPolarHBondContact CA-OH 3.48Å; P216-Y222 HydrophobicContact CB-CE2 3.57Å
217	V	29.2	Very low	30.9	Very low	61 Å²	61	81.1 Å²	81.1	37%	0.37	42%	0.418	S	S	.	.			trans	-65	168.2	177.5	178.5	0	0	0	0	115.5	Y222	V217-Y222 HydrophobicContact CB-CE2 3.95Å; V217-Y222 PolarHBondContact N-OH 3.12Å; V217-Y222 WeakPolarHBondContact O-CD2 3.47Å; V217-Y222 WeakPolarHBondContact O-CE2 3.22Å
218	S	33.8	Very low	31.8	Very low	39 Å²	39	76.1 Å²	76.1	27%	0.273	39%	0.388	S	S	.	.			trans	-42.1	136.5	176.2	178.6	0	0	0	0	115.5	R220 G221 Y222	S218-R220 VanDerWaalsContact C-N 3.31Å; S218-R220 PolarHBondContact O-N 2.86Å; S218-G221 WeakPolarHBondContact O-CA 3.38Å; S218-G221 PolarHBondContact O-N 3.31Å; S218-Y222 PolarHBondContact O-N 3.06Å
219	V	36.9	Very low	32.8	Very low	20 Å²	20	70.5 Å²	70.5	12%	0.121	36%	0.361	C	S	.	.	H	α-helix	trans	-51.2	-43.7	-179	-171.5	0	0	0	0	113	V190 G221 Y222 A223 F229	V190-V219 HydrophobicContact CB-CG2 4.15Å; V190-V219 HydrophobicContact CG1-CG2 3.56Å; V190-V219 HydrophobicContact CG2-CG1 4.24Å; V190-V219 HydrophobicContact CG2-CG2 3.74Å; V219-G221 VanDerWaalsContact C-N 3.25Å; V219-G221 PolarHBondContact O-N 3.32Å; V219-Y222 PolarHBondContact O-N 3.3Å; V219-A223 WeakPolarHBondContact O-CB 3.49Å; V219-A223 PolarHBondContact O-N 3.1Å; V219-F229 HydrophobicContact CG1-CD1 4.43Å; V219-F229 HydrophobicContact CG1-CE1 3.85Å
220	R	36.2	Very low	33.7	Very low	90 Å²	90	67.1 Å²	67.1	34%	0.34	34%	0.34	S	S	.	.	H	α-helix	trans	-65.4	-31.1	-179.7	-158.4	175.7	-161.6	158.6	11.7	112	S218 V224 D389	S218-R220 VanDerWaalsContact C-N 3.31Å; S218-R220 PolarHBondContact O-N 2.86Å; R220-V224 WeakPolarHBondContact O-CG2 3.49Å; R220-V224 PolarHBondContact O-N 3.29Å; R220-D389 IonicContact CZ-OD2 2.6Å; R220-D389 VanDerWaalsContact CZ-OD2 3.25Å; R220-D389 IonicContact NH1-OD2 2.63Å; R220-D389 PolarHBondContact NH1-OD2 3.37Å; R220-D389 VanDerWaalsContact NH2-CG 3.29Å; R220-D389 PolarHBondContact NH2-O 2.94Å; R220-D389 IonicContact NH2-OD1 3.89Å; R220-D389 IonicContact NH2-OD2 2.79Å; R220-D389 PolarHBondContact NH2-OD2 3.41Å
221	G	35.7	Very low	34.6	Very low	38 Å²	38	63 Å²	63	39%	0.392	32%	0.318	S	S	.	.	H	α-helix	trans	-70.2	-42.3	173.9	0	0	0	0	0	112.6	S218 V219 K225	S218-G221 WeakPolarHBondContact O-CA 3.38Å; S218-G221 PolarHBondContact O-N 3.31Å; V219-G221 VanDerWaalsContact C-N 3.25Å; V219-G221 PolarHBondContact O-N 3.32Å; G221-K225 WeakPolarHBondContact O-CB 3.13Å; G221-K225 PolarHBondContact O-N 3.37Å
222	Y	38	Very low	35.3	Very low	39 Å²	39	58.1 Å²	58.1	15%	0.153	30%	0.297	C	S	.	.	H	α-helix	trans	-75	-34.3	177.4	-74.5	-52.1	0	0	0	114.3	P216 V217 S218 V219 V224 K225 Y226	P216-Y222 WeakPolarHBondContact CA-OH 3.48Å; P216-Y222 HydrophobicContact CB-CE2 3.57Å; V217-Y222 HydrophobicContact CB-CE2 3.95Å; V217-Y222 PolarHBondContact N-OH 3.12Å; V217-Y222 WeakPolarHBondContact O-CD2 3.47Å; V217-Y222 WeakPolarHBondContact O-CE2 3.22Å; S218-Y222 PolarHBondContact O-N 3.06Å; V219-Y222 PolarHBondContact O-N 3.3Å; Y222-V224 VanDerWaalsContact C-N 3.26Å; Y222-V224 PolarHBondContact O-N 3.2Å; Y222-K225 HydrophobicContact CD1-CD 4.26Å; Y222-K225 HydrophobicContact CE1-CD 4.48Å; Y222-K225 PolarHBondContact O-N 3.23Å; Y222-Y226 HydrophobicContact CD1-CD2 4.09Å; Y222-Y226 AromaticContact CD1-CE2 3.51Å; Y222-Y226 HydrophobicContact CD1-CE2 3.51Å; Y222-Y226 HydrophobicContact CE1-CE2 4.17Å; Y222-Y226 HydrophobicContact CG-CD2 4.44Å; Y222-Y226 HydrophobicContact CG-CE2 4.17Å; Y222-Y226 WeakPolarHBondContact O-CB 3.24Å; Y222-Y226 WeakPolarHBondContact O-CD2 3.38Å; Y222-Y226 PolarHBondContact O-N 2.81Å
223	A	37.8	Very low	36.1	Very low	11 Å²	11	51.4 Å²	51.4	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-36.7	173.7	0	0	0	0	0	111.4	V219 G227 S228 F229	V219-A223 WeakPolarHBondContact O-CB 3.49Å; V219-A223 PolarHBondContact O-N 3.1Å; A223-G227 CarbonylContact O-C 3.56Å; A223-G227 WeakPolarHBondContact O-CA 3.49Å; A223-G227 PolarHBondContact O-N 3.39Å; A223-S228 PolarHBondContact O-N 2.74Å; A223-F229 HydrophobicContact CB-CD1 4.48Å; A223-F229 HydrophobicContact CB-CD2 4.36Å; A223-F229 HydrophobicContact CB-CE1 4.21Å; A223-F229 HydrophobicContact CB-CE2 4.07Å; A223-F229 HydrophobicContact CB-CZ 3.99Å
224	V	36.3	Very low	37	Very low	74 Å²	74	45.9 Å²	45.9	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-69.2	-48.1	170.5	171.3	0	0	0	0	111	R220 Y222 Y226 G227	R220-V224 WeakPolarHBondContact O-CG2 3.49Å; R220-V224 PolarHBondContact O-N 3.29Å; Y222-V224 VanDerWaalsContact C-N 3.26Å; Y222-V224 PolarHBondContact O-N 3.2Å; V224-Y226 PolarHBondContact O-N 3.17Å; V224-G227 PolarHBondContact O-N 2.81Å
225	K	38.3	Very low	37.7	Very low	77 Å²	77	46.3 Å²	46.3	34%	0.335	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-37.6	-178.3	-164.7	-165.8	172.9	-153.7	0	113.8	G221 Y222 D1251	G221-K225 WeakPolarHBondContact O-CB 3.13Å; G221-K225 PolarHBondContact O-N 3.37Å; Y222-K225 HydrophobicContact CD1-CD 4.26Å; Y222-K225 HydrophobicContact CE1-CD 4.48Å; Y222-K225 PolarHBondContact O-N 3.23Å; K225-D1251 VanDerWaalsContact CE-OD1 3.3Å; K225-D1251 WeakPolarHBondContact CE-OD1 3.47Å; K225-D1251 VanDerWaalsContact NZ-CG 3.35Å; K225-D1251 IonicContact NZ-OD1 2.71Å; K225-D1251 PolarHBondContact NZ-OD1 2.7Å; K225-D1251 IonicContact NZ-OD2 2.74Å
226	Y	36.3	Very low	38.2	Very low	49 Å²	49	43.8 Å²	43.8	19%	0.192	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	12	-177	-63.7	-58.2	0	0	0	114	Y222 V224 S228 N231 L232 D1251	Y222-Y226 HydrophobicContact CD1-CD2 4.09Å; Y222-Y226 AromaticContact CD1-CE2 3.51Å; Y222-Y226 HydrophobicContact CD1-CE2 3.51Å; Y222-Y226 HydrophobicContact CE1-CE2 4.17Å; Y222-Y226 HydrophobicContact CG-CD2 4.44Å; Y222-Y226 HydrophobicContact CG-CE2 4.17Å; Y222-Y226 WeakPolarHBondContact O-CB 3.24Å; Y222-Y226 WeakPolarHBondContact O-CD2 3.38Å; Y222-Y226 PolarHBondContact O-N 2.81Å; V224-Y226 PolarHBondContact O-N 3.17Å; Y226-S228 PolarHBondContact O-N 2.93Å; Y226-N231 PolarHBondContact O-ND2 2.73Å; Y226-L232 HydrophobicContact CD2-CD1 4.35Å; Y226-D1251 WeakPolarHBondContact CE1-OD2 3.32Å; Y226-D1251 PolarHBondContact OH-OD2 3.07Å
227	G	33.9	Very low	38.2	Very low	25 Å²	25	48.7 Å²	48.7	26%	0.258	25%	0.251	S	S	.	.	S	Bend	trans	72.6	-32	-177.6	0	0	0	0	0	115.1	A223 V224	A223-G227 CarbonylContact O-C 3.56Å; A223-G227 WeakPolarHBondContact O-CA 3.49Å; A223-G227 PolarHBondContact O-N 3.39Å; V224-G227 PolarHBondContact O-N 2.81Å
228	S	43.5	Very low	38.5	Very low	1 Å²	1	52.6 Å²	52.6	1%	0.007	26%	0.263	C	S	.	.			trans	-157.7	164.6	177.3	68	0	0	0	0	117.9	A223 Y226 K230 N231 L232 D399	A223-S228 PolarHBondContact O-N 2.74Å; Y226-S228 PolarHBondContact O-N 2.93Å; S228-K230 PolarHBondContact O-N 3.23Å; S228-K230 PolarHBondContact OG-N 3.08Å; S228-N231 PolarHBondContact OG-N 3.42Å; S228-N231 PolarHBondContact OG-ND2 2.94Å; S228-L232 PolarHBondContact O-N 3.43Å; S228-D399 VanDerWaalsContact CB-CB 3.46Å; S228-D399 VanDerWaalsContact CB-CG 3.46Å; S228-D399 WeakPolarHBondContact CB-O 3.43Å; S228-D399 WeakPolarHBondContact CB-OD1 3.39Å; S228-D399 PolarHBondContact OG-OD1 3.2Å
229	F	44.8	Very low	38.5	Very low	49 Å²	49	52.7 Å²	52.7	22%	0.215	26%	0.261	C	S	.	.	H	α-helix	trans	-56.9	-30.1	158.2	-59.8	-85.9	0	0	0	113.6	V219 A223 Y233	V219-F229 HydrophobicContact CG1-CD1 4.43Å; V219-F229 HydrophobicContact CG1-CE1 3.85Å; A223-F229 HydrophobicContact CB-CD1 4.48Å; A223-F229 HydrophobicContact CB-CD2 4.36Å; A223-F229 HydrophobicContact CB-CE1 4.21Å; A223-F229 HydrophobicContact CB-CE2 4.07Å; A223-F229 HydrophobicContact CB-CZ 3.99Å; F229-Y233 WeakPolarHBondContact O-CB 3.35Å; F229-Y233 PolarHBondContact O-N 3.26Å
230	K	43.2	Very low	38	Very low	64 Å²	64	57 Å²	57	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-74.7	-39.1	-176.2	-152.3	-178.2	-169.9	98.4	0	111.7	S228 Y233 L234 D336	S228-K230 PolarHBondContact O-N 3.23Å; S228-K230 PolarHBondContact OG-N 3.08Å; K230-Y233 PolarHBondContact O-N 2.84Å; K230-L234 PolarHBondContact O-N 3.24Å; K230-D336 IonicContact NZ-OD2 3.38Å; K230-D336 PolarHBondContact NZ-OD2 2.84Å
231	N	41.3	Very low	37.4	Very low	45 Å²	45	55.7 Å²	55.7	24%	0.241	28%	0.282	C	S	.	.	H	α-helix	trans	-69.6	-41.9	174	-59.4	-27.7	0	0	0	110.7	Y226 S228 Y233 L234 Y235 D399	Y226-N231 PolarHBondContact O-ND2 2.73Å; S228-N231 PolarHBondContact OG-N 3.42Å; S228-N231 PolarHBondContact OG-ND2 2.94Å; N231-Y233 VanDerWaalsContact C-N 3.3Å; N231-Y233 PolarHBondContact O-N 2.79Å; N231-L234 PolarHBondContact O-N 3.21Å; N231-Y235 WeakPolarHBondContact O-CB 3.41Å; N231-Y235 PolarHBondContact O-N 3.17Å; N231-D399 PolarHBondContact ND2-OD1 3.09Å
232	L	41.2	Very low	36.9	Very low	8 Å²	8	61.9 Å²	61.9	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-58.6	-38.7	173	-176.5	64	0	0	0	112.5	Y226 S228 L236	Y226-L232 HydrophobicContact CD2-CD1 4.35Å; S228-L232 PolarHBondContact O-N 3.43Å; L232-L236 HydrophobicContact CD1-CD1 4.15Å; L232-L236 HydrophobicContact CG-CD1 4.46Å; L232-L236 PolarHBondContact O-N 3.47Å
233	Y	41	Very low	36.2	Very low	57 Å²	57	65.2 Å²	65.2	22%	0.224	33%	0.33	C	S	.	.	H	α-helix	trans	-65.2	-47.3	175.5	175.6	-88.6	0	0	0	112.8	Y187 L189 F229 K230 N231 Y235 L236 Q237	Y187-Y233 AromaticContact CD1-CD1 3.97Å; Y187-Y233 HydrophobicContact CD1-CD1 3.97Å; Y187-Y233 AromaticContact CD1-CD2 3.78Å; Y187-Y233 HydrophobicContact CD1-CD2 3.78Å; Y187-Y233 AromaticContact CD1-CE1 4Å; Y187-Y233 HydrophobicContact CD1-CE1 4Å; Y187-Y233 AromaticContact CD1-CE2 3.81Å; Y187-Y233 HydrophobicContact CD1-CE2 3.81Å; Y187-Y233 AromaticContact CD1-CG 3.87Å; Y187-Y233 HydrophobicContact CD1-CG 3.87Å; Y187-Y233 AromaticContact CD1-CZ 3.93Å; Y187-Y233 HydrophobicContact CE1-CE1 4.36Å; Y187-Y233 HydrophobicContact CG-CD2 4.39Å; Y187-Y233 HydrophobicContact CG-CG 4.42Å; L189-Y233 HydrophobicContact CD1-CD2 3.48Å; L189-Y233 VanDerWaalsContact CD1-CD2 3.48Å; L189-Y233 HydrophobicContact CD1-CE2 3.77Å; L189-Y233 HydrophobicContact CD1-CG 4.05Å; L189-Y233 VanDerWaalsContact CD1-O 3.29Å; L189-Y233 WeakPolarHBondContact CD1-O 3.44Å; L189-Y233 HydrophobicContact CG-CD2 3.95Å; L189-Y233 HydrophobicContact CG-CE2 4.37Å; F229-Y233 WeakPolarHBondContact O-CB 3.35Å; F229-Y233 PolarHBondContact O-N 3.26Å; K230-Y233 PolarHBondContact O-N 2.84Å; N231-Y233 VanDerWaalsContact C-N 3.3Å; N231-Y233 PolarHBondContact O-N 2.79Å; Y233-Y235 VanDerWaalsContact C-N 3.33Å; Y233-Y235 PolarHBondContact O-N 2.74Å; Y233-L236 PolarHBondContact O-N 2.94Å; Y233-Q237 HydrophobicContact CD1-CG 4.36Å; Y233-Q237 VanDerWaalsContact CE1-CD 3.44Å; Y233-Q237 HydrophobicContact CE1-CG 3.8Å; Y233-Q237 PolarHBondContact O-N 3.33Å; Y233-Q237 VanDerWaalsContact O-N 3.14Å; Y233-Q237 PolarHBondContact OH-NE2 2.87Å; Y233-Q237 VanDerWaalsContact OH-NE2 3.09Å
234	L	40.9	Very low	35.6	Very low	62 Å²	62	73.4 Å²	73.4	33%	0.325	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-38.2	179.7	-69.2	171.2	0	0	0	112.1	K230 N231 L236 Q237 Y1244	K230-L234 PolarHBondContact O-N 3.24Å; N231-L234 PolarHBondContact O-N 3.21Å; L234-L236 VanDerWaalsContact C-N 3.28Å; L234-L236 PolarHBondContact O-N 3.14Å; L234-Q237 PolarHBondContact O-N 3.35Å; L234-Y1244 PolarHBondContact O-OH 3.44Å
235	Y	40.3	Very low	35	Very low	76 Å²	76	77.9 Å²	77.9	30%	0.298	38%	0.38	S	S	.	.	H	α-helix	trans	-54	-45.7	175.2	175.2	-107.5	0	0	0	111.7	N231 Y233 K238 Y1244	N231-Y235 WeakPolarHBondContact O-CB 3.41Å; N231-Y235 PolarHBondContact O-N 3.17Å; Y233-Y235 VanDerWaalsContact C-N 3.33Å; Y233-Y235 PolarHBondContact O-N 2.74Å; Y235-K238 PolarHBondContact O-N 3.39Å; Y235-Y1244 VanDerWaalsContact CA-OH 3.25Å; Y235-Y1244 WeakPolarHBondContact CA-OH 3.28Å; Y235-Y1244 HydrophobicContact CD2-CE1 4.11Å; Y235-Y1244 PolarHBondContact N-OH 2.67Å; Y235-Y1244 VanDerWaalsContact N-OH 3.13Å
236	L	36.8	Very low	34.3	Very low	27 Å²	27	81.6 Å²	81.6	14%	0.141	40%	0.404	C	S	.	.	H	α-helix	trans	-81.3	-23.7	-175.9	-85.5	147.5	0	0	0	114.6	L189 L191 L232 Y233 L234 K238 V239	L189-L236 HydrophobicContact CB-CB 3.62Å; L189-L236 HydrophobicContact CB-CD1 3.61Å; L189-L236 HydrophobicContact CB-CG 4.19Å; L189-L236 HydrophobicContact CD1-CB 3.59Å; L189-L236 HydrophobicContact CD2-CB 4.15Å; L189-L236 HydrophobicContact CG-CB 3.96Å; L189-L236 WeakPolarHBondContact O-CD1 3.36Å; L191-L236 HydrophobicContact CB-CD1 4.32Å; L191-L236 HydrophobicContact CD1-CD1 3.73Å; L191-L236 HydrophobicContact CD1-CD2 3.81Å; L191-L236 HydrophobicContact CD1-CG 4.14Å; L191-L236 HydrophobicContact CD2-CD2 4.03Å; L191-L236 HydrophobicContact CG-CD1 3.63Å; L191-L236 HydrophobicContact CG-CD2 3.76Å; L191-L236 HydrophobicContact CG-CG 4.27Å; L232-L236 HydrophobicContact CD1-CD1 4.15Å; L232-L236 HydrophobicContact CG-CD1 4.46Å; L232-L236 PolarHBondContact O-N 3.47Å; Y233-L236 PolarHBondContact O-N 2.94Å; L234-L236 VanDerWaalsContact C-N 3.28Å; L234-L236 PolarHBondContact O-N 3.14Å; L236-K238 PolarHBondContact O-N 3.1Å; L236-V239 HydrophobicContact CD2-CG2 4.27Å; L236-V239 PolarHBondContact O-N 3.05Å
237	Q	36.2	Very low	33.7	Very low	111 Å²	111	83.3 Å²	83.3	52%	0.519	42%	0.423	S	S	.	.	H	α-helix	trans	-64.4	-21.4	170.8	-77.5	-155.4	-59.4	0	0	113.7	L189 Y233 L234	L189-Q237 HydrophobicContact CD1-CG 4.2Å; Y233-Q237 HydrophobicContact CD1-CG 4.36Å; Y233-Q237 VanDerWaalsContact CE1-CD 3.44Å; Y233-Q237 HydrophobicContact CE1-CG 3.8Å; Y233-Q237 PolarHBondContact O-N 3.33Å; Y233-Q237 VanDerWaalsContact O-N 3.14Å; Y233-Q237 PolarHBondContact OH-NE2 2.87Å; Y233-Q237 VanDerWaalsContact OH-NE2 3.09Å; L234-Q237 PolarHBondContact O-N 3.35Å
238	K	35.3	Very low	33.2	Very low	143 Å²	143	87.2 Å²	87.2	62%	0.622	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	2	178.8	-81.7	-164.3	167.9	-162.1	0	115	Y235 L236 K240 Y1244	Y235-K238 PolarHBondContact O-N 3.39Å; L236-K238 PolarHBondContact O-N 3.1Å; K238-K240 PolarHBondContact O-N 2.97Å; K238-Y1244 HydrophobicContact CB-CE1 4.17Å; K238-Y1244 HydrophobicContact CD-CD1 4.3Å; K238-Y1244 HydrophobicContact CD-CE1 4.01Å
239	V	34.9	Very low	32.4	Very low	40 Å²	40	93.4 Å²	93.4	24%	0.242	48%	0.484	C	S	.	.			trans	-80.2	67.2	173.1	-172.1	0	0	0	0	109.1	F211 I214 L236	F211-V239 HydrophobicContact CD1-CG1 3.56Å; F211-V239 HydrophobicContact CD2-CG1 4.05Å; F211-V239 WeakPolarHBondContact CD2-O 3.42Å; F211-V239 HydrophobicContact CE1-CG1 3.5Å; F211-V239 VanDerWaalsContact CE1-CG1 3.5Å; F211-V239 HydrophobicContact CE2-CG1 4.01Å; F211-V239 WeakPolarHBondContact CE2-O 3.11Å; F211-V239 HydrophobicContact CG-CG1 3.85Å; F211-V239 HydrophobicContact CZ-CG1 3.75Å; I214-V239 HydrophobicContact CD1-CB 4.36Å; I214-V239 HydrophobicContact CD1-CG1 3.69Å; I214-V239 HydrophobicContact CD1-CG2 3.64Å; L236-V239 HydrophobicContact CD2-CG2 4.27Å; L236-V239 PolarHBondContact O-N 3.05Å
240	K	25.4	Very low	31.4	Very low	110 Å²	110	96.9 Å²	96.9	48%	0.478	51%	0.505	S	S	.	.	S	Bend	trans	-138.7	141.4	172.7	-93.8	-164.4	171.6	-172.1	0	109	K238	K238-K240 PolarHBondContact O-N 2.97Å
241	P	24.9	Very low	30.5	Very low	64 Å²	64	98.7 Å²	98.7	42%	0.416	52%	0.521	S	S	.	.			trans	-93.6	113.8	-170.6	22.2	-4.8	0	0	0	110.4	F211 T243	F211-P241 HydrophobicContact CD2-CG 4.49Å; F211-P241 HydrophobicContact CE2-CB 4.29Å; F211-P241 HydrophobicContact CE2-CG 3.78Å; F211-P241 HydrophobicContact CZ-CG 4.47Å; P241-T243 VanDerWaalsContact C-N 3.32Å; P241-T243 PolarHBondContact O-N 3.41Å; P241-T243 PolarHBondContact O-OG1 3.03Å
242	D	24.3	Very low	29.8	Very low	167 Å²	167	101.8 Å²	101.8	89%	0.893	54%	0.542	S	S	*	.	S	Bend	trans	44.2	42	154.2	-53.2	-22.2	0	0	0	117.6
243	T	23.7	Very low	29.1	Very low	110 Å²	110	105.5 Å²	105.5	68%	0.675	56%	0.559	S	S	*	*			trans	-139	26.3	179.7	36.3	0	0	0	0	114.6	P241	P241-T243 VanDerWaalsContact C-N 3.32Å; P241-T243 PolarHBondContact O-N 3.41Å; P241-T243 PolarHBondContact O-OG1 3.03Å
244	F	25.6	Very low	28.3	Very low	183 Å²	183	108.4 Å²	108.4	80%	0.803	58%	0.582	S	S	*	*			trans	-147.8	51.9	165.8	-103.2	-69.1	0	0	0	113.5
245	E	23.6	Very low	27.6	Very low	168 Å²	168	110.4 Å²	110.4	79%	0.785	59%	0.592	S	S	*	*			trans	-67.7	154.2	154	-67	-162.5	137.1	0	0	110.5
246	N	23.6	Very low	26.8	Very low	154 Å²	154	115.1 Å²	115.1	82%	0.824	62%	0.617	S	S	*	*			trans	68	52.4	164.1	-54.6	-51.8	0	0	0	118.2
247	S	22.7	Very low	26.2	Very low	86 Å²	86	121.4 Å²	121.4	60%	0.601	64%	0.639	S	S	*	*			trans	-130	99.2	146.4	71.7	0	0	0	0	111.4	V249	S247-V249 PolarHBondContact O-N 3.2Å
248	S	24.7	Very low	25.5	Very low	107 Å²	107	125.3 Å²	125.3	75%	0.748	65%	0.654	S	S	*	*			trans	-34.2	114.5	-176.5	54.7	0	0	0	0	116.5
249	V	25.8	Very low	25.1	Very low	131 Å²	131	124 Å²	124	79%	0.794	66%	0.66	S	S	*	*			trans	-108.5	-33.4	161.1	178.5	0	0	0	0	110.8	S247 T251	S247-V249 PolarHBondContact O-N 3.2Å; V249-T251 PolarHBondContact O-N 3.02Å
250	D	24	Very low	24.6	Very low	122 Å²	122	128.8 Å²	128.8	65%	0.652	69%	0.685	S	S	*	*	S	Bend	trans	-86	67.7	178.7	-58	-89	0	0	0	113.3	R1241	D250-R1241 IonicContact OD1-NH2 2.65Å; D250-R1241 PolarHBondContact OD1-NH2 3.2Å
251	T	24.5	Very low	24.6	Very low	101 Å²	101	129.2 Å²	129.2	62%	0.62	69%	0.692	S	S	*	*			trans	-161.6	69.2	166.1	-5.5	0	0	0	0	115.2	V249	V249-T251 PolarHBondContact O-N 3.02Å
252	V	25.7	Very low	24.6	Very low	111 Å²	111	132.4 Å²	132.4	67%	0.673	71%	0.706	S	S	*	*	S	Bend	trans	-142.3	53.8	162.5	-161.4	0	0	0	0	111.6
253	H	26.6	Very low	24.6	Very low	86 Å²	86	131.4 Å²	131.4	40%	0.398	70%	0.7	S	S	.	*	S	Bend	trans	-150	54.3	169.9	-100.1	-69.6	0	0	0	110.4	E1219	H253-E1219 IonicContact CE1-OE2 2.73Å; H253-E1219 IonicContact ND1-OE2 2.94Å; H253-E1219 PolarHBondContact ND1-OE2 3.4Å
254	T	24.3	Very low	24.7	Very low	117 Å²	117	132.9 Å²	132.9	72%	0.718	70%	0.704	S	S	*	*			trans	-153.1	100.4	178.1	-36.8	0	0	0	0	110.3
255	I	27	Very low	24.7	Very low	105 Å²	105	130.7 Å²	130.7	54%	0.538	70%	0.701	S	S	.	*			trans	-134.5	119.5	165.9	-88.3	175.5	0	0	0	105.6	R257 E275	I255-R257 HydrophobicContact CG2-CG 4.38Å; I255-E275 HydrophobicContact CD1-CB 4.17Å; I255-E275 WeakPolarHBondContact CG1-OE2 3.22Å; I255-E275 VanDerWaalsContact CG2-OE1 3.31Å; I255-E275 WeakPolarHBondContact CG2-OE1 3.36Å; I255-E275 VanDerWaalsContact CG2-OE2 3.23Å; I255-E275 WeakPolarHBondContact CG2-OE2 3.44Å
256	E	22.7	Very low	24.7	Very low	175 Å²	175	130.4 Å²	130.4	82%	0.818	70%	0.704	S	S	*	*			trans	-86.3	125.1	179	-68.5	-166.8	152.7	0	0	110.6
257	R	24.7	Very low	24.8	Very low	158 Å²	158	131 Å²	131	60%	0.596	70%	0.702	S	S	*	*			trans	-125.9	122	162.8	-68.7	-168.7	178.5	-174.5	2.7	111	I255 E275	I255-R257 HydrophobicContact CG2-CG 4.38Å; R257-E275 IonicContact CZ-OE1 3.18Å; R257-E275 IonicContact NE-OE1 2.74Å; R257-E275 PolarHBondContact NE-OE1 3.4Å; R257-E275 IonicContact NH2-OE1 2.58Å; R257-E275 PolarHBondContact NH2-OE1 2.74Å
258	K	22.4	Very low	24.9	Very low	193 Å²	193	137.1 Å²	137.1	84%	0.839	71%	0.714	S	S	*	*			trans	-73.9	140.4	173	-64.7	176.1	-178.3	174.1	0	109.4
259	P	25.5	Very low	25	Very low	116 Å²	116	138.4 Å²	138.4	75%	0.753	72%	0.717	S	S	*	*			trans	-74.6	145.3	171.3	32	-34.1	0	0	0	110.8
260	N	25.1	Very low	25.1	Very low	141 Å²	141	138 Å²	138	75%	0.754	71%	0.707	S	S	*	*			trans	-172	140.8	137.3	-106.5	28.2	0	0	0	111.9
261	D	26.3	Very low	25.1	Very low	119 Å²	119	134.6 Å²	134.6	64%	0.636	69%	0.692	S	S	*	*			trans	55.6	94.9	149.5	-55.6	-47.2	0	0	0	122.6
262	N	24.4	Very low	25.4	Very low	131 Å²	131	135.8 Å²	135.8	70%	0.701	70%	0.699	S	S	*	*				68.3	123.3	121.1	-55.6	-43	0	0	0	123.2
263	N	24.8	Very low	25.6	Very low	146 Å²	146	135.9 Å²	135.9	78%	0.781	69%	0.688	S	S	*	*			trans	86.6	145.3	144	-63.9	-8.7	0	0	0	121.7
264	N	25.4	Very low	25.7	Very low	140 Å²	140	137.4 Å²	137.4	75%	0.749	70%	0.695	S	S	*	*			trans	79	95.6	166.1	-61.1	7.3	0	0	0	119.2
265	D	24.9	Very low	26.2	Very low	138 Å²	138	136.1 Å²	136.1	74%	0.738	68%	0.681	S	S	*	*				53.1	119.2	122.8	-54.3	-6.1	0	0	0	122.2
266	N	24.4	Very low	26.8	Very low	161 Å²	161	134 Å²	134	86%	0.861	67%	0.67	S	S	*	*			trans	68.7	40.5	139.8	-64.1	-33.5	0	0	0	121.3
267	E	24.7	Very low	27.6	Very low	166 Å²	166	131.1 Å²	131.1	78%	0.776	66%	0.661	S	S	*	*			trans	-141.9	45.4	165.4	-152.1	164.3	-128.2	0	0	115.5	V269	E267-V269 PolarHBondContact O-N 2.88Å
268	Y	25.9	Very low	28.5	Very low	215 Å²	215	131.6 Å²	131.6	84%	0.843	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	48.1	-168.4	-138	-90.5	0	0	0	116.3
269	V	26.9	Very low	29.9	Very low	135 Å²	135	128.6 Å²	128.6	82%	0.818	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.4	-17.2	177	-177.3	0	0	0	0	114.2	E267	E267-V269 PolarHBondContact O-N 2.88Å
270	Q	25.9	Very low	31.5	Very low	123 Å²	123	128 Å²	128	58%	0.575	66%	0.658	S	S	*	*	S	Bend	trans	-106.9	-3.7	-172.6	-68.3	-175.5	-9	0	0	115.8	V272	Q270-V272 VanDerWaalsContact C-N 3.29Å; Q270-V272 PolarHBondContact O-N 3.07Å; Q270-V272 VanDerWaalsContact O-N 3.13Å
271	S	24.2	Very low	33.8	Very low	50 Å²	50	125.3 Å²	125.3	35%	0.35	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-72.2	-8.1	-166.6	55.4	0	0	0	0	116.8	Y273	S271-Y273 VanDerWaalsContact C-N 3.27Å; S271-Y273 PolarHBondContact O-N 3.23Å
272	V	31	Very low	36.5	Very low	125 Å²	125	121.5 Å²	121.5	76%	0.758	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-75.3	-10.8	-178.2	-177.1	0	0	0	0	113.2	Q270	Q270-V272 VanDerWaalsContact C-N 3.29Å; Q270-V272 PolarHBondContact O-N 3.07Å; Q270-V272 VanDerWaalsContact O-N 3.13Å
273	Y	31.2	Very low	39.5	Very low	114 Å²	114	118.4 Å²	118.4	45%	0.447	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-90.8	-2.8	-168.9	-75.9	-68.7	0	0	0	116.9	S271 E275 R326	S271-Y273 VanDerWaalsContact C-N 3.27Å; S271-Y273 PolarHBondContact O-N 3.23Å; Y273-E275 PolarHBondContact O-N 3.49Å; Y273-R326 HydrophobicContact CE1-CG 4.26Å
274	H	28.9	Very low	42.6	Very low	118 Å²	118	111.6 Å²	111.6	55%	0.546	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	2.9	-148.8	-111.1	-72.3	0	0	0	119.6	N277	H274-N277 PolarHBondContact ND1-ND2 3.29Å; H274-N277 PolarHBondContact O-ND2 3.36Å
275	E	33.7	Very low	45.7	Very low	89 Å²	89	106 Å²	106	42%	0.416	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	0.7	-167.4	-63.3	-169.1	-150.7	0	0	116.9	I255 R257 Y273	I255-E275 HydrophobicContact CD1-CB 4.17Å; I255-E275 WeakPolarHBondContact CG1-OE2 3.22Å; I255-E275 VanDerWaalsContact CG2-OE1 3.31Å; I255-E275 WeakPolarHBondContact CG2-OE1 3.36Å; I255-E275 VanDerWaalsContact CG2-OE2 3.23Å; I255-E275 WeakPolarHBondContact CG2-OE2 3.44Å; R257-E275 IonicContact CZ-OE1 3.18Å; R257-E275 IonicContact NE-OE1 2.74Å; R257-E275 PolarHBondContact NE-OE1 3.4Å; R257-E275 IonicContact NH2-OE1 2.58Å; R257-E275 PolarHBondContact NH2-OE1 2.74Å; Y273-E275 PolarHBondContact O-N 3.49Å
276	D	39.2	Very low	48.7	Very low	61 Å²	61	99.9 Å²	99.9	33%	0.326	51%	0.508	S	S	.	.			trans	-98.4	16.9	168	-57.4	-62	0	0	0	112.9	N278 Q279 R326	D276-N278 PolarHBondContact O-N 2.89Å; D276-Q279 PolarHBondContact O-N 3.11Å; D276-R326 IonicContact OD2-CZ 2.72Å; D276-R326 IonicContact OD2-NH1 3.87Å; D276-R326 PolarHBondContact OD2-NH1 3.15Å; D276-R326 IonicContact OD2-NH2 3.26Å; D276-R326 PolarHBondContact OD2-NH2 3.24Å
277	N	39.3	Very low	51.6	Low	114 Å²	114	93.1 Å²	93.1	61%	0.61	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	0.8	-164.3	-82.5	-6.9	0	0	0	117	H274	H274-N277 PolarHBondContact ND1-ND2 3.29Å; H274-N277 PolarHBondContact O-ND2 3.36Å
278	N	44.3	Very low	54.4	Low	168 Å²	168	89 Å²	89	90%	0.898	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-1.2	173.5	-75.2	-18.1	0	0	0	114.2	D276	D276-N278 PolarHBondContact O-N 2.89Å
279	Q	52	Low	56.5	Low	131 Å²	131	88.1 Å²	88.1	61%	0.612	45%	0.453	S	S	*	.			trans	-90.8	110.5	172.4	-76.2	-168.9	-11.8	0	0	111.2	D276 F282	D276-Q279 PolarHBondContact O-N 3.11Å; Q279-F282 VanDerWaalsContact O-CD1 3.32Å; Q279-F282 WeakPolarHBondContact O-CD1 3.27Å; Q279-F282 WeakPolarHBondContact O-CE1 3.41Å
280	T	59.1	Low	58.3	Low	103 Å²	103	89.4 Å²	89.4	63%	0.632	45%	0.45	S	S	*	.			trans	-85.1	157.1	157	50.2	0	0	0	0	109.8	L298	T280-L298 WeakPolarHBondContact CG2-O 3.43Å
281	D	74.3	Confident	60.6	Low	85 Å²	85	83.7 Å²	83.7	46%	0.455	42%	0.424	S	S	.	.	S	Bend	trans	67.6	53.1	-178.9	-161.4	24.8	0	0	0	117.1	K296 F297	D281-K296 WeakPolarHBondContact OD1-CB 3.46Å; D281-K296 WeakPolarHBondContact OD1-CD 3.37Å; D281-K296 WeakPolarHBondContact OD1-CE 3.36Å; D281-K296 WeakPolarHBondContact OD1-CG 3.45Å; D281-K296 IonicContact OD1-NZ 3.06Å; D281-K296 PolarHBondContact OD1-NZ 2.89Å; D281-K296 IonicContact OD2-NZ 3.63Å; D281-K296 PolarHBondContact OD2-NZ 3.39Å; D281-F297 WeakPolarHBondContact CA-O 3.29Å; D281-F297 PolarHBondContact N-O 3.27Å
282	F	83.1	Confident	63.5	Low	39 Å²	39	82.8 Å²	82.8	17%	0.171	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	152.7	165.2	62.5	-97.9	0	0	0	112.3	Q279 V284 K296 F297 R326	Q279-F282 VanDerWaalsContact O-CD1 3.32Å; Q279-F282 WeakPolarHBondContact O-CD1 3.27Å; Q279-F282 WeakPolarHBondContact O-CE1 3.41Å; F282-V284 HydrophobicContact CD2-CG1 3.78Å; F282-V284 HydrophobicContact CE2-CG1 3.52Å; F282-K296 WeakPolarHBondContact O-CA 3.48Å; F282-F297 HydrophobicContact CD1-CB 4.33Å; F282-F297 HydrophobicContact CD1-CD1 4.32Å; F282-F297 HydrophobicContact CD2-CB 4.08Å; F282-F297 HydrophobicContact CE1-CB 4.01Å; F282-F297 AromaticContact CE1-CD1 3.46Å; F282-F297 HydrophobicContact CE1-CD1 3.46Å; F282-F297 VanDerWaalsContact CE1-CD1 3.46Å; F282-F297 HydrophobicContact CE1-CE1 4.14Å; F282-F297 AromaticContact CE1-CG 3.92Å; F282-F297 HydrophobicContact CE1-CG 3.92Å; F282-F297 HydrophobicContact CE2-CB 3.73Å; F282-F297 HydrophobicContact CE2-CD1 4.41Å; F282-F297 HydrophobicContact CE2-CG 4.04Å; F282-F297 HydrophobicContact CG-CB 4.36Å; F282-F297 HydrophobicContact CZ-CB 3.69Å; F282-F297 AromaticContact CZ-CD1 3.5Å; F282-F297 HydrophobicContact CZ-CD1 3.5Å; F282-F297 HydrophobicContact CZ-CD2 4.22Å; F282-F297 HydrophobicContact CZ-CE1 4.14Å; F282-F297 AromaticContact CZ-CG 3.54Å; F282-F297 HydrophobicContact CZ-CG 3.54Å; F282-F297 PolarHBondContact O-N 3.23Å; F282-R326 HydrophobicContact CE2-CG 4.26Å
283	P	86.3	Confident	66.1	Low	66 Å²	66	79.4 Å²	79.4	43%	0.429	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	141.8	-176.6	32.2	-36.5	0	0	0	112.8	G295 A327	P283-G295 WeakPolarHBondContact CA-O 3.34Å; P283-A327 HydrophobicContact CB-CB 4.11Å; P283-A327 HydrophobicContact CG-CB 4.49Å; P283-A327 PolarHBondContact O-N 3.11Å; P283-A327 VanDerWaalsContact O-N 3.1Å
284	V	90.5	Very high	68.6	Low	2 Å²	2	76 Å²	76	1%	0.012	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	160.9	-176.3	-68.6	0	0	0	0	111.8	F282 G295 F297 V308 V324 E325	F282-V284 HydrophobicContact CD2-CG1 3.78Å; F282-V284 HydrophobicContact CE2-CG1 3.52Å; V284-G295 PolarHBondContact N-O 3.03Å; V284-G295 PolarHBondContact O-N 3.04Å; V284-F297 HydrophobicContact CG1-CB 4.02Å; V284-F297 HydrophobicContact CG2-CB 4.49Å; V284-V308 HydrophobicContact CG2-CG1 3.68Å; V284-V324 HydrophobicContact CB-CG1 3.87Å; V284-V324 HydrophobicContact CG1-CG1 4Å; V284-V324 HydrophobicContact CG2-CG1 4.12Å; V284-E325 CarbonylContact C-O 3.51Å; V284-E325 VanDerWaalsContact CA-O 3.32Å; V284-E325 WeakPolarHBondContact CA-O 3.29Å; V284-E325 WeakPolarHBondContact CB-O 3.46Å
285	W	89.8	Confident	71.4	Confident	22 Å²	22	70.4 Å²	70.4	8%	0.083	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.7	163.7	-58.4	120.6	0	0	0	109.2	Y292 V293 V324 E325 A327 S347 S348 H351	W285-Y292 AromaticContact CD2-CD2 3.91Å; W285-Y292 HydrophobicContact CD2-CD2 3.91Å; W285-Y292 HydrophobicContact CD2-CE2 4.15Å; W285-Y292 AromaticContact CE3-CD2 3.52Å; W285-Y292 HydrophobicContact CE3-CD2 3.52Å; W285-Y292 AromaticContact CE3-CE2 3.73Å; W285-Y292 HydrophobicContact CE3-CE2 3.73Å; W285-Y292 HydrophobicContact CG-CD2 4.36Å; W285-Y292 HydrophobicContact CH2-CE2 4.14Å; W285-Y292 AromaticContact CZ3-CD2 3.98Å; W285-Y292 HydrophobicContact CZ3-CD2 3.98Å; W285-Y292 AromaticContact CZ3-CE2 3.72Å; W285-Y292 HydrophobicContact CZ3-CE2 3.72Å; W285-V293 WeakPolarHBondContact CA-O 3.39Å; W285-V324 WeakPolarHBondContact O-CA 3.08Å; W285-E325 HydrophobicContact CB-CB 4.38Å; W285-E325 PolarHBondContact N-O 2.91Å; W285-E325 PolarHBondContact O-N 3.15Å; W285-A327 HydrophobicContact CD2-CB 4.24Å; W285-A327 HydrophobicContact CG-CB 4.35Å; W285-A327 HydrophobicContact CZ2-CB 4.42Å; W285-S347 VanDerWaalsContact CD1-CB 3.45Å; W285-S347 VanDerWaalsContact CG-CB 3.45Å; W285-S348 PolarHBondContact NE1-OG 3.22Å; W285-H351 HydrophobicContact CH2-CB 4.44Å; W285-H351 AromaticContact CH2-CD2 3.84Å; W285-H351 AromaticContact CH2-CE1 3.7Å; W285-H351 AromaticContact CH2-CG 3.75Å; W285-H351 AromaticContact CH2-ND1 3.66Å; W285-H351 AromaticContact CH2-NE2 3.82Å; W285-H351 HydrophobicContact CZ2-CB 4.07Å; W285-H351 AromaticContact CZ2-CD2 3.88Å; W285-H351 AromaticContact CZ2-CG 3.78Å
286	I	88.7	Confident	74	Confident	11 Å²	11	69.2 Å²	69.2	6%	0.056	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.5	174.2	-52.9	171	0	0	0	106.5	Y292 V293 V308 I310 I317 V319	I286-Y292 CarbonylContact O-C 3.51Å; I286-Y292 VanDerWaalsContact O-CA 3.23Å; I286-Y292 WeakPolarHBondContact O-CA 3.15Å; I286-V293 PolarHBondContact N-O 3.49Å; I286-V293 PolarHBondContact O-N 3.28Å; I286-V308 HydrophobicContact CD1-CB 3.83Å; I286-V308 HydrophobicContact CD1-CG1 4.4Å; I286-V308 HydrophobicContact CD1-CG2 3.91Å; I286-V308 HydrophobicContact CG1-CB 4.4Å; I286-V308 HydrophobicContact CG1-CG1 4.5Å; I286-V308 HydrophobicContact CG1-CG2 4.35Å; I286-I310 HydrophobicContact CD1-CG1 4.39Å; I286-I317 HydrophobicContact CD1-CD1 4.34Å; I286-I317 HydrophobicContact CG2-CD1 4.46Å; I286-V319 HydrophobicContact CG2-CG1 4.24Å; I286-V319 HydrophobicContact CG2-CG2 4.23Å
287	T	85.6	Confident	76.4	Confident	18 Å²	18	67.8 Å²	67.8	11%	0.11	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	150	-175.9	75.3	0	0	0	0	112	D323 E325 S347	T287-D323 WeakPolarHBondContact CB-O 3.4Å; T287-D323 PolarHBondContact N-O 2.66Å; T287-D323 PolarHBondContact OG1-O 3.32Å; T287-E325 HydrophobicContact CG2-CG 4.26Å; T287-S347 VanDerWaalsContact CG2-OG 3.24Å; T287-S347 WeakPolarHBondContact CG2-OG 2.94Å
288	F	82.2	Confident	78.6	Confident	81 Å²	81	65.5 Å²	65.5	36%	0.355	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	175.3	178.4	49.6	-83.9	0	0	0	110.6	Q290 G291 V293 R1151	F288-Q290 HydrophobicContact CD2-CB 3.84Å; F288-Q290 HydrophobicContact CE2-CB 3.78Å; F288-Q290 PolarHBondContact O-N 3.04Å; F288-G291 PolarHBondContact N-O 3.41Å; F288-G291 PolarHBondContact O-N 3.39Å; F288-V293 HydrophobicContact CE1-CB 4.01Å; F288-V293 HydrophobicContact CE1-CG2 3.67Å; F288-V293 HydrophobicContact CZ-CG2 3.7Å; F288-R1151 PolarHBondContact O-NH1 2.91Å; F288-R1151 VanDerWaalsContact O-NH1 3.1Å
289	K	69.7	Low	80.4	Confident	195 Å²	195	58.4 Å²	58.4	85%	0.848	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-13.7	-174.3	-71.3	-177.5	179.3	173.5	0	115.5	N1148	K289-N1148 PolarHBondContact O-ND2 3.27Å
290	Q	64.8	Low	81.9	Confident	162 Å²	162	57 Å²	57	76%	0.757	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-10	-178.6	-67.1	148.5	-28.6	0	0	112.8	F288	F288-Q290 HydrophobicContact CD2-CB 3.84Å; F288-Q290 HydrophobicContact CE2-CB 3.78Å; F288-Q290 PolarHBondContact O-N 3.04Å
291	G	75.4	Confident	83	Confident	4 Å²	4	54 Å²	54	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.2	-144.2	-175.7	0	0	0	0	0	113.1	F288 R1151	F288-G291 PolarHBondContact N-O 3.41Å; F288-G291 PolarHBondContact O-N 3.39Å; G291-R1151 PolarHBondContact O-NH1 3.48Å
292	Y	85.7	Confident	83	Confident	31 Å²	31	54.7 Å²	54.7	12%	0.122	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154.3	173.8	66.5	-83.2	0	0	0	108.8	W285 I286 T350 H351 I354 V1147	W285-Y292 AromaticContact CD2-CD2 3.91Å; W285-Y292 HydrophobicContact CD2-CD2 3.91Å; W285-Y292 HydrophobicContact CD2-CE2 4.15Å; W285-Y292 AromaticContact CE3-CD2 3.52Å; W285-Y292 HydrophobicContact CE3-CD2 3.52Å; W285-Y292 AromaticContact CE3-CE2 3.73Å; W285-Y292 HydrophobicContact CE3-CE2 3.73Å; W285-Y292 HydrophobicContact CG-CD2 4.36Å; W285-Y292 HydrophobicContact CH2-CE2 4.14Å; W285-Y292 AromaticContact CZ3-CD2 3.98Å; W285-Y292 HydrophobicContact CZ3-CD2 3.98Å; W285-Y292 AromaticContact CZ3-CE2 3.72Å; W285-Y292 HydrophobicContact CZ3-CE2 3.72Å; I286-Y292 CarbonylContact O-C 3.51Å; I286-Y292 VanDerWaalsContact O-CA 3.23Å; I286-Y292 WeakPolarHBondContact O-CA 3.15Å; Y292-T350 HydrophobicContact CE1-CG2 3.91Å; Y292-H351 HydrophobicContact CE2-CB 4.26Å; Y292-H351 AromaticContact CE2-ND1 3.77Å; Y292-H351 AromaticContact CZ-ND1 3.78Å; Y292-H351 VanDerWaalsContact OH-CA 3.28Å; Y292-H351 WeakPolarHBondContact OH-CA 3.44Å; Y292-H351 WeakPolarHBondContact OH-CB 3.46Å; Y292-H351 PolarHBondContact OH-ND1 3.5Å; Y292-I354 HydrophobicContact CE1-CD1 4.28Å; Y292-V1147 HydrophobicContact CD1-CG1 3.97Å; Y292-V1147 HydrophobicContact CE1-CG1 3.84Å
293	V	83.9	Confident	82.7	Confident	54 Å²	54	60.4 Å²	60.4	33%	0.327	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	151.5	178.2	166.4	0	0	0	0	109.6	W285 I286 F288 I310	W285-V293 WeakPolarHBondContact CA-O 3.39Å; I286-V293 PolarHBondContact N-O 3.49Å; I286-V293 PolarHBondContact O-N 3.28Å; F288-V293 HydrophobicContact CE1-CB 4.01Å; F288-V293 HydrophobicContact CE1-CG2 3.67Å; F288-V293 HydrophobicContact CZ-CG2 3.7Å; V293-I310 HydrophobicContact CG1-CG2 3.54Å
294	S	84.8	Confident	82.3	Confident	42 Å²	42	59.3 Å²	59.3	29%	0.294	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	146.2	177.1	-163.9	0	0	0	0	111.8	L311	S294-L311 PolarHBondContact O-N 3.37Å
295	G	87.4	Confident	82	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	-178.9	175	0	0	0	0	0	113.9	P283 V284 I309	P283-G295 WeakPolarHBondContact CA-O 3.34Å; V284-G295 PolarHBondContact N-O 3.03Å; V284-G295 PolarHBondContact O-N 3.04Å; G295-I309 CarbonylContact C-O 3.06Å; G295-I309 WeakPolarHBondContact CA-O 3.48Å
296	K	87.7	Confident	81.9	Confident	65 Å²	65	62.8 Å²	62.8	28%	0.283	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	131.6	174.7	-87.2	163.8	162.8	-89.9	0	110	D281 F282 V308 I309 L311	D281-K296 WeakPolarHBondContact OD1-CB 3.46Å; D281-K296 WeakPolarHBondContact OD1-CD 3.37Å; D281-K296 WeakPolarHBondContact OD1-CE 3.36Å; D281-K296 WeakPolarHBondContact OD1-CG 3.45Å; D281-K296 IonicContact OD1-NZ 3.06Å; D281-K296 PolarHBondContact OD1-NZ 2.89Å; D281-K296 IonicContact OD2-NZ 3.63Å; D281-K296 PolarHBondContact OD2-NZ 3.39Å; F282-K296 WeakPolarHBondContact O-CA 3.48Å; K296-V308 CarbonylContact O-C 3.48Å; K296-V308 WeakPolarHBondContact O-CA 3.39Å; K296-I309 HydrophobicContact CB-CB 4.35Å; K296-I309 PolarHBondContact N-O 2.97Å; K296-I309 PolarHBondContact O-N 2.98Å; K296-L311 HydrophobicContact CD-CD1 4Å; K296-L311 HydrophobicContact CD-CD2 4.12Å; K296-L311 HydrophobicContact CD-CG 4.26Å; K296-L311 HydrophobicContact CG-CD1 3.95Å; K296-L311 HydrophobicContact CG-CG 4.36Å
297	F	89.1	Confident	81.8	Confident	30 Å²	30	67.8 Å²	67.8	13%	0.132	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	123.1	179.9	-175.2	-94.9	0	0	0	111.5	D281 F282 V284 G299 C306 V308	D281-F297 WeakPolarHBondContact CA-O 3.29Å; D281-F297 PolarHBondContact N-O 3.27Å; F282-F297 HydrophobicContact CD1-CB 4.33Å; F282-F297 HydrophobicContact CD1-CD1 4.32Å; F282-F297 HydrophobicContact CD2-CB 4.08Å; F282-F297 HydrophobicContact CE1-CB 4.01Å; F282-F297 AromaticContact CE1-CD1 3.46Å; F282-F297 HydrophobicContact CE1-CD1 3.46Å; F282-F297 VanDerWaalsContact CE1-CD1 3.46Å; F282-F297 HydrophobicContact CE1-CE1 4.14Å; F282-F297 AromaticContact CE1-CG 3.92Å; F282-F297 HydrophobicContact CE1-CG 3.92Å; F282-F297 HydrophobicContact CE2-CB 3.73Å; F282-F297 HydrophobicContact CE2-CD1 4.41Å; F282-F297 HydrophobicContact CE2-CG 4.04Å; F282-F297 HydrophobicContact CG-CB 4.36Å; F282-F297 HydrophobicContact CZ-CB 3.69Å; F282-F297 AromaticContact CZ-CD1 3.5Å; F282-F297 HydrophobicContact CZ-CD1 3.5Å; F282-F297 HydrophobicContact CZ-CD2 4.22Å; F282-F297 HydrophobicContact CZ-CE1 4.14Å; F282-F297 AromaticContact CZ-CG 3.54Å; F282-F297 HydrophobicContact CZ-CG 3.54Å; F282-F297 PolarHBondContact O-N 3.23Å; V284-F297 HydrophobicContact CG1-CB 4.02Å; V284-F297 HydrophobicContact CG2-CB 4.49Å; F297-G299 VanDerWaalsContact CE1-CA 3.48Å; F297-C306 HydrophobicContact CD2-CB 4.48Å; F297-C306 HydrophobicContact CE2-CB 3.64Å; F297-C306 HydrophobicContact CZ-CB 4.3Å; F297-V308 HydrophobicContact CD2-CG1 4.31Å
298	L	85.6	Confident	82	Confident	66 Å²	66	66.9 Å²	66.9	35%	0.346	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-30.9	178.9	-68.7	-175.4	0	0	0	113.8	T280 R307 I309 V316	T280-L298 WeakPolarHBondContact CG2-O 3.43Å; L298-R307 HydrophobicContact CB-CB 4.04Å; L298-R307 WeakPolarHBondContact CB-O 3.43Å; L298-R307 HydrophobicContact CD1-CB 4.5Å; L298-R307 PolarHBondContact N-O 2.84Å; L298-I309 HydrophobicContact CD1-CD1 4.05Å; L298-I309 HydrophobicContact CD1-CG1 3.75Å; L298-I309 HydrophobicContact CD2-CD1 3.82Å; L298-I309 HydrophobicContact CD2-CG1 4.19Å; L298-I309 HydrophobicContact CG-CD1 4.17Å; L298-I309 HydrophobicContact CG-CG1 3.98Å; L298-V316 HydrophobicContact CD1-CG1 4.02Å; L298-V316 HydrophobicContact CD1-CG2 4.06Å
299	G	83.1	Confident	82.3	Confident	20 Å²	20	64.7 Å²	64.7	21%	0.206	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.1	157.5	-179.6	0	0	0	0	0	114.2	F297 C306 R307	F297-G299 VanDerWaalsContact CE1-CA 3.48Å; G299-C306 CarbonylContact O-C 3.59Å; G299-C306 WeakPolarHBondContact O-CA 3.48Å; G299-R307 PolarHBondContact O-N 3.26Å
300	S	83.1	Confident	83	Confident	101 Å²	101	57.4 Å²	57.4	71%	0.706	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	150.4	175.1	-55.5	0	0	0	0	112.1
301	L	83.3	Confident	83.7	Confident	40 Å²	40	52 Å²	52	21%	0.209	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	161.9	171.7	-66	173	0	0	0	109.8	R305 R307 E318	L301-R305 WeakPolarHBondContact CA-O 3.27Å; L301-R305 HydrophobicContact CB-CB 4.25Å; L301-R305 WeakPolarHBondContact CB-O 3.39Å; L301-R305 HydrophobicContact CD1-CB 4.39Å; L301-R305 PolarHBondContact N-O 2.9Å; L301-R307 HydrophobicContact CD1-CG 3.95Å; L301-R307 HydrophobicContact CD2-CG 4.47Å; L301-R307 HydrophobicContact CG-CG 4.29Å; L301-E318 HydrophobicContact CD1-CB 4.25Å; L301-E318 HydrophobicContact CD1-CG 3.81Å; L301-E318 WeakPolarHBondContact CD1-OE1 3.33Å
302	P	73.5	Confident	83.1	Confident	100 Å²	100	53.2 Å²	53.2	65%	0.649	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	154	167.2	-24.4	35	0	0	0	112.7
303	N	76.9	Confident	82.3	Confident	158 Å²	158	54.4 Å²	54.4	85%	0.845	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	39.2	175.4	-47.3	-8.1	0	0	0	114.8	R305	N303-R305 VanDerWaalsContact C-N 3.32Å; N303-R305 PolarHBondContact O-N 3.33Å
304	G	77.8	Confident	82.1	Confident	44 Å²	44	58.7 Å²	58.7	45%	0.454	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	29.5	172.5	0	0	0	0	0	114.2	N320 S321	G304-N320 CarbonylContact O-C 3.57Å; G304-N320 WeakPolarHBondContact O-CA 3.27Å; G304-S321 PolarHBondContact O-N 2.98Å; G304-S321 PolarHBondContact O-OG 2.6Å
305	R	84.3	Confident	82	Confident	94 Å²	94	62.5 Å²	62.5	36%	0.355	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	165.7	175.5	-59.4	-169.2	-56.1	124.9	11.8	110.5	L301 N303 E318 V319	L301-R305 WeakPolarHBondContact CA-O 3.27Å; L301-R305 HydrophobicContact CB-CB 4.25Å; L301-R305 WeakPolarHBondContact CB-O 3.39Å; L301-R305 HydrophobicContact CD1-CB 4.39Å; L301-R305 PolarHBondContact N-O 2.9Å; N303-R305 VanDerWaalsContact C-N 3.32Å; N303-R305 PolarHBondContact O-N 3.33Å; R305-E318 IonicContact CZ-OE2 2.67Å; R305-E318 VanDerWaalsContact CZ-OE2 3.25Å; R305-E318 IonicContact NH1-OE2 3.25Å; R305-E318 PolarHBondContact NH1-OE2 3.11Å; R305-E318 IonicContact NH2-OE2 2.67Å; R305-E318 PolarHBondContact NH2-OE2 3.08Å; R305-V319 CarbonylContact C-O 3.08Å; R305-V319 VanDerWaalsContact CA-O 3.22Å; R305-V319 WeakPolarHBondContact CA-O 3.32Å
306	C	87.2	Confident	82	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.014	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	160.9	179.5	61.8	0	0	0	0	110.9	F297 G299 E318 V319	F297-C306 HydrophobicContact CD2-CB 4.48Å; F297-C306 HydrophobicContact CE2-CB 3.64Å; F297-C306 HydrophobicContact CZ-CB 4.3Å; G299-C306 CarbonylContact O-C 3.59Å; G299-C306 WeakPolarHBondContact O-CA 3.48Å; C306-E318 WeakPolarHBondContact O-CA 3.35Å; C306-V319 PolarHBondContact N-O 3.37Å; C306-V319 PolarHBondContact O-N 3.42Å; C306-V319 PolarHBondContact SG-O 3.28Å
307	R	87.8	Confident	82	Confident	116 Å²	116	65.5 Å²	65.5	44%	0.438	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.2	171.7	-76.4	179	-179.3	172	1.4	110.3	L298 G299 L301 V316 I317 E318	L298-R307 HydrophobicContact CB-CB 4.04Å; L298-R307 WeakPolarHBondContact CB-O 3.43Å; L298-R307 HydrophobicContact CD1-CB 4.5Å; L298-R307 PolarHBondContact N-O 2.84Å; G299-R307 PolarHBondContact O-N 3.26Å; L301-R307 HydrophobicContact CD1-CG 3.95Å; L301-R307 HydrophobicContact CD2-CG 4.47Å; L301-R307 HydrophobicContact CG-CG 4.29Å; R307-V316 HydrophobicContact CB-CG1 4.48Å; R307-I317 WeakPolarHBondContact CA-O 3.38Å; R307-E318 HydrophobicContact CG-CG 4Å; R307-E318 IonicContact CZ-OE1 2.65Å; R307-E318 VanDerWaalsContact CZ-OE1 3.22Å; R307-E318 IonicContact NE-OE1 2.78Å; R307-E318 PolarHBondContact NE-OE1 3.24Å; R307-E318 IonicContact NH2-OE1 3.19Å; R307-E318 PolarHBondContact NH2-OE1 3.37Å
308	V	88.8	Confident	82	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.5	-179.1	-98.6	0	0	0	0	109.4	V284 I286 K296 F297 I317 V319 V324	V284-V308 HydrophobicContact CG2-CG1 3.68Å; I286-V308 HydrophobicContact CD1-CB 3.83Å; I286-V308 HydrophobicContact CD1-CG1 4.4Å; I286-V308 HydrophobicContact CD1-CG2 3.91Å; I286-V308 HydrophobicContact CG1-CB 4.4Å; I286-V308 HydrophobicContact CG1-CG1 4.5Å; I286-V308 HydrophobicContact CG1-CG2 4.35Å; K296-V308 CarbonylContact O-C 3.48Å; K296-V308 WeakPolarHBondContact O-CA 3.39Å; F297-V308 HydrophobicContact CD2-CG1 4.31Å; V308-I317 HydrophobicContact CG2-CG1 4.15Å; V308-I317 PolarHBondContact N-O 3.4Å; V308-I317 VanDerWaalsContact N-O 3.09Å; V308-I317 PolarHBondContact O-N 3.06Å; V308-V319 HydrophobicContact CG2-CB 4.01Å; V308-V319 HydrophobicContact CG2-CG2 3.61Å; V308-V324 HydrophobicContact CG1-CG1 4.49Å
309	I	88.6	Confident	82.1	Confident	35 Å²	35	65.6 Å²	65.6	18%	0.179	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	124.1	167.7	-69.7	175.2	0	0	0	108	G295 K296 L298 L311 Q314 E315 V316	G295-I309 CarbonylContact C-O 3.06Å; G295-I309 WeakPolarHBondContact CA-O 3.48Å; K296-I309 HydrophobicContact CB-CB 4.35Å; K296-I309 PolarHBondContact N-O 2.97Å; K296-I309 PolarHBondContact O-N 2.98Å; L298-I309 HydrophobicContact CD1-CD1 4.05Å; L298-I309 HydrophobicContact CD1-CG1 3.75Å; L298-I309 HydrophobicContact CD2-CD1 3.82Å; L298-I309 HydrophobicContact CD2-CG1 4.19Å; L298-I309 HydrophobicContact CG-CD1 4.17Å; L298-I309 HydrophobicContact CG-CG1 3.98Å; I309-L311 PolarHBondContact O-N 3.35Å; I309-Q314 HydrophobicContact CG2-CB 4.43Å; I309-Q314 HydrophobicContact CG2-CG 4.49Å; I309-E315 CarbonylContact C-O 3.36Å; I309-E315 WeakPolarHBondContact CA-O 3.36Å; I309-V316 HydrophobicContact CG1-CG2 3.89Å
310	I	85.1	Confident	82.3	Confident	41 Å²	41	68.7 Å²	68.7	21%	0.21	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	119.7	167.1	-46.5	-179.8	0	0	0	108.2	I286 V293 G313 Q314 E315 I317	I286-I310 HydrophobicContact CD1-CG1 4.39Å; V293-I310 HydrophobicContact CG1-CG2 3.54Å; I310-G313 PolarHBondContact O-N 3.44Å; I310-Q314 PolarHBondContact O-N 3.34Å; I310-E315 HydrophobicContact CD1-CB 4.29Å; I310-E315 HydrophobicContact CG1-CB 4.47Å; I310-E315 PolarHBondContact N-O 2.6Å; I310-I317 HydrophobicContact CD1-CD1 3.8Å; I310-I317 HydrophobicContact CD1-CG1 4.2Å; I310-I317 HydrophobicContact CD1-CG2 3.98Å; I310-I317 HydrophobicContact CG1-CD1 3.77Å; I310-I317 HydrophobicContact CG1-CG1 3.87Å; I310-I317 HydrophobicContact CG1-CG2 4.34Å
311	L	78.3	Confident	82.4	Confident	49 Å²	49	67.1 Å²	67.1	26%	0.257	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	138.4	-177.5	-89.7	-177.9	0	0	0	112.5	S294 K296 I309	S294-L311 PolarHBondContact O-N 3.37Å; K296-L311 HydrophobicContact CD-CD1 4Å; K296-L311 HydrophobicContact CD-CD2 4.12Å; K296-L311 HydrophobicContact CD-CG 4.26Å; K296-L311 HydrophobicContact CG-CD1 3.95Å; K296-L311 HydrophobicContact CG-CG 4.36Å; I309-L311 PolarHBondContact O-N 3.35Å
312	P	63	Low	82.4	Confident	30 Å²	30	73 Å²	73	20%	0.195	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	cis	-98.8	27.7	-22.4	46.8	-44.1	0	0	0	111.3	H72 V73 Q314	H72-P312 HydrophobicContact CB-CB 3.89Å; H72-P312 HydrophobicContact CB-CG 3.6Å; H72-P312 WeakPolarHBondContact O-CD 3.42Å; V73-P312 HydrophobicContact CB-CG 4.11Å; V73-P312 HydrophobicContact CG2-CG 3.48Å; V73-P312 VanDerWaalsContact CG2-CG 3.48Å; P312-Q314 PolarHBondContact O-N 2.98Å; P312-Q314 VanDerWaalsContact O-N 3.1Å
313	G	69.8	Low	83	Confident	56 Å²	56	70.9 Å²	70.9	58%	0.577	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-20.2	165.3	0	0	0	0	0	111.3	I310 E315	I310-G313 PolarHBondContact O-N 3.44Å; G313-E315 PolarHBondContact O-N 2.97Å
314	Q	78.8	Confident	83.6	Confident	143 Å²	143	64.6 Å²	64.6	67%	0.668	35%	0.347	S	S	*	.			trans	60.3	12.3	179.8	-66	-170.7	11.7	0	0	113.6	I309 I310 P312 V316	I309-Q314 HydrophobicContact CG2-CB 4.43Å; I309-Q314 HydrophobicContact CG2-CG 4.49Å; I310-Q314 PolarHBondContact O-N 3.34Å; P312-Q314 PolarHBondContact O-N 2.98Å; P312-Q314 VanDerWaalsContact O-N 3.1Å; Q314-V316 PolarHBondContact O-N 2.62Å
315	E	83.5	Confident	84.2	Confident	123 Å²	123	64.2 Å²	64.2	58%	0.575	33%	0.333	S	S	*	.			trans	-66.5	123.1	173.2	-169	178.3	-174.6	0	0	110.1	I309 I310 G313 I317	I309-E315 CarbonylContact C-O 3.36Å; I309-E315 WeakPolarHBondContact CA-O 3.36Å; I310-E315 HydrophobicContact CD1-CB 4.29Å; I310-E315 HydrophobicContact CG1-CB 4.47Å; I310-E315 PolarHBondContact N-O 2.6Å; G313-E315 PolarHBondContact O-N 2.97Å; E315-I317 HydrophobicContact CG-CG2 4.01Å
316	V	86.9	Confident	84.4	Confident	82 Å²	82	61.1 Å²	61.1	50%	0.497	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	115.5	173.8	178.6	0	0	0	0	108.4	L298 R307 I309 Q314	L298-V316 HydrophobicContact CD1-CG1 4.02Å; L298-V316 HydrophobicContact CD1-CG2 4.06Å; R307-V316 HydrophobicContact CB-CG1 4.48Å; I309-V316 HydrophobicContact CG1-CG2 3.89Å; Q314-V316 PolarHBondContact O-N 2.62Å
317	I	88.1	Confident	84.4	Confident	45 Å²	45	61.4 Å²	61.4	23%	0.231	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	153.2	176.3	59.4	165.2	0	0	0	111.8	I286 R307 V308 I310 E315 V319	I286-I317 HydrophobicContact CD1-CD1 4.34Å; I286-I317 HydrophobicContact CG2-CD1 4.46Å; R307-I317 WeakPolarHBondContact CA-O 3.38Å; V308-I317 HydrophobicContact CG2-CG1 4.15Å; V308-I317 PolarHBondContact N-O 3.4Å; V308-I317 VanDerWaalsContact N-O 3.09Å; V308-I317 PolarHBondContact O-N 3.06Å; I310-I317 HydrophobicContact CD1-CD1 3.8Å; I310-I317 HydrophobicContact CD1-CG1 4.2Å; I310-I317 HydrophobicContact CD1-CG2 3.98Å; I310-I317 HydrophobicContact CG1-CD1 3.77Å; I310-I317 HydrophobicContact CG1-CG1 3.87Å; I310-I317 HydrophobicContact CG1-CG2 4.34Å; E315-I317 HydrophobicContact CG-CG2 4.01Å; I317-V319 HydrophobicContact CB-CG2 4.4Å; I317-V319 HydrophobicContact CD1-CG2 3.41Å; I317-V319 VanDerWaalsContact CD1-CG2 3.41Å; I317-V319 HydrophobicContact CG1-CG2 3.69Å
318	E	89.4	Confident	84.4	Confident	80 Å²	80	56.7 Å²	56.7	37%	0.374	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.6	170.6	-60.7	-164.3	163.7	0	0	109.8	L301 R305 C306 R307	L301-E318 HydrophobicContact CD1-CB 4.25Å; L301-E318 HydrophobicContact CD1-CG 3.81Å; L301-E318 WeakPolarHBondContact CD1-OE1 3.33Å; R305-E318 IonicContact CZ-OE2 2.67Å; R305-E318 VanDerWaalsContact CZ-OE2 3.25Å; R305-E318 IonicContact NH1-OE2 3.25Å; R305-E318 PolarHBondContact NH1-OE2 3.11Å; R305-E318 IonicContact NH2-OE2 2.67Å; R305-E318 PolarHBondContact NH2-OE2 3.08Å; C306-E318 WeakPolarHBondContact O-CA 3.35Å; R307-E318 HydrophobicContact CG-CG 4Å; R307-E318 IonicContact CZ-OE1 2.65Å; R307-E318 VanDerWaalsContact CZ-OE1 3.22Å; R307-E318 IonicContact NE-OE1 2.78Å; R307-E318 PolarHBondContact NE-OE1 3.24Å; R307-E318 IonicContact NH2-OE1 3.19Å; R307-E318 PolarHBondContact NH2-OE1 3.37Å
319	V	86.4	Confident	84.1	Confident	19 Å²	19	58.9 Å²	58.9	12%	0.115	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	153.4	-172.5	-173.9	0	0	0	0	109.8	I286 R305 C306 V308 I317 D323 V324	I286-V319 HydrophobicContact CG2-CG1 4.24Å; I286-V319 HydrophobicContact CG2-CG2 4.23Å; R305-V319 CarbonylContact C-O 3.08Å; R305-V319 VanDerWaalsContact CA-O 3.22Å; R305-V319 WeakPolarHBondContact CA-O 3.32Å; C306-V319 PolarHBondContact N-O 3.37Å; C306-V319 PolarHBondContact O-N 3.42Å; C306-V319 PolarHBondContact SG-O 3.28Å; V308-V319 HydrophobicContact CG2-CB 4.01Å; V308-V319 HydrophobicContact CG2-CG2 3.61Å; I317-V319 HydrophobicContact CB-CG2 4.4Å; I317-V319 HydrophobicContact CD1-CG2 3.41Å; I317-V319 VanDerWaalsContact CD1-CG2 3.41Å; I317-V319 HydrophobicContact CG1-CG2 3.69Å; V319-D323 HydrophobicContact CG1-CB 3.74Å; V319-V324 HydrophobicContact CB-CG2 4.23Å; V319-V324 HydrophobicContact CG1-CG2 3.91Å
320	N	87.8	Confident	83.4	Confident	84 Å²	84	62.1 Å²	62.1	45%	0.449	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	147	173.1	-44.4	-58.1	0	0	0	110.2	G304 E322 D323	G304-N320 CarbonylContact O-C 3.57Å; G304-N320 WeakPolarHBondContact O-CA 3.27Å; N320-E322 PolarHBondContact O-N 2.87Å; N320-D323 WeakPolarHBondContact CB-OD2 3.4Å; N320-D323 PolarHBondContact ND2-OD2 3.29Å; N320-D323 PolarHBondContact O-N 3.4Å
321	S	84.4	Confident	83	Confident	69 Å²	69	70 Å²	70	48%	0.483	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-65.3	-22	178	50.1	0	0	0	0	113.5	G304	G304-S321 PolarHBondContact O-N 2.98Å; G304-S321 PolarHBondContact O-OG 2.6Å
322	E	83.7	Confident	83.1	Confident	164 Å²	164	69.2 Å²	69.2	77%	0.766	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-70.7	-29.7	175.3	-64.6	-179.5	-169.8	0	0	113.4	N320 V324	N320-E322 PolarHBondContact O-N 2.87Å; E322-V324 VanDerWaalsContact C-N 3.3Å; E322-V324 PolarHBondContact O-N 3.02Å
323	D	87.1	Confident	83.6	Confident	54 Å²	54	70.1 Å²	70.1	29%	0.289	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-83.6	-5.2	-177.3	-65.4	-62.6	0	0	0	112.5	T287 V319 N320	T287-D323 WeakPolarHBondContact CB-O 3.4Å; T287-D323 PolarHBondContact N-O 2.66Å; T287-D323 PolarHBondContact OG1-O 3.32Å; V319-D323 HydrophobicContact CG1-CB 3.74Å; N320-D323 WeakPolarHBondContact CB-OD2 3.4Å; N320-D323 PolarHBondContact ND2-OD2 3.29Å; N320-D323 PolarHBondContact O-N 3.4Å
324	V	88.8	Confident	84	Confident	26 Å²	26	70 Å²	70	16%	0.158	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.7	-172.4	179.8	0	0	0	0	111.8	V284 W285 V308 V319 E322	V284-V324 HydrophobicContact CB-CG1 3.87Å; V284-V324 HydrophobicContact CG1-CG1 4Å; V284-V324 HydrophobicContact CG2-CG1 4.12Å; W285-V324 WeakPolarHBondContact O-CA 3.08Å; V308-V324 HydrophobicContact CG1-CG1 4.49Å; V319-V324 HydrophobicContact CB-CG2 4.23Å; V319-V324 HydrophobicContact CG1-CG2 3.91Å; E322-V324 VanDerWaalsContact C-N 3.3Å; E322-V324 PolarHBondContact O-N 3.02Å
325	E	89.6	Confident	84.3	Confident	36 Å²	36	64 Å²	64	17%	0.168	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	151.1	177	-58.7	-176.9	133.4	0	0	111	V284 W285 T287 N345 E346 S347	V284-E325 CarbonylContact C-O 3.51Å; V284-E325 VanDerWaalsContact CA-O 3.32Å; V284-E325 WeakPolarHBondContact CA-O 3.29Å; V284-E325 WeakPolarHBondContact CB-O 3.46Å; W285-E325 HydrophobicContact CB-CB 4.38Å; W285-E325 PolarHBondContact N-O 2.91Å; W285-E325 PolarHBondContact O-N 3.15Å; T287-E325 HydrophobicContact CG2-CG 4.26Å; E325-N345 HydrophobicContact CB-CB 4.3Å; E325-N345 HydrophobicContact CG-CB 4.35Å; E325-N345 WeakPolarHBondContact OE1-CB 3.43Å; E325-E346 PolarHBondContact OE1-N 3.3Å; E325-E346 VanDerWaalsContact OE1-N 3.08Å; E325-S347 WeakPolarHBondContact OE2-CA 3.06Å; E325-S347 WeakPolarHBondContact OE2-CB 3.47Å; E325-S347 PolarHBondContact OE2-N 3.27Å; E325-S347 PolarHBondContact OE2-OG 3.21Å
326	R	89.1	Confident	84.3	Confident	30 Å²	30	59.2 Å²	59.2	11%	0.113	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	136.1	173.4	-73	-169.5	179.5	-157.6	15.7	112.2	Y273 D276 F282 Y343 N345	Y273-R326 HydrophobicContact CE1-CG 4.26Å; D276-R326 IonicContact OD2-CZ 2.72Å; D276-R326 IonicContact OD2-NH1 3.87Å; D276-R326 PolarHBondContact OD2-NH1 3.15Å; D276-R326 IonicContact OD2-NH2 3.26Å; D276-R326 PolarHBondContact OD2-NH2 3.24Å; F282-R326 HydrophobicContact CE2-CG 4.26Å; R326-Y343 HydrophobicContact CB-CD1 4.31Å; R326-Y343 HydrophobicContact CB-CD2 3.86Å; R326-Y343 HydrophobicContact CB-CE2 4.17Å; R326-Y343 HydrophobicContact CB-CG 3.94Å; R326-Y343 PolarHBondContact NH1-OH 2.94Å; R326-Y343 VanDerWaalsContact NH1-OH 3.08Å; R326-N345 PolarHBondContact O-ND2 3.47Å
327	A	87.1	Confident	84.4	Confident	8 Å²	8	55.4 Å²	55.4	7%	0.066	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-83.2	149.8	174	0	0	0	0	0	111.5	P283 W285 Y343	P283-A327 HydrophobicContact CB-CB 4.11Å; P283-A327 HydrophobicContact CG-CB 4.49Å; P283-A327 PolarHBondContact O-N 3.11Å; P283-A327 VanDerWaalsContact O-N 3.1Å; W285-A327 HydrophobicContact CD2-CB 4.24Å; W285-A327 HydrophobicContact CG-CB 4.35Å; W285-A327 HydrophobicContact CZ2-CB 4.42Å; A327-Y343 WeakPolarHBondContact O-CD2 3.46Å
328	N	88.3	Confident	84.6	Confident	16 Å²	16	53.2 Å²	53.2	9%	0.086	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-83.6	145.3	170.6	-75.5	-86.7	0	0	0	110.2	F332 R342 Y343 S348	N328-F332 HydrophobicContact CB-CB 4.17Å; N328-F332 HydrophobicContact CB-CD2 4.44Å; N328-R342 WeakPolarHBondContact OD1-CA 3.42Å; N328-R342 WeakPolarHBondContact OD1-CB 3.39Å; N328-R342 PolarHBondContact OD1-N 2.91Å; N328-Y343 PolarHBondContact ND2-O 3.44Å; N328-Y343 PolarHBondContact OD1-N 2.65Å; N328-S348 WeakPolarHBondContact ND2-CB 3.41Å; N328-S348 PolarHBondContact ND2-OG 2.91Å
329	P	82	Confident	84.5	Confident	46 Å²	46	49.9 Å²	49.9	30%	0.299	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-61.4	146.6	172.3	-24.8	33.6	0	0	0	112.6	R331 F332	P329-R331 PolarHBondContact O-N 2.72Å; P329-F332 HydrophobicContact CB-CD2 4.31Å; P329-F332 HydrophobicContact CG-CD2 4.39Å; P329-F332 HydrophobicContact CG-CE2 4.39Å; P329-F332 WeakPolarHBondContact O-CD2 3.42Å; P329-F332 PolarHBondContact O-N 3.15Å
330	P	75	Confident	84.4	Confident	104 Å²	104	52 Å²	52	68%	0.675	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-57.6	-14.4	-173.3	-29.3	36.1	0	0	0	117.2	F332 D333	P330-F332 PolarHBondContact O-N 2.81Å; P330-D333 WeakPolarHBondContact CA-OD1 3.5Å; P330-D333 VanDerWaalsContact O-CB 3.23Å; P330-D333 WeakPolarHBondContact O-CB 3.49Å; P330-D333 VanDerWaalsContact O-CG 3.31Å; P330-D333 PolarHBondContact O-N 3.06Å; P330-D333 VanDerWaalsContact O-N 3.15Å
331	R	76	Confident	84.4	Confident	206 Å²	206	48 Å²	48	78%	0.777	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-66.8	-10.2	170.8	76.6	-178.7	-170.7	-171.7	2.7	114	P329	P329-R331 PolarHBondContact O-N 2.72Å
332	F	79.6	Confident	84.4	Confident	32 Å²	32	50.4 Å²	50.4	14%	0.14	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-103.3	7.2	175.7	-64	-76.9	0	0	0	112.4	N328 P329 P330 V335 K340 L341 R342	N328-F332 HydrophobicContact CB-CB 4.17Å; N328-F332 HydrophobicContact CB-CD2 4.44Å; P329-F332 HydrophobicContact CB-CD2 4.31Å; P329-F332 HydrophobicContact CG-CD2 4.39Å; P329-F332 HydrophobicContact CG-CE2 4.39Å; P329-F332 WeakPolarHBondContact O-CD2 3.42Å; P329-F332 PolarHBondContact O-N 3.15Å; P330-F332 PolarHBondContact O-N 2.81Å; F332-V335 HydrophobicContact CB-CG2 4.16Å; F332-V335 HydrophobicContact CD1-CG2 4.33Å; F332-V335 WeakPolarHBondContact O-CB 3.34Å; F332-V335 WeakPolarHBondContact O-CG2 3.26Å; F332-K340 VanDerWaalsContact CE1-O 3.27Å; F332-K340 WeakPolarHBondContact CE1-O 3.44Å; F332-L341 HydrophobicContact CB-CD2 4.04Å; F332-R342 HydrophobicContact CE2-CB 4.35Å; F332-R342 HydrophobicContact CZ-CB 4.42Å
333	D	74.5	Confident	84.6	Confident	49 Å²	49	44.9 Å²	44.9	26%	0.262	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	147.8	173.3	-74	16.3	0	0	0	110.5	P330 V335 Q355	P330-D333 WeakPolarHBondContact CA-OD1 3.5Å; P330-D333 VanDerWaalsContact O-CB 3.23Å; P330-D333 WeakPolarHBondContact O-CB 3.49Å; P330-D333 VanDerWaalsContact O-CG 3.31Å; P330-D333 PolarHBondContact O-N 3.06Å; P330-D333 VanDerWaalsContact O-N 3.15Å; D333-V335 PolarHBondContact O-N 3.25Å; D333-Q355 VanDerWaalsContact CA-OE1 3.23Å; D333-Q355 PolarHBondContact OD2-NE2 2.91Å
334	R	78.3	Confident	84.8	Confident	53 Å²	53	43 Å²	43	20%	0.2	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	17.1	-177.2	-55.3	177.4	-154	-149.3	14.8	116	S78 D336 Q355 R356 S359	S78-R334 PolarHBondContact O-NH2 2.92Å; R334-D336 PolarHBondContact O-N 2.92Å; R334-Q355 HydrophobicContact CG-CB 3.8Å; R334-R356 HydrophobicContact CB-CG 4.08Å; R334-R356 WeakPolarHBondContact O-CD 3.4Å; R334-R356 PolarHBondContact O-NH1 3.26Å; R334-S359 PolarHBondContact NH1-OG 2.79Å
335	V	83.9	Confident	84.8	Confident	17 Å²	17	42.1 Å²	42.1	10%	0.103	20%	0.195	C	C	.	.			trans	-48.4	133.2	-174.9	147.2	0	0	0	0	114.3	F332 D333 D337 K340 L341 R356	F332-V335 HydrophobicContact CB-CG2 4.16Å; F332-V335 HydrophobicContact CD1-CG2 4.33Å; F332-V335 WeakPolarHBondContact O-CB 3.34Å; F332-V335 WeakPolarHBondContact O-CG2 3.26Å; D333-V335 PolarHBondContact O-N 3.25Å; V335-D337 VanDerWaalsContact CG1-C 3.48Å; V335-D337 WeakPolarHBondContact CG1-O 3.42Å; V335-K340 HydrophobicContact CG1-CB 4.12Å; V335-L341 HydrophobicContact CB-CD2 4.4Å; V335-L341 HydrophobicContact CG1-CD2 4.46Å; V335-R356 VanDerWaalsContact O-CD 3.28Å; V335-R356 WeakPolarHBondContact O-CD 3.48Å
336	D	84.5	Confident	84.8	Confident	23 Å²	23	41.1 Å²	41.1	12%	0.123	19%	0.191	C	C	.	.	S	Bend	trans	-69.3	-31.7	-175.5	59.7	-16.1	0	0	0	114.3	K230 R334 K340 Y365 P402	K230-D336 IonicContact NZ-OD2 3.38Å; K230-D336 PolarHBondContact NZ-OD2 2.84Å; R334-D336 PolarHBondContact O-N 2.92Å; D336-K340 WeakPolarHBondContact OD1-CD 3.5Å; D336-K340 IonicContact OD1-NZ 2.71Å; D336-K340 PolarHBondContact OD1-NZ 2.87Å; D336-K340 IonicContact OD2-NZ 3.5Å; D336-K340 PolarHBondContact OD2-NZ 2.85Å; D336-Y365 PolarHBondContact O-N 3.23Å; D336-P402 HydrophobicContact CB-CG 3.98Å; D336-P402 WeakPolarHBondContact O-CG 3.4Å
337	D	89.1	Confident	84.8	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.011	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-132.8	117.3	172.6	-169.5	-28.1	0	0	0	111.6	V335 I339 K340 Y365 A366 S367 G368	V335-D337 VanDerWaalsContact CG1-C 3.48Å; V335-D337 WeakPolarHBondContact CG1-O 3.42Å; D337-I339 HydrophobicContact CB-CG2 4.3Å; D337-I339 PolarHBondContact O-N 3.35Å; D337-I339 VanDerWaalsContact OD1-CG2 3.22Å; D337-I339 WeakPolarHBondContact OD1-CG2 3.37Å; D337-I339 PolarHBondContact OD1-N 2.95Å; D337-I339 VanDerWaalsContact OD1-N 3.1Å; D337-K340 HydrophobicContact CB-CD 4.17Å; D337-K340 HydrophobicContact CB-CG 4.36Å; D337-K340 VanDerWaalsContact O-CB 3.31Å; D337-K340 WeakPolarHBondContact O-CB 3.44Å; D337-K340 WeakPolarHBondContact O-CG 3.5Å; D337-K340 PolarHBondContact O-N 3.42Å; D337-Y365 WeakPolarHBondContact CA-O 3.4Å; D337-Y365 HydrophobicContact CB-CD2 4.48Å; D337-A366 WeakPolarHBondContact OD1-CA 3.12Å; D337-S367 PolarHBondContact OD1-N 3.3Å; D337-S367 WeakPolarHBondContact OD2-CA 3.44Å; D337-S367 PolarHBondContact OD2-N 3.38Å; D337-G368 PolarHBondContact OD2-N 2.79Å; D337-G368 VanDerWaalsContact OD2-N 3.15Å
338	L	91.2	Very high	85	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-54.4	-25.1	-175.8	-64.2	175.6	0	0	0	114.7	K340 L341 V349 F353 T364 Y365 A366 L1159 L1163	L338-K340 PolarHBondContact O-N 3.41Å; L338-L341 HydrophobicContact CD2-CD1 4.25Å; L338-L341 WeakPolarHBondContact O-CB 3.42Å; L338-L341 VanDerWaalsContact O-CG 3.3Å; L338-L341 WeakPolarHBondContact O-CG 3.4Å; L338-L341 PolarHBondContact O-N 3.45Å; L338-V349 HydrophobicContact CD1-CG1 3.78Å; L338-V349 HydrophobicContact CD2-CG1 4.19Å; L338-V349 HydrophobicContact CD2-CG2 4.42Å; L338-F353 HydrophobicContact CD1-CE1 3.83Å; L338-F353 HydrophobicContact CD1-CZ 3.68Å; L338-F353 HydrophobicContact CD2-CE1 4.36Å; L338-F353 HydrophobicContact CG-CE1 4.48Å; L338-T364 HydrophobicContact CD2-CG2 4.28Å; L338-T364 HydrophobicContact CG-CG2 4.12Å; L338-Y365 PolarHBondContact N-O 2.86Å; L338-Y365 VanDerWaalsContact N-O 3.08Å; L338-A366 HydrophobicContact CD1-CB 4.43Å; L338-L1159 HydrophobicContact CD1-CD2 4.07Å; L338-L1163 HydrophobicContact CB-CD1 3.82Å; L338-L1163 HydrophobicContact CD1-CD1 4.1Å
339	I	87.6	Confident	85.2	Confident	9 Å²	9	38.8 Å²	38.8	5%	0.046	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-62.9	-25.5	178.1	-160.5	67.4	0	0	0	112.6	D337 L341 I344 L1163 K1167 F1233	D337-I339 HydrophobicContact CB-CG2 4.3Å; D337-I339 PolarHBondContact O-N 3.35Å; D337-I339 VanDerWaalsContact OD1-CG2 3.22Å; D337-I339 WeakPolarHBondContact OD1-CG2 3.37Å; D337-I339 PolarHBondContact OD1-N 2.95Å; D337-I339 VanDerWaalsContact OD1-N 3.1Å; I339-L341 VanDerWaalsContact C-N 3.29Å; I339-L341 PolarHBondContact O-N 2.82Å; I339-I344 HydrophobicContact CD1-CD1 4.08Å; I339-L1163 HydrophobicContact CB-CD2 4.31Å; I339-L1163 HydrophobicContact CD1-CB 4.47Å; I339-L1163 HydrophobicContact CD1-CD2 3.95Å; I339-L1163 VanDerWaalsContact CD1-O 3.23Å; I339-L1163 WeakPolarHBondContact CD1-O 3.45Å; I339-K1167 HydrophobicContact CD1-CB 3.71Å; I339-K1167 HydrophobicContact CD1-CD 4.33Å; I339-K1167 HydrophobicContact CD1-CG 4.32Å; I339-K1167 PolarHBondContact O-NZ 3.41Å; I339-F1233 HydrophobicContact CG2-CD2 4.46Å; I339-F1233 HydrophobicContact CG2-CE2 3.48Å; I339-F1233 VanDerWaalsContact CG2-CE2 3.48Å; I339-F1233 HydrophobicContact CG2-CZ 4.14Å
340	K	85	Confident	85.6	Confident	64 Å²	64	36.6 Å²	36.6	28%	0.278	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-74.1	-15.3	-179.4	-60.5	173.4	-175.8	172.3	0	113.2	F332 V335 D336 D337 L338 R342 F1233	F332-K340 VanDerWaalsContact CE1-O 3.27Å; F332-K340 WeakPolarHBondContact CE1-O 3.44Å; V335-K340 HydrophobicContact CG1-CB 4.12Å; D336-K340 WeakPolarHBondContact OD1-CD 3.5Å; D336-K340 IonicContact OD1-NZ 2.71Å; D336-K340 PolarHBondContact OD1-NZ 2.87Å; D336-K340 IonicContact OD2-NZ 3.5Å; D336-K340 PolarHBondContact OD2-NZ 2.85Å; D337-K340 HydrophobicContact CB-CD 4.17Å; D337-K340 HydrophobicContact CB-CG 4.36Å; D337-K340 VanDerWaalsContact O-CB 3.31Å; D337-K340 WeakPolarHBondContact O-CB 3.44Å; D337-K340 WeakPolarHBondContact O-CG 3.5Å; D337-K340 PolarHBondContact O-N 3.42Å; L338-K340 PolarHBondContact O-N 3.41Å; K340-R342 PolarHBondContact O-N 2.85Å; K340-F1233 HydrophobicContact CD-CZ 4.49Å; K340-F1233 VanDerWaalsContact CE-CE1 3.45Å; K340-F1233 VanDerWaalsContact CE-CZ 3.4Å; K340-F1233 HydrophobicContact CG-CE2 4.35Å; K340-F1233 HydrophobicContact CG-CZ 4.3Å
341	L	87.1	Confident	86.1	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	14%	0.143	C	C	.	.			trans	-58	135.4	172.5	-63.5	176.3	0	0	0	109.6	F332 V335 L338 I339 I344 V349 K1167	F332-L341 HydrophobicContact CB-CD2 4.04Å; V335-L341 HydrophobicContact CB-CD2 4.4Å; V335-L341 HydrophobicContact CG1-CD2 4.46Å; L338-L341 HydrophobicContact CD2-CD1 4.25Å; L338-L341 WeakPolarHBondContact O-CB 3.42Å; L338-L341 VanDerWaalsContact O-CG 3.3Å; L338-L341 WeakPolarHBondContact O-CG 3.4Å; L338-L341 PolarHBondContact O-N 3.45Å; I339-L341 VanDerWaalsContact C-N 3.29Å; I339-L341 PolarHBondContact O-N 2.82Å; L341-I344 HydrophobicContact CB-CG1 4.22Å; L341-V349 HydrophobicContact CD1-CG2 4.04Å; L341-K1167 PolarHBondContact O-NZ 2.79Å
342	R	85	Confident	86.7	Confident	118 Å²	118	24.1 Å²	24.1	45%	0.445	11%	0.107	S	C	.	.	S	Bend	trans	-62.1	-52.2	176.4	-174.2	179.1	-176.3	-169.7	-0.6	109.7	N328 F332 K340 K1167	N328-R342 WeakPolarHBondContact OD1-CA 3.42Å; N328-R342 WeakPolarHBondContact OD1-CB 3.39Å; N328-R342 PolarHBondContact OD1-N 2.91Å; F332-R342 HydrophobicContact CE2-CB 4.35Å; F332-R342 HydrophobicContact CZ-CB 4.42Å; K340-R342 PolarHBondContact O-N 2.85Å; R342-K1167 PolarHBondContact O-NZ 3.43Å
343	Y	88.2	Confident	87.2	Confident	49 Å²	49	22.6 Å²	22.6	19%	0.192	10%	0.1	C	C	.	.	S	Bend	trans	-106.5	112	177.6	-50.8	-64.4	0	0	0	109.5	R326 A327 N328 N345	R326-Y343 HydrophobicContact CB-CD1 4.31Å; R326-Y343 HydrophobicContact CB-CD2 3.86Å; R326-Y343 HydrophobicContact CB-CE2 4.17Å; R326-Y343 HydrophobicContact CB-CG 3.94Å; R326-Y343 PolarHBondContact NH1-OH 2.94Å; R326-Y343 VanDerWaalsContact NH1-OH 3.08Å; A327-Y343 WeakPolarHBondContact O-CD2 3.46Å; N328-Y343 PolarHBondContact ND2-O 3.44Å; N328-Y343 PolarHBondContact OD1-N 2.65Å; Y343-N345 PolarHBondContact O-N 3.37Å
344	I	90	Very high	87.7	Confident	14 Å²	14	20.5 Å²	20.5	7%	0.072	9%	0.089	C	C	.	.			trans	-93	96.9	178.1	-58.4	-178.4	0	0	0	108.2	I339 L341 V349 L1163 Q1164 K1167	I339-I344 HydrophobicContact CD1-CD1 4.08Å; L341-I344 HydrophobicContact CB-CG1 4.22Å; I344-V349 HydrophobicContact CG2-CG2 4.49Å; I344-L1163 HydrophobicContact CD1-CB 4.28Å; I344-L1163 HydrophobicContact CG2-CB 3.97Å; I344-L1163 HydrophobicContact CG2-CD1 4.18Å; I344-Q1164 HydrophobicContact CB-CG 4.43Å; I344-Q1164 HydrophobicContact CG2-CG 4.41Å; I344-Q1164 PolarHBondContact O-NE2 2.86Å; I344-K1167 HydrophobicContact CD1-CD 3.6Å; I344-K1167 HydrophobicContact CG1-CD 4.5Å
345	N	90	Very high	87.8	Confident	8 Å²	8	18.7 Å²	18.7	4%	0.043	8%	0.083	C	C	.	.			trans	-140	169	-179.4	59.3	35.1	0	0	0	111.1	E325 R326 Y343 S347 S348 V349	E325-N345 HydrophobicContact CB-CB 4.3Å; E325-N345 HydrophobicContact CG-CB 4.35Å; E325-N345 WeakPolarHBondContact OE1-CB 3.43Å; R326-N345 PolarHBondContact O-ND2 3.47Å; Y343-N345 PolarHBondContact O-N 3.37Å; N345-S347 PolarHBondContact O-N 2.93Å; N345-S348 PolarHBondContact O-N 3.33Å; N345-S348 WeakPolarHBondContact OD1-CB 3.44Å; N345-S348 PolarHBondContact OD1-N 3.27Å; N345-S348 VanDerWaalsContact OD1-N 3.07Å; N345-S348 PolarHBondContact OD1-OG 3.31Å; N345-V349 WeakPolarHBondContact O-CG2 3.28Å; N345-V349 PolarHBondContact O-N 3.42Å; N345-V349 VanDerWaalsContact O-N 3.13Å
346	E	88.9	Confident	88	Confident	15 Å²	15	18 Å²	18	7%	0.07	8%	0.079	C	C	.	.	H	α-helix	trans	-68.4	-41.2	-165.1	-165.7	-177.6	128	0	0	112.1	E325 T350 R1151 R1155 I1160	E325-E346 PolarHBondContact OE1-N 3.3Å; E325-E346 VanDerWaalsContact OE1-N 3.08Å; E346-T350 VanDerWaalsContact O-CB 3.26Å; E346-T350 WeakPolarHBondContact O-CB 3.18Å; E346-T350 PolarHBondContact O-N 3.18Å; E346-T350 PolarHBondContact O-OG1 3.08Å; E346-R1151 HydrophobicContact CG-CG 4.38Å; E346-R1151 WeakPolarHBondContact OE1-CB 3.4Å; E346-R1151 WeakPolarHBondContact OE1-CG 3.49Å; E346-R1151 IonicContact OE1-CZ 3.46Å; E346-R1151 IonicContact OE1-NE 2.77Å; E346-R1151 PolarHBondContact OE1-NE 3.13Å; E346-R1151 IonicContact OE1-NH2 3.98Å; E346-R1151 PolarHBondContact OE1-NH2 3.48Å; E346-R1155 VanDerWaalsContact CD-NH2 3.33Å; E346-R1155 IonicContact OE1-CZ 2.61Å; E346-R1155 IonicContact OE1-NE 2.95Å; E346-R1155 PolarHBondContact OE1-NE 3.09Å; E346-R1155 VanDerWaalsContact OE1-NE 3.09Å; E346-R1155 IonicContact OE1-NH2 3.25Å; E346-R1155 PolarHBondContact OE1-NH2 2.82Å; E346-R1155 VanDerWaalsContact OE1-NH2 3.07Å; E346-R1155 IonicContact OE2-CZ 3.96Å; E346-R1155 IonicContact OE2-NE 2.78Å; E346-R1155 PolarHBondContact OE2-NE 2.9Å; E346-R1155 IonicContact OE2-NH2 3.76Å; E346-R1155 PolarHBondContact OE2-NH2 2.97Å; E346-I1160 HydrophobicContact CB-CD1 3.63Å; E346-I1160 HydrophobicContact CG-CD1 3.92Å
347	S	89.9	Confident	88	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-67.1	-42.5	178.6	-53.7	0	0	0	0	111.7	W285 T287 E325 N345 T350 H351	W285-S347 VanDerWaalsContact CD1-CB 3.45Å; W285-S347 VanDerWaalsContact CG-CB 3.45Å; T287-S347 VanDerWaalsContact CG2-OG 3.24Å; T287-S347 WeakPolarHBondContact CG2-OG 2.94Å; E325-S347 WeakPolarHBondContact OE2-CA 3.06Å; E325-S347 WeakPolarHBondContact OE2-CB 3.47Å; E325-S347 PolarHBondContact OE2-N 3.27Å; E325-S347 PolarHBondContact OE2-OG 3.21Å; N345-S347 PolarHBondContact O-N 2.93Å; S347-T350 PolarHBondContact O-N 3.45Å; S347-H351 VanDerWaalsContact O-CB 3.28Å; S347-H351 WeakPolarHBondContact O-CB 3.46Å; S347-H351 PolarHBondContact O-N 3.21Å
348	S	90.7	Very high	87.4	Confident	4 Å²	4	17.1 Å²	17.1	3%	0.028	8%	0.075	C	C	.	.	H	α-helix	trans	-68.8	-38.2	-179.7	-58.8	0	0	0	0	113.1	W285 N328 N345 H351 S352	W285-S348 PolarHBondContact NE1-OG 3.22Å; N328-S348 WeakPolarHBondContact ND2-CB 3.41Å; N328-S348 PolarHBondContact ND2-OG 2.91Å; N345-S348 PolarHBondContact O-N 3.33Å; N345-S348 WeakPolarHBondContact OD1-CB 3.44Å; N345-S348 PolarHBondContact OD1-N 3.27Å; N345-S348 VanDerWaalsContact OD1-N 3.07Å; N345-S348 PolarHBondContact OD1-OG 3.31Å; S348-H351 PolarHBondContact O-N 2.88Å; S348-S352 PolarHBondContact O-N 3.13Å; S348-S352 PolarHBondContact O-OG 2.99Å
349	V	92.2	Very high	86.6	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.7	-44.6	173.6	172.3	0	0	0	0	110.2	L338 L341 I344 N345 H351 S352 F353 I1154 L1159	L338-V349 HydrophobicContact CD1-CG1 3.78Å; L338-V349 HydrophobicContact CD2-CG1 4.19Å; L338-V349 HydrophobicContact CD2-CG2 4.42Å; L341-V349 HydrophobicContact CD1-CG2 4.04Å; I344-V349 HydrophobicContact CG2-CG2 4.49Å; N345-V349 WeakPolarHBondContact O-CG2 3.28Å; N345-V349 PolarHBondContact O-N 3.42Å; N345-V349 VanDerWaalsContact O-N 3.13Å; V349-H351 VanDerWaalsContact C-N 3.31Å; V349-H351 PolarHBondContact O-N 2.9Å; V349-S352 PolarHBondContact O-N 3.42Å; V349-F353 HydrophobicContact CG1-CD2 4.05Å; V349-F353 HydrophobicContact CG1-CE2 3.58Å; V349-F353 HydrophobicContact CG1-CZ 3.91Å; V349-F353 WeakPolarHBondContact O-CG 3.42Å; V349-F353 PolarHBondContact O-N 2.81Å; V349-I1154 HydrophobicContact CG1-CD1 3.89Å; V349-I1154 HydrophobicContact CG1-CG1 4.42Å; V349-L1159 HydrophobicContact CG1-CD2 4.45Å
350	T	90.4	Very high	86.2	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.9	-37	175.7	-54	0	0	0	0	111.8	Y292 E346 S347 F353 I354 V1147 I1150 R1151 I1154	Y292-T350 HydrophobicContact CE1-CG2 3.91Å; E346-T350 VanDerWaalsContact O-CB 3.26Å; E346-T350 WeakPolarHBondContact O-CB 3.18Å; E346-T350 PolarHBondContact O-N 3.18Å; E346-T350 PolarHBondContact O-OG1 3.08Å; S347-T350 PolarHBondContact O-N 3.45Å; T350-F353 PolarHBondContact O-N 3.13Å; T350-I354 HydrophobicContact CG2-CD1 3.92Å; T350-I354 WeakPolarHBondContact O-CD1 3.37Å; T350-I354 VanDerWaalsContact O-CG1 3.27Å; T350-I354 WeakPolarHBondContact O-CG1 3.34Å; T350-I354 PolarHBondContact O-N 2.96Å; T350-V1147 HydrophobicContact CG2-CG1 3.88Å; T350-I1150 HydrophobicContact CG2-CG2 4.11Å; T350-R1151 HydrophobicContact CG2-CG 4.14Å; T350-I1154 VanDerWaalsContact OG1-CD1 3.32Å; T350-I1154 WeakPolarHBondContact OG1-CD1 3.32Å
351	H	86.6	Confident	86.3	Confident	44 Å²	44	15 Å²	15	20%	0.204	7%	0.07	C	C	.	.	H	α-helix	trans	-65	-48.8	175.8	-161.2	69.3	0	0	0	111.4	W285 Y292 S347 S348 V349 F353 I354 Q355	W285-H351 HydrophobicContact CH2-CB 4.44Å; W285-H351 AromaticContact CH2-CD2 3.84Å; W285-H351 AromaticContact CH2-CE1 3.7Å; W285-H351 AromaticContact CH2-CG 3.75Å; W285-H351 AromaticContact CH2-ND1 3.66Å; W285-H351 AromaticContact CH2-NE2 3.82Å; W285-H351 HydrophobicContact CZ2-CB 4.07Å; W285-H351 AromaticContact CZ2-CD2 3.88Å; W285-H351 AromaticContact CZ2-CG 3.78Å; Y292-H351 HydrophobicContact CE2-CB 4.26Å; Y292-H351 AromaticContact CE2-ND1 3.77Å; Y292-H351 AromaticContact CZ-ND1 3.78Å; Y292-H351 VanDerWaalsContact OH-CA 3.28Å; Y292-H351 WeakPolarHBondContact OH-CA 3.44Å; Y292-H351 WeakPolarHBondContact OH-CB 3.46Å; Y292-H351 PolarHBondContact OH-ND1 3.5Å; S347-H351 VanDerWaalsContact O-CB 3.28Å; S347-H351 WeakPolarHBondContact O-CB 3.46Å; S347-H351 PolarHBondContact O-N 3.21Å; S348-H351 PolarHBondContact O-N 2.88Å; V349-H351 VanDerWaalsContact C-N 3.31Å; V349-H351 PolarHBondContact O-N 2.9Å; H351-F353 VanDerWaalsContact C-N 3.3Å; H351-F353 PolarHBondContact O-N 3.15Å; H351-I354 PolarHBondContact O-N 3.23Å; H351-I354 VanDerWaalsContact O-N 3.14Å; H351-Q355 PolarHBondContact CD2-NE2 3.28Å; H351-Q355 PolarHBondContact NE2-NE2 2.94Å; H351-Q355 WeakPolarHBondContact O-CG 3.43Å; H351-Q355 PolarHBondContact O-N 2.68Å
352	S	88.9	Confident	86.5	Confident	4 Å²	4	15 Å²	15	3%	0.028	7%	0.07	C	C	.	.	H	α-helix	trans	-57.8	-42.9	176.6	-55.8	0	0	0	0	111.5	S348 V349 Q355 R356	S348-S352 PolarHBondContact O-N 3.13Å; S348-S352 PolarHBondContact O-OG 2.99Å; V349-S352 PolarHBondContact O-N 3.42Å; S352-Q355 PolarHBondContact O-N 2.7Å; S352-R356 WeakPolarHBondContact O-CB 3.45Å; S352-R356 VanDerWaalsContact O-CG 3.3Å; S352-R356 WeakPolarHBondContact O-CG 3.42Å; S352-R356 PolarHBondContact O-N 2.99Å
353	F	90.2	Very high	86.9	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-63.7	-44.1	174	-70.8	-28.1	0	0	0	113.2	L338 V349 T350 H351 Q355 R356 Y357 T364 I372 I374 F1074 I1150 I1154 L1159	L338-F353 HydrophobicContact CD1-CE1 3.83Å; L338-F353 HydrophobicContact CD1-CZ 3.68Å; L338-F353 HydrophobicContact CD2-CE1 4.36Å; L338-F353 HydrophobicContact CG-CE1 4.48Å; V349-F353 HydrophobicContact CG1-CD2 4.05Å; V349-F353 HydrophobicContact CG1-CE2 3.58Å; V349-F353 HydrophobicContact CG1-CZ 3.91Å; V349-F353 WeakPolarHBondContact O-CG 3.42Å; V349-F353 PolarHBondContact O-N 2.81Å; T350-F353 PolarHBondContact O-N 3.13Å; H351-F353 VanDerWaalsContact C-N 3.3Å; H351-F353 PolarHBondContact O-N 3.15Å; F353-Q355 VanDerWaalsContact C-N 3.33Å; F353-Q355 PolarHBondContact O-N 3.13Å; F353-R356 PolarHBondContact O-N 3.48Å; F353-Y357 WeakPolarHBondContact O-CB 3.45Å; F353-Y357 PolarHBondContact O-N 3.03Å; F353-T364 HydrophobicContact CE1-CG2 4.39Å; F353-I372 HydrophobicContact CE1-CB 4.19Å; F353-I372 HydrophobicContact CE1-CG1 4.34Å; F353-I372 HydrophobicContact CE1-CG2 3.94Å; F353-I372 HydrophobicContact CZ-CB 4.23Å; F353-I372 HydrophobicContact CZ-CG1 4.09Å; F353-I372 HydrophobicContact CZ-CG2 3.76Å; F353-I374 HydrophobicContact CB-CD1 3.91Å; F353-I374 HydrophobicContact CD1-CD1 4.21Å; F353-I374 HydrophobicContact CG-CD1 4.06Å; F353-F1074 HydrophobicContact CE2-CD2 4.47Å; F353-F1074 HydrophobicContact CE2-CE2 4.01Å; F353-I1150 HydrophobicContact CD2-CG2 3.92Å; F353-I1154 HydrophobicContact CD2-CD1 4.03Å; F353-I1154 HydrophobicContact CD2-CG1 4.46Å; F353-I1154 HydrophobicContact CE2-CD1 3.9Å; F353-I1154 HydrophobicContact CE2-CG1 3.91Å; F353-L1159 HydrophobicContact CE2-CD2 4.48Å; F353-L1159 HydrophobicContact CZ-CD2 4.15Å
354	I	84.7	Confident	87.2	Confident	5 Å²	5	7.5 Å²	7.5	3%	0.026	4%	0.042	C	C	.	.	H	α-helix	trans	-61.7	-42.7	176.8	-73	164.1	0	0	0	110.8	F77 L112 Y292 T350 H351 G358 I1145 V1147	F77-I354 HydrophobicContact CZ-CG2 4.34Å; L112-I354 HydrophobicContact CD2-CD1 4.46Å; L112-I354 HydrophobicContact CD2-CG2 4.11Å; Y292-I354 HydrophobicContact CE1-CD1 4.28Å; T350-I354 HydrophobicContact CG2-CD1 3.92Å; T350-I354 WeakPolarHBondContact O-CD1 3.37Å; T350-I354 VanDerWaalsContact O-CG1 3.27Å; T350-I354 WeakPolarHBondContact O-CG1 3.34Å; T350-I354 PolarHBondContact O-N 2.96Å; H351-I354 PolarHBondContact O-N 3.23Å; H351-I354 VanDerWaalsContact O-N 3.14Å; I354-G358 WeakPolarHBondContact O-CA 3.27Å; I354-G358 PolarHBondContact O-N 3.33Å; I354-I1145 HydrophobicContact CG1-CD1 4.04Å; I354-I1145 HydrophobicContact CG1-CG1 4.5Å; I354-I1145 HydrophobicContact CG1-CG2 4.15Å; I354-V1147 HydrophobicContact CD1-CG2 4.03Å
355	Q	80.3	Confident	87.3	Confident	16 Å²	16	7.3 Å²	7.3	8%	0.075	4%	0.04	C	C	.	.	H	α-helix	trans	-66.9	-43.6	177.8	-69	-175.4	-24.2	0	0	112.8	D333 R334 H351 S352 F353 G358 S359	D333-Q355 VanDerWaalsContact CA-OE1 3.23Å; D333-Q355 PolarHBondContact OD2-NE2 2.91Å; R334-Q355 HydrophobicContact CG-CB 3.8Å; H351-Q355 PolarHBondContact CD2-NE2 3.28Å; H351-Q355 PolarHBondContact NE2-NE2 2.94Å; H351-Q355 WeakPolarHBondContact O-CG 3.43Å; H351-Q355 PolarHBondContact O-N 2.68Å; S352-Q355 PolarHBondContact O-N 2.7Å; F353-Q355 VanDerWaalsContact C-N 3.33Å; F353-Q355 PolarHBondContact O-N 3.13Å; Q355-G358 CarbonylContact O-C 3.56Å; Q355-G358 PolarHBondContact O-N 2.82Å; Q355-S359 PolarHBondContact O-N 3.3Å; Q355-S359 VanDerWaalsContact O-N 3.08Å; Q355-S359 PolarHBondContact O-OG 3.42Å
356	R	86.8	Confident	87.3	Confident	1 Å²	1	7 Å²	7	0%	0.004	4%	0.039	C	C	.	.	H	α-helix	trans	-70.9	-46.8	179.5	-72.1	-177.9	65	77.2	3.9	111.9	D184 R334 V335 S352 F353 G358 S359 G360 L361 F363 T364	D184-R356 IonicContact OD1-NH1 3.63Å; D184-R356 PolarHBondContact OD1-NH1 2.96Å; D184-R356 IonicContact OD2-CZ 3.22Å; D184-R356 VanDerWaalsContact OD2-CZ 3.26Å; D184-R356 IonicContact OD2-NH1 3.4Å; D184-R356 PolarHBondContact OD2-NH1 2.79Å; D184-R356 IonicContact OD2-NH2 3.73Å; D184-R356 PolarHBondContact OD2-NH2 3.21Å; R334-R356 HydrophobicContact CB-CG 4.08Å; R334-R356 WeakPolarHBondContact O-CD 3.4Å; R334-R356 PolarHBondContact O-NH1 3.26Å; V335-R356 VanDerWaalsContact O-CD 3.28Å; V335-R356 WeakPolarHBondContact O-CD 3.48Å; S352-R356 WeakPolarHBondContact O-CB 3.45Å; S352-R356 VanDerWaalsContact O-CG 3.3Å; S352-R356 WeakPolarHBondContact O-CG 3.42Å; S352-R356 PolarHBondContact O-N 2.99Å; F353-R356 PolarHBondContact O-N 3.48Å; R356-G358 VanDerWaalsContact C-N 3.28Å; R356-G358 PolarHBondContact O-N 2.78Å; R356-S359 CarbonylContact O-C 3.57Å; R356-S359 WeakPolarHBondContact O-CA 3.32Å; R356-S359 WeakPolarHBondContact O-CB 3.37Å; R356-S359 PolarHBondContact O-N 2.83Å; R356-G360 PolarHBondContact O-N 2.9Å; R356-L361 CarbonylContact C-O 3.55Å; R356-L361 HydrophobicContact CB-CB 4.02Å; R356-L361 WeakPolarHBondContact CB-O 3.48Å; R356-L361 WeakPolarHBondContact O-CA 3.35Å; R356-L361 WeakPolarHBondContact O-CB 3.43Å; R356-L361 PolarHBondContact O-N 3.15Å; R356-F363 PolarHBondContact NH2-O 3.5Å; R356-T364 WeakPolarHBondContact CD-OG1 3.44Å; R356-T364 PolarHBondContact NE-OG1 3.49Å
357	Y	85.9	Confident	86.7	Confident	1 Å²	1	6.6 Å²	6.6	0%	0.004	4%	0.038	C	C	.	.	H	α-helix	trans	-56.8	-44.3	170.6	-171.6	-103.1	0	0	0	111	R109 I118 F353 S359 G360 I362 I374 N375 P1076 P1142 I1145	R109-Y357 PolarHBondContact NH1-O 3.48Å; I118-Y357 HydrophobicContact CD1-CD1 4.1Å; F353-Y357 WeakPolarHBondContact O-CB 3.45Å; F353-Y357 PolarHBondContact O-N 3.03Å; Y357-S359 PolarHBondContact O-N 3.17Å; Y357-S359 VanDerWaalsContact O-N 3.12Å; Y357-G360 PolarHBondContact O-N 2.82Å; Y357-I362 HydrophobicContact CD2-CG2 4.19Å; Y357-I362 HydrophobicContact CE2-CG2 4.36Å; Y357-I374 HydrophobicContact CD2-CB 3.98Å; Y357-I374 HydrophobicContact CD2-CG2 3.6Å; Y357-I374 HydrophobicContact CE2-CB 4.35Å; Y357-I374 HydrophobicContact CE2-CG2 3.69Å; Y357-I374 HydrophobicContact CG-CG2 4.46Å; Y357-N375 WeakPolarHBondContact CE2-O 3.5Å; Y357-N375 PolarHBondContact OH-O 3.39Å; Y357-P1076 HydrophobicContact CE1-CB 4.16Å; Y357-P1076 HydrophobicContact CE2-CB 4.19Å; Y357-P1076 HydrophobicContact CE2-CG 4.41Å; Y357-P1076 WeakPolarHBondContact OH-CG 2.96Å; Y357-P1142 PolarHBondContact OH-O 3.32Å; Y357-I1145 HydrophobicContact CD1-CB 4.36Å; Y357-I1145 HydrophobicContact CD1-CD1 4.02Å; Y357-I1145 HydrophobicContact CE1-CB 4.47Å; Y357-I1145 HydrophobicContact CG-CD1 4.18Å
358	G	75.8	Confident	85.7	Confident	6 Å²	6	6.8 Å²	6.8	6%	0.062	4%	0.039	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-13.9	172.5	0	0	0	0	0	115.1	R109 I354 Q355 R356	R109-G358 WeakPolarHBondContact CB-O 3.29Å; R109-G358 WeakPolarHBondContact CD-O 3.18Å; I354-G358 WeakPolarHBondContact O-CA 3.27Å; I354-G358 PolarHBondContact O-N 3.33Å; Q355-G358 CarbonylContact O-C 3.56Å; Q355-G358 PolarHBondContact O-N 2.82Å; R356-G358 VanDerWaalsContact C-N 3.28Å; R356-G358 PolarHBondContact O-N 2.78Å
359	S	74.7	Confident	85	Confident	7 Å²	7	7.1 Å²	7.1	5%	0.049	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	1.4	173.7	-50.3	0	0	0	0	113.6	P180 E181 R334 Q355 R356 Y357 L361	P180-S359 CarbonylContact C-O 3.53Å; P180-S359 VanDerWaalsContact CB-O 3.3Å; P180-S359 WeakPolarHBondContact CB-O 3.3Å; E181-S359 PolarHBondContact N-O 3.14Å; R334-S359 PolarHBondContact NH1-OG 2.79Å; Q355-S359 PolarHBondContact O-N 3.3Å; Q355-S359 VanDerWaalsContact O-N 3.08Å; Q355-S359 PolarHBondContact O-OG 3.42Å; R356-S359 CarbonylContact O-C 3.57Å; R356-S359 WeakPolarHBondContact O-CA 3.32Å; R356-S359 WeakPolarHBondContact O-CB 3.37Å; R356-S359 PolarHBondContact O-N 2.83Å; Y357-S359 PolarHBondContact O-N 3.17Å; Y357-S359 VanDerWaalsContact O-N 3.12Å; S359-L361 PolarHBondContact O-N 3.21Å
360	G	79.1	Confident	84.9	Confident	10 Å²	10	7.3 Å²	7.3	10%	0.103	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	-1.7	-169.4	0	0	0	0	0	114.4	R356 Y357 I362	R356-G360 PolarHBondContact O-N 2.9Å; Y357-G360 PolarHBondContact O-N 2.82Å; G360-I362 VanDerWaalsContact C-N 3.32Å; G360-I362 PolarHBondContact O-N 3.05Å
361	L	86	Confident	85.1	Confident	11 Å²	11	7.3 Å²	7.3	6%	0.058	4%	0.042	C	C	.	.			trans	-80.6	74.4	-179.7	-59.9	170.1	0	0	0	110.1	E181 R356 S359 F363	E181-L361 WeakPolarHBondContact O-CD2 3.39Å; R356-L361 CarbonylContact C-O 3.55Å; R356-L361 HydrophobicContact CB-CB 4.02Å; R356-L361 WeakPolarHBondContact CB-O 3.48Å; R356-L361 WeakPolarHBondContact O-CA 3.35Å; R356-L361 WeakPolarHBondContact O-CB 3.43Å; R356-L361 PolarHBondContact O-N 3.15Å; S359-L361 PolarHBondContact O-N 3.21Å; L361-F363 VanDerWaalsContact C-N 3.28Å; L361-F363 PolarHBondContact O-N 2.92Å
362	I	91.2	Very high	85.5	Confident	3 Å²	3	5.2 Å²	5.2	2%	0.015	3%	0.032	C	C	.	.			trans	-68.1	-23.5	-175.9	56.2	166	0	0	0	114.8	Y357 G360 S373 I374 P376 L380 I382	Y357-I362 HydrophobicContact CD2-CG2 4.19Å; Y357-I362 HydrophobicContact CE2-CG2 4.36Å; G360-I362 VanDerWaalsContact C-N 3.32Å; G360-I362 PolarHBondContact O-N 3.05Å; I362-S373 WeakPolarHBondContact O-CA 3.19Å; I362-I374 WeakPolarHBondContact CB-O 3.46Å; I362-I374 WeakPolarHBondContact CG2-O 3.28Å; I362-I374 PolarHBondContact O-N 3.02Å; I362-P376 HydrophobicContact CD1-CG 4.14Å; I362-P376 HydrophobicContact CG2-CB 3.94Å; I362-L380 HydrophobicContact CD1-CD1 3.91Å; I362-L380 HydrophobicContact CG1-CD1 3.98Å; I362-L380 HydrophobicContact CG2-CD1 3.89Å; I362-I382 HydrophobicContact CD1-CD1 4.15Å; I362-I382 HydrophobicContact CG1-CD1 4.21Å
363	F	94.5	Very high	85.8	Confident	6 Å²	6	5.2 Å²	5.2	3%	0.026	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	140.7	179.5	-68.8	-65.7	0	0	0	110.8	R356 L361 L371 I372 I382 P402 H403 V404	R356-F363 PolarHBondContact NH2-O 3.5Å; L361-F363 VanDerWaalsContact C-N 3.28Å; L361-F363 PolarHBondContact O-N 2.92Å; F363-L371 HydrophobicContact CB-CD1 4.25Å; F363-L371 HydrophobicContact CD1-CD1 4.36Å; F363-L371 HydrophobicContact CD1-CD2 3.62Å; F363-L371 HydrophobicContact CD1-CG 4.01Å; F363-L371 HydrophobicContact CE1-CD2 3.94Å; F363-L371 HydrophobicContact CG-CD2 4.47Å; F363-I372 CarbonylContact C-O 3.17Å; F363-I372 VanDerWaalsContact CA-O 3.31Å; F363-I372 WeakPolarHBondContact CA-O 3.38Å; F363-I382 HydrophobicContact CD2-CD1 4.16Å; F363-I382 HydrophobicContact CE2-CD1 3.84Å; F363-P402 HydrophobicContact CB-CB 4.17Å; F363-P402 VanDerWaalsContact CB-O 3.23Å; F363-P402 WeakPolarHBondContact CB-O 3.28Å; F363-H403 AromaticContact CD2-CD2 3.44Å; F363-H403 VanDerWaalsContact CD2-CD2 3.44Å; F363-H403 WeakPolarHBondContact CD2-CD2 3.3Å; F363-H403 AromaticContact CE2-CD2 3.49Å; F363-H403 VanDerWaalsContact CE2-CD2 3.49Å; F363-H403 WeakPolarHBondContact CE2-CD2 3.5Å; F363-H403 AromaticContact CE2-NE2 3.61Å; F363-V404 HydrophobicContact CE1-CB 4.06Å; F363-V404 HydrophobicContact CE2-CG1 4.19Å; F363-V404 HydrophobicContact CZ-CB 3.78Å; F363-V404 HydrophobicContact CZ-CG1 3.75Å
364	T	93.4	Very high	86	Confident	2 Å²	2	5.3 Å²	5.3	1%	0.012	3%	0.033	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	139.9	174.7	-50.1	0	0	0	0	109.2	L338 F353 R356 I372	L338-T364 HydrophobicContact CD2-CG2 4.28Å; L338-T364 HydrophobicContact CG-CG2 4.12Å; F353-T364 HydrophobicContact CE1-CG2 4.39Å; R356-T364 WeakPolarHBondContact CD-OG1 3.44Å; R356-T364 PolarHBondContact NE-OG1 3.49Å; T364-I372 PolarHBondContact N-O 2.84Å; T364-I372 PolarHBondContact O-N 2.89Å
365	Y	92.2	Very high	86.3	Confident	10 Å²	10	6 Å²	6	4%	0.039	4%	0.036	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	154.8	174.2	-66	-42.9	0	0	0	112.1	D336 D337 L338 L371 R397 M400 P401 P402 S406	D336-Y365 PolarHBondContact O-N 3.23Å; D337-Y365 WeakPolarHBondContact CA-O 3.4Å; D337-Y365 HydrophobicContact CB-CD2 4.48Å; L338-Y365 PolarHBondContact N-O 2.86Å; L338-Y365 VanDerWaalsContact N-O 3.08Å; Y365-L371 HydrophobicContact CD1-CD1 3.65Å; Y365-L371 HydrophobicContact CE1-CD1 3.82Å; Y365-R397 HydrophobicContact CE1-CG 4.14Å; Y365-R397 HydrophobicContact CE2-CG 4.44Å; Y365-R397 PolarHBondContact OH-O 3.49Å; Y365-M400 VanDerWaalsContact CE2-O 3.3Å; Y365-M400 WeakPolarHBondContact CE2-O 3.47Å; Y365-M400 PolarHBondContact OH-O 2.71Å; Y365-P401 PolarHBondContact OH-O 3.34Å; Y365-P401 VanDerWaalsContact OH-O 3.12Å; Y365-P402 HydrophobicContact CD1-CB 4.25Å; Y365-P402 HydrophobicContact CD2-CB 4.32Å; Y365-P402 HydrophobicContact CD2-CG 3.83Å; Y365-P402 HydrophobicContact CE1-CB 4.29Å; Y365-P402 HydrophobicContact CE2-CB 4.36Å; Y365-P402 HydrophobicContact CE2-CG 3.97Å; Y365-P402 HydrophobicContact CG-CB 4.26Å; Y365-P402 HydrophobicContact CG-CG 4.17Å; Y365-S406 WeakPolarHBondContact OH-CB 3.46Å; Y365-S406 PolarHBondContact OH-OG 3.32Å
366	A	90	Very high	86.5	Confident	1 Å²	1	6.2 Å²	6.2	1%	0.008	4%	0.039	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	99.3	164.4	0	0	0	0	0	109.5	D337 L338 G368 I369 N370 I372 L1159 L1163	D337-A366 WeakPolarHBondContact OD1-CA 3.12Å; L338-A366 HydrophobicContact CD1-CB 4.43Å; A366-G368 PolarHBondContact O-N 3.19Å; A366-I369 PolarHBondContact O-N 3.39Å; A366-N370 HydrophobicContact CB-CB 3.76Å; A366-N370 PolarHBondContact N-O 3.09Å; A366-N370 PolarHBondContact O-N 3.41Å; A366-N370 VanDerWaalsContact O-N 3.09Å; A366-I372 HydrophobicContact CB-CG1 4.35Å; A366-L1159 HydrophobicContact CB-CD1 3.95Å; A366-L1163 HydrophobicContact CB-CD2 3.8Å; A366-L1163 HydrophobicContact CB-CG 4.44Å
367	S	76.6	Confident	86.3	Confident	8 Å²	8	6.9 Å²	6.9	6%	0.056	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	35	178.3	-161.9	0	0	0	0	116.1	D337 I369 V1166	D337-S367 PolarHBondContact OD1-N 3.3Å; D337-S367 WeakPolarHBondContact OD2-CA 3.44Å; D337-S367 PolarHBondContact OD2-N 3.38Å; S367-I369 PolarHBondContact O-N 3.45Å; S367-V1166 WeakPolarHBondContact OG-CG1 3.32Å
368	G	68.6	Low	85.9	Confident	3 Å²	3	8.6 Å²	8.6	3%	0.031	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	-10	-178.3	0	0	0	0	0	116.3	D337 A366 R397 G1062 G1063	D337-G368 PolarHBondContact OD2-N 2.79Å; D337-G368 VanDerWaalsContact OD2-N 3.15Å; A366-G368 PolarHBondContact O-N 3.19Å; G368-R397 WeakPolarHBondContact O-CD 3.29Å; G368-R397 VanDerWaalsContact O-CZ 3.29Å; G368-R397 PolarHBondContact O-NE 3.35Å; G368-R397 PolarHBondContact O-NH1 3.47Å; G368-G1062 CarbonylContact C-O 3.21Å; G368-G1062 WeakPolarHBondContact CA-O 3.34Å; G368-G1063 CarbonylContact O-C 3.53Å; G368-G1063 WeakPolarHBondContact O-CA 3.48Å
369	I	77	Confident	85.9	Confident	11 Å²	11	13.1 Å²	13.1	6%	0.056	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-57.9	174.7	-64.1	165.4	0	0	0	108.5	A366 S367 R397 N839 P1064 V1166	A366-I369 PolarHBondContact O-N 3.39Å; S367-I369 PolarHBondContact O-N 3.45Å; I369-R397 PolarHBondContact O-NH1 3.44Å; I369-N839 WeakPolarHBondContact CG2-OD1 3.38Å; I369-P1064 HydrophobicContact CB-CB 4.49Å; I369-P1064 HydrophobicContact CG1-CB 4.49Å; I369-P1064 HydrophobicContact CG2-CB 4.15Å; I369-V1166 HydrophobicContact CD1-CG1 3.98Å; I369-V1166 HydrophobicContact CD1-CG2 3.83Å
370	N	88.9	Confident	86.2	Confident	5 Å²	5	13.8 Å²	13.8	3%	0.027	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	145	-171.8	-67.7	-13	0	0	0	112.4	A366 R397 Y835 H1072	A366-N370 HydrophobicContact CB-CB 3.76Å; A366-N370 PolarHBondContact N-O 3.09Å; A366-N370 PolarHBondContact O-N 3.41Å; A366-N370 VanDerWaalsContact O-N 3.09Å; N370-R397 PolarHBondContact O-NH2 3.26Å; N370-Y835 PolarHBondContact ND2-OH 3.31Å; N370-Y835 WeakPolarHBondContact OD1-CE2 3.38Å; N370-H1072 PolarHBondContact ND2-NE2 3.42Å
371	L	95.1	Very high	86	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130.2	153.5	-169.3	70	0	0	0	108.5	F363 Y365 P402 V407 W1070 I1071 H1072	F363-L371 HydrophobicContact CB-CD1 4.25Å; F363-L371 HydrophobicContact CD1-CD1 4.36Å; F363-L371 HydrophobicContact CD1-CD2 3.62Å; F363-L371 HydrophobicContact CD1-CG 4.01Å; F363-L371 HydrophobicContact CE1-CD2 3.94Å; F363-L371 HydrophobicContact CG-CD2 4.47Å; Y365-L371 HydrophobicContact CD1-CD1 3.65Å; Y365-L371 HydrophobicContact CE1-CD1 3.82Å; L371-P402 HydrophobicContact CD1-CB 4.34Å; L371-V407 HydrophobicContact CB-CG2 4.19Å; L371-V407 HydrophobicContact CD2-CG2 4.03Å; L371-W1070 PolarHBondContact N-O 3.06Å; L371-I1071 HydrophobicContact CB-CG1 4.13Å; L371-I1071 HydrophobicContact CB-CG2 4.22Å; L371-I1071 HydrophobicContact CD2-CD1 4.19Å; L371-I1071 HydrophobicContact CD2-CG1 4.45Å; L371-I1071 HydrophobicContact CD2-CG2 4.27Å; L371-I1071 HydrophobicContact CG-CG2 4.48Å; L371-I1071 CarbonylContact O-C 3.59Å; L371-I1071 VanDerWaalsContact O-CA 3.29Å; L371-I1071 WeakPolarHBondContact O-CA 3.42Å; L371-H1072 PolarHBondContact O-N 2.9Å
372	I	95.8	Very high	85.9	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135.2	165.9	-47.9	-58.7	0	0	0	107.5	F353 F363 T364 A366 H1072 F1074 L1159	F353-I372 HydrophobicContact CE1-CB 4.19Å; F353-I372 HydrophobicContact CE1-CG1 4.34Å; F353-I372 HydrophobicContact CE1-CG2 3.94Å; F353-I372 HydrophobicContact CZ-CB 4.23Å; F353-I372 HydrophobicContact CZ-CG1 4.09Å; F353-I372 HydrophobicContact CZ-CG2 3.76Å; F363-I372 CarbonylContact C-O 3.17Å; F363-I372 VanDerWaalsContact CA-O 3.31Å; F363-I372 WeakPolarHBondContact CA-O 3.38Å; T364-I372 PolarHBondContact N-O 2.84Å; T364-I372 PolarHBondContact O-N 2.89Å; A366-I372 HydrophobicContact CB-CG1 4.35Å; I372-H1072 WeakPolarHBondContact CA-O 3.47Å; I372-H1072 HydrophobicContact CD1-CB 3.93Å; I372-F1074 HydrophobicContact CG2-CD2 4.41Å; I372-L1159 HydrophobicContact CD1-CD1 4.23Å; I372-L1159 HydrophobicContact CD1-CD2 4.14Å; I372-L1159 HydrophobicContact CG1-CD2 4.46Å
373	S	95.3	Very high	85.7	Confident	4 Å²	4	17.1 Å²	17.1	3%	0.028	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	140.7	170.7	-176.6	0	0	0	0	109.5	I362 H1072 C1073 F1074	I362-S373 WeakPolarHBondContact O-CA 3.19Å; S373-H1072 PolarHBondContact N-O 3.4Å; S373-C1073 CarbonylContact O-C 3.57Å; S373-C1073 WeakPolarHBondContact O-CA 3.48Å; S373-F1074 PolarHBondContact O-N 2.92Å
374	I	94	Very high	85.1	Confident	2 Å²	2	17.5 Å²	17.5	1%	0.01	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.2	174.3	-53.5	176	0	0	0	107.6	F353 Y357 I362 P376 F1074 P1076	F353-I374 HydrophobicContact CB-CD1 3.91Å; F353-I374 HydrophobicContact CD1-CD1 4.21Å; F353-I374 HydrophobicContact CG-CD1 4.06Å; Y357-I374 HydrophobicContact CD2-CB 3.98Å; Y357-I374 HydrophobicContact CD2-CG2 3.6Å; Y357-I374 HydrophobicContact CE2-CB 4.35Å; Y357-I374 HydrophobicContact CE2-CG2 3.69Å; Y357-I374 HydrophobicContact CG-CG2 4.46Å; I362-I374 WeakPolarHBondContact CB-O 3.46Å; I362-I374 WeakPolarHBondContact CG2-O 3.28Å; I362-I374 PolarHBondContact O-N 3.02Å; I374-P376 WeakPolarHBondContact O-CD 3.36Å; I374-P376 VanDerWaalsContact O-N 3.12Å; I374-F1074 HydrophobicContact CG1-CB 4.27Å; I374-P1076 HydrophobicContact CG2-CB 4.06Å; I374-P1076 HydrophobicContact CG2-CG 4.45Å
375	N	90.6	Very high	84.7	Confident	18 Å²	18	21 Å²	21	10%	0.096	12%	0.116	C	C	.	.			trans	-54	119.1	-177.8	178.1	-7.3	0	0	0	110.7	Y357 M377 G457 F1074 P1076 A1080	Y357-N375 WeakPolarHBondContact CE2-O 3.5Å; Y357-N375 PolarHBondContact OH-O 3.39Å; N375-M377 PolarHBondContact O-N 2.99Å; N375-M377 PolarHBondContact OD1-N 3.1Å; N375-G457 PolarHBondContact ND2-O 3.08Å; N375-F1074 PolarHBondContact N-O 3.03Å; N375-P1076 WeakPolarHBondContact O-CG 3.49Å; N375-A1080 PolarHBondContact ND2-O 3.4Å
376	P	85.7	Confident	84	Confident	22 Å²	22	23.1 Å²	23.1	14%	0.143	13%	0.126	C	C	.	.			trans	-66.9	-19.6	-178.8	25.1	-33.7	0	0	0	114.2	I362 I374 M378 L380	I362-P376 HydrophobicContact CD1-CG 4.14Å; I362-P376 HydrophobicContact CG2-CB 3.94Å; I374-P376 WeakPolarHBondContact O-CD 3.36Å; I374-P376 VanDerWaalsContact O-N 3.12Å; P376-M378 HydrophobicContact CB-CG 4.38Å; P376-M378 WeakPolarHBondContact CB-O 3.49Å; P376-M378 VanDerWaalsContact CG-O 3.23Å; P376-M378 WeakPolarHBondContact CG-O 3.47Å; P376-M378 PolarHBondContact O-N 3.41Å; P376-L380 HydrophobicContact CB-CD1 3.89Å; P376-L380 HydrophobicContact CB-CD2 4.33Å; P376-L380 HydrophobicContact CB-CG 3.88Å; P376-L380 HydrophobicContact CG-CD1 4.42Å; P376-L380 HydrophobicContact CG-CG 4.33Å
377	M	81.3	Confident	83.6	Confident	14 Å²	14	23 Å²	23	7%	0.069	13%	0.125	C	C	.	.	S	Bend	trans	57	9	-169	-63.3	175.1	59.3	0	0	114.7	N375 P1076 V1077 A1080 C1083 L1140 P1142	N375-M377 PolarHBondContact O-N 2.99Å; N375-M377 PolarHBondContact OD1-N 3.1Å; M377-P1076 HydrophobicContact CG-CG 4.15Å; M377-P1076 HydrophobicContact SD-CG 3.75Å; M377-V1077 HydrophobicContact CE-CG2 4.16Å; M377-V1077 HydrophobicContact SD-CG2 3.71Å; M377-A1080 HydrophobicContact CE-CB 4.44Å; M377-A1080 HydrophobicContact CG-CB 3.7Å; M377-A1080 HydrophobicContact SD-CB 3.47Å; M377-A1080 WeakPolarHBondContact SD-CB 3.47Å; M377-C1083 HydrophobicContact CB-CB 3.84Å; M377-C1083 HydrophobicContact CE-CB 4.33Å; M377-C1083 HydrophobicContact CG-CB 4.09Å; M377-L1140 VanDerWaalsContact CE-O 3.29Å; M377-L1140 WeakPolarHBondContact CE-O 3.48Å; M377-P1142 HydrophobicContact CB-CB 3.7Å
378	M	77.8	Confident	84	Confident	37 Å²	37	23 Å²	23	18%	0.182	13%	0.125	C	C	.	.	S	Bend	trans	-148.5	154.3	174.5	66.3	167.5	77.4	0	0	109.7	V107 P376 L380 P1142	V107-M378 HydrophobicContact CG2-CE 4.46Å; V107-M378 HydrophobicContact CG2-SD 4.3Å; P376-M378 HydrophobicContact CB-CG 4.38Å; P376-M378 WeakPolarHBondContact CB-O 3.49Å; P376-M378 VanDerWaalsContact CG-O 3.23Å; P376-M378 WeakPolarHBondContact CG-O 3.47Å; P376-M378 PolarHBondContact O-N 3.41Å; M378-L380 HydrophobicContact CG-CD2 3.89Å; M378-L380 PolarHBondContact O-N 3.45Å; M378-L380 HydrophobicContact SD-CD2 4.04Å; M378-P1142 HydrophobicContact CB-CB 4.42Å; M378-P1142 HydrophobicContact CE-CB 3.7Å; M378-P1142 HydrophobicContact CE-CG 3.46Å; M378-P1142 VanDerWaalsContact CE-CG 3.46Å
379	P	76.7	Confident	84.6	Confident	102 Å²	102	23.9 Å²	23.9	66%	0.662	13%	0.128	S	C	*	.			trans	-68.2	127.7	171	28	-33.8	0	0	0	111	T2322	P379-T2322 HydrophobicContact CB-CG2 4.09Å; P379-T2322 HydrophobicContact CG-CG2 3.85Å
380	L	79.7	Confident	84.6	Confident	20 Å²	20	24.7 Å²	24.7	11%	0.105	13%	0.132	C	C	.	.			trans	-101.8	157.4	177.2	-62.8	-173.3	0	0	0	112	E181 I362 P376 M378 I382	E181-L380 HydrophobicContact CG-CD2 4.39Å; I362-L380 HydrophobicContact CD1-CD1 3.91Å; I362-L380 HydrophobicContact CG1-CD1 3.98Å; I362-L380 HydrophobicContact CG2-CD1 3.89Å; P376-L380 HydrophobicContact CB-CD1 3.89Å; P376-L380 HydrophobicContact CB-CD2 4.33Å; P376-L380 HydrophobicContact CB-CG 3.88Å; P376-L380 HydrophobicContact CG-CD1 4.42Å; P376-L380 HydrophobicContact CG-CG 4.33Å; M378-L380 HydrophobicContact CG-CD2 3.89Å; M378-L380 PolarHBondContact O-N 3.45Å; M378-L380 HydrophobicContact SD-CD2 4.04Å; L380-I382 VanDerWaalsContact C-N 3.29Å; L380-I382 HydrophobicContact CB-CD1 4.24Å; L380-I382 HydrophobicContact CB-CG1 4.13Å; L380-I382 HydrophobicContact CD1-CD1 4.18Å; L380-I382 PolarHBondContact O-N 3.43Å
381	N	76.1	Confident	84.3	Confident	38 Å²	38	24.6 Å²	24.6	20%	0.203	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-8.3	-173.9	-84.7	-76	0	0	0	114.8	R102 E181 F182 Y383	R102-N381 PolarHBondContact NH1-OD1 3.16Å; R102-N381 PolarHBondContact NH2-OD1 3.44Å; E181-N381 PolarHBondContact OE2-N 3.03Å; F182-N381 HydrophobicContact CE2-CB 3.91Å; F182-N381 HydrophobicContact CZ-CB 4.4Å; N381-Y383 VanDerWaalsContact C-N 3.28Å; N381-Y383 PolarHBondContact O-N 2.94Å
382	I	83.5	Confident	83.7	Confident	5 Å²	5	25.5 Å²	25.5	3%	0.026	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.5	-174.4	64.2	-171.7	0	0	0	114.4	E181 F182 I362 F363 L380 S384 V387	E181-I382 HydrophobicContact CB-CG2 4.23Å; F182-I382 HydrophobicContact CD1-CG2 4.39Å; F182-I382 HydrophobicContact CE1-CB 4.37Å; F182-I382 HydrophobicContact CE1-CG2 4.03Å; F182-I382 HydrophobicContact CE2-CG2 4.38Å; F182-I382 HydrophobicContact CZ-CB 4.4Å; F182-I382 HydrophobicContact CZ-CG2 4.05Å; I362-I382 HydrophobicContact CD1-CD1 4.15Å; I362-I382 HydrophobicContact CG1-CD1 4.21Å; F363-I382 HydrophobicContact CD2-CD1 4.16Å; F363-I382 HydrophobicContact CE2-CD1 3.84Å; L380-I382 VanDerWaalsContact C-N 3.29Å; L380-I382 HydrophobicContact CB-CD1 4.24Å; L380-I382 HydrophobicContact CB-CG1 4.13Å; L380-I382 HydrophobicContact CD1-CD1 4.18Å; L380-I382 PolarHBondContact O-N 3.43Å; I382-S384 PolarHBondContact O-N 3.01Å; I382-V387 WeakPolarHBondContact O-CB 3.44Å; I382-V387 WeakPolarHBondContact O-CG1 3.41Å
383	Y	86.5	Confident	82.8	Confident	51 Å²	51	28.9 Å²	28.9	20%	0.2	16%	0.156	C	C	.	.			trans	-86.7	64	-176.6	-56.2	-80.3	0	0	0	112.5	N381 V404 Y405 D466 K2320	N381-Y383 VanDerWaalsContact C-N 3.28Å; N381-Y383 PolarHBondContact O-N 2.94Å; Y383-V404 HydrophobicContact CE1-CG1 3.94Å; Y383-Y405 WeakPolarHBondContact CA-OH 3.47Å; Y383-D466 HydrophobicContact CD1-CB 4.43Å; Y383-D466 WeakPolarHBondContact CD1-OD1 3.36Å; Y383-D466 HydrophobicContact CE1-CB 4.25Å; Y383-D466 WeakPolarHBondContact CE1-OD2 2.96Å; Y383-K2320 PolarHBondContact O-NZ 2.9Å
384	S	83.1	Confident	82	Confident	14 Å²	14	29.5 Å²	29.5	10%	0.098	16%	0.16	C	C	.	.	S	Bend	trans	-129.9	151.4	176.5	70.2	0	0	0	0	113.6	I382 K386 V387 M388	I382-S384 PolarHBondContact O-N 3.01Å; S384-K386 PolarHBondContact O-N 3Å; S384-V387 CarbonylContact O-C 3.58Å; S384-V387 VanDerWaalsContact O-CA 3.29Å; S384-V387 WeakPolarHBondContact O-CA 3.25Å; S384-V387 VanDerWaalsContact O-CB 3.26Å; S384-V387 WeakPolarHBondContact O-CB 3.34Å; S384-V387 PolarHBondContact O-N 3.43Å; S384-V387 VanDerWaalsContact OG-CG2 3.29Å; S384-V387 WeakPolarHBondContact OG-CG2 3.35Å; S384-M388 WeakPolarHBondContact O-CG 3.4Å; S384-M388 PolarHBondContact O-N 3.31Å
385	D	84.3	Confident	81.1	Confident	75 Å²	75	31.9 Å²	31.9	40%	0.401	17%	0.171	S	C	.	.	H	α-helix	trans	-57.2	-37.2	-178.4	11.2	-46.7	0	0	0	111.2	V387 M388 D389 Y473	D385-V387 PolarHBondContact O-N 3.1Å; D385-M388 WeakPolarHBondContact O-CB 3.47Å; D385-M388 PolarHBondContact O-N 3.07Å; D385-D389 PolarHBondContact O-N 3.11Å; D385-Y473 HydrophobicContact CB-CD2 4.33Å; D385-Y473 HydrophobicContact CB-CE2 3.67Å
386	K	77.4	Confident	80.5	Confident	55 Å²	55	32.7 Å²	32.7	24%	0.239	18%	0.176	C	C	.	.	H	α-helix	trans	-60.2	-27	169.6	-72.1	168	168.2	159	0	114.4	D129 Y130 P141 S384	D129-K386 HydrophobicContact CB-CD 3.78Å; D129-K386 IonicContact OD2-NZ 2.66Å; D129-K386 PolarHBondContact OD2-NZ 3.37Å; Y130-K386 WeakPolarHBondContact O-CE 3.4Å; Y130-K386 PolarHBondContact OH-O 3.19Å; P141-K386 HydrophobicContact CB-CB 3.96Å; P141-K386 HydrophobicContact CG-CB 3.84Å; P141-K386 VanDerWaalsContact CG-O 3.24Å; P141-K386 WeakPolarHBondContact CG-O 3.32Å; S384-K386 PolarHBondContact O-N 3Å
387	V	81.8	Confident	80.3	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-89	-36.3	176.3	179.1	0	0	0	0	110.6	P141 F182 F185 I382 S384 D385 D389 L390 F391	P141-V387 HydrophobicContact CB-CG2 3.68Å; P141-V387 HydrophobicContact CG-CG2 3.96Å; F182-V387 HydrophobicContact CE1-CG1 4.22Å; F182-V387 HydrophobicContact CE1-CG2 3.48Å; F182-V387 VanDerWaalsContact CE1-CG2 3.48Å; F182-V387 HydrophobicContact CZ-CG2 3.83Å; F185-V387 HydrophobicContact CD1-CG1 4.5Å; F185-V387 HydrophobicContact CE1-CG1 3.68Å; F185-V387 HydrophobicContact CZ-CG1 4.1Å; I382-V387 WeakPolarHBondContact O-CB 3.44Å; I382-V387 WeakPolarHBondContact O-CG1 3.41Å; S384-V387 CarbonylContact O-C 3.58Å; S384-V387 VanDerWaalsContact O-CA 3.29Å; S384-V387 WeakPolarHBondContact O-CA 3.25Å; S384-V387 VanDerWaalsContact O-CB 3.26Å; S384-V387 WeakPolarHBondContact O-CB 3.34Å; S384-V387 PolarHBondContact O-N 3.43Å; S384-V387 VanDerWaalsContact OG-CG2 3.29Å; S384-V387 WeakPolarHBondContact OG-CG2 3.35Å; D385-V387 PolarHBondContact O-N 3.1Å; V387-D389 PolarHBondContact O-N 3.19Å; V387-L390 HydrophobicContact CG1-CD1 4.49Å; V387-L390 WeakPolarHBondContact O-CB 3.33Å; V387-L390 PolarHBondContact O-N 3.38Å; V387-F391 HydrophobicContact CG1-CE2 4.02Å; V387-F391 VanDerWaalsContact O-CD2 3.28Å; V387-F391 WeakPolarHBondContact O-CD2 3.24Å
388	M	85.7	Confident	79.9	Confident	8 Å²	8	32.6 Å²	32.6	4%	0.039	17%	0.173	C	C	.	.	H	α-helix	trans	-56.8	-36.1	166.7	-54.7	-178.8	-168.9	0	0	110.9	S384 D385 L390 F391 T392 Y405 T469 Y470 Y473	S384-M388 WeakPolarHBondContact O-CG 3.4Å; S384-M388 PolarHBondContact O-N 3.31Å; D385-M388 WeakPolarHBondContact O-CB 3.47Å; D385-M388 PolarHBondContact O-N 3.07Å; M388-L390 PolarHBondContact O-N 3.42Å; M388-F391 PolarHBondContact O-N 3.49Å; M388-T392 PolarHBondContact O-N 3.25Å; M388-T392 PolarHBondContact O-OG1 3.26Å; M388-Y405 HydrophobicContact CE-CE1 4.37Å; M388-Y405 HydrophobicContact CE-CE2 4.3Å; M388-Y405 VanDerWaalsContact CE-OH 3.29Å; M388-Y405 WeakPolarHBondContact CE-OH 3.31Å; M388-Y405 HydrophobicContact CG-CD2 3.93Å; M388-Y405 HydrophobicContact CG-CE2 3.54Å; M388-T469 HydrophobicContact CE-CG2 3.88Å; M388-Y470 HydrophobicContact CB-CD2 3.82Å; M388-Y470 HydrophobicContact CB-CE2 3.82Å; M388-Y470 HydrophobicContact CG-CD2 3.83Å; M388-Y470 HydrophobicContact CG-CE2 4.32Å; M388-Y470 HydrophobicContact SD-CD2 4.32Å; M388-Y473 HydrophobicContact CB-CD1 3.8Å; M388-Y473 HydrophobicContact CB-CE1 3.83Å; M388-Y473 HydrophobicContact CG-CD1 4.43Å; M388-Y473 HydrophobicContact SD-CD1 3.74Å; M388-Y473 HydrophobicContact SD-CD2 4.28Å; M388-Y473 HydrophobicContact SD-CE1 4.4Å; M388-Y473 HydrophobicContact SD-CG 3.67Å
389	D	80.5	Confident	79.6	Confident	21 Å²	21	31.9 Å²	31.9	11%	0.112	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-24.4	175.4	-114.2	48.7	0	0	0	114.2	Y130 R220 D385 V387 T392 Y473 K477	Y130-D389 WeakPolarHBondContact OH-CB 3.39Å; R220-D389 IonicContact CZ-OD2 2.6Å; R220-D389 VanDerWaalsContact CZ-OD2 3.25Å; R220-D389 IonicContact NH1-OD2 2.63Å; R220-D389 PolarHBondContact NH1-OD2 3.37Å; R220-D389 VanDerWaalsContact NH2-CG 3.29Å; R220-D389 PolarHBondContact NH2-O 2.94Å; R220-D389 IonicContact NH2-OD1 3.89Å; R220-D389 IonicContact NH2-OD2 2.79Å; R220-D389 PolarHBondContact NH2-OD2 3.41Å; D385-D389 PolarHBondContact O-N 3.11Å; V387-D389 PolarHBondContact O-N 3.19Å; D389-T392 WeakPolarHBondContact CA-OG1 3.39Å; D389-T392 PolarHBondContact O-OG1 3.09Å; D389-Y473 PolarHBondContact OD1-OH 3.45Å; D389-K477 VanDerWaalsContact CG-NZ 3.34Å; D389-K477 IonicContact OD1-NZ 3.79Å; D389-K477 PolarHBondContact OD1-NZ 2.97Å; D389-K477 IonicContact OD2-NZ 2.96Å; D389-K477 PolarHBondContact OD2-NZ 3.28Å
390	L	77.4	Confident	79.7	Confident	27 Å²	27	27.3 Å²	27.3	14%	0.141	14%	0.139	C	C	.	.	H	α-helix	trans	-75	-32.6	175.1	-57.6	178.6	0	0	0	112.9	L140 P141 F185 V387 M388	L140-L390 HydrophobicContact CD2-CD2 4.03Å; P141-L390 HydrophobicContact CG-CD1 4.04Å; P141-L390 HydrophobicContact CG-CD2 4.43Å; P141-L390 HydrophobicContact CG-CG 4.27Å; F185-L390 HydrophobicContact CD1-CD1 3.76Å; F185-L390 HydrophobicContact CE1-CD1 4.39Å; V387-L390 HydrophobicContact CG1-CD1 4.49Å; V387-L390 WeakPolarHBondContact O-CB 3.33Å; V387-L390 PolarHBondContact O-N 3.38Å; M388-L390 PolarHBondContact O-N 3.42Å
391	F	82.8	Confident	80	Confident	3 Å²	3	27.6 Å²	27.6	1%	0.013	14%	0.142	C	C	.	.	H	α-helix	trans	-83.8	-14.7	177.4	-63.5	-76.9	0	0	0	112.7	F185 V387 M388 N393 C394 M400 P401 H403 Y405 Q409 Y470	F185-F391 HydrophobicContact CD1-CZ 4.44Å; F185-F391 HydrophobicContact CE1-CE1 4.48Å; F185-F391 AromaticContact CE1-CE2 3.63Å; F185-F391 HydrophobicContact CE1-CE2 3.63Å; F185-F391 AromaticContact CE1-CZ 3.44Å; F185-F391 HydrophobicContact CE1-CZ 3.44Å; F185-F391 VanDerWaalsContact CE1-CZ 3.44Å; F185-F391 HydrophobicContact CZ-CE2 4.2Å; F185-F391 AromaticContact CZ-CZ 3.89Å; F185-F391 HydrophobicContact CZ-CZ 3.89Å; V387-F391 HydrophobicContact CG1-CE2 4.02Å; V387-F391 VanDerWaalsContact O-CD2 3.28Å; V387-F391 WeakPolarHBondContact O-CD2 3.24Å; M388-F391 PolarHBondContact O-N 3.49Å; F391-N393 PolarHBondContact O-N 3.4Å; F391-C394 WeakPolarHBondContact O-CB 3.48Å; F391-C394 PolarHBondContact O-N 3.23Å; F391-C394 VanDerWaalsContact O-N 3.16Å; F391-M400 HydrophobicContact CD1-CB 4.11Å; F391-M400 HydrophobicContact CD1-CG 4.07Å; F391-M400 HydrophobicContact CD1-SD 3.81Å; F391-M400 HydrophobicContact CE1-CB 4.12Å; F391-P401 HydrophobicContact CE1-CG 3.92Å; F391-P401 HydrophobicContact CZ-CG 4.04Å; F391-H403 HydrophobicContact CE1-CB 4.12Å; F391-H403 HydrophobicContact CE2-CB 4.1Å; F391-H403 AromaticContact CE2-ND1 3.79Å; F391-H403 HydrophobicContact CZ-CB 3.42Å; F391-H403 VanDerWaalsContact CZ-CB 3.42Å; F391-H403 AromaticContact CZ-CG 3.88Å; F391-Y405 VanDerWaalsContact CD2-CB 3.49Å; F391-Y405 AromaticContact CD2-CD2 3.96Å; F391-Y405 HydrophobicContact CD2-CD2 3.96Å; F391-Y405 HydrophobicContact CD2-CG 4.25Å; F391-Y405 AromaticContact CE2-CD2 3.93Å; F391-Y405 HydrophobicContact CE2-CD2 3.93Å; F391-Y405 HydrophobicContact CE2-CG 4.34Å; F391-Q409 HydrophobicContact CB-CB 4.34Å; F391-Q409 WeakPolarHBondContact O-CG 3.45Å; F391-Q409 PolarHBondContact O-OE1 2.87Å; F391-Y470 HydrophobicContact CB-CE2 4.11Å; F391-Y470 WeakPolarHBondContact CB-OH 3.45Å
392	T	81.9	Confident	80.6	Confident	20 Å²	20	26 Å²	26	12%	0.123	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	128.9	-176.9	-58.8	0	0	0	0	111.4	M388 D389 C394 Q474 K477	M388-T392 PolarHBondContact O-N 3.25Å; M388-T392 PolarHBondContact O-OG1 3.26Å; D389-T392 WeakPolarHBondContact CA-OG1 3.39Å; D389-T392 PolarHBondContact O-OG1 3.09Å; T392-C394 PolarHBondContact O-N 3.49Å; T392-Q474 PolarHBondContact OG1-NE2 3.02Å; T392-K477 PolarHBondContact OG1-NZ 3.41Å; T392-K477 VanDerWaalsContact OG1-NZ 3.15Å
393	N	76.8	Confident	81.1	Confident	70 Å²	70	25.9 Å²	25.9	37%	0.374	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	2.5	-179.4	-64.8	2.5	0	0	0	117	F391 Q395	F391-N393 PolarHBondContact O-N 3.4Å; N393-Q395 PolarHBondContact O-N 2.93Å
394	C	78.3	Confident	81.4	Confident	17 Å²	17	23.4 Å²	23.4	12%	0.115	12%	0.124	C	C	.	.			trans	-61.1	130.4	169.5	-65.8	0	0	0	0	110.6	F391 T392 M400 Q409	F391-C394 WeakPolarHBondContact O-CB 3.48Å; F391-C394 PolarHBondContact O-N 3.23Å; F391-C394 VanDerWaalsContact O-N 3.16Å; T392-C394 PolarHBondContact O-N 3.49Å; C394-M400 HydrophobicContact CB-CE 4.37Å; C394-M400 HydrophobicContact CB-CG 3.53Å; C394-M400 HydrophobicContact CB-SD 3.48Å; C394-M400 WeakPolarHBondContact CB-SD 3.42Å; C394-Q409 HydrophobicContact CB-CG 4.2Å; C394-Q409 VanDerWaalsContact O-CG 3.26Å; C394-Q409 WeakPolarHBondContact O-CG 3.45Å; C394-Q409 PolarHBondContact O-NE2 2.78Å
395	Q	75.9	Confident	81.9	Confident	53 Å²	53	22.9 Å²	22.9	25%	0.248	12%	0.12	C	C	.	.			trans	-104.2	-10.4	-174.6	-74.5	-144.3	46.6	0	0	115.2	N393 R417 E548	N393-Q395 PolarHBondContact O-N 2.93Å; Q395-R417 PolarHBondContact O-NH2 3.39Å; Q395-E548 PolarHBondContact NE2-OE1 3.14Å
396	V	76.3	Confident	82.3	Confident	35 Å²	35	19.3 Å²	19.3	21%	0.212	10%	0.101	C	C	.	.			trans	-133.2	141.9	-170.3	174.6	0	0	0	0	109.9	Y398 D399 M400 D1061	V396-Y398 HydrophobicContact CG1-CD2 4.11Å; V396-D399 HydrophobicContact CB-CB 3.97Å; V396-D399 WeakPolarHBondContact CB-OD2 3.34Å; V396-D399 HydrophobicContact CG1-CB 4.13Å; V396-D399 WeakPolarHBondContact O-CB 3.36Å; V396-M400 WeakPolarHBondContact O-CE 3.49Å; V396-D1061 CarbonylContact C-O 3.55Å; V396-D1061 WeakPolarHBondContact CA-O 3.33Å; V396-D1061 HydrophobicContact CG2-CB 4.43Å
397	R	81.6	Confident	83	Confident	3 Å²	3	16.8 Å²	16.8	1%	0.011	9%	0.09	C	C	.	.	S	Bend	trans	-80.3	-37.2	-175	-165.7	-176.9	-177	153.3	4.6	113.8	Y365 G368 I369 N370 D399 M400 L410 D1061 G1062	Y365-R397 HydrophobicContact CE1-CG 4.14Å; Y365-R397 HydrophobicContact CE2-CG 4.44Å; Y365-R397 PolarHBondContact OH-O 3.49Å; G368-R397 WeakPolarHBondContact O-CD 3.29Å; G368-R397 VanDerWaalsContact O-CZ 3.29Å; G368-R397 PolarHBondContact O-NE 3.35Å; G368-R397 PolarHBondContact O-NH1 3.47Å; I369-R397 PolarHBondContact O-NH1 3.44Å; N370-R397 PolarHBondContact O-NH2 3.26Å; R397-D399 PolarHBondContact O-N 3.35Å; R397-D399 VanDerWaalsContact O-N 3.09Å; R397-M400 PolarHBondContact O-N 3.33Å; R397-M400 VanDerWaalsContact O-N 3.12Å; R397-M400 VanDerWaalsContact O-O 3.09Å; R397-L410 HydrophobicContact CB-CD2 4.27Å; R397-L410 HydrophobicContact CG-CD2 4.39Å; R397-D1061 WeakPolarHBondContact CB-O 3.42Å; R397-D1061 PolarHBondContact N-O 3.3Å; R397-G1062 WeakPolarHBondContact CD-O 3.22Å
398	Y	74.2	Confident	83.6	Confident	30 Å²	30	16.8 Å²	16.8	12%	0.118	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.7	173.9	-59.3	-54.2	0	0	0	113	V396 D1172 T1232 F1233 P1236	V396-Y398 HydrophobicContact CG1-CD2 4.11Å; Y398-D1172 PolarHBondContact OH-OD2 3.2Å; Y398-T1232 HydrophobicContact CE1-CG2 4.26Å; Y398-T1232 WeakPolarHBondContact OH-CG2 3.49Å; Y398-F1233 HydrophobicContact CD1-CD1 4Å; Y398-F1233 AromaticContact CD1-CE1 3.38Å; Y398-F1233 HydrophobicContact CD1-CE1 3.38Å; Y398-F1233 AromaticContact CD1-CZ 3.79Å; Y398-F1233 HydrophobicContact CD1-CZ 3.79Å; Y398-F1233 HydrophobicContact CE1-CD1 4.02Å; Y398-F1233 AromaticContact CE1-CE1 3.58Å; Y398-F1233 HydrophobicContact CE1-CE1 3.58Å; Y398-F1233 HydrophobicContact CE1-CE2 4.15Å; Y398-F1233 HydrophobicContact CE1-CG 4.48Å; Y398-F1233 AromaticContact CE1-CZ 3.63Å; Y398-F1233 HydrophobicContact CE1-CZ 3.63Å; Y398-F1233 HydrophobicContact CG-CE1 4.28Å; Y398-P1236 HydrophobicContact CD2-CG 3.43Å; Y398-P1236 VanDerWaalsContact CD2-CG 3.43Å; Y398-P1236 HydrophobicContact CE2-CG 3.65Å; Y398-P1236 HydrophobicContact CG-CG 4Å
399	D	70.2	Confident	83.9	Confident	23 Å²	23	16.7 Å²	16.7	12%	0.123	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-12.7	-174.3	-88.5	-22.4	0	0	0	113.4	S228 N231 V396 R397	S228-D399 VanDerWaalsContact CB-CB 3.46Å; S228-D399 VanDerWaalsContact CB-CG 3.46Å; S228-D399 WeakPolarHBondContact CB-O 3.43Å; S228-D399 WeakPolarHBondContact CB-OD1 3.39Å; S228-D399 PolarHBondContact OG-OD1 3.2Å; N231-D399 PolarHBondContact ND2-OD1 3.09Å; V396-D399 HydrophobicContact CB-CB 3.97Å; V396-D399 WeakPolarHBondContact CB-OD2 3.34Å; V396-D399 HydrophobicContact CG1-CB 4.13Å; V396-D399 WeakPolarHBondContact O-CB 3.36Å; R397-D399 PolarHBondContact O-N 3.35Å; R397-D399 VanDerWaalsContact O-N 3.09Å
400	M	80.6	Confident	84.4	Confident	5 Å²	5	15.7 Å²	15.7	3%	0.025	8%	0.084	C	C	.	.	S	Bend	trans	-111.5	136.9	178.4	-67.9	-174.1	-81.4	0	0	111	Y365 F391 C394 V396 R397 S406 Q409 L410	Y365-M400 VanDerWaalsContact CE2-O 3.3Å; Y365-M400 WeakPolarHBondContact CE2-O 3.47Å; Y365-M400 PolarHBondContact OH-O 2.71Å; F391-M400 HydrophobicContact CD1-CB 4.11Å; F391-M400 HydrophobicContact CD1-CG 4.07Å; F391-M400 HydrophobicContact CD1-SD 3.81Å; F391-M400 HydrophobicContact CE1-CB 4.12Å; C394-M400 HydrophobicContact CB-CE 4.37Å; C394-M400 HydrophobicContact CB-CG 3.53Å; C394-M400 HydrophobicContact CB-SD 3.48Å; C394-M400 WeakPolarHBondContact CB-SD 3.42Å; V396-M400 WeakPolarHBondContact O-CE 3.49Å; R397-M400 PolarHBondContact O-N 3.33Å; R397-M400 VanDerWaalsContact O-N 3.12Å; R397-M400 VanDerWaalsContact O-O 3.09Å; M400-S406 VanDerWaalsContact CE-O 3.29Å; M400-S406 WeakPolarHBondContact CE-O 3.48Å; M400-Q409 HydrophobicContact CE-CB 4.3Å; M400-Q409 HydrophobicContact CE-CG 4.15Å; M400-Q409 HydrophobicContact SD-CB 3.86Å; M400-Q409 HydrophobicContact SD-CG 3.66Å; M400-L410 HydrophobicContact CE-CB 4.19Å
401	P	84.1	Confident	85.1	Confident	26 Å²	26	14.4 Å²	14.4	17%	0.169	8%	0.077	C	C	.	.			trans	-63.6	156.6	175.5	26.9	-34.2	0	0	0	112.1	D184 F185 Y365 F391 H403 S406	D184-P401 HydrophobicContact CB-CB 3.84Å; F185-P401 HydrophobicContact CD1-CG 3.67Å; F185-P401 HydrophobicContact CD2-CG 4.36Å; F185-P401 HydrophobicContact CE1-CG 3.82Å; F185-P401 HydrophobicContact CE2-CG 4.48Å; F185-P401 HydrophobicContact CG-CG 3.97Å; F185-P401 HydrophobicContact CZ-CG 4.23Å; Y365-P401 PolarHBondContact OH-O 3.34Å; Y365-P401 VanDerWaalsContact OH-O 3.12Å; F391-P401 HydrophobicContact CE1-CG 3.92Å; F391-P401 HydrophobicContact CZ-CG 4.04Å; P401-H403 PolarHBondContact O-N 3.47Å; P401-S406 PolarHBondContact O-OG 3.05Å
402	P	90.4	Very high	85.4	Confident	5 Å²	5	14.9 Å²	14.9	3%	0.032	8%	0.08	C	C	.	.	S	Bend	trans	-59.7	109.7	-179.9	-21.6	32.7	0	0	0	111.9	D336 F363 Y365 L371	D336-P402 HydrophobicContact CB-CG 3.98Å; D336-P402 WeakPolarHBondContact O-CG 3.4Å; F363-P402 HydrophobicContact CB-CB 4.17Å; F363-P402 VanDerWaalsContact CB-O 3.23Å; F363-P402 WeakPolarHBondContact CB-O 3.28Å; Y365-P402 HydrophobicContact CD1-CB 4.25Å; Y365-P402 HydrophobicContact CD2-CB 4.32Å; Y365-P402 HydrophobicContact CD2-CG 3.83Å; Y365-P402 HydrophobicContact CE1-CB 4.29Å; Y365-P402 HydrophobicContact CE2-CB 4.36Å; Y365-P402 HydrophobicContact CE2-CG 3.97Å; Y365-P402 HydrophobicContact CG-CB 4.26Å; Y365-P402 HydrophobicContact CG-CG 4.17Å; L371-P402 HydrophobicContact CD1-CB 4.34Å
403	H	92.7	Very high	85.7	Confident	2 Å²	2	14.2 Å²	14.2	1%	0.009	8%	0.076	C	C	.	.	S	Bend	trans	-156.1	159.2	178.1	-157.4	-112.4	0	0	0	111.3	F363 F391 P401 Y405 S406	F363-H403 AromaticContact CD2-CD2 3.44Å; F363-H403 VanDerWaalsContact CD2-CD2 3.44Å; F363-H403 WeakPolarHBondContact CD2-CD2 3.3Å; F363-H403 AromaticContact CE2-CD2 3.49Å; F363-H403 VanDerWaalsContact CE2-CD2 3.49Å; F363-H403 WeakPolarHBondContact CE2-CD2 3.5Å; F363-H403 AromaticContact CE2-NE2 3.61Å; F391-H403 HydrophobicContact CE1-CB 4.12Å; F391-H403 HydrophobicContact CE2-CB 4.1Å; F391-H403 AromaticContact CE2-ND1 3.79Å; F391-H403 HydrophobicContact CZ-CB 3.42Å; F391-H403 VanDerWaalsContact CZ-CB 3.42Å; F391-H403 AromaticContact CZ-CG 3.88Å; P401-H403 PolarHBondContact O-N 3.47Å; H403-Y405 AromaticContact CE1-CD2 3.34Å; H403-Y405 WeakPolarHBondContact CE1-CD2 3.45Å; H403-Y405 AromaticContact CE1-CE2 3.52Å; H403-Y405 AromaticContact CE1-CG 3.71Å; H403-Y405 WeakPolarHBondContact ND1-CB 3.48Å; H403-Y405 AromaticContact ND1-CD2 3.25Å; H403-Y405 VanDerWaalsContact ND1-CD2 3.25Å; H403-Y405 WeakPolarHBondContact ND1-CD2 3.44Å; H403-Y405 AromaticContact ND1-CE2 3.93Å; H403-Y405 AromaticContact ND1-CG 3.31Å; H403-Y405 VanDerWaalsContact ND1-CG 3.31Å; H403-Y405 PolarHBondContact ND1-N 3.49Å; H403-Y405 PolarHBondContact O-N 3.42Å; H403-S406 PolarHBondContact O-N 3.1Å; H403-S406 PolarHBondContact O-OG 2.99Å
404	V	94.3	Very high	86.2	Confident	0 Å²	0	11 Å²	11	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-59.5	-37.4	170	56.6	0	0	0	0	111.8	F363 Y383 S406 V407 A408 I463 D466 V467	F363-V404 HydrophobicContact CE1-CB 4.06Å; F363-V404 HydrophobicContact CE2-CG1 4.19Å; F363-V404 HydrophobicContact CZ-CB 3.78Å; F363-V404 HydrophobicContact CZ-CG1 3.75Å; Y383-V404 HydrophobicContact CE1-CG1 3.94Å; V404-S406 VanDerWaalsContact C-N 3.32Å; V404-S406 PolarHBondContact O-N 2.76Å; V404-V407 PolarHBondContact O-N 3.06Å; V404-A408 PolarHBondContact O-N 3.07Å; V404-A408 VanDerWaalsContact O-N 3.13Å; V404-I463 HydrophobicContact CG2-CG2 3.9Å; V404-D466 HydrophobicContact CG1-CB 3.96Å; V404-D466 HydrophobicContact CG2-CB 4.13Å; V404-V467 HydrophobicContact CG2-CG2 3.33Å
405	Y	93.7	Very high	86.6	Confident	3 Å²	3	10.2 Å²	10.2	1%	0.012	5%	0.054	C	C	.	.	H	α-helix	trans	-68.2	-24.9	178.5	-57.9	-24	0	0	0	113.8	Y383 M388 F391 H403 V407 A408 Q409 D466 Y470	Y383-Y405 WeakPolarHBondContact CA-OH 3.47Å; M388-Y405 HydrophobicContact CE-CE1 4.37Å; M388-Y405 HydrophobicContact CE-CE2 4.3Å; M388-Y405 VanDerWaalsContact CE-OH 3.29Å; M388-Y405 WeakPolarHBondContact CE-OH 3.31Å; M388-Y405 HydrophobicContact CG-CD2 3.93Å; M388-Y405 HydrophobicContact CG-CE2 3.54Å; F391-Y405 VanDerWaalsContact CD2-CB 3.49Å; F391-Y405 AromaticContact CD2-CD2 3.96Å; F391-Y405 HydrophobicContact CD2-CD2 3.96Å; F391-Y405 HydrophobicContact CD2-CG 4.25Å; F391-Y405 AromaticContact CE2-CD2 3.93Å; F391-Y405 HydrophobicContact CE2-CD2 3.93Å; F391-Y405 HydrophobicContact CE2-CG 4.34Å; H403-Y405 AromaticContact CE1-CD2 3.34Å; H403-Y405 WeakPolarHBondContact CE1-CD2 3.45Å; H403-Y405 AromaticContact CE1-CE2 3.52Å; H403-Y405 AromaticContact CE1-CG 3.71Å; H403-Y405 WeakPolarHBondContact ND1-CB 3.48Å; H403-Y405 AromaticContact ND1-CD2 3.25Å; H403-Y405 VanDerWaalsContact ND1-CD2 3.25Å; H403-Y405 WeakPolarHBondContact ND1-CD2 3.44Å; H403-Y405 AromaticContact ND1-CE2 3.93Å; H403-Y405 AromaticContact ND1-CG 3.31Å; H403-Y405 VanDerWaalsContact ND1-CG 3.31Å; H403-Y405 PolarHBondContact ND1-N 3.49Å; H403-Y405 PolarHBondContact O-N 3.42Å; Y405-V407 VanDerWaalsContact C-N 3.33Å; Y405-A408 PolarHBondContact O-N 3.2Å; Y405-Q409 WeakPolarHBondContact O-CB 3.32Å; Y405-Q409 PolarHBondContact O-N 3.37Å; Y405-D466 HydrophobicContact CE1-CB 4.28Å; Y405-Y470 AromaticContact CD1-CD2 3.71Å; Y405-Y470 HydrophobicContact CD1-CD2 3.71Å; Y405-Y470 AromaticContact CD1-CG 3.97Å; Y405-Y470 HydrophobicContact CD1-CG 3.97Å; Y405-Y470 HydrophobicContact CD2-CD2 4.16Å; Y405-Y470 HydrophobicContact CE1-CD2 4.38Å; Y405-Y470 AromaticContact CG-CD2 3.6Å; Y405-Y470 HydrophobicContact CG-CD2 3.6Å; Y405-Y470 HydrophobicContact CG-CE2 4.19Å; Y405-Y470 HydrophobicContact CG-CG 4.26Å
406	S	90.8	Very high	87.1	Confident	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-71.7	-31.4	175.1	71.2	0	0	0	0	112.1	Y365 M400 P401 H403 V404 L410	Y365-S406 WeakPolarHBondContact OH-CB 3.46Å; Y365-S406 PolarHBondContact OH-OG 3.32Å; M400-S406 VanDerWaalsContact CE-O 3.29Å; M400-S406 WeakPolarHBondContact CE-O 3.48Å; P401-S406 PolarHBondContact O-OG 3.05Å; H403-S406 PolarHBondContact O-N 3.1Å; H403-S406 PolarHBondContact O-OG 2.99Å; V404-S406 VanDerWaalsContact C-N 3.32Å; V404-S406 PolarHBondContact O-N 2.76Å; S406-L410 WeakPolarHBondContact O-CB 3.24Å; S406-L410 PolarHBondContact O-N 3.03Å
407	V	93.7	Very high	87.3	Confident	2 Å²	2	9.5 Å²	9.5	1%	0.012	5%	0.046	C	C	.	.	H	α-helix	trans	-69.9	-45.7	171.4	-179	0	0	0	0	110.7	L371 V404 Y405 Q409 L410 I411 L450 H1069	L371-V407 HydrophobicContact CB-CG2 4.19Å; L371-V407 HydrophobicContact CD2-CG2 4.03Å; V404-V407 PolarHBondContact O-N 3.06Å; Y405-V407 VanDerWaalsContact C-N 3.33Å; V407-Q409 PolarHBondContact O-N 3.17Å; V407-L410 PolarHBondContact O-N 3.06Å; V407-I411 HydrophobicContact CG1-CD1 4.05Å; V407-I411 VanDerWaalsContact O-CG1 3.31Å; V407-I411 WeakPolarHBondContact O-CG1 3.37Å; V407-I411 PolarHBondContact O-N 2.96Å; V407-L450 HydrophobicContact CG1-CD1 4.16Å; V407-H1069 HydrophobicContact CG1-CB 3.77Å
408	A	94.6	Very high	87.3	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.8	-42.9	176.4	0	0	0	0	0	112.4	V404 Y405 I411 L412 V467 Y470 M471	V404-A408 PolarHBondContact O-N 3.07Å; V404-A408 VanDerWaalsContact O-N 3.13Å; Y405-A408 PolarHBondContact O-N 3.2Å; A408-I411 WeakPolarHBondContact O-CB 3.29Å; A408-I411 PolarHBondContact O-N 3.06Å; A408-L412 PolarHBondContact O-N 3.2Å; A408-V467 HydrophobicContact CB-CG1 4.1Å; A408-V467 HydrophobicContact CB-CG2 4.48Å; A408-Y470 HydrophobicContact CB-CD1 3.52Å; A408-Y470 HydrophobicContact CB-CE1 4.19Å; A408-Y470 HydrophobicContact CB-CG 4.05Å; A408-M471 HydrophobicContact CB-CE 4.46Å; A408-M471 WeakPolarHBondContact O-CE 3Å
409	Q	91.8	Very high	87.6	Confident	6 Å²	6	9.8 Å²	9.8	3%	0.028	5%	0.047	C	C	.	.	H	α-helix	trans	-64.3	-43.6	175.3	176.2	59	24.8	0	0	112.5	F391 C394 M400 Y405 V407 I411 L412 A413 Y470	F391-Q409 HydrophobicContact CB-CB 4.34Å; F391-Q409 WeakPolarHBondContact O-CG 3.45Å; F391-Q409 PolarHBondContact O-OE1 2.87Å; C394-Q409 HydrophobicContact CB-CG 4.2Å; C394-Q409 VanDerWaalsContact O-CG 3.26Å; C394-Q409 WeakPolarHBondContact O-CG 3.45Å; C394-Q409 PolarHBondContact O-NE2 2.78Å; M400-Q409 HydrophobicContact CE-CB 4.3Å; M400-Q409 HydrophobicContact CE-CG 4.15Å; M400-Q409 HydrophobicContact SD-CB 3.86Å; M400-Q409 HydrophobicContact SD-CG 3.66Å; Y405-Q409 WeakPolarHBondContact O-CB 3.32Å; Y405-Q409 PolarHBondContact O-N 3.37Å; V407-Q409 PolarHBondContact O-N 3.17Å; Q409-I411 VanDerWaalsContact C-N 3.33Å; Q409-I411 PolarHBondContact O-N 3.25Å; Q409-L412 PolarHBondContact O-N 3.34Å; Q409-A413 WeakPolarHBondContact O-CB 3.49Å; Q409-A413 PolarHBondContact O-N 2.7Å; Q409-Y470 HydrophobicContact CB-CE1 4.02Å; Q409-Y470 PolarHBondContact OE1-OH 3.23Å
410	L	90.2	Very high	88	Confident	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-60.6	-43	176.6	174.6	68.1	0	0	0	111.6	R397 M400 S406 V407 A413 R414 D1061	R397-L410 HydrophobicContact CB-CD2 4.27Å; R397-L410 HydrophobicContact CG-CD2 4.39Å; M400-L410 HydrophobicContact CE-CB 4.19Å; S406-L410 WeakPolarHBondContact O-CB 3.24Å; S406-L410 PolarHBondContact O-N 3.03Å; V407-L410 PolarHBondContact O-N 3.06Å; L410-A413 PolarHBondContact O-N 3.43Å; L410-R414 WeakPolarHBondContact O-CB 3.3Å; L410-R414 WeakPolarHBondContact O-CG 3.37Å; L410-R414 PolarHBondContact O-N 3.06Å; L410-D1061 HydrophobicContact CD1-CB 4.32Å
411	I	91.6	Very high	87.8	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-57.2	-50.6	172	-72.5	163.5	0	0	0	109.9	V407 A408 Q409 A413 R414 L415 Q448 L450 M471 L775 H1069	V407-I411 HydrophobicContact CG1-CD1 4.05Å; V407-I411 VanDerWaalsContact O-CG1 3.31Å; V407-I411 WeakPolarHBondContact O-CG1 3.37Å; V407-I411 PolarHBondContact O-N 2.96Å; A408-I411 WeakPolarHBondContact O-CB 3.29Å; A408-I411 PolarHBondContact O-N 3.06Å; Q409-I411 VanDerWaalsContact C-N 3.33Å; Q409-I411 PolarHBondContact O-N 3.25Å; I411-A413 PolarHBondContact O-N 3.19Å; I411-R414 PolarHBondContact O-N 3.42Å; I411-L415 HydrophobicContact CG2-CD1 3.99Å; I411-L415 HydrophobicContact CG2-CG 4.37Å; I411-L415 WeakPolarHBondContact O-CG 3.11Å; I411-L415 PolarHBondContact O-N 3.39Å; I411-Q448 HydrophobicContact CG1-CB 4.46Å; I411-Q448 HydrophobicContact CG2-CB 3.89Å; I411-Q448 HydrophobicContact CG2-CG 4.14Å; I411-L450 HydrophobicContact CD1-CB 4.36Å; I411-M471 HydrophobicContact CB-CE 3.92Å; I411-M471 HydrophobicContact CG2-CE 3.51Å; I411-L775 HydrophobicContact CD1-CD1 4.07Å; I411-L775 HydrophobicContact CG2-CD1 4.08Å; I411-L775 HydrophobicContact CG2-CD2 4.33Å; I411-H1069 HydrophobicContact CD1-CB 4.43Å; I411-H1069 VanDerWaalsContact CG1-CD2 3.49Å; I411-H1069 WeakPolarHBondContact CG1-CD2 3.29Å; I411-H1069 WeakPolarHBondContact CG1-NE2 3.46Å
412	L	90.8	Very high	87.2	Confident	13 Å²	13	15 Å²	15	7%	0.068	7%	0.069	C	C	.	.	H	α-helix	trans	-60.7	-43.4	-179.6	-172	67.6	0	0	0	112.3	A408 Q409 L415 K416 M471 Q474 F535 L552	A408-L412 PolarHBondContact O-N 3.2Å; Q409-L412 PolarHBondContact O-N 3.34Å; L412-L415 PolarHBondContact O-N 3.07Å; L412-K416 WeakPolarHBondContact O-CG 3.32Å; L412-K416 PolarHBondContact O-N 2.85Å; L412-M471 HydrophobicContact CB-CE 4.21Å; L412-M471 HydrophobicContact CB-SD 4.15Å; L412-M471 HydrophobicContact CD1-SD 4.16Å; L412-Q474 HydrophobicContact CD2-CB 4.01Å; L412-Q474 HydrophobicContact CD2-CG 4.09Å; L412-F535 HydrophobicContact CD1-CE1 4.42Å; L412-L552 HydrophobicContact CD1-CB 4.42Å; L412-L552 HydrophobicContact CD1-CD1 4.06Å
413	A	86.6	Confident	86.4	Confident	6 Å²	6	16.9 Å²	16.9	5%	0.05	8%	0.078	C	C	.	.	H	α-helix	trans	-62.5	-42.5	176.8	0	0	0	0	0	111.9	Q409 L410 I411 R417	Q409-A413 WeakPolarHBondContact O-CB 3.49Å; Q409-A413 PolarHBondContact O-N 2.7Å; L410-A413 PolarHBondContact O-N 3.43Å; I411-A413 PolarHBondContact O-N 3.19Å; A413-R417 VanDerWaalsContact O-CB 3.25Å; A413-R417 WeakPolarHBondContact O-CB 3.4Å; A413-R417 PolarHBondContact O-N 3Å
414	R	87.1	Confident	85.4	Confident	2 Å²	2	18 Å²	18	1%	0.008	9%	0.085	C	C	.	.	H	α-helix	trans	-66.8	-38.6	175.3	-73.4	173.8	170.7	-158.6	-4.3	112.7	L410 I411 R417 R418 Q448 G1058 D1061 G1063 P1064 H1069	L410-R414 WeakPolarHBondContact O-CB 3.3Å; L410-R414 WeakPolarHBondContact O-CG 3.37Å; L410-R414 PolarHBondContact O-N 3.06Å; I411-R414 PolarHBondContact O-N 3.42Å; R414-R417 PolarHBondContact O-N 2.98Å; R414-R418 WeakPolarHBondContact O-CB 3.33Å; R414-R418 PolarHBondContact O-N 3.3Å; R414-Q448 VanDerWaalsContact CD-OE1 3.31Å; R414-G1058 PolarHBondContact NH2-O 3.05Å; R414-D1061 WeakPolarHBondContact CG-OD2 3.41Å; R414-D1061 IonicContact CZ-OD1 2.66Å; R414-D1061 IonicContact CZ-OD2 3.92Å; R414-D1061 IonicContact NE-OD1 3.12Å; R414-D1061 PolarHBondContact NE-OD1 2.81Å; R414-D1061 IonicContact NE-OD2 3.17Å; R414-D1061 PolarHBondContact NE-OD2 2.81Å; R414-D1061 IonicContact NH2-OD1 3.94Å; R414-D1061 PolarHBondContact NH2-OD1 3.46Å; R414-D1061 IonicContact NH2-OD2 3.04Å; R414-G1063 VanDerWaalsContact NH2-C 3.3Å; R414-G1063 VanDerWaalsContact NH2-CA 3.34Å; R414-P1064 VanDerWaalsContact CZ-O 3.3Å; R414-P1064 PolarHBondContact NH1-O 3.25Å; R414-P1064 PolarHBondContact NH2-O 3.4Å; R414-H1069 PolarHBondContact NH1-CE1 3.37Å
415	L	87.9	Confident	84.1	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-64.3	-47.5	174.4	-70.4	179	0	0	0	111.7	I411 L412 R417 R418 L419 S446 Q448 F535 L552 A773	I411-L415 HydrophobicContact CG2-CD1 3.99Å; I411-L415 HydrophobicContact CG2-CG 4.37Å; I411-L415 WeakPolarHBondContact O-CG 3.11Å; I411-L415 PolarHBondContact O-N 3.39Å; L412-L415 PolarHBondContact O-N 3.07Å; L415-R417 VanDerWaalsContact C-N 3.34Å; L415-R417 PolarHBondContact O-N 2.88Å; L415-R418 PolarHBondContact O-N 3.17Å; L415-L419 WeakPolarHBondContact O-CB 3.41Å; L415-L419 PolarHBondContact O-N 3.37Å; L415-S446 WeakPolarHBondContact CD2-O 3.23Å; L415-Q448 HydrophobicContact CD2-CB 4.33Å; L415-Q448 HydrophobicContact CD2-CG 3.71Å; L415-Q448 HydrophobicContact CG-CG 3.95Å; L415-F535 HydrophobicContact CD1-CD2 4.2Å; L415-F535 HydrophobicContact CD1-CE2 3.98Å; L415-L552 HydrophobicContact CB-CD1 3.97Å; L415-A773 HydrophobicContact CB-CB 4.26Å; L415-A773 HydrophobicContact CD1-CB 4.38Å; L415-A773 HydrophobicContact CD2-CB 4.07Å; L415-A773 HydrophobicContact CG-CB 4.47Å
416	K	86.2	Confident	82.8	Confident	30 Å²	30	25.3 Å²	25.3	13%	0.13	12%	0.123	C	C	.	.	H	α-helix	trans	-56.3	-47.8	172.6	-74.5	-166.3	-177.9	-154.6	0	111.5	L412 L419 F420 E548 I550 L552	L412-K416 WeakPolarHBondContact O-CG 3.32Å; L412-K416 PolarHBondContact O-N 2.85Å; K416-L419 PolarHBondContact O-N 3.26Å; K416-F420 WeakPolarHBondContact O-CB 3.46Å; K416-F420 PolarHBondContact O-N 2.81Å; K416-E548 PolarHBondContact NZ-O 3.35Å; K416-I550 WeakPolarHBondContact CD-O 3.46Å; K416-I550 WeakPolarHBondContact CE-O 3.47Å; K416-I550 HydrophobicContact CG-CB 4.41Å; K416-I550 HydrophobicContact CG-CG2 4.21Å; K416-I550 PolarHBondContact NZ-O 3.09Å; K416-I550 WeakPolarHBondContact O-CD1 3.14Å; K416-L552 HydrophobicContact CG-CD1 3.88Å; K416-L552 HydrophobicContact CG-CG 4.12Å
417	R	80.6	Confident	81.4	Confident	43 Å²	43	27.5 Å²	27.5	16%	0.162	13%	0.133	C	C	.	.	H	α-helix	trans	-62.3	-46.4	-179.5	-165.7	-178	-59.1	138	1.4	112	Q395 A413 R414 L415 L419 F420 Y421 D1061	Q395-R417 PolarHBondContact O-NH2 3.39Å; A413-R417 VanDerWaalsContact O-CB 3.25Å; A413-R417 WeakPolarHBondContact O-CB 3.4Å; A413-R417 PolarHBondContact O-N 3Å; R414-R417 PolarHBondContact O-N 2.98Å; L415-R417 VanDerWaalsContact C-N 3.34Å; L415-R417 PolarHBondContact O-N 2.88Å; R417-L419 VanDerWaalsContact C-N 3.33Å; R417-L419 PolarHBondContact O-N 3.04Å; R417-F420 PolarHBondContact O-N 3.22Å; R417-Y421 HydrophobicContact CG-CD2 4.48Å; R417-Y421 HydrophobicContact CG-CE2 4.18Å; R417-Y421 WeakPolarHBondContact O-CD2 3.45Å; R417-Y421 PolarHBondContact O-N 3.46Å; R417-D1061 IonicContact CZ-OD2 3.22Å; R417-D1061 IonicContact NH1-OD2 2.63Å; R417-D1061 PolarHBondContact NH1-OD2 2.77Å
418	R	80.6	Confident	79.5	Confident	29 Å²	29	33 Å²	33	11%	0.109	16%	0.159	C	C	.	.	H	α-helix	trans	-65.1	-37.4	178.6	-161.5	172.8	-165.2	139.8	14.8	112.1	R414 L415 S422 S446 H1046 N1047 D1054 P1055	R414-R418 WeakPolarHBondContact O-CB 3.33Å; R414-R418 PolarHBondContact O-N 3.3Å; L415-R418 PolarHBondContact O-N 3.17Å; R418-S422 PolarHBondContact O-N 3.5Å; R418-S446 WeakPolarHBondContact CB-OG 3.49Å; R418-S446 WeakPolarHBondContact CG-OG 3.37Å; R418-H1046 PolarHBondContact NH1-O 3.13Å; R418-H1046 PolarHBondContact NH2-CE1 3.08Å; R418-H1046 PolarHBondContact NH2-O 2.95Å; R418-N1047 PolarHBondContact NH1-OD1 3.07Å; R418-D1054 IonicContact CZ-OD1 2.64Å; R418-D1054 IonicContact NH2-OD1 2.66Å; R418-D1054 PolarHBondContact NH2-OD1 3.02Å; R418-D1054 IonicContact NH2-OD2 2.69Å; R418-D1054 PolarHBondContact NH2-OD2 2.9Å; R418-P1055 HydrophobicContact CG-CB 4.45Å
419	L	80.7	Confident	77.5	Confident	9 Å²	9	39.1 Å²	39.1	5%	0.047	19%	0.187	C	C	.	.	H	α-helix	trans	-69.9	-41.1	176.7	-168.6	141.5	0	0	0	113	L415 K416 R417 S422 I423 N537 I550 L552 A772 A773	L415-L419 WeakPolarHBondContact O-CB 3.41Å; L415-L419 PolarHBondContact O-N 3.37Å; K416-L419 PolarHBondContact O-N 3.26Å; R417-L419 VanDerWaalsContact C-N 3.33Å; R417-L419 PolarHBondContact O-N 3.04Å; L419-S422 WeakPolarHBondContact O-CB 3.4Å; L419-S422 PolarHBondContact O-N 3.5Å; L419-S422 VanDerWaalsContact O-N 3.14Å; L419-I423 HydrophobicContact CD2-CD1 3.6Å; L419-I423 HydrophobicContact CD2-CG1 4.35Å; L419-I423 PolarHBondContact O-N 2.96Å; L419-I423 VanDerWaalsContact O-N 3.08Å; L419-N537 HydrophobicContact CD2-CB 4.4Å; L419-I550 HydrophobicContact CD2-CD1 3.89Å; L419-I550 HydrophobicContact CD2-CG1 4.4Å; L419-I550 HydrophobicContact CD2-CG2 3.9Å; L419-L552 HydrophobicContact CD1-CD2 4.04Å; L419-A772 HydrophobicContact CD1-CB 3.42Å; L419-A772 VanDerWaalsContact CD1-CB 3.42Å; L419-A773 HydrophobicContact CD1-CB 4.5Å
420	F	79.6	Confident	75.5	Confident	23 Å²	23	45 Å²	45	10%	0.101	21%	0.214	C	C	.	.	H	α-helix	trans	-51.5	-59.7	177.3	174.8	-112.2	0	0	0	112.8	K416 R417 S422 I423 V424 V544 N545 Q546 P547 I550	K416-F420 WeakPolarHBondContact O-CB 3.46Å; K416-F420 PolarHBondContact O-N 2.81Å; R417-F420 PolarHBondContact O-N 3.22Å; F420-S422 PolarHBondContact O-N 3.16Å; F420-I423 WeakPolarHBondContact O-CB 3.41Å; F420-I423 PolarHBondContact O-N 2.98Å; F420-V424 HydrophobicContact CD2-CG2 4.26Å; F420-V424 HydrophobicContact CE1-CG2 4.19Å; F420-V424 HydrophobicContact CE2-CG2 3.85Å; F420-V424 HydrophobicContact CZ-CG2 3.82Å; F420-V424 WeakPolarHBondContact O-CG2 3.47Å; F420-V424 PolarHBondContact O-N 3.08Å; F420-V544 HydrophobicContact CD2-CB 4.49Å; F420-V544 HydrophobicContact CD2-CG1 3.82Å; F420-V544 HydrophobicContact CE2-CB 4.42Å; F420-V544 HydrophobicContact CE2-CG1 3.97Å; F420-V544 WeakPolarHBondContact CE2-O 3.17Å; F420-N545 WeakPolarHBondContact CZ-O 3.34Å; F420-Q546 VanDerWaalsContact CE2-C 3.47Å; F420-P547 HydrophobicContact CB-CB 3.83Å; F420-P547 HydrophobicContact CD1-CB 4.16Å; F420-P547 HydrophobicContact CD1-CG 4.48Å; F420-P547 HydrophobicContact CD2-CB 4.41Å; F420-P547 HydrophobicContact CG-CB 3.88Å; F420-I550 VanDerWaalsContact CA-CD1 3.42Å; F420-I550 HydrophobicContact CB-CD1 3.46Å; F420-I550 VanDerWaalsContact CB-CD1 3.46Å; F420-I550 HydrophobicContact CD2-CD1 4.13Å; F420-I550 HydrophobicContact CG-CD1 4.29Å
421	Y	75.4	Confident	73.4	Confident	103 Å²	103	51.7 Å²	51.7	40%	0.404	25%	0.25	S	S	.	.	H	α-helix	trans	-66.3	-26	-179	-76.5	-98.8	0	0	0	112.3	R417 I423 N425 P1055	R417-Y421 HydrophobicContact CG-CD2 4.48Å; R417-Y421 HydrophobicContact CG-CE2 4.18Å; R417-Y421 WeakPolarHBondContact O-CD2 3.45Å; R417-Y421 PolarHBondContact O-N 3.46Å; Y421-I423 VanDerWaalsContact C-N 3.32Å; Y421-N425 WeakPolarHBondContact O-CB 3.24Å; Y421-N425 PolarHBondContact O-N 2.94Å; Y421-N425 PolarHBondContact O-ND2 3.09Å; Y421-P1055 HydrophobicContact CD1-CG 3.85Å; Y421-P1055 HydrophobicContact CD2-CB 3.55Å; Y421-P1055 HydrophobicContact CD2-CG 3.69Å; Y421-P1055 HydrophobicContact CE2-CB 4.26Å; Y421-P1055 HydrophobicContact CE2-CG 4.45Å; Y421-P1055 HydrophobicContact CG-CB 3.73Å; Y421-P1055 HydrophobicContact CG-CG 3.32Å
422	S	73	Confident	71.3	Confident	38 Å²	38	59.8 Å²	59.8	27%	0.266	29%	0.288	S	S	.	.	H	α-helix	trans	-68.7	-31.6	173.4	-162.7	0	0	0	0	112.5	R418 L419 F420 M426 C443	R418-S422 PolarHBondContact O-N 3.5Å; L419-S422 WeakPolarHBondContact O-CB 3.4Å; L419-S422 PolarHBondContact O-N 3.5Å; L419-S422 VanDerWaalsContact O-N 3.14Å; F420-S422 PolarHBondContact O-N 3.16Å; S422-M426 WeakPolarHBondContact O-CG 3.08Å; S422-M426 PolarHBondContact O-N 3.31Å; S422-C443 PolarHBondContact OG-SG 3.11Å
423	I	73	Confident	68.8	Low	44 Å²	44	66.5 Å²	66.5	23%	0.226	32%	0.321	C	S	.	.	H	α-helix	trans	-70.7	-53.4	170.8	-65.7	172.5	0	0	0	109.6	L419 F420 Y421 N425 M426 E427 V544	L419-I423 HydrophobicContact CD2-CD1 3.6Å; L419-I423 HydrophobicContact CD2-CG1 4.35Å; L419-I423 PolarHBondContact O-N 2.96Å; L419-I423 VanDerWaalsContact O-N 3.08Å; F420-I423 WeakPolarHBondContact O-CB 3.41Å; F420-I423 PolarHBondContact O-N 2.98Å; Y421-I423 VanDerWaalsContact C-N 3.32Å; I423-N425 VanDerWaalsContact C-N 3.3Å; I423-N425 PolarHBondContact O-N 3.47Å; I423-M426 WeakPolarHBondContact O-CA 3.49Å; I423-M426 WeakPolarHBondContact O-CB 3.35Å; I423-M426 PolarHBondContact O-N 3.25Å; I423-E427 HydrophobicContact CG2-CG 4.45Å; I423-E427 WeakPolarHBondContact CG2-OE1 3.29Å; I423-E427 PolarHBondContact O-N 3.24Å; I423-V544 HydrophobicContact CG2-CG2 4.41Å
424	V	70.6	Confident	66.2	Low	27 Å²	27	75.1 Å²	75.1	16%	0.164	37%	0.366	C	S	.	.	H	α-helix	trans	-57.9	-40.1	-178.2	173.9	0	0	0	0	112.1	F420 M426 E427 Q428	F420-V424 HydrophobicContact CD2-CG2 4.26Å; F420-V424 HydrophobicContact CE1-CG2 4.19Å; F420-V424 HydrophobicContact CE2-CG2 3.85Å; F420-V424 HydrophobicContact CZ-CG2 3.82Å; F420-V424 WeakPolarHBondContact O-CG2 3.47Å; F420-V424 PolarHBondContact O-N 3.08Å; V424-M426 VanDerWaalsContact C-N 3.32Å; V424-M426 PolarHBondContact O-N 3.38Å; V424-E427 PolarHBondContact O-N 2.97Å; V424-Q428 HydrophobicContact CG1-CG 4.46Å; V424-Q428 WeakPolarHBondContact O-CG 3.38Å; V424-Q428 PolarHBondContact O-N 3.49Å
425	N	68.2	Low	63.7	Low	75 Å²	75	77.7 Å²	77.7	40%	0.401	39%	0.394	S	S	.	.	H	α-helix	trans	-66.3	-32.1	176.5	-72.1	-18.5	0	0	0	112.7	Y421 I423 Q429	Y421-N425 WeakPolarHBondContact O-CB 3.24Å; Y421-N425 PolarHBondContact O-N 2.94Å; Y421-N425 PolarHBondContact O-ND2 3.09Å; I423-N425 VanDerWaalsContact C-N 3.3Å; I423-N425 PolarHBondContact O-N 3.47Å; N425-Q429 VanDerWaalsContact O-CG 3.3Å; N425-Q429 WeakPolarHBondContact O-CG 3.12Å; N425-Q429 PolarHBondContact O-N 2.88Å
426	M	65.7	Low	60.9	Low	80 Å²	80	84.7 Å²	84.7	39%	0.394	43%	0.431	S	S	.	.	H	α-helix	trans	-72	-41	174.9	-67.4	-97.2	-77.6	0	0	111.1	S422 I423 V424 Q429 Q430	S422-M426 WeakPolarHBondContact O-CG 3.08Å; S422-M426 PolarHBondContact O-N 3.31Å; I423-M426 WeakPolarHBondContact O-CA 3.49Å; I423-M426 WeakPolarHBondContact O-CB 3.35Å; I423-M426 PolarHBondContact O-N 3.25Å; V424-M426 VanDerWaalsContact C-N 3.32Å; V424-M426 PolarHBondContact O-N 3.38Å; M426-Q429 PolarHBondContact O-N 3.48Å; M426-Q430 WeakPolarHBondContact O-CG 3.33Å; M426-Q430 PolarHBondContact O-N 2.95Å; M426-Q430 VanDerWaalsContact O-N 3.1Å
427	E	61.4	Low	58.4	Low	47 Å²	47	87.8 Å²	87.8	22%	0.22	45%	0.454	C	S	.	.	H	α-helix	trans	-64.4	-42.3	175.9	-69.1	173.2	-178.4	0	0	111.9	I423 V424 Q429 Q430 N431	I423-E427 HydrophobicContact CG2-CG 4.45Å; I423-E427 WeakPolarHBondContact CG2-OE1 3.29Å; I423-E427 PolarHBondContact O-N 3.24Å; V424-E427 PolarHBondContact O-N 2.97Å; E427-Q429 VanDerWaalsContact C-N 3.31Å; E427-Q429 PolarHBondContact O-N 2.69Å; E427-Q430 PolarHBondContact O-N 2.68Å; E427-N431 PolarHBondContact O-N 3.37Å; E427-N431 VanDerWaalsContact O-N 3.14Å; E427-N431 PolarHBondContact O-ND2 2.77Å
428	Q	54.9	Low	56	Low	118 Å²	118	91.5 Å²	91.5	55%	0.551	48%	0.481	S	S	*	.	H	α-helix	trans	-63.2	-34.8	175.1	-72.7	-179.3	19.6	0	0	112.8	V424	V424-Q428 HydrophobicContact CG1-CG 4.46Å; V424-Q428 WeakPolarHBondContact O-CG 3.38Å; V424-Q428 PolarHBondContact O-N 3.49Å
429	Q	52.1	Low	53.7	Low	127 Å²	127	99.4 Å²	99.4	59%	0.593	51%	0.512	S	S	*	.	H	α-helix	trans	-70.9	-33.7	174.7	-73.4	175.5	25.9	0	0	112.7	N425 M426 E427	N425-Q429 VanDerWaalsContact O-CG 3.3Å; N425-Q429 WeakPolarHBondContact O-CG 3.12Å; N425-Q429 PolarHBondContact O-N 2.88Å; M426-Q429 PolarHBondContact O-N 3.48Å; E427-Q429 VanDerWaalsContact C-N 3.31Å; E427-Q429 PolarHBondContact O-N 2.69Å
430	Q	49.2	Very low	51.2	Low	129 Å²	129	106.9 Å²	106.9	60%	0.603	55%	0.547	S	S	*	.	H	α-helix	trans	-66.9	-39.8	175	-71.2	179.6	31.5	0	0	112.3	M426 E427 H432 M433	M426-Q430 WeakPolarHBondContact O-CG 3.33Å; M426-Q430 PolarHBondContact O-N 2.95Å; M426-Q430 VanDerWaalsContact O-N 3.1Å; E427-Q430 PolarHBondContact O-N 2.68Å; Q430-H432 PolarHBondContact O-N 3.22Å; Q430-H432 VanDerWaalsContact O-N 3.1Å; Q430-M433 PolarHBondContact O-N 2.83Å
431	N	45.2	Very low	48.8	Very low	141 Å²	141	111.9 Å²	111.9	75%	0.754	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-10.9	-179	-77.9	-46.3	0	0	0	114.8	E427	E427-N431 PolarHBondContact O-N 3.37Å; E427-N431 VanDerWaalsContact O-N 3.14Å; E427-N431 PolarHBondContact O-ND2 2.77Å
432	H	49.5	Very low	47	Very low	171 Å²	171	112.5 Å²	112.5	79%	0.792	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-0.4	178.9	-96.1	-65.2	0	0	0	115.5	Q430	Q430-H432 PolarHBondContact O-N 3.22Å; Q430-H432 VanDerWaalsContact O-N 3.1Å
433	M	37.4	Very low	45.5	Very low	153 Å²	153	113.9 Å²	113.9	75%	0.754	60%	0.599	S	S	*	*			trans	-130.8	104.4	-177	-80.6	-68	-175.7	0	0	114.1	Q430 G435	Q430-M433 PolarHBondContact O-N 2.83Å; M433-G435 VanDerWaalsContact C-N 3.26Å; M433-G435 PolarHBondContact O-N 3.38Å
434	N	33	Very low	44.9	Very low	187 Å²	187	115.9 Å²	115.9	100%	1	62%	0.617	S	S	*	*			trans	-73	72.7	167	-89.4	-43.4	0	0	0	111.6
435	G	33.1	Very low	44.9	Very low	57 Å²	57	117 Å²	117	59%	0.588	62%	0.622	S	S	*	*	S	Bend	trans	170.1	117.1	170.2	0	0	0	0	0	116.2	M433	M433-G435 VanDerWaalsContact C-N 3.26Å; M433-G435 PolarHBondContact O-N 3.38Å
436	N	30.2	Very low	45.3	Very low	148 Å²	148	113.6 Å²	113.6	79%	0.791	60%	0.604	S	S	*	*			trans	50.7	111.2	167.5	-69.2	-12.1	0	0	0	117.7	V438	N436-V438 PolarHBondContact O-N 3.44Å
437	P	33.6	Very low	46.2	Very low	94 Å²	94	111.9 Å²	111.9	61%	0.61	60%	0.595	S	S	*	*			trans	-70.8	104.1	172.9	30.1	-33.9	0	0	0	111.2	Y439	P437-Y439 HydrophobicContact CB-CD2 4.18Å; P437-Y439 HydrophobicContact CB-CE2 3.75Å; P437-Y439 HydrophobicContact CG-CD2 4.49Å; P437-Y439 HydrophobicContact CG-CE2 3.88Å; P437-Y439 WeakPolarHBondContact O-CD2 2.96Å; P437-Y439 PolarHBondContact O-N 2.86Å
438	V	29	Very low	47.6	Very low	122 Å²	122	109.8 Å²	109.8	74%	0.739	59%	0.585	S	S	*	*			trans	-83.6	94.9	171.5	-179.4	0	0	0	0	108.8	N436 H440	N436-V438 PolarHBondContact O-N 3.44Å; V438-H440 PolarHBondContact O-N 3.43Å
439	Y	33.1	Very low	49.4	Very low	195 Å²	195	104.1 Å²	104.1	77%	0.765	56%	0.559	S	S	*	*			trans	-72.1	47.4	179	-71.9	-82.9	0	0	0	113.9	P437	P437-Y439 HydrophobicContact CB-CD2 4.18Å; P437-Y439 HydrophobicContact CB-CE2 3.75Å; P437-Y439 HydrophobicContact CG-CD2 4.49Å; P437-Y439 HydrophobicContact CG-CE2 3.88Å; P437-Y439 WeakPolarHBondContact O-CD2 2.96Å; P437-Y439 PolarHBondContact O-N 2.86Å
440	H	27.2	Very low	51.5	Low	166 Å²	166	98.1 Å²	98.1	77%	0.769	53%	0.531	S	S	*	.			trans	-143.8	74.7	176.1	-79.6	-57.9	0	0	0	112.8	V438	V438-H440 PolarHBondContact O-N 3.43Å
441	L	30.1	Very low	53.7	Low	127 Å²	127	92 Å²	92	67%	0.665	50%	0.502	S	S	*	.			trans	-118.7	128.1	147.4	-127	78.3	0	0	0	107.7	C443	L441-C443 PolarHBondContact O-N 2.88Å; L441-C443 VanDerWaalsContact O-N 3.12Å
442	P	37.4	Very low	56.1	Low	117 Å²	117	85.4 Å²	85.4	76%	0.76	47%	0.467	S	S	*	.			trans	-71.6	106.6	170.8	29.2	-31.3	0	0	0	108.4	S444	P442-S444 PolarHBondContact O-N 3.46Å
443	C	42.4	Very low	58.1	Low	66 Å²	66	77.3 Å²	77.3	45%	0.446	43%	0.429	S	S	.	.			trans	-59.5	110.7	166.7	178.5	0	0	0	0	108.2	S422 L441 I445	S422-C443 PolarHBondContact OG-SG 3.11Å; L441-C443 PolarHBondContact O-N 2.88Å; L441-C443 VanDerWaalsContact O-N 3.12Å; C443-I445 PolarHBondContact O-N 3.16Å; C443-I445 VanDerWaalsContact O-N 3.07Å
444	S	60.2	Low	60.7	Low	86 Å²	86	70.1 Å²	70.1	60%	0.601	39%	0.394	S	S	*	.			trans	-57.4	115.7	177.6	-60.7	0	0	0	0	109.4	P442 S446	P442-S444 PolarHBondContact O-N 3.46Å; S444-S446 PolarHBondContact O-N 3.32Å
445	I	70.3	Confident	63.3	Low	51 Å²	51	61.9 Å²	61.9	26%	0.262	35%	0.35	S	S	.	.			trans	-53.2	128	-174.3	-62	174.7	0	0	0	109.1	C443 Q447 V771 Q774	C443-I445 PolarHBondContact O-N 3.16Å; C443-I445 VanDerWaalsContact O-N 3.07Å; I445-Q447 PolarHBondContact O-N 3.41Å; I445-V771 HydrophobicContact CD1-CG1 4.49Å; I445-Q774 HydrophobicContact CG2-CB 3.73Å
446	S	76.6	Confident	65.8	Low	4 Å²	4	60.3 Å²	60.3	3%	0.028	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	107.6	-179.7	-71.6	0	0	0	0	109.5	L415 R418 S444 A772 A773 Q774	L415-S446 WeakPolarHBondContact CD2-O 3.23Å; R418-S446 WeakPolarHBondContact CB-OG 3.49Å; R418-S446 WeakPolarHBondContact CG-OG 3.37Å; S444-S446 PolarHBondContact O-N 3.32Å; S446-A772 PolarHBondContact N-O 3.17Å; S446-A773 CarbonylContact O-C 3.42Å; S446-A773 VanDerWaalsContact O-CA 3.29Å; S446-A773 WeakPolarHBondContact O-CA 3.38Å; S446-Q774 PolarHBondContact O-N 3.29Å
447	Q	85.1	Confident	68.4	Low	43 Å²	43	53.8 Å²	53.8	20%	0.201	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	139.1	-175.5	-77.4	173.1	-19.5	0	0	112.4	I445 Q774 C1043 N1047	I445-Q447 PolarHBondContact O-N 3.41Å; Q447-Q774 WeakPolarHBondContact CA-O 3.24Å; Q447-Q774 HydrophobicContact CG-CB 4.17Å; Q447-C1043 PolarHBondContact OE1-SG 2.98Å; Q447-N1047 PolarHBondContact O-ND2 2.77Å; Q447-N1047 PolarHBondContact O-OD1 3.45Å
448	Q	90.6	Very high	71.1	Confident	3 Å²	3	49.3 Å²	49.3	1%	0.014	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	154.5	162.7	-68.4	-68.8	-85.5	0	0	109.4	I411 R414 L415 Q774 L775 I776 N1047 G1067 H1069	I411-Q448 HydrophobicContact CG1-CB 4.46Å; I411-Q448 HydrophobicContact CG2-CB 3.89Å; I411-Q448 HydrophobicContact CG2-CG 4.14Å; R414-Q448 VanDerWaalsContact CD-OE1 3.31Å; L415-Q448 HydrophobicContact CD2-CB 4.33Å; L415-Q448 HydrophobicContact CD2-CG 3.71Å; L415-Q448 HydrophobicContact CG-CG 3.95Å; Q448-Q774 PolarHBondContact N-O 3.24Å; Q448-L775 HydrophobicContact CB-CD1 4.46Å; Q448-I776 PolarHBondContact O-N 3.44Å; Q448-N1047 PolarHBondContact NE2-ND2 2.86Å; Q448-N1047 PolarHBondContact NE2-OD1 3.47Å; Q448-G1067 PolarHBondContact OE1-O 3.13Å; Q448-H1069 PolarHBondContact OE1-NE2 3.46Å
449	V	92.6	Very high	74	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.1	-178.2	-179.9	0	0	0	0	110	I776 L1040 C1043 G1067 M1068 H1069	V449-I776 CarbonylContact C-O 3.58Å; V449-I776 WeakPolarHBondContact CA-O 3.37Å; V449-I776 HydrophobicContact CG2-CB 4.44Å; V449-I776 HydrophobicContact CG2-CD1 4.39Å; V449-L1040 HydrophobicContact CG1-CD2 3.77Å; V449-L1040 HydrophobicContact CG2-CD2 4.17Å; V449-C1043 HydrophobicContact CG2-CB 4.08Å; V449-G1067 PolarHBondContact N-O 2.9Å; V449-G1067 VanDerWaalsContact N-O 3.15Å; V449-M1068 HydrophobicContact CB-CB 4.09Å; V449-M1068 HydrophobicContact CB-CG 3.92Å; V449-M1068 HydrophobicContact CB-SD 4.22Å; V449-M1068 HydrophobicContact CG1-CB 4.47Å; V449-M1068 HydrophobicContact CG1-CG 3.76Å; V449-M1068 HydrophobicContact CG1-SD 3.64Å; V449-M1068 CarbonylContact O-C 3.51Å; V449-M1068 WeakPolarHBondContact O-CA 3.38Å; V449-H1069 PolarHBondContact O-CD2 2.81Å; V449-H1069 PolarHBondContact O-N 2.85Å
450	L	95.7	Very high	76.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118.8	171.8	174.6	61.1	0	0	0	110	V407 I411 L452 V467 L775 I776 L777 V778 H1069 I1071	V407-L450 HydrophobicContact CG1-CD1 4.16Å; I411-L450 HydrophobicContact CD1-CB 4.36Å; L450-L452 HydrophobicContact CD1-CD2 4.19Å; L450-L452 HydrophobicContact CD2-CD2 4.47Å; L450-L452 HydrophobicContact CG-CD2 4.17Å; L450-V467 HydrophobicContact CD2-CB 4.25Å; L450-V467 HydrophobicContact CD2-CG1 3.9Å; L450-V467 HydrophobicContact CD2-CG2 3.79Å; L450-L775 HydrophobicContact CB-CD1 4.08Å; L450-I776 PolarHBondContact N-O 3.02Å; L450-L777 HydrophobicContact CB-CG 4.42Å; L450-L777 HydrophobicContact CD2-CD1 3.75Å; L450-L777 HydrophobicContact CD2-CG 4.09Å; L450-L777 HydrophobicContact CG-CG 4.31Å; L450-L777 WeakPolarHBondContact O-CA 3.48Å; L450-V778 PolarHBondContact O-N 3.25Å; L450-H1069 WeakPolarHBondContact CA-O 3.39Å; L450-H1069 HydrophobicContact CD1-CB 4.05Å; L450-H1069 WeakPolarHBondContact CD1-O 3.4Å; L450-I1071 HydrophobicContact CD1-CD1 3.83Å; L450-I1071 HydrophobicContact CD1-CG1 3.87Å
451	C	95.2	Very high	80	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.014	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	124	-179.7	-70	0	0	0	0	110.9	M1068 H1069 W1070 I1071	C451-M1068 VanDerWaalsContact SG-SD 3.67Å; C451-H1069 PolarHBondContact N-O 3.07Å; C451-W1070 HydrophobicContact CB-CD2 4Å; C451-W1070 HydrophobicContact CB-CE3 3.41Å; C451-W1070 VanDerWaalsContact CB-CE3 3.41Å; C451-W1070 HydrophobicContact CB-CH2 3.87Å; C451-W1070 HydrophobicContact CB-CZ2 4.38Å; C451-W1070 HydrophobicContact CB-CZ3 3.33Å; C451-I1071 PolarHBondContact O-N 3.12Å
452	L	95.4	Very high	82.9	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.3	177.7	-51.9	-175.4	0	0	0	110.2	L450 K460 I463 S464 L777 V778 D779 P780 I1071	L450-L452 HydrophobicContact CD1-CD2 4.19Å; L450-L452 HydrophobicContact CD2-CD2 4.47Å; L450-L452 HydrophobicContact CG-CD2 4.17Å; L452-K460 HydrophobicContact CB-CB 4.27Å; L452-K460 HydrophobicContact CB-CD 4.03Å; L452-K460 HydrophobicContact CB-CG 4.22Å; L452-K460 HydrophobicContact CD1-CB 4.26Å; L452-K460 VanDerWaalsContact CD1-O 3.32Å; L452-K460 WeakPolarHBondContact CD1-O 3.11Å; L452-I463 HydrophobicContact CD1-CG2 4.39Å; L452-I463 HydrophobicContact CD2-CG2 3.93Å; L452-S464 WeakPolarHBondContact CD1-OG 3.49Å; L452-L777 HydrophobicContact CD1-CD2 4.31Å; L452-V778 PolarHBondContact N-O 3.05Å; L452-D779 HydrophobicContact CD1-CB 4.29Å; L452-P780 WeakPolarHBondContact O-CD 3.08Å; L452-P780 WeakPolarHBondContact O-CG 3.48Å; L452-I1071 HydrophobicContact CD2-CB 3.77Å; L452-I1071 HydrophobicContact CD2-CD1 3.94Å; L452-I1071 HydrophobicContact CD2-CG1 4.06Å
453	L	92.7	Very high	85.6	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	150.8	178.4	-76.2	-176.8	0	0	0	110.9	P780 Y828 F831 W1070 I1071 H1072 C1073	L453-P780 HydrophobicContact CD2-CG 4.33Å; L453-Y828 WeakPolarHBondContact CB-OH 3.36Å; L453-Y828 HydrophobicContact CD2-CD2 4.46Å; L453-Y828 HydrophobicContact CD2-CE1 4.19Å; L453-Y828 HydrophobicContact CD2-CE2 3.98Å; L453-F831 HydrophobicContact CD2-CB 3.8Å; L453-F831 HydrophobicContact CD2-CG 4.5Å; L453-W1070 HydrophobicContact CD1-CE3 3.84Å; L453-W1070 HydrophobicContact CD1-CZ3 3.58Å; L453-W1070 HydrophobicContact CG-CE3 4.22Å; L453-W1070 HydrophobicContact CG-CZ3 3.97Å; L453-I1071 PolarHBondContact N-O 2.76Å; L453-H1072 CarbonylContact O-C 3.58Å; L453-H1072 WeakPolarHBondContact O-CA 3.4Å; L453-C1073 WeakPolarHBondContact O-CB 3.04Å; L453-C1073 PolarHBondContact O-N 3.05Å
454	G	90.3	Very high	88.1	Confident	2 Å²	2	20.2 Å²	20.2	2%	0.021	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.2	160.8	-179.1	0	0	0	0	0	114.1	K460 G782 F783 Y828 C1073	G454-K460 PolarHBondContact O-NZ 2.75Å; G454-G782 WeakPolarHBondContact O-CA 3.41Å; G454-F783 PolarHBondContact O-N 2.87Å; G454-Y828 WeakPolarHBondContact CA-OH 3.32Å; G454-Y828 PolarHBondContact N-OH 2.95Å; G454-C1073 VanDerWaalsContact CA-O 3.29Å; G454-C1073 WeakPolarHBondContact CA-O 3.42Å
455	R	87.9	Confident	89.7	Confident	15 Å²	15	17.5 Å²	17.5	6%	0.057	10%	0.097	C	C	.	.	B	Isolated β-bridge	trans	-61.6	171.6	178.1	-69.1	-179.6	173.9	-160	0.7	112.6	S458 K460 F783 L959 T961 L1075 L1149	R455-S458 PolarHBondContact O-OG 3.05Å; R455-S458 VanDerWaalsContact O-OG 3.09Å; R455-K460 PolarHBondContact O-NZ 2.77Å; R455-F783 HydrophobicContact CG-CB 4.32Å; R455-L959 HydrophobicContact CG-CD2 4.4Å; R455-L959 PolarHBondContact NE-O 3.36Å; R455-L959 PolarHBondContact NH2-O 3.05Å; R455-T961 PolarHBondContact NH1-OG1 3.43Å; R455-T961 PolarHBondContact NH2-OG1 2.69Å; R455-T961 VanDerWaalsContact NH2-OG1 3.08Å; R455-L1075 HydrophobicContact CB-CD1 3.77Å; R455-L1075 HydrophobicContact CB-CG 4.38Å; R455-L1075 HydrophobicContact CG-CD1 4.47Å; R455-L1149 VanDerWaalsContact NH1-CD1 3.31Å
456	S	86.5	Confident	90.8	Very high	23 Å²	23	16 Å²	16	16%	0.161	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	145.7	167.2	-163.9	0	0	0	0	110.3	S458 N521	S456-S458 VanDerWaalsContact C-N 3.3Å; S456-S458 PolarHBondContact O-N 3.19Å; S456-N521 WeakPolarHBondContact OG-CB 3.49Å; S456-N521 PolarHBondContact OG-ND2 3.31Å; S456-N521 VanDerWaalsContact OG-ND2 3.08Å
457	G	85.2	Confident	91.7	Very high	11 Å²	11	15.8 Å²	15.8	11%	0.113	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	5.7	179.9	0	0	0	0	0	116.6	N375 N521 L1075	N375-G457 PolarHBondContact ND2-O 3.08Å; G457-N521 PolarHBondContact N-ND2 2.87Å; G457-L1075 WeakPolarHBondContact O-CD2 3.43Å
458	S	89.9	Confident	92.2	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.007	8%	0.078	C	C	.	.	S	Bend	trans	-89	7.6	-176.1	75	0	0	0	0	116	R455 S456 C1073	R455-S458 PolarHBondContact O-OG 3.05Å; R455-S458 VanDerWaalsContact O-OG 3.09Å; S456-S458 VanDerWaalsContact C-N 3.3Å; S456-S458 PolarHBondContact O-N 3.19Å; S458-C1073 WeakPolarHBondContact CB-O 3.49Å; S458-C1073 WeakPolarHBondContact O-CB 3.44Å; S458-C1073 WeakPolarHBondContact OG-CB 2.96Å; S458-C1073 PolarHBondContact OG-O 3.17Å
459	G	89.6	Confident	92.4	Very high	20 Å²	20	14.4 Å²	14.4	21%	0.206	8%	0.082	C	C	.	.	S	Bend	trans	92.6	5.1	172.4	0	0	0	0	0	117.1	T461 H462 I463	G459-T461 PolarHBondContact O-N 2.8Å; G459-H462 PolarHBondContact O-N 3.49Å; G459-I463 PolarHBondContact O-N 2.92Å
460	K	92.9	Very high	92.5	Very high	14 Å²	14	14.4 Å²	14.4	6%	0.061	8%	0.082	C	C	.	.	H	α-helix	trans	-49	-53.3	-178.4	-65.5	-168.5	-58.5	-64.3	0	113.6	L452 G454 R455 H462 I463 S464 D779 P780 C1073	L452-K460 HydrophobicContact CB-CB 4.27Å; L452-K460 HydrophobicContact CB-CD 4.03Å; L452-K460 HydrophobicContact CB-CG 4.22Å; L452-K460 HydrophobicContact CD1-CB 4.26Å; L452-K460 VanDerWaalsContact CD1-O 3.32Å; L452-K460 WeakPolarHBondContact CD1-O 3.11Å; G454-K460 PolarHBondContact O-NZ 2.75Å; R455-K460 PolarHBondContact O-NZ 2.77Å; K460-H462 VanDerWaalsContact C-N 3.31Å; K460-H462 PolarHBondContact O-N 2.69Å; K460-I463 CarbonylContact O-C 3.59Å; K460-I463 WeakPolarHBondContact O-CA 3.49Å; K460-I463 WeakPolarHBondContact O-CB 3.34Å; K460-I463 PolarHBondContact O-N 3.33Å; K460-S464 PolarHBondContact O-N 2.87Å; K460-S464 PolarHBondContact O-OG 2.87Å; K460-D779 VanDerWaalsContact CB-OD1 3.27Å; K460-D779 WeakPolarHBondContact CB-OD1 3.39Å; K460-P780 WeakPolarHBondContact CE-O 3.49Å; K460-C1073 HydrophobicContact CG-CB 3.9Å
461	T	92.9	Very high	92.5	Very high	26 Å²	26	14.5 Å²	14.5	16%	0.16	8%	0.083	C	C	.	.	H	α-helix	trans	-66.3	-29.2	-175.3	-49.9	0	0	0	0	113.6	G459 S464 N465 F507 R529 D779	G459-T461 PolarHBondContact O-N 2.8Å; T461-S464 WeakPolarHBondContact O-CB 3.35Å; T461-S464 PolarHBondContact O-N 3.06Å; T461-N465 PolarHBondContact O-N 3.34Å; T461-F507 HydrophobicContact CG2-CD1 3.91Å; T461-F507 HydrophobicContact CG2-CE1 3.88Å; T461-R529 VanDerWaalsContact CG2-NH1 3.34Å; T461-D779 VanDerWaalsContact CA-OD2 3.24Å; T461-D779 WeakPolarHBondContact CA-OD2 3.4Å; T461-D779 WeakPolarHBondContact CB-OD2 3.34Å; T461-D779 PolarHBondContact OG1-OD2 2.86Å
462	H	90.9	Very high	92.3	Very high	118 Å²	118	14.5 Å²	14.5	55%	0.546	8%	0.083	S	C	.	.	H	α-helix	trans	-65.6	-44.8	168.8	-69.9	-77.9	0	0	0	111.1	G459 K460 S464 N465 D466	G459-H462 PolarHBondContact O-N 3.49Å; K460-H462 VanDerWaalsContact C-N 3.31Å; K460-H462 PolarHBondContact O-N 2.69Å; H462-S464 VanDerWaalsContact C-N 3.27Å; H462-S464 PolarHBondContact O-N 2.9Å; H462-N465 CarbonylContact O-C 3.52Å; H462-N465 WeakPolarHBondContact O-CA 3.28Å; H462-N465 WeakPolarHBondContact O-CB 3.39Å; H462-N465 PolarHBondContact O-N 3.05Å; H462-D466 VanDerWaalsContact O-CG 3.25Å; H462-D466 PolarHBondContact O-N 3.13Å
463	I	94.2	Very high	92.2	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-61.3	-35.6	176.6	-69	163.3	0	0	0	111.3	V404 L452 G459 K460 D466 V467 I1071 C1073	V404-I463 HydrophobicContact CG2-CG2 3.9Å; L452-I463 HydrophobicContact CD1-CG2 4.39Å; L452-I463 HydrophobicContact CD2-CG2 3.93Å; G459-I463 PolarHBondContact O-N 2.92Å; K460-I463 CarbonylContact O-C 3.59Å; K460-I463 WeakPolarHBondContact O-CA 3.49Å; K460-I463 WeakPolarHBondContact O-CB 3.34Å; K460-I463 PolarHBondContact O-N 3.33Å; I463-D466 PolarHBondContact O-N 3.2Å; I463-V467 WeakPolarHBondContact O-CG2 3.38Å; I463-V467 PolarHBondContact O-N 2.68Å; I463-V467 VanDerWaalsContact O-N 3.1Å; I463-I1071 HydrophobicContact CD1-CG2 4.46Å; I463-I1071 HydrophobicContact CG2-CD1 3.8Å; I463-I1071 HydrophobicContact CG2-CG2 4.42Å; I463-C1073 VanDerWaalsContact CD1-SG 3.56Å
464	S	94.9	Very high	92.1	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-56.7	-49	169.7	-50.1	0	0	0	0	111.8	L452 K460 T461 H462 F468 D779	L452-S464 WeakPolarHBondContact CD1-OG 3.49Å; K460-S464 PolarHBondContact O-N 2.87Å; K460-S464 PolarHBondContact O-OG 2.87Å; T461-S464 WeakPolarHBondContact O-CB 3.35Å; T461-S464 PolarHBondContact O-N 3.06Å; H462-S464 VanDerWaalsContact C-N 3.27Å; H462-S464 PolarHBondContact O-N 2.9Å; S464-F468 WeakPolarHBondContact O-CD2 2.84Å; S464-F468 PolarHBondContact O-N 3.42Å; S464-D779 PolarHBondContact OG-OD2 3.38Å
465	N	94.1	Very high	92.1	Very high	28 Å²	28	18 Å²	18	15%	0.15	10%	0.096	C	C	.	.	H	α-helix	trans	-67	-39	179.4	-173.6	54.9	0	0	0	112.3	T461 H462 F468 T469 L503 F507	T461-N465 PolarHBondContact O-N 3.34Å; H462-N465 CarbonylContact O-C 3.52Å; H462-N465 WeakPolarHBondContact O-CA 3.28Å; H462-N465 WeakPolarHBondContact O-CB 3.39Å; H462-N465 PolarHBondContact O-N 3.05Å; N465-F468 PolarHBondContact O-N 2.73Å; N465-T469 WeakPolarHBondContact O-CB 3.45Å; N465-T469 PolarHBondContact O-N 2.75Å; N465-T469 PolarHBondContact O-OG1 2.86Å; N465-L503 WeakPolarHBondContact OD1-CD2 3.49Å; N465-L503 WeakPolarHBondContact OD1-CG 3.26Å; N465-F507 HydrophobicContact CB-CD2 3.99Å; N465-F507 HydrophobicContact CB-CE2 3.69Å; N465-F507 HydrophobicContact CB-CZ 4.19Å; N465-F507 WeakPolarHBondContact OD1-CD2 3.35Å; N465-F507 WeakPolarHBondContact OD1-CE2 3.26Å
466	D	94.4	Very high	92	Very high	20 Å²	20	19.9 Å²	19.9	11%	0.107	11%	0.106	C	C	.	.	H	α-helix	trans	-61.7	-43.6	177.2	-66.3	-38.4	0	0	0	112.1	Y383 V404 Y405 H462 I463 T469 Y470	Y383-D466 HydrophobicContact CD1-CB 4.43Å; Y383-D466 WeakPolarHBondContact CD1-OD1 3.36Å; Y383-D466 HydrophobicContact CE1-CB 4.25Å; Y383-D466 WeakPolarHBondContact CE1-OD2 2.96Å; V404-D466 HydrophobicContact CG1-CB 3.96Å; V404-D466 HydrophobicContact CG2-CB 4.13Å; Y405-D466 HydrophobicContact CE1-CB 4.28Å; H462-D466 VanDerWaalsContact O-CG 3.25Å; H462-D466 PolarHBondContact O-N 3.13Å; I463-D466 PolarHBondContact O-N 3.2Å; D466-T469 PolarHBondContact O-N 2.89Å; D466-Y470 PolarHBondContact O-N 3Å
467	V	95.7	Very high	91.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.8	-47	176.9	170.4	0	0	0	0	111.1	V404 A408 L450 I463 Y470 M471 L775 L777	V404-V467 HydrophobicContact CG2-CG2 3.33Å; A408-V467 HydrophobicContact CB-CG1 4.1Å; A408-V467 HydrophobicContact CB-CG2 4.48Å; L450-V467 HydrophobicContact CD2-CB 4.25Å; L450-V467 HydrophobicContact CD2-CG1 3.9Å; L450-V467 HydrophobicContact CD2-CG2 3.79Å; I463-V467 WeakPolarHBondContact O-CG2 3.38Å; I463-V467 PolarHBondContact O-N 2.68Å; I463-V467 VanDerWaalsContact O-N 3.1Å; V467-Y470 PolarHBondContact O-N 3.08Å; V467-M471 WeakPolarHBondContact O-CG 3.19Å; V467-M471 PolarHBondContact O-N 3.15Å; V467-L775 HydrophobicContact CG1-CD2 4.18Å; V467-L777 HydrophobicContact CB-CD1 4.48Å; V467-L777 HydrophobicContact CG1-CD1 4.41Å
468	F	95.6	Very high	91.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67.3	-37.3	179	-69.8	-34.1	0	0	0	112.5	S464 N465 Y470 M471 I472 L503 F507 F531 L533 L557 L775 L777	S464-F468 WeakPolarHBondContact O-CD2 2.84Å; S464-F468 PolarHBondContact O-N 3.42Å; N465-F468 PolarHBondContact O-N 2.73Å; F468-Y470 VanDerWaalsContact C-N 3.34Å; F468-Y470 PolarHBondContact O-N 3.47Å; F468-M471 PolarHBondContact O-N 3.41Å; F468-I472 WeakPolarHBondContact O-CB 3.44Å; F468-I472 VanDerWaalsContact O-CG1 3.29Å; F468-I472 WeakPolarHBondContact O-CG1 3.41Å; F468-I472 PolarHBondContact O-N 2.98Å; F468-L503 HydrophobicContact CB-CD1 3.64Å; F468-L503 HydrophobicContact CB-CD2 3.53Å; F468-L503 HydrophobicContact CB-CG 4.23Å; F468-L503 HydrophobicContact CD2-CD1 3.91Å; F468-L503 HydrophobicContact CG-CD1 4.12Å; F468-F507 HydrophobicContact CD2-CE2 4.24Å; F468-F507 HydrophobicContact CD2-CZ 4.19Å; F468-F507 HydrophobicContact CE2-CZ 4.47Å; F468-F531 HydrophobicContact CE2-CB 3.97Å; F468-F531 HydrophobicContact CE2-CD1 4.2Å; F468-F531 HydrophobicContact CE2-CD2 4.09Å; F468-F531 AromaticContact CE2-CG 3.86Å; F468-F531 HydrophobicContact CE2-CG 3.86Å; F468-F531 HydrophobicContact CZ-CB 3.58Å; F468-F531 HydrophobicContact CZ-CD2 4.39Å; F468-F531 HydrophobicContact CZ-CG 4.01Å; F468-L533 HydrophobicContact CD1-CB 4.43Å; F468-L533 HydrophobicContact CD1-CD2 3.95Å; F468-L533 HydrophobicContact CE1-CB 3.95Å; F468-L533 HydrophobicContact CE1-CD2 4.26Å; F468-L557 HydrophobicContact CZ-CD1 4.29Å; F468-L775 HydrophobicContact CE1-CD2 4.47Å; F468-L777 HydrophobicContact CD1-CD1 4.44Å; F468-L777 HydrophobicContact CE1-CB 4.23Å; F468-L777 HydrophobicContact CE1-CD1 3.88Å; F468-L777 HydrophobicContact CE2-CD1 3.97Å; F468-L777 HydrophobicContact CZ-CB 3.75Å; F468-L777 HydrophobicContact CZ-CD1 3.63Å; F468-L777 HydrophobicContact CZ-CG 4.2Å
469	T	94.1	Very high	91.5	Very high	16 Å²	16	22.7 Å²	22.7	10%	0.098	12%	0.115	C	C	.	.	H	α-helix	trans	-60.3	-43.9	173.4	-56.5	0	0	0	0	110.9	M388 N465 D466 I472 Y473 E500	M388-T469 HydrophobicContact CE-CG2 3.88Å; N465-T469 WeakPolarHBondContact O-CB 3.45Å; N465-T469 PolarHBondContact O-N 2.75Å; N465-T469 PolarHBondContact O-OG1 2.86Å; D466-T469 PolarHBondContact O-N 2.89Å; T469-I472 PolarHBondContact O-N 3.23Å; T469-Y473 VanDerWaalsContact O-CB 3.31Å; T469-Y473 WeakPolarHBondContact O-CB 3.37Å; T469-Y473 PolarHBondContact O-N 3.17Å; T469-E500 HydrophobicContact CG2-CG 4.25Å
470	Y	95.1	Very high	91	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.2	-45.1	174.8	-176	-91	0	0	0	112.8	M388 F391 Y405 A408 Q409 D466 V467 F468 Y473 Q474	M388-Y470 HydrophobicContact CB-CD2 3.82Å; M388-Y470 HydrophobicContact CB-CE2 3.82Å; M388-Y470 HydrophobicContact CG-CD2 3.83Å; M388-Y470 HydrophobicContact CG-CE2 4.32Å; M388-Y470 HydrophobicContact SD-CD2 4.32Å; F391-Y470 HydrophobicContact CB-CE2 4.11Å; F391-Y470 WeakPolarHBondContact CB-OH 3.45Å; Y405-Y470 AromaticContact CD1-CD2 3.71Å; Y405-Y470 HydrophobicContact CD1-CD2 3.71Å; Y405-Y470 AromaticContact CD1-CG 3.97Å; Y405-Y470 HydrophobicContact CD1-CG 3.97Å; Y405-Y470 HydrophobicContact CD2-CD2 4.16Å; Y405-Y470 HydrophobicContact CE1-CD2 4.38Å; Y405-Y470 AromaticContact CG-CD2 3.6Å; Y405-Y470 HydrophobicContact CG-CD2 3.6Å; Y405-Y470 HydrophobicContact CG-CE2 4.19Å; Y405-Y470 HydrophobicContact CG-CG 4.26Å; A408-Y470 HydrophobicContact CB-CD1 3.52Å; A408-Y470 HydrophobicContact CB-CE1 4.19Å; A408-Y470 HydrophobicContact CB-CG 4.05Å; Q409-Y470 HydrophobicContact CB-CE1 4.02Å; Q409-Y470 PolarHBondContact OE1-OH 3.23Å; D466-Y470 PolarHBondContact O-N 3Å; V467-Y470 PolarHBondContact O-N 3.08Å; F468-Y470 VanDerWaalsContact C-N 3.34Å; F468-Y470 PolarHBondContact O-N 3.47Å; Y470-Y473 PolarHBondContact O-N 2.93Å; Y470-Q474 HydrophobicContact CD1-CG 4.27Å; Y470-Q474 HydrophobicContact CE1-CG 3.81Å; Y470-Q474 WeakPolarHBondContact O-CG 3.36Å; Y470-Q474 PolarHBondContact O-N 3.49Å; Y470-Q474 VanDerWaalsContact O-N 3.07Å; Y470-Q474 PolarHBondContact OH-NE2 3.13Å
471	M	94.1	Very high	90.2	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-65.5	-41	179.4	-69.7	-61	-159.8	0	0	112.5	A408 I411 L412 V467 F468 S475 L533 F535 L775	A408-M471 HydrophobicContact CB-CE 4.46Å; A408-M471 WeakPolarHBondContact O-CE 3Å; I411-M471 HydrophobicContact CB-CE 3.92Å; I411-M471 HydrophobicContact CG2-CE 3.51Å; L412-M471 HydrophobicContact CB-CE 4.21Å; L412-M471 HydrophobicContact CB-SD 4.15Å; L412-M471 HydrophobicContact CD1-SD 4.16Å; V467-M471 WeakPolarHBondContact O-CG 3.19Å; V467-M471 PolarHBondContact O-N 3.15Å; F468-M471 PolarHBondContact O-N 3.41Å; M471-S475 WeakPolarHBondContact O-CB 3.46Å; M471-S475 PolarHBondContact O-N 3.39Å; M471-L533 HydrophobicContact CB-CD2 3.67Å; M471-L533 HydrophobicContact CG-CD2 4.01Å; M471-F535 HydrophobicContact CB-CZ 4.27Å; M471-F535 HydrophobicContact CE-CZ 4.39Å; M471-F535 HydrophobicContact CG-CZ 4.22Å; M471-F535 HydrophobicContact SD-CE1 4.45Å; M471-F535 HydrophobicContact SD-CZ 3.99Å; M471-L775 HydrophobicContact CE-CD2 4Å
472	I	93	Very high	89.2	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-65.3	-43.6	175	-68.8	164.7	0	0	0	110.2	F468 T469 Q474 S475 E476 I498 L503	F468-I472 WeakPolarHBondContact O-CB 3.44Å; F468-I472 VanDerWaalsContact O-CG1 3.29Å; F468-I472 WeakPolarHBondContact O-CG1 3.41Å; F468-I472 PolarHBondContact O-N 2.98Å; T469-I472 PolarHBondContact O-N 3.23Å; I472-Q474 PolarHBondContact O-N 2.7Å; I472-S475 CarbonylContact O-C 3.52Å; I472-S475 WeakPolarHBondContact O-CA 3.41Å; I472-S475 WeakPolarHBondContact O-CB 3.43Å; I472-S475 PolarHBondContact O-N 3.41Å; I472-S475 VanDerWaalsContact O-N 3.12Å; I472-E476 HydrophobicContact CG2-CG 4.24Å; I472-E476 WeakPolarHBondContact O-CG 3.38Å; I472-E476 PolarHBondContact O-N 3.31Å; I472-I498 HydrophobicContact CD1-CG2 3.8Å; I472-I498 HydrophobicContact CG1-CG2 4.31Å; I472-I498 WeakPolarHBondContact CG2-O 3.44Å; I472-L503 HydrophobicContact CD1-CB 4.06Å; I472-L503 HydrophobicContact CD1-CD1 4.32Å; I472-L503 HydrophobicContact CD1-CD2 4.01Å; I472-L503 HydrophobicContact CD1-CG 4.37Å
473	Y	92.4	Very high	88.3	Confident	63 Å²	63	28.8 Å²	28.8	25%	0.247	14%	0.14	C	C	.	.	H	α-helix	trans	-57.1	-46	176.9	179.3	-103.8	0	0	0	112.4	D385 M388 D389 T469 Y470 S475 E476 K477	D385-Y473 HydrophobicContact CB-CD2 4.33Å; D385-Y473 HydrophobicContact CB-CE2 3.67Å; M388-Y473 HydrophobicContact CB-CD1 3.8Å; M388-Y473 HydrophobicContact CB-CE1 3.83Å; M388-Y473 HydrophobicContact CG-CD1 4.43Å; M388-Y473 HydrophobicContact SD-CD1 3.74Å; M388-Y473 HydrophobicContact SD-CD2 4.28Å; M388-Y473 HydrophobicContact SD-CE1 4.4Å; M388-Y473 HydrophobicContact SD-CG 3.67Å; D389-Y473 PolarHBondContact OD1-OH 3.45Å; T469-Y473 VanDerWaalsContact O-CB 3.31Å; T469-Y473 WeakPolarHBondContact O-CB 3.37Å; T469-Y473 PolarHBondContact O-N 3.17Å; Y470-Y473 PolarHBondContact O-N 2.93Å; Y473-S475 VanDerWaalsContact C-N 3.34Å; Y473-S475 PolarHBondContact O-N 2.79Å; Y473-E476 PolarHBondContact O-N 3.12Å; Y473-K477 HydrophobicContact CE1-CD 4.29Å; Y473-K477 VanDerWaalsContact O-CB 3.23Å; Y473-K477 WeakPolarHBondContact O-CB 3.41Å; Y473-K477 PolarHBondContact O-N 3.42Å
474	Q	90.3	Very high	87.2	Confident	13 Å²	13	35.4 Å²	35.4	6%	0.061	17%	0.171	C	C	.	.	H	α-helix	trans	-67.8	-32.9	176.6	-63.1	-64.5	2.9	0	0	112.7	T392 L412 Y470 I472 S478	T392-Q474 PolarHBondContact OG1-NE2 3.02Å; L412-Q474 HydrophobicContact CD2-CB 4.01Å; L412-Q474 HydrophobicContact CD2-CG 4.09Å; Y470-Q474 HydrophobicContact CD1-CG 4.27Å; Y470-Q474 HydrophobicContact CE1-CG 3.81Å; Y470-Q474 WeakPolarHBondContact O-CG 3.36Å; Y470-Q474 PolarHBondContact O-N 3.49Å; Y470-Q474 VanDerWaalsContact O-N 3.07Å; Y470-Q474 PolarHBondContact OH-NE2 3.13Å; I472-Q474 PolarHBondContact O-N 2.7Å; Q474-S478 WeakPolarHBondContact O-CB 3.39Å; Q474-S478 PolarHBondContact O-N 3.15Å; Q474-S478 VanDerWaalsContact O-N 3.07Å; Q474-S478 PolarHBondContact O-OG 3.06Å
475	S	89.9	Confident	85.8	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-64.8	-50.9	172.1	175.1	0	0	0	0	111.7	M471 I472 Y473 K477 S478 I479 I553 V554	M471-S475 WeakPolarHBondContact O-CB 3.46Å; M471-S475 PolarHBondContact O-N 3.39Å; I472-S475 CarbonylContact O-C 3.52Å; I472-S475 WeakPolarHBondContact O-CA 3.41Å; I472-S475 WeakPolarHBondContact O-CB 3.43Å; I472-S475 PolarHBondContact O-N 3.41Å; I472-S475 VanDerWaalsContact O-N 3.12Å; Y473-S475 VanDerWaalsContact C-N 3.34Å; Y473-S475 PolarHBondContact O-N 2.79Å; S475-K477 VanDerWaalsContact C-N 3.34Å; S475-K477 PolarHBondContact O-N 2.9Å; S475-S478 WeakPolarHBondContact O-CB 3.43Å; S475-S478 PolarHBondContact O-N 3.5Å; S475-S478 VanDerWaalsContact O-N 3.14Å; S475-I479 WeakPolarHBondContact O-CG1 3.48Å; S475-I479 PolarHBondContact O-N 2.89Å; S475-I553 WeakPolarHBondContact OG-CA 3.37Å; S475-V554 PolarHBondContact OG-N 3.37Å
476	E	87.3	Confident	84	Confident	56 Å²	56	42.3 Å²	42.3	26%	0.262	22%	0.215	S	C	.	.	H	α-helix	trans	-62.3	-40.1	178.2	-71.5	-175.7	-175.4	0	0	112	I472 Y473 S478 I479 N480 N499	I472-E476 HydrophobicContact CG2-CG 4.24Å; I472-E476 WeakPolarHBondContact O-CG 3.38Å; I472-E476 PolarHBondContact O-N 3.31Å; Y473-E476 PolarHBondContact O-N 3.12Å; E476-S478 VanDerWaalsContact C-N 3.32Å; E476-S478 PolarHBondContact O-N 2.96Å; E476-I479 PolarHBondContact O-N 2.76Å; E476-N480 WeakPolarHBondContact O-CB 3.32Å; E476-N480 PolarHBondContact O-N 3.13Å; E476-N480 PolarHBondContact O-ND2 3.12Å; E476-N499 WeakPolarHBondContact OE1-CA 3.35Å; E476-N499 WeakPolarHBondContact OE1-CB 3.16Å
477	K	84.3	Confident	81.6	Confident	62 Å²	62	47.4 Å²	47.4	27%	0.27	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-41	173.3	-171.3	172.7	179.6	176.3	0	112.2	D389 T392 Y473 S475 H481	D389-K477 VanDerWaalsContact CG-NZ 3.34Å; D389-K477 IonicContact OD1-NZ 3.79Å; D389-K477 PolarHBondContact OD1-NZ 2.97Å; D389-K477 IonicContact OD2-NZ 2.96Å; D389-K477 PolarHBondContact OD2-NZ 3.28Å; T392-K477 PolarHBondContact OG1-NZ 3.41Å; T392-K477 VanDerWaalsContact OG1-NZ 3.15Å; Y473-K477 HydrophobicContact CE1-CD 4.29Å; Y473-K477 VanDerWaalsContact O-CB 3.23Å; Y473-K477 WeakPolarHBondContact O-CB 3.41Å; Y473-K477 PolarHBondContact O-N 3.42Å; S475-K477 VanDerWaalsContact C-N 3.34Å; S475-K477 PolarHBondContact O-N 2.9Å; K477-H481 PolarHBondContact O-N 3.26Å
478	S	82.8	Confident	78.9	Confident	24 Å²	24	52.6 Å²	52.6	17%	0.168	27%	0.27	C	S	.	.	H	α-helix	trans	-67.4	-43	175.4	-57.2	0	0	0	0	112.2	Q474 S475 E476 H481 F482	Q474-S478 WeakPolarHBondContact O-CB 3.39Å; Q474-S478 PolarHBondContact O-N 3.15Å; Q474-S478 VanDerWaalsContact O-N 3.07Å; Q474-S478 PolarHBondContact O-OG 3.06Å; S475-S478 WeakPolarHBondContact O-CB 3.43Å; S475-S478 PolarHBondContact O-N 3.5Å; S475-S478 VanDerWaalsContact O-N 3.14Å; E476-S478 VanDerWaalsContact C-N 3.32Å; E476-S478 PolarHBondContact O-N 2.96Å; S478-H481 PolarHBondContact O-N 3.35Å; S478-F482 PolarHBondContact O-N 3.38Å
479	I	82.1	Confident	76.1	Confident	8 Å²	8	54.5 Å²	54.5	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-42.7	175.9	-69.1	166.7	0	0	0	111.2	S475 E476 F482 N483 I494 N496 I553	S475-I479 WeakPolarHBondContact O-CG1 3.48Å; S475-I479 PolarHBondContact O-N 2.89Å; E476-I479 PolarHBondContact O-N 2.76Å; I479-F482 PolarHBondContact O-N 3.13Å; I479-N483 WeakPolarHBondContact CG2-ND2 3.45Å; I479-N483 WeakPolarHBondContact O-CB 3.47Å; I479-N483 PolarHBondContact O-N 3.2Å; I479-N483 PolarHBondContact O-ND2 3.41Å; I479-I494 HydrophobicContact CD1-CG2 4.23Å; I479-I494 HydrophobicContact CG1-CG2 4.2Å; I479-I494 HydrophobicContact CG2-CB 4.44Å; I479-I494 HydrophobicContact CG2-CG2 4.29Å; I479-N496 HydrophobicContact CD1-CB 3.82Å; I479-I553 HydrophobicContact CD1-CB 4.37Å; I479-I553 HydrophobicContact CD1-CG2 3.84Å; I479-I553 HydrophobicContact CG1-CB 4.47Å; I479-I553 HydrophobicContact CG1-CG2 3.47Å; I479-I553 VanDerWaalsContact CG1-CG2 3.47Å
480	N	80.6	Confident	73.4	Confident	90 Å²	90	60.2 Å²	60.2	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-66.6	-38.2	178.9	-71	-26.1	0	0	0	111.6	E476 N483 H484	E476-N480 WeakPolarHBondContact O-CB 3.32Å; E476-N480 PolarHBondContact O-N 3.13Å; E476-N480 PolarHBondContact O-ND2 3.12Å; N480-N483 PolarHBondContact O-N 2.99Å; N480-H484 WeakPolarHBondContact O-CB 3.49Å; N480-H484 PolarHBondContact O-CD2 2.94Å; N480-H484 VanDerWaalsContact O-CD2 3.26Å; N480-H484 PolarHBondContact O-N 2.9Å
481	H	74.7	Confident	70.8	Confident	139 Å²	139	64.7 Å²	64.7	64%	0.644	34%	0.344	S	S	*	.	H	α-helix	trans	-64.3	-43.9	173.4	-165.3	64.7	0	0	0	111.9	K477 S478 H484 S485	K477-H481 PolarHBondContact O-N 3.26Å; S478-H481 PolarHBondContact O-N 3.35Å; H481-H484 PolarHBondContact O-N 3.08Å; H481-S485 PolarHBondContact O-N 3.06Å
482	F	72.3	Confident	68.8	Low	39 Å²	39	66.7 Å²	66.7	17%	0.171	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-42.2	175.6	-177.1	-101.5	0	0	0	113.1	S478 I479 S485 N486 I494 I538 H539	S478-F482 PolarHBondContact O-N 3.38Å; I479-F482 PolarHBondContact O-N 3.13Å; F482-S485 PolarHBondContact O-N 3.23Å; F482-N486 WeakPolarHBondContact CE1-ND2 3.47Å; F482-N486 WeakPolarHBondContact CE2-ND2 3.44Å; F482-N486 VanDerWaalsContact CZ-ND2 3.25Å; F482-N486 WeakPolarHBondContact CZ-ND2 3.43Å; F482-N486 PolarHBondContact O-N 3.4Å; F482-N486 VanDerWaalsContact O-N 3.17Å; F482-N486 PolarHBondContact O-ND2 2.88Å; F482-I494 HydrophobicContact CD1-CD1 3.9Å; F482-I494 HydrophobicContact CE1-CD1 3.72Å; F482-I494 HydrophobicContact CE1-CG1 4.35Å; F482-I538 HydrophobicContact CB-CD1 4.43Å; F482-I538 HydrophobicContact CB-CG2 4.3Å; F482-I538 HydrophobicContact CD1-CG2 4.03Å; F482-I538 HydrophobicContact CD2-CG2 3.41Å; F482-I538 VanDerWaalsContact CD2-CG2 3.41Å; F482-I538 HydrophobicContact CE1-CG2 4.15Å; F482-I538 HydrophobicContact CE2-CG2 3.54Å; F482-I538 HydrophobicContact CG-CG2 3.65Å; F482-I538 HydrophobicContact CZ-CG2 3.91Å; F482-H539 AromaticContact CD2-CE1 3.34Å; F482-H539 WeakPolarHBondContact CD2-CE1 3.47Å; F482-H539 AromaticContact CE2-CE1 3.94Å
483	N	73.1	Confident	67	Low	37 Å²	37	72.6 Å²	72.6	20%	0.198	39%	0.388	C	S	.	.	H	α-helix	trans	-66.3	-37.9	176.3	-76.7	-35.8	0	0	0	111.8	I479 N480 N486 I494	I479-N483 WeakPolarHBondContact CG2-ND2 3.45Å; I479-N483 WeakPolarHBondContact O-CB 3.47Å; I479-N483 PolarHBondContact O-N 3.2Å; I479-N483 PolarHBondContact O-ND2 3.41Å; N480-N483 PolarHBondContact O-N 2.99Å; N483-N486 PolarHBondContact O-N 2.74Å; N483-I494 PolarHBondContact ND2-O 2.78Å
484	H	69.4	Low	65.3	Low	143 Å²	143	70.6 Å²	70.6	66%	0.662	38%	0.381	S	S	*	.	H	α-helix	trans	-69.8	-28.4	174	-85.3	-60.6	0	0	0	113.8	N480 H481	N480-H484 WeakPolarHBondContact O-CB 3.49Å; N480-H484 PolarHBondContact O-CD2 2.94Å; N480-H484 VanDerWaalsContact O-CD2 3.26Å; N480-H484 PolarHBondContact O-N 2.9Å; H481-H484 PolarHBondContact O-N 3.08Å
485	S	65.5	Low	63.8	Low	92 Å²	92	73.5 Å²	73.5	64%	0.643	40%	0.403	S	S	*	.	H	α-helix	trans	-69.4	-37.3	173.1	-170.4	0	0	0	0	112.1	H481 F482 N487	H481-S485 PolarHBondContact O-N 3.06Å; F482-S485 PolarHBondContact O-N 3.23Å; S485-N487 VanDerWaalsContact C-N 3.33Å; S485-N487 PolarHBondContact O-N 2.92Å
486	N	57.9	Low	62.7	Low	81 Å²	81	74.8 Å²	74.8	43%	0.433	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	46.2	-176	-66.9	-58.1	0	0	0	113.1	F482 N483 D488	F482-N486 WeakPolarHBondContact CE1-ND2 3.47Å; F482-N486 WeakPolarHBondContact CE2-ND2 3.44Å; F482-N486 VanDerWaalsContact CZ-ND2 3.25Å; F482-N486 WeakPolarHBondContact CZ-ND2 3.43Å; F482-N486 PolarHBondContact O-N 3.4Å; F482-N486 VanDerWaalsContact O-N 3.17Å; F482-N486 PolarHBondContact O-ND2 2.88Å; N483-N486 PolarHBondContact O-N 2.74Å; N486-D488 VanDerWaalsContact C-N 3.26Å; N486-D488 PolarHBondContact O-N 3.4Å
487	N	42.5	Very low	62	Low	127 Å²	127	75 Å²	75	68%	0.679	41%	0.41	S	S	*	.			trans	-84.3	52.9	-166.6	-152.7	14.7	0	0	0	114.6	S485	S485-N487 VanDerWaalsContact C-N 3.33Å; S485-N487 PolarHBondContact O-N 2.92Å
488	D	38.8	Very low	62.1	Low	109 Å²	109	72.1 Å²	72.1	58%	0.583	40%	0.397	S	S	*	.	S	Bend	trans	-94.3	104.2	161.6	-119	-15.1	0	0	0	108.4	N486 N490 K2252	N486-D488 VanDerWaalsContact C-N 3.26Å; N486-D488 PolarHBondContact O-N 3.4Å; D488-N490 PolarHBondContact O-N 3.14Å; D488-K2252 WeakPolarHBondContact OD1-CE 3.04Å; D488-K2252 IonicContact OD1-NZ 2.71Å; D488-K2252 PolarHBondContact OD1-NZ 3.18Å
489	G	38	Very low	62.3	Low	40 Å²	40	74.1 Å²	74.1	41%	0.412	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	114.2	-164	0	0	0	0	0	115.1
490	N	37.3	Very low	62.5	Low	137 Å²	137	77.1 Å²	77.1	73%	0.733	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn		178	-10.4	121.8	-92.2	0.1	0	0	0	114.4	D488	D488-N490 PolarHBondContact O-N 3.14Å
491	N	41.4	Very low	62.8	Low	94 Å²	94	75.9 Å²	75.9	50%	0.503	42%	0.418	S	S	.	.			trans	-127.7	116	-179.3	-79.8	-39.8	0	0	0	112	I493 N2310	N491-I493 PolarHBondContact O-N 3.1Å; N491-I493 VanDerWaalsContact O-N 3.14Å; N491-N2310 WeakPolarHBondContact OD1-CB 3.33Å; N491-N2310 PolarHBondContact OD1-ND2 3.41Å
492	S	50.2	Low	63.7	Low	43 Å²	43	71.3 Å²	71.3	30%	0.301	40%	0.395	S	S	.	.			trans	-70	105.4	165.2	56.7	0	0	0	0	109.2	I494 R2312	S492-I494 VanDerWaalsContact C-N 3.32Å; S492-I494 PolarHBondContact O-N 3.18Å; S492-R2312 PolarHBondContact OG-NH1 3.17Å
493	I	55.3	Low	64.7	Low	126 Å²	126	69.4 Å²	69.4	65%	0.646	39%	0.387	S	S	*	.	S	Bend	trans	-66.7	-34.9	-169.8	-57.5	175.6	0	0	0	111.6	N491	N491-I493 PolarHBondContact O-N 3.1Å; N491-I493 VanDerWaalsContact O-N 3.14Å
494	I	57.1	Low	65.6	Low	21 Å²	21	69.6 Å²	69.6	11%	0.108	39%	0.385	C	S	.	.			trans	-117.8	119.1	-179.7	-54.5	178.4	0	0	0	109.5	I479 F482 N483 S492 I538 F769	I479-I494 HydrophobicContact CD1-CG2 4.23Å; I479-I494 HydrophobicContact CG1-CG2 4.2Å; I479-I494 HydrophobicContact CG2-CB 4.44Å; I479-I494 HydrophobicContact CG2-CG2 4.29Å; F482-I494 HydrophobicContact CD1-CD1 3.9Å; F482-I494 HydrophobicContact CE1-CD1 3.72Å; F482-I494 HydrophobicContact CE1-CG1 4.35Å; N483-I494 PolarHBondContact ND2-O 2.78Å; S492-I494 VanDerWaalsContact C-N 3.32Å; S492-I494 PolarHBondContact O-N 3.18Å; I494-I538 HydrophobicContact CD1-CG2 4.23Å; I494-F769 HydrophobicContact CD1-CE2 4.26Å; I494-F769 HydrophobicContact CD1-CZ 4.03Å
495	S	58.5	Low	66.8	Low	75 Å²	75	62.8 Å²	62.8	52%	0.524	35%	0.353	S	S	.	.			trans	-113.1	125.4	166.1	60	0	0	0	0	109.1
496	N	68.2	Low	68.2	Low	27 Å²	27	58.4 Å²	58.4	14%	0.144	32%	0.323	C	S	.	.			trans	-60.4	137.7	173.7	-170.6	2	0	0	0	110.8	I479 I498 N499	I479-N496 HydrophobicContact CD1-CB 3.82Å; N496-I498 VanDerWaalsContact CG-O 3.27Å; N496-I498 PolarHBondContact ND2-O 2.87Å; N496-I498 PolarHBondContact OD1-N 2.9Å; N496-I498 PolarHBondContact OD1-O 3.13Å; N496-N499 WeakPolarHBondContact CB-OD1 3.24Å; N496-N499 PolarHBondContact O-OD1 2.88Å
497	K	73	Confident	69.9	Low	62 Å²	62	55.1 Å²	55.1	27%	0.27	30%	0.304	S	S	.	.	S	Bend	trans	-85.7	-22.9	175.4	-158.9	-175.6	-175.3	-164.8	0	111.7	R502 R756 C757 S759	K497-R502 WeakPolarHBondContact O-CD 3.08Å; K497-R502 PolarHBondContact O-NH1 3.17Å; K497-R756 PolarHBondContact NZ-O 3.05Å; K497-C757 WeakPolarHBondContact CE-O 3.39Å; K497-C757 PolarHBondContact NZ-O 3.46Å; K497-S759 PolarHBondContact NZ-O 2.95Å
498	I	84.3	Confident	72.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.284	C	S	.	.			trans	-123.7	98.8	-172.6	-58.9	154	0	0	0	109.6	I472 N496 V554 L557 L758	I472-I498 HydrophobicContact CD1-CG2 3.8Å; I472-I498 HydrophobicContact CG1-CG2 4.31Å; I472-I498 WeakPolarHBondContact CG2-O 3.44Å; N496-I498 VanDerWaalsContact CG-O 3.27Å; N496-I498 PolarHBondContact ND2-O 2.87Å; N496-I498 PolarHBondContact OD1-N 2.9Å; N496-I498 PolarHBondContact OD1-O 3.13Å; I498-V554 HydrophobicContact CB-CG1 4.16Å; I498-V554 HydrophobicContact CD1-CG1 3.59Å; I498-V554 HydrophobicContact CG2-CG1 4.44Å; I498-L557 HydrophobicContact CD1-CB 3.86Å; I498-L758 WeakPolarHBondContact CD1-O 3.39Å; I498-L758 HydrophobicContact CG1-CD2 4.28Å
499	N	87.1	Confident	75	Confident	67 Å²	67	46.1 Å²	46.1	36%	0.358	26%	0.256	S	S	.	.			trans	-111.4	167.5	179	-55.6	14.3	0	0	0	109.8	E476 N496 C501 R502 L503	E476-N499 WeakPolarHBondContact OE1-CA 3.35Å; E476-N499 WeakPolarHBondContact OE1-CB 3.16Å; N496-N499 WeakPolarHBondContact CB-OD1 3.24Å; N496-N499 PolarHBondContact O-OD1 2.88Å; N499-C501 VanDerWaalsContact C-N 3.27Å; N499-C501 PolarHBondContact O-N 3.27Å; N499-C501 VanDerWaalsContact O-N 3.13Å; N499-R502 WeakPolarHBondContact O-CB 3.49Å; N499-R502 PolarHBondContact O-N 3.43Å; N499-L503 PolarHBondContact O-N 3.47Å; N499-L503 VanDerWaalsContact O-N 3.11Å
500	E	87.1	Confident	77.7	Confident	70 Å²	70	44.3 Å²	44.3	33%	0.327	24%	0.237	S	C	.	.	H	α-helix	trans	-48.6	-43.6	-178.7	-171.4	-166.9	138.2	0	0	113.5	T469 R502 L503 R504	T469-E500 HydrophobicContact CG2-CG 4.25Å; E500-R502 VanDerWaalsContact C-N 3.3Å; E500-R502 PolarHBondContact O-N 3.08Å; E500-L503 WeakPolarHBondContact O-CB 3.37Å; E500-L503 PolarHBondContact O-N 3.11Å; E500-R504 PolarHBondContact O-N 3.07Å; E500-R504 IonicContact OE1-CZ 3.48Å; E500-R504 IonicContact OE1-NH1 3.34Å; E500-R504 PolarHBondContact OE1-NH1 3.48Å; E500-R504 IonicContact OE1-NH2 2.69Å; E500-R504 PolarHBondContact OE1-NH2 3.3Å
501	C	87.7	Confident	80.4	Confident	65 Å²	65	39.1 Å²	39.1	44%	0.439	21%	0.209	S	C	.	.	H	α-helix	trans	-63.3	-33.6	179.1	-58.1	0	0	0	0	113.2	N499 R504 A505 L634	N499-C501 VanDerWaalsContact C-N 3.27Å; N499-C501 PolarHBondContact O-N 3.27Å; N499-C501 VanDerWaalsContact O-N 3.13Å; C501-R504 PolarHBondContact O-N 3.31Å; C501-A505 WeakPolarHBondContact O-CB 3.38Å; C501-A505 PolarHBondContact O-N 3.32Å; C501-L634 HydrophobicContact CB-CD1 3.97Å; C501-L634 HydrophobicContact CB-CD2 4.09Å; C501-L634 WeakPolarHBondContact O-CD2 3.23Å
502	R	92.4	Very high	82.9	Confident	42 Å²	42	34.8 Å²	34.8	16%	0.158	19%	0.186	C	C	.	.	H	α-helix	trans	-75.2	-34.1	176.2	-78.2	-178.8	166.3	-175.7	-7.8	112.2	K497 N499 E500 R504 L506 L634 L635 L758	K497-R502 WeakPolarHBondContact O-CD 3.08Å; K497-R502 PolarHBondContact O-NH1 3.17Å; N499-R502 WeakPolarHBondContact O-CB 3.49Å; N499-R502 PolarHBondContact O-N 3.43Å; E500-R502 VanDerWaalsContact C-N 3.3Å; E500-R502 PolarHBondContact O-N 3.08Å; R502-R504 VanDerWaalsContact C-N 3.34Å; R502-L506 WeakPolarHBondContact O-CB 3.15Å; R502-L506 PolarHBondContact O-N 2.89Å; R502-L634 HydrophobicContact CB-CD2 4.24Å; R502-L634 HydrophobicContact CG-CD2 3.5Å; R502-L634 VanDerWaalsContact CG-CD2 3.5Å; R502-L634 HydrophobicContact CG-CG 4.47Å; R502-L634 PolarHBondContact NE-O 3.36Å; R502-L634 PolarHBondContact NH2-O 3.08Å; R502-L634 VanDerWaalsContact NH2-O 3.09Å; R502-L635 HydrophobicContact CB-CD2 4.28Å; R502-L635 HydrophobicContact CG-CD2 4.31Å; R502-L758 HydrophobicContact CB-CD2 4.17Å
503	L	93.3	Very high	85.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-41.6	170.8	-173.4	75.4	0	0	0	111.2	N465 F468 I472 N499 E500 L506 F507 L557	N465-L503 WeakPolarHBondContact OD1-CD2 3.49Å; N465-L503 WeakPolarHBondContact OD1-CG 3.26Å; F468-L503 HydrophobicContact CB-CD1 3.64Å; F468-L503 HydrophobicContact CB-CD2 3.53Å; F468-L503 HydrophobicContact CB-CG 4.23Å; F468-L503 HydrophobicContact CD2-CD1 3.91Å; F468-L503 HydrophobicContact CG-CD1 4.12Å; I472-L503 HydrophobicContact CD1-CB 4.06Å; I472-L503 HydrophobicContact CD1-CD1 4.32Å; I472-L503 HydrophobicContact CD1-CD2 4.01Å; I472-L503 HydrophobicContact CD1-CG 4.37Å; N499-L503 PolarHBondContact O-N 3.47Å; N499-L503 VanDerWaalsContact O-N 3.11Å; E500-L503 WeakPolarHBondContact O-CB 3.37Å; E500-L503 PolarHBondContact O-N 3.11Å; L503-L506 HydrophobicContact CD1-CD2 4.26Å; L503-L506 WeakPolarHBondContact O-CB 3.49Å; L503-L506 PolarHBondContact O-N 3.45Å; L503-F507 HydrophobicContact CD1-CD2 4.44Å; L503-F507 HydrophobicContact CD1-CE2 3.97Å; L503-F507 HydrophobicContact CG-CD2 4.19Å; L503-F507 HydrophobicContact CG-CE2 4.04Å; L503-F507 VanDerWaalsContact O-CD2 3.32Å; L503-F507 WeakPolarHBondContact O-CD2 3.37Å; L503-F507 PolarHBondContact O-N 2.88Å; L503-F507 VanDerWaalsContact O-N 3.12Å; L503-L557 HydrophobicContact CD1-CD2 3.86Å
504	R	92.5	Very high	86.9	Confident	41 Å²	41	26.8 Å²	26.8	16%	0.155	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-48.7	174.5	-178	174.7	-68.1	132.4	3.7	112.1	E500 C501 R502 L506 F507 N508 Q2321	E500-R504 PolarHBondContact O-N 3.07Å; E500-R504 IonicContact OE1-CZ 3.48Å; E500-R504 IonicContact OE1-NH1 3.34Å; E500-R504 PolarHBondContact OE1-NH1 3.48Å; E500-R504 IonicContact OE1-NH2 2.69Å; E500-R504 PolarHBondContact OE1-NH2 3.3Å; C501-R504 PolarHBondContact O-N 3.31Å; R502-R504 VanDerWaalsContact C-N 3.34Å; R504-L506 VanDerWaalsContact C-N 3.32Å; R504-L506 PolarHBondContact O-N 3.07Å; R504-F507 PolarHBondContact O-N 2.9Å; R504-N508 WeakPolarHBondContact O-CB 3.3Å; R504-N508 VanDerWaalsContact O-CG 3.23Å; R504-N508 PolarHBondContact O-N 3.45Å; R504-N508 PolarHBondContact O-OD1 3.39Å; R504-Q2321 VanDerWaalsContact CZ-OE1 3.29Å
505	A	94.4	Very high	88.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-57.8	-42	175.3	0	0	0	0	0	112.6	C501 N508 M509 D631 L634 L635	C501-A505 WeakPolarHBondContact O-CB 3.38Å; C501-A505 PolarHBondContact O-N 3.32Å; A505-N508 PolarHBondContact O-N 2.87Å; A505-M509 WeakPolarHBondContact O-CB 3.34Å; A505-M509 WeakPolarHBondContact O-CG 3.42Å; A505-M509 PolarHBondContact O-N 3Å; A505-D631 HydrophobicContact CB-CB 3.66Å; A505-L634 HydrophobicContact CB-CD2 3.98Å; A505-L635 HydrophobicContact CB-CD1 3.84Å; A505-L635 HydrophobicContact CB-CD2 4.33Å; A505-L635 HydrophobicContact CB-CG 3.81Å
506	L	95	Very high	90.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-54.9	-53.1	172.7	165.3	68.9	0	0	0	111.9	R502 L503 R504 L510 F531 L557 I754 L758	R502-L506 WeakPolarHBondContact O-CB 3.15Å; R502-L506 PolarHBondContact O-N 2.89Å; L503-L506 HydrophobicContact CD1-CD2 4.26Å; L503-L506 WeakPolarHBondContact O-CB 3.49Å; L503-L506 PolarHBondContact O-N 3.45Å; R504-L506 VanDerWaalsContact C-N 3.32Å; R504-L506 PolarHBondContact O-N 3.07Å; L506-L510 HydrophobicContact CD1-CD1 3.71Å; L506-L510 HydrophobicContact CD1-CG 4.12Å; L506-L510 HydrophobicContact CG-CD1 4.09Å; L506-L510 WeakPolarHBondContact O-CB 3.44Å; L506-L510 VanDerWaalsContact O-CG 3.28Å; L506-L510 WeakPolarHBondContact O-CG 3.28Å; L506-L510 PolarHBondContact O-N 3.45Å; L506-F531 HydrophobicContact CD2-CE1 4.2Å; L506-L557 HydrophobicContact CD2-CD2 3.62Å; L506-L557 HydrophobicContact CD2-CG 4.35Å; L506-I754 HydrophobicContact CD1-CD1 4.15Å; L506-I754 HydrophobicContact CD1-CG2 3.44Å; L506-I754 VanDerWaalsContact CD1-CG2 3.44Å; L506-L758 HydrophobicContact CB-CD1 4.27Å; L506-L758 HydrophobicContact CD1-CD1 4.21Å; L506-L758 HydrophobicContact CD2-CD1 4.01Å; L506-L758 HydrophobicContact CG-CD1 4.41Å
507	F	94.7	Very high	90.9	Very high	12 Å²	12	24.4 Å²	24.4	5%	0.053	12%	0.118	C	C	.	.	H	α-helix	trans	-66.6	-43.2	-179.5	-80.8	-70.9	0	0	0	112.3	T461 N465 F468 L503 R504 M509 L510 D511 F531	T461-F507 HydrophobicContact CG2-CD1 3.91Å; T461-F507 HydrophobicContact CG2-CE1 3.88Å; N465-F507 HydrophobicContact CB-CD2 3.99Å; N465-F507 HydrophobicContact CB-CE2 3.69Å; N465-F507 HydrophobicContact CB-CZ 4.19Å; N465-F507 WeakPolarHBondContact OD1-CD2 3.35Å; N465-F507 WeakPolarHBondContact OD1-CE2 3.26Å; F468-F507 HydrophobicContact CD2-CE2 4.24Å; F468-F507 HydrophobicContact CD2-CZ 4.19Å; F468-F507 HydrophobicContact CE2-CZ 4.47Å; L503-F507 HydrophobicContact CD1-CD2 4.44Å; L503-F507 HydrophobicContact CD1-CE2 3.97Å; L503-F507 HydrophobicContact CG-CD2 4.19Å; L503-F507 HydrophobicContact CG-CE2 4.04Å; L503-F507 VanDerWaalsContact O-CD2 3.32Å; L503-F507 WeakPolarHBondContact O-CD2 3.37Å; L503-F507 PolarHBondContact O-N 2.88Å; L503-F507 VanDerWaalsContact O-N 3.12Å; R504-F507 PolarHBondContact O-N 2.9Å; F507-M509 VanDerWaalsContact C-N 3.34Å; F507-M509 PolarHBondContact O-N 3.48Å; F507-L510 PolarHBondContact O-N 3.23Å; F507-D511 WeakPolarHBondContact O-CB 3.34Å; F507-D511 PolarHBondContact O-N 3.06Å; F507-F531 HydrophobicContact CE1-CE2 4.37Å; F507-F531 AromaticContact CE1-CZ 3.89Å; F507-F531 HydrophobicContact CE1-CZ 3.89Å; F507-F531 HydrophobicContact CZ-CZ 4.16Å
508	N	93.8	Very high	91.2	Very high	47 Å²	47	21.9 Å²	21.9	25%	0.251	11%	0.107	S	C	.	.	H	α-helix	trans	-56	-47.3	176.1	-71	-6.4	0	0	0	111.9	R504 A505 S512 L628 D631	R504-N508 WeakPolarHBondContact O-CB 3.3Å; R504-N508 VanDerWaalsContact O-CG 3.23Å; R504-N508 PolarHBondContact O-N 3.45Å; R504-N508 PolarHBondContact O-OD1 3.39Å; A505-N508 PolarHBondContact O-N 2.87Å; N508-S512 PolarHBondContact O-N 3.49Å; N508-L628 HydrophobicContact CB-CD2 4.45Å; N508-D631 WeakPolarHBondContact CB-OD2 3.5Å; N508-D631 PolarHBondContact ND2-OD2 2.83Å
509	M	94.3	Very high	90.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.9	-51.4	177.1	-77.9	-163.8	160.2	0	0	111.9	A505 F507 D511 S512 F513 L628 D631 A632 L635 F637 W643 L750 I754	A505-M509 WeakPolarHBondContact O-CB 3.34Å; A505-M509 WeakPolarHBondContact O-CG 3.42Å; A505-M509 PolarHBondContact O-N 3Å; F507-M509 VanDerWaalsContact C-N 3.34Å; F507-M509 PolarHBondContact O-N 3.48Å; M509-D511 VanDerWaalsContact C-N 3.3Å; M509-D511 PolarHBondContact O-N 3.23Å; M509-S512 PolarHBondContact O-N 3.25Å; M509-S512 PolarHBondContact O-OG 3.37Å; M509-F513 WeakPolarHBondContact O-CD2 3.31Å; M509-F513 PolarHBondContact O-N 3.21Å; M509-L628 HydrophobicContact CG-CD2 3.96Å; M509-D631 HydrophobicContact CE-CB 4.44Å; M509-A632 VanDerWaalsContact CE-CA 3.48Å; M509-A632 HydrophobicContact CE-CB 3.49Å; M509-A632 VanDerWaalsContact CE-CB 3.49Å; M509-L635 HydrophobicContact SD-CD1 3.67Å; M509-F637 HydrophobicContact CE-CD2 4.07Å; M509-F637 HydrophobicContact CE-CE2 3.65Å; M509-F637 HydrophobicContact SD-CE2 3.54Å; M509-F637 VanDerWaalsContact SD-CE2 3.54Å; M509-F637 HydrophobicContact SD-CZ 3.95Å; M509-W643 HydrophobicContact CE-CE3 4.25Å; M509-W643 HydrophobicContact CE-CH2 3.97Å; M509-W643 HydrophobicContact CE-CZ2 4.46Å; M509-W643 HydrophobicContact CE-CZ3 3.85Å; M509-L750 HydrophobicContact SD-CD1 4Å; M509-I754 HydrophobicContact CB-CD1 4.46Å
510	L	94.6	Very high	90.2	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-56.4	-44.8	178.4	-72.5	173.6	0	0	0	111.7	L506 F507 F513 T514 F531 T559 I754	L506-L510 HydrophobicContact CD1-CD1 3.71Å; L506-L510 HydrophobicContact CD1-CG 4.12Å; L506-L510 HydrophobicContact CG-CD1 4.09Å; L506-L510 WeakPolarHBondContact O-CB 3.44Å; L506-L510 VanDerWaalsContact O-CG 3.28Å; L506-L510 WeakPolarHBondContact O-CG 3.28Å; L506-L510 PolarHBondContact O-N 3.45Å; F507-L510 PolarHBondContact O-N 3.23Å; L510-F513 PolarHBondContact O-N 3.24Å; L510-T514 WeakPolarHBondContact O-CA 3.5Å; L510-T514 VanDerWaalsContact O-CB 3.27Å; L510-T514 WeakPolarHBondContact O-CB 3.27Å; L510-T514 WeakPolarHBondContact O-CG2 3.44Å; L510-T514 PolarHBondContact O-N 3.39Å; L510-T514 PolarHBondContact O-OG1 3.22Å; L510-F531 HydrophobicContact CD1-CE1 3.92Å; L510-F531 HydrophobicContact CD1-CZ 3.94Å; L510-T559 HydrophobicContact CD1-CG2 4.04Å; L510-T559 HydrophobicContact CD2-CG2 4.25Å; L510-I754 HydrophobicContact CD2-CD1 4.38Å
511	D	93.9	Very high	90	Very high	27 Å²	27	21.6 Å²	21.6	14%	0.144	11%	0.107	C	C	.	.	H	α-helix	trans	-63.2	-42.9	179.1	-76.9	6.7	0	0	0	111.6	F507 M509 F513 T514 C515 N523 R529	F507-D511 WeakPolarHBondContact O-CB 3.34Å; F507-D511 PolarHBondContact O-N 3.06Å; M509-D511 VanDerWaalsContact C-N 3.3Å; M509-D511 PolarHBondContact O-N 3.23Å; D511-F513 VanDerWaalsContact C-N 3.31Å; D511-F513 PolarHBondContact O-N 3.11Å; D511-T514 PolarHBondContact O-N 3.39Å; D511-C515 HydrophobicContact CB-CB 4.38Å; D511-C515 WeakPolarHBondContact O-CA 3.48Å; D511-C515 WeakPolarHBondContact O-CB 3.4Å; D511-C515 PolarHBondContact O-N 3.43Å; D511-C515 PolarHBondContact OD1-SG 2.87Å; D511-C515 VanDerWaalsContact OD1-SG 3.41Å; D511-N523 PolarHBondContact OD2-ND2 2.99Å; D511-R529 IonicContact OD1-CZ 2.69Å; D511-R529 IonicContact OD1-NH1 3.46Å; D511-R529 PolarHBondContact OD1-NH1 3.1Å; D511-R529 IonicContact OD1-NH2 3.52Å; D511-R529 PolarHBondContact OD1-NH2 3.2Å
512	S	94.2	Very high	89.7	Confident	3 Å²	3	19.2 Å²	19.2	2%	0.021	9%	0.09	C	C	.	.	H	α-helix	trans	-60.4	-37.2	-179.1	71.1	0	0	0	0	113.9	N508 M509 H580 I581	N508-S512 PolarHBondContact O-N 3.49Å; M509-S512 PolarHBondContact O-N 3.25Å; M509-S512 PolarHBondContact O-OG 3.37Å; S512-H580 PolarHBondContact O-N 3.48Å; S512-I581 WeakPolarHBondContact O-CB 3.4Å; S512-I581 PolarHBondContact O-N 3.03Å
513	F	95.8	Very high	89.4	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-91.7	-26.4	179.3	-73.9	-102.4	0	0	0	114.4	M509 L510 D511 F579 I581 W643 I648 L652 Y743 I746 V747 L750	M509-F513 WeakPolarHBondContact O-CD2 3.31Å; M509-F513 PolarHBondContact O-N 3.21Å; L510-F513 PolarHBondContact O-N 3.24Å; D511-F513 VanDerWaalsContact C-N 3.31Å; D511-F513 PolarHBondContact O-N 3.11Å; F513-F579 WeakPolarHBondContact O-CD1 3.08Å; F513-F579 WeakPolarHBondContact O-CG 3.3Å; F513-I581 HydrophobicContact CD1-CB 4.46Å; F513-I581 HydrophobicContact CD1-CG1 4.28Å; F513-I581 HydrophobicContact CD1-CG2 4.1Å; F513-I581 HydrophobicContact CD2-CB 4.36Å; F513-I581 HydrophobicContact CD2-CD1 4.18Å; F513-I581 HydrophobicContact CD2-CG1 4.18Å; F513-I581 HydrophobicContact CE1-CD1 4.48Å; F513-I581 HydrophobicContact CE1-CG1 3.86Å; F513-I581 HydrophobicContact CE1-CG2 4.37Å; F513-I581 HydrophobicContact CE2-CB 4.42Å; F513-I581 HydrophobicContact CE2-CD1 3.53Å; F513-I581 HydrophobicContact CE2-CG1 3.76Å; F513-I581 HydrophobicContact CG-CB 4.38Å; F513-I581 HydrophobicContact CG-CG1 4.43Å; F513-I581 HydrophobicContact CG-CG2 4.31Å; F513-I581 HydrophobicContact CZ-CB 4.5Å; F513-I581 HydrophobicContact CZ-CD1 3.7Å; F513-I581 HydrophobicContact CZ-CG1 3.57Å; F513-W643 AromaticContact CE2-CH2 3.9Å; F513-W643 HydrophobicContact CE2-CH2 3.9Å; F513-W643 HydrophobicContact CE2-CZ3 4.12Å; F513-W643 HydrophobicContact CZ-CH2 4.12Å; F513-W643 HydrophobicContact CZ-CZ3 4.13Å; F513-I648 HydrophobicContact CE1-CG2 3.8Å; F513-I648 HydrophobicContact CZ-CG2 3.59Å; F513-L652 HydrophobicContact CE1-CD1 3.97Å; F513-L652 HydrophobicContact CE1-CD2 4.28Å; F513-L652 HydrophobicContact CZ-CD1 4.15Å; F513-Y743 HydrophobicContact CD1-CE2 4.48Å; F513-Y743 PolarHBondContact O-OH 3.41Å; F513-I746 HydrophobicContact CD1-CG2 4.23Å; F513-I746 HydrophobicContact CE1-CG2 3.75Å; F513-V747 HydrophobicContact CB-CG2 4.18Å; F513-V747 HydrophobicContact CD1-CG2 4.31Å; F513-L750 HydrophobicContact CB-CD2 4.1Å; F513-L750 HydrophobicContact CD1-CD2 4.19Å; F513-L750 HydrophobicContact CD2-CD2 3.36Å; F513-L750 HydrophobicContact CE1-CD2 4.47Å; F513-L750 HydrophobicContact CE2-CD2 3.72Å; F513-L750 HydrophobicContact CG-CD2 3.63Å; F513-L750 HydrophobicContact CZ-CD2 4.27Å
514	T	93.7	Very high	89.2	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-121	-7.7	-167.3	74.9	0	0	0	0	114.6	L510 D511 R526 R529 L561 F564 V747	L510-T514 WeakPolarHBondContact O-CA 3.5Å; L510-T514 VanDerWaalsContact O-CB 3.27Å; L510-T514 WeakPolarHBondContact O-CB 3.27Å; L510-T514 WeakPolarHBondContact O-CG2 3.44Å; L510-T514 PolarHBondContact O-N 3.39Å; L510-T514 PolarHBondContact O-OG1 3.22Å; D511-T514 PolarHBondContact O-N 3.39Å; T514-R526 WeakPolarHBondContact O-CB 3.44Å; T514-R526 PolarHBondContact O-N 3.03Å; T514-R529 PolarHBondContact OG1-NH2 3.38Å; T514-L561 HydrophobicContact CG2-CD1 3.53Å; T514-F564 HydrophobicContact CG2-CE2 4.25Å; T514-V747 HydrophobicContact CG2-CG1 4.19Å
515	C	93.2	Very high	89.1	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	156.4	167.4	-63	0	0	0	0	111.4	D511 N523 G524 S525 R529 F579 H580	D511-C515 HydrophobicContact CB-CB 4.38Å; D511-C515 WeakPolarHBondContact O-CA 3.48Å; D511-C515 WeakPolarHBondContact O-CB 3.4Å; D511-C515 PolarHBondContact O-N 3.43Å; D511-C515 PolarHBondContact OD1-SG 2.87Å; D511-C515 VanDerWaalsContact OD1-SG 3.41Å; C515-N523 WeakPolarHBondContact CB-OD1 3.49Å; C515-N523 PolarHBondContact SG-OD1 2.81Å; C515-G524 WeakPolarHBondContact CA-O 3.34Å; C515-S525 WeakPolarHBondContact SG-CA 3.43Å; C515-R529 PolarHBondContact SG-NH2 3.16Å; C515-R529 VanDerWaalsContact SG-NH2 3.37Å; C515-F579 VanDerWaalsContact O-CD1 3.31Å; C515-F579 WeakPolarHBondContact O-CD1 3.14Å; C515-H580 VanDerWaalsContact C-CD2 3.44Å; C515-H580 PolarHBondContact O-CD2 2.87Å
516	S	89.1	Confident	89	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	156.4	169.6	58.3	0	0	0	0	109.3	I518 G524 R568 H580	S516-I518 PolarHBondContact O-N 3.24Å; S516-G524 PolarHBondContact N-O 3.41Å; S516-G524 VanDerWaalsContact N-O 3.08Å; S516-G524 WeakPolarHBondContact O-CA 3.49Å; S516-G524 PolarHBondContact O-N 3.38Å; S516-R568 WeakPolarHBondContact OG-CD 3.42Å; S516-R568 PolarHBondContact OG-NE 2.83Å; S516-R568 PolarHBondContact OG-NH1 2.89Å; S516-H580 WeakPolarHBondContact CA-NE2 3.45Å
517	R	84.4	Confident	88.9	Confident	73 Å²	73	18.4 Å²	18.4	28%	0.275	9%	0.094	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	116.7	169.4	-180	173.5	-179	160.3	1.6	110.1	T522 P577	R517-T522 WeakPolarHBondContact CA-O 3.45Å; R517-P577 HydrophobicContact CB-CG 3.77Å; R517-P577 WeakPolarHBondContact O-CD 2.74Å
518	I	80.3	Confident	88.8	Confident	9 Å²	9	18 Å²	18	5%	0.046	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	152.2	172.5	-54.5	176.9	0	0	0	107.3	S516 L520 N521 E576	S516-I518 PolarHBondContact O-N 3.24Å; I518-L520 PolarHBondContact O-N 3.4Å; I518-N521 HydrophobicContact CB-CB 4.4Å; I518-N521 PolarHBondContact N-O 3.02Å; I518-N521 CarbonylContact O-C 3.48Å; I518-N521 PolarHBondContact O-N 3.27Å; I518-E576 VanDerWaalsContact CA-OE1 3.3Å; I518-E576 WeakPolarHBondContact CA-OE1 3.47Å; I518-E576 VanDerWaalsContact CG2-OE1 3.27Å; I518-E576 WeakPolarHBondContact CG2-OE1 3.38Å
519	I	74.5	Confident	88.8	Confident	57 Å²	57	15.7 Å²	15.7	29%	0.292	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-23.8	-176.5	-72.1	158.6	0	0	0	114.6	E576 Y787	I519-E576 HydrophobicContact CD1-CG 4.08Å; I519-E576 HydrophobicContact CG1-CG 3.9Å; I519-E576 PolarHBondContact N-OE1 3.28Å; I519-Y787 HydrophobicContact CB-CD2 4.44Å; I519-Y787 HydrophobicContact CB-CE1 4.09Å; I519-Y787 HydrophobicContact CB-CE2 3.69Å; I519-Y787 HydrophobicContact CD1-CD2 3.81Å; I519-Y787 HydrophobicContact CD1-CE2 3.78Å; I519-Y787 HydrophobicContact CD1-CG 4.49Å; I519-Y787 HydrophobicContact CG1-CE2 4.29Å; I519-Y787 HydrophobicContact CG2-CD1 4.13Å; I519-Y787 HydrophobicContact CG2-CE1 3.58Å; I519-Y787 HydrophobicContact CG2-CE2 4.05Å
520	L	75.9	Confident	88.8	Confident	59 Å²	59	15.8 Å²	15.8	31%	0.309	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	9.8	174.7	-68.8	175.8	0	0	0	114.9	I518 Y787 T1079 G1081 L1082	I518-L520 PolarHBondContact O-N 3.4Å; L520-Y787 HydrophobicContact CD1-CE1 3.76Å; L520-Y787 HydrophobicContact CG-CE1 3.85Å; L520-Y787 WeakPolarHBondContact CG-OH 3.33Å; L520-Y787 PolarHBondContact N-OH 3.15Å; L520-T1079 HydrophobicContact CD2-CG2 4.18Å; L520-G1081 CarbonylContact O-C 3.52Å; L520-G1081 WeakPolarHBondContact O-CA 3.32Å; L520-L1082 HydrophobicContact CD2-CD1 4.39Å
521	N	81.9	Confident	88.8	Confident	16 Å²	16	15.7 Å²	15.7	9%	0.086	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	120.3	175.2	-175.2	2.9	0	0	0	111.1	S456 G457 I518 N523 G524 G1081	S456-N521 WeakPolarHBondContact OG-CB 3.49Å; S456-N521 PolarHBondContact OG-ND2 3.31Å; S456-N521 VanDerWaalsContact OG-ND2 3.08Å; G457-N521 PolarHBondContact N-ND2 2.87Å; I518-N521 HydrophobicContact CB-CB 4.4Å; I518-N521 PolarHBondContact N-O 3.02Å; I518-N521 CarbonylContact O-C 3.48Å; I518-N521 PolarHBondContact O-N 3.27Å; N521-N523 VanDerWaalsContact C-N 3.31Å; N521-N523 PolarHBondContact ND2-O 2.88Å; N521-N523 PolarHBondContact O-N 2.86Å; N521-N523 PolarHBondContact OD1-N 3.35Å; N521-N523 VanDerWaalsContact OD1-N 3.15Å; N521-N523 PolarHBondContact OD1-O 3.47Å; N521-G524 WeakPolarHBondContact ND2-CA 3.42Å; N521-G1081 WeakPolarHBondContact CA-O 3.15Å; N521-G1081 PolarHBondContact OD1-O 3.03Å
522	T	81.2	Confident	88.7	Confident	15 Å²	15	14.4 Å²	14.4	9%	0.092	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	-38	178.5	32.8	0	0	0	0	113.6	R517 G1081 L1082 E1084 L1085	R517-T522 WeakPolarHBondContact CA-O 3.45Å; T522-G1081 PolarHBondContact N-O 3.08Å; T522-G1081 VanDerWaalsContact N-O 3.12Å; T522-G1081 PolarHBondContact OG1-O 3.36Å; T522-L1082 HydrophobicContact CG2-CD2 4.36Å; T522-E1084 VanDerWaalsContact CB-OE2 3.26Å; T522-E1084 WeakPolarHBondContact CB-OE2 3.18Å; T522-E1084 HydrophobicContact CG2-CB 4.34Å; T522-E1084 PolarHBondContact OG1-OE2 2.79Å; T522-L1085 HydrophobicContact CG2-CD1 4.24Å; T522-L1085 HydrophobicContact CG2-CD2 3.63Å; T522-L1085 HydrophobicContact CG2-CG 3.64Å
523	N	86.7	Confident	88.7	Confident	44 Å²	44	14.2 Å²	14.2	24%	0.235	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	76.6	-175.8	-175.1	15.2	0	0	0	109.2	D511 C515 N521	D511-N523 PolarHBondContact OD2-ND2 2.99Å; C515-N523 WeakPolarHBondContact CB-OD1 3.49Å; C515-N523 PolarHBondContact SG-OD1 2.81Å; N521-N523 VanDerWaalsContact C-N 3.31Å; N521-N523 PolarHBondContact ND2-O 2.88Å; N521-N523 PolarHBondContact O-N 2.86Å; N521-N523 PolarHBondContact OD1-N 3.35Å; N521-N523 VanDerWaalsContact OD1-N 3.15Å; N521-N523 PolarHBondContact OD1-O 3.47Å
524	G	88.4	Confident	88.4	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	103.9	-171.6	0	0	0	0	0	113.9	C515 S516 N521 R526	C515-G524 WeakPolarHBondContact CA-O 3.34Å; S516-G524 PolarHBondContact N-O 3.41Å; S516-G524 VanDerWaalsContact N-O 3.08Å; S516-G524 WeakPolarHBondContact O-CA 3.49Å; S516-G524 PolarHBondContact O-N 3.38Å; N521-G524 WeakPolarHBondContact ND2-CA 3.42Å; G524-R526 WeakPolarHBondContact O-CD 3.35Å; G524-R526 WeakPolarHBondContact O-CG 3.48Å; G524-R526 PolarHBondContact O-N 2.89Å
525	S	91.9	Very high	88.2	Confident	20 Å²	20	14.4 Å²	14.4	14%	0.14	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	128.6	177.3	-30.5	0	0	0	0	112.4	C515 V781	C515-S525 WeakPolarHBondContact SG-CA 3.43Å; S525-V781 WeakPolarHBondContact O-CG1 3.05Å
526	R	91.4	Very high	87.8	Confident	1 Å²	1	14.4 Å²	14.4	0%	0.004	7%	0.073	C	C	.	.			trans	-117.2	22.8	-178.6	-49.2	-55.7	-63.7	155.2	-12.4	113.7	T514 G524 E565 F579 Q784 D821 F824	T514-R526 WeakPolarHBondContact O-CB 3.44Å; T514-R526 PolarHBondContact O-N 3.03Å; G524-R526 WeakPolarHBondContact O-CD 3.35Å; G524-R526 WeakPolarHBondContact O-CG 3.48Å; G524-R526 PolarHBondContact O-N 2.89Å; R526-E565 HydrophobicContact CB-CB 3.77Å; R526-E565 IonicContact CZ-OE1 2.83Å; R526-E565 IonicContact CZ-OE2 2.89Å; R526-E565 IonicContact NE-OE1 2.59Å; R526-E565 IonicContact NE-OE2 3.95Å; R526-E565 PolarHBondContact NE-OE2 3.32Å; R526-E565 VanDerWaalsContact NH2-CD 3.27Å; R526-E565 IonicContact NH2-OE1 3.27Å; R526-E565 PolarHBondContact NH2-OE1 2.85Å; R526-E565 IonicContact NH2-OE2 3.46Å; R526-E565 PolarHBondContact NH2-OE2 3.16Å; R526-E565 PolarHBondContact O-N 2.86Å; R526-F579 HydrophobicContact CB-CE1 4.05Å; R526-F579 HydrophobicContact CB-CZ 4.39Å; R526-F579 HydrophobicContact CG-CE1 4.07Å; R526-Q784 VanDerWaalsContact NH1-CD 3.35Å; R526-Q784 VanDerWaalsContact NH1-NE2 3.12Å; R526-D821 IonicContact NH2-OD1 2.91Å; R526-F824 WeakPolarHBondContact O-CZ 3.12Å
527	A	92.3	Very high	87.5	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.079	C	C	.	.	S	Bend	trans	-140.6	147.3	169.8	0	0	0	0	0	109.7	R529 L561 F564 V781	A527-R529 PolarHBondContact O-N 3.39Å; A527-L561 HydrophobicContact CB-CB 4.22Å; A527-L561 HydrophobicContact CB-CD1 4.09Å; A527-L561 HydrophobicContact CB-CD2 4.02Å; A527-L561 HydrophobicContact CB-CG 4.35Å; A527-F564 HydrophobicContact CB-CB 4.26Å; A527-F564 HydrophobicContact CB-CD2 3.98Å; A527-V781 VanDerWaalsContact O-CG2 3.31Å; A527-V781 WeakPolarHBondContact O-CG2 2.98Å
528	L	93.5	Very high	86.9	Confident	3 Å²	3	12.4 Å²	12.4	2%	0.016	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.1	166.6	-179.1	178.2	0	0	0	106.9	L530 L561 L562 L563 V778 P780 F831 M1033 L1036	L528-L530 HydrophobicContact CD2-CB 4.46Å; L528-L561 WeakPolarHBondContact O-CA 3.41Å; L528-L562 HydrophobicContact CB-CB 4.18Å; L528-L562 WeakPolarHBondContact CB-O 3.3Å; L528-L562 HydrophobicContact CD1-CB 4.3Å; L528-L562 HydrophobicContact CD1-CD1 4.46Å; L528-L562 HydrophobicContact CD2-CB 4.31Å; L528-L562 HydrophobicContact CD2-CD1 4.14Å; L528-L562 HydrophobicContact CG-CB 4.49Å; L528-L562 PolarHBondContact N-O 3.28Å; L528-L562 PolarHBondContact O-N 3.37Å; L528-L563 HydrophobicContact CD1-CD1 4.36Å; L528-V778 HydrophobicContact CD2-CG1 4.08Å; L528-P780 HydrophobicContact CG-CB 4.22Å; L528-F831 HydrophobicContact CD1-CE2 3.94Å; L528-F831 HydrophobicContact CD1-CZ 4.01Å; L528-M1033 HydrophobicContact CD1-SD 4.16Å; L528-L1036 HydrophobicContact CD1-CD2 3.93Å; L528-L1036 HydrophobicContact CD2-CD2 4.45Å
529	R	94	Very high	86.2	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.9	-179	-55.2	-179.3	170.4	174.5	-4.1	109.7	T461 D511 T514 C515 A527 F531 L561 D779	T461-R529 VanDerWaalsContact CG2-NH1 3.34Å; D511-R529 IonicContact OD1-CZ 2.69Å; D511-R529 IonicContact OD1-NH1 3.46Å; D511-R529 PolarHBondContact OD1-NH1 3.1Å; D511-R529 IonicContact OD1-NH2 3.52Å; D511-R529 PolarHBondContact OD1-NH2 3.2Å; T514-R529 PolarHBondContact OG1-NH2 3.38Å; C515-R529 PolarHBondContact SG-NH2 3.16Å; C515-R529 VanDerWaalsContact SG-NH2 3.37Å; A527-R529 PolarHBondContact O-N 3.39Å; R529-F531 HydrophobicContact CB-CD2 4.3Å; R529-F531 HydrophobicContact CB-CE2 3.59Å; R529-F531 HydrophobicContact CB-CZ 4.06Å; R529-L561 HydrophobicContact CB-CD2 4.26Å; R529-L561 HydrophobicContact CG-CD2 3.73Å; R529-D779 HydrophobicContact CB-CB 4.3Å; R529-D779 PolarHBondContact N-O 3.17Å; R529-D779 PolarHBondContact O-N 3.18Å
530	L	94.1	Very high	85.2	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.005	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.8	175.1	-176.3	65.8	0	0	0	108.2	L528 R560 I776 V778 L1012 F1015 L1036	L528-L530 HydrophobicContact CD2-CB 4.46Å; L530-R560 PolarHBondContact N-O 3.19Å; L530-R560 PolarHBondContact O-N 3.42Å; L530-I776 HydrophobicContact CD1-CG2 3.74Å; L530-V778 HydrophobicContact CD1-CG2 3.88Å; L530-L1012 HydrophobicContact CD2-CD1 4.3Å; L530-L1012 HydrophobicContact CD2-CD2 3.96Å; L530-L1012 HydrophobicContact CG-CD1 4.12Å; L530-L1012 HydrophobicContact CG-CD2 4.05Å; L530-F1015 HydrophobicContact CD2-CB 4.09Å; L530-F1015 HydrophobicContact CD2-CG 4.42Å; L530-L1036 HydrophobicContact CD1-CD1 4.36Å; L530-L1036 HydrophobicContact CD2-CD1 4.08Å
531	F	94.5	Very high	83.6	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	145.9	-179.9	-60	-87.6	0	0	0	110.2	F468 L506 F507 L510 R529 L557 T558 T559 I776 L777	F468-F531 HydrophobicContact CE2-CB 3.97Å; F468-F531 HydrophobicContact CE2-CD1 4.2Å; F468-F531 HydrophobicContact CE2-CD2 4.09Å; F468-F531 AromaticContact CE2-CG 3.86Å; F468-F531 HydrophobicContact CE2-CG 3.86Å; F468-F531 HydrophobicContact CZ-CB 3.58Å; F468-F531 HydrophobicContact CZ-CD2 4.39Å; F468-F531 HydrophobicContact CZ-CG 4.01Å; L506-F531 HydrophobicContact CD2-CE1 4.2Å; F507-F531 HydrophobicContact CE1-CE2 4.37Å; F507-F531 AromaticContact CE1-CZ 3.89Å; F507-F531 HydrophobicContact CE1-CZ 3.89Å; F507-F531 HydrophobicContact CZ-CZ 4.16Å; L510-F531 HydrophobicContact CD1-CE1 3.92Å; L510-F531 HydrophobicContact CD1-CZ 3.94Å; R529-F531 HydrophobicContact CB-CD2 4.3Å; R529-F531 HydrophobicContact CB-CE2 3.59Å; R529-F531 HydrophobicContact CB-CZ 4.06Å; F531-L557 HydrophobicContact CB-CD1 4.3Å; F531-L557 HydrophobicContact CD1-CD1 4.41Å; F531-T558 CarbonylContact C-O 3.6Å; F531-T558 WeakPolarHBondContact CA-O 3.44Å; F531-T559 HydrophobicContact CD1-CG2 3.97Å; F531-T559 WeakPolarHBondContact CD1-OG1 3.5Å; F531-T559 HydrophobicContact CE1-CG2 3.71Å; F531-I776 CarbonylContact O-C 3.6Å; F531-I776 WeakPolarHBondContact O-CA 3.42Å; F531-L777 HydrophobicContact CB-CB 4.32Å; F531-L777 HydrophobicContact CD2-CD2 4.03Å; F531-L777 PolarHBondContact N-O 3.47Å; F531-L777 PolarHBondContact O-N 3.06Å
532	S	92.2	Very high	82.1	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	111.3	170.9	151.3	0	0	0	0	108.8	E534 L557 T558 Q774 L775	S532-E534 PolarHBondContact OG-OE1 3.21Å; S532-L557 WeakPolarHBondContact O-CA 3.48Å; S532-T558 WeakPolarHBondContact CB-OG1 3.35Å; S532-T558 PolarHBondContact N-O 3.29Å; S532-T558 PolarHBondContact O-N 3.24Å; S532-T558 PolarHBondContact O-OG1 3.47Å; S532-T558 PolarHBondContact OG-OG1 2.95Å; S532-T558 VanDerWaalsContact OG-OG1 3.12Å; S532-Q774 PolarHBondContact OG-NE2 3.28Å; S532-L775 WeakPolarHBondContact CA-O 3.13Å
533	L	93.1	Very high	80.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	118	172.9	-173	73.7	0	0	0	108.6	F468 M471 F535 V554 L557 Q774 L775	F468-L533 HydrophobicContact CD1-CB 4.43Å; F468-L533 HydrophobicContact CD1-CD2 3.95Å; F468-L533 HydrophobicContact CE1-CB 3.95Å; F468-L533 HydrophobicContact CE1-CD2 4.26Å; M471-L533 HydrophobicContact CB-CD2 3.67Å; M471-L533 HydrophobicContact CG-CD2 4.01Å; L533-F535 HydrophobicContact CB-CE2 4.43Å; L533-F535 HydrophobicContact CD2-CE1 4.26Å; L533-F535 HydrophobicContact CD2-CE2 3.87Å; L533-F535 HydrophobicContact CD2-CZ 3.49Å; L533-F535 VanDerWaalsContact CD2-CZ 3.49Å; L533-F535 HydrophobicContact CG-CE2 4.04Å; L533-F535 HydrophobicContact CG-CZ 4.08Å; L533-V554 HydrophobicContact CD1-CG1 3.59Å; L533-V554 HydrophobicContact CD1-CG2 4.08Å; L533-V554 HydrophobicContact CD2-CG2 4.07Å; L533-V554 HydrophobicContact CG-CG1 4.38Å; L533-V554 HydrophobicContact CG-CG2 4.19Å; L533-L557 HydrophobicContact CB-CD1 4.37Å; L533-L557 HydrophobicContact CD1-CB 4.19Å; L533-L557 HydrophobicContact CD1-CD1 4.14Å; L533-Q774 CarbonylContact O-C 3.37Å; L533-Q774 WeakPolarHBondContact O-CA 3.35Å; L533-L775 HydrophobicContact CB-CB 4.35Å; L533-L775 PolarHBondContact N-O 3.21Å; L533-L775 PolarHBondContact O-N 2.92Å
534	E	89.7	Confident	79.3	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.009	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136.4	-172.4	-67.6	153.9	-143.2	0	0	110.2	S532 V554 T555 G556 T558 V771 Y1011	S532-E534 PolarHBondContact OG-OE1 3.21Å; E534-V554 WeakPolarHBondContact O-CA 3.32Å; E534-T555 PolarHBondContact O-N 2.9Å; E534-T555 PolarHBondContact O-OG1 2.81Å; E534-G556 PolarHBondContact N-O 2.87Å; E534-G556 PolarHBondContact O-N 3.46Å; E534-T558 WeakPolarHBondContact OE1-CG2 3.29Å; E534-T558 PolarHBondContact OE1-OG1 3.43Å; E534-V771 HydrophobicContact CB-CG1 3.95Å; E534-V771 HydrophobicContact CB-CG2 4.14Å; E534-V771 HydrophobicContact CG-CG1 4.21Å; E534-Y1011 WeakPolarHBondContact OE1-CD2 3.32Å
535	F	89	Confident	77.9	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.009	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.4	-177.5	-60.6	-96.8	0	0	0	112.4	L412 L415 M471 L533 L552 I553 V554 A772 A773 L775	L412-F535 HydrophobicContact CD1-CE1 4.42Å; L415-F535 HydrophobicContact CD1-CD2 4.2Å; L415-F535 HydrophobicContact CD1-CE2 3.98Å; M471-F535 HydrophobicContact CB-CZ 4.27Å; M471-F535 HydrophobicContact CE-CZ 4.39Å; M471-F535 HydrophobicContact CG-CZ 4.22Å; M471-F535 HydrophobicContact SD-CE1 4.45Å; M471-F535 HydrophobicContact SD-CZ 3.99Å; L533-F535 HydrophobicContact CB-CE2 4.43Å; L533-F535 HydrophobicContact CD2-CE1 4.26Å; L533-F535 HydrophobicContact CD2-CE2 3.87Å; L533-F535 HydrophobicContact CD2-CZ 3.49Å; L533-F535 VanDerWaalsContact CD2-CZ 3.49Å; L533-F535 HydrophobicContact CG-CE2 4.04Å; L533-F535 HydrophobicContact CG-CZ 4.08Å; F535-L552 HydrophobicContact CD1-CB 4.19Å; F535-I553 CarbonylContact C-O 3.56Å; F535-I553 WeakPolarHBondContact CA-O 3.15Å; F535-V554 HydrophobicContact CD1-CG2 4.01Å; F535-V554 HydrophobicContact CE1-CG2 3.67Å; F535-V554 HydrophobicContact CZ-CG2 4.34Å; F535-A772 PolarHBondContact O-N 2.93Å; F535-A773 HydrophobicContact CB-CB 4.05Å; F535-A773 PolarHBondContact N-O 3.46Å; F535-A773 PolarHBondContact O-N 3.36Å; F535-A773 VanDerWaalsContact O-N 3.12Å; F535-L775 HydrophobicContact CE2-CB 4.14Å
536	A	85.2	Confident	76.5	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.008	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	164.1	165.9	0	0	0	0	0	111.1	L552 I553 T555 F769 N770	A536-L552 CarbonylContact O-C 3.47Å; A536-L552 WeakPolarHBondContact O-CA 3.34Å; A536-I553 HydrophobicContact CB-CG1 4.5Å; A536-I553 PolarHBondContact N-O 3.39Å; A536-I553 WeakPolarHBondContact O-CG1 3.47Å; A536-I553 PolarHBondContact O-N 2.74Å; A536-T555 HydrophobicContact CB-CG2 3.54Å; A536-F769 HydrophobicContact CB-CB 3.89Å; A536-N770 WeakPolarHBondContact CB-O 3.43Å
537	N	83.1	Confident	75	Confident	24 Å²	24	40 Å²	40	13%	0.128	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	131.7	173.2	179	18.9	0	0	0	109.8	L419 H539 S551 L552 F769	L419-N537 HydrophobicContact CD2-CB 4.4Å; N537-H539 VanDerWaalsContact C-N 3.31Å; N537-H539 PolarHBondContact ND2-O 3.4Å; N537-H539 PolarHBondContact OD1-N 3.16Å; N537-H539 VanDerWaalsContact OD1-N 3.1Å; N537-S551 PolarHBondContact OD1-O 2.98Å; N537-L552 HydrophobicContact CB-CD2 4.5Å; N537-F769 WeakPolarHBondContact O-CD1 3.31Å
538	I	72.7	Confident	73.9	Confident	7 Å²	7	43 Å²	43	4%	0.036	24%	0.238	C	C	.	.	S	Bend	trans	-65.2	-36.5	175	-62	164.1	0	0	0	111.3	F482 I494 S540 S551 I553	F482-I538 HydrophobicContact CB-CD1 4.43Å; F482-I538 HydrophobicContact CB-CG2 4.3Å; F482-I538 HydrophobicContact CD1-CG2 4.03Å; F482-I538 HydrophobicContact CD2-CG2 3.41Å; F482-I538 VanDerWaalsContact CD2-CG2 3.41Å; F482-I538 HydrophobicContact CE1-CG2 4.15Å; F482-I538 HydrophobicContact CE2-CG2 3.54Å; F482-I538 HydrophobicContact CG-CG2 3.65Å; F482-I538 HydrophobicContact CZ-CG2 3.91Å; I494-I538 HydrophobicContact CD1-CG2 4.23Å; I538-S540 PolarHBondContact O-N 2.99Å; I538-S551 PolarHBondContact N-O 3.34Å; I538-I553 HydrophobicContact CD1-CG2 3.36Å; I538-I553 HydrophobicContact CG1-CB 4.34Å; I538-I553 HydrophobicContact CG1-CD1 3.99Å; I538-I553 HydrophobicContact CG1-CG1 3.98Å; I538-I553 HydrophobicContact CG1-CG2 3.47Å; I538-I553 VanDerWaalsContact CG1-CG2 3.47Å
539	H	65	Low	72.7	Confident	59 Å²	59	46.6 Å²	46.6	27%	0.273	26%	0.257	S	S	.	.			trans	-93.6	105.2	-167.8	-59.6	-58.7	0	0	0	112	F482 N537 L541 D549 S551	F482-H539 AromaticContact CD2-CE1 3.34Å; F482-H539 WeakPolarHBondContact CD2-CE1 3.47Å; F482-H539 AromaticContact CE2-CE1 3.94Å; N537-H539 VanDerWaalsContact C-N 3.31Å; N537-H539 PolarHBondContact ND2-O 3.4Å; N537-H539 PolarHBondContact OD1-N 3.16Å; N537-H539 VanDerWaalsContact OD1-N 3.1Å; H539-L541 PolarHBondContact O-N 3.05Å; H539-D549 PolarHBondContact CD2-O 3.14Å; H539-S551 PolarHBondContact CD2-OG 3.42Å; H539-S551 WeakPolarHBondContact NE2-CB 3.31Å; H539-S551 PolarHBondContact NE2-OG 2.82Å
540	S	52.6	Low	71.9	Confident	119 Å²	119	46.7 Å²	46.7	83%	0.832	26%	0.257	S	S	*	.			trans	-86	30.9	167.9	70.5	0	0	0	0	112.6	I538	I538-S540 PolarHBondContact O-N 2.99Å
541	L	44.3	Very low	71.4	Confident	113 Å²	113	47.3 Å²	47.3	59%	0.592	26%	0.262	S	S	*	.			trans	-81.8	136	-176.8	-71	170.7	0	0	0	110.5	H539 I543	H539-L541 PolarHBondContact O-N 3.05Å; L541-I543 PolarHBondContact O-N 3.03Å; L541-I543 VanDerWaalsContact O-N 3.12Å
542	P	48.7	Very low	71	Confident	108 Å²	108	47.6 Å²	47.6	70%	0.701	26%	0.263	S	S	*	.	S	Bend	trans	-83.8	19.7	-169.8	36.7	-39.4	0	0	0	114.3
543	I	50.6	Low	70.8	Confident	118 Å²	118	48 Å²	48	61%	0.605	27%	0.265	S	S	*	.			trans	-149	110.4	174.8	-53.9	179.2	0	0	0	106.6	L541	L541-I543 PolarHBondContact O-N 3.03Å; L541-I543 VanDerWaalsContact O-N 3.12Å
544	V	58.6	Low	70.7	Confident	13 Å²	13	48.2 Å²	48.2	8%	0.079	27%	0.266	C	S	.	.			trans	-118.6	118.9	171.1	-172.7	0	0	0	0	107.3	F420 I423 D549 I550	F420-V544 HydrophobicContact CD2-CB 4.49Å; F420-V544 HydrophobicContact CD2-CG1 3.82Å; F420-V544 HydrophobicContact CE2-CB 4.42Å; F420-V544 HydrophobicContact CE2-CG1 3.97Å; F420-V544 WeakPolarHBondContact CE2-O 3.17Å; I423-V544 HydrophobicContact CG2-CG2 4.41Å; V544-D549 HydrophobicContact CG1-CB 3.98Å; V544-I550 HydrophobicContact CG1-CD1 4.46Å; V544-I550 HydrophobicContact CG1-CG1 3.99Å
545	N	59.1	Low	70.5	Confident	125 Å²	125	48.8 Å²	48.8	67%	0.668	27%	0.27	S	S	*	.			trans	-97	-30.1	-170.3	-71.3	-47.5	0	0	0	112.7	F420 D549	F420-N545 WeakPolarHBondContact CZ-O 3.34Å; N545-D549 PolarHBondContact N-OD2 3.03Å; N545-D549 VanDerWaalsContact N-OD2 3.14Å
546	Q	63.6	Low	70.4	Confident	117 Å²	117	48.7 Å²	48.7	55%	0.547	27%	0.27	S	S	.	.	S	Bend	trans	-137.1	153	178.9	-62.3	-167.3	13.3	0	0	111.7	F420 E548 D549	F420-Q546 VanDerWaalsContact CE2-C 3.47Å; Q546-E548 PolarHBondContact O-N 3.39Å; Q546-E548 VanDerWaalsContact O-N 3.12Å; Q546-D549 PolarHBondContact N-OD2 3.14Å; Q546-D549 WeakPolarHBondContact O-CB 3.15Å; Q546-D549 PolarHBondContact O-N 3.37Å
547	P	59.1	Low	70.7	Confident	27 Å²	27	48.7 Å²	48.7	18%	0.175	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.2	178.5	27.6	-36.1	0	0	0	113.8	F420	F420-P547 HydrophobicContact CB-CB 3.83Å; F420-P547 HydrophobicContact CD1-CB 4.16Å; F420-P547 HydrophobicContact CD1-CG 4.48Å; F420-P547 HydrophobicContact CD2-CB 4.41Å; F420-P547 HydrophobicContact CG-CB 3.88Å
548	E	68.4	Low	71.1	Confident	65 Å²	65	47.8 Å²	47.8	30%	0.304	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-31.4	177.9	-55.6	-159	174.2	0	0	112.4	Q395 K416 Q546 I550	Q395-E548 PolarHBondContact NE2-OE1 3.14Å; K416-E548 PolarHBondContact NZ-O 3.35Å; Q546-E548 PolarHBondContact O-N 3.39Å; Q546-E548 VanDerWaalsContact O-N 3.12Å; E548-I550 PolarHBondContact O-N 3.25Å; E548-I550 VanDerWaalsContact O-N 3.11Å
549	D	68.3	Low	72	Confident	78 Å²	78	47.5 Å²	47.5	42%	0.417	26%	0.263	S	S	.	.	S	Bend	trans	-56.8	-25.2	176.6	-54.8	-23.2	0	0	0	112.6	H539 V544 N545 Q546 S551	H539-D549 PolarHBondContact CD2-O 3.14Å; V544-D549 HydrophobicContact CG1-CB 3.98Å; N545-D549 PolarHBondContact N-OD2 3.03Å; N545-D549 VanDerWaalsContact N-OD2 3.14Å; Q546-D549 PolarHBondContact N-OD2 3.14Å; Q546-D549 WeakPolarHBondContact O-CB 3.15Å; Q546-D549 PolarHBondContact O-N 3.37Å; D549-S551 PolarHBondContact O-N 3.49Å
550	I	77.7	Confident	73.1	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	26%	0.257	C	S	.	.			trans	-72.7	119.3	-176.4	-66.7	168	0	0	0	110.2	K416 L419 F420 V544 E548 L552	K416-I550 WeakPolarHBondContact CD-O 3.46Å; K416-I550 WeakPolarHBondContact CE-O 3.47Å; K416-I550 HydrophobicContact CG-CB 4.41Å; K416-I550 HydrophobicContact CG-CG2 4.21Å; K416-I550 PolarHBondContact NZ-O 3.09Å; K416-I550 WeakPolarHBondContact O-CD1 3.14Å; L419-I550 HydrophobicContact CD2-CD1 3.89Å; L419-I550 HydrophobicContact CD2-CG1 4.4Å; L419-I550 HydrophobicContact CD2-CG2 3.9Å; F420-I550 VanDerWaalsContact CA-CD1 3.42Å; F420-I550 HydrophobicContact CB-CD1 3.46Å; F420-I550 VanDerWaalsContact CB-CD1 3.46Å; F420-I550 HydrophobicContact CD2-CD1 4.13Å; F420-I550 HydrophobicContact CG-CD1 4.29Å; V544-I550 HydrophobicContact CG1-CD1 4.46Å; V544-I550 HydrophobicContact CG1-CG1 3.99Å; E548-I550 PolarHBondContact O-N 3.25Å; E548-I550 VanDerWaalsContact O-N 3.11Å; I550-L552 HydrophobicContact CG2-CD2 3.8Å; I550-L552 HydrophobicContact CG2-CG 3.99Å
551	S	83.2	Confident	74.9	Confident	15 Å²	15	42 Å²	42	11%	0.105	22%	0.224	C	C	.	.			trans	-104.9	94.9	178.4	-61.2	0	0	0	0	109.1	N537 I538 H539 D549	N537-S551 PolarHBondContact OD1-O 2.98Å; I538-S551 PolarHBondContact N-O 3.34Å; H539-S551 PolarHBondContact CD2-OG 3.42Å; H539-S551 WeakPolarHBondContact NE2-CB 3.31Å; H539-S551 PolarHBondContact NE2-OG 2.82Å; D549-S551 PolarHBondContact O-N 3.49Å
552	L	86.7	Confident	77	Confident	5 Å²	5	37.1 Å²	37.1	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	131.9	176.1	-63.4	-179	0	0	0	110.6	L412 L415 K416 L419 F535 A536 N537 I550	L412-L552 HydrophobicContact CD1-CB 4.42Å; L412-L552 HydrophobicContact CD1-CD1 4.06Å; L415-L552 HydrophobicContact CB-CD1 3.97Å; K416-L552 HydrophobicContact CG-CD1 3.88Å; K416-L552 HydrophobicContact CG-CG 4.12Å; L419-L552 HydrophobicContact CD1-CD2 4.04Å; F535-L552 HydrophobicContact CD1-CB 4.19Å; A536-L552 CarbonylContact O-C 3.47Å; A536-L552 WeakPolarHBondContact O-CA 3.34Å; N537-L552 HydrophobicContact CB-CD2 4.5Å; I550-L552 HydrophobicContact CG2-CD2 3.8Å; I550-L552 HydrophobicContact CG2-CG 3.99Å
553	I	88.9	Confident	78.9	Confident	8 Å²	8	33 Å²	33	4%	0.041	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	142.6	171.8	51.4	167.9	0	0	0	110.4	S475 I479 F535 A536 I538 T555	S475-I553 WeakPolarHBondContact OG-CA 3.37Å; I479-I553 HydrophobicContact CD1-CB 4.37Å; I479-I553 HydrophobicContact CD1-CG2 3.84Å; I479-I553 HydrophobicContact CG1-CB 4.47Å; I479-I553 HydrophobicContact CG1-CG2 3.47Å; I479-I553 VanDerWaalsContact CG1-CG2 3.47Å; F535-I553 CarbonylContact C-O 3.56Å; F535-I553 WeakPolarHBondContact CA-O 3.15Å; A536-I553 HydrophobicContact CB-CG1 4.5Å; A536-I553 PolarHBondContact N-O 3.39Å; A536-I553 WeakPolarHBondContact O-CG1 3.47Å; A536-I553 PolarHBondContact O-N 2.74Å; I538-I553 HydrophobicContact CD1-CG2 3.36Å; I538-I553 HydrophobicContact CG1-CB 4.34Å; I538-I553 HydrophobicContact CG1-CD1 3.99Å; I538-I553 HydrophobicContact CG1-CG1 3.98Å; I538-I553 HydrophobicContact CG1-CG2 3.47Å; I538-I553 VanDerWaalsContact CG1-CG2 3.47Å; I553-T555 HydrophobicContact CG1-CG2 4.47Å; I553-T555 PolarHBondContact O-N 3.15Å
554	V	89.7	Confident	80.7	Confident	5 Å²	5	28.6 Å²	28.6	3%	0.03	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	124.9	168.8	170.8	0	0	0	0	108.4	S475 I498 L533 E534 F535	S475-V554 PolarHBondContact OG-N 3.37Å; I498-V554 HydrophobicContact CB-CG1 4.16Å; I498-V554 HydrophobicContact CD1-CG1 3.59Å; I498-V554 HydrophobicContact CG2-CG1 4.44Å; L533-V554 HydrophobicContact CD1-CG1 3.59Å; L533-V554 HydrophobicContact CD1-CG2 4.08Å; L533-V554 HydrophobicContact CD2-CG2 4.07Å; L533-V554 HydrophobicContact CG-CG1 4.38Å; L533-V554 HydrophobicContact CG-CG2 4.19Å; E534-V554 WeakPolarHBondContact O-CA 3.32Å; F535-V554 HydrophobicContact CD1-CG2 4.01Å; F535-V554 HydrophobicContact CE1-CG2 3.67Å; F535-V554 HydrophobicContact CZ-CG2 4.34Å
555	T	85.3	Confident	82.1	Confident	15 Å²	15	28.2 Å²	28.2	9%	0.092	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-38.5	176.5	51.8	0	0	0	0	112.5	E534 A536 I553 T760	E534-T555 PolarHBondContact O-N 2.9Å; E534-T555 PolarHBondContact O-OG1 2.81Å; A536-T555 HydrophobicContact CB-CG2 3.54Å; I553-T555 HydrophobicContact CG1-CG2 4.47Å; I553-T555 PolarHBondContact O-N 3.15Å; T555-T760 WeakPolarHBondContact O-CG2 3.39Å
556	G	87.6	Confident	83.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	152.5	-173.7	0	0	0	0	0	112.6	E534	E534-G556 PolarHBondContact N-O 2.87Å; E534-G556 PolarHBondContact O-N 3.46Å
557	L	91.7	Very high	84.1	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	102	169.6	176.3	53.7	0	0	0	108.7	F468 I498 L503 L506 F531 S532 L533 L758	F468-L557 HydrophobicContact CZ-CD1 4.29Å; I498-L557 HydrophobicContact CD1-CB 3.86Å; L503-L557 HydrophobicContact CD1-CD2 3.86Å; L506-L557 HydrophobicContact CD2-CD2 3.62Å; L506-L557 HydrophobicContact CD2-CG 4.35Å; F531-L557 HydrophobicContact CB-CD1 4.3Å; F531-L557 HydrophobicContact CD1-CD1 4.41Å; S532-L557 WeakPolarHBondContact O-CA 3.48Å; L533-L557 HydrophobicContact CB-CD1 4.37Å; L533-L557 HydrophobicContact CD1-CB 4.19Å; L533-L557 HydrophobicContact CD1-CD1 4.14Å; L557-L758 HydrophobicContact CB-CB 4.35Å; L557-L758 HydrophobicContact CD2-CD1 4.44Å; L557-L758 PolarHBondContact N-O 3.41Å; L557-L758 WeakPolarHBondContact O-CB 3.35Å
558	T	90.5	Very high	85.4	Confident	5 Å²	5	19.3 Å²	19.3	3%	0.031	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.1	176.9	36.7	0	0	0	0	110.3	F531 S532 E534 S759	F531-T558 CarbonylContact C-O 3.6Å; F531-T558 WeakPolarHBondContact CA-O 3.44Å; S532-T558 WeakPolarHBondContact CB-OG1 3.35Å; S532-T558 PolarHBondContact N-O 3.29Å; S532-T558 PolarHBondContact O-N 3.24Å; S532-T558 PolarHBondContact O-OG1 3.47Å; S532-T558 PolarHBondContact OG-OG1 2.95Å; S532-T558 VanDerWaalsContact OG-OG1 3.12Å; E534-T558 WeakPolarHBondContact OE1-CG2 3.29Å; E534-T558 PolarHBondContact OE1-OG1 3.43Å; T558-S759 VanDerWaalsContact CG2-OG 3.26Å; T558-S759 WeakPolarHBondContact CG2-OG 3.47Å
559	T	91.5	Very high	86.5	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	144.3	-179.1	-60.3	0	0	0	0	110.3	L510 F531 I751 N755	L510-T559 HydrophobicContact CD1-CG2 4.04Å; L510-T559 HydrophobicContact CD2-CG2 4.25Å; F531-T559 HydrophobicContact CD1-CG2 3.97Å; F531-T559 WeakPolarHBondContact CD1-OG1 3.5Å; F531-T559 HydrophobicContact CE1-CG2 3.71Å; T559-I751 VanDerWaalsContact O-CG2 3.25Å; T559-I751 WeakPolarHBondContact O-CG2 3Å; T559-N755 WeakPolarHBondContact CB-OD1 3.44Å; T559-N755 PolarHBondContact N-OD1 2.9Å; T559-N755 PolarHBondContact O-ND2 3.13Å; T559-N755 PolarHBondContact O-OD1 3.15Å
560	R	88.9	Confident	87.4	Confident	38 Å²	38	12.9 Å²	12.9	14%	0.143	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	144.3	174.3	-156.9	161.4	-171.1	83.7	-8	111.6	L530 D1010 L1012	L530-R560 PolarHBondContact N-O 3.19Å; L530-R560 PolarHBondContact O-N 3.42Å; R560-D1010 IonicContact CZ-OD2 3.17Å; R560-D1010 IonicContact NH1-OD2 2.79Å; R560-D1010 PolarHBondContact NH1-OD2 3.31Å; R560-L1012 HydrophobicContact CB-CD1 3.81Å
561	L	90.7	Very high	87.6	Confident	24 Å²	24	15.4 Å²	15.4	13%	0.126	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	144.1	176	-60.6	-175	0	0	0	111	T514 A527 L528 R529 V747 I751	T514-L561 HydrophobicContact CG2-CD1 3.53Å; A527-L561 HydrophobicContact CB-CB 4.22Å; A527-L561 HydrophobicContact CB-CD1 4.09Å; A527-L561 HydrophobicContact CB-CD2 4.02Å; A527-L561 HydrophobicContact CB-CG 4.35Å; L528-L561 WeakPolarHBondContact O-CA 3.41Å; R529-L561 HydrophobicContact CB-CD2 4.26Å; R529-L561 HydrophobicContact CG-CD2 3.73Å; L561-V747 HydrophobicContact CD1-CG1 3.61Å; L561-I751 HydrophobicContact CB-CD1 3.98Å; L561-I751 HydrophobicContact CD1-CD1 3.73Å; L561-I751 HydrophobicContact CD1-CG1 4.45Å; L561-I751 HydrophobicContact CG-CD1 3.6Å; L561-I751 HydrophobicContact CG-CG1 4.38Å
562	L	88.9	Confident	87.3	Confident	11 Å²	11	18.7 Å²	18.7	6%	0.058	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	153.7	173.5	-57.1	174.4	0	0	0	109.5	L528 F564 L1016 I1032 L1036	L528-L562 HydrophobicContact CB-CB 4.18Å; L528-L562 WeakPolarHBondContact CB-O 3.3Å; L528-L562 HydrophobicContact CD1-CB 4.3Å; L528-L562 HydrophobicContact CD1-CD1 4.46Å; L528-L562 HydrophobicContact CD2-CB 4.31Å; L528-L562 HydrophobicContact CD2-CD1 4.14Å; L528-L562 HydrophobicContact CG-CB 4.49Å; L528-L562 PolarHBondContact N-O 3.28Å; L528-L562 PolarHBondContact O-N 3.37Å; L562-F564 VanDerWaalsContact C-N 3.32Å; L562-F564 PolarHBondContact O-N 3.2Å; L562-L1016 HydrophobicContact CD2-CD2 3.58Å; L562-L1016 HydrophobicContact CD2-CG 4.26Å; L562-I1032 HydrophobicContact CB-CG2 4.49Å; L562-I1032 HydrophobicContact CD1-CG2 4.18Å; L562-I1032 HydrophobicContact CD2-CG2 4.17Å; L562-L1036 HydrophobicContact CD1-CD1 4.49Å; L562-L1036 HydrophobicContact CD1-CD2 3.84Å
563	L	87.3	Confident	86.8	Confident	22 Å²	22	20.2 Å²	20.2	12%	0.115	10%	0.1	C	C	.	.	S	Bend	trans	54.5	39.2	173	-51.3	179.6	0	0	0	114.6	L528 I823 F824 A827 V1029 M1033	L528-L563 HydrophobicContact CD1-CD1 4.36Å; L563-I823 HydrophobicContact CB-CG2 4.1Å; L563-I823 HydrophobicContact CD1-CG2 3.86Å; L563-I823 HydrophobicContact CD2-CG2 4.15Å; L563-I823 HydrophobicContact CG-CG2 4.26Å; L563-F824 HydrophobicContact CB-CE1 4.17Å; L563-F824 WeakPolarHBondContact O-CE1 3.28Å; L563-F824 VanDerWaalsContact O-CZ 3.27Å; L563-F824 WeakPolarHBondContact O-CZ 3.42Å; L563-A827 HydrophobicContact CD1-CB 3.75Å; L563-V1029 HydrophobicContact CD2-CB 4.28Å; L563-V1029 HydrophobicContact CD2-CG1 3.9Å; L563-V1029 HydrophobicContact CD2-CG2 3.97Å; L563-M1033 HydrophobicContact CD1-CG 4.3Å; L563-M1033 HydrophobicContact CD1-SD 3.79Å
564	F	89.2	Confident	85.8	Confident	26 Å²	26	26 Å²	26	11%	0.114	13%	0.126	C	C	.	.			trans	-67.2	133.5	-176.1	179	-141.3	0	0	0	113.4	T514 A527 L562 R566 F579 Y743 V747	T514-F564 HydrophobicContact CG2-CE2 4.25Å; A527-F564 HydrophobicContact CB-CB 4.26Å; A527-F564 HydrophobicContact CB-CD2 3.98Å; L562-F564 VanDerWaalsContact C-N 3.32Å; L562-F564 PolarHBondContact O-N 3.2Å; F564-R566 HydrophobicContact CD1-CB 4.16Å; F564-R566 HydrophobicContact CE1-CB 4.38Å; F564-R566 PolarHBondContact O-N 3.27Å; F564-F579 AromaticContact CE2-CE1 3.79Å; F564-F579 HydrophobicContact CE2-CE1 3.79Å; F564-F579 HydrophobicContact CE2-CE2 4.5Å; F564-F579 AromaticContact CE2-CZ 3.67Å; F564-F579 HydrophobicContact CE2-CZ 3.67Å; F564-F579 HydrophobicContact CZ-CE1 4.3Å; F564-F579 HydrophobicContact CZ-CE2 4.41Å; F564-F579 HydrophobicContact CZ-CZ 4.01Å; F564-Y743 HydrophobicContact CE1-CD1 4.02Å; F564-Y743 HydrophobicContact CE1-CE1 4.11Å; F564-Y743 AromaticContact CZ-CD1 3.98Å; F564-Y743 HydrophobicContact CZ-CD1 3.98Å; F564-Y743 AromaticContact CZ-CE1 3.61Å; F564-Y743 HydrophobicContact CZ-CE1 3.61Å; F564-V747 HydrophobicContact CE1-CB 4.04Å; F564-V747 HydrophobicContact CE1-CG1 4.2Å; F564-V747 HydrophobicContact CE1-CG2 3.7Å; F564-V747 HydrophobicContact CZ-CG2 3.84Å
565	E	86.7	Confident	84.9	Confident	5 Å²	5	27.1 Å²	27.1	2%	0.023	14%	0.139	C	C	.	.			trans	-73.5	59.2	173.7	-165.4	172.8	-115.4	0	0	112.9	R526 S567 R568 F579 T820 F824	R526-E565 HydrophobicContact CB-CB 3.77Å; R526-E565 IonicContact CZ-OE1 2.83Å; R526-E565 IonicContact CZ-OE2 2.89Å; R526-E565 IonicContact NE-OE1 2.59Å; R526-E565 IonicContact NE-OE2 3.95Å; R526-E565 PolarHBondContact NE-OE2 3.32Å; R526-E565 VanDerWaalsContact NH2-CD 3.27Å; R526-E565 IonicContact NH2-OE1 3.27Å; R526-E565 PolarHBondContact NH2-OE1 2.85Å; R526-E565 IonicContact NH2-OE2 3.46Å; R526-E565 PolarHBondContact NH2-OE2 3.16Å; R526-E565 PolarHBondContact O-N 2.86Å; E565-S567 WeakPolarHBondContact CG-OG 3.48Å; E565-S567 PolarHBondContact O-N 3.16Å; E565-S567 VanDerWaalsContact O-N 3.14Å; E565-R568 HydrophobicContact CG-CB 3.91Å; E565-R568 PolarHBondContact O-N 3.49Å; E565-R568 IonicContact OE2-CZ 3.56Å; E565-R568 IonicContact OE2-NE 3.84Å; E565-R568 PolarHBondContact OE2-NE 3.3Å; E565-R568 IonicContact OE2-NH2 3.32Å; E565-R568 PolarHBondContact OE2-NH2 3.29Å; E565-F579 WeakPolarHBondContact O-CZ 3.5Å; E565-T820 HydrophobicContact CB-CG2 3.86Å; E565-T820 HydrophobicContact CG-CG2 3.67Å; E565-T820 WeakPolarHBondContact OE1-CB 3.24Å; E565-T820 PolarHBondContact OE1-OG1 3.19Å; E565-F824 HydrophobicContact CB-CE2 4.43Å; E565-F824 HydrophobicContact CB-CZ 4.4Å
566	R	82.9	Confident	84.6	Confident	44 Å²	44	26.9 Å²	26.9	17%	0.166	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-56.5	-27.9	173.6	58.7	-174	178.8	144.1	1.4	113	F564 R568 V569 Q740 D741 S979	F564-R566 HydrophobicContact CD1-CB 4.16Å; F564-R566 HydrophobicContact CE1-CB 4.38Å; F564-R566 PolarHBondContact O-N 3.27Å; R566-R568 VanDerWaalsContact C-N 3.29Å; R566-R568 PolarHBondContact O-N 3.5Å; R566-V569 WeakPolarHBondContact O-CB 3.32Å; R566-V569 WeakPolarHBondContact O-CG1 3.08Å; R566-V569 PolarHBondContact O-N 3.2Å; R566-Q740 HydrophobicContact CB-CB 4.45Å; R566-Q740 HydrophobicContact CG-CB 4.35Å; R566-D741 IonicContact CZ-OD1 2.66Å; R566-D741 IonicContact NH1-OD1 2.85Å; R566-D741 PolarHBondContact NH1-OD1 3.4Å; R566-S979 PolarHBondContact NH2-OG 2.66Å
567	S	82.1	Confident	84.6	Confident	33 Å²	33	28.4 Å²	28.4	23%	0.231	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-57.4	-33	176.8	48.1	0	0	0	0	114.6	E565 V569 T570 D571	E565-S567 WeakPolarHBondContact CG-OG 3.48Å; E565-S567 PolarHBondContact O-N 3.16Å; E565-S567 VanDerWaalsContact O-N 3.14Å; S567-V569 PolarHBondContact O-N 3.17Å; S567-V569 VanDerWaalsContact O-N 3.13Å; S567-T570 PolarHBondContact O-N 3.42Å; S567-T570 VanDerWaalsContact O-N 3.09Å; S567-T570 PolarHBondContact O-OG1 2.98Å; S567-D571 PolarHBondContact O-N 2.75Å
568	R	87.6	Confident	84.6	Confident	4 Å²	4	28.4 Å²	28.4	2%	0.015	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-60.4	-23.8	178.8	173.1	173.8	-64	-102.8	0.3	112.9	S516 E565 R566 T570 E576 P577 F579	S516-R568 WeakPolarHBondContact OG-CD 3.42Å; S516-R568 PolarHBondContact OG-NE 2.83Å; S516-R568 PolarHBondContact OG-NH1 2.89Å; E565-R568 HydrophobicContact CG-CB 3.91Å; E565-R568 PolarHBondContact O-N 3.49Å; E565-R568 IonicContact OE2-CZ 3.56Å; E565-R568 IonicContact OE2-NE 3.84Å; E565-R568 PolarHBondContact OE2-NE 3.3Å; E565-R568 IonicContact OE2-NH2 3.32Å; E565-R568 PolarHBondContact OE2-NH2 3.29Å; R566-R568 VanDerWaalsContact C-N 3.29Å; R566-R568 PolarHBondContact O-N 3.5Å; R568-T570 PolarHBondContact O-N 3.03Å; R568-E576 IonicContact CZ-OE2 3.18Å; R568-E576 VanDerWaalsContact CZ-OE2 3.28Å; R568-E576 IonicContact NH1-OE2 2.6Å; R568-E576 PolarHBondContact NH1-OE2 2.77Å; R568-E576 IonicContact NH2-OE2 3.39Å; R568-E576 PolarHBondContact NH2-OE2 3.31Å; R568-P577 PolarHBondContact NH1-O 3.03Å; R568-F579 HydrophobicContact CB-CE2 3.75Å; R568-F579 HydrophobicContact CB-CZ 4.01Å; R568-F579 HydrophobicContact CG-CD2 4.37Å; R568-F579 HydrophobicContact CG-CE2 3.95Å; R568-F579 HydrophobicContact CG-CZ 4.3Å
569	V	90.8	Very high	84.8	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-64.1	-23.1	178.3	86.2	0	0	0	0	112.5	R566 S567 N578 F582 F608 I655 V739 Q740 Y743	R566-V569 WeakPolarHBondContact O-CB 3.32Å; R566-V569 WeakPolarHBondContact O-CG1 3.08Å; R566-V569 PolarHBondContact O-N 3.2Å; S567-V569 PolarHBondContact O-N 3.17Å; S567-V569 VanDerWaalsContact O-N 3.13Å; V569-N578 WeakPolarHBondContact CA-OD1 3.43Å; V569-N578 PolarHBondContact O-ND2 3.46Å; V569-F582 HydrophobicContact CG2-CE2 3.72Å; V569-F582 HydrophobicContact CG2-CZ 3.55Å; V569-F608 WeakPolarHBondContact O-CB 3.39Å; V569-I655 HydrophobicContact CG2-CG2 4.35Å; V569-V739 HydrophobicContact CG1-CG1 4.04Å; V569-Q740 HydrophobicContact CG1-CG 4.11Å; V569-Y743 HydrophobicContact CB-CD1 3.91Å; V569-Y743 HydrophobicContact CB-CG 4.16Å; V569-Y743 HydrophobicContact CG1-CD1 4.46Å; V569-Y743 HydrophobicContact CG1-CG 4.46Å; V569-Y743 HydrophobicContact CG2-CD1 3.88Å; V569-Y743 HydrophobicContact CG2-CD2 4.1Å; V569-Y743 HydrophobicContact CG2-CE1 4.35Å; V569-Y743 HydrophobicContact CG2-CG 3.75Å
570	T	87.4	Confident	84.9	Confident	9 Å²	9	29.4 Å²	29.4	6%	0.055	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-34.2	-179.5	64.6	0	0	0	0	114.8	S567 R568 F608 H736 V739 Q740	S567-T570 PolarHBondContact O-N 3.42Å; S567-T570 VanDerWaalsContact O-N 3.09Å; S567-T570 PolarHBondContact O-OG1 2.98Å; R568-T570 PolarHBondContact O-N 3.03Å; T570-F608 HydrophobicContact CG2-CD1 4.07Å; T570-F608 HydrophobicContact CG2-CE1 3.8Å; T570-F608 HydrophobicContact CG2-CZ 4.16Å; T570-H736 WeakPolarHBondContact CB-ND1 3.07Å; T570-H736 HydrophobicContact CG2-CB 4.39Å; T570-H736 PolarHBondContact O-CE1 3.41Å; T570-H736 PolarHBondContact OG1-ND1 3.12Å; T570-V739 HydrophobicContact CG2-CB 3.81Å; T570-V739 HydrophobicContact CG2-CG1 3.78Å; T570-Q740 HydrophobicContact CG2-CG 4.16Å; T570-Q740 PolarHBondContact OG1-NE2 3.26Å
571	D	81	Confident	85.2	Confident	53 Å²	53	27.6 Å²	27.6	28%	0.283	14%	0.144	S	C	.	.	S	Bend	trans	-122.2	74.1	-179.9	-61	-86.4	0	0	0	109.5	S567 K732 H736	S567-D571 PolarHBondContact O-N 2.75Å; D571-K732 IonicContact OD1-NZ 2.68Å; D571-K732 PolarHBondContact OD1-NZ 3.44Å; D571-H736 VanDerWaalsContact CG-ND1 3.35Å; D571-H736 IonicContact OD1-CE1 2.69Å; D571-H736 PolarHBondContact OD1-CE1 3.21Å; D571-H736 IonicContact OD1-ND1 3.59Å; D571-H736 PolarHBondContact OD1-ND1 3.41Å; D571-H736 IonicContact OD2-CE1 3.33Å; D571-H736 PolarHBondContact OD2-CE1 3.46Å; D571-H736 IonicContact OD2-CG 3.69Å; D571-H736 IonicContact OD2-ND1 3.2Å; D571-H736 PolarHBondContact OD2-ND1 3.26Å
572	R	78.5	Confident	85.4	Confident	84 Å²	84	26.5 Å²	26.5	32%	0.317	14%	0.138	S	C	.	.	P	Polyproline II helix	trans	-71.4	143.7	175.9	69.2	-171.7	-179.1	88.1	0.6	111.6	E576 T610	R572-E576 WeakPolarHBondContact CD-O 3.42Å; R572-E576 PolarHBondContact NH1-O 3.18Å; R572-T610 PolarHBondContact NH2-OG1 3.18Å
573	P	75.3	Confident	85.6	Confident	38 Å²	38	26.9 Å²	26.9	25%	0.247	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-61.2	150.5	172.8	-24.1	35.3	0	0	0	113.4	G575 E576	P573-G575 PolarHBondContact O-N 2.97Å; P573-E576 HydrophobicContact CB-CB 4.23Å; P573-E576 HydrophobicContact CB-CG 4.24Å; P573-E576 PolarHBondContact O-N 3.05Å
574	E	68.6	Low	86	Confident	128 Å²	128	27.4 Å²	27.4	60%	0.598	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	128	177.1	-67.8	-174.3	159.9	0	0	112	E576 M813	E574-E576 VanDerWaalsContact C-N 3.27Å; E574-E576 PolarHBondContact O-N 3.43Å; E574-M813 HydrophobicContact CG-CE 4.28Å; E574-M813 WeakPolarHBondContact OE1-CE 3.33Å
575	G	69.9	Low	86.2	Confident	29 Å²	29	26.2 Å²	26.2	30%	0.299	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	4.3	-175.9	0	0	0	0	0	114.9	P573 N1098	P573-G575 PolarHBondContact O-N 2.97Å; G575-N1098 WeakPolarHBondContact CA-ND2 3.36Å; G575-N1098 PolarHBondContact O-ND2 3.38Å
576	E	80.3	Confident	86.5	Confident	10 Å²	10	26.9 Å²	26.9	5%	0.047	14%	0.139	C	C	.	.			trans	-111.4	141.6	172.2	-62.5	-166.6	164.7	0	0	111.9	I518 I519 R568 R572 P573 E574	I518-E576 VanDerWaalsContact CA-OE1 3.3Å; I518-E576 WeakPolarHBondContact CA-OE1 3.47Å; I518-E576 VanDerWaalsContact CG2-OE1 3.27Å; I518-E576 WeakPolarHBondContact CG2-OE1 3.38Å; I519-E576 HydrophobicContact CD1-CG 4.08Å; I519-E576 HydrophobicContact CG1-CG 3.9Å; I519-E576 PolarHBondContact N-OE1 3.28Å; R568-E576 IonicContact CZ-OE2 3.18Å; R568-E576 VanDerWaalsContact CZ-OE2 3.28Å; R568-E576 IonicContact NH1-OE2 2.6Å; R568-E576 PolarHBondContact NH1-OE2 2.77Å; R568-E576 IonicContact NH2-OE2 3.39Å; R568-E576 PolarHBondContact NH2-OE2 3.31Å; R572-E576 WeakPolarHBondContact CD-O 3.42Å; R572-E576 PolarHBondContact NH1-O 3.18Å; P573-E576 HydrophobicContact CB-CB 4.23Å; P573-E576 HydrophobicContact CB-CG 4.24Å; P573-E576 PolarHBondContact O-N 3.05Å; E574-E576 VanDerWaalsContact C-N 3.27Å; E574-E576 PolarHBondContact O-N 3.43Å
577	P	86.8	Confident	86.9	Confident	33 Å²	33	26.1 Å²	26.1	21%	0.214	14%	0.142	C	C	.	.			trans	-76.1	173.6	171.6	32.4	-35.8	0	0	0	112.8	R517 R568 Y583	R517-P577 HydrophobicContact CB-CG 3.77Å; R517-P577 WeakPolarHBondContact O-CD 2.74Å; R568-P577 PolarHBondContact NH1-O 3.03Å; P577-Y583 HydrophobicContact CB-CE2 3.85Å; P577-Y583 WeakPolarHBondContact CB-OH 3.41Å
578	N	91.6	Very high	87.3	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.137	C	C	.	.			trans	-74.9	-172.8	168.7	-151.1	-40.2	0	0	0	110.2	V569 F582 Y583 F608	V569-N578 WeakPolarHBondContact CA-OD1 3.43Å; V569-N578 PolarHBondContact O-ND2 3.46Å; N578-F582 HydrophobicContact CB-CD2 4.36Å; N578-Y583 HydrophobicContact CB-CE2 4.31Å; N578-Y583 PolarHBondContact N-OH 3.09Å; N578-Y583 VanDerWaalsContact N-OH 3.08Å; N578-F608 PolarHBondContact ND2-O 3.46Å
579	F	94.8	Very high	87.5	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.			trans	-61.4	148.6	174.8	-66.1	-81.4	0	0	0	112.4	F513 C515 R526 F564 E565 R568 I581 F582 Y583 Y743	F513-F579 WeakPolarHBondContact O-CD1 3.08Å; F513-F579 WeakPolarHBondContact O-CG 3.3Å; C515-F579 VanDerWaalsContact O-CD1 3.31Å; C515-F579 WeakPolarHBondContact O-CD1 3.14Å; R526-F579 HydrophobicContact CB-CE1 4.05Å; R526-F579 HydrophobicContact CB-CZ 4.39Å; R526-F579 HydrophobicContact CG-CE1 4.07Å; F564-F579 AromaticContact CE2-CE1 3.79Å; F564-F579 HydrophobicContact CE2-CE1 3.79Å; F564-F579 HydrophobicContact CE2-CE2 4.5Å; F564-F579 AromaticContact CE2-CZ 3.67Å; F564-F579 HydrophobicContact CE2-CZ 3.67Å; F564-F579 HydrophobicContact CZ-CE1 4.3Å; F564-F579 HydrophobicContact CZ-CE2 4.41Å; F564-F579 HydrophobicContact CZ-CZ 4.01Å; E565-F579 WeakPolarHBondContact O-CZ 3.5Å; R568-F579 HydrophobicContact CB-CE2 3.75Å; R568-F579 HydrophobicContact CB-CZ 4.01Å; R568-F579 HydrophobicContact CG-CD2 4.37Å; R568-F579 HydrophobicContact CG-CE2 3.95Å; R568-F579 HydrophobicContact CG-CZ 4.3Å; F579-I581 VanDerWaalsContact C-N 3.32Å; F579-I581 HydrophobicContact CB-CG2 4.43Å; F579-I581 PolarHBondContact O-N 2.96Å; F579-F582 HydrophobicContact CB-CD2 4.24Å; F579-F582 HydrophobicContact CB-CE2 4.21Å; F579-Y583 WeakPolarHBondContact O-CD2 3.49Å; F579-Y743 VanDerWaalsContact CB-OH 3.31Å; F579-Y743 WeakPolarHBondContact CB-OH 3.45Å; F579-Y743 HydrophobicContact CD2-CD1 4.32Å; F579-Y743 AromaticContact CD2-CE1 3.39Å; F579-Y743 HydrophobicContact CD2-CE1 3.39Å; F579-Y743 AromaticContact CD2-CZ 3.87Å; F579-Y743 HydrophobicContact CE2-CD1 4.3Å; F579-Y743 AromaticContact CE2-CE1 3.63Å; F579-Y743 HydrophobicContact CE2-CE1 3.63Å; F579-Y743 AromaticContact CG-CE1 3.95Å; F579-Y743 HydrophobicContact CG-CE1 3.95Å; F579-Y743 WeakPolarHBondContact CG-OH 3.21Å; F579-Y743 HydrophobicContact CZ-CE1 4.37Å
580	H	93.5	Very high	87.5	Confident	27 Å²	27	29.1 Å²	29.1	13%	0.125	16%	0.158	C	C	.	.	H	α-helix	trans	-61.4	-36.4	-170.2	-64.1	-79.4	0	0	0	113.8	S512 C515 S516 F582 Y583 Y584	S512-H580 PolarHBondContact O-N 3.48Å; C515-H580 VanDerWaalsContact C-CD2 3.44Å; C515-H580 PolarHBondContact O-CD2 2.87Å; S516-H580 WeakPolarHBondContact CA-NE2 3.45Å; H580-F582 VanDerWaalsContact C-N 3.26Å; H580-F582 PolarHBondContact O-N 3.12Å; H580-F582 VanDerWaalsContact O-N 3.15Å; H580-Y583 PolarHBondContact O-N 3.04Å; H580-Y584 HydrophobicContact CB-CD2 4.29Å; H580-Y584 HydrophobicContact CB-CE1 4.24Å; H580-Y584 HydrophobicContact CB-CE2 3.69Å; H580-Y584 PolarHBondContact O-N 3.45Å
581	I	95.5	Very high	87.4	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-52.9	-37.1	-175.5	-171.6	66.3	0	0	0	113.9	S512 F513 F579 Y583 Y584 M585 W625 L628 L652 Y743	S512-I581 WeakPolarHBondContact O-CB 3.4Å; S512-I581 PolarHBondContact O-N 3.03Å; F513-I581 HydrophobicContact CD1-CB 4.46Å; F513-I581 HydrophobicContact CD1-CG1 4.28Å; F513-I581 HydrophobicContact CD1-CG2 4.1Å; F513-I581 HydrophobicContact CD2-CB 4.36Å; F513-I581 HydrophobicContact CD2-CD1 4.18Å; F513-I581 HydrophobicContact CD2-CG1 4.18Å; F513-I581 HydrophobicContact CE1-CD1 4.48Å; F513-I581 HydrophobicContact CE1-CG1 3.86Å; F513-I581 HydrophobicContact CE1-CG2 4.37Å; F513-I581 HydrophobicContact CE2-CB 4.42Å; F513-I581 HydrophobicContact CE2-CD1 3.53Å; F513-I581 HydrophobicContact CE2-CG1 3.76Å; F513-I581 HydrophobicContact CG-CB 4.38Å; F513-I581 HydrophobicContact CG-CG1 4.43Å; F513-I581 HydrophobicContact CG-CG2 4.31Å; F513-I581 HydrophobicContact CZ-CB 4.5Å; F513-I581 HydrophobicContact CZ-CD1 3.7Å; F513-I581 HydrophobicContact CZ-CG1 3.57Å; F579-I581 VanDerWaalsContact C-N 3.32Å; F579-I581 HydrophobicContact CB-CG2 4.43Å; F579-I581 PolarHBondContact O-N 2.96Å; I581-Y583 VanDerWaalsContact C-N 3.33Å; I581-Y583 PolarHBondContact O-N 3.49Å; I581-Y584 PolarHBondContact O-N 3.21Å; I581-M585 VanDerWaalsContact O-CB 3.32Å; I581-M585 WeakPolarHBondContact O-CB 3.24Å; I581-M585 PolarHBondContact O-N 2.72Å; I581-W625 HydrophobicContact CD1-CE3 4.32Å; I581-W625 HydrophobicContact CD1-CZ3 3.8Å; I581-L628 HydrophobicContact CD1-CD1 3.84Å; I581-L652 HydrophobicContact CG1-CD1 3.64Å; I581-L652 HydrophobicContact CG2-CD2 4.41Å; I581-Y743 HydrophobicContact CG2-CE2 4.42Å; I581-Y743 WeakPolarHBondContact CG2-OH 3.26Å
582	F	94.8	Very high	87.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-40.3	179.9	-65.6	-70.3	0	0	0	112.2	V569 N578 F579 H580 L586 M609 L652 I655 Y743	V569-F582 HydrophobicContact CG2-CE2 3.72Å; V569-F582 HydrophobicContact CG2-CZ 3.55Å; N578-F582 HydrophobicContact CB-CD2 4.36Å; F579-F582 HydrophobicContact CB-CD2 4.24Å; F579-F582 HydrophobicContact CB-CE2 4.21Å; H580-F582 VanDerWaalsContact C-N 3.26Å; H580-F582 PolarHBondContact O-N 3.12Å; H580-F582 VanDerWaalsContact O-N 3.15Å; F582-L586 VanDerWaalsContact O-CG 3.27Å; F582-L586 WeakPolarHBondContact O-CG 3.33Å; F582-L586 PolarHBondContact O-N 2.71Å; F582-M609 HydrophobicContact CB-CE 3.68Å; F582-M609 HydrophobicContact CB-SD 4.03Å; F582-M609 HydrophobicContact CD1-CE 3.61Å; F582-M609 HydrophobicContact CD2-CE 4.46Å; F582-M609 HydrophobicContact CE1-CE 4.37Å; F582-M609 HydrophobicContact CG-CE 3.66Å; F582-L652 HydrophobicContact CD1-CD2 4.42Å; F582-L652 HydrophobicContact CE1-CD2 3.77Å; F582-L652 HydrophobicContact CZ-CD2 4.13Å; F582-I655 HydrophobicContact CE1-CB 4.29Å; F582-I655 HydrophobicContact CE1-CG2 3.76Å; F582-I655 HydrophobicContact CZ-CG2 4Å; F582-Y743 HydrophobicContact CE1-CE2 4.42Å; F582-Y743 HydrophobicContact CE2-CD2 4.38Å; F582-Y743 AromaticContact CE2-CE2 3.75Å; F582-Y743 HydrophobicContact CE2-CE2 3.75Å; F582-Y743 AromaticContact CE2-CZ 3.92Å; F582-Y743 AromaticContact CZ-CD2 3.75Å; F582-Y743 HydrophobicContact CZ-CD2 3.75Å; F582-Y743 AromaticContact CZ-CE2 3.45Å; F582-Y743 HydrophobicContact CZ-CE2 3.45Å; F582-Y743 VanDerWaalsContact CZ-CE2 3.45Å
583	Y	93.7	Very high	88.3	Confident	20 Å²	20	31 Å²	31	8%	0.078	18%	0.18	C	C	.	.	H	α-helix	trans	-72.6	-40.1	179	-55.1	-70.3	0	0	0	111.5	P577 N578 F579 H580 I581 A587 M609 T610 L612	P577-Y583 HydrophobicContact CB-CE2 3.85Å; P577-Y583 WeakPolarHBondContact CB-OH 3.41Å; N578-Y583 HydrophobicContact CB-CE2 4.31Å; N578-Y583 PolarHBondContact N-OH 3.09Å; N578-Y583 VanDerWaalsContact N-OH 3.08Å; F579-Y583 WeakPolarHBondContact O-CD2 3.49Å; H580-Y583 PolarHBondContact O-N 3.04Å; I581-Y583 VanDerWaalsContact C-N 3.33Å; I581-Y583 PolarHBondContact O-N 3.49Å; Y583-A587 WeakPolarHBondContact O-CB 3.48Å; Y583-A587 PolarHBondContact O-N 3.2Å; Y583-A587 VanDerWaalsContact O-N 3.14Å; Y583-M609 HydrophobicContact CE1-CB 4.47Å; Y583-T610 WeakPolarHBondContact CE1-O 3.41Å; Y583-L612 HydrophobicContact CD1-CD1 4.46Å; Y583-L612 HydrophobicContact CD1-CD2 4.14Å; Y583-L612 HydrophobicContact CD1-CG 3.89Å; Y583-L612 HydrophobicContact CG-CD1 4.5Å; Y583-L612 HydrophobicContact CG-CG 4.36Å
584	Y	94.6	Very high	89.2	Confident	33 Å²	33	31.6 Å²	31.6	13%	0.129	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-49.3	176.7	-59.6	-12.3	0	0	0	110.4	H580 I581 L586 A587 G588 A621 F624 W625 L628	H580-Y584 HydrophobicContact CB-CD2 4.29Å; H580-Y584 HydrophobicContact CB-CE1 4.24Å; H580-Y584 HydrophobicContact CB-CE2 3.69Å; H580-Y584 PolarHBondContact O-N 3.45Å; I581-Y584 PolarHBondContact O-N 3.21Å; Y584-L586 PolarHBondContact O-N 3.47Å; Y584-A587 PolarHBondContact O-N 2.68Å; Y584-G588 WeakPolarHBondContact O-CA 3.39Å; Y584-G588 PolarHBondContact O-N 3.14Å; Y584-A621 HydrophobicContact CD1-CB 3.8Å; Y584-A621 HydrophobicContact CE1-CB 4.39Å; Y584-F624 HydrophobicContact CD1-CB 3.84Å; Y584-F624 HydrophobicContact CD1-CD2 4.47Å; Y584-F624 HydrophobicContact CD2-CB 3.81Å; Y584-F624 HydrophobicContact CE1-CB 3.75Å; Y584-F624 AromaticContact CE1-CD2 3.66Å; Y584-F624 HydrophobicContact CE1-CD2 3.66Å; Y584-F624 AromaticContact CE1-CG 3.93Å; Y584-F624 HydrophobicContact CE1-CG 3.93Å; Y584-F624 HydrophobicContact CE2-CB 3.69Å; Y584-F624 HydrophobicContact CE2-CD1 4.49Å; Y584-F624 HydrophobicContact CE2-CD2 4.48Å; Y584-F624 HydrophobicContact CE2-CG 4.01Å; Y584-F624 HydrophobicContact CG-CB 3.87Å; Y584-F624 AromaticContact CZ-CD2 3.65Å; Y584-F624 AromaticContact CZ-CG 3.63Å; Y584-W625 WeakPolarHBondContact O-CB 3.48Å; Y584-L628 HydrophobicContact CD2-CD1 3.76Å
585	M	94.4	Very high	90.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-55.2	-54.2	176.4	-177.5	-174.7	74.1	0	0	112.2	I581 A587 G588 L589 L599 W625 T649 L652	I581-M585 VanDerWaalsContact O-CB 3.32Å; I581-M585 WeakPolarHBondContact O-CB 3.24Å; I581-M585 PolarHBondContact O-N 2.72Å; M585-A587 PolarHBondContact O-N 2.74Å; M585-G588 PolarHBondContact O-N 3.4Å; M585-L589 HydrophobicContact CG-CD1 3.54Å; M585-L589 HydrophobicContact CG-CG 4.02Å; M585-L589 VanDerWaalsContact O-CG 3.26Å; M585-L589 WeakPolarHBondContact O-CG 3.47Å; M585-L589 PolarHBondContact O-N 3.43Å; M585-L589 HydrophobicContact SD-CD1 4.43Å; M585-L599 HydrophobicContact CE-CD1 4.12Å; M585-W625 VanDerWaalsContact CA-CE3 3.45Å; M585-W625 HydrophobicContact CB-CE3 4.06Å; M585-W625 HydrophobicContact CB-CH2 4.05Å; M585-W625 HydrophobicContact CB-CZ3 3.65Å; M585-W625 HydrophobicContact CG-CH2 4.01Å; M585-W625 HydrophobicContact CG-CZ3 4.14Å; M585-T649 HydrophobicContact CG-CG2 4.02Å; M585-T649 HydrophobicContact SD-CG2 3.81Å; M585-L652 HydrophobicContact CE-CB 4.15Å; M585-L652 HydrophobicContact SD-CB 3.55Å; M585-L652 VanDerWaalsContact SD-CB 3.55Å; M585-L652 HydrophobicContact SD-CD1 4.22Å
586	L	92.8	Very high	91.3	Very high	20 Å²	20	36.2 Å²	36.2	11%	0.105	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-38.8	-174.6	-68.7	171.6	0	0	0	112.8	F582 Y584 R594 L599 L602 M609 Y656	F582-L586 VanDerWaalsContact O-CG 3.27Å; F582-L586 WeakPolarHBondContact O-CG 3.33Å; F582-L586 PolarHBondContact O-N 2.71Å; Y584-L586 PolarHBondContact O-N 3.47Å; L586-R594 PolarHBondContact O-NH2 3.3Å; L586-L599 HydrophobicContact CD2-CD1 4.33Å; L586-L599 HydrophobicContact CD2-CD2 4.34Å; L586-L602 HydrophobicContact CD2-CD2 3.88Å; L586-M609 HydrophobicContact CD1-SD 3.65Å; L586-Y656 HydrophobicContact CD1-CD2 3.91Å; L586-Y656 HydrophobicContact CD1-CE2 3.66Å; L586-Y656 HydrophobicContact CD2-CD2 4.11Å; L586-Y656 HydrophobicContact CD2-CE2 4.03Å; L586-Y656 HydrophobicContact CD2-CG 4.49Å
587	A	91.2	Very high	91.9	Very high	28 Å²	28	35.7 Å²	35.7	23%	0.231	18%	0.182	C	C	.	.	H	α-helix	trans	-78.3	-28.1	177.5	0	0	0	0	0	113.7	Y583 Y584 M585 A621 K622	Y583-A587 WeakPolarHBondContact O-CB 3.48Å; Y583-A587 PolarHBondContact O-N 3.2Å; Y583-A587 VanDerWaalsContact O-N 3.14Å; Y584-A587 PolarHBondContact O-N 2.68Å; M585-A587 PolarHBondContact O-N 2.74Å; A587-A621 HydrophobicContact CB-CB 3.72Å; A587-K622 HydrophobicContact CB-CB 4.43Å
588	G	90.6	Very high	92.1	Very high	12 Å²	12	37.1 Å²	37.1	12%	0.124	19%	0.185	C	C	.	.	H	α-helix	trans	-99.5	-24.2	-167.5	0	0	0	0	0	116.6	Y584 M585 W625	Y584-G588 WeakPolarHBondContact O-CA 3.39Å; Y584-G588 PolarHBondContact O-N 3.14Å; M585-G588 PolarHBondContact O-N 3.4Å; G588-W625 VanDerWaalsContact CA-CD1 3.48Å; G588-W625 VanDerWaalsContact O-CD1 3.29Å
589	L	92	Very high	92.1	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.037	19%	0.185	C	C	.	.			trans	-60.7	142.5	-178.4	-77.7	171.5	0	0	0	113.1	M585 R594 L597 L599 W625 L644 T649	M585-L589 HydrophobicContact CG-CD1 3.54Å; M585-L589 HydrophobicContact CG-CG 4.02Å; M585-L589 VanDerWaalsContact O-CG 3.26Å; M585-L589 WeakPolarHBondContact O-CG 3.47Å; M585-L589 PolarHBondContact O-N 3.43Å; M585-L589 HydrophobicContact SD-CD1 4.43Å; L589-R594 VanDerWaalsContact O-CZ 3.22Å; L589-R594 PolarHBondContact O-NH1 3.25Å; L589-R594 PolarHBondContact O-NH2 3.1Å; L589-L597 HydrophobicContact CD1-CD1 4.18Å; L589-L599 HydrophobicContact CD1-CD1 3.8Å; L589-W625 HydrophobicContact CD2-CZ2 3.65Å; L589-W625 HydrophobicContact CG-CZ2 4.19Å; L589-L644 HydrophobicContact CD2-CD2 4.45Å; L589-T649 HydrophobicContact CD1-CG2 4.14Å; L589-T649 HydrophobicContact CD2-CG2 3.95Å
590	D	90	Very high	91.6	Very high	80 Å²	80	41 Å²	41	43%	0.428	21%	0.208	S	C	.	.			trans	-74.3	167.2	171.3	69.4	-78.9	0	0	0	111.9	G592 S593 R594	D590-G592 VanDerWaalsContact C-N 3.33Å; D590-G592 PolarHBondContact O-N 3.14Å; D590-G592 VanDerWaalsContact OD2-CA 3.23Å; D590-G592 WeakPolarHBondContact OD2-CA 3.43Å; D590-G592 PolarHBondContact OD2-N 3.31Å; D590-S593 WeakPolarHBondContact OD1-CB 3.39Å; D590-S593 PolarHBondContact OD1-OG 3.29Å; D590-S593 PolarHBondContact OD2-N 2.97Å; D590-R594 WeakPolarHBondContact O-CB 3.45Å; D590-R594 PolarHBondContact O-N 3.16Å
591	E	86.4	Confident	90.9	Very high	138 Å²	138	43.6 Å²	43.6	65%	0.645	22%	0.223	S	C	*	.	H	α-helix	trans	-74.6	-17	-177.3	-60.9	-167.1	155.7	0	0	115	R595	E591-R595 WeakPolarHBondContact O-CG 3.49Å; E591-R595 PolarHBondContact O-N 3.44Å; E591-R595 PolarHBondContact O-NE 3.22Å; E591-R595 PolarHBondContact O-NH2 3.26Å
592	G	88.2	Confident	90.3	Very high	38 Å²	38	45.5 Å²	45.5	39%	0.392	23%	0.233	S	C	.	.	H	α-helix	trans	-71.9	-60.6	170.5	0	0	0	0	0	109.6	D590 R594 R595 E596	D590-G592 VanDerWaalsContact C-N 3.33Å; D590-G592 PolarHBondContact O-N 3.14Å; D590-G592 VanDerWaalsContact OD2-CA 3.23Å; D590-G592 WeakPolarHBondContact OD2-CA 3.43Å; D590-G592 PolarHBondContact OD2-N 3.31Å; G592-R594 VanDerWaalsContact C-N 3.29Å; G592-R594 PolarHBondContact O-N 2.92Å; G592-R595 WeakPolarHBondContact O-CB 3.45Å; G592-R595 PolarHBondContact O-N 3.34Å; G592-E596 PolarHBondContact O-N 3.46Å
593	S	90.4	Very high	89.6	Confident	11 Å²	11	50.7 Å²	50.7	8%	0.077	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-38	177.9	-53.5	0	0	0	0	112.5	D590 R595 E596 L597	D590-S593 WeakPolarHBondContact OD1-CB 3.39Å; D590-S593 PolarHBondContact OD1-OG 3.29Å; D590-S593 PolarHBondContact OD2-N 2.97Å; S593-R595 VanDerWaalsContact C-N 3.29Å; S593-R595 PolarHBondContact O-N 3.32Å; S593-E596 PolarHBondContact O-N 3.45Å; S593-L597 WeakPolarHBondContact O-CB 3.48Å; S593-L597 VanDerWaalsContact O-CG 3.3Å; S593-L597 WeakPolarHBondContact O-CG 3.43Å; S593-L597 PolarHBondContact O-N 3.09Å
594	R	92.8	Very high	89.1	Confident	49 Å²	49	51.8 Å²	51.8	19%	0.185	27%	0.27	C	S	.	.	H	α-helix	trans	-62.8	-34.2	176.3	-174.2	178.5	-76.5	101.7	7.5	112.1	L586 L589 D590 G592 F598 L599 T600	L586-R594 PolarHBondContact O-NH2 3.3Å; L589-R594 VanDerWaalsContact O-CZ 3.22Å; L589-R594 PolarHBondContact O-NH1 3.25Å; L589-R594 PolarHBondContact O-NH2 3.1Å; D590-R594 WeakPolarHBondContact O-CB 3.45Å; D590-R594 PolarHBondContact O-N 3.16Å; G592-R594 VanDerWaalsContact C-N 3.29Å; G592-R594 PolarHBondContact O-N 2.92Å; R594-F598 PolarHBondContact O-N 3.01Å; R594-L599 VanDerWaalsContact CD-O 3.3Å; R594-L599 WeakPolarHBondContact CD-O 3.43Å; R594-L599 HydrophobicContact CG-CB 3.96Å; R594-L599 WeakPolarHBondContact CG-O 3.26Å; R594-L599 PolarHBondContact O-N 2.8Å; R594-T600 HydrophobicContact CG-CG2 4.1Å
595	R	91.6	Very high	88.6	Confident	159 Å²	159	55.6 Å²	55.6	60%	0.6	30%	0.298	S	S	*	.	H	α-helix	trans	-73.3	-47.9	172.7	-83	177.8	-75.5	-166.7	-6.7	112.1	E591 G592 S593 L597 F598 T600	E591-R595 WeakPolarHBondContact O-CG 3.49Å; E591-R595 PolarHBondContact O-N 3.44Å; E591-R595 PolarHBondContact O-NE 3.22Å; E591-R595 PolarHBondContact O-NH2 3.26Å; G592-R595 WeakPolarHBondContact O-CB 3.45Å; G592-R595 PolarHBondContact O-N 3.34Å; S593-R595 VanDerWaalsContact C-N 3.29Å; S593-R595 PolarHBondContact O-N 3.32Å; R595-L597 PolarHBondContact O-N 3.11Å; R595-F598 PolarHBondContact O-N 3.4Å; R595-F598 VanDerWaalsContact O-N 3.11Å; R595-T600 HydrophobicContact CB-CG2 4.39Å; R595-T600 HydrophobicContact CG-CG2 3.57Å
596	E	90.7	Very high	88.3	Confident	95 Å²	95	56.6 Å²	56.6	44%	0.444	30%	0.303	S	S	.	.	H	α-helix	trans	-61.1	-29.4	-179.9	-161.5	-175.7	158.5	0	0	112.7	G592 S593 T645	G592-E596 PolarHBondContact O-N 3.46Å; S593-E596 PolarHBondContact O-N 3.45Å; E596-T645 HydrophobicContact CB-CG2 4.13Å; E596-T645 VanDerWaalsContact CD-OG1 3.23Å; E596-T645 HydrophobicContact CG-CG2 4.37Å; E596-T645 WeakPolarHBondContact OE1-CB 3.31Å; E596-T645 PolarHBondContact OE1-OG1 3.13Å; E596-T645 WeakPolarHBondContact OE2-CB 3.25Å; E596-T645 WeakPolarHBondContact OE2-CG2 3.26Å; E596-T645 PolarHBondContact OE2-OG1 3.46Å
597	L	93	Very high	88.1	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	5.9	179.1	-60.7	177.8	0	0	0	114.5	L589 S593 R595 L599 T645 T649 R650 A653 H657 L687	L589-L597 HydrophobicContact CD1-CD1 4.18Å; S593-L597 WeakPolarHBondContact O-CB 3.48Å; S593-L597 VanDerWaalsContact O-CG 3.3Å; S593-L597 WeakPolarHBondContact O-CG 3.43Å; S593-L597 PolarHBondContact O-N 3.09Å; R595-L597 PolarHBondContact O-N 3.11Å; L597-L599 HydrophobicContact CB-CD1 4.03Å; L597-L599 HydrophobicContact CB-CG 4.02Å; L597-L599 HydrophobicContact CD1-CD1 4.43Å; L597-L599 PolarHBondContact O-N 3.32Å; L597-T645 HydrophobicContact CD1-CG2 4.2Å; L597-T645 HydrophobicContact CD2-CG2 4.27Å; L597-T645 HydrophobicContact CG-CG2 4.03Å; L597-T649 HydrophobicContact CD1-CG2 3.6Å; L597-R650 HydrophobicContact CD2-CB 4.19Å; L597-R650 HydrophobicContact CD2-CG 4.03Å; L597-A653 HydrophobicContact CB-CB 4Å; L597-A653 HydrophobicContact CD1-CB 4.25Å; L597-A653 HydrophobicContact CD2-CB 4.21Å; L597-A653 HydrophobicContact CG-CB 4.38Å; L597-H657 PolarHBondContact O-NE2 3.2Å; L597-L687 HydrophobicContact CD2-CD2 3.94Å
598	F	92.7	Very high	88	Confident	63 Å²	63	57.9 Å²	57.9	28%	0.276	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	27.9	-176.8	-49.8	-89.2	0	0	0	114.1	R594 R595 T600 H657 Y683 Y686 L687	R594-F598 PolarHBondContact O-N 3.01Å; R595-F598 PolarHBondContact O-N 3.4Å; R595-F598 VanDerWaalsContact O-N 3.11Å; F598-T600 VanDerWaalsContact C-N 3.32Å; F598-H657 PolarHBondContact O-CE1 3.45Å; F598-H657 VanDerWaalsContact O-CE1 3.24Å; F598-Y683 HydrophobicContact CB-CD1 4Å; F598-Y683 HydrophobicContact CB-CD2 4.22Å; F598-Y683 HydrophobicContact CB-CE1 4.37Å; F598-Y683 HydrophobicContact CB-CG 3.94Å; F598-Y683 AromaticContact CD1-CD1 3.63Å; F598-Y683 HydrophobicContact CD1-CD1 3.63Å; F598-Y683 AromaticContact CD1-CE1 3.61Å; F598-Y683 HydrophobicContact CD1-CE1 3.61Å; F598-Y683 HydrophobicContact CD1-CG 4.43Å; F598-Y683 HydrophobicContact CD2-CD1 4.18Å; F598-Y683 HydrophobicContact CE1-CD1 4.15Å; F598-Y683 HydrophobicContact CE1-CE1 4.14Å; F598-Y683 AromaticContact CG-CD1 3.65Å; F598-Y683 HydrophobicContact CG-CD1 3.65Å; F598-Y683 HydrophobicContact CG-CE1 4.06Å; F598-Y683 HydrophobicContact CG-CG 4.06Å; F598-Y686 AromaticContact CE2-CD1 3.52Å; F598-Y686 HydrophobicContact CE2-CD1 3.52Å; F598-Y686 AromaticContact CE2-CE1 3.77Å; F598-Y686 HydrophobicContact CE2-CE1 3.77Å; F598-Y686 HydrophobicContact CE2-CG 4.47Å; F598-Y686 AromaticContact CZ-CD1 3.78Å; F598-Y686 HydrophobicContact CZ-CD1 3.78Å; F598-Y686 AromaticContact CZ-CE1 3.76Å; F598-Y686 HydrophobicContact CZ-CE1 3.76Å; F598-L687 HydrophobicContact CD2-CD1 4.48Å; F598-L687 HydrophobicContact CD2-CD2 4.25Å; F598-L687 HydrophobicContact CD2-CG 4.28Å; F598-L687 HydrophobicContact CE2-CD2 4.22Å; F598-L687 HydrophobicContact CE2-CG 4.44Å
599	L	90.5	Very high	87.9	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.302	C	S	.	.			trans	-94.4	19.4	-179.1	-64	176.9	0	0	0	112.5	M585 L586 L589 R594 L597 L602 A653 Y656	M585-L599 HydrophobicContact CE-CD1 4.12Å; L586-L599 HydrophobicContact CD2-CD1 4.33Å; L586-L599 HydrophobicContact CD2-CD2 4.34Å; L589-L599 HydrophobicContact CD1-CD1 3.8Å; R594-L599 VanDerWaalsContact CD-O 3.3Å; R594-L599 WeakPolarHBondContact CD-O 3.43Å; R594-L599 HydrophobicContact CG-CB 3.96Å; R594-L599 WeakPolarHBondContact CG-O 3.26Å; R594-L599 PolarHBondContact O-N 2.8Å; L597-L599 HydrophobicContact CB-CD1 4.03Å; L597-L599 HydrophobicContact CB-CG 4.02Å; L597-L599 HydrophobicContact CD1-CD1 4.43Å; L597-L599 PolarHBondContact O-N 3.32Å; L599-L602 HydrophobicContact CB-CD2 4.44Å; L599-L602 VanDerWaalsContact O-CD2 3.29Å; L599-L602 WeakPolarHBondContact O-CD2 3.34Å; L599-A653 HydrophobicContact CD1-CB 4.06Å; L599-A653 HydrophobicContact CG-CB 4.42Å; L599-Y656 HydrophobicContact CD2-CD1 3.35Å; L599-Y656 HydrophobicContact CD2-CE1 3.82Å; L599-Y656 HydrophobicContact CD2-CG 4.02Å
600	T	84.6	Confident	87.5	Confident	80 Å²	80	60.9 Å²	60.9	49%	0.491	32%	0.322	S	S	.	.	S	Bend	trans	-73.9	-52.8	-177.3	41.4	0	0	0	0	112.8	R594 R595 F598 L602	R594-T600 HydrophobicContact CG-CG2 4.1Å; R595-T600 HydrophobicContact CB-CG2 4.39Å; R595-T600 HydrophobicContact CG-CG2 3.57Å; F598-T600 VanDerWaalsContact C-N 3.32Å; T600-L602 PolarHBondContact O-N 3.21Å
601	D	79.1	Confident	87	Confident	82 Å²	82	60.1 Å²	60.1	44%	0.439	31%	0.313	S	S	.	.			trans	-87.3	103.7	169.7	-172.6	29.1	0	0	0	109.7	D603 K2335	D601-D603 PolarHBondContact OD1-N 2.83Å; D601-K2335 IonicContact OD1-NZ 2.72Å; D601-K2335 PolarHBondContact OD1-NZ 3.29Å
602	L	81.9	Confident	86.7	Confident	40 Å²	40	55.9 Å²	55.9	21%	0.209	30%	0.295	C	S	.	.			trans	-83	-22.7	178.5	-67.8	-178.4	0	0	0	112.4	L586 L599 T600 V604 R611 Y656	L586-L602 HydrophobicContact CD2-CD2 3.88Å; L599-L602 HydrophobicContact CB-CD2 4.44Å; L599-L602 VanDerWaalsContact O-CD2 3.29Å; L599-L602 WeakPolarHBondContact O-CD2 3.34Å; T600-L602 PolarHBondContact O-N 3.21Å; L602-V604 VanDerWaalsContact C-N 3.29Å; L602-V604 PolarHBondContact O-N 2.83Å; L602-R611 PolarHBondContact O-NE 3.09Å; L602-R611 PolarHBondContact O-NH1 2.85Å; L602-R611 PolarHBondContact O-NH2 3.14Å; L602-Y656 HydrophobicContact CD2-CE1 4.35Å; L602-Y656 PolarHBondContact O-OH 2.86Å
603	D	80.7	Confident	86.1	Confident	109 Å²	109	61 Å²	61	58%	0.583	31%	0.308	S	S	*	.			trans	-64.8	-27.3	-151.7	-68.7	-43	0	0	0	115	D601 R611 K2335	D601-D603 PolarHBondContact OD1-N 2.83Å; D603-R611 PolarHBondContact O-NH1 3.12Å; D603-K2335 IonicContact OD2-NZ 2.71Å; D603-K2335 PolarHBondContact OD2-NZ 2.89Å
604	V	82.8	Confident	85.3	Confident	43 Å²	43	63.2 Å²	63.2	26%	0.261	32%	0.315	S	S	.	.	S	Bend	trans	-40.9	130.9	172.2	-174	0	0	0	0	112.8	L602 R611 C660	L602-V604 VanDerWaalsContact C-N 3.29Å; L602-V604 PolarHBondContact O-N 2.83Å; V604-R611 PolarHBondContact O-NH2 2.78Å; V604-C660 HydrophobicContact CG1-CB 3.93Å
605	P	83.9	Confident	84.5	Confident	112 Å²	112	62.4 Å²	62.4	73%	0.727	32%	0.316	S	S	*	.			trans	-65.2	143.2	178.6	27.3	-35.1	0	0	0	112.2
606	N	89.3	Confident	83.6	Confident	21 Å²	21	56.9 Å²	56.9	11%	0.112	30%	0.297	C	S	.	.			trans	-119.1	127.2	-177.8	-168.7	-66.6	0	0	0	111.3	F608 M609 Y656 C660	N606-F608 VanDerWaalsContact C-N 3.32Å; N606-F608 PolarHBondContact O-N 3.46Å; N606-F608 PolarHBondContact OD1-N 2.93Å; N606-M609 HydrophobicContact CB-CG 4.27Å; N606-M609 PolarHBondContact OD1-N 3.29Å; N606-Y656 WeakPolarHBondContact ND2-CD2 3.43Å; N606-Y656 PolarHBondContact ND2-O 3.28Å; N606-C660 PolarHBondContact ND2-SG 3.13Å
607	L	87.8	Confident	82.9	Confident	74 Å²	74	55.5 Å²	55.5	39%	0.387	29%	0.293	S	S	.	.	S	Bend	trans	-64.1	-33	-178.9	179.6	62.3	0	0	0	113.3	G659 Y663	L607-G659 WeakPolarHBondContact CB-O 3.35Å; L607-G659 PolarHBondContact N-O 3.33Å; L607-Y663 HydrophobicContact CD2-CD1 3.89Å; L607-Y663 HydrophobicContact CD2-CE1 3.68Å
608	F	90.3	Very high	82.5	Confident	2 Å²	2	60 Å²	60	1%	0.009	31%	0.312	C	S	.	.	S	Bend	trans	-94.8	-17.2	-169.5	-56.5	-32.2	0	0	0	113.7	V569 T570 N578 N606 I655 L658 L735 H736 V739	V569-F608 WeakPolarHBondContact O-CB 3.39Å; T570-F608 HydrophobicContact CG2-CD1 4.07Å; T570-F608 HydrophobicContact CG2-CE1 3.8Å; T570-F608 HydrophobicContact CG2-CZ 4.16Å; N578-F608 PolarHBondContact ND2-O 3.46Å; N606-F608 VanDerWaalsContact C-N 3.32Å; N606-F608 PolarHBondContact O-N 3.46Å; N606-F608 PolarHBondContact OD1-N 2.93Å; F608-I655 HydrophobicContact CD2-CG2 4.45Å; F608-L658 HydrophobicContact CE2-CB 4.35Å; F608-L735 HydrophobicContact CZ-CD2 4.15Å; F608-L735 HydrophobicContact CZ-CG 4.24Å; F608-H736 AromaticContact CE1-NE2 3.88Å; F608-V739 HydrophobicContact CD2-CG1 4.27Å; F608-V739 HydrophobicContact CE2-CB 4.32Å; F608-V739 HydrophobicContact CE2-CG1 3.85Å; F608-V739 HydrophobicContact CE2-CG2 3.85Å; F608-V739 HydrophobicContact CZ-CB 4.37Å; F608-V739 HydrophobicContact CZ-CG1 4.3Å; F608-V739 HydrophobicContact CZ-CG2 3.94Å
609	M	88.4	Confident	82.2	Confident	6 Å²	6	59.5 Å²	59.5	3%	0.03	31%	0.312	C	S	.	.			trans	-151.5	139.6	-179.7	66.9	-173.7	77.2	0	0	113.5	F582 Y583 L586 N606 Y656	F582-M609 HydrophobicContact CB-CE 3.68Å; F582-M609 HydrophobicContact CB-SD 4.03Å; F582-M609 HydrophobicContact CD1-CE 3.61Å; F582-M609 HydrophobicContact CD2-CE 4.46Å; F582-M609 HydrophobicContact CE1-CE 4.37Å; F582-M609 HydrophobicContact CG-CE 3.66Å; Y583-M609 HydrophobicContact CE1-CB 4.47Å; L586-M609 HydrophobicContact CD1-SD 3.65Å; N606-M609 HydrophobicContact CB-CG 4.27Å; N606-M609 PolarHBondContact OD1-N 3.29Å; M609-Y656 HydrophobicContact CE-CD2 3.95Å; M609-Y656 HydrophobicContact SD-CD2 3.82Å; M609-Y656 HydrophobicContact SD-CE2 4.03Å
610	T	82.7	Confident	81.8	Confident	76 Å²	76	60.7 Å²	60.7	47%	0.466	32%	0.32	S	S	.	.			trans	-89.9	135.4	162.2	-53.7	0	0	0	0	108.4	R572 Y583	R572-T610 PolarHBondContact NH2-OG1 3.18Å; Y583-T610 WeakPolarHBondContact CE1-O 3.41Å
611	R	78.5	Confident	82	Confident	63 Å²	63	57 Å²	57	24%	0.238	30%	0.298	C	S	.	.			trans	-68.4	158.9	-176.6	-66.2	-172.6	-171.4	86.8	39.8	112.6	L602 D603 V604 H613 Y656	L602-R611 PolarHBondContact O-NE 3.09Å; L602-R611 PolarHBondContact O-NH1 2.85Å; L602-R611 PolarHBondContact O-NH2 3.14Å; D603-R611 PolarHBondContact O-NH1 3.12Å; V604-R611 PolarHBondContact O-NH2 2.78Å; R611-H613 PolarHBondContact O-CD2 3.46Å; R611-H613 PolarHBondContact O-N 3.5Å; R611-Y656 PolarHBondContact NE-OH 3.46Å; R611-Y656 PolarHBondContact NH2-OH 3.02Å
612	L	80.5	Confident	82.6	Confident	49 Å²	49	58.1 Å²	58.1	26%	0.257	30%	0.299	S	S	.	.			trans	-68.4	112.8	161.7	-59.6	-179.7	0	0	0	108.6	Y583 D617 K618 A621	Y583-L612 HydrophobicContact CD1-CD1 4.46Å; Y583-L612 HydrophobicContact CD1-CD2 4.14Å; Y583-L612 HydrophobicContact CD1-CG 3.89Å; Y583-L612 HydrophobicContact CG-CD1 4.5Å; Y583-L612 HydrophobicContact CG-CG 4.36Å; L612-D617 HydrophobicContact CB-CB 4.25Å; L612-D617 HydrophobicContact CD1-CB 4.03Å; L612-D617 HydrophobicContact CD2-CB 4.08Å; L612-D617 HydrophobicContact CG-CB 4.34Å; L612-K618 HydrophobicContact CB-CG 4.07Å; L612-K618 WeakPolarHBondContact O-CE 3.36Å; L612-A621 HydrophobicContact CD1-CB 3.76Å
613	H	76.1	Confident	83	Confident	146 Å²	146	60.5 Å²	60.5	68%	0.676	31%	0.307	S	S	*	.			trans	-84.2	-37.8	176.3	-72.6	-92	0	0	0	112	R611 K618	R611-H613 PolarHBondContact O-CD2 3.46Å; R611-H613 PolarHBondContact O-N 3.5Å; H613-K618 PolarHBondContact O-NZ 2.87Å
614	R	72.7	Confident	83.6	Confident	57 Å²	57	59.1 Å²	59.1	22%	0.215	30%	0.297	C	S	.	.	S	Bend	trans	-72.1	134.3	-176	-60.1	-177.4	179.1	-169.7	0.6	111.8	E616 D617 K618 Q1093 Q1096	R614-E616 VanDerWaalsContact C-N 3.34Å; R614-E616 PolarHBondContact O-N 2.98Å; R614-D617 HydrophobicContact CB-CB 4.32Å; R614-D617 WeakPolarHBondContact CB-OD2 3.4Å; R614-D617 PolarHBondContact O-N 3.22Å; R614-K618 WeakPolarHBondContact O-CG 3.49Å; R614-K618 PolarHBondContact O-N 3.26Å; R614-Q1093 PolarHBondContact NH2-O 3.33Å; R614-Q1096 VanDerWaalsContact NH2-C 3.27Å; R614-Q1096 PolarHBondContact NH2-O 3Å
615	P	77.4	Confident	84.2	Confident	32 Å²	32	57.5 Å²	57.5	21%	0.208	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-32.4	179.4	-18.2	31.1	0	0	0	113.3	D617 K618 I619 Q2329 D2331	P615-D617 PolarHBondContact O-N 3.13Å; P615-K618 WeakPolarHBondContact O-CB 3.34Å; P615-K618 PolarHBondContact O-N 3.39Å; P615-I619 VanDerWaalsContact O-CG1 3.29Å; P615-I619 WeakPolarHBondContact O-CG1 3.31Å; P615-I619 PolarHBondContact O-N 3.01Å; P615-Q2329 HydrophobicContact CB-CG 4.16Å; P615-D2331 WeakPolarHBondContact CB-OD2 3.43Å; P615-D2331 VanDerWaalsContact CG-OD2 3.28Å; P615-D2331 WeakPolarHBondContact CG-OD2 3.38Å
616	E	73.3	Confident	84.7	Confident	44 Å²	44	56.7 Å²	56.7	21%	0.206	27%	0.272	C	S	.	.	H	α-helix	trans	-59.6	-45.9	175.5	-56.3	94.8	137	0	0	111.8	R614 K618 I619 S620 R2327 Q2329	R614-E616 VanDerWaalsContact C-N 3.34Å; R614-E616 PolarHBondContact O-N 2.98Å; E616-K618 VanDerWaalsContact C-N 3.33Å; E616-K618 PolarHBondContact O-N 3.49Å; E616-I619 PolarHBondContact O-N 2.81Å; E616-S620 WeakPolarHBondContact O-CB 3.38Å; E616-S620 PolarHBondContact O-N 2.92Å; E616-R2327 HydrophobicContact CG-CG 4.1Å; E616-R2327 IonicContact OE1-CZ 2.88Å; E616-R2327 IonicContact OE1-NE 3.78Å; E616-R2327 IonicContact OE1-NH2 3.69Å; E616-R2327 PolarHBondContact OE1-NH2 3.09Å; E616-Q2329 VanDerWaalsContact CD-OE1 3.27Å; E616-Q2329 HydrophobicContact CG-CG 4Å; E616-Q2329 PolarHBondContact OE1-OE1 3.24Å
617	D	75.8	Confident	84.9	Confident	66 Å²	66	59.6 Å²	59.6	35%	0.353	29%	0.285	S	S	.	.	H	α-helix	trans	-65.1	-39	178.7	-64.2	-30.7	0	0	0	110.5	L612 R614 P615 S620 A621	L612-D617 HydrophobicContact CB-CB 4.25Å; L612-D617 HydrophobicContact CD1-CB 4.03Å; L612-D617 HydrophobicContact CD2-CB 4.08Å; L612-D617 HydrophobicContact CG-CB 4.34Å; R614-D617 HydrophobicContact CB-CB 4.32Å; R614-D617 WeakPolarHBondContact CB-OD2 3.4Å; R614-D617 PolarHBondContact O-N 3.22Å; P615-D617 PolarHBondContact O-N 3.13Å; D617-S620 PolarHBondContact O-N 3.08Å; D617-A621 VanDerWaalsContact O-CB 3.28Å; D617-A621 WeakPolarHBondContact O-CB 3.37Å; D617-A621 PolarHBondContact O-N 2.98Å
618	K	84	Confident	85.3	Confident	95 Å²	95	56.3 Å²	56.3	41%	0.413	27%	0.268	S	S	.	.	H	α-helix	trans	-63.7	-44	174.5	-67	173	-171.9	168.9	0	112	L612 H613 R614 P615 E616 A621 K622	L612-K618 HydrophobicContact CB-CG 4.07Å; L612-K618 WeakPolarHBondContact O-CE 3.36Å; H613-K618 PolarHBondContact O-NZ 2.87Å; R614-K618 WeakPolarHBondContact O-CG 3.49Å; R614-K618 PolarHBondContact O-N 3.26Å; P615-K618 WeakPolarHBondContact O-CB 3.34Å; P615-K618 PolarHBondContact O-N 3.39Å; E616-K618 VanDerWaalsContact C-N 3.33Å; E616-K618 PolarHBondContact O-N 3.49Å; K618-A621 PolarHBondContact O-N 3Å; K618-K622 WeakPolarHBondContact O-CB 3.3Å; K618-K622 PolarHBondContact O-N 2.94Å
619	I	85.1	Confident	85.5	Confident	51 Å²	51	57.4 Å²	57.4	26%	0.262	28%	0.276	S	S	.	.	H	α-helix	trans	-65.6	-42.7	178.6	-69	165.2	0	0	0	110.4	P615 E616 K622 K623 Q2329	P615-I619 VanDerWaalsContact O-CG1 3.29Å; P615-I619 WeakPolarHBondContact O-CG1 3.31Å; P615-I619 PolarHBondContact O-N 3.01Å; E616-I619 PolarHBondContact O-N 2.81Å; I619-K622 PolarHBondContact O-N 3.49Å; I619-K623 PolarHBondContact O-N 3.07Å; I619-Q2329 HydrophobicContact CD1-CB 3.95Å; I619-Q2329 HydrophobicContact CD1-CG 3.75Å
620	S	82.3	Confident	85.8	Confident	26 Å²	26	61.6 Å²	61.6	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-58.1	-50.1	172.9	-173.9	0	0	0	0	111.4	E616 D617 K622 K623 F624 I2325	E616-S620 WeakPolarHBondContact O-CB 3.38Å; E616-S620 PolarHBondContact O-N 2.92Å; D617-S620 PolarHBondContact O-N 3.08Å; S620-K622 VanDerWaalsContact C-N 3.34Å; S620-K622 PolarHBondContact O-N 3.22Å; S620-K623 PolarHBondContact O-N 3.22Å; S620-F624 VanDerWaalsContact O-CD2 3.24Å; S620-F624 WeakPolarHBondContact O-CD2 3.31Å; S620-F624 PolarHBondContact O-N 3.35Å; S620-I2325 WeakPolarHBondContact OG-CD1 3.47Å
621	A	88.8	Confident	86.4	Confident	3 Å²	3	58.1 Å²	58.1	3%	0.025	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-38.4	177	0	0	0	0	0	113.3	Y584 A587 L612 D617 K618 F624 W625	Y584-A621 HydrophobicContact CD1-CB 3.8Å; Y584-A621 HydrophobicContact CE1-CB 4.39Å; A587-A621 HydrophobicContact CB-CB 3.72Å; L612-A621 HydrophobicContact CD1-CB 3.76Å; D617-A621 VanDerWaalsContact O-CB 3.28Å; D617-A621 WeakPolarHBondContact O-CB 3.37Å; D617-A621 PolarHBondContact O-N 2.98Å; K618-A621 PolarHBondContact O-N 3Å; A621-F624 PolarHBondContact O-N 2.93Å; A621-W625 PolarHBondContact O-N 2.98Å
622	K	92.6	Very high	87.2	Confident	106 Å²	106	55.1 Å²	55.1	46%	0.461	26%	0.262	S	S	.	.	H	α-helix	trans	-65.1	-42.9	174.3	179.7	171	-178.3	-178.3	0	112.1	A587 K618 I619 S620 W625 Q626	A587-K622 HydrophobicContact CB-CB 4.43Å; K618-K622 WeakPolarHBondContact O-CB 3.3Å; K618-K622 PolarHBondContact O-N 2.94Å; I619-K622 PolarHBondContact O-N 3.49Å; S620-K622 VanDerWaalsContact C-N 3.34Å; S620-K622 PolarHBondContact O-N 3.22Å; K622-W625 PolarHBondContact O-N 3.2Å; K622-Q626 WeakPolarHBondContact O-CG 3.45Å; K622-Q626 PolarHBondContact O-N 3.49Å; K622-Q626 VanDerWaalsContact O-N 3.08Å
623	K	91.2	Very high	87.8	Confident	89 Å²	89	58.1 Å²	58.1	39%	0.387	28%	0.275	S	S	.	.	H	α-helix	trans	-61.7	-42.7	173.9	-73	-172.3	177.3	-170.5	0	111.2	I619 S620 Q626 Q627	I619-K623 PolarHBondContact O-N 3.07Å; S620-K623 PolarHBondContact O-N 3.22Å; K623-Q626 PolarHBondContact O-N 2.98Å; K623-Q627 PolarHBondContact O-N 2.59Å
624	F	92	Very high	88.5	Confident	81 Å²	81	53.4 Å²	53.4	36%	0.355	26%	0.255	S	S	.	.	H	α-helix	trans	-64.2	-38.6	175.1	-79.1	-63.3	0	0	0	113.7	Y584 S620 A621 Q627 L628 I2325	Y584-F624 HydrophobicContact CD1-CB 3.84Å; Y584-F624 HydrophobicContact CD1-CD2 4.47Å; Y584-F624 HydrophobicContact CD2-CB 3.81Å; Y584-F624 HydrophobicContact CE1-CB 3.75Å; Y584-F624 AromaticContact CE1-CD2 3.66Å; Y584-F624 HydrophobicContact CE1-CD2 3.66Å; Y584-F624 AromaticContact CE1-CG 3.93Å; Y584-F624 HydrophobicContact CE1-CG 3.93Å; Y584-F624 HydrophobicContact CE2-CB 3.69Å; Y584-F624 HydrophobicContact CE2-CD1 4.49Å; Y584-F624 HydrophobicContact CE2-CD2 4.48Å; Y584-F624 HydrophobicContact CE2-CG 4.01Å; Y584-F624 HydrophobicContact CG-CB 3.87Å; Y584-F624 AromaticContact CZ-CD2 3.65Å; Y584-F624 AromaticContact CZ-CG 3.63Å; S620-F624 VanDerWaalsContact O-CD2 3.24Å; S620-F624 WeakPolarHBondContact O-CD2 3.31Å; S620-F624 PolarHBondContact O-N 3.35Å; A621-F624 PolarHBondContact O-N 2.93Å; F624-Q627 PolarHBondContact O-N 2.74Å; F624-L628 WeakPolarHBondContact O-CG 3.5Å; F624-L628 PolarHBondContact O-N 2.82Å; F624-I2325 HydrophobicContact CD2-CD1 4.32Å; F624-I2325 HydrophobicContact CE1-CD1 4.48Å; F624-I2325 HydrophobicContact CE2-CD1 3.48Å; F624-I2325 VanDerWaalsContact CE2-CD1 3.48Å; F624-I2325 HydrophobicContact CZ-CD1 3.58Å
625	W	95.5	Very high	89.3	Confident	9 Å²	9	50.8 Å²	50.8	3%	0.034	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-41.8	174.7	-177.3	-100.8	0	0	0	112.7	I581 Y584 M585 G588 L589 A621 K622 Q627 L628 C629 W643 L644 T649	I581-W625 HydrophobicContact CD1-CE3 4.32Å; I581-W625 HydrophobicContact CD1-CZ3 3.8Å; Y584-W625 WeakPolarHBondContact O-CB 3.48Å; M585-W625 VanDerWaalsContact CA-CE3 3.45Å; M585-W625 HydrophobicContact CB-CE3 4.06Å; M585-W625 HydrophobicContact CB-CH2 4.05Å; M585-W625 HydrophobicContact CB-CZ3 3.65Å; M585-W625 HydrophobicContact CG-CH2 4.01Å; M585-W625 HydrophobicContact CG-CZ3 4.14Å; G588-W625 VanDerWaalsContact CA-CD1 3.48Å; G588-W625 VanDerWaalsContact O-CD1 3.29Å; L589-W625 HydrophobicContact CD2-CZ2 3.65Å; L589-W625 HydrophobicContact CG-CZ2 4.19Å; A621-W625 PolarHBondContact O-N 2.98Å; K622-W625 PolarHBondContact O-N 3.2Å; W625-Q627 VanDerWaalsContact C-N 3.3Å; W625-Q627 PolarHBondContact O-N 2.95Å; W625-L628 PolarHBondContact O-N 2.98Å; W625-L628 VanDerWaalsContact O-N 3.16Å; W625-C629 PolarHBondContact O-N 3.38Å; W625-W643 HydrophobicContact CH2-CZ2 4.29Å; W625-W643 HydrophobicContact CZ3-CZ2 4.29Å; W625-L644 HydrophobicContact CZ2-CD2 3.99Å; W625-T649 HydrophobicContact CH2-CG2 4.03Å; W625-T649 HydrophobicContact CZ2-CG2 4.26Å
626	Q	94.6	Very high	89.9	Confident	95 Å²	95	54.9 Å²	54.9	44%	0.444	26%	0.261	S	S	.	.	H	α-helix	trans	-60.6	-40.8	174.7	-71.6	176.1	-28.3	0	0	111.5	K622 K623 C629 H630	K622-Q626 WeakPolarHBondContact O-CG 3.45Å; K622-Q626 PolarHBondContact O-N 3.49Å; K622-Q626 VanDerWaalsContact O-N 3.08Å; K623-Q626 PolarHBondContact O-N 2.98Å; Q626-C629 PolarHBondContact O-N 3.32Å; Q626-H630 PolarHBondContact O-N 3.37Å; Q626-H630 VanDerWaalsContact O-N 3.17Å
627	Q	94.6	Very high	90.7	Very high	81 Å²	81	53.3 Å²	53.3	38%	0.379	25%	0.253	S	S	.	.	H	α-helix	trans	-62	-44.1	172.2	-174.3	62.9	50.2	0	0	112	K623 F624 W625 C629 H630 D631	K623-Q627 PolarHBondContact O-N 2.59Å; F624-Q627 PolarHBondContact O-N 2.74Å; W625-Q627 VanDerWaalsContact C-N 3.3Å; W625-Q627 PolarHBondContact O-N 2.95Å; Q627-C629 PolarHBondContact O-N 2.87Å; Q627-H630 PolarHBondContact O-N 2.89Å; Q627-H630 VanDerWaalsContact O-N 3.16Å; Q627-D631 PolarHBondContact NE2-OD1 2.81Å; Q627-D631 WeakPolarHBondContact O-CB 3.41Å; Q627-D631 PolarHBondContact O-N 2.87Å
628	L	95.5	Very high	91.4	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-64.8	-35.1	179.3	-72.9	171.8	0	0	0	113.4	N508 M509 I581 Y584 F624 W625 D631 A632 W643	N508-L628 HydrophobicContact CB-CD2 4.45Å; M509-L628 HydrophobicContact CG-CD2 3.96Å; I581-L628 HydrophobicContact CD1-CD1 3.84Å; Y584-L628 HydrophobicContact CD2-CD1 3.76Å; F624-L628 WeakPolarHBondContact O-CG 3.5Å; F624-L628 PolarHBondContact O-N 2.82Å; W625-L628 PolarHBondContact O-N 2.98Å; W625-L628 VanDerWaalsContact O-N 3.16Å; L628-D631 PolarHBondContact O-N 2.62Å; L628-A632 WeakPolarHBondContact O-CB 3.35Å; L628-A632 PolarHBondContact O-N 2.87Å; L628-W643 HydrophobicContact CB-CH2 4.48Å; L628-W643 HydrophobicContact CB-CZ2 3.96Å
629	C	95	Very high	91.7	Very high	26 Å²	26	50.9 Å²	50.9	18%	0.176	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-43.7	171.3	-72.3	0	0	0	0	111.6	W625 Q626 Q627 A632 E633 W643	W625-C629 PolarHBondContact O-N 3.38Å; Q626-C629 PolarHBondContact O-N 3.32Å; Q627-C629 PolarHBondContact O-N 2.87Å; C629-A632 WeakPolarHBondContact O-CB 3.2Å; C629-A632 PolarHBondContact O-N 3.44Å; C629-E633 WeakPolarHBondContact O-CG 3.49Å; C629-E633 PolarHBondContact O-N 2.97Å; C629-E633 VanDerWaalsContact O-N 3.11Å; C629-W643 PolarHBondContact SG-NE1 3.05Å; C629-W643 VanDerWaalsContact SG-NE1 3.44Å
630	H	94.8	Very high	91.8	Very high	93 Å²	93	55.1 Å²	55.1	43%	0.431	26%	0.261	S	S	.	.	H	α-helix	trans	-66.5	-38.7	176	-176.1	58.6	0	0	0	112.6	Q626 Q627 A632 E633 L634	Q626-H630 PolarHBondContact O-N 3.37Å; Q626-H630 VanDerWaalsContact O-N 3.17Å; Q627-H630 PolarHBondContact O-N 2.89Å; Q627-H630 VanDerWaalsContact O-N 3.16Å; H630-A632 VanDerWaalsContact C-N 3.27Å; H630-A632 PolarHBondContact O-N 3.32Å; H630-E633 IonicContact ND1-OE2 3.47Å; H630-E633 PolarHBondContact O-N 2.9Å; H630-L634 VanDerWaalsContact O-CB 3.28Å; H630-L634 WeakPolarHBondContact O-CB 3.39Å; H630-L634 PolarHBondContact O-N 2.83Å
631	D	95.4	Very high	91.9	Very high	4 Å²	4	57 Å²	57	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-35.6	174.1	-71.2	-17.2	0	0	0	111.2	A505 N508 M509 Q627 L628 L634 L635	A505-D631 HydrophobicContact CB-CB 3.66Å; N508-D631 WeakPolarHBondContact CB-OD2 3.5Å; N508-D631 PolarHBondContact ND2-OD2 2.83Å; M509-D631 HydrophobicContact CE-CB 4.44Å; Q627-D631 PolarHBondContact NE2-OD1 2.81Å; Q627-D631 WeakPolarHBondContact O-CB 3.41Å; Q627-D631 PolarHBondContact O-N 2.87Å; L628-D631 PolarHBondContact O-N 2.62Å; D631-L634 PolarHBondContact O-N 3.28Å; D631-L635 VanDerWaalsContact O-CB 3.31Å; D631-L635 WeakPolarHBondContact O-CB 3.48Å; D631-L635 VanDerWaalsContact O-CG 3.3Å; D631-L635 WeakPolarHBondContact O-CG 3.46Å; D631-L635 PolarHBondContact O-N 3.47Å
632	A	94.1	Very high	91.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-42.8	174.1	0	0	0	0	0	112.5	M509 L628 C629 H630 L635 Q636 F637 I639 W643	M509-A632 VanDerWaalsContact CE-CA 3.48Å; M509-A632 HydrophobicContact CE-CB 3.49Å; M509-A632 VanDerWaalsContact CE-CB 3.49Å; L628-A632 WeakPolarHBondContact O-CB 3.35Å; L628-A632 PolarHBondContact O-N 2.87Å; C629-A632 WeakPolarHBondContact O-CB 3.2Å; C629-A632 PolarHBondContact O-N 3.44Å; H630-A632 VanDerWaalsContact C-N 3.27Å; H630-A632 PolarHBondContact O-N 3.32Å; A632-L635 CarbonylContact O-C 3.53Å; A632-L635 PolarHBondContact O-N 3.14Å; A632-Q636 PolarHBondContact O-N 3.39Å; A632-Q636 VanDerWaalsContact O-N 3.1Å; A632-F637 HydrophobicContact CB-CB 4.35Å; A632-F637 HydrophobicContact CB-CD2 3.94Å; A632-F637 HydrophobicContact CB-CG 4.44Å; A632-F637 PolarHBondContact O-N 3.48Å; A632-I639 HydrophobicContact CB-CD1 3.63Å; A632-W643 HydrophobicContact CB-CD2 4.1Å; A632-W643 HydrophobicContact CB-CG 4.11Å
633	E	93.2	Very high	91.9	Very high	111 Å²	111	52.2 Å²	52.2	52%	0.519	25%	0.248	S	C	.	.	H	α-helix	trans	-61.7	-45	174.4	-68.3	172.9	166.1	0	0	110.7	C629 H630 L635 Q636 I639	C629-E633 WeakPolarHBondContact O-CG 3.49Å; C629-E633 PolarHBondContact O-N 2.97Å; C629-E633 VanDerWaalsContact O-N 3.11Å; H630-E633 IonicContact ND1-OE2 3.47Å; H630-E633 PolarHBondContact O-N 2.9Å; E633-L635 VanDerWaalsContact C-N 3.33Å; E633-L635 PolarHBondContact O-N 3.04Å; E633-Q636 WeakPolarHBondContact O-CA 3.36Å; E633-Q636 PolarHBondContact O-N 2.98Å; E633-I639 HydrophobicContact CG-CD1 3.68Å; E633-I639 HydrophobicContact CG-CG1 3.74Å
634	L	90.7	Very high	91.8	Very high	48 Å²	48	49.4 Å²	49.4	25%	0.251	24%	0.237	S	C	.	.	H	α-helix	trans	-69.1	-30	-178.3	-172	138.6	0	0	0	112.6	C501 R502 A505 H630 D631 Q636	C501-L634 HydrophobicContact CB-CD1 3.97Å; C501-L634 HydrophobicContact CB-CD2 4.09Å; C501-L634 WeakPolarHBondContact O-CD2 3.23Å; R502-L634 HydrophobicContact CB-CD2 4.24Å; R502-L634 HydrophobicContact CG-CD2 3.5Å; R502-L634 VanDerWaalsContact CG-CD2 3.5Å; R502-L634 HydrophobicContact CG-CG 4.47Å; R502-L634 PolarHBondContact NE-O 3.36Å; R502-L634 PolarHBondContact NH2-O 3.08Å; R502-L634 VanDerWaalsContact NH2-O 3.09Å; A505-L634 HydrophobicContact CB-CD2 3.98Å; H630-L634 VanDerWaalsContact O-CB 3.28Å; H630-L634 WeakPolarHBondContact O-CB 3.39Å; H630-L634 PolarHBondContact O-N 2.83Å; D631-L634 PolarHBondContact O-N 3.28Å; L634-Q636 VanDerWaalsContact C-N 3.33Å
635	L	90.6	Very high	91.3	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	4.1	167.7	-70	171.8	0	0	0	114	R502 A505 M509 D631 A632 E633 F637 C757 L758	R502-L635 HydrophobicContact CB-CD2 4.28Å; R502-L635 HydrophobicContact CG-CD2 4.31Å; A505-L635 HydrophobicContact CB-CD1 3.84Å; A505-L635 HydrophobicContact CB-CD2 4.33Å; A505-L635 HydrophobicContact CB-CG 3.81Å; M509-L635 HydrophobicContact SD-CD1 3.67Å; D631-L635 VanDerWaalsContact O-CB 3.31Å; D631-L635 WeakPolarHBondContact O-CB 3.48Å; D631-L635 VanDerWaalsContact O-CG 3.3Å; D631-L635 WeakPolarHBondContact O-CG 3.46Å; D631-L635 PolarHBondContact O-N 3.47Å; A632-L635 CarbonylContact O-C 3.53Å; A632-L635 PolarHBondContact O-N 3.14Å; E633-L635 VanDerWaalsContact C-N 3.33Å; E633-L635 PolarHBondContact O-N 3.04Å; L635-F637 HydrophobicContact CB-CD1 4.19Å; L635-F637 HydrophobicContact CB-CE1 3.86Å; L635-F637 HydrophobicContact CB-CZ 4.24Å; L635-F637 HydrophobicContact CD1-CZ 4.25Å; L635-C757 WeakPolarHBondContact O-CB 3.4Å; L635-C757 PolarHBondContact O-SG 3.35Å; L635-L758 HydrophobicContact CD2-CD2 3.84Å; L635-L758 HydrophobicContact CD2-CG 4.3Å
636	Q	89.1	Confident	90.6	Very high	118 Å²	118	45.8 Å²	45.8	55%	0.551	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	45.7	176.7	-63.1	173	-52.3	0	0	114	A632 E633 L634	A632-Q636 PolarHBondContact O-N 3.39Å; A632-Q636 VanDerWaalsContact O-N 3.1Å; E633-Q636 WeakPolarHBondContact O-CA 3.36Å; E633-Q636 PolarHBondContact O-N 2.98Å; L634-Q636 VanDerWaalsContact C-N 3.33Å
637	F	91	Very high	90.2	Very high	11 Å²	11	41.3 Å²	41.3	5%	0.048	20%	0.203	C	C	.	.			trans	-84.6	149.6	166.2	-62.1	-3.2	0	0	0	110.4	M509 A632 L635 I639 W643 L750 L753 I754 C757	M509-F637 HydrophobicContact CE-CD2 4.07Å; M509-F637 HydrophobicContact CE-CE2 3.65Å; M509-F637 HydrophobicContact SD-CE2 3.54Å; M509-F637 VanDerWaalsContact SD-CE2 3.54Å; M509-F637 HydrophobicContact SD-CZ 3.95Å; A632-F637 HydrophobicContact CB-CB 4.35Å; A632-F637 HydrophobicContact CB-CD2 3.94Å; A632-F637 HydrophobicContact CB-CG 4.44Å; A632-F637 PolarHBondContact O-N 3.48Å; L635-F637 HydrophobicContact CB-CD1 4.19Å; L635-F637 HydrophobicContact CB-CE1 3.86Å; L635-F637 HydrophobicContact CB-CZ 4.24Å; L635-F637 HydrophobicContact CD1-CZ 4.25Å; F637-I639 PolarHBondContact O-N 3.08Å; F637-I639 VanDerWaalsContact O-N 3.13Å; F637-W643 HydrophobicContact CD2-CE3 4.35Å; F637-L750 HydrophobicContact CE2-CD1 4.07Å; F637-L750 HydrophobicContact CZ-CD1 4.45Å; F637-L753 HydrophobicContact CD1-CB 4.3Å; F637-L753 HydrophobicContact CE1-CB 3.82Å; F637-L753 HydrophobicContact CE2-CB 4.39Å; F637-L753 HydrophobicContact CZ-CB 3.87Å; F637-I754 HydrophobicContact CZ-CG1 3.91Å; F637-C757 HydrophobicContact CE1-CB 4.49Å
638	D	89.4	Confident	90.2	Very high	66 Å²	66	37.5 Å²	37.5	35%	0.353	19%	0.185	S	C	.	.			trans	-71.1	106.8	166.2	-175	-35.4	0	0	0	109.1	K640 N641 E642 W643	D638-K640 PolarHBondContact O-N 3.34Å; D638-K640 PolarHBondContact OD1-N 3.02Å; D638-N641 HydrophobicContact CB-CB 4.27Å; D638-N641 PolarHBondContact O-N 3.42Å; D638-N641 PolarHBondContact OD1-N 3.17Å; D638-N641 WeakPolarHBondContact OD2-CB 3.5Å; D638-N641 PolarHBondContact OD2-ND2 2.93Å; D638-E642 HydrophobicContact CB-CB 4.21Å; D638-E642 HydrophobicContact CB-CG 3.93Å; D638-E642 PolarHBondContact N-OE2 3.18Å; D638-E642 WeakPolarHBondContact O-CA 3.29Å; D638-E642 WeakPolarHBondContact O-CB 3.44Å; D638-E642 PolarHBondContact O-N 3.05Å; D638-W643 PolarHBondContact O-N 3.06Å
639	I	90.1	Very high	90.1	Very high	44 Å²	44	37.2 Å²	37.2	23%	0.226	18%	0.184	C	C	.	.	I	π-helix	trans	-60.6	-32.3	-175.5	-59.1	-55.7	0	0	0	112.3	A632 E633 F637 W643 L644	A632-I639 HydrophobicContact CB-CD1 3.63Å; E633-I639 HydrophobicContact CG-CD1 3.68Å; E633-I639 HydrophobicContact CG-CG1 3.74Å; F637-I639 PolarHBondContact O-N 3.08Å; F637-I639 VanDerWaalsContact O-N 3.13Å; I639-W643 HydrophobicContact CD1-CB 4.43Å; I639-L644 HydrophobicContact CG2-CD1 3.74Å; I639-L644 HydrophobicContact CG2-CG 4.09Å; I639-L644 WeakPolarHBondContact O-CB 3.37Å; I639-L644 VanDerWaalsContact O-CG 3.24Å; I639-L644 WeakPolarHBondContact O-CG 3.48Å; I639-L644 PolarHBondContact O-N 2.91Å
640	K	86.5	Confident	90	Very high	141 Å²	141	36.9 Å²	36.9	61%	0.613	18%	0.179	S	C	*	.	I	π-helix	trans	-83.4	-51.1	178.7	-172.6	176.9	-178.5	-179.7	0	111.6	D638 G646	D638-K640 PolarHBondContact O-N 3.34Å; D638-K640 PolarHBondContact OD1-N 3.02Å; K640-G646 WeakPolarHBondContact O-CA 3.37Å; K640-G646 PolarHBondContact O-N 3.03Å
641	N	85.9	Confident	89.9	Confident	65 Å²	65	32.6 Å²	32.6	35%	0.348	16%	0.159	S	C	.	.	I	π-helix	trans	-89.4	-30.5	-167.9	-61.7	-53.5	0	0	0	113.6	D638 G646 G647 S997	D638-N641 HydrophobicContact CB-CB 4.27Å; D638-N641 PolarHBondContact O-N 3.42Å; D638-N641 PolarHBondContact OD1-N 3.17Å; D638-N641 WeakPolarHBondContact OD2-CB 3.5Å; D638-N641 PolarHBondContact OD2-ND2 2.93Å; N641-G646 CarbonylContact O-C 3.51Å; N641-G647 WeakPolarHBondContact O-CA 2.96Å; N641-G647 PolarHBondContact O-N 3.45Å; N641-S997 WeakPolarHBondContact O-CB 3.43Å
642	E	89.1	Confident	89.9	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.037	16%	0.158	C	C	.	.	I	π-helix	trans	-104.3	-38.9	-176.8	-65.8	174.1	158	0	0	112.8	D638 G647 I648 L753 R756 M1000	D638-E642 HydrophobicContact CB-CB 4.21Å; D638-E642 HydrophobicContact CB-CG 3.93Å; D638-E642 PolarHBondContact N-OE2 3.18Å; D638-E642 WeakPolarHBondContact O-CA 3.29Å; D638-E642 WeakPolarHBondContact O-CB 3.44Å; D638-E642 PolarHBondContact O-N 3.05Å; E642-G647 WeakPolarHBondContact O-CA 3.22Å; E642-I648 PolarHBondContact O-N 3.22Å; E642-L753 HydrophobicContact CB-CD1 4.26Å; E642-L753 HydrophobicContact CB-CD2 4.49Å; E642-L753 HydrophobicContact CG-CD2 4.25Å; E642-R756 IonicContact OE1-CZ 3.97Å; E642-R756 IonicContact OE1-NH1 3.36Å; E642-R756 PolarHBondContact OE1-NH1 2.75Å; E642-R756 IonicContact OE1-NH2 3.26Å; E642-R756 PolarHBondContact OE1-NH2 3.19Å; E642-R756 IonicContact OE2-CZ 2.76Å; E642-R756 IonicContact OE2-NH1 3.29Å; E642-R756 IonicContact OE2-NH2 2.63Å; E642-R756 PolarHBondContact OE2-NH2 3.25Å; E642-M1000 HydrophobicContact CG-CE 3.71Å; E642-M1000 VanDerWaalsContact OE1-CE 3.31Å; E642-M1000 WeakPolarHBondContact OE1-CE 3.48Å
643	W	91.5	Very high	90	Very high	1 Å²	1	32.4 Å²	32.4	0%	0.004	16%	0.158	C	C	.	.	I	π-helix	trans	-92.6	-60.1	-175.7	-173.4	-118.2	0	0	0	113.9	M509 F513 W625 L628 C629 A632 F637 D638 I639 I648 T649 L750	M509-W643 HydrophobicContact CE-CE3 4.25Å; M509-W643 HydrophobicContact CE-CH2 3.97Å; M509-W643 HydrophobicContact CE-CZ2 4.46Å; M509-W643 HydrophobicContact CE-CZ3 3.85Å; F513-W643 AromaticContact CE2-CH2 3.9Å; F513-W643 HydrophobicContact CE2-CH2 3.9Å; F513-W643 HydrophobicContact CE2-CZ3 4.12Å; F513-W643 HydrophobicContact CZ-CH2 4.12Å; F513-W643 HydrophobicContact CZ-CZ3 4.13Å; W625-W643 HydrophobicContact CH2-CZ2 4.29Å; W625-W643 HydrophobicContact CZ3-CZ2 4.29Å; L628-W643 HydrophobicContact CB-CH2 4.48Å; L628-W643 HydrophobicContact CB-CZ2 3.96Å; C629-W643 PolarHBondContact SG-NE1 3.05Å; C629-W643 VanDerWaalsContact SG-NE1 3.44Å; A632-W643 HydrophobicContact CB-CD2 4.1Å; A632-W643 HydrophobicContact CB-CG 4.11Å; F637-W643 HydrophobicContact CD2-CE3 4.35Å; D638-W643 PolarHBondContact O-N 3.06Å; I639-W643 HydrophobicContact CD1-CB 4.43Å; W643-I648 HydrophobicContact CE3-CB 4.45Å; W643-I648 HydrophobicContact CE3-CD1 4.25Å; W643-I648 HydrophobicContact CZ3-CD1 4.34Å; W643-I648 HydrophobicContact CZ3-CG2 4.33Å; W643-I648 PolarHBondContact O-N 3.22Å; W643-T649 WeakPolarHBondContact O-CB 3.24Å; W643-T649 PolarHBondContact O-N 3Å; W643-T649 PolarHBondContact O-OG1 3.48Å; W643-L750 HydrophobicContact CZ3-CD1 4.46Å
644	L	90.1	Very high	90	Very high	29 Å²	29	27.1 Å²	27.1	15%	0.152	13%	0.133	C	C	.	.	S	Bend	trans	-85.1	-126.7	-172.8	-60.9	177.6	0	0	0	112.9	L589 W625 I639 G646 G647 R650	L589-L644 HydrophobicContact CD2-CD2 4.45Å; W625-L644 HydrophobicContact CZ2-CD2 3.99Å; I639-L644 HydrophobicContact CG2-CD1 3.74Å; I639-L644 HydrophobicContact CG2-CG 4.09Å; I639-L644 WeakPolarHBondContact O-CB 3.37Å; I639-L644 VanDerWaalsContact O-CG 3.24Å; I639-L644 WeakPolarHBondContact O-CG 3.48Å; I639-L644 PolarHBondContact O-N 2.91Å; L644-G646 VanDerWaalsContact C-N 3.28Å; L644-G646 PolarHBondContact O-N 3.47Å; L644-G647 PolarHBondContact O-N 3.46Å; L644-R650 PolarHBondContact O-N 3.14Å
645	T	81.3	Confident	90.2	Very high	8 Å²	8	24.9 Å²	24.9	5%	0.049	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-14.6	-162.4	59	0	0	0	0	114.5	E596 L597 R650	E596-T645 HydrophobicContact CB-CG2 4.13Å; E596-T645 VanDerWaalsContact CD-OG1 3.23Å; E596-T645 HydrophobicContact CG-CG2 4.37Å; E596-T645 WeakPolarHBondContact OE1-CB 3.31Å; E596-T645 PolarHBondContact OE1-OG1 3.13Å; E596-T645 WeakPolarHBondContact OE2-CB 3.25Å; E596-T645 WeakPolarHBondContact OE2-CG2 3.26Å; E596-T645 PolarHBondContact OE2-OG1 3.46Å; L597-T645 HydrophobicContact CD1-CG2 4.2Å; L597-T645 HydrophobicContact CD2-CG2 4.27Å; L597-T645 HydrophobicContact CG-CG2 4.03Å; T645-R650 WeakPolarHBondContact O-CB 3.49Å; T645-R650 VanDerWaalsContact O-CD 3.26Å; T645-R650 WeakPolarHBondContact O-CD 3.37Å; T645-R650 WeakPolarHBondContact O-CG 3.2Å; T645-R650 PolarHBondContact O-NH1 3.36Å
646	G	81.1	Confident	90.5	Very high	7 Å²	7	25 Å²	25	7%	0.072	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-17.4	167.4	0	0	0	0	0	115.1	K640 N641 L644 S997	K640-G646 WeakPolarHBondContact O-CA 3.37Å; K640-G646 PolarHBondContact O-N 3.03Å; N641-G646 CarbonylContact O-C 3.51Å; L644-G646 VanDerWaalsContact C-N 3.28Å; L644-G646 PolarHBondContact O-N 3.47Å; G646-S997 VanDerWaalsContact O-CB 3.29Å; G646-S997 WeakPolarHBondContact O-CB 3.33Å; G646-S997 PolarHBondContact O-OG 3.47Å
647	G	86.2	Confident	90.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	-139.9	-126.9	-161	0	0	0	0	0	116.3	N641 E642 L644 T649 R650 L651	N641-G647 WeakPolarHBondContact O-CA 2.96Å; N641-G647 PolarHBondContact O-N 3.45Å; E642-G647 WeakPolarHBondContact O-CA 3.22Å; L644-G647 PolarHBondContact O-N 3.46Å; G647-T649 VanDerWaalsContact C-N 3.34Å; G647-T649 PolarHBondContact O-N 2.87Å; G647-R650 WeakPolarHBondContact O-CA 3.41Å; G647-R650 WeakPolarHBondContact O-CB 3.42Å; G647-R650 PolarHBondContact O-N 2.93Å; G647-L651 PolarHBondContact O-N 2.88Å
648	I	93	Very high	90.9	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-54.6	-46.4	-170	-74.8	173.7	0	0	0	112.4	F513 E642 W643 R650 L651 L652 I746 I749 L750 L753	F513-I648 HydrophobicContact CE1-CG2 3.8Å; F513-I648 HydrophobicContact CZ-CG2 3.59Å; E642-I648 PolarHBondContact O-N 3.22Å; W643-I648 HydrophobicContact CE3-CB 4.45Å; W643-I648 HydrophobicContact CE3-CD1 4.25Å; W643-I648 HydrophobicContact CZ3-CD1 4.34Å; W643-I648 HydrophobicContact CZ3-CG2 4.33Å; W643-I648 PolarHBondContact O-N 3.22Å; I648-R650 VanDerWaalsContact C-N 3.26Å; I648-R650 PolarHBondContact O-N 2.98Å; I648-L651 PolarHBondContact O-N 3.49Å; I648-L651 VanDerWaalsContact O-N 3.14Å; I648-L652 HydrophobicContact CG2-CD1 4.06Å; I648-L652 HydrophobicContact CG2-CG 4.46Å; I648-L652 WeakPolarHBondContact O-CG 3.33Å; I648-L652 PolarHBondContact O-N 3.04Å; I648-I746 HydrophobicContact CG2-CG2 3.93Å; I648-I749 HydrophobicContact CD1-CG2 4.14Å; I648-I749 HydrophobicContact CG1-CG2 4.01Å; I648-L750 HydrophobicContact CD1-CB 4.2Å; I648-L750 HydrophobicContact CD1-CD1 4.05Å; I648-L753 HydrophobicContact CD1-CD1 3.95Å
649	T	94.2	Very high	91	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62	-36	179.9	-52.9	0	0	0	0	111.5	M585 L589 L597 W625 W643 G647 L651 L652 A653	M585-T649 HydrophobicContact CG-CG2 4.02Å; M585-T649 HydrophobicContact SD-CG2 3.81Å; L589-T649 HydrophobicContact CD1-CG2 4.14Å; L589-T649 HydrophobicContact CD2-CG2 3.95Å; L597-T649 HydrophobicContact CD1-CG2 3.6Å; W625-T649 HydrophobicContact CH2-CG2 4.03Å; W625-T649 HydrophobicContact CZ2-CG2 4.26Å; W643-T649 WeakPolarHBondContact O-CB 3.24Å; W643-T649 PolarHBondContact O-N 3Å; W643-T649 PolarHBondContact O-OG1 3.48Å; G647-T649 VanDerWaalsContact C-N 3.34Å; G647-T649 PolarHBondContact O-N 2.87Å; T649-L651 VanDerWaalsContact C-N 3.35Å; T649-L651 PolarHBondContact O-N 3.01Å; T649-L652 PolarHBondContact O-N 3.06Å; T649-A653 PolarHBondContact O-N 3.44Å
650	R	93.3	Very high	91.2	Very high	19 Å²	19	14.4 Å²	14.4	7%	0.072	7%	0.071	C	C	.	.	H	α-helix	trans	-59.5	-43.9	174.8	-162.5	-166	-177	92.4	2.8	111.9	L597 L644 T645 G647 I648 A653 V654 L687 H689	L597-R650 HydrophobicContact CD2-CB 4.19Å; L597-R650 HydrophobicContact CD2-CG 4.03Å; L644-R650 PolarHBondContact O-N 3.14Å; T645-R650 WeakPolarHBondContact O-CB 3.49Å; T645-R650 VanDerWaalsContact O-CD 3.26Å; T645-R650 WeakPolarHBondContact O-CD 3.37Å; T645-R650 WeakPolarHBondContact O-CG 3.2Å; T645-R650 PolarHBondContact O-NH1 3.36Å; G647-R650 WeakPolarHBondContact O-CA 3.41Å; G647-R650 WeakPolarHBondContact O-CB 3.42Å; G647-R650 PolarHBondContact O-N 2.93Å; I648-R650 VanDerWaalsContact C-N 3.26Å; I648-R650 PolarHBondContact O-N 2.98Å; R650-A653 PolarHBondContact O-N 3.32Å; R650-V654 WeakPolarHBondContact O-CG2 3.37Å; R650-V654 PolarHBondContact O-N 3.03Å; R650-V654 VanDerWaalsContact O-N 3.12Å; R650-L687 HydrophobicContact CG-CD2 4.2Å; R650-L687 PolarHBondContact NE-O 3.46Å; R650-L687 PolarHBondContact NH2-O 3.37Å; R650-H689 PolarHBondContact NH2-CD2 2.83Å; R650-H689 PolarHBondContact NH2-NE2 2.92Å
651	L	93.1	Very high	91.4	Very high	2 Å²	2	7.7 Å²	7.7	1%	0.01	4%	0.042	C	C	.	.	H	α-helix	trans	-72.6	-32	179	-60.2	177.6	0	0	0	112.4	G647 I648 T649 V654 I655 L688 L742 I746 I749 L998	G647-L651 PolarHBondContact O-N 2.88Å; I648-L651 PolarHBondContact O-N 3.49Å; I648-L651 VanDerWaalsContact O-N 3.14Å; T649-L651 VanDerWaalsContact C-N 3.35Å; T649-L651 PolarHBondContact O-N 3.01Å; L651-V654 WeakPolarHBondContact O-CB 3.29Å; L651-V654 PolarHBondContact O-N 3.09Å; L651-I655 PolarHBondContact O-N 3.29Å; L651-L688 HydrophobicContact CD2-CD2 4.29Å; L651-L742 HydrophobicContact CD2-CD1 4.46Å; L651-I746 HydrophobicContact CB-CD1 3.53Å; L651-I746 HydrophobicContact CB-CG1 3.68Å; L651-I746 HydrophobicContact CD1-CG1 3.99Å; L651-I749 HydrophobicContact CD1-CD1 4.12Å; L651-L998 HydrophobicContact CD2-CD2 4.01Å; L651-L998 HydrophobicContact CG-CD2 4.38Å
652	L	95.5	Very high	91.5	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-66.9	-37.1	170.6	-67.3	171.7	0	0	0	112.1	F513 I581 F582 M585 I648 T649 I655 Y656 Y743 I746	F513-L652 HydrophobicContact CE1-CD1 3.97Å; F513-L652 HydrophobicContact CE1-CD2 4.28Å; F513-L652 HydrophobicContact CZ-CD1 4.15Å; I581-L652 HydrophobicContact CG1-CD1 3.64Å; I581-L652 HydrophobicContact CG2-CD2 4.41Å; F582-L652 HydrophobicContact CD1-CD2 4.42Å; F582-L652 HydrophobicContact CE1-CD2 3.77Å; F582-L652 HydrophobicContact CZ-CD2 4.13Å; M585-L652 HydrophobicContact CE-CB 4.15Å; M585-L652 HydrophobicContact SD-CB 3.55Å; M585-L652 VanDerWaalsContact SD-CB 3.55Å; M585-L652 HydrophobicContact SD-CD1 4.22Å; I648-L652 HydrophobicContact CG2-CD1 4.06Å; I648-L652 HydrophobicContact CG2-CG 4.46Å; I648-L652 WeakPolarHBondContact O-CG 3.33Å; I648-L652 PolarHBondContact O-N 3.04Å; T649-L652 PolarHBondContact O-N 3.06Å; L652-I655 PolarHBondContact O-N 2.76Å; L652-Y656 PolarHBondContact O-N 3.16Å; L652-Y743 HydrophobicContact CD2-CD2 4.24Å; L652-Y743 HydrophobicContact CD2-CE2 3.86Å; L652-I746 HydrophobicContact CD2-CD1 4.05Å; L652-I746 HydrophobicContact CD2-CG2 4.39Å; L652-I746 HydrophobicContact CG-CD1 4.38Å
653	A	94.9	Very high	91.4	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-64.9	-38	173.1	0	0	0	0	0	112.2	L597 L599 T649 R650 I655 Y656 H657 L687	L597-A653 HydrophobicContact CB-CB 4Å; L597-A653 HydrophobicContact CD1-CB 4.25Å; L597-A653 HydrophobicContact CD2-CB 4.21Å; L597-A653 HydrophobicContact CG-CB 4.38Å; L599-A653 HydrophobicContact CD1-CB 4.06Å; L599-A653 HydrophobicContact CG-CB 4.42Å; T649-A653 PolarHBondContact O-N 3.44Å; R650-A653 PolarHBondContact O-N 3.32Å; A653-I655 VanDerWaalsContact C-N 3.34Å; A653-I655 PolarHBondContact O-N 3.19Å; A653-Y656 WeakPolarHBondContact O-CB 3.18Å; A653-Y656 PolarHBondContact O-N 2.83Å; A653-H657 PolarHBondContact O-CD2 3.34Å; A653-H657 PolarHBondContact O-N 3.4Å; A653-L687 HydrophobicContact CB-CD1 4Å
654	V	94.1	Very high	90.8	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.006	5%	0.048	C	C	.	.	H	α-helix	trans	-57.8	-45.5	171	171.5	0	0	0	0	111.2	R650 L651 Y656 H657 L658 A684 L687 L688 L742	R650-V654 WeakPolarHBondContact O-CG2 3.37Å; R650-V654 PolarHBondContact O-N 3.03Å; R650-V654 VanDerWaalsContact O-N 3.12Å; L651-V654 WeakPolarHBondContact O-CB 3.29Å; L651-V654 PolarHBondContact O-N 3.09Å; V654-Y656 VanDerWaalsContact C-N 3.35Å; V654-Y656 PolarHBondContact O-N 2.86Å; V654-H657 PolarHBondContact O-N 3.4Å; V654-L658 HydrophobicContact CG1-CD1 3.94Å; V654-L658 HydrophobicContact CG1-CG 4.43Å; V654-L658 WeakPolarHBondContact O-CB 3.48Å; V654-L658 WeakPolarHBondContact O-CG 3.36Å; V654-L658 PolarHBondContact O-N 2.69Å; V654-A684 HydrophobicContact CG1-CB 4.31Å; V654-L687 HydrophobicContact CG2-CB 3.55Å; V654-L687 HydrophobicContact CG2-CD1 4.28Å; V654-L688 HydrophobicContact CG1-CD1 3.89Å; V654-L688 HydrophobicContact CG1-CD2 4.14Å; V654-L688 HydrophobicContact CG1-CG 3.92Å; V654-L688 HydrophobicContact CG2-CD2 4.11Å; V654-L688 HydrophobicContact CG2-CG 3.92Å; V654-L742 HydrophobicContact CB-CD2 4.46Å; V654-L742 HydrophobicContact CG1-CD2 3.8Å
655	I	95.1	Very high	89.7	Confident	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-61.5	-42.4	176.3	-69	174.1	0	0	0	111.4	V569 F582 F608 L651 L652 A653 L658 G659 V739 L742 Y743 I746	V569-I655 HydrophobicContact CG2-CG2 4.35Å; F582-I655 HydrophobicContact CE1-CB 4.29Å; F582-I655 HydrophobicContact CE1-CG2 3.76Å; F582-I655 HydrophobicContact CZ-CG2 4Å; F608-I655 HydrophobicContact CD2-CG2 4.45Å; L651-I655 PolarHBondContact O-N 3.29Å; L652-I655 PolarHBondContact O-N 2.76Å; A653-I655 VanDerWaalsContact C-N 3.34Å; A653-I655 PolarHBondContact O-N 3.19Å; I655-L658 PolarHBondContact O-N 2.7Å; I655-G659 PolarHBondContact O-N 2.87Å; I655-V739 HydrophobicContact CG1-CG1 4.23Å; I655-V739 HydrophobicContact CG2-CG1 3.8Å; I655-L742 HydrophobicContact CD1-CD2 4.35Å; I655-L742 HydrophobicContact CD1-CG 4.14Å; I655-L742 HydrophobicContact CG1-CD2 3.7Å; I655-L742 HydrophobicContact CG1-CG 4.04Å; I655-Y743 HydrophobicContact CD1-CD2 3.72Å; I655-Y743 HydrophobicContact CD1-CG 4.25Å; I655-I746 HydrophobicContact CD1-CD1 3.57Å
656	Y	95.3	Very high	88.8	Confident	3 Å²	3	18 Å²	18	1%	0.012	9%	0.093	C	C	.	.	H	α-helix	trans	-59.8	-50.1	175.5	-178.8	-94.9	0	0	0	111.5	L586 L599 L602 N606 M609 R611 L652 A653 V654 L658 G659 C660	L586-Y656 HydrophobicContact CD1-CD2 3.91Å; L586-Y656 HydrophobicContact CD1-CE2 3.66Å; L586-Y656 HydrophobicContact CD2-CD2 4.11Å; L586-Y656 HydrophobicContact CD2-CE2 4.03Å; L586-Y656 HydrophobicContact CD2-CG 4.49Å; L599-Y656 HydrophobicContact CD2-CD1 3.35Å; L599-Y656 HydrophobicContact CD2-CE1 3.82Å; L599-Y656 HydrophobicContact CD2-CG 4.02Å; L602-Y656 HydrophobicContact CD2-CE1 4.35Å; L602-Y656 PolarHBondContact O-OH 2.86Å; N606-Y656 WeakPolarHBondContact ND2-CD2 3.43Å; N606-Y656 PolarHBondContact ND2-O 3.28Å; M609-Y656 HydrophobicContact CE-CD2 3.95Å; M609-Y656 HydrophobicContact SD-CD2 3.82Å; M609-Y656 HydrophobicContact SD-CE2 4.03Å; R611-Y656 PolarHBondContact NE-OH 3.46Å; R611-Y656 PolarHBondContact NH2-OH 3.02Å; L652-Y656 PolarHBondContact O-N 3.16Å; A653-Y656 WeakPolarHBondContact O-CB 3.18Å; A653-Y656 PolarHBondContact O-N 2.83Å; V654-Y656 VanDerWaalsContact C-N 3.35Å; V654-Y656 PolarHBondContact O-N 2.86Å; Y656-L658 PolarHBondContact O-N 3.13Å; Y656-G659 WeakPolarHBondContact O-CA 3.39Å; Y656-G659 PolarHBondContact O-N 3.41Å; Y656-C660 PolarHBondContact O-N 2.99Å
657	H	95.3	Very high	87.9	Confident	7 Å²	7	22.2 Å²	22.2	3%	0.032	11%	0.113	C	C	.	.	H	α-helix	trans	-63.5	-38.6	179.8	-76.6	-58	0	0	0	113	L597 F598 A653 V654 G659 C660 A661 S680 Y683 A684	L597-H657 PolarHBondContact O-NE2 3.2Å; F598-H657 PolarHBondContact O-CE1 3.45Å; F598-H657 VanDerWaalsContact O-CE1 3.24Å; A653-H657 PolarHBondContact O-CD2 3.34Å; A653-H657 PolarHBondContact O-N 3.4Å; V654-H657 PolarHBondContact O-N 3.4Å; H657-G659 VanDerWaalsContact C-N 3.26Å; H657-G659 PolarHBondContact O-N 3.41Å; H657-C660 CarbonylContact O-C 3.58Å; H657-C660 PolarHBondContact O-N 3.32Å; H657-C660 VanDerWaalsContact O-N 3.1Å; H657-A661 WeakPolarHBondContact O-CB 3.34Å; H657-A661 PolarHBondContact O-N 3.11Å; H657-S680 WeakPolarHBondContact O-CB 3.38Å; H657-Y683 AromaticContact CE1-CD2 3.87Å; H657-Y683 AromaticContact ND1-CD2 3.93Å; H657-A684 HydrophobicContact CB-CB 4.01Å
658	L	93.8	Very high	86.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.2	-33.6	171.2	-71.7	171.2	0	0	0	112.4	F608 V654 I655 Y656 A661 G662 F675 A684 L695 I699 L735 F738 V739	F608-L658 HydrophobicContact CE2-CB 4.35Å; V654-L658 HydrophobicContact CG1-CD1 3.94Å; V654-L658 HydrophobicContact CG1-CG 4.43Å; V654-L658 WeakPolarHBondContact O-CB 3.48Å; V654-L658 WeakPolarHBondContact O-CG 3.36Å; V654-L658 PolarHBondContact O-N 2.69Å; I655-L658 PolarHBondContact O-N 2.7Å; Y656-L658 PolarHBondContact O-N 3.13Å; L658-A661 PolarHBondContact O-N 3.03Å; L658-G662 PolarHBondContact O-N 3.03Å; L658-F675 HydrophobicContact CD2-CE1 3.77Å; L658-F675 HydrophobicContact CD2-CZ 3.77Å; L658-A684 HydrophobicContact CD2-CB 3.97Å; L658-A684 HydrophobicContact CG-CB 3.95Å; L658-L695 HydrophobicContact CD2-CD2 4.36Å; L658-I699 HydrophobicContact CD2-CD1 4.18Å; L658-L735 HydrophobicContact CB-CD1 4.39Å; L658-L735 HydrophobicContact CD2-CD1 4.19Å; L658-F738 HydrophobicContact CD1-CD1 4.1Å; L658-F738 HydrophobicContact CD1-CE1 3.9Å; L658-V739 HydrophobicContact CB-CG2 4.21Å; L658-V739 HydrophobicContact CD1-CG2 3.94Å
659	G	92.6	Very high	84.8	Confident	2 Å²	2	35 Å²	35	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-68.8	-30.2	172.4	0	0	0	0	0	113.8	L607 I655 Y656 H657	L607-G659 WeakPolarHBondContact CB-O 3.35Å; L607-G659 PolarHBondContact N-O 3.33Å; I655-G659 PolarHBondContact O-N 2.87Å; Y656-G659 WeakPolarHBondContact O-CA 3.39Å; Y656-G659 PolarHBondContact O-N 3.41Å; H657-G659 VanDerWaalsContact C-N 3.26Å; H657-G659 PolarHBondContact O-N 3.41Å
660	C	92.9	Very high	82.9	Confident	9 Å²	9	42.6 Å²	42.6	6%	0.061	21%	0.21	C	C	.	.	H	α-helix	trans	-82.1	-24	172.9	-63.1	0	0	0	0	113	V604 N606 Y656 H657 N677 S680	V604-C660 HydrophobicContact CG1-CB 3.93Å; N606-C660 PolarHBondContact ND2-SG 3.13Å; Y656-C660 PolarHBondContact O-N 2.99Å; H657-C660 CarbonylContact O-C 3.58Å; H657-C660 PolarHBondContact O-N 3.32Å; H657-C660 VanDerWaalsContact O-N 3.1Å; C660-N677 WeakPolarHBondContact O-CB 3.48Å; C660-N677 PolarHBondContact O-ND2 3.04Å; C660-S680 WeakPolarHBondContact CB-OG 3.48Å
661	A	91.9	Very high	81.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-72.7	-28.4	178.8	0	0	0	0	0	113.2	H657 L658 F675 T676 N677 A681	H657-A661 WeakPolarHBondContact O-CB 3.34Å; H657-A661 PolarHBondContact O-N 3.11Å; L658-A661 PolarHBondContact O-N 3.03Å; A661-F675 HydrophobicContact CB-CB 4.33Å; A661-F675 HydrophobicContact CB-CD1 3.48Å; A661-F675 VanDerWaalsContact CB-CD1 3.48Å; A661-F675 HydrophobicContact CB-CE1 4Å; A661-F675 HydrophobicContact CB-CG 4.13Å; A661-T676 PolarHBondContact O-N 3.34Å; A661-N677 PolarHBondContact O-N 2.68Å; A661-A681 HydrophobicContact CB-CB 4.03Å
662	G	88.1	Confident	80	Confident	14 Å²	14	50.5 Å²	50.5	14%	0.144	25%	0.254	C	S	.	.			trans	64	-155.8	178.6	0	0	0	0	0	113.3	L658 F675 L735	L658-G662 PolarHBondContact O-N 3.03Å; G662-F675 WeakPolarHBondContact O-CD1 3.26Å; G662-L735 WeakPolarHBondContact O-CD2 3.38Å
663	Y	85.2	Confident	78.8	Confident	59 Å²	59	52.5 Å²	52.5	23%	0.231	26%	0.264	C	S	.	.			trans	-153.5	142.4	174.5	60.6	-96.4	0	0	0	109.9	L607 T676 A731 K732 L735	L607-Y663 HydrophobicContact CD2-CD1 3.89Å; L607-Y663 HydrophobicContact CD2-CE1 3.68Å; Y663-T676 PolarHBondContact N-OG1 3.2Å; Y663-T676 VanDerWaalsContact N-OG1 3.09Å; Y663-T676 PolarHBondContact O-OG1 3.28Å; Y663-A731 HydrophobicContact CD2-CB 4.13Å; Y663-A731 HydrophobicContact CG-CB 4.31Å; Y663-K732 HydrophobicContact CD1-CB 4.25Å; Y663-K732 HydrophobicContact CD1-CG 4.41Å; Y663-K732 HydrophobicContact CD2-CB 4.21Å; Y663-K732 HydrophobicContact CE1-CB 3.76Å; Y663-K732 HydrophobicContact CE1-CD 4.49Å; Y663-K732 HydrophobicContact CE1-CG 3.65Å; Y663-K732 HydrophobicContact CE2-CB 3.77Å; Y663-K732 HydrophobicContact CE2-CG 4.44Å; Y663-K732 HydrophobicContact CG-CB 4.47Å; Y663-L735 HydrophobicContact CD1-CD2 4.38Å
664	C	79.4	Confident	77.9	Confident	20 Å²	20	56.5 Å²	56.5	14%	0.135	28%	0.28	C	S	.	.			trans	-93.6	136.6	166.6	-157.9	0	0	0	0	110.6	E666 Y674 A731	C664-E666 PolarHBondContact SG-N 3.48Å; C664-Y674 HydrophobicContact CB-CD1 3.85Å; C664-Y674 HydrophobicContact CB-CD2 4.21Å; C664-Y674 HydrophobicContact CB-CE1 3.47Å; C664-Y674 VanDerWaalsContact CB-CE1 3.47Å; C664-Y674 HydrophobicContact CB-CE2 3.86Å; C664-Y674 HydrophobicContact CB-CG 4.2Å; C664-Y674 VanDerWaalsContact CB-CZ 3.49Å; C664-Y674 PolarHBondContact N-O 3.27Å; C664-Y674 VanDerWaalsContact SG-CZ 3.57Å; C664-Y674 PolarHBondContact SG-OH 2.82Å; C664-A731 WeakPolarHBondContact O-CB 3.46Å
665	N	66.8	Low	77.5	Confident	88 Å²	88	57 Å²	57	47%	0.471	28%	0.282	S	S	.	.			trans	-94.6	-11.5	170.6	-80.7	-23.5	0	0	0	112.5
666	E	64	Low	77.1	Confident	147 Å²	147	61.7 Å²	61.7	69%	0.687	31%	0.311	S	S	*	.	S	Bend	trans	-75.8	151.9	170.4	-56.4	-171.3	158.5	0	0	109.6	C664	C664-E666 PolarHBondContact SG-N 3.48Å
667	I	61.9	Low	76.7	Confident	95 Å²	95	63.7 Å²	63.7	49%	0.487	32%	0.322	S	S	.	.			trans	-113.1	126.2	-169.8	-66	171.5	0	0	0	107.6	N671 L673	I667-N671 VanDerWaalsContact CG2-CA 3.47Å; I667-N671 HydrophobicContact CG2-CB 4.29Å; I667-L673 HydrophobicContact CG1-CD2 4.21Å
668	N	60	Low	76.3	Confident	66 Å²	66	70 Å²	70	35%	0.353	35%	0.346	S	S	.	.			trans	-61.7	166	179.6	-50.4	59.5	0	0	0	111.5	E670 N671 L672 Y674	N668-E670 PolarHBondContact O-N 3.06Å; N668-N671 PolarHBondContact O-N 3.44Å; N668-L672 PolarHBondContact OD1-O 2.84Å; N668-L672 VanDerWaalsContact OD1-O 3.08Å; N668-Y674 WeakPolarHBondContact OD1-CD1 3.34Å; N668-Y674 VanDerWaalsContact OD1-CE1 3.27Å; N668-Y674 WeakPolarHBondContact OD1-CE1 3.49Å
669	E	53.6	Low	76.1	Confident	204 Å²	204	74.3 Å²	74.3	95%	0.953	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-28.4	171.9	-58.2	-172.5	156.6	0	0	112.8
670	E	54.7	Low	76.1	Confident	158 Å²	158	74.6 Å²	74.6	74%	0.738	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	6.8	177.1	-58.3	-165.6	142.1	0	0	115.6	N668 L672	N668-E670 PolarHBondContact O-N 3.06Å; E670-L672 HydrophobicContact CB-CD1 4.41Å; E670-L672 PolarHBondContact O-N 3.18Å
671	N	60.5	Low	76	Confident	123 Å²	123	74.1 Å²	74.1	66%	0.658	37%	0.365	S	S	*	.	S	Bend	trans	63.9	26.9	-176.8	-71.1	-87.7	0	0	0	116.6	I667 N668	I667-N671 VanDerWaalsContact CG2-CA 3.47Å; I667-N671 HydrophobicContact CG2-CB 4.29Å; N668-N671 PolarHBondContact O-N 3.44Å
672	L	63.4	Low	76	Confident	65 Å²	65	77.7 Å²	77.7	34%	0.34	38%	0.382	S	S	.	.			trans	-99.2	169.5	178	-66	173.1	0	0	0	113	N668 E670	N668-L672 PolarHBondContact OD1-O 2.84Å; N668-L672 VanDerWaalsContact OD1-O 3.08Å; E670-L672 HydrophobicContact CB-CD1 4.41Å; E670-L672 PolarHBondContact O-N 3.18Å
673	L	70.6	Confident	76.3	Confident	41 Å²	41	80.5 Å²	80.5	22%	0.215	39%	0.388	C	S	.	.			trans	-116.5	147	173.8	-60.4	175	0	0	0	109.5	I667 F700 A731	I667-L673 HydrophobicContact CG1-CD2 4.21Å; L673-F700 HydrophobicContact CB-CB 4.1Å; L673-F700 HydrophobicContact CB-CD1 3.89Å; L673-F700 HydrophobicContact CB-CG 3.98Å; L673-F700 HydrophobicContact CD1-CD1 4.3Å; L673-A731 HydrophobicContact CB-CB 4.37Å; L673-A731 HydrophobicContact CD1-CB 4.18Å; L673-A731 HydrophobicContact CD2-CB 4.41Å
674	Y	76.7	Confident	76.7	Confident	85 Å²	85	77.7 Å²	77.7	33%	0.333	38%	0.377	S	S	.	.			trans	-147.3	165.3	-169.6	66.2	-71.7	0	0	0	113.8	C664 N668	C664-Y674 HydrophobicContact CB-CD1 3.85Å; C664-Y674 HydrophobicContact CB-CD2 4.21Å; C664-Y674 HydrophobicContact CB-CE1 3.47Å; C664-Y674 VanDerWaalsContact CB-CE1 3.47Å; C664-Y674 HydrophobicContact CB-CE2 3.86Å; C664-Y674 HydrophobicContact CB-CG 4.2Å; C664-Y674 VanDerWaalsContact CB-CZ 3.49Å; C664-Y674 PolarHBondContact N-O 3.27Å; C664-Y674 VanDerWaalsContact SG-CZ 3.57Å; C664-Y674 PolarHBondContact SG-OH 2.82Å; N668-Y674 WeakPolarHBondContact OD1-CD1 3.34Å; N668-Y674 VanDerWaalsContact OD1-CE1 3.27Å; N668-Y674 WeakPolarHBondContact OD1-CE1 3.49Å
675	F	85.6	Confident	77.3	Confident	10 Å²	10	76.9 Å²	76.9	4%	0.044	37%	0.372	C	S	.	.			trans	-76.1	142	173	-67.9	-77.4	0	0	0	111.8	L658 A661 G662 A681 L692 N696 I699 F700 L735	L658-F675 HydrophobicContact CD2-CE1 3.77Å; L658-F675 HydrophobicContact CD2-CZ 3.77Å; A661-F675 HydrophobicContact CB-CB 4.33Å; A661-F675 HydrophobicContact CB-CD1 3.48Å; A661-F675 VanDerWaalsContact CB-CD1 3.48Å; A661-F675 HydrophobicContact CB-CE1 4Å; A661-F675 HydrophobicContact CB-CG 4.13Å; G662-F675 WeakPolarHBondContact O-CD1 3.26Å; F675-A681 HydrophobicContact CB-CB 3.95Å; F675-A681 HydrophobicContact CD1-CB 4.18Å; F675-A681 HydrophobicContact CD2-CB 3.46Å; F675-A681 VanDerWaalsContact CD2-CB 3.46Å; F675-A681 HydrophobicContact CE2-CB 3.89Å; F675-A681 HydrophobicContact CG-CB 3.61Å; F675-A681 HydrophobicContact CZ-CB 4.41Å; F675-L692 HydrophobicContact CD2-CD1 4.34Å; F675-L692 HydrophobicContact CE2-CD1 4.25Å; F675-N696 VanDerWaalsContact CD2-OD1 3.24Å; F675-N696 WeakPolarHBondContact CD2-OD1 3.32Å; F675-N696 WeakPolarHBondContact CE2-OD1 3.34Å; F675-I699 HydrophobicContact CZ-CD1 3.8Å; F675-F700 HydrophobicContact CD1-CZ 4.42Å; F675-F700 HydrophobicContact CD2-CE2 4.05Å; F675-F700 HydrophobicContact CE1-CE2 4.37Å; F675-F700 HydrophobicContact CE1-CZ 4.27Å; F675-F700 AromaticContact CE2-CE2 3.85Å; F675-F700 HydrophobicContact CE2-CE2 3.85Å; F675-F700 HydrophobicContact CG-CE2 4.42Å; F675-F700 HydrophobicContact CZ-CE2 4.03Å; F675-F700 HydrophobicContact CZ-CZ 4.34Å; F675-L735 HydrophobicContact CE1-CD1 3.97Å
676	T	86.3	Confident	78.5	Confident	99 Å²	99	79.2 Å²	79.2	61%	0.607	38%	0.375	S	S	*	.	S	Bend	trans	-69.5	-41.9	176.8	-40.6	0	0	0	0	111.9	A661 Y663	A661-T676 PolarHBondContact O-N 3.34Å; Y663-T676 PolarHBondContact N-OG1 3.2Å; Y663-T676 VanDerWaalsContact N-OG1 3.09Å; Y663-T676 PolarHBondContact O-OG1 3.28Å
677	N	86.9	Confident	79.8	Confident	46 Å²	46	72.3 Å²	72.3	25%	0.246	34%	0.343	C	S	.	.			trans	-112.7	96.7	177.7	173.8	-0.5	0	0	0	109.3	C660 A661 Q679 S680 A681	C660-N677 WeakPolarHBondContact O-CB 3.48Å; C660-N677 PolarHBondContact O-ND2 3.04Å; A661-N677 PolarHBondContact O-N 2.68Å; N677-Q679 VanDerWaalsContact C-N 3.29Å; N677-Q679 PolarHBondContact O-N 3.39Å; N677-Q679 WeakPolarHBondContact OD1-CB 3.26Å; N677-Q679 PolarHBondContact OD1-N 3.06Å; N677-Q679 VanDerWaalsContact OD1-N 3.17Å; N677-S680 PolarHBondContact ND2-OG 2.94Å; N677-S680 PolarHBondContact O-N 2.96Å; N677-S680 PolarHBondContact OD1-N 3.4Å; N677-A681 PolarHBondContact O-N 3.41Å
678	Y	87.2	Confident	81	Confident	140 Å²	140	68 Å²	68	55%	0.549	32%	0.321	S	S	.	.	H	α-helix	trans	-58.9	-36.1	-179.3	-175.3	-93.8	0	0	0	112.9	A681 Q682 L692	Y678-A681 WeakPolarHBondContact O-CB 3.15Å; Y678-A681 PolarHBondContact O-N 3.05Å; Y678-Q682 HydrophobicContact CD1-CG 4.2Å; Y678-Q682 HydrophobicContact CE1-CG 3.93Å; Y678-Q682 PolarHBondContact O-N 2.89Å; Y678-L692 HydrophobicContact CD2-CD2 3.68Å; Y678-L692 HydrophobicContact CE1-CD2 4.23Å; Y678-L692 HydrophobicContact CE2-CD2 3.24Å; Y678-L692 HydrophobicContact CG-CD2 4.33Å
679	Q	89.9	Confident	82.2	Confident	90 Å²	90	68.4 Å²	68.4	42%	0.421	32%	0.32	S	S	.	.	H	α-helix	trans	-66	-45.9	-177.8	-168.2	66.6	17.7	0	0	111.9	N677 A681 Q682 Y683	N677-Q679 VanDerWaalsContact C-N 3.29Å; N677-Q679 PolarHBondContact O-N 3.39Å; N677-Q679 WeakPolarHBondContact OD1-CB 3.26Å; N677-Q679 PolarHBondContact OD1-N 3.06Å; N677-Q679 VanDerWaalsContact OD1-N 3.17Å; Q679-A681 VanDerWaalsContact C-N 3.29Å; Q679-A681 PolarHBondContact O-N 3.14Å; Q679-Q682 WeakPolarHBondContact O-CB 3.41Å; Q679-Q682 PolarHBondContact O-N 3.06Å; Q679-Y683 HydrophobicContact CG-CE2 3.86Å; Q679-Y683 PolarHBondContact NE2-OH 3.06Å; Q679-Y683 VanDerWaalsContact NE2-OH 3.07Å; Q679-Y683 WeakPolarHBondContact O-CD2 3.42Å; Q679-Y683 PolarHBondContact O-N 3.01Å; Q679-Y683 VanDerWaalsContact O-N 3.15Å
680	S	91.7	Very high	83.8	Confident	7 Å²	7	59.6 Å²	59.6	5%	0.049	28%	0.281	C	S	.	.	H	α-helix	trans	-65.8	-32.6	174.9	-64.1	0	0	0	0	112.2	H657 C660 N677 Y683 A684	H657-S680 WeakPolarHBondContact O-CB 3.38Å; C660-S680 WeakPolarHBondContact CB-OG 3.48Å; N677-S680 PolarHBondContact ND2-OG 2.94Å; N677-S680 PolarHBondContact O-N 2.96Å; N677-S680 PolarHBondContact OD1-N 3.4Å; S680-Y683 PolarHBondContact O-N 2.68Å; S680-A684 PolarHBondContact O-N 3.08Å; S680-A684 VanDerWaalsContact O-N 3.13Å
681	A	91.5	Very high	85.3	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.4	-37.6	173.2	0	0	0	0	0	112.4	A661 F675 N677 Y678 Q679 A684 A685 L692	A661-A681 HydrophobicContact CB-CB 4.03Å; F675-A681 HydrophobicContact CB-CB 3.95Å; F675-A681 HydrophobicContact CD1-CB 4.18Å; F675-A681 HydrophobicContact CD2-CB 3.46Å; F675-A681 VanDerWaalsContact CD2-CB 3.46Å; F675-A681 HydrophobicContact CE2-CB 3.89Å; F675-A681 HydrophobicContact CG-CB 3.61Å; F675-A681 HydrophobicContact CZ-CB 4.41Å; N677-A681 PolarHBondContact O-N 3.41Å; Y678-A681 WeakPolarHBondContact O-CB 3.15Å; Y678-A681 PolarHBondContact O-N 3.05Å; Q679-A681 VanDerWaalsContact C-N 3.29Å; Q679-A681 PolarHBondContact O-N 3.14Å; A681-A684 PolarHBondContact O-N 3.13Å; A681-A685 PolarHBondContact O-N 2.97Å; A681-L692 HydrophobicContact CB-CD1 3.65Å
682	Q	93	Very high	86.6	Confident	75 Å²	75	49.6 Å²	49.6	35%	0.35	24%	0.237	S	C	.	.	H	α-helix	trans	-62.6	-42.7	172.8	-74.9	-166.5	-24.8	0	0	112.5	Y678 Q679 A684 A685 Y686 L692	Y678-Q682 HydrophobicContact CD1-CG 4.2Å; Y678-Q682 HydrophobicContact CE1-CG 3.93Å; Y678-Q682 PolarHBondContact O-N 2.89Å; Q679-Q682 WeakPolarHBondContact O-CB 3.41Å; Q679-Q682 PolarHBondContact O-N 3.06Å; Q682-A684 VanDerWaalsContact C-N 3.34Å; Q682-A684 PolarHBondContact O-N 3.45Å; Q682-A685 PolarHBondContact O-N 2.8Å; Q682-Y686 WeakPolarHBondContact O-CB 3.4Å; Q682-Y686 PolarHBondContact O-N 3.02Å; Q682-L692 HydrophobicContact CG-CD2 3.86Å
683	Y	94.2	Very high	87.6	Confident	72 Å²	72	51.8 Å²	51.8	28%	0.282	25%	0.249	S	C	.	.	H	α-helix	trans	-62.3	-40.5	175.6	-61.3	-41.1	0	0	0	112.2	F598 H657 Q679 S680 L687	F598-Y683 HydrophobicContact CB-CD1 4Å; F598-Y683 HydrophobicContact CB-CD2 4.22Å; F598-Y683 HydrophobicContact CB-CE1 4.37Å; F598-Y683 HydrophobicContact CB-CG 3.94Å; F598-Y683 AromaticContact CD1-CD1 3.63Å; F598-Y683 HydrophobicContact CD1-CD1 3.63Å; F598-Y683 AromaticContact CD1-CE1 3.61Å; F598-Y683 HydrophobicContact CD1-CE1 3.61Å; F598-Y683 HydrophobicContact CD1-CG 4.43Å; F598-Y683 HydrophobicContact CD2-CD1 4.18Å; F598-Y683 HydrophobicContact CE1-CD1 4.15Å; F598-Y683 HydrophobicContact CE1-CE1 4.14Å; F598-Y683 AromaticContact CG-CD1 3.65Å; F598-Y683 HydrophobicContact CG-CD1 3.65Å; F598-Y683 HydrophobicContact CG-CE1 4.06Å; F598-Y683 HydrophobicContact CG-CG 4.06Å; H657-Y683 AromaticContact CE1-CD2 3.87Å; H657-Y683 AromaticContact ND1-CD2 3.93Å; Q679-Y683 HydrophobicContact CG-CE2 3.86Å; Q679-Y683 PolarHBondContact NE2-OH 3.06Å; Q679-Y683 VanDerWaalsContact NE2-OH 3.07Å; Q679-Y683 WeakPolarHBondContact O-CD2 3.42Å; Q679-Y683 PolarHBondContact O-N 3.01Å; Q679-Y683 VanDerWaalsContact O-N 3.15Å; S680-Y683 PolarHBondContact O-N 2.68Å; Y683-L687 WeakPolarHBondContact O-CB 3.5Å; Y683-L687 VanDerWaalsContact O-CG 3.31Å; Y683-L687 WeakPolarHBondContact O-CG 3.35Å; Y683-L687 PolarHBondContact O-N 3.46Å
684	A	93.1	Very high	88.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-42.7	173.6	0	0	0	0	0	112.3	V654 H657 L658 S680 A681 Q682 L688 L695	V654-A684 HydrophobicContact CG1-CB 4.31Å; H657-A684 HydrophobicContact CB-CB 4.01Å; L658-A684 HydrophobicContact CD2-CB 3.97Å; L658-A684 HydrophobicContact CG-CB 3.95Å; S680-A684 PolarHBondContact O-N 3.08Å; S680-A684 VanDerWaalsContact O-N 3.13Å; A681-A684 PolarHBondContact O-N 3.13Å; Q682-A684 VanDerWaalsContact C-N 3.34Å; Q682-A684 PolarHBondContact O-N 3.45Å; A684-L688 WeakPolarHBondContact O-CG 3.31Å; A684-L688 PolarHBondContact O-N 3.42Å; A684-L695 HydrophobicContact CB-CD2 4.15Å
685	A	91.4	Very high	88.8	Confident	3 Å²	3	48.1 Å²	48.1	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-66.2	-45.8	178.2	0	0	0	0	0	112.5	A681 Q682 L687 L688 H689 C690 L692 L695	A681-A685 PolarHBondContact O-N 2.97Å; Q682-A685 PolarHBondContact O-N 2.8Å; A685-L687 PolarHBondContact O-N 3.33Å; A685-L688 CarbonylContact O-C 3.3Å; A685-L688 PolarHBondContact O-N 2.97Å; A685-H689 PolarHBondContact O-N 3.24Å; A685-H689 VanDerWaalsContact O-N 3.07Å; A685-C690 CarbonylContact C-O 3.59Å; A685-C690 PolarHBondContact O-N 3.42Å; A685-L692 HydrophobicContact CB-CB 4.38Å; A685-L692 HydrophobicContact CB-CD1 4.48Å; A685-L695 HydrophobicContact CB-CB 4.39Å; A685-L695 HydrophobicContact CB-CD2 3.84Å
686	Y	91.9	Very high	88.7	Confident	138 Å²	138	49.3 Å²	49.3	54%	0.541	24%	0.244	S	C	.	.	H	α-helix	trans	-59.7	-46.1	176.8	-179.1	-87.2	0	0	0	111.8	F598 Q682 L688 H689	F598-Y686 AromaticContact CE2-CD1 3.52Å; F598-Y686 HydrophobicContact CE2-CD1 3.52Å; F598-Y686 AromaticContact CE2-CE1 3.77Å; F598-Y686 HydrophobicContact CE2-CE1 3.77Å; F598-Y686 HydrophobicContact CE2-CG 4.47Å; F598-Y686 AromaticContact CZ-CD1 3.78Å; F598-Y686 HydrophobicContact CZ-CD1 3.78Å; F598-Y686 AromaticContact CZ-CE1 3.76Å; F598-Y686 HydrophobicContact CZ-CE1 3.76Å; Q682-Y686 WeakPolarHBondContact O-CB 3.4Å; Q682-Y686 PolarHBondContact O-N 3.02Å; Y686-L688 VanDerWaalsContact C-N 3.28Å; Y686-L688 PolarHBondContact O-N 2.97Å; Y686-H689 PolarHBondContact O-CD2 2.76Å; Y686-H689 VanDerWaalsContact O-CD2 3.29Å; Y686-H689 PolarHBondContact O-N 3.22Å
687	L	91.1	Very high	88.5	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-63.3	-32.5	178.2	-72.5	172.7	0	0	0	112.7	L597 F598 R650 A653 V654 Y683 A685 H689	L597-L687 HydrophobicContact CD2-CD2 3.94Å; F598-L687 HydrophobicContact CD2-CD1 4.48Å; F598-L687 HydrophobicContact CD2-CD2 4.25Å; F598-L687 HydrophobicContact CD2-CG 4.28Å; F598-L687 HydrophobicContact CE2-CD2 4.22Å; F598-L687 HydrophobicContact CE2-CG 4.44Å; R650-L687 HydrophobicContact CG-CD2 4.2Å; R650-L687 PolarHBondContact NE-O 3.46Å; R650-L687 PolarHBondContact NH2-O 3.37Å; A653-L687 HydrophobicContact CB-CD1 4Å; V654-L687 HydrophobicContact CG2-CB 3.55Å; V654-L687 HydrophobicContact CG2-CD1 4.28Å; Y683-L687 WeakPolarHBondContact O-CB 3.5Å; Y683-L687 VanDerWaalsContact O-CG 3.31Å; Y683-L687 WeakPolarHBondContact O-CG 3.35Å; Y683-L687 PolarHBondContact O-N 3.46Å; A685-L687 PolarHBondContact O-N 3.33Å; L687-H689 VanDerWaalsContact C-N 3.31Å
688	L	87.2	Confident	88.1	Confident	4 Å²	4	49 Å²	49	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-77.9	-9.9	172.2	-69.7	171.3	0	0	0	114.2	L651 V654 A684 A685 Y686 L695 L990	L651-L688 HydrophobicContact CD2-CD2 4.29Å; V654-L688 HydrophobicContact CG1-CD1 3.89Å; V654-L688 HydrophobicContact CG1-CD2 4.14Å; V654-L688 HydrophobicContact CG1-CG 3.92Å; V654-L688 HydrophobicContact CG2-CD2 4.11Å; V654-L688 HydrophobicContact CG2-CG 3.92Å; A684-L688 WeakPolarHBondContact O-CG 3.31Å; A684-L688 PolarHBondContact O-N 3.42Å; A685-L688 CarbonylContact O-C 3.3Å; A685-L688 PolarHBondContact O-N 2.97Å; Y686-L688 VanDerWaalsContact C-N 3.28Å; Y686-L688 PolarHBondContact O-N 2.97Å; L688-L695 HydrophobicContact CD1-CD1 3.85Å; L688-L990 HydrophobicContact CD2-CD2 4.15Å
689	H	86.6	Confident	87.8	Confident	74 Å²	74	42.3 Å²	42.3	34%	0.343	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	50.3	-166	-73.7	-112	0	0	0	112.9	R650 A685 Y686 L687 V995	R650-H689 PolarHBondContact NH2-CD2 2.83Å; R650-H689 PolarHBondContact NH2-NE2 2.92Å; A685-H689 PolarHBondContact O-N 3.24Å; A685-H689 VanDerWaalsContact O-N 3.07Å; Y686-H689 PolarHBondContact O-CD2 2.76Å; Y686-H689 VanDerWaalsContact O-CD2 3.29Å; Y686-H689 PolarHBondContact O-N 3.22Å; L687-H689 VanDerWaalsContact C-N 3.31Å; H689-V995 HydrophobicContact CB-CG2 4.15Å; H689-V995 WeakPolarHBondContact CD2-CG2 2.94Å; H689-V995 VanDerWaalsContact CG-CG2 3.48Å; H689-V995 WeakPolarHBondContact NE2-CG2 3.48Å
690	C	85.4	Confident	87.2	Confident	19 Å²	19	38.7 Å²	38.7	13%	0.128	19%	0.192	C	C	.	.			trans	-123.1	161	168.4	66.2	0	0	0	0	111.4	A685 T694 F989	A685-C690 CarbonylContact C-O 3.59Å; A685-C690 PolarHBondContact O-N 3.42Å; C690-T694 HydrophobicContact CB-CG2 4.23Å; C690-F989 HydrophobicContact CB-CE1 3.78Å; C690-F989 HydrophobicContact CB-CE2 4.37Å; C690-F989 HydrophobicContact CB-CZ 3.44Å; C690-F989 VanDerWaalsContact CB-CZ 3.44Å
691	S	87.8	Confident	86.2	Confident	56 Å²	56	41 Å²	41	39%	0.392	20%	0.203	S	C	.	.			trans	-71.9	152.5	164.4	72.8	0	0	0	0	109.9	D693 T694 L695	S691-D693 PolarHBondContact O-N 2.79Å; S691-T694 WeakPolarHBondContact O-CB 3.48Å; S691-T694 PolarHBondContact O-N 3.22Å; S691-T694 VanDerWaalsContact O-N 3.09Å; S691-T694 WeakPolarHBondContact OG-CB 3.42Å; S691-T694 PolarHBondContact OG-N 2.95Å; S691-T694 VanDerWaalsContact OG-N 3.16Å; S691-T694 PolarHBondContact OG-OG1 2.98Å; S691-L695 PolarHBondContact O-N 2.82Å
692	L	87	Confident	84.6	Confident	15 Å²	15	43.3 Å²	43.3	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-33.7	176.7	179.3	58.5	0	0	0	111.9	F675 Y678 A681 Q682 A685 T694 L695 N696	F675-L692 HydrophobicContact CD2-CD1 4.34Å; F675-L692 HydrophobicContact CE2-CD1 4.25Å; Y678-L692 HydrophobicContact CD2-CD2 3.68Å; Y678-L692 HydrophobicContact CE1-CD2 4.23Å; Y678-L692 HydrophobicContact CE2-CD2 3.24Å; Y678-L692 HydrophobicContact CG-CD2 4.33Å; A681-L692 HydrophobicContact CB-CD1 3.65Å; Q682-L692 HydrophobicContact CG-CD2 3.86Å; A685-L692 HydrophobicContact CB-CB 4.38Å; A685-L692 HydrophobicContact CB-CD1 4.48Å; L692-T694 VanDerWaalsContact C-N 3.34Å; L692-L695 HydrophobicContact CD1-CD2 4.34Å; L692-L695 WeakPolarHBondContact O-CB 3.5Å; L692-L695 PolarHBondContact O-N 3.37Å; L692-N696 WeakPolarHBondContact O-CB 3.27Å; L692-N696 PolarHBondContact O-N 3.25Å; L692-N696 PolarHBondContact O-ND2 3.16Å
693	D	85.1	Confident	82.4	Confident	112 Å²	112	43.3 Å²	43.3	60%	0.599	22%	0.224	S	C	*	.	H	α-helix	trans	-65.6	-39.1	175.9	-46.5	-62	0	0	0	111.4	S691 L695 N696 E697	S691-D693 PolarHBondContact O-N 2.79Å; D693-L695 VanDerWaalsContact C-N 3.32Å; D693-L695 PolarHBondContact O-N 3.37Å; D693-N696 PolarHBondContact O-N 3.12Å; D693-E697 WeakPolarHBondContact O-CG 3.3Å; D693-E697 PolarHBondContact O-N 3.01Å
694	T	84.4	Confident	80	Confident	48 Å²	48	46.4 Å²	46.4	29%	0.294	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-41.2	172.5	-55.4	0	0	0	0	110.9	C690 S691 L692 E697 L698 F989	C690-T694 HydrophobicContact CB-CG2 4.23Å; S691-T694 WeakPolarHBondContact O-CB 3.48Å; S691-T694 PolarHBondContact O-N 3.22Å; S691-T694 VanDerWaalsContact O-N 3.09Å; S691-T694 WeakPolarHBondContact OG-CB 3.42Å; S691-T694 PolarHBondContact OG-N 2.95Å; S691-T694 VanDerWaalsContact OG-N 3.16Å; S691-T694 PolarHBondContact OG-OG1 2.98Å; L692-T694 VanDerWaalsContact C-N 3.34Å; T694-E697 PolarHBondContact O-N 3.46Å; T694-L698 HydrophobicContact CG2-CD1 4.1Å; T694-L698 WeakPolarHBondContact O-CB 3.37Å; T694-L698 VanDerWaalsContact O-CG 3.25Å; T694-L698 WeakPolarHBondContact O-CG 3.34Å; T694-L698 PolarHBondContact O-N 3.1Å; T694-F989 HydrophobicContact CG2-CD2 4.46Å; T694-F989 HydrophobicContact CG2-CE2 3.95Å; T694-F989 HydrophobicContact CG2-CZ 4.45Å
695	L	86.7	Confident	77.3	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.7	-42.8	176.4	-172.7	59.5	0	0	0	111.8	L658 A684 A685 L688 S691 L692 D693 L698 I699 F738	L658-L695 HydrophobicContact CD2-CD2 4.36Å; A684-L695 HydrophobicContact CB-CD2 4.15Å; A685-L695 HydrophobicContact CB-CB 4.39Å; A685-L695 HydrophobicContact CB-CD2 3.84Å; L688-L695 HydrophobicContact CD1-CD1 3.85Å; S691-L695 PolarHBondContact O-N 2.82Å; L692-L695 HydrophobicContact CD1-CD2 4.34Å; L692-L695 WeakPolarHBondContact O-CB 3.5Å; L692-L695 PolarHBondContact O-N 3.37Å; D693-L695 VanDerWaalsContact C-N 3.32Å; D693-L695 PolarHBondContact O-N 3.37Å; L695-L698 PolarHBondContact O-N 2.79Å; L695-I699 HydrophobicContact CD1-CD1 3.65Å; L695-I699 HydrophobicContact CD1-CG1 4.36Å; L695-I699 HydrophobicContact CG-CD1 3.92Å; L695-I699 WeakPolarHBondContact O-CB 3.18Å; L695-I699 WeakPolarHBondContact O-CG1 3.18Å; L695-I699 PolarHBondContact O-N 3.47Å; L695-F738 HydrophobicContact CD1-CE1 4.45Å; L695-F738 HydrophobicContact CD1-CZ 4.24Å
696	N	85.4	Confident	74.3	Confident	36 Å²	36	65.5 Å²	65.5	19%	0.193	32%	0.32	C	S	.	.	H	α-helix	trans	-61.2	-43.5	173.4	-76.7	-33.7	0	0	0	111.7	F675 L692 D693 I699 F700	F675-N696 VanDerWaalsContact CD2-OD1 3.24Å; F675-N696 WeakPolarHBondContact CD2-OD1 3.32Å; F675-N696 WeakPolarHBondContact CE2-OD1 3.34Å; L692-N696 WeakPolarHBondContact O-CB 3.27Å; L692-N696 PolarHBondContact O-N 3.25Å; L692-N696 PolarHBondContact O-ND2 3.16Å; D693-N696 PolarHBondContact O-N 3.12Å; N696-I699 PolarHBondContact O-N 3.43Å; N696-F700 HydrophobicContact CB-CD2 4.47Å; N696-F700 WeakPolarHBondContact O-CB 3.46Å; N696-F700 PolarHBondContact O-N 2.86Å
697	E	80.7	Confident	71.4	Confident	111 Å²	111	64.5 Å²	64.5	52%	0.519	33%	0.331	S	S	.	.	H	α-helix	trans	-65.3	-40.7	177	-77.3	-146.6	138.1	0	0	112.9	D693 T694 N701 P702	D693-E697 WeakPolarHBondContact O-CG 3.3Å; D693-E697 PolarHBondContact O-N 3.01Å; T694-E697 PolarHBondContact O-N 3.46Å; E697-N701 PolarHBondContact O-N 3.03Å; E697-P702 WeakPolarHBondContact O-CD 3.49Å
698	L	79.5	Confident	68.4	Low	27 Å²	27	70.6 Å²	70.6	14%	0.141	37%	0.368	C	S	.	.	H	α-helix	trans	-65	-38	177.5	-75.6	169.5	0	0	0	112.1	T694 L695 P702 K985 F989	T694-L698 HydrophobicContact CG2-CD1 4.1Å; T694-L698 WeakPolarHBondContact O-CB 3.37Å; T694-L698 VanDerWaalsContact O-CG 3.25Å; T694-L698 WeakPolarHBondContact O-CG 3.34Å; T694-L698 PolarHBondContact O-N 3.1Å; L695-L698 PolarHBondContact O-N 2.79Å; L698-P702 VanDerWaalsContact O-CG 3.31Å; L698-P702 WeakPolarHBondContact O-CG 3.36Å; L698-K985 HydrophobicContact CD2-CB 4.06Å; L698-F989 HydrophobicContact CD1-CG 4.44Å
699	I	79.9	Confident	65.8	Low	0 Å²	0	76.4 Å²	76.4	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-88.9	-51.2	-175.3	-66.3	171.5	0	0	0	112	L658 F675 L695 N696 L735 F738 R978	L658-I699 HydrophobicContact CD2-CD1 4.18Å; F675-I699 HydrophobicContact CZ-CD1 3.8Å; L695-I699 HydrophobicContact CD1-CD1 3.65Å; L695-I699 HydrophobicContact CD1-CG1 4.36Å; L695-I699 HydrophobicContact CG-CD1 3.92Å; L695-I699 WeakPolarHBondContact O-CB 3.18Å; L695-I699 WeakPolarHBondContact O-CG1 3.18Å; L695-I699 PolarHBondContact O-N 3.47Å; N696-I699 PolarHBondContact O-N 3.43Å; I699-L735 HydrophobicContact CD1-CD1 4.32Å; I699-L735 HydrophobicContact CG2-CB 4.44Å; I699-L735 HydrophobicContact CG2-CD1 4.36Å; I699-F738 HydrophobicContact CD1-CD1 3.79Å; I699-F738 HydrophobicContact CD1-CE1 3.96Å; I699-F738 HydrophobicContact CD1-CG 4.11Å; I699-F738 HydrophobicContact CD1-CZ 4.39Å; I699-F738 HydrophobicContact CG1-CB 4.08Å; I699-F738 HydrophobicContact CG1-CD1 3.85Å; I699-F738 HydrophobicContact CG1-CD2 3.76Å; I699-F738 HydrophobicContact CG1-CE1 4.19Å; I699-F738 HydrophobicContact CG1-CE2 4.1Å; I699-F738 HydrophobicContact CG1-CG 3.62Å; I699-F738 HydrophobicContact CG1-CZ 4.31Å; I699-R978 PolarHBondContact O-NH1 3.02Å
700	F	78.6	Confident	63.1	Low	14 Å²	14	80 Å²	80	6%	0.061	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-45.8	-168.4	-60.8	-63.1	0	0	0	113.7	L673 F675 N696 P702 A731 C734	L673-F700 HydrophobicContact CB-CB 4.1Å; L673-F700 HydrophobicContact CB-CD1 3.89Å; L673-F700 HydrophobicContact CB-CG 3.98Å; L673-F700 HydrophobicContact CD1-CD1 4.3Å; F675-F700 HydrophobicContact CD1-CZ 4.42Å; F675-F700 HydrophobicContact CD2-CE2 4.05Å; F675-F700 HydrophobicContact CE1-CE2 4.37Å; F675-F700 HydrophobicContact CE1-CZ 4.27Å; F675-F700 AromaticContact CE2-CE2 3.85Å; F675-F700 HydrophobicContact CE2-CE2 3.85Å; F675-F700 HydrophobicContact CG-CE2 4.42Å; F675-F700 HydrophobicContact CZ-CE2 4.03Å; F675-F700 HydrophobicContact CZ-CZ 4.34Å; N696-F700 HydrophobicContact CB-CD2 4.47Å; N696-F700 WeakPolarHBondContact O-CB 3.46Å; N696-F700 PolarHBondContact O-N 2.86Å; F700-P702 VanDerWaalsContact O-CD 3.24Å; F700-P702 WeakPolarHBondContact O-CD 3.42Å; F700-A731 HydrophobicContact CD1-CB 4.35Å; F700-A731 HydrophobicContact CE1-CB 3.9Å; F700-C734 HydrophobicContact CD1-CB 3.8Å; F700-C734 HydrophobicContact CE1-CB 4.15Å
701	N	70.4	Confident	60.4	Low	55 Å²	55	87.5 Å²	87.5	29%	0.294	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-74.1	-2.3	-174	-75.6	-20.9	0	0	0	119.8	E697 V703	E697-N701 PolarHBondContact O-N 3.03Å; N701-V703 PolarHBondContact O-N 3.16Å
702	P	56.9	Low	57.7	Low	49 Å²	49	93.7 Å²	93.7	32%	0.318	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-59.3	-9.8	-176.8	-29.4	37	0	0	0	118.4	E697 L698 F700	E697-P702 WeakPolarHBondContact O-CD 3.49Å; L698-P702 VanDerWaalsContact O-CG 3.31Å; L698-P702 WeakPolarHBondContact O-CG 3.36Å; F700-P702 VanDerWaalsContact O-CD 3.24Å; F700-P702 WeakPolarHBondContact O-CD 3.42Å
703	V	47.3	Very low	54.9	Low	75 Å²	75	101.5 Å²	101.5	46%	0.455	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-113.5	-13.9	-166.8	-176.2	0	0	0	0	114.3	N701 R705	N701-V703 PolarHBondContact O-N 3.16Å; V703-R705 PolarHBondContact O-N 3.32Å
704	L	44.1	Very low	52.3	Low	136 Å²	136	105.1 Å²	105.1	71%	0.712	53%	0.53	S	S	*	.	S	Bend	trans	-80.1	-10.6	-173.7	-79	171.5	0	0	0	115.6
705	R	35.5	Very low	49.7	Very low	222 Å²	222	110.9 Å²	110.9	84%	0.838	55%	0.553	S	S	*	*			trans	-106.4	106	178.4	-68.5	-176	-176.9	150.3	7.4	111.6	V703	V703-R705 PolarHBondContact O-N 3.32Å
706	K	30.1	Very low	46.9	Very low	182 Å²	182	118 Å²	118	79%	0.791	59%	0.591	S	S	*	*			trans	-56.1	145.5	157.1	-71.3	-178	178.5	178	0	108.9	T708	K706-T708 PolarHBondContact O-N 3.07Å
707	P	29.9	Very low	44.2	Very low	117 Å²	117	122.7 Å²	122.7	76%	0.76	62%	0.616	S	S	*	*			trans	-71.1	92.7	179	28.8	-34.4	0	0	0	111	T709	P707-T709 PolarHBondContact O-N 2.82Å
708	T	27.7	Very low	41.7	Very low	130 Å²	130	126.4 Å²	126.4	80%	0.798	63%	0.633	S	S	*	*			trans	-79.6	64.1	176.6	54	0	0	0	0	111.7	K706	K706-T708 PolarHBondContact O-N 3.07Å
709	T	33.8	Very low	39.2	Very low	126 Å²	126	131.7 Å²	131.7	77%	0.773	66%	0.661	S	S	*	*			trans	-95.1	105.1	165	50.2	0	0	0	0	109.1	P707 H711	P707-T709 PolarHBondContact O-N 2.82Å; T709-H711 PolarHBondContact O-N 3.12Å
710	N	28.3	Very low	36.7	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	69%	0.694	S	S	*	*			trans	-58.9	119.2	177	-71.5	-34.1	0	0	0	111
711	H	29.7	Very low	34.3	Very low	176 Å²	176	144.6 Å²	144.6	82%	0.815	73%	0.731	S	S	*	*			trans	-174.9	78.8	142.3	-91	-46.6	0	0	0	111.7	T709	T709-H711 PolarHBondContact O-N 3.12Å
712	H	30.3	Very low	32.5	Very low	186 Å²	186	149.5 Å²	149.5	86%	0.861	76%	0.757	S	S	*	*				176.8	145.2	115.8	-95.6	77	0	0	0	110.4
713	H	28.5	Very low	31.2	Very low	179 Å²	179	155.3 Å²	155.3	83%	0.829	79%	0.786	S	S	*	*			trans	-72.7	130.6	175.7	-77.4	-83.1	0	0	0	111.3
714	H	31	Very low	30.4	Very low	188 Å²	188	160.3 Å²	160.3	87%	0.87	80%	0.804	S	S	*	*			trans	-148.1	130.3	134.4	-114.8	-79.3	0	0	0	110.3
715	H	29.2	Very low	29.8	Very low	169 Å²	169	161.8 Å²	161.8	78%	0.782	81%	0.813	S	S	*	*			trans	-62.1	145.6	164	-93.2	-103.1	0	0	0	109.7
716	L	28	Very low	30	Very low	151 Å²	151	157 Å²	157	79%	0.791	81%	0.812	S	S	*	*				-170.6	140.6	112.2	-99.7	163.1	0	0	0	112.7
717	N	28.4	Very low	30.9	Very low	134 Å²	134	151.2 Å²	151.2	72%	0.717	79%	0.789	S	S	*	*			trans	8.7	121.9	167.8	-61.5	-1.9	0	0	0	120.3	N719	N717-N719 PolarHBondContact O-N 3Å
718	E	28.6	Very low	31.9	Very low	188 Å²	188	154.6 Å²	154.6	88%	0.879	79%	0.792	S	S	*	*			trans	-60.6	122.3	140.9	-59.7	174.2	132	0	0	109.3
719	N	26.7	Very low	33.3	Very low	139 Å²	139	151 Å²	151	74%	0.743	76%	0.764	S	S	*	*			trans	-176	143	149.9	-103.3	-63.2	0	0	0	111.1	N717	N717-N719 PolarHBondContact O-N 3Å
720	N	27.3	Very low	34.9	Very low	129 Å²	129	147.6 Å²	147.6	69%	0.69	74%	0.742	S	S	*	*	S	Bend	trans	68.7	102	168	-55.6	-33.5	0	0	0	119.5	D722	N720-D722 PolarHBondContact O-N 3.26Å
721	N	29.2	Very low	37.2	Very low	155 Å²	155	140.4 Å²	140.4	83%	0.829	70%	0.704	S	S	*	*				60.3	44.6	124.3	-60.2	-1.6	0	0	0	121.8
722	D	32.3	Very low	39.7	Very low	159 Å²	159	134.6 Å²	134.6	85%	0.85	68%	0.676	S	S	*	*			trans	-122.3	32.8	162.1	-91.4	-43.5	0	0	0	113.3	N720 Q724	N720-D722 PolarHBondContact O-N 3.26Å; D722-Q724 PolarHBondContact O-N 3.49Å
723	N	28.7	Very low	41.9	Very low	171 Å²	171	128.5 Å²	128.5	91%	0.914	65%	0.646	S	S	*	*			trans	-77.3	28.5	-177.7	-107.7	-4	0	0	0	114.6
724	Q	31.3	Very low	44.3	Very low	180 Å²	180	120 Å²	120	84%	0.841	61%	0.607	S	S	*	*			trans	-141.6	67.6	-176.8	-71.7	-171.8	-31.9	0	0	112.7	D722	D722-Q724 PolarHBondContact O-N 3.49Å
725	N	32.5	Very low	46.8	Very low	167 Å²	167	111.1 Å²	111.1	89%	0.893	57%	0.566	S	S	*	*			trans	-166.1	25.4	152	-101.6	-20.1	0	0	0	115
726	C	39.5	Very low	49.5	Very low	122 Å²	122	103.1 Å²	103.1	82%	0.824	53%	0.529	S	S	*	.	S	Bend	trans	-83.6	124.7	164	-166.8	0	0	0	0	108.9	K728	C726-K728 PolarHBondContact O-N 3.39Å
727	I	48.1	Very low	51.9	Low	60 Å²	60	96 Å²	96	31%	0.308	49%	0.492	S	S	.	.			trans	-60.9	111.6	-176.5	-59.3	172.6	0	0	0	109.6	W729	I727-W729 VanDerWaalsContact C-N 3.32Å; I727-W729 HydrophobicContact CD1-CZ2 4.41Å; I727-W729 HydrophobicContact CG2-CD2 4.16Å; I727-W729 HydrophobicContact CG2-CG 4.33Å; I727-W729 HydrophobicContact CG2-CZ2 3.99Å; I727-W729 PolarHBondContact O-N 3.24Å
728	K	50.9	Low	54.6	Low	188 Å²	188	89.8 Å²	89.8	82%	0.817	46%	0.458	S	S	*	.			trans	-72.4	86.2	171.4	-84.9	-165.8	170.8	-169.3	0	110.1	C726 T730	C726-K728 PolarHBondContact O-N 3.39Å; K728-T730 PolarHBondContact O-N 2.86Å
729	W	57	Low	57.4	Low	55 Å²	55	80.8 Å²	80.8	21%	0.208	42%	0.417	C	S	.	.			trans	-61.3	112.2	170.8	-68.4	94.7	0	0	0	110.5	I727 H977	I727-W729 VanDerWaalsContact C-N 3.32Å; I727-W729 HydrophobicContact CD1-CZ2 4.41Å; I727-W729 HydrophobicContact CG2-CD2 4.16Å; I727-W729 HydrophobicContact CG2-CG 4.33Å; I727-W729 HydrophobicContact CG2-CZ2 3.99Å; I727-W729 PolarHBondContact O-N 3.24Å; W729-H977 HydrophobicContact CH2-CB 3.53Å; W729-H977 AromaticContact CH2-CD2 3.49Å; W729-H977 VanDerWaalsContact CH2-CD2 3.49Å; W729-H977 WeakPolarHBondContact CH2-CD2 3.39Å; W729-H977 AromaticContact CH2-CG 3.57Å; W729-H977 HydrophobicContact CZ2-CB 3.51Å; W729-H977 AromaticContact CZ2-CD2 3.71Å; W729-H977 AromaticContact CZ2-CG 3.44Å; W729-H977 VanDerWaalsContact CZ2-CG 3.44Å; W729-H977 HydrophobicContact CZ3-CB 4.45Å
730	T	68.1	Low	60.3	Low	53 Å²	53	74.4 Å²	74.4	33%	0.325	38%	0.382	S	S	.	.			trans	-75.1	153	174.2	55.7	0	0	0	0	111.2	K728 K732 Y733 C734	K728-T730 PolarHBondContact O-N 2.86Å; T730-K732 PolarHBondContact O-N 3.09Å; T730-K732 VanDerWaalsContact O-N 3.11Å; T730-Y733 PolarHBondContact O-N 3.22Å; T730-Y733 WeakPolarHBondContact OG1-CD2 3.43Å; T730-C734 PolarHBondContact O-N 3.01Å; T730-C734 PolarHBondContact O-SG 2.86Å; T730-C734 VanDerWaalsContact O-SG 3.34Å
731	A	76.4	Confident	62.8	Low	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-56.1	-31.2	-179.2	0	0	0	0	0	112.8	Y663 C664 L673 F700 Y733 C734 L735	Y663-A731 HydrophobicContact CD2-CB 4.13Å; Y663-A731 HydrophobicContact CG-CB 4.31Å; C664-A731 WeakPolarHBondContact O-CB 3.46Å; L673-A731 HydrophobicContact CB-CB 4.37Å; L673-A731 HydrophobicContact CD1-CB 4.18Å; L673-A731 HydrophobicContact CD2-CB 4.41Å; F700-A731 HydrophobicContact CD1-CB 4.35Å; F700-A731 HydrophobicContact CE1-CB 3.9Å; A731-Y733 PolarHBondContact O-N 3.19Å; A731-C734 WeakPolarHBondContact O-CB 3.42Å; A731-C734 PolarHBondContact O-N 3.27Å; A731-L735 PolarHBondContact O-N 3Å
732	K	81.7	Confident	65.6	Low	53 Å²	53	61 Å²	61	23%	0.23	31%	0.31	C	S	.	.	H	α-helix	trans	-47.7	-61.2	170	-170.2	-173	-175.8	-158.8	0	111.8	D571 Y663 T730 C734 L735 H736	D571-K732 IonicContact OD1-NZ 2.68Å; D571-K732 PolarHBondContact OD1-NZ 3.44Å; Y663-K732 HydrophobicContact CD1-CB 4.25Å; Y663-K732 HydrophobicContact CD1-CG 4.41Å; Y663-K732 HydrophobicContact CD2-CB 4.21Å; Y663-K732 HydrophobicContact CE1-CB 3.76Å; Y663-K732 HydrophobicContact CE1-CD 4.49Å; Y663-K732 HydrophobicContact CE1-CG 3.65Å; Y663-K732 HydrophobicContact CE2-CB 3.77Å; Y663-K732 HydrophobicContact CE2-CG 4.44Å; Y663-K732 HydrophobicContact CG-CB 4.47Å; T730-K732 PolarHBondContact O-N 3.09Å; T730-K732 VanDerWaalsContact O-N 3.11Å; K732-C734 VanDerWaalsContact C-N 3.25Å; K732-C734 PolarHBondContact O-N 3.37Å; K732-L735 PolarHBondContact O-N 2.84Å; K732-H736 WeakPolarHBondContact CE-CE1 3.47Å; K732-H736 WeakPolarHBondContact CE-NE2 3.01Å; K732-H736 VanDerWaalsContact O-CB 3.3Å; K732-H736 WeakPolarHBondContact O-CB 3.42Å; K732-H736 PolarHBondContact O-CD2 3.33Å; K732-H736 VanDerWaalsContact O-CG 3.3Å; K732-H736 PolarHBondContact O-N 2.99Å
733	Y	76.4	Confident	68.4	Low	59 Å²	59	53.4 Å²	53.4	23%	0.231	27%	0.27	C	S	.	.	H	α-helix	trans	-67.5	-29.1	-174.2	-61.2	-57.6	0	0	0	112.2	T730 A731 A737 T974	T730-Y733 PolarHBondContact O-N 3.22Å; T730-Y733 WeakPolarHBondContact OG1-CD2 3.43Å; A731-Y733 PolarHBondContact O-N 3.19Å; Y733-A737 WeakPolarHBondContact O-CB 3.38Å; Y733-A737 PolarHBondContact O-N 3.18Å; Y733-A737 VanDerWaalsContact O-N 3.14Å; Y733-T974 HydrophobicContact CD1-CG2 4.01Å; Y733-T974 WeakPolarHBondContact CD1-OG1 3.25Å
734	C	78.5	Confident	71.1	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-51.8	174.4	-58.2	0	0	0	0	111.7	F700 T730 A731 K732 F738 R978	F700-C734 HydrophobicContact CD1-CB 3.8Å; F700-C734 HydrophobicContact CE1-CB 4.15Å; T730-C734 PolarHBondContact O-N 3.01Å; T730-C734 PolarHBondContact O-SG 2.86Å; T730-C734 VanDerWaalsContact O-SG 3.34Å; A731-C734 WeakPolarHBondContact O-CB 3.42Å; A731-C734 PolarHBondContact O-N 3.27Å; K732-C734 VanDerWaalsContact C-N 3.25Å; K732-C734 PolarHBondContact O-N 3.37Å; C734-F738 PolarHBondContact O-N 3.09Å; C734-R978 PolarHBondContact SG-NH2 3.22Å
735	L	85	Confident	73.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-67.3	-44.8	177.5	-179.4	62.5	0	0	0	111.7	F608 L658 G662 Y663 F675 I699 A731 K732 A737 F738 V739	F608-L735 HydrophobicContact CZ-CD2 4.15Å; F608-L735 HydrophobicContact CZ-CG 4.24Å; L658-L735 HydrophobicContact CB-CD1 4.39Å; L658-L735 HydrophobicContact CD2-CD1 4.19Å; G662-L735 WeakPolarHBondContact O-CD2 3.38Å; Y663-L735 HydrophobicContact CD1-CD2 4.38Å; F675-L735 HydrophobicContact CE1-CD1 3.97Å; I699-L735 HydrophobicContact CD1-CD1 4.32Å; I699-L735 HydrophobicContact CG2-CB 4.44Å; I699-L735 HydrophobicContact CG2-CD1 4.36Å; A731-L735 PolarHBondContact O-N 3Å; K732-L735 PolarHBondContact O-N 2.84Å; L735-A737 PolarHBondContact O-N 2.98Å; L735-F738 PolarHBondContact O-N 3.12Å; L735-V739 HydrophobicContact CD1-CG2 4.03Å; L735-V739 HydrophobicContact CG-CG2 4.37Å; L735-V739 WeakPolarHBondContact O-CG2 3.39Å; L735-V739 PolarHBondContact O-N 3.3Å
736	H	85	Confident	76.6	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-59.1	-46.8	-177	-80	-133.3	0	0	0	111.7	T570 D571 F608 K732 F738 V739 Q740	T570-H736 WeakPolarHBondContact CB-ND1 3.07Å; T570-H736 HydrophobicContact CG2-CB 4.39Å; T570-H736 PolarHBondContact O-CE1 3.41Å; T570-H736 PolarHBondContact OG1-ND1 3.12Å; D571-H736 VanDerWaalsContact CG-ND1 3.35Å; D571-H736 IonicContact OD1-CE1 2.69Å; D571-H736 PolarHBondContact OD1-CE1 3.21Å; D571-H736 IonicContact OD1-ND1 3.59Å; D571-H736 PolarHBondContact OD1-ND1 3.41Å; D571-H736 IonicContact OD2-CE1 3.33Å; D571-H736 PolarHBondContact OD2-CE1 3.46Å; D571-H736 IonicContact OD2-CG 3.69Å; D571-H736 IonicContact OD2-ND1 3.2Å; D571-H736 PolarHBondContact OD2-ND1 3.26Å; F608-H736 AromaticContact CE1-NE2 3.88Å; K732-H736 WeakPolarHBondContact CE-CE1 3.47Å; K732-H736 WeakPolarHBondContact CE-NE2 3.01Å; K732-H736 VanDerWaalsContact O-CB 3.3Å; K732-H736 WeakPolarHBondContact O-CB 3.42Å; K732-H736 PolarHBondContact O-CD2 3.33Å; K732-H736 VanDerWaalsContact O-CG 3.3Å; K732-H736 PolarHBondContact O-N 2.99Å; H736-F738 PolarHBondContact O-N 3.07Å; H736-V739 PolarHBondContact O-N 3.44Å; H736-Q740 WeakPolarHBondContact O-CB 3.31Å; H736-Q740 WeakPolarHBondContact O-CG 3.46Å; H736-Q740 PolarHBondContact O-N 3.35Å
737	A	78.1	Confident	79.1	Confident	2 Å²	2	24.5 Å²	24.5	2%	0.017	11%	0.113	C	C	.	.	H	α-helix	trans	-62.1	-40.4	177.8	0	0	0	0	0	113	Y733 L735 Q740 D741 R978	Y733-A737 WeakPolarHBondContact O-CB 3.38Å; Y733-A737 PolarHBondContact O-N 3.18Å; Y733-A737 VanDerWaalsContact O-N 3.14Å; L735-A737 PolarHBondContact O-N 2.98Å; A737-Q740 PolarHBondContact O-N 3.14Å; A737-D741 PolarHBondContact O-N 3.41Å; A737-R978 HydrophobicContact CB-CB 3.72Å; A737-R978 HydrophobicContact CB-CG 4.4Å
738	F	84.4	Confident	80.9	Confident	3 Å²	3	24 Å²	24	1%	0.013	11%	0.111	C	C	.	.	H	α-helix	trans	-64.4	-43.3	178.1	179.9	-91.7	0	0	0	112.2	L658 L695 I699 C734 L735 H736 D741 L742 L986	L658-F738 HydrophobicContact CD1-CD1 4.1Å; L658-F738 HydrophobicContact CD1-CE1 3.9Å; L695-F738 HydrophobicContact CD1-CE1 4.45Å; L695-F738 HydrophobicContact CD1-CZ 4.24Å; I699-F738 HydrophobicContact CD1-CD1 3.79Å; I699-F738 HydrophobicContact CD1-CE1 3.96Å; I699-F738 HydrophobicContact CD1-CG 4.11Å; I699-F738 HydrophobicContact CD1-CZ 4.39Å; I699-F738 HydrophobicContact CG1-CB 4.08Å; I699-F738 HydrophobicContact CG1-CD1 3.85Å; I699-F738 HydrophobicContact CG1-CD2 3.76Å; I699-F738 HydrophobicContact CG1-CE1 4.19Å; I699-F738 HydrophobicContact CG1-CE2 4.1Å; I699-F738 HydrophobicContact CG1-CG 3.62Å; I699-F738 HydrophobicContact CG1-CZ 4.31Å; C734-F738 PolarHBondContact O-N 3.09Å; L735-F738 PolarHBondContact O-N 3.12Å; H736-F738 PolarHBondContact O-N 3.07Å; F738-D741 PolarHBondContact O-N 3.23Å; F738-L742 HydrophobicContact CE1-CD2 4.34Å; F738-L742 WeakPolarHBondContact O-CB 3.46Å; F738-L742 PolarHBondContact O-N 3.43Å; F738-L986 HydrophobicContact CE2-CD1 4.04Å; F738-L986 HydrophobicContact CE2-CD2 4Å; F738-L986 HydrophobicContact CE2-CG 4.42Å; F738-L986 HydrophobicContact CZ-CD1 3.92Å; F738-L986 HydrophobicContact CZ-CD2 4.06Å
739	V	89	Confident	82.7	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-70	-36.2	179.7	178.2	0	0	0	0	111.4	V569 T570 F608 I655 L658 L735 H736 L742 Y743	V569-V739 HydrophobicContact CG1-CG1 4.04Å; T570-V739 HydrophobicContact CG2-CB 3.81Å; T570-V739 HydrophobicContact CG2-CG1 3.78Å; F608-V739 HydrophobicContact CD2-CG1 4.27Å; F608-V739 HydrophobicContact CE2-CB 4.32Å; F608-V739 HydrophobicContact CE2-CG1 3.85Å; F608-V739 HydrophobicContact CE2-CG2 3.85Å; F608-V739 HydrophobicContact CZ-CB 4.37Å; F608-V739 HydrophobicContact CZ-CG1 4.3Å; F608-V739 HydrophobicContact CZ-CG2 3.94Å; I655-V739 HydrophobicContact CG1-CG1 4.23Å; I655-V739 HydrophobicContact CG2-CG1 3.8Å; L658-V739 HydrophobicContact CB-CG2 4.21Å; L658-V739 HydrophobicContact CD1-CG2 3.94Å; L735-V739 HydrophobicContact CD1-CG2 4.03Å; L735-V739 HydrophobicContact CG-CG2 4.37Å; L735-V739 WeakPolarHBondContact O-CG2 3.39Å; L735-V739 PolarHBondContact O-N 3.3Å; H736-V739 PolarHBondContact O-N 3.44Å; V739-L742 PolarHBondContact O-N 2.84Å; V739-Y743 WeakPolarHBondContact O-CB 3.43Å; V739-Y743 PolarHBondContact O-N 2.95Å
740	Q	86.1	Confident	84.4	Confident	5 Å²	5	12.6 Å²	12.6	2%	0.023	6%	0.063	C	C	.	.	H	α-helix	trans	-63.1	-40	172.2	-70.2	171.7	22.3	0	0	112.6	R566 V569 T570 H736 A737 N744	R566-Q740 HydrophobicContact CB-CB 4.45Å; R566-Q740 HydrophobicContact CG-CB 4.35Å; V569-Q740 HydrophobicContact CG1-CG 4.11Å; T570-Q740 HydrophobicContact CG2-CG 4.16Å; T570-Q740 PolarHBondContact OG1-NE2 3.26Å; H736-Q740 WeakPolarHBondContact O-CB 3.31Å; H736-Q740 WeakPolarHBondContact O-CG 3.46Å; H736-Q740 PolarHBondContact O-N 3.35Å; A737-Q740 PolarHBondContact O-N 3.14Å; Q740-N744 WeakPolarHBondContact O-CB 3.31Å; Q740-N744 PolarHBondContact O-N 3.43Å; Q740-N744 VanDerWaalsContact O-N 3.1Å
741	D	80.6	Confident	85.5	Confident	1 Å²	1	10.5 Å²	10.5	1%	0.005	5%	0.049	C	C	.	.	H	α-helix	trans	-67.1	-46.5	174.7	-76	-13.1	0	0	0	111.9	R566 A737 F738 Y743 N744 M745 S979 S982 L983	R566-D741 IonicContact CZ-OD1 2.66Å; R566-D741 IonicContact NH1-OD1 2.85Å; R566-D741 PolarHBondContact NH1-OD1 3.4Å; A737-D741 PolarHBondContact O-N 3.41Å; F738-D741 PolarHBondContact O-N 3.23Å; D741-Y743 PolarHBondContact O-N 2.68Å; D741-N744 PolarHBondContact O-N 3.02Å; D741-M745 PolarHBondContact O-N 3.12Å; D741-S979 VanDerWaalsContact OD1-CA 3.29Å; D741-S979 WeakPolarHBondContact OD1-CA 3.46Å; D741-S979 WeakPolarHBondContact OD1-CB 3.35Å; D741-S979 WeakPolarHBondContact OD2-CA 3.33Å; D741-S982 VanDerWaalsContact OD2-CB 3.28Å; D741-S982 WeakPolarHBondContact OD2-CB 3.42Å; D741-S982 PolarHBondContact OD2-OG 2.77Å; D741-L983 HydrophobicContact CB-CB 4.08Å; D741-L983 HydrophobicContact CB-CD1 4.2Å; D741-L983 PolarHBondContact OD2-N 3.21Å; D741-L983 VanDerWaalsContact OD2-N 3.15Å
742	L	87.3	Confident	86	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-61.3	-42.4	178	176.4	59.3	0	0	0	111.4	L651 V654 I655 F738 V739 M745 I746 L986	L651-L742 HydrophobicContact CD2-CD1 4.46Å; V654-L742 HydrophobicContact CB-CD2 4.46Å; V654-L742 HydrophobicContact CG1-CD2 3.8Å; I655-L742 HydrophobicContact CD1-CD2 4.35Å; I655-L742 HydrophobicContact CD1-CG 4.14Å; I655-L742 HydrophobicContact CG1-CD2 3.7Å; I655-L742 HydrophobicContact CG1-CG 4.04Å; F738-L742 HydrophobicContact CE1-CD2 4.34Å; F738-L742 WeakPolarHBondContact O-CB 3.46Å; F738-L742 PolarHBondContact O-N 3.43Å; V739-L742 PolarHBondContact O-N 2.84Å; L742-M745 WeakPolarHBondContact O-CB 3.24Å; L742-M745 PolarHBondContact O-N 2.88Å; L742-I746 HydrophobicContact CG-CD1 4.49Å; L742-I746 WeakPolarHBondContact O-CG1 3.49Å; L742-I746 PolarHBondContact O-N 3.3Å; L742-L986 HydrophobicContact CB-CD2 4.17Å; L742-L986 HydrophobicContact CD1-CD2 4.17Å
743	Y	92	Very high	86.4	Confident	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-67.3	-37.4	176.5	-165.5	-118.9	0	0	0	112.6	F513 F564 V569 F579 I581 F582 L652 I655 V739 D741 M745 I746 V747	F513-Y743 HydrophobicContact CD1-CE2 4.48Å; F513-Y743 PolarHBondContact O-OH 3.41Å; F564-Y743 HydrophobicContact CE1-CD1 4.02Å; F564-Y743 HydrophobicContact CE1-CE1 4.11Å; F564-Y743 AromaticContact CZ-CD1 3.98Å; F564-Y743 HydrophobicContact CZ-CD1 3.98Å; F564-Y743 AromaticContact CZ-CE1 3.61Å; F564-Y743 HydrophobicContact CZ-CE1 3.61Å; V569-Y743 HydrophobicContact CB-CD1 3.91Å; V569-Y743 HydrophobicContact CB-CG 4.16Å; V569-Y743 HydrophobicContact CG1-CD1 4.46Å; V569-Y743 HydrophobicContact CG1-CG 4.46Å; V569-Y743 HydrophobicContact CG2-CD1 3.88Å; V569-Y743 HydrophobicContact CG2-CD2 4.1Å; V569-Y743 HydrophobicContact CG2-CE1 4.35Å; V569-Y743 HydrophobicContact CG2-CG 3.75Å; F579-Y743 VanDerWaalsContact CB-OH 3.31Å; F579-Y743 WeakPolarHBondContact CB-OH 3.45Å; F579-Y743 HydrophobicContact CD2-CD1 4.32Å; F579-Y743 AromaticContact CD2-CE1 3.39Å; F579-Y743 HydrophobicContact CD2-CE1 3.39Å; F579-Y743 AromaticContact CD2-CZ 3.87Å; F579-Y743 HydrophobicContact CE2-CD1 4.3Å; F579-Y743 AromaticContact CE2-CE1 3.63Å; F579-Y743 HydrophobicContact CE2-CE1 3.63Å; F579-Y743 AromaticContact CG-CE1 3.95Å; F579-Y743 HydrophobicContact CG-CE1 3.95Å; F579-Y743 WeakPolarHBondContact CG-OH 3.21Å; F579-Y743 HydrophobicContact CZ-CE1 4.37Å; I581-Y743 HydrophobicContact CG2-CE2 4.42Å; I581-Y743 WeakPolarHBondContact CG2-OH 3.26Å; F582-Y743 HydrophobicContact CE1-CE2 4.42Å; F582-Y743 HydrophobicContact CE2-CD2 4.38Å; F582-Y743 AromaticContact CE2-CE2 3.75Å; F582-Y743 HydrophobicContact CE2-CE2 3.75Å; F582-Y743 AromaticContact CE2-CZ 3.92Å; F582-Y743 AromaticContact CZ-CD2 3.75Å; F582-Y743 HydrophobicContact CZ-CD2 3.75Å; F582-Y743 AromaticContact CZ-CE2 3.45Å; F582-Y743 HydrophobicContact CZ-CE2 3.45Å; F582-Y743 VanDerWaalsContact CZ-CE2 3.45Å; L652-Y743 HydrophobicContact CD2-CD2 4.24Å; L652-Y743 HydrophobicContact CD2-CE2 3.86Å; I655-Y743 HydrophobicContact CD1-CD2 3.72Å; I655-Y743 HydrophobicContact CD1-CG 4.25Å; V739-Y743 WeakPolarHBondContact O-CB 3.43Å; V739-Y743 PolarHBondContact O-N 2.95Å; D741-Y743 PolarHBondContact O-N 2.68Å; Y743-M745 VanDerWaalsContact C-N 3.31Å; Y743-M745 PolarHBondContact O-N 2.85Å; Y743-I746 HydrophobicContact CD2-CD1 4.43Å; Y743-I746 PolarHBondContact O-N 3.34Å; Y743-V747 HydrophobicContact CE1-CG2 4.45Å; Y743-V747 PolarHBondContact O-N 3.07Å; Y743-V747 VanDerWaalsContact O-N 3.13Å
744	N	86.4	Confident	87.1	Confident	30 Å²	30	6.6 Å²	6.6	16%	0.16	4%	0.037	C	C	.	.	H	α-helix	trans	-61.9	-41.1	172.3	-158.9	106	0	0	0	111.3	Q740 D741 I746 V747 D748	Q740-N744 WeakPolarHBondContact O-CB 3.31Å; Q740-N744 PolarHBondContact O-N 3.43Å; Q740-N744 VanDerWaalsContact O-N 3.1Å; D741-N744 PolarHBondContact O-N 3.02Å; N744-I746 PolarHBondContact O-N 3.26Å; N744-V747 PolarHBondContact O-N 3.26Å; N744-D748 PolarHBondContact ND2-OD2 3.11Å; N744-D748 PolarHBondContact O-N 3.32Å
745	M	85.6	Confident	87.6	Confident	1 Å²	1	7 Å²	7	1%	0.005	4%	0.039	C	C	.	.	H	α-helix	trans	-60.1	-44.2	176.1	-168.4	-168.8	-60.4	0	0	111.8	D741 L742 Y743 V747 D748 I749 L983 L986 I987 L990 V1002 L1005	D741-M745 PolarHBondContact O-N 3.12Å; L742-M745 WeakPolarHBondContact O-CB 3.24Å; L742-M745 PolarHBondContact O-N 2.88Å; Y743-M745 VanDerWaalsContact C-N 3.31Å; Y743-M745 PolarHBondContact O-N 2.85Å; M745-V747 VanDerWaalsContact C-N 3.28Å; M745-V747 PolarHBondContact O-N 2.91Å; M745-D748 PolarHBondContact O-N 3.49Å; M745-I749 HydrophobicContact CG-CD1 3.88Å; M745-I749 WeakPolarHBondContact O-CB 3.31Å; M745-I749 WeakPolarHBondContact O-CD1 3.22Å; M745-I749 VanDerWaalsContact O-CG1 3.23Å; M745-I749 WeakPolarHBondContact O-CG1 3.37Å; M745-I749 PolarHBondContact O-N 3.19Å; M745-I749 HydrophobicContact SD-CD1 4.33Å; M745-L983 HydrophobicContact CB-CD1 4.15Å; M745-L983 HydrophobicContact CE-CD1 3.58Å; M745-L986 HydrophobicContact CE-CB 4.3Å; M745-L986 HydrophobicContact CE-CD2 3.78Å; M745-L986 HydrophobicContact CE-CG 3.77Å; M745-I987 HydrophobicContact CE-CD1 4.45Å; M745-I987 HydrophobicContact CE-CG1 3.52Å; M745-I987 HydrophobicContact SD-CG1 4.46Å; M745-L990 HydrophobicContact CE-CD1 4.14Å; M745-L990 HydrophobicContact SD-CD1 3.79Å; M745-V1002 HydrophobicContact SD-CG2 4.19Å; M745-L1005 HydrophobicContact CG-CD1 3.54Å; M745-L1005 HydrophobicContact SD-CD1 4.18Å
746	I	91.8	Very high	87.6	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-59.5	-40.3	176.8	-65.6	166.8	0	0	0	111.1	F513 I648 L651 L652 I655 L742 Y743 N744 I749 L750	F513-I746 HydrophobicContact CD1-CG2 4.23Å; F513-I746 HydrophobicContact CE1-CG2 3.75Å; I648-I746 HydrophobicContact CG2-CG2 3.93Å; L651-I746 HydrophobicContact CB-CD1 3.53Å; L651-I746 HydrophobicContact CB-CG1 3.68Å; L651-I746 HydrophobicContact CD1-CG1 3.99Å; L652-I746 HydrophobicContact CD2-CD1 4.05Å; L652-I746 HydrophobicContact CD2-CG2 4.39Å; L652-I746 HydrophobicContact CG-CD1 4.38Å; I655-I746 HydrophobicContact CD1-CD1 3.57Å; L742-I746 HydrophobicContact CG-CD1 4.49Å; L742-I746 WeakPolarHBondContact O-CG1 3.49Å; L742-I746 PolarHBondContact O-N 3.3Å; Y743-I746 HydrophobicContact CD2-CD1 4.43Å; Y743-I746 PolarHBondContact O-N 3.34Å; N744-I746 PolarHBondContact O-N 3.26Å; I746-I749 WeakPolarHBondContact O-CB 3.48Å; I746-I749 PolarHBondContact O-N 3.46Å; I746-L750 WeakPolarHBondContact O-CB 3.28Å; I746-L750 PolarHBondContact O-N 3.29Å
747	V	91.8	Very high	87.6	Confident	3 Å²	3	12.1 Å²	12.1	2%	0.018	6%	0.06	C	C	.	.	H	α-helix	trans	-72	-40	178.1	173.7	0	0	0	0	111.9	F513 T514 L561 F564 Y743 N744 M745 I749 L750 I751	F513-V747 HydrophobicContact CB-CG2 4.18Å; F513-V747 HydrophobicContact CD1-CG2 4.31Å; T514-V747 HydrophobicContact CG2-CG1 4.19Å; L561-V747 HydrophobicContact CD1-CG1 3.61Å; F564-V747 HydrophobicContact CE1-CB 4.04Å; F564-V747 HydrophobicContact CE1-CG1 4.2Å; F564-V747 HydrophobicContact CE1-CG2 3.7Å; F564-V747 HydrophobicContact CZ-CG2 3.84Å; Y743-V747 HydrophobicContact CE1-CG2 4.45Å; Y743-V747 PolarHBondContact O-N 3.07Å; Y743-V747 VanDerWaalsContact O-N 3.13Å; N744-V747 PolarHBondContact O-N 3.26Å; M745-V747 VanDerWaalsContact C-N 3.28Å; M745-V747 PolarHBondContact O-N 2.91Å; V747-I749 VanDerWaalsContact C-N 3.34Å; V747-I749 PolarHBondContact O-N 3.2Å; V747-L750 PolarHBondContact O-N 3.19Å; V747-I751 HydrophobicContact CG1-CD1 4.09Å; V747-I751 WeakPolarHBondContact O-CD1 3.21Å; V747-I751 VanDerWaalsContact O-CG1 3.25Å; V747-I751 WeakPolarHBondContact O-CG1 3.14Å; V747-I751 PolarHBondContact O-N 3.16Å
748	D	87	Confident	88	Confident	50 Å²	50	12 Å²	12	27%	0.267	6%	0.059	S	C	.	.	H	α-helix	trans	-61.3	-41.8	172.2	-71.5	-39.5	0	0	0	111.5	N744 M745 I751 S752 L1005	N744-D748 PolarHBondContact ND2-OD2 3.11Å; N744-D748 PolarHBondContact O-N 3.32Å; M745-D748 PolarHBondContact O-N 3.49Å; D748-I751 PolarHBondContact O-N 3.12Å; D748-S752 PolarHBondContact O-N 2.94Å; D748-L1005 HydrophobicContact CB-CD2 3.53Å
749	I	88.4	Confident	87.7	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-58.4	-49.3	174	-76.2	159	0	0	0	110.9	I648 L651 M745 I746 V747 I751 S752 L753 I1001 L1005	I648-I749 HydrophobicContact CD1-CG2 4.14Å; I648-I749 HydrophobicContact CG1-CG2 4.01Å; L651-I749 HydrophobicContact CD1-CD1 4.12Å; M745-I749 HydrophobicContact CG-CD1 3.88Å; M745-I749 WeakPolarHBondContact O-CB 3.31Å; M745-I749 WeakPolarHBondContact O-CD1 3.22Å; M745-I749 VanDerWaalsContact O-CG1 3.23Å; M745-I749 WeakPolarHBondContact O-CG1 3.37Å; M745-I749 PolarHBondContact O-N 3.19Å; M745-I749 HydrophobicContact SD-CD1 4.33Å; I746-I749 WeakPolarHBondContact O-CB 3.48Å; I746-I749 PolarHBondContact O-N 3.46Å; V747-I749 VanDerWaalsContact C-N 3.34Å; V747-I749 PolarHBondContact O-N 3.2Å; I749-I751 VanDerWaalsContact C-N 3.32Å; I749-I751 PolarHBondContact O-N 2.98Å; I749-S752 PolarHBondContact O-N 3.09Å; I749-L753 HydrophobicContact CG2-CD1 4.04Å; I749-L753 WeakPolarHBondContact O-CG 3.47Å; I749-L753 PolarHBondContact O-N 3.29Å; I749-I1001 HydrophobicContact CB-CG2 4.23Å; I749-I1001 HydrophobicContact CD1-CG2 3.4Å; I749-I1001 VanDerWaalsContact CD1-CG2 3.4Å; I749-I1001 HydrophobicContact CG1-CG2 3.64Å; I749-I1001 HydrophobicContact CG2-CG2 3.52Å; I749-L1005 HydrophobicContact CG1-CD1 4.14Å; I749-L1005 HydrophobicContact CG1-CD2 4.08Å; I749-L1005 HydrophobicContact CG1-CG 4.18Å
750	L	92.6	Very high	86.5	Confident	2 Å²	2	14.9 Å²	14.9	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-58.9	-43.9	179.1	178.1	64.7	0	0	0	111.1	M509 F513 F637 W643 I648 I746 V747 L753 I754	M509-L750 HydrophobicContact SD-CD1 4Å; F513-L750 HydrophobicContact CB-CD2 4.1Å; F513-L750 HydrophobicContact CD1-CD2 4.19Å; F513-L750 HydrophobicContact CD2-CD2 3.36Å; F513-L750 HydrophobicContact CE1-CD2 4.47Å; F513-L750 HydrophobicContact CE2-CD2 3.72Å; F513-L750 HydrophobicContact CG-CD2 3.63Å; F513-L750 HydrophobicContact CZ-CD2 4.27Å; F637-L750 HydrophobicContact CE2-CD1 4.07Å; F637-L750 HydrophobicContact CZ-CD1 4.45Å; W643-L750 HydrophobicContact CZ3-CD1 4.46Å; I648-L750 HydrophobicContact CD1-CB 4.2Å; I648-L750 HydrophobicContact CD1-CD1 4.05Å; I746-L750 WeakPolarHBondContact O-CB 3.28Å; I746-L750 PolarHBondContact O-N 3.29Å; V747-L750 PolarHBondContact O-N 3.19Å; L750-L753 PolarHBondContact O-N 2.99Å; L750-I754 HydrophobicContact CD1-CD1 4.08Å; L750-I754 HydrophobicContact CD1-CG1 4.39Å; L750-I754 HydrophobicContact CG-CD1 3.88Å; L750-I754 WeakPolarHBondContact O-CB 3.49Å; L750-I754 VanDerWaalsContact O-CG1 3.23Å; L750-I754 WeakPolarHBondContact O-CG1 3.23Å; L750-I754 PolarHBondContact O-N 2.89Å
751	I	90.8	Very high	84.9	Confident	9 Å²	9	16.8 Å²	16.8	5%	0.046	9%	0.092	C	C	.	.	H	α-helix	trans	-62.7	-43.6	176	-63.7	159.2	0	0	0	111	T559 L561 V747 D748 I749 L753 I754 N755	T559-I751 VanDerWaalsContact O-CG2 3.25Å; T559-I751 WeakPolarHBondContact O-CG2 3Å; L561-I751 HydrophobicContact CB-CD1 3.98Å; L561-I751 HydrophobicContact CD1-CD1 3.73Å; L561-I751 HydrophobicContact CD1-CG1 4.45Å; L561-I751 HydrophobicContact CG-CD1 3.6Å; L561-I751 HydrophobicContact CG-CG1 4.38Å; V747-I751 HydrophobicContact CG1-CD1 4.09Å; V747-I751 WeakPolarHBondContact O-CD1 3.21Å; V747-I751 VanDerWaalsContact O-CG1 3.25Å; V747-I751 WeakPolarHBondContact O-CG1 3.14Å; V747-I751 PolarHBondContact O-N 3.16Å; D748-I751 PolarHBondContact O-N 3.12Å; I749-I751 VanDerWaalsContact C-N 3.32Å; I749-I751 PolarHBondContact O-N 2.98Å; I751-L753 PolarHBondContact O-N 2.92Å; I751-I754 PolarHBondContact O-N 3.49Å; I751-N755 VanDerWaalsContact O-CB 3.28Å; I751-N755 WeakPolarHBondContact O-CB 3.35Å; I751-N755 PolarHBondContact O-N 3.45Å
752	S	87.5	Confident	83.3	Confident	30 Å²	30	25.3 Å²	25.3	21%	0.21	13%	0.129	C	C	.	.	H	α-helix	trans	-63	-39.4	176.8	-75.4	0	0	0	0	112.8	D748 I749 R756 L1004	D748-S752 PolarHBondContact O-N 2.94Å; I749-S752 PolarHBondContact O-N 3.09Å; S752-R756 WeakPolarHBondContact O-CB 3.02Å; S752-R756 PolarHBondContact O-N 3.11Å; S752-L1004 PolarHBondContact OG-O 2.84Å
753	L	89.8	Confident	81.1	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-46.8	175	-72.1	170.3	0	0	0	111.8	F637 E642 I648 I749 L750 I751 N755 R756 C757 L1004	F637-L753 HydrophobicContact CD1-CB 4.3Å; F637-L753 HydrophobicContact CE1-CB 3.82Å; F637-L753 HydrophobicContact CE2-CB 4.39Å; F637-L753 HydrophobicContact CZ-CB 3.87Å; E642-L753 HydrophobicContact CB-CD1 4.26Å; E642-L753 HydrophobicContact CB-CD2 4.49Å; E642-L753 HydrophobicContact CG-CD2 4.25Å; I648-L753 HydrophobicContact CD1-CD1 3.95Å; I749-L753 HydrophobicContact CG2-CD1 4.04Å; I749-L753 WeakPolarHBondContact O-CG 3.47Å; I749-L753 PolarHBondContact O-N 3.29Å; L750-L753 PolarHBondContact O-N 2.99Å; I751-L753 PolarHBondContact O-N 2.92Å; L753-N755 PolarHBondContact O-N 3.38Å; L753-R756 PolarHBondContact O-N 3.23Å; L753-C757 PolarHBondContact O-N 3Å; L753-C757 VanDerWaalsContact O-N 3.11Å; L753-C757 PolarHBondContact O-SG 3.23Å; L753-C757 VanDerWaalsContact O-SG 3.34Å; L753-L1004 HydrophobicContact CD2-CD1 3.56Å; L753-L1004 HydrophobicContact CG-CD1 3.99Å
754	I	91.1	Very high	78.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-54.7	-51.4	173	-74.7	171.9	0	0	0	110.6	L506 M509 L510 F637 L750 I751 R756 C757 L758	L506-I754 HydrophobicContact CD1-CD1 4.15Å; L506-I754 HydrophobicContact CD1-CG2 3.44Å; L506-I754 VanDerWaalsContact CD1-CG2 3.44Å; M509-I754 HydrophobicContact CB-CD1 4.46Å; L510-I754 HydrophobicContact CD2-CD1 4.38Å; F637-I754 HydrophobicContact CZ-CG1 3.91Å; L750-I754 HydrophobicContact CD1-CD1 4.08Å; L750-I754 HydrophobicContact CD1-CG1 4.39Å; L750-I754 HydrophobicContact CG-CD1 3.88Å; L750-I754 WeakPolarHBondContact O-CB 3.49Å; L750-I754 VanDerWaalsContact O-CG1 3.23Å; L750-I754 WeakPolarHBondContact O-CG1 3.23Å; L750-I754 PolarHBondContact O-N 2.89Å; I751-I754 PolarHBondContact O-N 3.49Å; I754-R756 PolarHBondContact O-N 3.06Å; I754-C757 PolarHBondContact O-N 3.17Å; I754-C757 VanDerWaalsContact O-N 3.16Å; I754-L758 HydrophobicContact CG2-CD1 3.92Å; I754-L758 WeakPolarHBondContact O-CG 3.45Å; I754-L758 PolarHBondContact O-N 3.01Å
755	N	88.9	Confident	76.5	Confident	9 Å²	9	39.9 Å²	39.9	5%	0.048	21%	0.214	C	C	.	.	H	α-helix	trans	-65.7	-39.3	-177.5	-73.6	-7.5	0	0	0	111.9	T559 I751 L753 C757 L758 S759	T559-N755 WeakPolarHBondContact CB-OD1 3.44Å; T559-N755 PolarHBondContact N-OD1 2.9Å; T559-N755 PolarHBondContact O-ND2 3.13Å; T559-N755 PolarHBondContact O-OD1 3.15Å; I751-N755 VanDerWaalsContact O-CB 3.28Å; I751-N755 WeakPolarHBondContact O-CB 3.35Å; I751-N755 PolarHBondContact O-N 3.45Å; L753-N755 PolarHBondContact O-N 3.38Å; N755-C757 VanDerWaalsContact C-N 3.27Å; N755-C757 PolarHBondContact O-N 3.38Å; N755-L758 PolarHBondContact O-N 3.36Å; N755-S759 WeakPolarHBondContact O-CB 3.49Å; N755-S759 PolarHBondContact O-N 3.33Å; N755-S759 PolarHBondContact O-OG 3.12Å
756	R	85.5	Confident	74.4	Confident	100 Å²	100	42 Å²	42	38%	0.377	23%	0.229	S	C	.	.	H	α-helix	trans	-55.9	-43.6	172.4	-179.4	-168.7	72	-178	-1	111.5	K497 E642 S752 L753 I754	K497-R756 PolarHBondContact NZ-O 3.05Å; E642-R756 IonicContact OE1-CZ 3.97Å; E642-R756 IonicContact OE1-NH1 3.36Å; E642-R756 PolarHBondContact OE1-NH1 2.75Å; E642-R756 IonicContact OE1-NH2 3.26Å; E642-R756 PolarHBondContact OE1-NH2 3.19Å; E642-R756 IonicContact OE2-CZ 2.76Å; E642-R756 IonicContact OE2-NH1 3.29Å; E642-R756 IonicContact OE2-NH2 2.63Å; E642-R756 PolarHBondContact OE2-NH2 3.25Å; S752-R756 WeakPolarHBondContact O-CB 3.02Å; S752-R756 PolarHBondContact O-N 3.11Å; L753-R756 PolarHBondContact O-N 3.23Å; I754-R756 PolarHBondContact O-N 3.06Å
757	C	84.8	Confident	72.2	Confident	9 Å²	9	45.8 Å²	45.8	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-80.8	-30.5	-174.7	-65.2	0	0	0	0	113.3	K497 L635 F637 L753 I754 N755	K497-C757 WeakPolarHBondContact CE-O 3.39Å; K497-C757 PolarHBondContact NZ-O 3.46Å; L635-C757 WeakPolarHBondContact O-CB 3.4Å; L635-C757 PolarHBondContact O-SG 3.35Å; F637-C757 HydrophobicContact CE1-CB 4.49Å; L753-C757 PolarHBondContact O-N 3Å; L753-C757 VanDerWaalsContact O-N 3.11Å; L753-C757 PolarHBondContact O-SG 3.23Å; L753-C757 VanDerWaalsContact O-SG 3.34Å; I754-C757 PolarHBondContact O-N 3.17Å; I754-C757 VanDerWaalsContact O-N 3.16Å; N755-C757 VanDerWaalsContact C-N 3.27Å; N755-C757 PolarHBondContact O-N 3.38Å
758	L	86.9	Confident	70.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-95.3	-22.5	179.5	-60.9	-178.4	0	0	0	114.7	I498 R502 L506 L557 L635 I754 N755	I498-L758 WeakPolarHBondContact CD1-O 3.39Å; I498-L758 HydrophobicContact CG1-CD2 4.28Å; R502-L758 HydrophobicContact CB-CD2 4.17Å; L506-L758 HydrophobicContact CB-CD1 4.27Å; L506-L758 HydrophobicContact CD1-CD1 4.21Å; L506-L758 HydrophobicContact CD2-CD1 4.01Å; L506-L758 HydrophobicContact CG-CD1 4.41Å; L557-L758 HydrophobicContact CB-CB 4.35Å; L557-L758 HydrophobicContact CD2-CD1 4.44Å; L557-L758 PolarHBondContact N-O 3.41Å; L557-L758 WeakPolarHBondContact O-CB 3.35Å; L635-L758 HydrophobicContact CD2-CD2 3.84Å; L635-L758 HydrophobicContact CD2-CG 4.3Å; I754-L758 HydrophobicContact CG2-CD1 3.92Å; I754-L758 WeakPolarHBondContact O-CG 3.45Å; I754-L758 PolarHBondContact O-N 3.01Å; N755-L758 PolarHBondContact O-N 3.36Å
759	S	77.2	Confident	68.8	Low	23 Å²	23	53.5 Å²	53.5	16%	0.161	29%	0.289	C	S	.	.	S	Bend	trans	-84.7	157.5	178.8	-47.3	0	0	0	0	112.3	K497 T558 N755 S761	K497-S759 PolarHBondContact NZ-O 2.95Å; T558-S759 VanDerWaalsContact CG2-OG 3.26Å; T558-S759 WeakPolarHBondContact CG2-OG 3.47Å; N755-S759 WeakPolarHBondContact O-CB 3.49Å; N755-S759 PolarHBondContact O-N 3.33Å; N755-S759 PolarHBondContact O-OG 3.12Å; S759-S761 PolarHBondContact O-N 2.91Å
760	T	64.1	Low	67.9	Low	40 Å²	40	60.1 Å²	60.1	25%	0.245	32%	0.324	C	S	.	.			trans	-81.3	113	167.4	34.6	0	0	0	0	111.6	T555	T555-T760 WeakPolarHBondContact O-CG2 3.39Å
761	S	51.9	Low	67.1	Low	45 Å²	45	61.3 Å²	61.3	32%	0.315	33%	0.331	S	S	.	.			trans	-59.1	132.3	163.6	28	0	0	0	0	110.6	S759 S763 D764	S759-S761 PolarHBondContact O-N 2.91Å; S761-S763 PolarHBondContact O-N 3.39Å; S761-D764 VanDerWaalsContact CB-OD2 3.29Å; S761-D764 WeakPolarHBondContact CB-OD2 3.21Å; S761-D764 PolarHBondContact O-N 3.06Å; S761-D764 PolarHBondContact OG-OD2 2.99Å
762	K	48.6	Very low	66.7	Low	180 Å²	180	62 Å²	62	78%	0.783	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-7	179.2	-65.1	176.9	-178.1	167.4	0	113.9
763	S	41.4	Very low	66.7	Low	100 Å²	100	60.6 Å²	60.6	70%	0.699	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-22.7	-174.6	47.6	0	0	0	0	115.2	S761	S761-S763 PolarHBondContact O-N 3.39Å
764	D	38.5	Very low	66.7	Low	87 Å²	87	60.9 Å²	60.9	47%	0.465	33%	0.33	S	S	.	.	S	Bend	trans	-90.8	172.4	-171.9	-67.7	-67.5	0	0	0	112.5	S761 S766 S767	S761-D764 VanDerWaalsContact CB-OD2 3.29Å; S761-D764 WeakPolarHBondContact CB-OD2 3.21Å; S761-D764 PolarHBondContact O-N 3.06Å; S761-D764 PolarHBondContact OG-OD2 2.99Å; D764-S766 PolarHBondContact O-N 3.31Å; D764-S767 WeakPolarHBondContact O-CB 3.4Å; D764-S767 PolarHBondContact O-N 3.44Å; D764-S767 PolarHBondContact O-OG 3.08Å
765	L	41.6	Very low	66.8	Low	150 Å²	150	60.9 Å²	60.9	79%	0.785	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-60.3	-12.6	-172.2	-101.7	67.8	0	0	0	115	S767	L765-S767 PolarHBondContact O-N 3.23Å
766	S	43.4	Very low	67	Low	45 Å²	45	60.5 Å²	60.5	32%	0.315	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-65.2	-9	168	47.2	0	0	0	0	114.3	D764 Q768 F769	D764-S766 PolarHBondContact O-N 3.31Å; S766-Q768 PolarHBondContact O-N 3.24Å; S766-F769 PolarHBondContact O-N 3.33Å
767	S	43.6	Very low	67.6	Low	79 Å²	79	55.7 Å²	55.7	55%	0.552	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-58.1	-5.9	175	46.1	0	0	0	0	115.6	D764 L765 F769	D764-S767 WeakPolarHBondContact O-CB 3.4Å; D764-S767 PolarHBondContact O-N 3.44Å; D764-S767 PolarHBondContact O-OG 3.08Å; L765-S767 PolarHBondContact O-N 3.23Å; S767-F769 VanDerWaalsContact C-N 3.33Å
768	Q	51.3	Low	68.1	Low	157 Å²	157	55.3 Å²	55.3	73%	0.734	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-73.4	-21.4	166.4	-63.6	-175.2	-7.3	0	0	113.6	S766	S766-Q768 PolarHBondContact O-N 3.24Å
769	F	57.8	Low	68.5	Low	58 Å²	58	55.5 Å²	55.5	25%	0.254	31%	0.308	S	S	.	.	S	Bend	trans	-117.1	102.3	-171.8	-65.2	-73.4	0	0	0	111.5	I494 A536 N537 S766 S767	I494-F769 HydrophobicContact CD1-CE2 4.26Å; I494-F769 HydrophobicContact CD1-CZ 4.03Å; A536-F769 HydrophobicContact CB-CB 3.89Å; N537-F769 WeakPolarHBondContact O-CD1 3.31Å; S766-F769 PolarHBondContact O-N 3.33Å; S767-F769 VanDerWaalsContact C-N 3.33Å
770	N	68	Low	69.2	Low	139 Å²	139	54.8 Å²	54.8	74%	0.743	30%	0.303	S	S	*	.			trans	-72.6	140.1	171.6	-72	-46.3	0	0	0	111	A536 A772	A536-N770 WeakPolarHBondContact CB-O 3.43Å; N770-A772 PolarHBondContact O-N 3.37Å
771	V	77.3	Confident	70.5	Confident	27 Å²	27	53.1 Å²	53.1	16%	0.164	29%	0.293	C	S	.	.			trans	-61.2	124.9	168.7	180	0	0	0	0	109	I445 E534	I445-V771 HydrophobicContact CD1-CG1 4.49Å; E534-V771 HydrophobicContact CB-CG1 3.95Å; E534-V771 HydrophobicContact CB-CG2 4.14Å; E534-V771 HydrophobicContact CG-CG1 4.21Å
772	A	81.4	Confident	72.1	Confident	25 Å²	25	51.2 Å²	51.2	21%	0.207	28%	0.28	C	S	.	.			trans	-125.6	-20	-173.8	0	0	0	0	0	113.1	L419 S446 F535 N770	L419-A772 HydrophobicContact CD1-CB 3.42Å; L419-A772 VanDerWaalsContact CD1-CB 3.42Å; S446-A772 PolarHBondContact N-O 3.17Å; F535-A772 PolarHBondContact O-N 2.93Å; N770-A772 PolarHBondContact O-N 3.37Å
773	A	87.3	Confident	74	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	156.6	173.9	0	0	0	0	0	111.1	L415 L419 S446 F535	L415-A773 HydrophobicContact CB-CB 4.26Å; L415-A773 HydrophobicContact CD1-CB 4.38Å; L415-A773 HydrophobicContact CD2-CB 4.07Å; L415-A773 HydrophobicContact CG-CB 4.47Å; L419-A773 HydrophobicContact CD1-CB 4.5Å; S446-A773 CarbonylContact O-C 3.42Å; S446-A773 VanDerWaalsContact O-CA 3.29Å; S446-A773 WeakPolarHBondContact O-CA 3.38Å; F535-A773 HydrophobicContact CB-CB 4.05Å; F535-A773 PolarHBondContact N-O 3.46Å; F535-A773 PolarHBondContact O-N 3.36Å; F535-A773 VanDerWaalsContact O-N 3.12Å
774	Q	90.1	Very high	76.1	Confident	6 Å²	6	38.7 Å²	38.7	3%	0.028	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	136.9	-173.8	-172.8	-176.3	23.4	0	0	110.9	I445 S446 Q447 Q448 S532 L533	I445-Q774 HydrophobicContact CG2-CB 3.73Å; S446-Q774 PolarHBondContact O-N 3.29Å; Q447-Q774 WeakPolarHBondContact CA-O 3.24Å; Q447-Q774 HydrophobicContact CG-CB 4.17Å; Q448-Q774 PolarHBondContact N-O 3.24Å; S532-Q774 PolarHBondContact OG-NE2 3.28Å; L533-Q774 CarbonylContact O-C 3.37Å; L533-Q774 WeakPolarHBondContact O-CA 3.35Å
775	L	93.6	Very high	77.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.2	167.9	167.2	60.7	0	0	0	109.2	I411 Q448 L450 V467 F468 M471 S532 L533 F535	I411-L775 HydrophobicContact CD1-CD1 4.07Å; I411-L775 HydrophobicContact CG2-CD1 4.08Å; I411-L775 HydrophobicContact CG2-CD2 4.33Å; Q448-L775 HydrophobicContact CB-CD1 4.46Å; L450-L775 HydrophobicContact CB-CD1 4.08Å; V467-L775 HydrophobicContact CG1-CD2 4.18Å; F468-L775 HydrophobicContact CE1-CD2 4.47Å; M471-L775 HydrophobicContact CE-CD2 4Å; S532-L775 WeakPolarHBondContact CA-O 3.13Å; L533-L775 HydrophobicContact CB-CB 4.35Å; L533-L775 PolarHBondContact N-O 3.21Å; L533-L775 PolarHBondContact O-N 2.92Å; F535-L775 HydrophobicContact CE2-CB 4.14Å
776	I	93.9	Very high	79	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	122.8	171.8	-61	154.9	0	0	0	108.3	Q448 V449 L450 L530 F531 F1015 L1040	Q448-I776 PolarHBondContact O-N 3.44Å; V449-I776 CarbonylContact C-O 3.58Å; V449-I776 WeakPolarHBondContact CA-O 3.37Å; V449-I776 HydrophobicContact CG2-CB 4.44Å; V449-I776 HydrophobicContact CG2-CD1 4.39Å; L450-I776 PolarHBondContact N-O 3.02Å; L530-I776 HydrophobicContact CD1-CG2 3.74Å; F531-I776 CarbonylContact O-C 3.6Å; F531-I776 WeakPolarHBondContact O-CA 3.42Å; I776-F1015 HydrophobicContact CD1-CE1 4.24Å; I776-F1015 HydrophobicContact CD1-CE2 4.17Å; I776-F1015 HydrophobicContact CD1-CZ 3.51Å; I776-L1040 HydrophobicContact CG2-CD2 4.05Å
777	L	96.4	Very high	79.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.5	177.7	-169	157.9	0	0	0	110.1	L450 L452 V467 F468 F531 D779	L450-L777 HydrophobicContact CB-CG 4.42Å; L450-L777 HydrophobicContact CD2-CD1 3.75Å; L450-L777 HydrophobicContact CD2-CG 4.09Å; L450-L777 HydrophobicContact CG-CG 4.31Å; L450-L777 WeakPolarHBondContact O-CA 3.48Å; L452-L777 HydrophobicContact CD1-CD2 4.31Å; V467-L777 HydrophobicContact CB-CD1 4.48Å; V467-L777 HydrophobicContact CG1-CD1 4.41Å; F468-L777 HydrophobicContact CD1-CD1 4.44Å; F468-L777 HydrophobicContact CE1-CB 4.23Å; F468-L777 HydrophobicContact CE1-CD1 3.88Å; F468-L777 HydrophobicContact CE2-CD1 3.97Å; F468-L777 HydrophobicContact CZ-CB 3.75Å; F468-L777 HydrophobicContact CZ-CD1 3.63Å; F468-L777 HydrophobicContact CZ-CG 4.2Å; F531-L777 HydrophobicContact CB-CB 4.32Å; F531-L777 HydrophobicContact CD2-CD2 4.03Å; F531-L777 PolarHBondContact N-O 3.47Å; F531-L777 PolarHBondContact O-N 3.06Å; L777-D779 HydrophobicContact CD2-CB 4.21Å
778	V	95.9	Very high	79.5	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	113.1	178.9	-163.6	0	0	0	0	109.9	L450 L452 L528 L530 P780 F831 L1040	L450-V778 PolarHBondContact O-N 3.25Å; L452-V778 PolarHBondContact N-O 3.05Å; L528-V778 HydrophobicContact CD2-CG1 4.08Å; L530-V778 HydrophobicContact CD1-CG2 3.88Å; V778-P780 WeakPolarHBondContact O-CD 3.42Å; V778-F831 HydrophobicContact CG1-CE1 3.98Å; V778-F831 HydrophobicContact CG1-CZ 3.7Å; V778-L1040 HydrophobicContact CG2-CD1 4.1Å; V778-L1040 HydrophobicContact CG2-CD2 4.36Å
779	D	95.1	Very high	78.6	Confident	3 Å²	3	26.4 Å²	26.4	2%	0.016	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	87.8	171.7	-175.2	15.2	0	0	0	109	L452 K460 T461 S464 R529 L777	L452-D779 HydrophobicContact CD1-CB 4.29Å; K460-D779 VanDerWaalsContact CB-OD1 3.27Å; K460-D779 WeakPolarHBondContact CB-OD1 3.39Å; T461-D779 VanDerWaalsContact CA-OD2 3.24Å; T461-D779 WeakPolarHBondContact CA-OD2 3.4Å; T461-D779 WeakPolarHBondContact CB-OD2 3.34Å; T461-D779 PolarHBondContact OG1-OD2 2.86Å; S464-D779 PolarHBondContact OG-OD2 3.38Å; R529-D779 HydrophobicContact CB-CB 4.3Å; R529-D779 PolarHBondContact N-O 3.17Å; R529-D779 PolarHBondContact O-N 3.18Å; L777-D779 HydrophobicContact CD2-CB 4.21Å
780	P	92.6	Very high	77.4	Confident	8 Å²	8	26.8 Å²	26.8	5%	0.052	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-77.1	155.1	-179.1	32.8	-34.5	0	0	0	111.7	L452 L453 K460 L528 V778 G782 F831	L452-P780 WeakPolarHBondContact O-CD 3.08Å; L452-P780 WeakPolarHBondContact O-CG 3.48Å; L453-P780 HydrophobicContact CD2-CG 4.33Å; K460-P780 WeakPolarHBondContact CE-O 3.49Å; L528-P780 HydrophobicContact CG-CB 4.22Å; V778-P780 WeakPolarHBondContact O-CD 3.42Å; P780-G782 PolarHBondContact O-N 3.37Å; P780-F831 HydrophobicContact CB-CD2 4.13Å; P780-F831 HydrophobicContact CB-CE2 3.78Å; P780-F831 HydrophobicContact CG-CD2 4.31Å; P780-F831 HydrophobicContact CG-CE2 4.31Å
781	V	90.2	Very high	75.4	Confident	5 Å²	5	25.6 Å²	25.6	3%	0.03	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-54	130.6	170.7	176.7	0	0	0	0	109.6	S525 A527 F824	S525-V781 WeakPolarHBondContact O-CG1 3.05Å; A527-V781 VanDerWaalsContact O-CG2 3.31Å; A527-V781 WeakPolarHBondContact O-CG2 2.98Å; V781-F824 HydrophobicContact CB-CB 4.3Å; V781-F824 HydrophobicContact CB-CD1 3.51Å; V781-F824 HydrophobicContact CB-CD2 4.31Å; V781-F824 HydrophobicContact CB-CE1 3.83Å; V781-F824 HydrophobicContact CB-CG 3.79Å; V781-F824 HydrophobicContact CB-CZ 4.35Å; V781-F824 HydrophobicContact CG1-CB 4.06Å; V781-F824 HydrophobicContact CG1-CD1 3.87Å; V781-F824 HydrophobicContact CG1-CD2 3.72Å; V781-F824 HydrophobicContact CG1-CE1 4.23Å; V781-F824 HydrophobicContact CG1-CE2 4.08Å; V781-F824 HydrophobicContact CG1-CG 3.61Å; V781-F824 HydrophobicContact CG1-CZ 4.33Å; V781-F824 HydrophobicContact CG2-CD1 3.66Å; V781-F824 HydrophobicContact CG2-CE1 3.4Å; V781-F824 VanDerWaalsContact CG2-CE1 3.4Å; V781-F824 HydrophobicContact CG2-CE2 4.36Å; V781-F824 HydrophobicContact CG2-CG 4.28Å; V781-F824 HydrophobicContact CG2-CZ 3.8Å
782	G	86.6	Confident	73	Confident	5 Å²	5	31 Å²	31	5%	0.052	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-64.7	146.2	-178.7	0	0	0	0	0	112	G454 P780 Q784	G454-G782 WeakPolarHBondContact O-CA 3.41Å; P780-G782 PolarHBondContact O-N 3.37Å; G782-Q784 WeakPolarHBondContact O-CG 3.2Å; G782-Q784 PolarHBondContact O-N 2.77Å; G782-Q784 PolarHBondContact O-NE2 3.36Å
783	F	88.2	Confident	70.2	Confident	4 Å²	4	37 Å²	37	2%	0.018	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-48.8	127.5	178.6	-173.1	-89.2	0	0	0	111.6	G454 R455 I785 N825 Y828 H957 L959 I964	G454-F783 PolarHBondContact O-N 2.87Å; R455-F783 HydrophobicContact CG-CB 4.32Å; F783-I785 HydrophobicContact CD1-CD1 4.38Å; F783-I785 HydrophobicContact CD1-CG1 3.95Å; F783-I785 HydrophobicContact CE1-CD1 4.27Å; F783-I785 HydrophobicContact CE1-CG1 3.77Å; F783-N825 HydrophobicContact CD2-CB 4.27Å; F783-N825 VanDerWaalsContact CD2-OD1 3.23Å; F783-N825 WeakPolarHBondContact CD2-OD1 3.15Å; F783-N825 HydrophobicContact CE2-CB 3.8Å; F783-N825 WeakPolarHBondContact CE2-OD1 3.39Å; F783-N825 HydrophobicContact CZ-CB 4.42Å; F783-Y828 HydrophobicContact CB-CD2 3.81Å; F783-Y828 HydrophobicContact CB-CE2 3.96Å; F783-Y828 HydrophobicContact CB-CG 4.21Å; F783-Y828 HydrophobicContact CD2-CD1 4.26Å; F783-Y828 HydrophobicContact CD2-CD2 4.48Å; F783-Y828 HydrophobicContact CD2-CG 4.04Å; F783-H957 HydrophobicContact CE2-CB 3.69Å; F783-H957 HydrophobicContact CZ-CB 3.49Å; F783-H957 VanDerWaalsContact CZ-CB 3.49Å; F783-H957 AromaticContact CZ-CG 3.96Å; F783-L959 HydrophobicContact CD2-CB 4.37Å; F783-L959 HydrophobicContact CG-CB 4.41Å; F783-I964 HydrophobicContact CE1-CD1 3.88Å; F783-I964 HydrophobicContact CZ-CD1 3.75Å
784	Q	84.6	Confident	67.3	Low	13 Å²	13	42.7 Å²	42.7	6%	0.061	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-100.6	136.6	-171	-61.9	-59.8	-34.2	0	0	111.4	R526 G782 D821 F824 N825 I964	R526-Q784 VanDerWaalsContact NH1-CD 3.35Å; R526-Q784 VanDerWaalsContact NH1-NE2 3.12Å; G782-Q784 WeakPolarHBondContact O-CG 3.2Å; G782-Q784 PolarHBondContact O-N 2.77Å; G782-Q784 PolarHBondContact O-NE2 3.36Å; Q784-D821 HydrophobicContact CB-CB 4.26Å; Q784-F824 HydrophobicContact CG-CB 4.3Å; Q784-F824 HydrophobicContact CG-CD2 4.42Å; Q784-N825 PolarHBondContact N-OD1 3.04Å; Q784-N825 PolarHBondContact O-ND2 3.41Å; Q784-N825 PolarHBondContact O-OD1 3.05Å; Q784-I964 VanDerWaalsContact O-CD1 3.28Å; Q784-I964 WeakPolarHBondContact O-CD1 3.45Å
785	I	76.2	Confident	64	Low	40 Å²	40	48.2 Å²	48.2	21%	0.205	29%	0.292	C	S	.	.			trans	-127.4	107.9	176.5	-58.6	178.9	0	0	0	108.2	F783	F783-I785 HydrophobicContact CD1-CD1 4.38Å; F783-I785 HydrophobicContact CD1-CG1 3.95Å; F783-I785 HydrophobicContact CE1-CD1 4.27Å; F783-I785 HydrophobicContact CE1-CG1 3.77Å
786	P	65.2	Low	60.7	Low	19 Å²	19	53.2 Å²	53.2	12%	0.123	33%	0.327	C	S	.	.			trans	-70.6	152.7	176.9	30.8	-36.9	0	0	0	111.5	S788 G817 I964	P786-S788 VanDerWaalsContact C-N 3.32Å; P786-S788 PolarHBondContact O-N 3.08Å; P786-G817 VanDerWaalsContact CG-CA 3.49Å; P786-I964 HydrophobicContact CG-CG2 3.63Å
787	Y	55	Low	57.5	Low	54 Å²	54	60 Å²	60	21%	0.212	37%	0.368	C	S	.	.			trans	-77.7	70.6	-164.8	-63.8	-79.9	0	0	0	114.6	I519 L520 T789 K815	I519-Y787 HydrophobicContact CB-CD2 4.44Å; I519-Y787 HydrophobicContact CB-CE1 4.09Å; I519-Y787 HydrophobicContact CB-CE2 3.69Å; I519-Y787 HydrophobicContact CD1-CD2 3.81Å; I519-Y787 HydrophobicContact CD1-CE2 3.78Å; I519-Y787 HydrophobicContact CD1-CG 4.49Å; I519-Y787 HydrophobicContact CG1-CE2 4.29Å; I519-Y787 HydrophobicContact CG2-CD1 4.13Å; I519-Y787 HydrophobicContact CG2-CE1 3.58Å; I519-Y787 HydrophobicContact CG2-CE2 4.05Å; L520-Y787 HydrophobicContact CD1-CE1 3.76Å; L520-Y787 HydrophobicContact CG-CE1 3.85Å; L520-Y787 WeakPolarHBondContact CG-OH 3.33Å; L520-Y787 PolarHBondContact N-OH 3.15Å; Y787-T789 PolarHBondContact O-N 3.16Å; Y787-K815 WeakPolarHBondContact O-CB 3.43Å
788	S	42.1	Very low	54	Low	57 Å²	57	65.6 Å²	65.6	40%	0.399	41%	0.407	S	S	.	.			trans	-70.2	118.6	167.4	55.2	0	0	0	0	111.3	P786 T790	P786-S788 VanDerWaalsContact C-N 3.32Å; P786-S788 PolarHBondContact O-N 3.08Å; S788-T790 PolarHBondContact O-N 3.44Å; S788-T790 VanDerWaalsContact O-N 3.13Å; S788-T790 PolarHBondContact O-OG1 2.98Å
789	T	33.2	Very low	50.6	Low	90 Å²	90	72.5 Å²	72.5	55%	0.552	45%	0.449	S	S	*	.			trans	-63.3	112.5	171	36.2	0	0	0	0	109.3	Y787 S791	Y787-T789 PolarHBondContact O-N 3.16Å; T789-S791 VanDerWaalsContact C-N 3.35Å; T789-S791 PolarHBondContact O-N 3.34Å
790	T	32.4	Very low	47.2	Very low	67 Å²	67	77 Å²	77	41%	0.411	48%	0.481	S	S	.	.			trans	-78.2	82.4	-167.7	-38.3	0	0	0	0	111.8	S788 L792	S788-T790 PolarHBondContact O-N 3.44Å; S788-T790 VanDerWaalsContact O-N 3.13Å; S788-T790 PolarHBondContact O-OG1 2.98Å; T790-L792 VanDerWaalsContact C-N 3.28Å; T790-L792 HydrophobicContact CG2-CD1 3.93Å; T790-L792 HydrophobicContact CG2-CG 4.2Å; T790-L792 PolarHBondContact O-N 2.98Å
791	S	25.5	Very low	44	Very low	114 Å²	114	82.2 Å²	82.2	80%	0.797	52%	0.518	S	S	*	.			trans	-66.7	77.5	177.7	41.8	0	0	0	0	112.6	T789	T789-S791 VanDerWaalsContact C-N 3.35Å; T789-S791 PolarHBondContact O-N 3.34Å
792	L	27.3	Very low	41.4	Very low	141 Å²	141	87.1 Å²	87.1	74%	0.738	55%	0.549	S	S	*	.			trans	-121.6	42	176	-74	177.5	0	0	0	112.6	T790	T790-L792 VanDerWaalsContact C-N 3.28Å; T790-L792 HydrophobicContact CG2-CD1 3.93Å; T790-L792 HydrophobicContact CG2-CG 4.2Å; T790-L792 PolarHBondContact O-N 2.98Å
793	I	23.8	Very low	38.3	Very low	151 Å²	151	93.5 Å²	93.5	77%	0.774	59%	0.588	S	S	*	*			trans	-138.9	97.4	161.1	-52.6	179.1	0	0	0	108.8
794	S	24.9	Very low	35.4	Very low	118 Å²	118	98.3 Å²	98.3	83%	0.825	63%	0.628	S	S	*	*			trans	172.8	89.1	152.4	34.9	0	0	0	0	110.6
795	S	22.3	Very low	32.5	Very low	122 Å²	122	107.3 Å²	107.3	85%	0.853	67%	0.667	S	S	*	*			trans	-128.5	58.1	172.3	64.3	0	0	0	0	111.6
796	S	23.9	Very low	30	Very low	105 Å²	105	113.1 Å²	113.1	73%	0.734	70%	0.698	S	S	*	*	S	Bend	trans	-166.4	154.4	169	36.1	0	0	0	0	112.3
797	T	25.2	Very low	28	Very low	143 Å²	143	117.5 Å²	117.5	88%	0.877	73%	0.729	S	S	*	*			trans	57	110.3	166.7	45.1	0	0	0	0	119.2
798	S	23.6	Very low	26.6	Very low	117 Å²	117	119.8 Å²	119.8	82%	0.818	75%	0.753	S	S	*	*			trans	-101.9	132.9	170.7	53.5	0	0	0	0	112.2
799	V	25.4	Very low	25.8	Very low	147 Å²	147	126.5 Å²	126.5	89%	0.891	78%	0.778	S	S	*	*			trans	-137	155.1	161.8	-176.8	0	0	0	0	110
800	S	23.9	Very low	25.4	Very low	97 Å²	97	126.7 Å²	126.7	68%	0.678	78%	0.783	S	S	*	*			trans	-81.3	152.7	-154.5	56	0	0	0	0	119.6
801	S	23.7	Very low	25.3	Very low	118 Å²	118	130.5 Å²	130.5	83%	0.825	80%	0.801	S	S	*	*			trans	89.4	155.6	134.8	-70.7	0	0	0	0	122.1
802	P	35.3	Very low	25.5	Very low	107 Å²	107	132.1 Å²	132.1	70%	0.695	80%	0.796	S	S	*	*			trans	-128.6	170	-160.4	41.5	-24.7	0	0	0	115.8
803	T	22.9	Very low	25.9	Very low	140 Å²	140	131.5 Å²	131.5	86%	0.859	79%	0.791	S	S	*	*				155.7	122.2	126.8	51.2	0	0	0	0	113.1
804	A	26.3	Very low	26.8	Very low	104 Å²	104	130.3 Å²	130.3	86%	0.86	78%	0.782	S	S	*	*			trans	-168.8	151.9	143.2	0	0	0	0	0	109.4
805	K	24	Very low	28.4	Very low	202 Å²	202	130.7 Å²	130.7	88%	0.878	77%	0.768	S	S	*	*			trans	-128	134.5	166.1	-71.7	-179	177.9	-179.1	0	107.9
806	L	23.4	Very low	30.8	Very low	162 Å²	162	127 Å²	127	85%	0.848	74%	0.741	S	S	*	*				174.6	136.6	126.5	-96.6	154.2	0	0	0	112.3
807	S	23.5	Very low	33.2	Very low	111 Å²	111	122.1 Å²	122.1	78%	0.776	71%	0.707	S	S	*	*			trans	29.1	98.3	152.5	57	0	0	0	0	120.3
808	S	25.5	Very low	35.7	Very low	103 Å²	103	117.6 Å²	117.6	72%	0.72	68%	0.677	S	S	*	*			trans	-151.5	117.8	140.8	46.1	0	0	0	0	109.6	S810	S808-S810 VanDerWaalsContact C-N 3.26Å; S808-S810 PolarHBondContact O-N 2.95Å; S808-S810 VanDerWaalsContact O-N 3.13Å
809	E	24.8	Very low	38.4	Very low	197 Å²	197	113.1 Å²	113.1	92%	0.921	64%	0.643	S	S	*	*			trans	-87.5	59.7	179.5	-69.9	-168.6	125	0	0	111.9
810	S	25.1	Very low	41.2	Very low	95 Å²	95	106.6 Å²	106.6	66%	0.664	60%	0.604	S	S	*	*			trans	-103.5	78.8	168.3	54.1	0	0	0	0	109.3	S808 E812	S808-S810 VanDerWaalsContact C-N 3.26Å; S808-S810 PolarHBondContact O-N 2.95Å; S808-S810 VanDerWaalsContact O-N 3.13Å; S810-E812 PolarHBondContact O-N 3.5Å; S810-E812 VanDerWaalsContact O-N 3.13Å
811	N	31.2	Very low	44.1	Very low	147 Å²	147	102.7 Å²	102.7	79%	0.786	58%	0.575	S	S	*	*			trans	-63.7	111.1	-178.7	-80.3	-55.2	0	0	0	111.3	M813	N811-M813 PolarHBondContact O-N 3.32Å
812	E	29.4	Very low	47.2	Very low	148 Å²	148	97.1 Å²	97.1	69%	0.692	54%	0.536	S	S	*	.			trans	-60.6	101.1	161.8	-70.2	-167.6	135.6	0	0	108.9	S810 H814	S810-E812 PolarHBondContact O-N 3.5Å; S810-E812 VanDerWaalsContact O-N 3.13Å; E812-H814 VanDerWaalsContact C-N 3.31Å; E812-H814 PolarHBondContact O-N 3.1Å
813	M	36.4	Very low	49.7	Very low	128 Å²	128	92.8 Å²	92.8	63%	0.631	51%	0.507	S	S	*	.			trans	-72.8	85.5	-175.5	-169.3	163	60.9	0	0	110.7	E574 N811 K815	E574-M813 HydrophobicContact CG-CE 4.28Å; E574-M813 WeakPolarHBondContact OE1-CE 3.33Å; N811-M813 PolarHBondContact O-N 3.32Å; M813-K815 PolarHBondContact O-N 3Å
814	H	42.4	Very low	52.9	Low	126 Å²	126	86.3 Å²	86.3	58%	0.583	47%	0.467	S	S	*	.			trans	-54.2	126	177.4	-66.4	-34.7	0	0	0	111.1	E812 T816	E812-H814 VanDerWaalsContact C-N 3.31Å; E812-H814 PolarHBondContact O-N 3.1Å; H814-T816 PolarHBondContact O-N 2.87Å
815	K	57.5	Low	55.9	Low	126 Å²	126	81.3 Å²	81.3	55%	0.548	43%	0.426	S	S	.	.			trans	-72.3	94.5	-169.6	-60.8	-174.2	-180	-167.8	0	112.4	Y787 M813	Y787-K815 WeakPolarHBondContact O-CB 3.43Å; M813-K815 PolarHBondContact O-N 3Å
816	T	72.1	Confident	59	Low	45 Å²	45	71.7 Å²	71.7	28%	0.276	38%	0.384	S	S	.	.			trans	-103.9	161.9	174.6	54.1	0	0	0	0	112.1	H814 E965 A967	H814-T816 PolarHBondContact O-N 2.87Å; T816-E965 CarbonylContact C-O 3.57Å; T816-E965 WeakPolarHBondContact CA-O 3.4Å; T816-E965 WeakPolarHBondContact CB-O 3.5Å; T816-E965 HydrophobicContact CG2-CB 4.32Å; T816-E965 HydrophobicContact CG2-CG 3.93Å; T816-A967 HydrophobicContact CG2-CB 4.07Å; T816-A967 WeakPolarHBondContact OG1-CB 3.44Å
817	G	74.7	Confident	62.3	Low	1 Å²	1	64.2 Å²	64.2	1%	0.01	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-65.1	141.9	173.6	0	0	0	0	0	112.8	P786 E965	P786-G817 VanDerWaalsContact CG-CA 3.49Å; G817-E965 PolarHBondContact N-O 2.77Å
818	N	77.8	Confident	65.4	Low	48 Å²	48	59.1 Å²	59.1	26%	0.257	31%	0.309	S	S	.	.			trans	-86.5	179.2	176.5	72.8	41.3	0	0	0	111.3	T820 D821 L822	N818-T820 WeakPolarHBondContact OD1-CA 3.44Å; N818-T820 WeakPolarHBondContact OD1-CB 3.21Å; N818-T820 PolarHBondContact OD1-N 3.05Å; N818-T820 PolarHBondContact OD1-OG1 2.91Å; N818-D821 VanDerWaalsContact CG-OD2 3.24Å; N818-D821 PolarHBondContact N-OD2 3.19Å; N818-D821 PolarHBondContact ND2-OD2 2.89Å; N818-D821 PolarHBondContact O-N 3.45Å; N818-D821 PolarHBondContact OD1-N 3.26Å; N818-D821 PolarHBondContact OD1-OD2 3.24Å; N818-L822 PolarHBondContact O-N 3.12Å
819	F	80.7	Confident	68.4	Low	23 Å²	23	54.2 Å²	54.2	10%	0.101	28%	0.275	C	S	.	.	H	α-helix	trans	-66	-37.9	179.5	176.3	-122.8	0	0	0	113.4	D821 L822 I823 W972 Y1026	F819-D821 VanDerWaalsContact C-N 3.34Å; F819-D821 PolarHBondContact O-N 2.56Å; F819-L822 WeakPolarHBondContact O-CB 3.39Å; F819-L822 PolarHBondContact O-N 3.06Å; F819-I823 HydrophobicContact CD1-CD1 4.01Å; F819-I823 HydrophobicContact CE1-CD1 3.32Å; F819-I823 HydrophobicContact CE1-CG1 4.05Å; F819-I823 HydrophobicContact CE2-CD1 4.13Å; F819-I823 HydrophobicContact CE2-CG1 3.91Å; F819-I823 HydrophobicContact CZ-CD1 3.35Å; F819-I823 HydrophobicContact CZ-CG1 3.59Å; F819-I823 PolarHBondContact O-N 2.83Å; F819-W972 HydrophobicContact CB-CB 4.27Å; F819-W972 HydrophobicContact CB-CD2 3.65Å; F819-W972 HydrophobicContact CB-CE3 4.06Å; F819-W972 HydrophobicContact CB-CG 3.76Å; F819-W972 HydrophobicContact CB-CZ2 4.47Å; F819-W972 HydrophobicContact CD2-CD2 4.19Å; F819-W972 AromaticContact CD2-CE3 3.7Å; F819-W972 HydrophobicContact CD2-CE3 3.7Å; F819-W972 HydrophobicContact CD2-CZ3 4.02Å; F819-W972 HydrophobicContact CG-CD2 4.24Å; F819-W972 HydrophobicContact CG-CE3 4.21Å; F819-W972 HydrophobicContact CG-CG 4.4Å; F819-Y1026 HydrophobicContact CD2-CE1 4.26Å; F819-Y1026 HydrophobicContact CE1-CD1 4.27Å; F819-Y1026 AromaticContact CE1-CE1 3.77Å; F819-Y1026 HydrophobicContact CE1-CE1 3.77Å; F819-Y1026 AromaticContact CE2-CD1 3.6Å; F819-Y1026 HydrophobicContact CE2-CD1 3.6Å; F819-Y1026 AromaticContact CE2-CE1 3.51Å; F819-Y1026 HydrophobicContact CE2-CE1 3.51Å; F819-Y1026 AromaticContact CZ-CD1 3.36Å; F819-Y1026 HydrophobicContact CZ-CD1 3.36Å; F819-Y1026 AromaticContact CZ-CE1 3.25Å; F819-Y1026 HydrophobicContact CZ-CE1 3.25Å
820	T	83.4	Confident	71.5	Confident	11 Å²	11	45.4 Å²	45.4	7%	0.067	24%	0.235	C	C	.	.	H	α-helix	trans	-67.4	-35.3	177.8	-13	0	0	0	0	112.4	E565 N818 L822 I823 F824	E565-T820 HydrophobicContact CB-CG2 3.86Å; E565-T820 HydrophobicContact CG-CG2 3.67Å; E565-T820 WeakPolarHBondContact OE1-CB 3.24Å; E565-T820 PolarHBondContact OE1-OG1 3.19Å; N818-T820 WeakPolarHBondContact OD1-CA 3.44Å; N818-T820 WeakPolarHBondContact OD1-CB 3.21Å; N818-T820 PolarHBondContact OD1-N 3.05Å; N818-T820 PolarHBondContact OD1-OG1 2.91Å; T820-L822 PolarHBondContact O-N 3.14Å; T820-I823 PolarHBondContact O-N 3.09Å; T820-F824 HydrophobicContact CG2-CD2 3.97Å; T820-F824 HydrophobicContact CG2-CE2 3.33Å; T820-F824 HydrophobicContact CG2-CZ 3.73Å; T820-F824 WeakPolarHBondContact O-CD2 3.45Å; T820-F824 WeakPolarHBondContact O-CG 3.26Å; T820-F824 PolarHBondContact O-N 2.85Å
821	D	85.7	Confident	74.7	Confident	15 Å²	15	41 Å²	41	8%	0.08	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-39.4	173.5	-58.7	-35.8	0	0	0	110.5	R526 Q784 N818 F819 N825 Y966	R526-D821 IonicContact NH2-OD1 2.91Å; Q784-D821 HydrophobicContact CB-CB 4.26Å; N818-D821 VanDerWaalsContact CG-OD2 3.24Å; N818-D821 PolarHBondContact N-OD2 3.19Å; N818-D821 PolarHBondContact ND2-OD2 2.89Å; N818-D821 PolarHBondContact O-N 3.45Å; N818-D821 PolarHBondContact OD1-N 3.26Å; N818-D821 PolarHBondContact OD1-OD2 3.24Å; F819-D821 VanDerWaalsContact C-N 3.34Å; F819-D821 PolarHBondContact O-N 2.56Å; D821-N825 WeakPolarHBondContact O-CB 3.14Å; D821-N825 PolarHBondContact O-N 3.28Å; D821-N825 PolarHBondContact O-ND2 3.33Å; D821-Y966 HydrophobicContact CB-CE1 4.3Å
822	L	88.2	Confident	77.3	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-43.8	173.5	-177.9	65.7	0	0	0	111.9	N818 F819 T820 Y826 M871 L904 L955 Y966 W972	N818-L822 PolarHBondContact O-N 3.12Å; F819-L822 WeakPolarHBondContact O-CB 3.39Å; F819-L822 PolarHBondContact O-N 3.06Å; T820-L822 PolarHBondContact O-N 3.14Å; L822-Y826 WeakPolarHBondContact O-CB 3.43Å; L822-Y826 PolarHBondContact O-N 3.15Å; L822-M871 HydrophobicContact CD1-SD 4.41Å; L822-L904 HydrophobicContact CD1-CD2 4.37Å; L822-L904 HydrophobicContact CD2-CD2 3.92Å; L822-L955 HydrophobicContact CD1-CD1 4.09Å; L822-Y966 HydrophobicContact CB-CD1 4.19Å; L822-Y966 HydrophobicContact CB-CE1 3.79Å; L822-Y966 HydrophobicContact CD1-CE1 4.25Å; L822-Y966 HydrophobicContact CD1-CE2 4.05Å; L822-W972 HydrophobicContact CD2-CH2 3.9Å; L822-W972 HydrophobicContact CD2-CZ3 3.64Å
823	I	88	Confident	80	Confident	16 Å²	16	27.9 Å²	27.9	8%	0.082	14%	0.138	C	C	.	.	H	α-helix	trans	-58.8	-49.8	174.5	-68.9	167.8	0	0	0	111	L563 F819 T820 Y826 A827 V1029	L563-I823 HydrophobicContact CB-CG2 4.1Å; L563-I823 HydrophobicContact CD1-CG2 3.86Å; L563-I823 HydrophobicContact CD2-CG2 4.15Å; L563-I823 HydrophobicContact CG-CG2 4.26Å; F819-I823 HydrophobicContact CD1-CD1 4.01Å; F819-I823 HydrophobicContact CE1-CD1 3.32Å; F819-I823 HydrophobicContact CE1-CG1 4.05Å; F819-I823 HydrophobicContact CE2-CD1 4.13Å; F819-I823 HydrophobicContact CE2-CG1 3.91Å; F819-I823 HydrophobicContact CZ-CD1 3.35Å; F819-I823 HydrophobicContact CZ-CG1 3.59Å; F819-I823 PolarHBondContact O-N 2.83Å; T820-I823 PolarHBondContact O-N 3.09Å; I823-Y826 WeakPolarHBondContact O-CB 3.33Å; I823-Y826 PolarHBondContact O-N 2.93Å; I823-A827 WeakPolarHBondContact O-CB 3.49Å; I823-A827 PolarHBondContact O-N 2.93Å; I823-V1029 HydrophobicContact CD1-CG2 4.25Å; I823-V1029 HydrophobicContact CG1-CG1 4.43Å; I823-V1029 HydrophobicContact CG1-CG2 4.44Å; I823-V1029 HydrophobicContact CG2-CG1 4.03Å
824	F	89.8	Confident	82.6	Confident	4 Å²	4	22 Å²	22	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-69.1	-38.2	-175.6	-65.9	-46.2	0	0	0	111.9	R526 L563 E565 V781 Q784 T820 Y828	R526-F824 WeakPolarHBondContact O-CZ 3.12Å; L563-F824 HydrophobicContact CB-CE1 4.17Å; L563-F824 WeakPolarHBondContact O-CE1 3.28Å; L563-F824 VanDerWaalsContact O-CZ 3.27Å; L563-F824 WeakPolarHBondContact O-CZ 3.42Å; E565-F824 HydrophobicContact CB-CE2 4.43Å; E565-F824 HydrophobicContact CB-CZ 4.4Å; V781-F824 HydrophobicContact CB-CB 4.3Å; V781-F824 HydrophobicContact CB-CD1 3.51Å; V781-F824 HydrophobicContact CB-CD2 4.31Å; V781-F824 HydrophobicContact CB-CE1 3.83Å; V781-F824 HydrophobicContact CB-CG 3.79Å; V781-F824 HydrophobicContact CB-CZ 4.35Å; V781-F824 HydrophobicContact CG1-CB 4.06Å; V781-F824 HydrophobicContact CG1-CD1 3.87Å; V781-F824 HydrophobicContact CG1-CD2 3.72Å; V781-F824 HydrophobicContact CG1-CE1 4.23Å; V781-F824 HydrophobicContact CG1-CE2 4.08Å; V781-F824 HydrophobicContact CG1-CG 3.61Å; V781-F824 HydrophobicContact CG1-CZ 4.33Å; V781-F824 HydrophobicContact CG2-CD1 3.66Å; V781-F824 HydrophobicContact CG2-CE1 3.4Å; V781-F824 VanDerWaalsContact CG2-CE1 3.4Å; V781-F824 HydrophobicContact CG2-CE2 4.36Å; V781-F824 HydrophobicContact CG2-CG 4.28Å; V781-F824 HydrophobicContact CG2-CZ 3.8Å; Q784-F824 HydrophobicContact CG-CB 4.3Å; Q784-F824 HydrophobicContact CG-CD2 4.42Å; T820-F824 HydrophobicContact CG2-CD2 3.97Å; T820-F824 HydrophobicContact CG2-CE2 3.33Å; T820-F824 HydrophobicContact CG2-CZ 3.73Å; T820-F824 WeakPolarHBondContact O-CD2 3.45Å; T820-F824 WeakPolarHBondContact O-CG 3.26Å; T820-F824 PolarHBondContact O-N 2.85Å; F824-Y828 VanDerWaalsContact O-CB 3.31Å; F824-Y828 WeakPolarHBondContact O-CB 3.47Å; F824-Y828 PolarHBondContact O-N 3.22Å
825	N	89.9	Confident	84.8	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-70.3	-32.5	174.4	-67.9	-18.8	0	0	0	112	F783 Q784 D821 E829 I964 Y966	F783-N825 HydrophobicContact CD2-CB 4.27Å; F783-N825 VanDerWaalsContact CD2-OD1 3.23Å; F783-N825 WeakPolarHBondContact CD2-OD1 3.15Å; F783-N825 HydrophobicContact CE2-CB 3.8Å; F783-N825 WeakPolarHBondContact CE2-OD1 3.39Å; F783-N825 HydrophobicContact CZ-CB 4.42Å; Q784-N825 PolarHBondContact N-OD1 3.04Å; Q784-N825 PolarHBondContact O-ND2 3.41Å; Q784-N825 PolarHBondContact O-OD1 3.05Å; D821-N825 WeakPolarHBondContact O-CB 3.14Å; D821-N825 PolarHBondContact O-N 3.28Å; D821-N825 PolarHBondContact O-ND2 3.33Å; N825-E829 WeakPolarHBondContact O-CG 3.21Å; N825-E829 PolarHBondContact O-N 3.08Å; N825-E829 VanDerWaalsContact O-N 3.15Å; N825-I964 WeakPolarHBondContact ND2-CD1 3.37Å; N825-Y966 PolarHBondContact ND2-OH 3.35Å; N825-Y966 VanDerWaalsContact ND2-OH 3.1Å
826	Y	90.1	Very high	86.1	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.8	-57.1	169.7	167.2	-113.7	0	0	0	111.7	L822 I823 Y828 E829 C830 L868 M871 D872 F905 V1029 M1033	L822-Y826 WeakPolarHBondContact O-CB 3.43Å; L822-Y826 PolarHBondContact O-N 3.15Å; I823-Y826 WeakPolarHBondContact O-CB 3.33Å; I823-Y826 PolarHBondContact O-N 2.93Å; Y826-Y828 PolarHBondContact O-N 3.27Å; Y826-E829 PolarHBondContact O-N 3.15Å; Y826-C830 WeakPolarHBondContact CE2-SG 3.45Å; Y826-C830 PolarHBondContact O-N 3.3Å; Y826-C830 PolarHBondContact O-SG 3.46Å; Y826-C830 VanDerWaalsContact O-SG 3.32Å; Y826-L868 HydrophobicContact CD2-CD2 3.94Å; Y826-L868 HydrophobicContact CE2-CD2 3.68Å; Y826-M871 HydrophobicContact CD2-CB 4.42Å; Y826-M871 HydrophobicContact CD2-CE 3.67Å; Y826-M871 HydrophobicContact CD2-SD 4.01Å; Y826-M871 HydrophobicContact CE2-CE 4.46Å; Y826-D872 WeakPolarHBondContact CE2-OD1 3.49Å; Y826-D872 WeakPolarHBondContact CE2-OD2 3.21Å; Y826-D872 VanDerWaalsContact OH-CG 3.29Å; Y826-D872 PolarHBondContact OH-OD1 2.74Å; Y826-D872 PolarHBondContact OH-OD2 3.02Å; Y826-F905 AromaticContact CD1-CE2 3.79Å; Y826-F905 HydrophobicContact CD1-CE2 3.79Å; Y826-F905 AromaticContact CD1-CZ 3.81Å; Y826-F905 HydrophobicContact CD1-CZ 3.81Å; Y826-F905 AromaticContact CD2-CE2 3.63Å; Y826-F905 HydrophobicContact CD2-CE2 3.63Å; Y826-F905 HydrophobicContact CD2-CZ 4.05Å; Y826-F905 AromaticContact CE1-CE2 3.88Å; Y826-F905 HydrophobicContact CE1-CE2 3.88Å; Y826-F905 HydrophobicContact CE1-CZ 4.33Å; Y826-F905 AromaticContact CE2-CE2 3.73Å; Y826-F905 HydrophobicContact CE2-CE2 3.73Å; Y826-F905 AromaticContact CG-CE2 3.65Å; Y826-F905 HydrophobicContact CG-CE2 3.65Å; Y826-F905 AromaticContact CG-CZ 3.64Å; Y826-F905 HydrophobicContact CG-CZ 3.64Å; Y826-F905 AromaticContact CZ-CE2 3.84Å; Y826-V1029 HydrophobicContact CD1-CG1 4.09Å; Y826-V1029 HydrophobicContact CE1-CG1 4.23Å; Y826-M1033 HydrophobicContact CE1-CB 4.18Å; Y826-M1033 HydrophobicContact CE1-CG 4Å
827	A	90.9	Very high	86.8	Confident	5 Å²	5	9.6 Å²	9.6	4%	0.041	5%	0.051	C	C	.	.	H	α-helix	trans	-57.4	-34.9	-179.9	0	0	0	0	0	111.9	L563 I823 C830 F831 M1033	L563-A827 HydrophobicContact CD1-CB 3.75Å; I823-A827 WeakPolarHBondContact O-CB 3.49Å; I823-A827 PolarHBondContact O-N 2.93Å; A827-C830 WeakPolarHBondContact O-CB 3.47Å; A827-C830 PolarHBondContact O-N 2.95Å; A827-F831 WeakPolarHBondContact O-CD2 3.29Å; A827-F831 PolarHBondContact O-N 2.97Å; A827-F831 VanDerWaalsContact O-N 3.11Å; A827-M1033 HydrophobicContact CB-CE 3.88Å; A827-M1033 HydrophobicContact CB-CG 4.3Å; A827-M1033 HydrophobicContact CB-SD 3.81Å
828	Y	89.8	Confident	87.4	Confident	3 Å²	3	9.5 Å²	9.5	1%	0.012	5%	0.05	C	C	.	.	H	α-helix	trans	-62.3	-46.2	173	-160.3	-69.8	0	0	0	112.4	L453 G454 F783 F824 Y826 C830 F831 N832 L959	L453-Y828 WeakPolarHBondContact CB-OH 3.36Å; L453-Y828 HydrophobicContact CD2-CD2 4.46Å; L453-Y828 HydrophobicContact CD2-CE1 4.19Å; L453-Y828 HydrophobicContact CD2-CE2 3.98Å; G454-Y828 WeakPolarHBondContact CA-OH 3.32Å; G454-Y828 PolarHBondContact N-OH 2.95Å; F783-Y828 HydrophobicContact CB-CD2 3.81Å; F783-Y828 HydrophobicContact CB-CE2 3.96Å; F783-Y828 HydrophobicContact CB-CG 4.21Å; F783-Y828 HydrophobicContact CD2-CD1 4.26Å; F783-Y828 HydrophobicContact CD2-CD2 4.48Å; F783-Y828 HydrophobicContact CD2-CG 4.04Å; F824-Y828 VanDerWaalsContact O-CB 3.31Å; F824-Y828 WeakPolarHBondContact O-CB 3.47Å; F824-Y828 PolarHBondContact O-N 3.22Å; Y826-Y828 PolarHBondContact O-N 3.27Å; Y828-C830 VanDerWaalsContact C-N 3.3Å; Y828-C830 PolarHBondContact O-N 2.8Å; Y828-F831 PolarHBondContact O-N 2.93Å; Y828-F831 VanDerWaalsContact O-N 3.16Å; Y828-N832 WeakPolarHBondContact CE1-OD1 3.18Å; Y828-N832 PolarHBondContact O-N 3.19Å; Y828-L959 HydrophobicContact CD1-CD1 4.34Å; Y828-L959 HydrophobicContact CE1-CD1 3.31Å; Y828-L959 VanDerWaalsContact CZ-CD1 3.42Å; Y828-L959 WeakPolarHBondContact OH-CD1 2.93Å
829	E	88	Confident	87.5	Confident	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-66.1	-32	176.5	-60.8	-70.1	-163.9	0	0	111.6	N825 Y826 F831 N832 Q833 T864 I867 L868 H957 N958	N825-E829 WeakPolarHBondContact O-CG 3.21Å; N825-E829 PolarHBondContact O-N 3.08Å; N825-E829 VanDerWaalsContact O-N 3.15Å; Y826-E829 PolarHBondContact O-N 3.15Å; E829-F831 VanDerWaalsContact C-N 3.34Å; E829-F831 PolarHBondContact O-N 3.31Å; E829-N832 WeakPolarHBondContact O-CB 3.28Å; E829-N832 PolarHBondContact O-N 3.39Å; E829-N832 PolarHBondContact OE2-ND2 3.12Å; E829-Q833 WeakPolarHBondContact O-CB 3.44Å; E829-Q833 PolarHBondContact O-N 3.35Å; E829-T864 HydrophobicContact CB-CG2 4.01Å; E829-T864 WeakPolarHBondContact O-CG2 3.33Å; E829-I867 HydrophobicContact CB-CG2 4.34Å; E829-I867 HydrophobicContact CG-CG2 4.05Å; E829-L868 HydrophobicContact CB-CD2 3.92Å; E829-L868 HydrophobicContact CB-CG 4.31Å; E829-H957 WeakPolarHBondContact OE1-CA 3.41Å; E829-H957 WeakPolarHBondContact OE1-CB 3.47Å; E829-H957 IonicContact OE1-ND1 2.87Å; E829-N958 PolarHBondContact OE1-N 2.8Å; E829-N958 PolarHBondContact OE2-ND2 3.2Å
830	C	90.4	Very high	87.6	Confident	12 Å²	12	7.1 Å²	7.1	8%	0.081	4%	0.038	C	C	.	.	H	α-helix	trans	-60.7	-41.3	170.5	-56.8	0	0	0	0	112	Y826 A827 Y828 Q833 L834 M1033 T1037	Y826-C830 WeakPolarHBondContact CE2-SG 3.45Å; Y826-C830 PolarHBondContact O-N 3.3Å; Y826-C830 PolarHBondContact O-SG 3.46Å; Y826-C830 VanDerWaalsContact O-SG 3.32Å; A827-C830 WeakPolarHBondContact O-CB 3.47Å; A827-C830 PolarHBondContact O-N 2.95Å; Y828-C830 VanDerWaalsContact C-N 3.3Å; Y828-C830 PolarHBondContact O-N 2.8Å; C830-Q833 PolarHBondContact O-N 3.29Å; C830-L834 PolarHBondContact O-N 2.82Å; C830-M1033 HydrophobicContact CB-CE 3.84Å; C830-T1037 HydrophobicContact CB-CG2 4.19Å
831	F	91.4	Very high	87.7	Confident	2 Å²	2	8.4 Å²	8.4	1%	0.009	4%	0.044	C	C	.	.	H	α-helix	trans	-71.6	-35.1	174.8	-70.5	-63.3	0	0	0	113.1	L453 L528 V778 P780 A827 Y828 E829 Q833 L834 Y835 M1033 L1036 L1040 W1070	L453-F831 HydrophobicContact CD2-CB 3.8Å; L453-F831 HydrophobicContact CD2-CG 4.5Å; L528-F831 HydrophobicContact CD1-CE2 3.94Å; L528-F831 HydrophobicContact CD1-CZ 4.01Å; V778-F831 HydrophobicContact CG1-CE1 3.98Å; V778-F831 HydrophobicContact CG1-CZ 3.7Å; P780-F831 HydrophobicContact CB-CD2 4.13Å; P780-F831 HydrophobicContact CB-CE2 3.78Å; P780-F831 HydrophobicContact CG-CD2 4.31Å; P780-F831 HydrophobicContact CG-CE2 4.31Å; A827-F831 WeakPolarHBondContact O-CD2 3.29Å; A827-F831 PolarHBondContact O-N 2.97Å; A827-F831 VanDerWaalsContact O-N 3.11Å; Y828-F831 PolarHBondContact O-N 2.93Å; Y828-F831 VanDerWaalsContact O-N 3.16Å; E829-F831 VanDerWaalsContact C-N 3.34Å; E829-F831 PolarHBondContact O-N 3.31Å; F831-Q833 VanDerWaalsContact C-N 3.28Å; F831-Q833 PolarHBondContact O-N 3.21Å; F831-L834 HydrophobicContact CD1-CD2 4.31Å; F831-L834 PolarHBondContact O-N 2.91Å; F831-Y835 WeakPolarHBondContact O-CB 3.43Å; F831-Y835 PolarHBondContact O-N 3.27Å; F831-M1033 HydrophobicContact CD2-CE 4.27Å; F831-M1033 HydrophobicContact CE2-CE 3.77Å; F831-M1033 HydrophobicContact CZ-CE 3.92Å; F831-L1036 HydrophobicContact CE1-CD2 4.35Å; F831-L1036 HydrophobicContact CZ-CD2 3.82Å; F831-L1040 HydrophobicContact CE1-CD1 4.17Å; F831-W1070 WeakPolarHBondContact O-CH2 3.3Å
832	N	86.7	Confident	87.6	Confident	3 Å²	3	8.2 Å²	8.2	2%	0.016	4%	0.044	C	C	.	.	H	α-helix	trans	-58.9	-41.5	169.4	-80.2	-21	0	0	0	111	Y828 E829 Y835 F836 T864	Y828-N832 WeakPolarHBondContact CE1-OD1 3.18Å; Y828-N832 PolarHBondContact O-N 3.19Å; E829-N832 WeakPolarHBondContact O-CB 3.28Å; E829-N832 PolarHBondContact O-N 3.39Å; E829-N832 PolarHBondContact OE2-ND2 3.12Å; N832-Y835 WeakPolarHBondContact O-CB 3.4Å; N832-Y835 PolarHBondContact O-N 2.8Å; N832-F836 WeakPolarHBondContact O-CD2 3.2Å; N832-F836 WeakPolarHBondContact O-CE2 3.49Å; N832-F836 PolarHBondContact O-N 3.19Å; N832-T864 HydrophobicContact CB-CG2 3.88Å
833	Q	86.9	Confident	87.2	Confident	17 Å²	17	9 Å²	9	8%	0.079	5%	0.047	C	C	.	.	H	α-helix	trans	-65.9	-48.4	177.5	-175.6	58	57.5	0	0	111.3	E829 C830 F831 Y835 F836 D837 Y858 T864 L868	E829-Q833 WeakPolarHBondContact O-CB 3.44Å; E829-Q833 PolarHBondContact O-N 3.35Å; C830-Q833 PolarHBondContact O-N 3.29Å; F831-Q833 VanDerWaalsContact C-N 3.28Å; F831-Q833 PolarHBondContact O-N 3.21Å; Q833-Y835 PolarHBondContact O-N 3.34Å; Q833-F836 PolarHBondContact O-N 3.13Å; Q833-D837 PolarHBondContact NE2-OD1 3.07Å; Q833-D837 PolarHBondContact NE2-OD2 3.33Å; Q833-D837 PolarHBondContact O-N 2.96Å; Q833-Y858 PolarHBondContact NE2-OH 3.21Å; Q833-T864 HydrophobicContact CB-CG2 3.99Å; Q833-L868 HydrophobicContact CB-CD1 3.5Å; Q833-L868 VanDerWaalsContact CB-CD1 3.5Å; Q833-L868 HydrophobicContact CG-CD1 3.77Å
834	L	90	Very high	87	Confident	5 Å²	5	9.4 Å²	9.4	3%	0.026	5%	0.049	C	C	.	.	H	α-helix	trans	-57.7	-32.6	174	-179.1	62.8	0	0	0	112.7	C830 F831 D837 S838 T1037 L1040 Y1041 M1068 W1070	C830-L834 PolarHBondContact O-N 2.82Å; F831-L834 HydrophobicContact CD1-CD2 4.31Å; F831-L834 PolarHBondContact O-N 2.91Å; L834-D837 PolarHBondContact O-N 3.2Å; L834-S838 VanDerWaalsContact O-CB 3.22Å; L834-S838 WeakPolarHBondContact O-CB 3.38Å; L834-S838 PolarHBondContact O-N 2.95Å; L834-S838 PolarHBondContact O-OG 2.82Å; L834-T1037 HydrophobicContact CD2-CG2 4.3Å; L834-L1040 HydrophobicContact CD2-CB 3.96Å; L834-L1040 HydrophobicContact CD2-CD1 4.12Å; L834-Y1041 HydrophobicContact CD1-CD2 4.23Å; L834-M1068 HydrophobicContact CD1-CE 4.06Å; L834-M1068 HydrophobicContact CD2-CE 4.18Å; L834-M1068 HydrophobicContact CD2-SD 4.32Å; L834-M1068 HydrophobicContact CG-CE 3.89Å; L834-W1070 HydrophobicContact CB-CH2 4.44Å; L834-W1070 HydrophobicContact CD2-CH2 4.4Å; L834-W1070 HydrophobicContact CG-CH2 4.31Å; L834-W1070 HydrophobicContact CG-CZ2 4.2Å
835	Y	88.7	Confident	86.8	Confident	2 Å²	2	12.4 Å²	12.4	1%	0.008	6%	0.063	C	C	.	.	H	α-helix	trans	-64.8	-41.6	173.9	163.5	-100.5	0	0	0	112.8	N370 F831 N832 Q833 S838 N839 W1070 H1072 T1162	N370-Y835 PolarHBondContact ND2-OH 3.31Å; N370-Y835 WeakPolarHBondContact OD1-CE2 3.38Å; F831-Y835 WeakPolarHBondContact O-CB 3.43Å; F831-Y835 PolarHBondContact O-N 3.27Å; N832-Y835 WeakPolarHBondContact O-CB 3.4Å; N832-Y835 PolarHBondContact O-N 2.8Å; Q833-Y835 PolarHBondContact O-N 3.34Å; Y835-S838 PolarHBondContact O-OG 3.45Å; Y835-N839 VanDerWaalsContact CD2-ND2 3.34Å; Y835-N839 WeakPolarHBondContact CD2-ND2 3.38Å; Y835-N839 WeakPolarHBondContact O-CB 3.49Å; Y835-N839 PolarHBondContact O-N 3.37Å; Y835-N839 PolarHBondContact O-ND2 3.21Å; Y835-W1070 VanDerWaalsContact CA-CZ2 3.44Å; Y835-W1070 HydrophobicContact CD2-CB 4.41Å; Y835-W1070 AromaticContact CD2-CD1 3.95Å; Y835-W1070 AromaticContact CD2-CD2 3.78Å; Y835-W1070 HydrophobicContact CD2-CD2 3.78Å; Y835-W1070 AromaticContact CD2-CE2 3.91Å; Y835-W1070 HydrophobicContact CD2-CE3 4.32Å; Y835-W1070 AromaticContact CD2-CG 3.81Å; Y835-W1070 HydrophobicContact CD2-CG 3.81Å; Y835-W1070 AromaticContact CD2-NE1 3.98Å; Y835-W1070 HydrophobicContact CE2-CG 4.36Å; Y835-H1072 AromaticContact CE2-CE1 3.99Å; Y835-H1072 AromaticContact CE2-NE2 3.64Å; Y835-T1162 HydrophobicContact CE1-CG2 4.44Å; Y835-T1162 WeakPolarHBondContact OH-CB 3.33Å; Y835-T1162 WeakPolarHBondContact OH-CG2 3.44Å; Y835-T1162 PolarHBondContact OH-OG1 2.76Å
836	F	85.3	Confident	86.4	Confident	5 Å²	5	12.7 Å²	12.7	2%	0.022	6%	0.064	C	C	.	.	H	α-helix	trans	-71.9	-39.1	173.1	-62.3	-66.9	0	0	0	112	N832 Q833 S838 N839 I840 L841 E1158	N832-F836 WeakPolarHBondContact O-CD2 3.2Å; N832-F836 WeakPolarHBondContact O-CE2 3.49Å; N832-F836 PolarHBondContact O-N 3.19Å; Q833-F836 PolarHBondContact O-N 3.13Å; F836-S838 PolarHBondContact O-N 2.94Å; F836-N839 PolarHBondContact O-N 3.42Å; F836-I840 HydrophobicContact CD1-CD1 3.97Å; F836-I840 WeakPolarHBondContact O-CA 3.45Å; F836-I840 WeakPolarHBondContact O-CB 3.31Å; F836-I840 PolarHBondContact O-N 3.09Å; F836-L841 PolarHBondContact O-N 3.22Å; F836-E1158 HydrophobicContact CE1-CB 4.39Å; F836-E1158 HydrophobicContact CZ-CB 4.01Å; F836-E1158 HydrophobicContact CZ-CG 4.24Å
837	D	86.8	Confident	86.2	Confident	29 Å²	29	12.7 Å²	12.7	16%	0.155	6%	0.064	C	C	.	.	I	π-helix	trans	-65.8	-40.3	-179.1	-61.4	-24.9	0	0	0	111.5	Q833 L834 N839 L841 L842 Y858 Y1041	Q833-D837 PolarHBondContact NE2-OD1 3.07Å; Q833-D837 PolarHBondContact NE2-OD2 3.33Å; Q833-D837 PolarHBondContact O-N 2.96Å; L834-D837 PolarHBondContact O-N 3.2Å; D837-N839 PolarHBondContact O-N 2.88Å; D837-L841 HydrophobicContact CB-CB 4.48Å; D837-L841 HydrophobicContact CB-CD2 4.41Å; D837-L841 WeakPolarHBondContact O-CB 3.12Å; D837-L841 PolarHBondContact O-N 2.99Å; D837-L842 PolarHBondContact O-N 2.84Å; D837-Y858 WeakPolarHBondContact OD1-CE2 3.43Å; D837-Y858 VanDerWaalsContact OD1-CZ 3.25Å; D837-Y858 PolarHBondContact OD1-OH 3.38Å; D837-Y1041 HydrophobicContact CB-CD2 4.17Å; D837-Y1041 HydrophobicContact CB-CE2 4Å
838	S	86.2	Confident	86	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.088	C	C	.	.	I	π-helix	trans	-78.4	-14	-178.8	60	0	0	0	0	115.8	L834 Y835 F836 S1066 M1068 W1070	L834-S838 VanDerWaalsContact O-CB 3.22Å; L834-S838 WeakPolarHBondContact O-CB 3.38Å; L834-S838 PolarHBondContact O-N 2.95Å; L834-S838 PolarHBondContact O-OG 2.82Å; Y835-S838 PolarHBondContact O-OG 3.45Å; F836-S838 PolarHBondContact O-N 2.94Å; S838-S1066 WeakPolarHBondContact O-CB 3.24Å; S838-S1066 PolarHBondContact O-OG 2.96Å; S838-M1068 WeakPolarHBondContact OG-CE 3.49Å; S838-W1070 PolarHBondContact OG-NE1 2.87Å
839	N	81.6	Confident	85.7	Confident	7 Å²	7	24 Å²	24	4%	0.037	11%	0.114	C	C	.	.	I	π-helix	trans	-120.6	-27.2	-175.8	-65.5	-58.8	0	0	0	114.3	I369 Y835 F836 D837 W1070	I369-N839 WeakPolarHBondContact CG2-OD1 3.38Å; Y835-N839 VanDerWaalsContact CD2-ND2 3.34Å; Y835-N839 WeakPolarHBondContact CD2-ND2 3.38Å; Y835-N839 WeakPolarHBondContact O-CB 3.49Å; Y835-N839 PolarHBondContact O-N 3.37Å; Y835-N839 PolarHBondContact O-ND2 3.21Å; F836-N839 PolarHBondContact O-N 3.42Å; D837-N839 PolarHBondContact O-N 2.88Å; N839-W1070 PolarHBondContact ND2-NE1 3Å
840	I	82.1	Confident	85.5	Confident	13 Å²	13	24.4 Å²	24.4	7%	0.067	12%	0.116	C	C	.	.	I	π-helix	trans	-110.5	-50.5	178.8	-52.7	-177.9	0	0	0	110.5	F836 D843 E844 Y858 F861 T1162 A1165	F836-I840 HydrophobicContact CD1-CD1 3.97Å; F836-I840 WeakPolarHBondContact O-CA 3.45Å; F836-I840 WeakPolarHBondContact O-CB 3.31Å; F836-I840 PolarHBondContact O-N 3.09Å; I840-D843 PolarHBondContact O-N 3.47Å; I840-E844 PolarHBondContact O-N 3.41Å; I840-Y858 HydrophobicContact CB-CD2 4.37Å; I840-Y858 HydrophobicContact CG2-CD2 4.3Å; I840-F861 HydrophobicContact CD1-CB 4.25Å; I840-F861 HydrophobicContact CD1-CD1 4.07Å; I840-F861 HydrophobicContact CD1-CD2 4.4Å; I840-F861 HydrophobicContact CD1-CG 3.95Å; I840-T1162 HydrophobicContact CD1-CG2 4.38Å; I840-A1165 HydrophobicContact CD1-CB 4.44Å
841	L	84.7	Confident	85.2	Confident	38 Å²	38	27.2 Å²	27.2	20%	0.199	15%	0.147	C	C	.	.	I	π-helix	trans	-67.2	-42.8	-177	-176.6	62.2	0	0	0	112.2	F836 D837 D843 E844 Q845 Y858	F836-L841 PolarHBondContact O-N 3.22Å; D837-L841 HydrophobicContact CB-CB 4.48Å; D837-L841 HydrophobicContact CB-CD2 4.41Å; D837-L841 WeakPolarHBondContact O-CB 3.12Å; D837-L841 PolarHBondContact O-N 2.99Å; L841-D843 VanDerWaalsContact C-N 3.28Å; L841-D843 PolarHBondContact O-N 3.43Å; L841-E844 PolarHBondContact O-N 3.04Å; L841-Q845 WeakPolarHBondContact O-CB 3.49Å; L841-Q845 VanDerWaalsContact O-CG 3.29Å; L841-Q845 WeakPolarHBondContact O-CG 3.48Å; L841-Q845 PolarHBondContact O-N 3.28Å; L841-Y858 HydrophobicContact CB-CD2 3.69Å; L841-Y858 HydrophobicContact CB-CE2 3.77Å; L841-Y858 HydrophobicContact CB-CG 4.27Å; L841-Y858 HydrophobicContact CD1-CD1 4.08Å; L841-Y858 HydrophobicContact CD1-CD2 4.31Å; L841-Y858 HydrophobicContact CD1-CE1 4.36Å; L841-Y858 HydrophobicContact CD1-CG 4.04Å; L841-Y858 HydrophobicContact CD2-CE2 4.4Å; L841-Y858 HydrophobicContact CG-CD2 4.49Å; L841-Y858 HydrophobicContact CG-CE2 4.46Å
842	L	83.7	Confident	85	Confident	12 Å²	12	28.4 Å²	28.4	6%	0.063	15%	0.154	C	C	.	.	H	α-helix	trans	-62.4	-32.9	172.5	-76.8	179.5	0	0	0	112.6	D837 R846 Y1041 A1044 A1045 A1048	D837-L842 PolarHBondContact O-N 2.84Å; L842-R846 WeakPolarHBondContact O-CB 3.43Å; L842-R846 PolarHBondContact O-N 2.99Å; L842-Y1041 HydrophobicContact CD1-CE2 4.43Å; L842-Y1041 HydrophobicContact CD2-CE1 4.37Å; L842-Y1041 HydrophobicContact CD2-CE2 4.19Å; L842-Y1041 VanDerWaalsContact CD2-OH 3.29Å; L842-Y1041 WeakPolarHBondContact CD2-OH 3.37Å; L842-Y1041 HydrophobicContact CG-CE2 4.03Å; L842-A1044 HydrophobicContact CD1-CB 4.22Å; L842-A1045 HydrophobicContact CD2-CB 4.08Å; L842-A1048 HydrophobicContact CD1-CB 4.12Å
843	D	80.1	Confident	84.8	Confident	15 Å²	15	33.7 Å²	33.7	8%	0.08	19%	0.186	C	C	.	.	H	α-helix	trans	-70.3	-44.4	175.8	-167.3	17	0	0	0	111.4	I840 L841 Q845 R846 L847 S1169	I840-D843 PolarHBondContact O-N 3.47Å; L841-D843 VanDerWaalsContact C-N 3.28Å; L841-D843 PolarHBondContact O-N 3.43Å; D843-Q845 PolarHBondContact O-N 3.37Å; D843-R846 WeakPolarHBondContact O-CB 3.29Å; D843-R846 PolarHBondContact O-N 3.04Å; D843-R846 IonicContact OD1-CZ 3.56Å; D843-R846 VanDerWaalsContact OD1-CZ 3.22Å; D843-R846 IonicContact OD1-NE 2.63Å; D843-R846 PolarHBondContact OD1-NE 2.96Å; D843-R846 IonicContact OD1-NH2 3.5Å; D843-R846 PolarHBondContact OD1-NH2 3.14Å; D843-R846 IonicContact OD2-NH2 2.67Å; D843-L847 WeakPolarHBondContact O-CG 3.41Å; D843-L847 PolarHBondContact O-N 3.21Å; D843-S1169 VanDerWaalsContact OD2-CB 3.32Å; D843-S1169 WeakPolarHBondContact OD2-CB 3.28Å; D843-S1169 PolarHBondContact OD2-OG 3.45Å
844	E	84.9	Confident	84.4	Confident	25 Å²	25	34.2 Å²	34.2	12%	0.117	19%	0.192	C	C	.	.	H	α-helix	trans	-61.8	-41.2	174.7	-173.5	-179.8	136.6	0	0	112.1	I840 L841 K848 Y858	I840-E844 PolarHBondContact O-N 3.41Å; L841-E844 PolarHBondContact O-N 3.04Å; E844-K848 HydrophobicContact CG-CD 4.12Å; E844-K848 WeakPolarHBondContact O-CB 3.43Å; E844-K848 VanDerWaalsContact O-CG 3.27Å; E844-K848 WeakPolarHBondContact O-CG 3.41Å; E844-K848 PolarHBondContact O-N 3.37Å; E844-K848 WeakPolarHBondContact OE1-CE 3.45Å; E844-K848 IonicContact OE1-NZ 3.13Å; E844-K848 PolarHBondContact OE1-NZ 3.4Å; E844-Y858 VanDerWaalsContact OE2-CB 3.28Å; E844-Y858 WeakPolarHBondContact OE2-CB 3.1Å; E844-Y858 PolarHBondContact OE2-N 3.14Å
845	Q	85.1	Confident	83.7	Confident	67 Å²	67	36.8 Å²	36.8	31%	0.313	21%	0.209	S	C	.	.	H	α-helix	trans	-64.1	-41.9	174.1	-72.7	174.8	14.9	0	0	111.8	L841 D843 K848 H849 Y1041	L841-Q845 WeakPolarHBondContact O-CB 3.49Å; L841-Q845 VanDerWaalsContact O-CG 3.29Å; L841-Q845 WeakPolarHBondContact O-CG 3.48Å; L841-Q845 PolarHBondContact O-N 3.28Å; D843-Q845 PolarHBondContact O-N 3.37Å; Q845-K848 PolarHBondContact O-N 2.72Å; Q845-H849 WeakPolarHBondContact O-CB 3.35Å; Q845-H849 PolarHBondContact O-N 3.47Å; Q845-Y1041 PolarHBondContact NE2-OH 2.97Å; Q845-Y1041 PolarHBondContact OE1-OH 3.06Å
846	R	82.1	Confident	82.8	Confident	6 Å²	6	37.4 Å²	37.4	2%	0.023	21%	0.212	C	C	.	.	H	α-helix	trans	-60.4	-47.8	176.2	-179.9	-175.9	71.6	131.7	5.8	112	L842 D843 H849 D850 F1059 Y1170 P1171 R1173 Y1229	L842-R846 WeakPolarHBondContact O-CB 3.43Å; L842-R846 PolarHBondContact O-N 2.99Å; D843-R846 WeakPolarHBondContact O-CB 3.29Å; D843-R846 PolarHBondContact O-N 3.04Å; D843-R846 IonicContact OD1-CZ 3.56Å; D843-R846 VanDerWaalsContact OD1-CZ 3.22Å; D843-R846 IonicContact OD1-NE 2.63Å; D843-R846 PolarHBondContact OD1-NE 2.96Å; D843-R846 IonicContact OD1-NH2 3.5Å; D843-R846 PolarHBondContact OD1-NH2 3.14Å; D843-R846 IonicContact OD2-NH2 2.67Å; R846-H849 PolarHBondContact O-N 3.41Å; R846-D850 PolarHBondContact O-N 2.81Å; R846-F1059 VanDerWaalsContact NH1-CD1 3.3Å; R846-Y1170 PolarHBondContact NH2-O 2.79Å; R846-P1171 PolarHBondContact NH1-O 2.8Å; R846-P1171 PolarHBondContact NH2-O 3.27Å; R846-R1173 VanDerWaalsContact NH1-CD 3.29Å; R846-Y1229 HydrophobicContact CG-CE1 3.99Å
847	L	84.9	Confident	82.2	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.9	-46	176.9	-70.2	172	0	0	0	111.4	D843 H849 D850 G851 L852 Y1229	D843-L847 WeakPolarHBondContact O-CG 3.41Å; D843-L847 PolarHBondContact O-N 3.21Å; L847-H849 VanDerWaalsContact C-N 3.32Å; L847-H849 PolarHBondContact O-N 3.49Å; L847-D850 PolarHBondContact O-N 2.63Å; L847-G851 PolarHBondContact O-N 2.86Å; L847-L852 CarbonylContact C-O 3.56Å; L847-L852 VanDerWaalsContact C-O 3.29Å; L847-L852 HydrophobicContact CB-CB 4.15Å; L847-L852 HydrophobicContact CD2-CB 4.23Å; L847-L852 HydrophobicContact CD2-CD1 3.85Å; L847-L852 WeakPolarHBondContact O-CB 3.32Å; L847-L852 PolarHBondContact O-N 3.36Å; L847-Y1229 HydrophobicContact CD2-CD1 3.66Å; L847-Y1229 HydrophobicContact CD2-CD2 4.41Å; L847-Y1229 HydrophobicContact CD2-CE1 3.95Å; L847-Y1229 HydrophobicContact CD2-CG 3.93Å
848	K	86.2	Confident	81.5	Confident	126 Å²	126	39.6 Å²	39.6	55%	0.548	23%	0.227	S	C	.	.	H	α-helix	trans	-59.2	-39.3	177.1	-77.7	173	172.2	175.8	0	112.8	E844 Q845 D850 G851 L852	E844-K848 HydrophobicContact CG-CD 4.12Å; E844-K848 WeakPolarHBondContact O-CB 3.43Å; E844-K848 VanDerWaalsContact O-CG 3.27Å; E844-K848 WeakPolarHBondContact O-CG 3.41Å; E844-K848 PolarHBondContact O-N 3.37Å; E844-K848 WeakPolarHBondContact OE1-CE 3.45Å; E844-K848 IonicContact OE1-NZ 3.13Å; E844-K848 PolarHBondContact OE1-NZ 3.4Å; Q845-K848 PolarHBondContact O-N 2.72Å; K848-D850 VanDerWaalsContact C-N 3.26Å; K848-D850 PolarHBondContact O-N 2.62Å; K848-G851 PolarHBondContact O-N 3.36Å; K848-G851 VanDerWaalsContact O-N 3.16Å; K848-L852 WeakPolarHBondContact CA-O 3.28Å; K848-L852 PolarHBondContact N-O 3.5Å
849	H	84.3	Confident	80.6	Confident	119 Å²	119	47.2 Å²	47.2	55%	0.551	26%	0.262	S	S	*	.	H	α-helix	trans	-62	-31.7	176	-173.9	-55.1	0	0	0	112.5	Q845 R846 L847 G851 Y1050	Q845-H849 WeakPolarHBondContact O-CB 3.35Å; Q845-H849 PolarHBondContact O-N 3.47Å; R846-H849 PolarHBondContact O-N 3.41Å; L847-H849 VanDerWaalsContact C-N 3.32Å; L847-H849 PolarHBondContact O-N 3.49Å; H849-G851 VanDerWaalsContact C-N 3.32Å; H849-Y1050 HydrophobicContact CB-CD1 3.59Å; H849-Y1050 HydrophobicContact CB-CE1 3.74Å; H849-Y1050 HydrophobicContact CB-CG 4.42Å; H849-Y1050 AromaticContact CD2-CD1 3.4Å; H849-Y1050 WeakPolarHBondContact CD2-CD1 3.45Å; H849-Y1050 AromaticContact CD2-CD2 3.67Å; H849-Y1050 AromaticContact CD2-CE1 3.72Å; H849-Y1050 AromaticContact CD2-CE2 3.98Å; H849-Y1050 AromaticContact CD2-CG 3.37Å; H849-Y1050 AromaticContact CG-CD1 3.51Å; H849-Y1050 AromaticContact CG-CE1 3.96Å; H849-Y1050 AromaticContact CG-CG 3.84Å; H849-Y1050 AromaticContact NE2-CD2 3.94Å; H849-Y1050 AromaticContact NE2-CG 3.74Å
850	D	84.4	Confident	79.9	Confident	9 Å²	9	52.7 Å²	52.7	5%	0.048	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	5.3	178.5	-119.7	-44.2	0	0	0	113.8	R846 L847 K848 G1224 S1225 N1226 N1227 Y1229	R846-D850 PolarHBondContact O-N 2.81Å; L847-D850 PolarHBondContact O-N 2.63Å; K848-D850 VanDerWaalsContact C-N 3.26Å; K848-D850 PolarHBondContact O-N 2.62Å; D850-G1224 WeakPolarHBondContact O-CA 3.32Å; D850-S1225 PolarHBondContact O-N 3.38Å; D850-S1225 WeakPolarHBondContact OD1-CA 3.49Å; D850-S1225 WeakPolarHBondContact OD1-CB 3.07Å; D850-S1225 PolarHBondContact OD1-N 2.87Å; D850-S1225 PolarHBondContact OD1-OG 3.31Å; D850-N1226 PolarHBondContact OD1-N 2.9Å; D850-N1227 PolarHBondContact OD2-ND2 3.49Å; D850-Y1229 HydrophobicContact CB-CE2 3.87Å; D850-Y1229 WeakPolarHBondContact OD2-CE2 3.42Å; D850-Y1229 VanDerWaalsContact OD2-CZ 3.31Å; D850-Y1229 PolarHBondContact OD2-OH 3.03Å
851	G	83.9	Confident	79.1	Confident	71 Å²	71	53.3 Å²	53.3	73%	0.732	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	14.7	-178	0	0	0	0	0	114.8	L847 K848 H849	L847-G851 PolarHBondContact O-N 2.86Å; K848-G851 PolarHBondContact O-N 3.36Å; K848-G851 VanDerWaalsContact O-N 3.16Å; H849-G851 VanDerWaalsContact C-N 3.32Å
852	L	85.9	Confident	77.8	Confident	28 Å²	28	52.5 Å²	52.5	15%	0.147	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-99.8	147.4	179.9	-61.5	173.7	0	0	0	111.4	L847 K848 Q1222 Y1229	L847-L852 CarbonylContact C-O 3.56Å; L847-L852 VanDerWaalsContact C-O 3.29Å; L847-L852 HydrophobicContact CB-CB 4.15Å; L847-L852 HydrophobicContact CD2-CB 4.23Å; L847-L852 HydrophobicContact CD2-CD1 3.85Å; L847-L852 WeakPolarHBondContact O-CB 3.32Å; L847-L852 PolarHBondContact O-N 3.36Å; K848-L852 WeakPolarHBondContact CA-O 3.28Å; K848-L852 PolarHBondContact N-O 3.5Å; L852-Q1222 HydrophobicContact CD1-CB 3.86Å; L852-Q1222 HydrophobicContact CD2-CB 4.2Å; L852-Y1229 HydrophobicContact CD1-CD2 3.49Å; L852-Y1229 VanDerWaalsContact CD1-CD2 3.49Å; L852-Y1229 HydrophobicContact CD1-CE2 3.89Å; L852-Y1229 HydrophobicContact CD1-CG 4.14Å
853	T	83.4	Confident	77	Confident	114 Å²	114	58.4 Å²	58.4	70%	0.699	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-87.6	132.5	168.3	43.1	0	0	0	0	110.1
854	S	77.8	Confident	76.7	Confident	28 Å²	28	57.8 Å²	57.8	20%	0.196	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-61.4	134.9	167.1	-179.3	0	0	0	0	109.2	I856	S854-I856 WeakPolarHBondContact CB-O 3.45Å; S854-I856 PolarHBondContact O-N 3.06Å; S854-I856 PolarHBondContact OG-N 3.42Å; S854-I856 PolarHBondContact OG-O 2.91Å
855	P	75	Confident	76.3	Confident	59 Å²	59	60.5 Å²	60.5	38%	0.383	32%	0.321	S	S	.	.	S	Bend	trans	-65.4	-13.7	172.5	28.1	-34	0	0	0	112.3	Q1168 Y1170	P855-Q1168 VanDerWaalsContact CG-O 3.3Å; P855-Q1168 WeakPolarHBondContact CG-O 3.23Å; P855-Y1170 HydrophobicContact CG-CE2 4.11Å
856	I	71.4	Confident	75.9	Confident	14 Å²	14	60.6 Å²	60.6	7%	0.072	32%	0.323	C	S	.	.	S	Bend	trans	-136.5	119	-175.1	-66.5	158.5	0	0	0	109.7	S854 F861 A1165 Q1168	S854-I856 WeakPolarHBondContact CB-O 3.45Å; S854-I856 PolarHBondContact O-N 3.06Å; S854-I856 PolarHBondContact OG-N 3.42Å; S854-I856 PolarHBondContact OG-O 2.91Å; I856-F861 HydrophobicContact CG2-CD2 4.29Å; I856-F861 HydrophobicContact CG2-CE2 3.24Å; I856-F861 HydrophobicContact CG2-CZ 3.72Å; I856-A1165 VanDerWaalsContact CD1-CA 3.49Å; I856-A1165 HydrophobicContact CD1-CB 4.04Å; I856-A1165 VanDerWaalsContact CD1-O 3.28Å; I856-A1165 WeakPolarHBondContact CD1-O 3.24Å; I856-Q1168 HydrophobicContact CD1-CB 3.37Å; I856-Q1168 HydrophobicContact CD1-CG 4.29Å; I856-Q1168 HydrophobicContact CG1-CB 4.27Å
857	P	71.3	Confident	75.9	Confident	65 Å²	65	60.5 Å²	60.5	42%	0.422	32%	0.323	S	S	.	.			trans	-69.6	130.6	169.5	-19.1	32.6	0	0	0	111.9	E859 N860	P857-E859 PolarHBondContact O-N 2.96Å; P857-N860 PolarHBondContact O-N 3.42Å
858	Y	72.1	Confident	75.8	Confident	16 Å²	16	61.2 Å²	61.2	6%	0.063	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-54.8	-30.1	173.8	156.5	-89.8	0	0	0	113.6	Q833 D837 I840 L841 E844 N860 F861 C862 K865	Q833-Y858 PolarHBondContact NE2-OH 3.21Å; D837-Y858 WeakPolarHBondContact OD1-CE2 3.43Å; D837-Y858 VanDerWaalsContact OD1-CZ 3.25Å; D837-Y858 PolarHBondContact OD1-OH 3.38Å; I840-Y858 HydrophobicContact CB-CD2 4.37Å; I840-Y858 HydrophobicContact CG2-CD2 4.3Å; L841-Y858 HydrophobicContact CB-CD2 3.69Å; L841-Y858 HydrophobicContact CB-CE2 3.77Å; L841-Y858 HydrophobicContact CB-CG 4.27Å; L841-Y858 HydrophobicContact CD1-CD1 4.08Å; L841-Y858 HydrophobicContact CD1-CD2 4.31Å; L841-Y858 HydrophobicContact CD1-CE1 4.36Å; L841-Y858 HydrophobicContact CD1-CG 4.04Å; L841-Y858 HydrophobicContact CD2-CE2 4.4Å; L841-Y858 HydrophobicContact CG-CD2 4.49Å; L841-Y858 HydrophobicContact CG-CE2 4.46Å; E844-Y858 VanDerWaalsContact OE2-CB 3.28Å; E844-Y858 WeakPolarHBondContact OE2-CB 3.1Å; E844-Y858 PolarHBondContact OE2-N 3.14Å; Y858-N860 PolarHBondContact O-N 3.4Å; Y858-N860 VanDerWaalsContact O-N 3.09Å; Y858-F861 PolarHBondContact O-N 3.33Å; Y858-C862 VanDerWaalsContact CE1-SG 3.52Å; Y858-K865 PolarHBondContact OH-NZ 3.24Å
859	E	68.1	Low	75.5	Confident	159 Å²	159	58.7 Å²	58.7	74%	0.743	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-57	-27.7	-179.1	-60.5	-171.6	153.7	0	0	113.1	P857 F861 C862	P857-E859 PolarHBondContact O-N 2.96Å; E859-F861 PolarHBondContact O-N 3.27Å; E859-C862 PolarHBondContact O-N 3.02Å
860	N	67.6	Low	75.5	Confident	122 Å²	122	53.5 Å²	53.5	65%	0.652	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-68	-12.7	178.9	-67.8	-16.1	0	0	0	114.2	P857 Y858	P857-N860 PolarHBondContact O-N 3.42Å; Y858-N860 PolarHBondContact O-N 3.4Å; Y858-N860 VanDerWaalsContact O-N 3.09Å
861	F	63.8	Low	75.4	Confident	26 Å²	26	53 Å²	53	11%	0.114	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-111.1	10.1	-173.5	-58.8	-96.7	0	0	0	112.7	I840 I856 Y858 E859 R863 N1161 A1165	I840-F861 HydrophobicContact CD1-CB 4.25Å; I840-F861 HydrophobicContact CD1-CD1 4.07Å; I840-F861 HydrophobicContact CD1-CD2 4.4Å; I840-F861 HydrophobicContact CD1-CG 3.95Å; I856-F861 HydrophobicContact CG2-CD2 4.29Å; I856-F861 HydrophobicContact CG2-CE2 3.24Å; I856-F861 HydrophobicContact CG2-CZ 3.72Å; Y858-F861 PolarHBondContact O-N 3.33Å; E859-F861 PolarHBondContact O-N 3.27Å; F861-R863 PolarHBondContact O-N 2.9Å; F861-R863 VanDerWaalsContact O-N 3.17Å; F861-N1161 HydrophobicContact CD1-CB 3.91Å; F861-N1161 HydrophobicContact CE1-CB 3.82Å; F861-N1161 WeakPolarHBondContact CE1-O 3.34Å; F861-A1165 HydrophobicContact CE1-CB 3.94Å; F861-A1165 HydrophobicContact CZ-CB 3.92Å
862	C	58.8	Low	75.1	Confident	22 Å²	22	50.7 Å²	50.7	15%	0.149	26%	0.263	C	S	.	.			trans	-85.7	31	-168.3	-79.7	0	0	0	0	116.3	Y858 E859 T864 K865	Y858-C862 VanDerWaalsContact CE1-SG 3.52Å; E859-C862 PolarHBondContact O-N 3.02Å; C862-T864 PolarHBondContact O-N 3.04Å; C862-K865 HydrophobicContact CB-CB 3.98Å; C862-K865 HydrophobicContact CB-CD 4.16Å; C862-K865 VanDerWaalsContact O-CB 3.26Å; C862-K865 WeakPolarHBondContact O-CB 3.06Å; C862-K865 PolarHBondContact O-N 3.02Å
863	R	66.3	Low	74.3	Confident	136 Å²	136	51.7 Å²	51.7	51%	0.513	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-44.1	177.8	-73.5	-151.4	-175.6	128	-7.9	112.9	F861 K865 N866 E1158	F861-R863 PolarHBondContact O-N 2.9Å; F861-R863 VanDerWaalsContact O-N 3.17Å; R863-K865 VanDerWaalsContact C-N 3.25Å; R863-K865 PolarHBondContact O-N 3.1Å; R863-N866 WeakPolarHBondContact O-CB 3.29Å; R863-N866 PolarHBondContact O-N 3.43Å; R863-E1158 VanDerWaalsContact CD-OE1 3.28Å; R863-E1158 WeakPolarHBondContact CD-OE1 3.31Å; R863-E1158 IonicContact CZ-OE1 2.72Å; R863-E1158 IonicContact NE-OE1 3.96Å; R863-E1158 IonicContact NH1-OE1 3.37Å; R863-E1158 PolarHBondContact NH1-OE1 2.77Å
864	T	73.3	Confident	72.9	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-56.6	-38.2	176.4	-44.7	0	0	0	0	112.6	E829 N832 Q833 C862 N866 I867 L868 N958	E829-T864 HydrophobicContact CB-CG2 4.01Å; E829-T864 WeakPolarHBondContact O-CG2 3.33Å; N832-T864 HydrophobicContact CB-CG2 3.88Å; Q833-T864 HydrophobicContact CB-CG2 3.99Å; C862-T864 PolarHBondContact O-N 3.04Å; T864-N866 PolarHBondContact O-N 3.31Å; T864-I867 WeakPolarHBondContact O-CG2 3.39Å; T864-I867 PolarHBondContact O-N 3.03Å; T864-I867 VanDerWaalsContact O-N 3.15Å; T864-L868 HydrophobicContact CG2-CD1 4.04Å; T864-L868 HydrophobicContact CG2-CG 4.37Å; T864-L868 WeakPolarHBondContact O-CG 3.38Å; T864-L868 PolarHBondContact O-N 2.87Å; T864-N958 PolarHBondContact OG1-ND2 2.66Å; T864-N958 VanDerWaalsContact OG1-ND2 3.15Å
865	K	76.1	Confident	71.2	Confident	82 Å²	82	52.2 Å²	52.2	36%	0.357	27%	0.271	S	S	.	.	H	α-helix	trans	-59.3	-32.8	177.6	-150	165.6	-171.3	162.6	0	112.4	Y858 C862 R863 N869	Y858-K865 PolarHBondContact OH-NZ 3.24Å; C862-K865 HydrophobicContact CB-CB 3.98Å; C862-K865 HydrophobicContact CB-CD 4.16Å; C862-K865 VanDerWaalsContact O-CB 3.26Å; C862-K865 WeakPolarHBondContact O-CB 3.06Å; C862-K865 PolarHBondContact O-N 3.02Å; R863-K865 VanDerWaalsContact C-N 3.25Å; R863-K865 PolarHBondContact O-N 3.1Å; K865-N869 VanDerWaalsContact O-CB 3.28Å; K865-N869 WeakPolarHBondContact O-CB 3.48Å; K865-N869 PolarHBondContact O-N 2.82Å; K865-N869 PolarHBondContact O-ND2 3.42Å; K865-N869 PolarHBondContact O-OD1 3.31Å
866	N	76.3	Confident	69.2	Low	69 Å²	69	55.5 Å²	55.5	37%	0.369	29%	0.285	S	S	.	.	H	α-helix	trans	-73.7	-27.8	178.9	-68.7	-24.4	0	0	0	113.9	R863 T864 S942	R863-N866 WeakPolarHBondContact O-CB 3.29Å; R863-N866 PolarHBondContact O-N 3.43Å; T864-N866 PolarHBondContact O-N 3.31Å; N866-S942 PolarHBondContact O-OG 3.17Å
867	I	82.1	Confident	67.2	Low	4 Å²	4	59.9 Å²	59.9	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-85.7	-36.1	172.5	-158.4	-172.9	0	0	0	111.3	E829 T864 F870 M871 L955 H957	E829-I867 HydrophobicContact CB-CG2 4.34Å; E829-I867 HydrophobicContact CG-CG2 4.05Å; T864-I867 WeakPolarHBondContact O-CG2 3.39Å; T864-I867 PolarHBondContact O-N 3.03Å; T864-I867 VanDerWaalsContact O-N 3.15Å; I867-F870 WeakPolarHBondContact O-CB 3.39Å; I867-F870 PolarHBondContact O-N 3.15Å; I867-M871 HydrophobicContact CD1-CE 4.4Å; I867-M871 HydrophobicContact CG1-CE 4.08Å; I867-M871 HydrophobicContact CG2-CE 4.39Å; I867-M871 WeakPolarHBondContact O-CE 3.32Å; I867-M871 PolarHBondContact O-N 3.07Å; I867-L955 HydrophobicContact CD1-CB 4.49Å; I867-H957 HydrophobicContact CD1-CB 4.45Å
868	L	83.5	Confident	65	Low	14 Å²	14	62.5 Å²	62.5	7%	0.073	33%	0.332	C	S	.	.	H	α-helix	trans	-62.5	-51.1	174	-70.5	175.4	0	0	0	111.9	Y826 E829 Q833 T864 F870 M871 D872	Y826-L868 HydrophobicContact CD2-CD2 3.94Å; Y826-L868 HydrophobicContact CE2-CD2 3.68Å; E829-L868 HydrophobicContact CB-CD2 3.92Å; E829-L868 HydrophobicContact CB-CG 4.31Å; Q833-L868 HydrophobicContact CB-CD1 3.5Å; Q833-L868 VanDerWaalsContact CB-CD1 3.5Å; Q833-L868 HydrophobicContact CG-CD1 3.77Å; T864-L868 HydrophobicContact CG2-CD1 4.04Å; T864-L868 HydrophobicContact CG2-CG 4.37Å; T864-L868 WeakPolarHBondContact O-CG 3.38Å; T864-L868 PolarHBondContact O-N 2.87Å; L868-F870 PolarHBondContact O-N 2.96Å; L868-F870 VanDerWaalsContact O-N 3.17Å; L868-M871 HydrophobicContact CD2-CE 4.11Å; L868-M871 CarbonylContact O-C 3.06Å; L868-M871 WeakPolarHBondContact O-CA 3.32Å; L868-M871 PolarHBondContact O-N 2.9Å; L868-D872 VanDerWaalsContact O-CB 3.29Å; L868-D872 WeakPolarHBondContact O-CB 3.4Å; L868-D872 PolarHBondContact O-N 3.12Å
869	N	80	Confident	62.8	Low	74 Å²	74	67.6 Å²	67.6	40%	0.396	37%	0.365	S	S	.	.	H	α-helix	trans	-56.2	-36.5	176.9	-69.6	-10.9	0	0	0	112.4	K865 M871 D872 N873	K865-N869 VanDerWaalsContact O-CB 3.28Å; K865-N869 WeakPolarHBondContact O-CB 3.48Å; K865-N869 PolarHBondContact O-N 2.82Å; K865-N869 PolarHBondContact O-ND2 3.42Å; K865-N869 PolarHBondContact O-OD1 3.31Å; N869-M871 VanDerWaalsContact C-N 3.3Å; N869-M871 PolarHBondContact O-N 3.39Å; N869-D872 PolarHBondContact O-N 3.36Å; N869-N873 WeakPolarHBondContact O-CB 3.44Å; N869-N873 PolarHBondContact O-N 3.26Å; N869-N873 VanDerWaalsContact O-N 3.08Å; N869-N873 PolarHBondContact O-ND2 2.93Å; N869-N873 PolarHBondContact O-OD1 3.3Å; N869-N873 VanDerWaalsContact O-OD1 3.11Å
870	F	83.7	Confident	60.8	Low	9 Å²	9	66.4 Å²	66.4	4%	0.039	37%	0.37	C	S	.	.	H	α-helix	trans	-64	-32.7	175.3	175.2	-86.2	0	0	0	112.8	I867 L868 G903 L904 L924 M927 I943 L955	I867-F870 WeakPolarHBondContact O-CB 3.39Å; I867-F870 PolarHBondContact O-N 3.15Å; L868-F870 PolarHBondContact O-N 2.96Å; L868-F870 VanDerWaalsContact O-N 3.17Å; F870-G903 WeakPolarHBondContact O-CA 3.28Å; F870-L904 PolarHBondContact O-N 2.93Å; F870-L904 VanDerWaalsContact O-N 3.12Å; F870-L924 HydrophobicContact CZ-CD2 4.03Å; F870-M927 HydrophobicContact CD2-CE 3.75Å; F870-M927 HydrophobicContact CE2-CB 4.15Å; F870-M927 HydrophobicContact CE2-CE 3.67Å; F870-M927 HydrophobicContact CE2-SD 4.3Å; F870-M927 HydrophobicContact CG-CE 4.47Å; F870-M927 HydrophobicContact CZ-CE 4.33Å; F870-I943 HydrophobicContact CD2-CG2 4.49Å; F870-I943 HydrophobicContact CE2-CB 4.07Å; F870-I943 HydrophobicContact CE2-CG2 3.67Å; F870-I943 HydrophobicContact CZ-CB 3.94Å; F870-I943 HydrophobicContact CZ-CD1 4.31Å; F870-I943 HydrophobicContact CZ-CG2 4.04Å; F870-L955 HydrophobicContact CD1-CD2 4.41Å; F870-L955 HydrophobicContact CE1-CD2 3.75Å; F870-L955 HydrophobicContact CZ-CD2 4.31Å
871	M	83.6	Confident	58.7	Low	0 Å²	0	67.4 Å²	67.4	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-84.6	-33.5	176.1	-64.4	-176.6	-73.5	0	0	112.7	L822 Y826 I867 L868 N869 G903 L904 F905	L822-M871 HydrophobicContact CD1-SD 4.41Å; Y826-M871 HydrophobicContact CD2-CB 4.42Å; Y826-M871 HydrophobicContact CD2-CE 3.67Å; Y826-M871 HydrophobicContact CD2-SD 4.01Å; Y826-M871 HydrophobicContact CE2-CE 4.46Å; I867-M871 HydrophobicContact CD1-CE 4.4Å; I867-M871 HydrophobicContact CG1-CE 4.08Å; I867-M871 HydrophobicContact CG2-CE 4.39Å; I867-M871 WeakPolarHBondContact O-CE 3.32Å; I867-M871 PolarHBondContact O-N 3.07Å; L868-M871 HydrophobicContact CD2-CE 4.11Å; L868-M871 CarbonylContact O-C 3.06Å; L868-M871 WeakPolarHBondContact O-CA 3.32Å; L868-M871 PolarHBondContact O-N 2.9Å; N869-M871 VanDerWaalsContact C-N 3.3Å; N869-M871 PolarHBondContact O-N 3.39Å; M871-G903 CarbonylContact O-C 3.44Å; M871-G903 VanDerWaalsContact O-C 3.3Å; M871-G903 WeakPolarHBondContact O-CA 3.25Å; M871-L904 HydrophobicContact CG-CB 4.46Å; M871-L904 HydrophobicContact CG-CD2 4.42Å; M871-L904 PolarHBondContact O-N 3.02Å; M871-F905 HydrophobicContact CB-CD2 4.21Å; M871-F905 HydrophobicContact CB-CE2 3.93Å; M871-F905 PolarHBondContact O-N 3.39Å; M871-F905 VanDerWaalsContact O-N 3.12Å
872	D	76.6	Confident	56.9	Low	21 Å²	21	71.2 Å²	71.2	11%	0.112	41%	0.406	C	S	.	.	H	α-helix	trans	-113.5	-3.3	-159.8	-69.6	-8.1	0	0	0	116.1	Y826 L868 N869 T874 F905 K1030	Y826-D872 WeakPolarHBondContact CE2-OD1 3.49Å; Y826-D872 WeakPolarHBondContact CE2-OD2 3.21Å; Y826-D872 VanDerWaalsContact OH-CG 3.29Å; Y826-D872 PolarHBondContact OH-OD1 2.74Å; Y826-D872 PolarHBondContact OH-OD2 3.02Å; L868-D872 VanDerWaalsContact O-CB 3.29Å; L868-D872 WeakPolarHBondContact O-CB 3.4Å; L868-D872 PolarHBondContact O-N 3.12Å; N869-D872 PolarHBondContact O-N 3.36Å; D872-T874 WeakPolarHBondContact O-CG2 3.26Å; D872-T874 PolarHBondContact O-N 3.21Å; D872-F905 WeakPolarHBondContact OD1-CD2 3.36Å; D872-K1030 HydrophobicContact CB-CD 4.18Å; D872-K1030 PolarHBondContact O-NZ 2.8Å
873	N	68.9	Low	55.3	Low	50 Å²	50	79.7 Å²	79.7	27%	0.267	44%	0.441	S	S	.	.			trans	-56.5	96.9	-177.5	-89.7	-2.9	0	0	0	113	N869 F901 G903	N869-N873 WeakPolarHBondContact O-CB 3.44Å; N869-N873 PolarHBondContact O-N 3.26Å; N869-N873 VanDerWaalsContact O-N 3.08Å; N869-N873 PolarHBondContact O-ND2 2.93Å; N869-N873 PolarHBondContact O-OD1 3.3Å; N869-N873 VanDerWaalsContact O-OD1 3.11Å; N873-F901 WeakPolarHBondContact CB-O 3.1Å; N873-F901 PolarHBondContact ND2-O 2.84Å; N873-G903 PolarHBondContact O-N 3.19Å
874	T	53.8	Low	53.5	Low	62 Å²	62	78.7 Å²	78.7	38%	0.38	45%	0.452	S	S	.	.			trans	-99.6	35.3	-179.2	44.9	0	0	0	0	112.9	D872 L876 S877 K1030	D872-T874 WeakPolarHBondContact O-CG2 3.26Å; D872-T874 PolarHBondContact O-N 3.21Å; T874-L876 PolarHBondContact O-N 3.38Å; T874-S877 PolarHBondContact O-N 3.32Å; T874-K1030 HydrophobicContact CG2-CD 4.49Å; T874-K1030 PolarHBondContact OG1-NZ 2.84Å; T874-K1030 VanDerWaalsContact OG1-NZ 3.16Å
875	T	42.3	Very low	51.2	Low	91 Å²	91	90 Å²	90	56%	0.558	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	54.5	179.4	53.3	0	0	0	0	113	V900	T875-V900 HydrophobicContact CG2-CG1 4.13Å; T875-V900 WeakPolarHBondContact OG1-CG1 3.47Å
876	L	33.5	Very low	48.7	Very low	128 Å²	128	95 Å²	95	67%	0.67	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.9	2.7	172.7	-102.4	160.7	0	0	0	112	T874 T878 P902	T874-L876 PolarHBondContact O-N 3.38Å; L876-T878 VanDerWaalsContact C-N 3.27Å; L876-T878 PolarHBondContact O-N 2.75Å; L876-P902 HydrophobicContact CD1-CB 4.5Å
877	S	28.7	Very low	46.2	Very low	106 Å²	106	99.1 Å²	99.1	74%	0.741	54%	0.539	S	S	*	.			trans	-85.3	49.8	-177.5	68.2	0	0	0	0	114.1	T874	T874-S877 PolarHBondContact O-N 3.32Å
878	T	25.7	Very low	43.6	Very low	120 Å²	120	107.3 Å²	107.3	74%	0.736	58%	0.582	S	S	*	*	S	Bend	trans	-127.7	108.6	162.9	50.6	0	0	0	0	109.1	L876	L876-T878 VanDerWaalsContact C-N 3.27Å; L876-T878 PolarHBondContact O-N 2.75Å
879	T	26.2	Very low	40.8	Very low	123 Å²	123	112.3 Å²	112.3	76%	0.755	61%	0.614	S	S	*	*			trans	53.4	98.6	176.9	53.3	0	0	0	0	116.7	N881	T879-N881 VanDerWaalsContact C-N 3.27Å; T879-N881 PolarHBondContact O-N 2.92Å
880	P	26.1	Very low	38.3	Very low	133 Å²	133	114.5 Å²	114.5	86%	0.864	63%	0.63	S	S	*	*			trans	-77.2	76	167.8	33.7	-34.4	0	0	0	110.6
881	N	24.4	Very low	35.6	Very low	143 Å²	143	119.7 Å²	119.7	77%	0.765	66%	0.662	S	S	*	*			trans	-153.9	114.5	168.6	-104.6	-37.9	0	0	0	111.1	T879	T879-N881 VanDerWaalsContact C-N 3.27Å; T879-N881 PolarHBondContact O-N 2.92Å
882	S	24.4	Very low	33.1	Very low	106 Å²	106	126.6 Å²	126.6	74%	0.741	70%	0.699	S	S	*	*			trans	60	125.2	-178.7	72.5	0	0	0	0	117.2
883	F	25	Very low	30.9	Very low	201 Å²	201	132.6 Å²	132.6	88%	0.882	73%	0.732	S	S	*	*				-163.7	131.4	122.2	-101.3	-69.1	0	0	0	109
884	P	28.6	Very low	29	Very low	115 Å²	115	138 Å²	138	75%	0.747	76%	0.76	S	S	*	*			trans	-91.4	142.8	-176.7	34.1	-33.7	0	0	0	113	K886	P884-K886 PolarHBondContact O-N 3.32Å; P884-K886 VanDerWaalsContact O-N 3.09Å
885	Y	25.5	Very low	27.9	Very low	239 Å²	239	140.5 Å²	140.5	94%	0.937	78%	0.775	S	S	*	*			trans	-71.7	97.9	166.9	-93.3	-90.6	0	0	0	111.2
886	K	24.2	Very low	27.6	Very low	187 Å²	187	144.5 Å²	144.5	81%	0.813	78%	0.781	S	S	*	*			trans	-167	147.9	151.3	-109	154.1	-170.4	172.6	0	112.1	P884	P884-K886 PolarHBondContact O-N 3.32Å; P884-K886 VanDerWaalsContact O-N 3.09Å
887	N	24.3	Very low	27.9	Very low	155 Å²	155	145.5 Å²	145.5	83%	0.829	79%	0.787	S	S	*	*			trans	67.9	103.4	173	-53.7	-15	0	0	0	116.8
888	L	26.4	Very low	28.6	Very low	176 Å²	176	147.6 Å²	147.6	92%	0.921	79%	0.79	S	S	*	*			trans	-148.6	102.9	144.5	-114.9	166.3	0	0	0	109.4
889	T	25.4	Very low	29.9	Very low	120 Å²	120	145.3 Å²	145.3	74%	0.736	78%	0.777	S	S	*	*			trans	-112.1	168.7	168	48.6	0	0	0	0	109.4
890	T	26.3	Very low	31.5	Very low	119 Å²	119	143.7 Å²	143.7	73%	0.73	77%	0.766	S	S	*	*			trans	66.2	99.6	170.6	52.8	0	0	0	0	118.2
891	T	28.3	Very low	33.6	Very low	118 Å²	118	139 Å²	139	72%	0.724	73%	0.733	S	S	*	*				53.7	107.3	129.6	58.8	0	0	0	0	120.2
892	N	30.8	Very low	35.9	Very low	145 Å²	145	133.7 Å²	133.7	78%	0.775	71%	0.706	S	S	*	*				-165.8	170.7	95.4	-93.7	-26.9	0	0	0	111.6
893	N	30.2	Very low	38.6	Very low	148 Å²	148	128.7 Å²	128.7	79%	0.791	67%	0.671	S	S	*	*	S	Bend	trans	-73.5	170.2	-177	-64.9	-34.6	0	0	0	112.7
894	D	29.1	Very low	41.5	Very low	162 Å²	162	119.1 Å²	119.1	87%	0.866	63%	0.629	S	S	*	*			trans	95.1	0.7	175.8	-54.1	-15.2	0	0	0	117.9	Y896	D894-Y896 PolarHBondContact O-N 3.18Å
895	V	30.1	Very low	44.1	Very low	116 Å²	116	113.8 Å²	113.8	70%	0.703	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	68	176.9	-165.7	0	0	0	0	112.5
896	Y	36.9	Very low	46.7	Very low	174 Å²	174	104.2 Å²	104.2	68%	0.682	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	-15.2	176.5	-98.7	-63.8	0	0	0	117.1	D894	D894-Y896 PolarHBondContact O-N 3.18Å
897	N	38.7	Very low	49.4	Very low	149 Å²	149	95.9 Å²	95.9	80%	0.797	53%	0.526	S	S	*	.	S	Bend	trans	-108.1	-6.1	-169.7	-72.3	1.5	0	0	0	116.4
898	N	44.3	Very low	52.2	Low	150 Å²	150	88.5 Å²	88.5	80%	0.802	49%	0.486	S	S	*	.			trans	-134.1	35	-173.3	-91.1	-28.5	0	0	0	114.4	V900	N898-V900 PolarHBondContact O-N 3.36Å; N898-V900 VanDerWaalsContact O-N 3.17Å
899	T	52.5	Low	54.6	Low	73 Å²	73	80.7 Å²	80.7	45%	0.448	45%	0.446	S	S	.	.			trans	-79.9	89.6	167.7	44.3	0	0	0	0	109.9	F901	T899-F901 WeakPolarHBondContact O-CD2 3.29Å; T899-F901 WeakPolarHBondContact O-CE2 3.42Å; T899-F901 PolarHBondContact O-N 3.11Å; T899-F901 VanDerWaalsContact O-N 3.16Å
900	V	60.5	Low	57.1	Low	89 Å²	89	76.8 Å²	76.8	54%	0.539	42%	0.423	S	S	.	.			trans	-78.4	102.1	179.4	-164.6	0	0	0	0	109.7	T875 N898	T875-V900 HydrophobicContact CG2-CG1 4.13Å; T875-V900 WeakPolarHBondContact OG1-CG1 3.47Å; N898-V900 PolarHBondContact O-N 3.36Å; N898-V900 VanDerWaalsContact O-N 3.17Å
901	F	68.8	Low	59.5	Low	35 Å²	35	71.2 Å²	71.2	15%	0.154	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-75.8	142.3	177.3	-64	-87.4	0	0	0	111.5	N873 T899 T923 Q926 M927 T930	N873-F901 WeakPolarHBondContact CB-O 3.1Å; N873-F901 PolarHBondContact ND2-O 2.84Å; T899-F901 WeakPolarHBondContact O-CD2 3.29Å; T899-F901 WeakPolarHBondContact O-CE2 3.42Å; T899-F901 PolarHBondContact O-N 3.11Å; T899-F901 VanDerWaalsContact O-N 3.16Å; F901-T923 HydrophobicContact CD1-CG2 4.17Å; F901-Q926 HydrophobicContact CE1-CB 3.8Å; F901-Q926 HydrophobicContact CZ-CB 4.18Å; F901-M927 HydrophobicContact CB-CE 3.94Å; F901-M927 HydrophobicContact CB-CG 3.79Å; F901-M927 HydrophobicContact CB-SD 4.13Å; F901-M927 HydrophobicContact CD1-CG 3.68Å; F901-M927 HydrophobicContact CD2-CG 4.08Å; F901-M927 HydrophobicContact CE1-CG 4.29Å; F901-M927 HydrophobicContact CG-CG 3.57Å; F901-T930 HydrophobicContact CE2-CG2 4.37Å
902	P	74.2	Confident	61.4	Low	31 Å²	31	65.8 Å²	65.8	20%	0.201	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-62.4	144.2	168.1	28.8	-35.2	0	0	0	110.7	L876 C906 L907	L876-P902 HydrophobicContact CD1-CB 4.5Å; P902-C906 HydrophobicContact CB-CB 4.31Å; P902-L907 HydrophobicContact CB-CG 4.48Å; P902-L907 HydrophobicContact CG-CD2 3.82Å; P902-L907 HydrophobicContact CG-CG 4.06Å
903	G	79.7	Confident	63.2	Low	1 Å²	1	64.9 Å²	64.9	1%	0.01	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-68.4	158	178.9	0	0	0	0	0	113.1	F870 M871 N873 F905 C906 L907	F870-G903 WeakPolarHBondContact O-CA 3.28Å; M871-G903 CarbonylContact O-C 3.44Å; M871-G903 VanDerWaalsContact O-C 3.3Å; M871-G903 WeakPolarHBondContact O-CA 3.25Å; N873-G903 PolarHBondContact O-N 3.19Å; G903-F905 VanDerWaalsContact C-N 3.26Å; G903-F905 PolarHBondContact O-N 2.97Å; G903-F905 VanDerWaalsContact O-N 3.16Å; G903-C906 WeakPolarHBondContact O-CB 3.36Å; G903-C906 PolarHBondContact O-N 3.18Å; G903-L907 PolarHBondContact O-N 3.15Å
904	L	86.2	Confident	65	Low	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-48.3	-42.3	-178.9	-177.5	60.4	0	0	0	113.8	L822 F870 M871 L907 L908 L924 F953	L822-L904 HydrophobicContact CD1-CD2 4.37Å; L822-L904 HydrophobicContact CD2-CD2 3.92Å; F870-L904 PolarHBondContact O-N 2.93Å; F870-L904 VanDerWaalsContact O-N 3.12Å; M871-L904 HydrophobicContact CG-CB 4.46Å; M871-L904 HydrophobicContact CG-CD2 4.42Å; M871-L904 PolarHBondContact O-N 3.02Å; L904-L907 PolarHBondContact O-N 2.92Å; L904-L908 HydrophobicContact CD1-CD1 4.42Å; L904-L908 HydrophobicContact CD1-CG 4.45Å; L904-L908 HydrophobicContact CG-CD1 4.18Å; L904-L908 WeakPolarHBondContact O-CG 3.28Å; L904-L908 PolarHBondContact O-N 2.58Å; L904-L924 HydrophobicContact CD1-CD1 4.45Å; L904-L924 HydrophobicContact CD1-CD2 4.17Å; L904-F953 HydrophobicContact CD1-CZ 4.22Å; L904-F953 HydrophobicContact CD2-CE2 4.38Å; L904-F953 HydrophobicContact CD2-CZ 4.09Å
905	F	83.5	Confident	66.7	Low	3 Å²	3	56 Å²	56	1%	0.013	30%	0.304	C	S	.	.	H	α-helix	trans	-69.9	-36.5	-179.9	-64.9	-55	0	0	0	113.1	Y826 M871 D872 G903 L907 L908 D909	Y826-F905 AromaticContact CD1-CE2 3.79Å; Y826-F905 HydrophobicContact CD1-CE2 3.79Å; Y826-F905 AromaticContact CD1-CZ 3.81Å; Y826-F905 HydrophobicContact CD1-CZ 3.81Å; Y826-F905 AromaticContact CD2-CE2 3.63Å; Y826-F905 HydrophobicContact CD2-CE2 3.63Å; Y826-F905 HydrophobicContact CD2-CZ 4.05Å; Y826-F905 AromaticContact CE1-CE2 3.88Å; Y826-F905 HydrophobicContact CE1-CE2 3.88Å; Y826-F905 HydrophobicContact CE1-CZ 4.33Å; Y826-F905 AromaticContact CE2-CE2 3.73Å; Y826-F905 HydrophobicContact CE2-CE2 3.73Å; Y826-F905 AromaticContact CG-CE2 3.65Å; Y826-F905 HydrophobicContact CG-CE2 3.65Å; Y826-F905 AromaticContact CG-CZ 3.64Å; Y826-F905 HydrophobicContact CG-CZ 3.64Å; Y826-F905 AromaticContact CZ-CE2 3.84Å; M871-F905 HydrophobicContact CB-CD2 4.21Å; M871-F905 HydrophobicContact CB-CE2 3.93Å; M871-F905 PolarHBondContact O-N 3.39Å; M871-F905 VanDerWaalsContact O-N 3.12Å; D872-F905 WeakPolarHBondContact OD1-CD2 3.36Å; G903-F905 VanDerWaalsContact C-N 3.26Å; G903-F905 PolarHBondContact O-N 2.97Å; G903-F905 VanDerWaalsContact O-N 3.16Å; F905-L907 VanDerWaalsContact C-N 3.31Å; F905-L907 PolarHBondContact O-N 3.3Å; F905-L908 HydrophobicContact CD1-CD1 4.3Å; F905-L908 PolarHBondContact O-N 3.17Å; F905-D909 PolarHBondContact O-N 3.43Å
906	C	80	Confident	68.7	Low	38 Å²	38	53.3 Å²	53.3	26%	0.257	29%	0.286	S	S	.	.	H	α-helix	trans	-66.1	-35.5	174.7	-177.9	0	0	0	0	111.6	P902 G903 S910	P902-C906 HydrophobicContact CB-CB 4.31Å; G903-C906 WeakPolarHBondContact O-CB 3.36Å; G903-C906 PolarHBondContact O-N 3.18Å; C906-S910 PolarHBondContact O-N 3.04Å; C906-S910 VanDerWaalsContact O-N 3.14Å
907	L	82.3	Confident	70.4	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.063	26%	0.261	C	S	.	.	H	α-helix	trans	-67.7	-40.5	170.9	-70	170.3	0	0	0	112.2	P902 G903 L904 F905 S910 V911 L920 T923 M927	P902-L907 HydrophobicContact CB-CG 4.48Å; P902-L907 HydrophobicContact CG-CD2 3.82Å; P902-L907 HydrophobicContact CG-CG 4.06Å; G903-L907 PolarHBondContact O-N 3.15Å; L904-L907 PolarHBondContact O-N 2.92Å; F905-L907 VanDerWaalsContact C-N 3.31Å; F905-L907 PolarHBondContact O-N 3.3Å; L907-S910 PolarHBondContact O-N 3.45Å; L907-S910 PolarHBondContact O-OG 3.49Å; L907-V911 WeakPolarHBondContact O-CG2 3.45Å; L907-V911 PolarHBondContact O-N 3Å; L907-L920 HydrophobicContact CB-CD1 3.74Å; L907-T923 HydrophobicContact CD1-CG2 3.81Å; L907-T923 HydrophobicContact CD2-CG2 4.04Å; L907-M927 HydrophobicContact CD1-SD 4.19Å
908	L	81.2	Confident	72.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-38.3	175.6	-70.4	170.3	0	0	0	112.1	L904 F905 V911 A912 L920 W972 F973 Y1026	L904-L908 HydrophobicContact CD1-CD1 4.42Å; L904-L908 HydrophobicContact CD1-CG 4.45Å; L904-L908 HydrophobicContact CG-CD1 4.18Å; L904-L908 WeakPolarHBondContact O-CG 3.28Å; L904-L908 PolarHBondContact O-N 2.58Å; F905-L908 HydrophobicContact CD1-CD1 4.3Å; F905-L908 PolarHBondContact O-N 3.17Å; L908-V911 PolarHBondContact O-N 3.11Å; L908-A912 WeakPolarHBondContact O-CB 3.08Å; L908-A912 PolarHBondContact O-N 3.26Å; L908-L920 HydrophobicContact CD2-CD1 4.5Å; L908-L920 HydrophobicContact CD2-CD2 4.16Å; L908-W972 HydrophobicContact CD1-CE3 4.42Å; L908-W972 HydrophobicContact CD1-CZ3 4.35Å; L908-W972 HydrophobicContact CD2-CE3 4.26Å; L908-F973 HydrophobicContact CD2-CE1 4.17Å; L908-F973 HydrophobicContact CD2-CZ 4.09Å; L908-F973 WeakPolarHBondContact O-CE1 3.23Å; L908-Y1026 HydrophobicContact CB-CD1 4.21Å; L908-Y1026 HydrophobicContact CB-CD2 3.7Å; L908-Y1026 HydrophobicContact CB-CE1 4.45Å; L908-Y1026 HydrophobicContact CB-CE2 3.97Å; L908-Y1026 HydrophobicContact CB-CG 3.85Å; L908-Y1026 HydrophobicContact CD1-CD1 4.37Å
909	D	77.6	Confident	73.6	Confident	12 Å²	12	40.1 Å²	40.1	6%	0.064	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-45.3	172.1	-81.2	-47.8	0	0	0	111.8	F905 Q913 Y976 G1024 Y1026 S1027	F905-D909 PolarHBondContact O-N 3.43Å; D909-Q913 WeakPolarHBondContact O-CG 3.42Å; D909-Q913 PolarHBondContact O-N 3.4Å; D909-Y976 PolarHBondContact O-OH 3.29Å; D909-Y976 WeakPolarHBondContact OD1-CE2 3.47Å; D909-Y976 PolarHBondContact OD1-OH 3.03Å; D909-Y976 VanDerWaalsContact OD1-OH 3.06Å; D909-G1024 VanDerWaalsContact OD1-C 3.31Å; D909-G1024 VanDerWaalsContact OD1-CA 3.24Å; D909-G1024 WeakPolarHBondContact OD1-CA 3.37Å; D909-Y1026 HydrophobicContact CB-CD2 4.47Å; D909-Y1026 WeakPolarHBondContact OD1-CD2 3.46Å; D909-S1027 VanDerWaalsContact OD2-CB 3.32Å; D909-S1027 WeakPolarHBondContact OD2-CB 3.11Å; D909-S1027 PolarHBondContact OD2-N 2.96Å; D909-S1027 VanDerWaalsContact OD2-N 3.16Å; D909-S1027 PolarHBondContact OD2-OG 2.64Å
910	S	77.7	Confident	75	Confident	37 Å²	37	36.7 Å²	36.7	26%	0.259	21%	0.206	S	C	.	.	H	α-helix	trans	-71.5	-36.1	-179.2	71.1	0	0	0	0	113	C906 L907 Q913 N914	C906-S910 PolarHBondContact O-N 3.04Å; C906-S910 VanDerWaalsContact O-N 3.14Å; L907-S910 PolarHBondContact O-N 3.45Å; L907-S910 PolarHBondContact O-OG 3.49Å; S910-Q913 PolarHBondContact O-N 3.4Å; S910-N914 VanDerWaalsContact O-CB 3.32Å; S910-N914 WeakPolarHBondContact O-CB 3.23Å; S910-N914 VanDerWaalsContact O-CG 3.3Å; S910-N914 PolarHBondContact O-N 2.85Å; S910-N914 PolarHBondContact O-ND2 3.47Å
911	V	76.2	Confident	76.2	Confident	3 Å²	3	34 Å²	34	2%	0.018	19%	0.187	C	C	.	.	H	α-helix	trans	-68.2	-38.2	176.7	176.1	0	0	0	0	111.2	L907 L908 N914 G915 F917 L920 F973	L907-V911 WeakPolarHBondContact O-CG2 3.45Å; L907-V911 PolarHBondContact O-N 3Å; L908-V911 PolarHBondContact O-N 3.11Å; V911-N914 PolarHBondContact O-N 3.14Å; V911-G915 WeakPolarHBondContact O-CA 3.49Å; V911-G915 PolarHBondContact O-N 2.88Å; V911-F917 HydrophobicContact CG1-CD1 4.49Å; V911-L920 HydrophobicContact CG2-CB 3.73Å; V911-L920 HydrophobicContact CG2-CD1 4.34Å; V911-L920 HydrophobicContact CG2-CD2 4.49Å; V911-L920 HydrophobicContact CG2-CG 4.39Å; V911-F973 HydrophobicContact CB-CE1 4.28Å; V911-F973 HydrophobicContact CB-CZ 3.82Å; V911-F973 HydrophobicContact CG1-CE1 4.2Å; V911-F973 HydrophobicContact CG1-CE2 3.63Å; V911-F973 HydrophobicContact CG1-CZ 3.34Å
912	A	69.2	Low	76.8	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.025	20%	0.201	C	C	.	.	H	α-helix	trans	-59.1	-51	172.9	0	0	0	0	0	110.8	L908 N914 F973 Y976 H977 Y1026	L908-A912 WeakPolarHBondContact O-CB 3.08Å; L908-A912 PolarHBondContact O-N 3.26Å; A912-N914 VanDerWaalsContact C-N 3.33Å; A912-N914 PolarHBondContact O-N 3.34Å; A912-F973 HydrophobicContact CB-CD1 3.56Å; A912-F973 HydrophobicContact CB-CE1 3.98Å; A912-F973 HydrophobicContact CB-CG 4.39Å; A912-Y976 HydrophobicContact CB-CD1 3.52Å; A912-Y976 HydrophobicContact CB-CD2 3.83Å; A912-Y976 HydrophobicContact CB-CE1 3.67Å; A912-Y976 HydrophobicContact CB-CE2 3.96Å; A912-Y976 HydrophobicContact CB-CG 3.6Å; A912-H977 PolarHBondContact O-CE1 2.9Å; A912-H977 PolarHBondContact O-NE2 3.28Å; A912-Y1026 HydrophobicContact CB-CE2 4.18Å
913	Q	68.3	Low	77.2	Confident	127 Å²	127	36.2 Å²	36.2	59%	0.593	20%	0.199	S	C	*	.	H	α-helix	trans	-62.6	-36.6	-179.2	-68.4	174.2	28.2	0	0	113.4	D909 S910 Y976	D909-Q913 WeakPolarHBondContact O-CG 3.42Å; D909-Q913 PolarHBondContact O-N 3.4Å; S910-Q913 PolarHBondContact O-N 3.4Å; Q913-Y976 HydrophobicContact CG-CE1 3.99Å; Q913-Y976 PolarHBondContact NE2-OH 3.14Å
914	N	68.7	Low	77.5	Confident	101 Å²	101	36.1 Å²	36.1	54%	0.54	20%	0.199	S	C	.	.	H	α-helix	trans	-98.1	-20.3	-172.6	-65.3	-25.4	0	0	0	114.9	S910 V911 A912 D916	S910-N914 VanDerWaalsContact O-CB 3.32Å; S910-N914 WeakPolarHBondContact O-CB 3.23Å; S910-N914 VanDerWaalsContact O-CG 3.3Å; S910-N914 PolarHBondContact O-N 2.85Å; S910-N914 PolarHBondContact O-ND2 3.47Å; V911-N914 PolarHBondContact O-N 3.14Å; A912-N914 VanDerWaalsContact C-N 3.33Å; A912-N914 PolarHBondContact O-N 3.34Å; N914-D916 VanDerWaalsContact C-N 3.32Å; N914-D916 PolarHBondContact O-N 3.03Å
915	G	64.9	Low	77.4	Confident	21 Å²	21	37.7 Å²	37.7	22%	0.216	21%	0.21	C	C	.	.			trans	73.5	10.4	-178.6	0	0	0	0	0	116.2	V911 W970	V911-G915 WeakPolarHBondContact O-CA 3.49Å; V911-G915 PolarHBondContact O-N 2.88Å; G915-W970 VanDerWaalsContact O-CH2 3.28Å; G915-W970 WeakPolarHBondContact O-CH2 3.39Å
916	D	71.4	Confident	77.5	Confident	61 Å²	61	42.3 Å²	42.3	33%	0.326	23%	0.231	S	C	.	.			trans	-114.2	115.4	-176.6	174.3	27.7	0	0	0	112.9	N914 S918 Q919	N914-D916 VanDerWaalsContact C-N 3.32Å; N914-D916 PolarHBondContact O-N 3.03Å; D916-S918 WeakPolarHBondContact OD1-CB 3.17Å; D916-S918 PolarHBondContact OD1-N 3.29Å; D916-Q919 WeakPolarHBondContact OD2-CG 3.4Å; D916-Q919 PolarHBondContact OD2-NE2 3.35Å
917	F	72.3	Confident	77.7	Confident	35 Å²	35	41 Å²	41	15%	0.154	22%	0.222	C	C	.	.	S	Bend	trans	-74.9	-19.9	175.4	-83.9	-82.2	0	0	0	114.5	V911 Q919 L920 Y921 P968 W970 F973	V911-F917 HydrophobicContact CG1-CD1 4.49Å; F917-Q919 PolarHBondContact O-N 3.16Å; F917-L920 HydrophobicContact CD1-CD2 4.21Å; F917-L920 WeakPolarHBondContact O-CB 3.32Å; F917-L920 PolarHBondContact O-N 3.36Å; F917-Y921 HydrophobicContact CB-CD2 4.08Å; F917-Y921 HydrophobicContact CB-CE2 3.92Å; F917-Y921 AromaticContact CD1-CE2 3.76Å; F917-Y921 HydrophobicContact CD1-CE2 3.76Å; F917-Y921 HydrophobicContact CG-CE2 4.2Å; F917-Y921 WeakPolarHBondContact O-CD2 3.35Å; F917-Y921 PolarHBondContact O-N 3.22Å; F917-P968 HydrophobicContact CE1-CB 3.86Å; F917-W970 HydrophobicContact CD2-CZ2 4.26Å; F917-W970 AromaticContact CE2-CD2 3.8Å; F917-W970 HydrophobicContact CE2-CD2 3.8Å; F917-W970 AromaticContact CE2-CE2 3.66Å; F917-W970 HydrophobicContact CE2-CE3 4.31Å; F917-W970 HydrophobicContact CE2-CG 4.08Å; F917-W970 HydrophobicContact CE2-CZ2 4.08Å; F917-W970 AromaticContact CE2-NE1 3.8Å; F917-F973 AromaticContact CE1-CE2 3.71Å; F917-F973 HydrophobicContact CE1-CE2 3.71Å; F917-F973 HydrophobicContact CE1-CZ 4.38Å; F917-F973 HydrophobicContact CE2-CE2 4.1Å; F917-F973 HydrophobicContact CZ-CD2 4.07Å; F917-F973 AromaticContact CZ-CE2 3.46Å; F917-F973 HydrophobicContact CZ-CE2 3.46Å; F917-F973 VanDerWaalsContact CZ-CE2 3.46Å
918	S	75.7	Confident	77.9	Confident	63 Å²	63	42.5 Å²	42.5	44%	0.441	23%	0.227	S	C	.	.	H	α-helix	trans	-60.1	-48.2	-175.2	-161.3	0	0	0	0	110.7	D916 L920 Y921 D922	D916-S918 WeakPolarHBondContact OD1-CB 3.17Å; D916-S918 PolarHBondContact OD1-N 3.29Å; S918-L920 PolarHBondContact O-N 3.36Å; S918-Y921 PolarHBondContact O-N 3.17Å; S918-D922 WeakPolarHBondContact O-CB 3.12Å; S918-D922 PolarHBondContact O-N 3.33Å; S918-D922 PolarHBondContact OG-OD2 3.43Å
919	Q	75	Confident	78.1	Confident	98 Å²	98	47.5 Å²	47.5	46%	0.458	25%	0.25	S	S	.	.	H	α-helix	trans	-57.1	-34.3	179.5	-67.6	170.6	53	0	0	113.2	D916 F917 T923	D916-Q919 WeakPolarHBondContact OD2-CG 3.4Å; D916-Q919 PolarHBondContact OD2-NE2 3.35Å; F917-Q919 PolarHBondContact O-N 3.16Å; Q919-T923 WeakPolarHBondContact O-CB 3.37Å; Q919-T923 PolarHBondContact O-N 3.48Å; Q919-T923 VanDerWaalsContact O-N 3.13Å; Q919-T923 PolarHBondContact O-OG1 3.27Å
920	L	81.9	Confident	78.4	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-53.5	173.3	-173.7	61.7	0	0	0	111.2	L907 L908 V911 F917 S918 T923 L924 P968	L907-L920 HydrophobicContact CB-CD1 3.74Å; L908-L920 HydrophobicContact CD2-CD1 4.5Å; L908-L920 HydrophobicContact CD2-CD2 4.16Å; V911-L920 HydrophobicContact CG2-CB 3.73Å; V911-L920 HydrophobicContact CG2-CD1 4.34Å; V911-L920 HydrophobicContact CG2-CD2 4.49Å; V911-L920 HydrophobicContact CG2-CG 4.39Å; F917-L920 HydrophobicContact CD1-CD2 4.21Å; F917-L920 WeakPolarHBondContact O-CB 3.32Å; F917-L920 PolarHBondContact O-N 3.36Å; S918-L920 PolarHBondContact O-N 3.36Å; L920-T923 PolarHBondContact O-N 3.06Å; L920-L924 HydrophobicContact CD1-CD1 4.02Å; L920-L924 HydrophobicContact CD1-CG 4.41Å; L920-L924 HydrophobicContact CG-CD1 3.93Å; L920-L924 WeakPolarHBondContact O-CB 3.43Å; L920-L924 VanDerWaalsContact O-CG 3.28Å; L920-L924 WeakPolarHBondContact O-CG 3.49Å; L920-L924 PolarHBondContact O-N 3.12Å; L920-P968 HydrophobicContact CD2-CB 4.09Å; L920-P968 HydrophobicContact CD2-CG 4.15Å
921	Y	84.7	Confident	78.6	Confident	32 Å²	32	48.5 Å²	48.5	13%	0.125	25%	0.253	C	S	.	.	H	α-helix	trans	-71	-35.6	-174.5	-70.7	-57.2	0	0	0	112.5	F917 S918 S925 F946 G950 P968	F917-Y921 HydrophobicContact CB-CD2 4.08Å; F917-Y921 HydrophobicContact CB-CE2 3.92Å; F917-Y921 AromaticContact CD1-CE2 3.76Å; F917-Y921 HydrophobicContact CD1-CE2 3.76Å; F917-Y921 HydrophobicContact CG-CE2 4.2Å; F917-Y921 WeakPolarHBondContact O-CD2 3.35Å; F917-Y921 PolarHBondContact O-N 3.22Å; S918-Y921 PolarHBondContact O-N 3.17Å; Y921-S925 WeakPolarHBondContact O-CB 3.49Å; Y921-S925 PolarHBondContact O-N 3.25Å; Y921-F946 AromaticContact CD1-CE2 3.99Å; Y921-F946 HydrophobicContact CD1-CE2 3.99Å; Y921-F946 AromaticContact CD1-CZ 3.9Å; Y921-F946 HydrophobicContact CD1-CZ 3.9Å; Y921-F946 HydrophobicContact CG-CZ 4.44Å; Y921-F946 VanDerWaalsContact O-CZ 3.25Å; Y921-F946 WeakPolarHBondContact O-CZ 3.45Å; Y921-G950 WeakPolarHBondContact CD1-O 3.15Å; Y921-G950 VanDerWaalsContact CD2-O 3.31Å; Y921-G950 WeakPolarHBondContact CD2-O 3.3Å; Y921-G950 WeakPolarHBondContact CE1-O 3.31Å; Y921-G950 WeakPolarHBondContact CE2-O 3.49Å; Y921-P968 HydrophobicContact CE1-CG 4.46Å; Y921-P968 WeakPolarHBondContact OH-CD 3.27Å; Y921-P968 PolarHBondContact OH-O 3.45Å; Y921-P968 VanDerWaalsContact OH-O 3.1Å
922	D	82.5	Confident	78.9	Confident	85 Å²	85	55.6 Å²	55.6	46%	0.455	28%	0.28	S	S	.	.	H	α-helix	trans	-64.4	-44.7	172.9	-72	-48.4	0	0	0	111.4	S918 S925 Q926	S918-D922 WeakPolarHBondContact O-CB 3.12Å; S918-D922 PolarHBondContact O-N 3.33Å; S918-D922 PolarHBondContact OG-OD2 3.43Å; D922-S925 WeakPolarHBondContact O-CB 3.42Å; D922-S925 PolarHBondContact O-N 3.37Å; D922-Q926 WeakPolarHBondContact O-CG 3.44Å; D922-Q926 PolarHBondContact O-N 3.23Å; D922-Q926 VanDerWaalsContact O-N 3.09Å
923	T	82.5	Confident	79.5	Confident	28 Å²	28	62 Å²	62	17%	0.172	31%	0.307	C	S	.	.	H	α-helix	trans	-69	-44.4	178.5	-51.5	0	0	0	0	111.7	F901 L907 Q919 L920 S925 Q926 M927	F901-T923 HydrophobicContact CD1-CG2 4.17Å; L907-T923 HydrophobicContact CD1-CG2 3.81Å; L907-T923 HydrophobicContact CD2-CG2 4.04Å; Q919-T923 WeakPolarHBondContact O-CB 3.37Å; Q919-T923 PolarHBondContact O-N 3.48Å; Q919-T923 VanDerWaalsContact O-N 3.13Å; Q919-T923 PolarHBondContact O-OG1 3.27Å; L920-T923 PolarHBondContact O-N 3.06Å; T923-S925 VanDerWaalsContact C-N 3.29Å; T923-S925 PolarHBondContact O-N 3.38Å; T923-Q926 WeakPolarHBondContact O-CB 3.19Å; T923-Q926 PolarHBondContact O-N 2.91Å; T923-Q926 VanDerWaalsContact O-N 3.12Å; T923-M927 HydrophobicContact CG2-CG 4.5Å; T923-M927 HydrophobicContact CG2-SD 4.23Å; T923-M927 WeakPolarHBondContact O-CG 3.42Å; T923-M927 PolarHBondContact O-N 3.06Å
924	L	84.9	Confident	80	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.6	-35.3	175.4	-72.7	174.2	0	0	0	112.5	F870 L904 L920 M927 Y928 F946 F953	F870-L924 HydrophobicContact CZ-CD2 4.03Å; L904-L924 HydrophobicContact CD1-CD1 4.45Å; L904-L924 HydrophobicContact CD1-CD2 4.17Å; L920-L924 HydrophobicContact CD1-CD1 4.02Å; L920-L924 HydrophobicContact CD1-CG 4.41Å; L920-L924 HydrophobicContact CG-CD1 3.93Å; L920-L924 WeakPolarHBondContact O-CB 3.43Å; L920-L924 VanDerWaalsContact O-CG 3.28Å; L920-L924 WeakPolarHBondContact O-CG 3.49Å; L920-L924 PolarHBondContact O-N 3.12Å; L924-M927 HydrophobicContact CD2-SD 4.17Å; L924-M927 PolarHBondContact O-N 3.41Å; L924-Y928 VanDerWaalsContact O-CB 3.3Å; L924-Y928 WeakPolarHBondContact O-CB 3.41Å; L924-Y928 PolarHBondContact O-N 2.91Å; L924-F946 HydrophobicContact CB-CD2 4.23Å; L924-F946 HydrophobicContact CB-CE2 3.71Å; L924-F953 HydrophobicContact CD1-CD1 3.75Å; L924-F953 HydrophobicContact CD1-CE1 3.9Å
925	S	85.4	Confident	80.3	Confident	32 Å²	32	60.4 Å²	60.4	22%	0.224	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-41.7	172.6	-178.8	0	0	0	0	111.8	Y921 D922 T923 Q929	Y921-S925 WeakPolarHBondContact O-CB 3.49Å; Y921-S925 PolarHBondContact O-N 3.25Å; D922-S925 WeakPolarHBondContact O-CB 3.42Å; D922-S925 PolarHBondContact O-N 3.37Å; T923-S925 VanDerWaalsContact C-N 3.29Å; T923-S925 PolarHBondContact O-N 3.38Å; S925-Q929 WeakPolarHBondContact O-CB 3.44Å; S925-Q929 VanDerWaalsContact O-CG 3.23Å; S925-Q929 WeakPolarHBondContact O-CG 3.37Å; S925-Q929 PolarHBondContact O-N 3.21Å; S925-Q929 PolarHBondContact O-NE2 3.07Å; S925-Q929 PolarHBondContact OG-NE2 2.9Å
926	Q	85.3	Confident	80.8	Confident	100 Å²	100	68.3 Å²	68.3	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-65.8	-47.9	174.8	-67.9	172.4	42.1	0	0	111.8	F901 D922 T923 Y928 Q929 T930	F901-Q926 HydrophobicContact CE1-CB 3.8Å; F901-Q926 HydrophobicContact CZ-CB 4.18Å; D922-Q926 WeakPolarHBondContact O-CG 3.44Å; D922-Q926 PolarHBondContact O-N 3.23Å; D922-Q926 VanDerWaalsContact O-N 3.09Å; T923-Q926 WeakPolarHBondContact O-CB 3.19Å; T923-Q926 PolarHBondContact O-N 2.91Å; T923-Q926 VanDerWaalsContact O-N 3.12Å; Q926-Y928 VanDerWaalsContact C-N 3.33Å; Q926-Y928 PolarHBondContact O-N 3.48Å; Q926-Q929 PolarHBondContact O-N 3.05Å; Q926-Q929 VanDerWaalsContact O-N 3.13Å; Q926-T930 PolarHBondContact O-N 3.1Å; Q926-T930 PolarHBondContact O-OG1 3.05Å
927	M	84	Confident	80.8	Confident	11 Å²	11	69.2 Å²	69.2	5%	0.054	33%	0.333	C	S	.	.	H	α-helix	trans	-57.8	-44.2	177	-66.6	169.5	89.3	0	0	111.9	F870 F901 L907 T923 L924 T930 Q931	F870-M927 HydrophobicContact CD2-CE 3.75Å; F870-M927 HydrophobicContact CE2-CB 4.15Å; F870-M927 HydrophobicContact CE2-CE 3.67Å; F870-M927 HydrophobicContact CE2-SD 4.3Å; F870-M927 HydrophobicContact CG-CE 4.47Å; F870-M927 HydrophobicContact CZ-CE 4.33Å; F901-M927 HydrophobicContact CB-CE 3.94Å; F901-M927 HydrophobicContact CB-CG 3.79Å; F901-M927 HydrophobicContact CB-SD 4.13Å; F901-M927 HydrophobicContact CD1-CG 3.68Å; F901-M927 HydrophobicContact CD2-CG 4.08Å; F901-M927 HydrophobicContact CE1-CG 4.29Å; F901-M927 HydrophobicContact CG-CG 3.57Å; L907-M927 HydrophobicContact CD1-SD 4.19Å; T923-M927 HydrophobicContact CG2-CG 4.5Å; T923-M927 HydrophobicContact CG2-SD 4.23Å; T923-M927 WeakPolarHBondContact O-CG 3.42Å; T923-M927 PolarHBondContact O-N 3.06Å; L924-M927 HydrophobicContact CD2-SD 4.17Å; L924-M927 PolarHBondContact O-N 3.41Å; M927-T930 PolarHBondContact O-N 2.54Å; M927-Q931 PolarHBondContact O-N 3.16Å
928	Y	85.9	Confident	81	Confident	43 Å²	43	75.5 Å²	75.5	17%	0.169	36%	0.355	C	S	.	.	H	α-helix	trans	-62.9	-41.3	175.1	169.3	-112.4	0	0	0	112.5	L924 Q926 R932 I943 F946	L924-Y928 VanDerWaalsContact O-CB 3.3Å; L924-Y928 WeakPolarHBondContact O-CB 3.41Å; L924-Y928 PolarHBondContact O-N 2.91Å; Q926-Y928 VanDerWaalsContact C-N 3.33Å; Q926-Y928 PolarHBondContact O-N 3.48Å; Y928-R932 WeakPolarHBondContact O-CB 3.31Å; Y928-R932 PolarHBondContact O-N 3.42Å; Y928-I943 HydrophobicContact CD2-CG1 4.11Å; Y928-I943 HydrophobicContact CD2-CG2 4.28Å; Y928-F946 HydrophobicContact CD1-CB 3.75Å; Y928-F946 HydrophobicContact CE1-CB 4.2Å; Y928-F946 HydrophobicContact CG-CB 3.95Å
929	Q	86	Confident	80.7	Confident	105 Å²	105	77 Å²	77	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-64.7	-38.8	176.1	-75.1	175.9	68.9	0	0	112	S925 Q926 R932 K933	S925-Q929 WeakPolarHBondContact O-CB 3.44Å; S925-Q929 VanDerWaalsContact O-CG 3.23Å; S925-Q929 WeakPolarHBondContact O-CG 3.37Å; S925-Q929 PolarHBondContact O-N 3.21Å; S925-Q929 PolarHBondContact O-NE2 3.07Å; S925-Q929 PolarHBondContact OG-NE2 2.9Å; Q926-Q929 PolarHBondContact O-N 3.05Å; Q926-Q929 VanDerWaalsContact O-N 3.13Å; Q929-R932 PolarHBondContact O-N 3.37Å; Q929-K933 WeakPolarHBondContact O-CG 3.5Å; Q929-K933 PolarHBondContact O-N 2.83Å
930	T	84.2	Confident	80.6	Confident	42 Å²	42	76 Å²	76	26%	0.258	36%	0.356	S	S	.	.	H	α-helix	trans	-66.4	-51.4	175.3	-59.6	0	0	0	0	111.6	F901 Q926 M927 R932 K933 L934	F901-T930 HydrophobicContact CE2-CG2 4.37Å; Q926-T930 PolarHBondContact O-N 3.1Å; Q926-T930 PolarHBondContact O-OG1 3.05Å; M927-T930 PolarHBondContact O-N 2.54Å; T930-R932 PolarHBondContact O-N 3.3Å; T930-K933 WeakPolarHBondContact O-CB 3.32Å; T930-K933 PolarHBondContact O-N 2.78Å; T930-L934 HydrophobicContact CG2-CD1 4.07Å; T930-L934 PolarHBondContact O-N 2.87Å; T930-L934 VanDerWaalsContact O-N 3.07Å
931	Q	81.8	Confident	80.5	Confident	28 Å²	28	76.9 Å²	76.9	13%	0.131	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-30.4	176.4	-71.2	-159.3	-14.8	0	0	113.1	M927 K933 L934 Y935 R941 S942	M927-Q931 PolarHBondContact O-N 3.16Å; Q931-K933 VanDerWaalsContact C-N 3.32Å; Q931-L934 PolarHBondContact O-N 3.05Å; Q931-Y935 PolarHBondContact O-N 2.89Å; Q931-R941 HydrophobicContact CB-CG 4.42Å; Q931-S942 PolarHBondContact NE2-OG 3.46Å
932	R	81.8	Confident	80.4	Confident	152 Å²	152	75.6 Å²	75.6	57%	0.574	36%	0.355	S	S	*	.	H	α-helix	trans	-68.7	-26.9	173.9	178.9	174.4	174	-150.9	-6	113.5	Y928 Q929 T930	Y928-R932 WeakPolarHBondContact O-CB 3.31Å; Y928-R932 PolarHBondContact O-N 3.42Å; Q929-R932 PolarHBondContact O-N 3.37Å; T930-R932 PolarHBondContact O-N 3.3Å
933	K	83.1	Confident	80.6	Confident	138 Å²	138	71.6 Å²	71.6	60%	0.6	33%	0.334	S	S	*	.	H	α-helix	trans	-79.1	-39.4	172.1	-70.9	173.2	177.8	-179.6	0	112	Q929 T930 Q931	Q929-K933 WeakPolarHBondContact O-CG 3.5Å; Q929-K933 PolarHBondContact O-N 2.83Å; T930-K933 WeakPolarHBondContact O-CB 3.32Å; T930-K933 PolarHBondContact O-N 2.78Å; Q931-K933 VanDerWaalsContact C-N 3.32Å
934	L	78.4	Confident	80.6	Confident	118 Å²	118	73.4 Å²	73.4	62%	0.618	34%	0.338	S	S	*	.	H	α-helix	trans	-73.8	-38	-176	-68.1	171.5	0	0	0	113.7	T930 Q931	T930-L934 HydrophobicContact CG2-CD1 4.07Å; T930-L934 PolarHBondContact O-N 2.87Å; T930-L934 VanDerWaalsContact O-N 3.07Å; Q931-L934 PolarHBondContact O-N 3.05Å
935	Y	75.3	Confident	80.5	Confident	77 Å²	77	80.5 Å²	80.5	30%	0.302	36%	0.364	S	S	.	.			trans	-121.1	115.8	-177.5	-58.2	-76.6	0	0	0	110.3	Q931 L940 R941	Q931-Y935 PolarHBondContact O-N 2.89Å; Y935-L940 HydrophobicContact CD1-CB 4Å; Y935-L940 HydrophobicContact CG-CB 4.26Å; Y935-R941 HydrophobicContact CD2-CG 4.35Å; Y935-R941 HydrophobicContact CG-CG 4.5Å; Y935-R941 PolarHBondContact O-NE 2.8Å; Y935-R941 PolarHBondContact O-NH2 3.16Å
936	E	74	Confident	80.4	Confident	186 Å²	186	80.2 Å²	80.2	87%	0.869	36%	0.359	S	S	*	.	S	Bend	trans	-66.6	-48.9	174.5	-64.1	-156.3	135.6	0	0	111.5	R938 R941	E936-R938 PolarHBondContact O-N 3.05Å; E936-R941 PolarHBondContact O-NH2 3.43Å
937	N	72.9	Confident	80.1	Confident	81 Å²	81	77.9 Å²	77.9	43%	0.433	35%	0.347	S	S	.	.	S	Bend	trans	-63	129.2	175.2	-171.9	-14.3	0	0	0	110.5	D939 L940	N937-D939 VanDerWaalsContact C-N 3.3Å; N937-D939 PolarHBondContact O-N 2.99Å; N937-D939 PolarHBondContact OD1-N 3.41Å; N937-D939 PolarHBondContact OD1-OD2 2.89Å; N937-L940 HydrophobicContact CB-CD1 4.11Å; N937-L940 HydrophobicContact CB-CG 4.17Å
938	R	76.2	Confident	79.2	Confident	166 Å²	166	89.8 Å²	89.8	63%	0.626	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-73.6	-21.3	-178.1	-54.8	-172.4	-174.1	179.9	4.2	113.3	E936 N956	E936-R938 PolarHBondContact O-N 3.05Å; R938-N956 PolarHBondContact O-ND2 2.88Å
939	D	69.9	Low	78.5	Confident	96 Å²	96	93.4 Å²	93.4	51%	0.513	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-82.6	-15.4	-178.9	-60.7	-54.4	0	0	0	112.5	N937 R944	N937-D939 VanDerWaalsContact C-N 3.3Å; N937-D939 PolarHBondContact O-N 2.99Å; N937-D939 PolarHBondContact OD1-N 3.41Å; N937-D939 PolarHBondContact OD1-OD2 2.89Å; D939-R944 IonicContact OD1-CZ 2.93Å; D939-R944 IonicContact OD1-NH1 3.4Å; D939-R944 PolarHBondContact OD1-NH1 3.44Å; D939-R944 IonicContact OD1-NH2 2.74Å; D939-R944 PolarHBondContact OD1-NH2 3.26Å
940	L	72.2	Confident	77.5	Confident	77 Å²	77	89.3 Å²	89.3	40%	0.403	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-90.2	-4	176.2	-61.9	179.9	0	0	0	114.1	Y935 N937	Y935-L940 HydrophobicContact CD1-CB 4Å; Y935-L940 HydrophobicContact CG-CB 4.26Å; N937-L940 HydrophobicContact CB-CD1 4.11Å; N937-L940 HydrophobicContact CB-CG 4.17Å
941	R	80.5	Confident	77	Confident	17 Å²	17	89.3 Å²	89.3	6%	0.064	40%	0.402	C	S	.	.			trans	-89.3	139.5	179.3	-60.3	174.6	-169.4	152.1	4.6	110.3	Q931 Y935 E936 N956	Q931-R941 HydrophobicContact CB-CG 4.42Å; Y935-R941 HydrophobicContact CD2-CG 4.35Å; Y935-R941 HydrophobicContact CG-CG 4.5Å; Y935-R941 PolarHBondContact O-NE 2.8Å; Y935-R941 PolarHBondContact O-NH2 3.16Å; E936-R941 PolarHBondContact O-NH2 3.43Å; R941-N956 WeakPolarHBondContact O-CB 3.49Å; R941-N956 PolarHBondContact O-ND2 2.95Å
942	S	81.8	Confident	77.1	Confident	6 Å²	6	88 Å²	88	4%	0.042	40%	0.396	C	S	.	.	S	Bend	trans	-62.5	-45.8	170.2	-35.1	0	0	0	0	110.7	N866 Q931 L955 N956	N866-S942 PolarHBondContact O-OG 3.17Å; Q931-S942 PolarHBondContact NE2-OG 3.46Å; S942-L955 WeakPolarHBondContact O-CA 3.16Å; S942-N956 PolarHBondContact O-N 3.35Å
943	I	85.9	Confident	77.4	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	107.5	173.7	179.6	160.7	0	0	0	111	F870 Y928 F946 F953 V954 L955	F870-I943 HydrophobicContact CD2-CG2 4.49Å; F870-I943 HydrophobicContact CE2-CB 4.07Å; F870-I943 HydrophobicContact CE2-CG2 3.67Å; F870-I943 HydrophobicContact CZ-CB 3.94Å; F870-I943 HydrophobicContact CZ-CD1 4.31Å; F870-I943 HydrophobicContact CZ-CG2 4.04Å; Y928-I943 HydrophobicContact CD2-CG1 4.11Å; Y928-I943 HydrophobicContact CD2-CG2 4.28Å; I943-F946 HydrophobicContact CD1-CD2 4.4Å; I943-F953 HydrophobicContact CD1-CB 3.83Å; I943-V954 CarbonylContact C-O 3.42Å; I943-L955 HydrophobicContact CB-CD2 4.21Å
944	R	82.7	Confident	77.6	Confident	67 Å²	67	74.8 Å²	74.8	25%	0.253	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-40.9	-175.2	-165.2	-168.6	-168.7	80.7	5	113	D939 V954 N956 P963	D939-R944 IonicContact OD1-CZ 2.93Å; D939-R944 IonicContact OD1-NH1 3.4Å; D939-R944 PolarHBondContact OD1-NH1 3.44Å; D939-R944 IonicContact OD1-NH2 2.74Å; D939-R944 PolarHBondContact OD1-NH2 3.26Å; R944-V954 HydrophobicContact CB-CB 4.29Å; R944-V954 HydrophobicContact CB-CG1 4.07Å; R944-V954 PolarHBondContact N-O 2.88Å; R944-N956 WeakPolarHBondContact CB-OD1 3.23Å; R944-N956 WeakPolarHBondContact CD-OD1 3.43Å; R944-N956 WeakPolarHBondContact CG-OD1 3.37Å; R944-N956 PolarHBondContact NH1-OD1 3.11Å; R944-P963 VanDerWaalsContact CD-CG 3.42Å
945	R	83.4	Confident	78	Confident	148 Å²	148	69.2 Å²	69.2	56%	0.558	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.8	145.4	-172.1	-173.6	-176.6	-173.7	-176.5	3.3	109.9	V954	R945-V954 HydrophobicContact CB-CB 4.02Å; R945-V954 HydrophobicContact CB-CG2 3.93Å; R945-V954 PolarHBondContact O-N 3.08Å
946	F	84	Confident	78.4	Confident	27 Å²	27	66.6 Å²	66.6	12%	0.118	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.8	168.8	-172.3	-98.4	0	0	0	107.9	Y921 L924 Y928 I943 F953	Y921-F946 AromaticContact CD1-CE2 3.99Å; Y921-F946 HydrophobicContact CD1-CE2 3.99Å; Y921-F946 AromaticContact CD1-CZ 3.9Å; Y921-F946 HydrophobicContact CD1-CZ 3.9Å; Y921-F946 HydrophobicContact CG-CZ 4.44Å; Y921-F946 VanDerWaalsContact O-CZ 3.25Å; Y921-F946 WeakPolarHBondContact O-CZ 3.45Å; L924-F946 HydrophobicContact CB-CD2 4.23Å; L924-F946 HydrophobicContact CB-CE2 3.71Å; Y928-F946 HydrophobicContact CD1-CB 3.75Å; Y928-F946 HydrophobicContact CE1-CB 4.2Å; Y928-F946 HydrophobicContact CG-CB 3.95Å; I943-F946 HydrophobicContact CD1-CD2 4.4Å; F946-F953 HydrophobicContact CD2-CB 4.08Å
947	K	78.7	Confident	78.9	Confident	50 Å²	50	58.1 Å²	58.1	22%	0.217	27%	0.266	C	S	.	.			trans	-77.3	138.1	176.4	-76.2	-170.1	-172.3	155.9	0	110.7	N949 G950 S952 E965	K947-N949 VanDerWaalsContact CB-OD1 3.31Å; K947-N949 WeakPolarHBondContact CB-OD1 3.12Å; K947-N949 PolarHBondContact O-N 2.92Å; K947-G950 PolarHBondContact O-N 2.97Å; K947-S952 WeakPolarHBondContact CD-OG 3.49Å; K947-S952 WeakPolarHBondContact CE-OG 3.5Å; K947-S952 WeakPolarHBondContact CG-OG 3.37Å; K947-S952 PolarHBondContact N-O 3.39Å; K947-S952 PolarHBondContact NZ-OG 3.48Å; K947-E965 WeakPolarHBondContact CE-OE1 3.45Å; K947-E965 IonicContact NZ-OE1 2.73Å; K947-E965 PolarHBondContact NZ-OE1 3.49Å; K947-E965 IonicContact NZ-OE2 2.72Å
948	R	64.6	Low	78.9	Confident	261 Å²	261	56.1 Å²	56.1	99%	0.985	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.3	-176.8	-80.1	-176	173	168.5	-3.7	115.2
949	N	70.4	Confident	78.5	Confident	120 Å²	120	48.2 Å²	48.2	64%	0.642	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	6.5	178.4	69.1	-24.5	0	0	0	113.5	K947 S951	K947-N949 VanDerWaalsContact CB-OD1 3.31Å; K947-N949 WeakPolarHBondContact CB-OD1 3.12Å; K947-N949 PolarHBondContact O-N 2.92Å; N949-S951 VanDerWaalsContact C-N 3.34Å; N949-S951 PolarHBondContact ND2-OG 3.07Å; N949-S951 PolarHBondContact O-N 2.92Å; N949-S951 PolarHBondContact OD1-N 3.23Å; N949-S951 PolarHBondContact OD1-OG 3.3Å
950	G	65.8	Low	78.4	Confident	19 Å²	19	44.8 Å²	44.8	20%	0.196	21%	0.209	C	C	.	.	S	Bend	trans	63.4	34.5	-179.7	0	0	0	0	0	114.1	Y921 K947	Y921-G950 WeakPolarHBondContact CD1-O 3.15Å; Y921-G950 VanDerWaalsContact CD2-O 3.31Å; Y921-G950 WeakPolarHBondContact CD2-O 3.3Å; Y921-G950 WeakPolarHBondContact CE1-O 3.31Å; Y921-G950 WeakPolarHBondContact CE2-O 3.49Å; K947-G950 PolarHBondContact O-N 2.97Å
951	S	74.1	Confident	78	Confident	42 Å²	42	44.1 Å²	44.1	29%	0.294	21%	0.208	S	C	.	.	S	Bend	trans	-105.2	-21	-179	61.6	0	0	0	0	115.3	N949 A967	N949-S951 VanDerWaalsContact C-N 3.34Å; N949-S951 PolarHBondContact ND2-OG 3.07Å; N949-S951 PolarHBondContact O-N 2.92Å; N949-S951 PolarHBondContact OD1-N 3.23Å; N949-S951 PolarHBondContact OD1-OG 3.3Å; S951-A967 WeakPolarHBondContact O-CB 3.36Å
952	S	84.4	Confident	77.3	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.007	22%	0.216	C	C	.	.			trans	-162.8	159.2	178.5	68.2	0	0	0	0	113.1	K947 E965 Y966	K947-S952 WeakPolarHBondContact CD-OG 3.49Å; K947-S952 WeakPolarHBondContact CE-OG 3.5Å; K947-S952 WeakPolarHBondContact CG-OG 3.37Å; K947-S952 PolarHBondContact N-O 3.39Å; K947-S952 PolarHBondContact NZ-OG 3.48Å; S952-E965 WeakPolarHBondContact CB-OE1 3.39Å; S952-E965 VanDerWaalsContact OG-CD 3.23Å; S952-E965 PolarHBondContact OG-OE1 3.18Å; S952-Y966 VanDerWaalsContact CA-O 3.31Å; S952-Y966 WeakPolarHBondContact CA-O 3.42Å; S952-Y966 WeakPolarHBondContact CB-O 3.13Å
953	F	87.4	Confident	76.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.1	173.6	62.6	-97.9	0	0	0	111.2	L904 L924 I943 F946 L955 E965 Y966 P968	L904-F953 HydrophobicContact CD1-CZ 4.22Å; L904-F953 HydrophobicContact CD2-CE2 4.38Å; L904-F953 HydrophobicContact CD2-CZ 4.09Å; L924-F953 HydrophobicContact CD1-CD1 3.75Å; L924-F953 HydrophobicContact CD1-CE1 3.9Å; I943-F953 HydrophobicContact CD1-CB 3.83Å; F946-F953 HydrophobicContact CD2-CB 4.08Å; F953-L955 HydrophobicContact CD2-CD2 3.84Å; F953-L955 HydrophobicContact CD2-CG 3.95Å; F953-L955 HydrophobicContact CE2-CD1 4.04Å; F953-L955 HydrophobicContact CE2-CD2 4Å; F953-L955 HydrophobicContact CE2-CG 3.84Å; F953-E965 CarbonylContact O-C 3.54Å; F953-E965 WeakPolarHBondContact O-CA 3.41Å; F953-Y966 HydrophobicContact CD2-CD2 4.42Å; F953-Y966 AromaticContact CE2-CD2 3.88Å; F953-Y966 HydrophobicContact CE2-CD2 3.88Å; F953-Y966 HydrophobicContact CE2-CG 4.29Å; F953-Y966 PolarHBondContact N-O 2.87Å; F953-Y966 PolarHBondContact O-N 2.87Å; F953-P968 HydrophobicContact CD1-CG 4.29Å; F953-P968 HydrophobicContact CE1-CG 3.6Å
954	V	87	Confident	76.7	Confident	12 Å²	12	47.4 Å²	47.4	7%	0.073	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.5	-177.1	-176.3	0	0	0	0	110.1	I943 R944 R945 P963 I964 E965	I943-V954 CarbonylContact C-O 3.42Å; R944-V954 HydrophobicContact CB-CB 4.29Å; R944-V954 HydrophobicContact CB-CG1 4.07Å; R944-V954 PolarHBondContact N-O 2.88Å; R945-V954 HydrophobicContact CB-CB 4.02Å; R945-V954 HydrophobicContact CB-CG2 3.93Å; R945-V954 PolarHBondContact O-N 3.08Å; V954-P963 HydrophobicContact CG1-CB 3.44Å; V954-P963 VanDerWaalsContact CG1-CB 3.44Å; V954-I964 CarbonylContact C-O 3.56Å; V954-I964 VanDerWaalsContact CA-O 3.26Å; V954-I964 WeakPolarHBondContact CA-O 3.42Å; V954-E965 HydrophobicContact CG2-CB 3.93Å; V954-E965 HydrophobicContact CG2-CG 3.87Å
955	L	87.9	Confident	76.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	145.5	176.6	-57.8	-174	0	0	0	112.3	L822 I867 F870 S942 I943 F953 I964 Y966	L822-L955 HydrophobicContact CD1-CD1 4.09Å; I867-L955 HydrophobicContact CD1-CB 4.49Å; F870-L955 HydrophobicContact CD1-CD2 4.41Å; F870-L955 HydrophobicContact CE1-CD2 3.75Å; F870-L955 HydrophobicContact CZ-CD2 4.31Å; S942-L955 WeakPolarHBondContact O-CA 3.16Å; I943-L955 HydrophobicContact CB-CD2 4.21Å; F953-L955 HydrophobicContact CD2-CD2 3.84Å; F953-L955 HydrophobicContact CD2-CG 3.95Å; F953-L955 HydrophobicContact CE2-CD1 4.04Å; F953-L955 HydrophobicContact CE2-CD2 4Å; F953-L955 HydrophobicContact CE2-CG 3.84Å; L955-I964 PolarHBondContact N-O 3.02Å; L955-I964 PolarHBondContact O-N 3.44Å; L955-Y966 HydrophobicContact CB-CE2 4.2Å; L955-Y966 HydrophobicContact CD1-CD2 4.24Å; L955-Y966 HydrophobicContact CD1-CE2 3.92Å; L955-Y966 HydrophobicContact CG-CD2 4.15Å; L955-Y966 HydrophobicContact CG-CE2 4.07Å
956	N	83.1	Confident	77.1	Confident	23 Å²	23	39.2 Å²	39.2	12%	0.123	20%	0.202	C	C	.	.			trans	-95.8	77.7	170.1	-71.3	-30.9	0	0	0	110.1	R938 R941 S942 R944	R938-N956 PolarHBondContact O-ND2 2.88Å; R941-N956 WeakPolarHBondContact O-CB 3.49Å; R941-N956 PolarHBondContact O-ND2 2.95Å; S942-N956 PolarHBondContact O-N 3.35Å; R944-N956 WeakPolarHBondContact CB-OD1 3.23Å; R944-N956 WeakPolarHBondContact CD-OD1 3.43Å; R944-N956 WeakPolarHBondContact CG-OD1 3.37Å; R944-N956 PolarHBondContact NH1-OD1 3.11Å
957	H	84.6	Confident	77	Confident	7 Å²	7	39 Å²	39	3%	0.032	20%	0.204	C	C	.	.			trans	-66.9	139.4	166.5	-66.2	-81.4	0	0	0	110.5	F783 E829 I867 L959 S960 Y966	F783-H957 HydrophobicContact CE2-CB 3.69Å; F783-H957 HydrophobicContact CZ-CB 3.49Å; F783-H957 VanDerWaalsContact CZ-CB 3.49Å; F783-H957 AromaticContact CZ-CG 3.96Å; E829-H957 WeakPolarHBondContact OE1-CA 3.41Å; E829-H957 WeakPolarHBondContact OE1-CB 3.47Å; E829-H957 IonicContact OE1-ND1 2.87Å; I867-H957 HydrophobicContact CD1-CB 4.45Å; H957-L959 VanDerWaalsContact C-N 3.33Å; H957-L959 PolarHBondContact O-N 3.06Å; H957-S960 PolarHBondContact O-N 2.88Å; H957-Y966 AromaticContact NE2-CE2 3.5Å; H957-Y966 AromaticContact NE2-CZ 3.61Å; H957-Y966 PolarHBondContact NE2-OH 3.27Å
958	N	73.6	Confident	77	Confident	39 Å²	39	37 Å²	37	21%	0.209	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-46.7	-174.4	-70.2	-50.7	0	0	0	112	E829 T864 S960 G1156	E829-N958 PolarHBondContact OE1-N 2.8Å; E829-N958 PolarHBondContact OE2-ND2 3.2Å; T864-N958 PolarHBondContact OG1-ND2 2.66Å; T864-N958 VanDerWaalsContact OG1-ND2 3.15Å; N958-S960 VanDerWaalsContact C-N 3.32Å; N958-S960 PolarHBondContact O-N 3.28Å; N958-G1156 VanDerWaalsContact O-CA 3.25Å; N958-G1156 WeakPolarHBondContact O-CA 3.28Å
959	L	67.2	Low	77.4	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	9.6	-171.9	-132	167	0	0	0	114.4	R455 F783 Y828 H957 Q1153 I1157	R455-L959 HydrophobicContact CG-CD2 4.4Å; R455-L959 PolarHBondContact NE-O 3.36Å; R455-L959 PolarHBondContact NH2-O 3.05Å; F783-L959 HydrophobicContact CD2-CB 4.37Å; F783-L959 HydrophobicContact CG-CB 4.41Å; Y828-L959 HydrophobicContact CD1-CD1 4.34Å; Y828-L959 HydrophobicContact CE1-CD1 3.31Å; Y828-L959 VanDerWaalsContact CZ-CD1 3.42Å; Y828-L959 WeakPolarHBondContact OH-CD1 2.93Å; H957-L959 VanDerWaalsContact C-N 3.33Å; H957-L959 PolarHBondContact O-N 3.06Å; L959-Q1153 HydrophobicContact CD2-CG 4.19Å; L959-I1157 HydrophobicContact CD1-CG2 3.54Å; L959-I1157 HydrophobicContact CG-CG2 4.19Å
960	S	67.9	Low	77.4	Confident	23 Å²	23	28.2 Å²	28.2	16%	0.161	16%	0.16	C	C	.	.			trans	-88.8	134.6	178.4	-158.5	0	0	0	0	113.3	H957 N958 T962	H957-S960 PolarHBondContact O-N 2.88Å; N958-S960 VanDerWaalsContact C-N 3.32Å; N958-S960 PolarHBondContact O-N 3.28Å; S960-T962 WeakPolarHBondContact CB-O 3.44Å; S960-T962 PolarHBondContact O-N 3.46Å; S960-T962 PolarHBondContact OG-N 3.01Å; S960-T962 PolarHBondContact OG-O 3.26Å
961	T	63.6	Low	77.5	Confident	64 Å²	64	29.6 Å²	29.6	39%	0.393	17%	0.167	S	C	.	.	S	Bend	trans	-72.3	-19.9	169.6	22.4	0	0	0	0	112.2	R455 L1149 A1152	R455-T961 PolarHBondContact NH1-OG1 3.43Å; R455-T961 PolarHBondContact NH2-OG1 2.69Å; R455-T961 VanDerWaalsContact NH2-OG1 3.08Å; T961-L1149 HydrophobicContact CG2-CD1 4.11Å; T961-A1152 HydrophobicContact CG2-CB 3.34Å
962	T	65.5	Low	77.6	Confident	37 Å²	37	28 Å²	28	23%	0.227	16%	0.155	C	C	.	.	S	Bend	trans	-147.6	124.1	-171.9	41.3	0	0	0	0	108.5	S960 I964	S960-T962 WeakPolarHBondContact CB-O 3.44Å; S960-T962 PolarHBondContact O-N 3.46Å; S960-T962 PolarHBondContact OG-N 3.01Å; S960-T962 PolarHBondContact OG-O 3.26Å; T962-I964 PolarHBondContact O-N 2.89Å
963	P	73.7	Confident	76.8	Confident	51 Å²	51	28.1 Å²	28.1	33%	0.331	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-53.1	133.8	-180	-26.3	33.9	0	0	0	112.2	R944 V954	R944-P963 VanDerWaalsContact CD-CG 3.42Å; V954-P963 HydrophobicContact CG1-CB 3.44Å; V954-P963 VanDerWaalsContact CG1-CB 3.44Å
964	I	81.7	Confident	75.5	Confident	4 Å²	4	28.3 Å²	28.3	2%	0.021	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123	-170	-60.7	179.7	0	0	0	109.5	F783 Q784 P786 N825 V954 L955 T962 Y966	F783-I964 HydrophobicContact CE1-CD1 3.88Å; F783-I964 HydrophobicContact CZ-CD1 3.75Å; Q784-I964 VanDerWaalsContact O-CD1 3.28Å; Q784-I964 WeakPolarHBondContact O-CD1 3.45Å; P786-I964 HydrophobicContact CG-CG2 3.63Å; N825-I964 WeakPolarHBondContact ND2-CD1 3.37Å; V954-I964 CarbonylContact C-O 3.56Å; V954-I964 VanDerWaalsContact CA-O 3.26Å; V954-I964 WeakPolarHBondContact CA-O 3.42Å; L955-I964 PolarHBondContact N-O 3.02Å; L955-I964 PolarHBondContact O-N 3.44Å; T962-I964 PolarHBondContact O-N 2.89Å; I964-Y966 HydrophobicContact CB-CE2 4.01Å; I964-Y966 HydrophobicContact CG2-CD1 4.28Å; I964-Y966 HydrophobicContact CG2-CD2 4.09Å; I964-Y966 HydrophobicContact CG2-CE1 3.79Å; I964-Y966 HydrophobicContact CG2-CE2 3.6Å; I964-Y966 HydrophobicContact CG2-CG 4.42Å; I964-Y966 VanDerWaalsContact CG2-CZ 3.44Å
965	E	86.1	Confident	73.9	Confident	43 Å²	43	28.6 Å²	28.6	20%	0.201	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.6	173.7	-169.2	174	135.4	0	0	110.5	T816 G817 K947 S952 F953 V954	T816-E965 CarbonylContact C-O 3.57Å; T816-E965 WeakPolarHBondContact CA-O 3.4Å; T816-E965 WeakPolarHBondContact CB-O 3.5Å; T816-E965 HydrophobicContact CG2-CB 4.32Å; T816-E965 HydrophobicContact CG2-CG 3.93Å; G817-E965 PolarHBondContact N-O 2.77Å; K947-E965 WeakPolarHBondContact CE-OE1 3.45Å; K947-E965 IonicContact NZ-OE1 2.73Å; K947-E965 PolarHBondContact NZ-OE1 3.49Å; K947-E965 IonicContact NZ-OE2 2.72Å; S952-E965 WeakPolarHBondContact CB-OE1 3.39Å; S952-E965 VanDerWaalsContact OG-CD 3.23Å; S952-E965 PolarHBondContact OG-OE1 3.18Å; F953-E965 CarbonylContact O-C 3.54Å; F953-E965 WeakPolarHBondContact O-CA 3.41Å; V954-E965 HydrophobicContact CG2-CB 3.93Å; V954-E965 HydrophobicContact CG2-CG 3.87Å
966	Y	87	Confident	72.2	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	138.6	175.9	-60	-82.7	0	0	0	110.1	D821 L822 N825 S952 F953 L955 H957 I964 W972	D821-Y966 HydrophobicContact CB-CE1 4.3Å; L822-Y966 HydrophobicContact CB-CD1 4.19Å; L822-Y966 HydrophobicContact CB-CE1 3.79Å; L822-Y966 HydrophobicContact CD1-CE1 4.25Å; L822-Y966 HydrophobicContact CD1-CE2 4.05Å; N825-Y966 PolarHBondContact ND2-OH 3.35Å; N825-Y966 VanDerWaalsContact ND2-OH 3.1Å; S952-Y966 VanDerWaalsContact CA-O 3.31Å; S952-Y966 WeakPolarHBondContact CA-O 3.42Å; S952-Y966 WeakPolarHBondContact CB-O 3.13Å; F953-Y966 HydrophobicContact CD2-CD2 4.42Å; F953-Y966 AromaticContact CE2-CD2 3.88Å; F953-Y966 HydrophobicContact CE2-CD2 3.88Å; F953-Y966 HydrophobicContact CE2-CG 4.29Å; F953-Y966 PolarHBondContact N-O 2.87Å; F953-Y966 PolarHBondContact O-N 2.87Å; L955-Y966 HydrophobicContact CB-CE2 4.2Å; L955-Y966 HydrophobicContact CD1-CD2 4.24Å; L955-Y966 HydrophobicContact CD1-CE2 3.92Å; L955-Y966 HydrophobicContact CG-CD2 4.15Å; L955-Y966 HydrophobicContact CG-CE2 4.07Å; H957-Y966 AromaticContact NE2-CE2 3.5Å; H957-Y966 AromaticContact NE2-CZ 3.61Å; H957-Y966 PolarHBondContact NE2-OH 3.27Å; I964-Y966 HydrophobicContact CB-CE2 4.01Å; I964-Y966 HydrophobicContact CG2-CD1 4.28Å; I964-Y966 HydrophobicContact CG2-CD2 4.09Å; I964-Y966 HydrophobicContact CG2-CE1 3.79Å; I964-Y966 HydrophobicContact CG2-CE2 3.6Å; I964-Y966 HydrophobicContact CG2-CG 4.42Å; I964-Y966 VanDerWaalsContact CG2-CZ 3.44Å; Y966-W972 HydrophobicContact CD1-CH2 4.35Å
967	A	83	Confident	70.6	Confident	21 Å²	21	32.2 Å²	32.2	17%	0.174	17%	0.174	C	C	.	.			trans	-122.5	101.1	175.5	0	0	0	0	0	110	T816 S951 N969 W972	T816-A967 HydrophobicContact CG2-CB 4.07Å; T816-A967 WeakPolarHBondContact OG1-CB 3.44Å; S951-A967 WeakPolarHBondContact O-CB 3.36Å; A967-N969 PolarHBondContact O-N 3.47Å; A967-W972 PolarHBondContact O-NE1 3.33Å
968	P	78.3	Confident	68.8	Low	10 Å²	10	32.5 Å²	32.5	7%	0.065	18%	0.175	C	C	.	.			trans	-59.1	127.2	172.8	-23.9	34	0	0	0	111.3	F917 L920 Y921 F953 W972	F917-P968 HydrophobicContact CE1-CB 3.86Å; L920-P968 HydrophobicContact CD2-CB 4.09Å; L920-P968 HydrophobicContact CD2-CG 4.15Å; Y921-P968 HydrophobicContact CE1-CG 4.46Å; Y921-P968 WeakPolarHBondContact OH-CD 3.27Å; Y921-P968 PolarHBondContact OH-O 3.45Å; Y921-P968 VanDerWaalsContact OH-O 3.1Å; F953-P968 HydrophobicContact CD1-CG 4.29Å; F953-P968 HydrophobicContact CE1-CG 3.6Å; P968-W972 HydrophobicContact CB-CD2 4.41Å; P968-W972 HydrophobicContact CB-CE3 4.38Å; P968-W972 HydrophobicContact CG-CH2 4.47Å; P968-W972 HydrophobicContact CG-CZ3 4.38Å
969	N	74.3	Confident	67.9	Low	77 Å²	77	31.2 Å²	31.2	41%	0.412	17%	0.169	S	C	.	.			trans	-136.9	173	176.7	73.4	26.1	0	0	0	110.1	A967 S971 W972	A967-N969 PolarHBondContact O-N 3.47Å; N969-S971 PolarHBondContact O-N 3.41Å; N969-S971 VanDerWaalsContact O-N 3.14Å; N969-S971 PolarHBondContact OD1-N 3.19Å; N969-S971 PolarHBondContact OD1-OG 2.87Å; N969-W972 WeakPolarHBondContact O-CB 3.5Å; N969-W972 PolarHBondContact O-N 3.41Å; N969-W972 VanDerWaalsContact OD1-CD1 3.28Å
970	W	69.8	Low	67.1	Low	118 Å²	118	35 Å²	35	45%	0.447	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-60.5	-23.3	-176.2	-79.1	108.5	0	0	0	115	G915 F917 W972 F973	G915-W970 VanDerWaalsContact O-CH2 3.28Å; G915-W970 WeakPolarHBondContact O-CH2 3.39Å; F917-W970 HydrophobicContact CD2-CZ2 4.26Å; F917-W970 AromaticContact CE2-CD2 3.8Å; F917-W970 HydrophobicContact CE2-CD2 3.8Å; F917-W970 AromaticContact CE2-CE2 3.66Å; F917-W970 HydrophobicContact CE2-CE3 4.31Å; F917-W970 HydrophobicContact CE2-CG 4.08Å; F917-W970 HydrophobicContact CE2-CZ2 4.08Å; F917-W970 AromaticContact CE2-NE1 3.8Å; W970-W972 VanDerWaalsContact C-N 3.27Å; W970-W972 PolarHBondContact O-N 3.27Å; W970-F973 HydrophobicContact CE3-CD2 4.19Å; W970-F973 PolarHBondContact O-N 3.15Å
971	S	67.6	Low	66.5	Low	49 Å²	49	36.6 Å²	36.6	34%	0.343	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-75.4	-15.1	177.2	76.4	0	0	0	0	113.6	N969 F973 T974	N969-S971 PolarHBondContact O-N 3.41Å; N969-S971 VanDerWaalsContact O-N 3.14Å; N969-S971 PolarHBondContact OD1-N 3.19Å; N969-S971 PolarHBondContact OD1-OG 2.87Å; S971-F973 PolarHBondContact O-N 2.78Å; S971-T974 WeakPolarHBondContact CA-OG1 3.32Å; S971-T974 PolarHBondContact O-N 3.19Å; S971-T974 PolarHBondContact O-OG1 2.8Å
972	W	75.4	Confident	66.2	Low	7 Å²	7	34 Å²	34	3%	0.027	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-61.7	-31.1	169.9	-71.4	39.6	0	0	0	111.3	F819 L822 L908 Y966 A967 P968 N969 W970 P975 Y1026	F819-W972 HydrophobicContact CB-CB 4.27Å; F819-W972 HydrophobicContact CB-CD2 3.65Å; F819-W972 HydrophobicContact CB-CE3 4.06Å; F819-W972 HydrophobicContact CB-CG 3.76Å; F819-W972 HydrophobicContact CB-CZ2 4.47Å; F819-W972 HydrophobicContact CD2-CD2 4.19Å; F819-W972 AromaticContact CD2-CE3 3.7Å; F819-W972 HydrophobicContact CD2-CE3 3.7Å; F819-W972 HydrophobicContact CD2-CZ3 4.02Å; F819-W972 HydrophobicContact CG-CD2 4.24Å; F819-W972 HydrophobicContact CG-CE3 4.21Å; F819-W972 HydrophobicContact CG-CG 4.4Å; L822-W972 HydrophobicContact CD2-CH2 3.9Å; L822-W972 HydrophobicContact CD2-CZ3 3.64Å; L908-W972 HydrophobicContact CD1-CE3 4.42Å; L908-W972 HydrophobicContact CD1-CZ3 4.35Å; L908-W972 HydrophobicContact CD2-CE3 4.26Å; Y966-W972 HydrophobicContact CD1-CH2 4.35Å; A967-W972 PolarHBondContact O-NE1 3.33Å; P968-W972 HydrophobicContact CB-CD2 4.41Å; P968-W972 HydrophobicContact CB-CE3 4.38Å; P968-W972 HydrophobicContact CG-CH2 4.47Å; P968-W972 HydrophobicContact CG-CZ3 4.38Å; N969-W972 WeakPolarHBondContact O-CB 3.5Å; N969-W972 PolarHBondContact O-N 3.41Å; N969-W972 VanDerWaalsContact OD1-CD1 3.28Å; W970-W972 VanDerWaalsContact C-N 3.27Å; W970-W972 PolarHBondContact O-N 3.27Å; W972-P975 WeakPolarHBondContact O-CD 3.41Å; W972-Y1026 PolarHBondContact O-OH 2.55Å
973	F	68.4	Low	66.1	Low	4 Å²	4	33.9 Å²	33.9	2%	0.018	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-92.3	-7.7	-177.2	-59.2	-58.4	0	0	0	114.6	L908 V911 A912 F917 W970 S971 P975 Y976 Y1026	L908-F973 HydrophobicContact CD2-CE1 4.17Å; L908-F973 HydrophobicContact CD2-CZ 4.09Å; L908-F973 WeakPolarHBondContact O-CE1 3.23Å; V911-F973 HydrophobicContact CB-CE1 4.28Å; V911-F973 HydrophobicContact CB-CZ 3.82Å; V911-F973 HydrophobicContact CG1-CE1 4.2Å; V911-F973 HydrophobicContact CG1-CE2 3.63Å; V911-F973 HydrophobicContact CG1-CZ 3.34Å; A912-F973 HydrophobicContact CB-CD1 3.56Å; A912-F973 HydrophobicContact CB-CE1 3.98Å; A912-F973 HydrophobicContact CB-CG 4.39Å; F917-F973 AromaticContact CE1-CE2 3.71Å; F917-F973 HydrophobicContact CE1-CE2 3.71Å; F917-F973 HydrophobicContact CE1-CZ 4.38Å; F917-F973 HydrophobicContact CE2-CE2 4.1Å; F917-F973 HydrophobicContact CZ-CD2 4.07Å; F917-F973 AromaticContact CZ-CE2 3.46Å; F917-F973 HydrophobicContact CZ-CE2 3.46Å; F917-F973 VanDerWaalsContact CZ-CE2 3.46Å; W970-F973 HydrophobicContact CE3-CD2 4.19Å; W970-F973 PolarHBondContact O-N 3.15Å; S971-F973 PolarHBondContact O-N 2.78Å; F973-P975 VanDerWaalsContact C-CD 3.44Å; F973-P975 VanDerWaalsContact C-N 3.35Å; F973-Y976 VanDerWaalsContact O-CB 3.29Å; F973-Y976 WeakPolarHBondContact O-CB 3.47Å; F973-Y976 PolarHBondContact O-N 3.48Å; F973-Y1026 WeakPolarHBondContact CA-OH 3.36Å; F973-Y1026 HydrophobicContact CD1-CE2 4.04Å; F973-Y1026 AromaticContact CD1-CZ 3.91Å; F973-Y1026 WeakPolarHBondContact CD1-OH 3.23Å; F973-Y1026 HydrophobicContact CE1-CE2 4.08Å
974	T	60.2	Low	65.8	Low	5 Å²	5	37.6 Å²	37.6	3%	0.031	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-38.5	178.2	-52.3	0	0	0	0	114	Y733 S971 Y976	Y733-T974 HydrophobicContact CD1-CG2 4.01Å; Y733-T974 WeakPolarHBondContact CD1-OG1 3.25Å; S971-T974 WeakPolarHBondContact CA-OG1 3.32Å; S971-T974 PolarHBondContact O-N 3.19Å; S971-T974 PolarHBondContact O-OG1 2.8Å; T974-Y976 PolarHBondContact O-N 3.35Å
975	P	53.9	Low	65.1	Low	18 Å²	18	42.3 Å²	42.3	12%	0.117	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-26.7	174.8	-23.2	35.3	0	0	0	114	W972 F973 S979 V1025	W972-P975 WeakPolarHBondContact O-CD 3.41Å; F973-P975 VanDerWaalsContact C-CD 3.44Å; F973-P975 VanDerWaalsContact C-N 3.35Å; P975-S979 PolarHBondContact O-OG 3.42Å; P975-V1025 HydrophobicContact CB-CG1 4.48Å
976	Y	50.7	Low	64.4	Low	30 Å²	30	40.3 Å²	40.3	12%	0.118	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-42.9	-163.2	-159.1	-90.5	0	0	0	114.3	D909 A912 Q913 F973 T974 G1024 V1025 Y1026	D909-Y976 PolarHBondContact O-OH 3.29Å; D909-Y976 WeakPolarHBondContact OD1-CE2 3.47Å; D909-Y976 PolarHBondContact OD1-OH 3.03Å; D909-Y976 VanDerWaalsContact OD1-OH 3.06Å; A912-Y976 HydrophobicContact CB-CD1 3.52Å; A912-Y976 HydrophobicContact CB-CD2 3.83Å; A912-Y976 HydrophobicContact CB-CE1 3.67Å; A912-Y976 HydrophobicContact CB-CE2 3.96Å; A912-Y976 HydrophobicContact CB-CG 3.6Å; Q913-Y976 HydrophobicContact CG-CE1 3.99Å; Q913-Y976 PolarHBondContact NE2-OH 3.14Å; F973-Y976 VanDerWaalsContact O-CB 3.29Å; F973-Y976 WeakPolarHBondContact O-CB 3.47Å; F973-Y976 PolarHBondContact O-N 3.48Å; T974-Y976 PolarHBondContact O-N 3.35Å; Y976-G1024 WeakPolarHBondContact OH-CA 3.43Å; Y976-V1025 HydrophobicContact CD2-CB 3.83Å; Y976-V1025 HydrophobicContact CD2-CG2 4.04Å; Y976-V1025 HydrophobicContact CE2-CB 4.3Å; Y976-V1025 VanDerWaalsContact CE2-N 3.26Å; Y976-V1025 HydrophobicContact CG-CG2 4.46Å; Y976-Y1026 AromaticContact CD2-CD2 3.81Å; Y976-Y1026 HydrophobicContact CD2-CD2 3.81Å; Y976-Y1026 AromaticContact CD2-CE2 3.35Å; Y976-Y1026 HydrophobicContact CD2-CE2 3.35Å; Y976-Y1026 AromaticContact CE2-CD2 3.63Å; Y976-Y1026 HydrophobicContact CE2-CD2 3.63Å; Y976-Y1026 AromaticContact CE2-CE2 3.62Å; Y976-Y1026 HydrophobicContact CE2-CE2 3.62Å; Y976-Y1026 HydrophobicContact CG-CE2 4.34Å
977	H	49.2	Very low	63.7	Low	69 Å²	69	42.1 Å²	42.1	32%	0.319	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-5.8	-163	-68	-86.4	0	0	0	115.5	W729 A912	W729-H977 HydrophobicContact CH2-CB 3.53Å; W729-H977 AromaticContact CH2-CD2 3.49Å; W729-H977 VanDerWaalsContact CH2-CD2 3.49Å; W729-H977 WeakPolarHBondContact CH2-CD2 3.39Å; W729-H977 AromaticContact CH2-CG 3.57Å; W729-H977 HydrophobicContact CZ2-CB 3.51Å; W729-H977 AromaticContact CZ2-CD2 3.71Å; W729-H977 AromaticContact CZ2-CG 3.44Å; W729-H977 VanDerWaalsContact CZ2-CG 3.44Å; W729-H977 HydrophobicContact CZ3-CB 4.45Å; A912-H977 PolarHBondContact O-CE1 2.9Å; A912-H977 PolarHBondContact O-NE2 3.28Å
978	R	48.1	Very low	63.3	Low	13 Å²	13	45.6 Å²	45.6	5%	0.049	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.7	-39.5	-174.5	-78.2	178	164.3	-112	-2.9	114.3	I699 C734 A737 S980 A981 S982	I699-R978 PolarHBondContact O-NH1 3.02Å; C734-R978 PolarHBondContact SG-NH2 3.22Å; A737-R978 HydrophobicContact CB-CB 3.72Å; A737-R978 HydrophobicContact CB-CG 4.4Å; R978-S980 VanDerWaalsContact C-N 3.31Å; R978-S980 PolarHBondContact O-N 2.79Å; R978-A981 PolarHBondContact O-N 3.07Å; R978-S982 PolarHBondContact O-N 3.1Å; R978-S982 PolarHBondContact O-OG 3Å
979	S	53.8	Low	63.3	Low	12 Å²	12	47.5 Å²	47.5	8%	0.084	25%	0.246	C	C	.	.	H	α-helix	trans	-61.6	-29.6	-156.8	64.1	0	0	0	0	116.9	R566 D741 P975 A981 L983	R566-S979 PolarHBondContact NH2-OG 2.66Å; D741-S979 VanDerWaalsContact OD1-CA 3.29Å; D741-S979 WeakPolarHBondContact OD1-CA 3.46Å; D741-S979 WeakPolarHBondContact OD1-CB 3.35Å; D741-S979 WeakPolarHBondContact OD2-CA 3.33Å; P975-S979 PolarHBondContact O-OG 3.42Å; S979-A981 VanDerWaalsContact C-N 3.33Å; S979-L983 WeakPolarHBondContact O-CB 3.5Å
980	S	51.3	Low	63.4	Low	80 Å²	80	43.9 Å²	43.9	56%	0.559	23%	0.227	S	C	*	.	H	α-helix	trans	-82	-11.9	178.1	67.2	0	0	0	0	113.5	R978 K984	R978-S980 VanDerWaalsContact C-N 3.31Å; R978-S980 PolarHBondContact O-N 2.79Å; S980-K984 WeakPolarHBondContact O-CD 3.27Å; S980-K984 VanDerWaalsContact O-CG 3.26Å; S980-K984 WeakPolarHBondContact O-CG 3.28Å
981	A	54	Low	63.7	Low	56 Å²	56	40.6 Å²	40.6	46%	0.463	22%	0.216	S	C	.	.	H	α-helix	trans	-107.2	-41.8	-176.4	0	0	0	0	0	112.8	R978 S979 K985	R978-A981 PolarHBondContact O-N 3.07Å; S979-A981 VanDerWaalsContact C-N 3.33Å; A981-K985 PolarHBondContact O-N 3.08Å
982	S	59	Low	64.1	Low	10 Å²	10	45.9 Å²	45.9	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-50.8	171.8	26.8	0	0	0	0	110.9	D741 R978 K984 K985 L986	D741-S982 VanDerWaalsContact OD2-CB 3.28Å; D741-S982 WeakPolarHBondContact OD2-CB 3.42Å; D741-S982 PolarHBondContact OD2-OG 2.77Å; R978-S982 PolarHBondContact O-N 3.1Å; R978-S982 PolarHBondContact O-OG 3Å; S982-K984 VanDerWaalsContact C-N 3.34Å; S982-K984 PolarHBondContact O-N 2.92Å; S982-K985 PolarHBondContact O-N 3.3Å; S982-L986 WeakPolarHBondContact O-CB 3.13Å; S982-L986 PolarHBondContact O-N 3.36Å
983	L	63.5	Low	64.2	Low	34 Å²	34	45.8 Å²	45.8	18%	0.178	24%	0.236	C	C	.	.	H	α-helix	trans	-54.8	-43.9	176.7	-174.9	63.2	0	0	0	113.2	D741 M745 S979 L986 I987	D741-L983 HydrophobicContact CB-CB 4.08Å; D741-L983 HydrophobicContact CB-CD1 4.2Å; D741-L983 PolarHBondContact OD2-N 3.21Å; D741-L983 VanDerWaalsContact OD2-N 3.15Å; M745-L983 HydrophobicContact CB-CD1 4.15Å; M745-L983 HydrophobicContact CE-CD1 3.58Å; S979-L983 WeakPolarHBondContact O-CB 3.5Å; L983-L986 PolarHBondContact O-N 3.2Å; L983-I987 HydrophobicContact CD1-CD1 4.19Å; L983-I987 HydrophobicContact CD1-CG1 4.37Å; L983-I987 HydrophobicContact CG-CD1 3.97Å; L983-I987 VanDerWaalsContact O-CG1 3.32Å; L983-I987 WeakPolarHBondContact O-CG1 3.48Å; L983-I987 PolarHBondContact O-N 3.37Å
984	K	66.2	Low	64.4	Low	129 Å²	129	49.7 Å²	49.7	56%	0.561	26%	0.264	S	S	*	.	H	α-helix	trans	-67.3	-39.4	179.2	-74.6	179.9	-171.6	170.7	0	113	S980 S982 L986 N988	S980-K984 WeakPolarHBondContact O-CD 3.27Å; S980-K984 VanDerWaalsContact O-CG 3.26Å; S980-K984 WeakPolarHBondContact O-CG 3.28Å; S982-K984 VanDerWaalsContact C-N 3.34Å; S982-K984 PolarHBondContact O-N 2.92Å; K984-L986 VanDerWaalsContact C-N 3.35Å; K984-N988 WeakPolarHBondContact O-CB 3.36Å; K984-N988 PolarHBondContact O-N 3.33Å; K984-N988 VanDerWaalsContact O-N 3.09Å; K984-N988 PolarHBondContact O-OD1 3.42Å
985	K	68	Low	65.2	Low	103 Å²	103	50.6 Å²	50.6	45%	0.448	27%	0.269	S	S	.	.	H	α-helix	trans	-63.6	-42.6	172.5	-76	-177.5	174.4	-173.7	0	111.3	L698 A981 S982 N988 F989	L698-K985 HydrophobicContact CD2-CB 4.06Å; A981-K985 PolarHBondContact O-N 3.08Å; S982-K985 PolarHBondContact O-N 3.3Å; K985-N988 PolarHBondContact O-N 2.77Å; K985-F989 WeakPolarHBondContact O-CB 3.36Å; K985-F989 PolarHBondContact O-N 3.28Å
986	L	70.7	Confident	66.3	Low	1 Å²	1	52.8 Å²	52.8	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-66.4	-42.6	179.9	-177.6	60.4	0	0	0	112.4	F738 L742 M745 S982 L983 K984 F989 L990	F738-L986 HydrophobicContact CE2-CD1 4.04Å; F738-L986 HydrophobicContact CE2-CD2 4Å; F738-L986 HydrophobicContact CE2-CG 4.42Å; F738-L986 HydrophobicContact CZ-CD1 3.92Å; F738-L986 HydrophobicContact CZ-CD2 4.06Å; L742-L986 HydrophobicContact CB-CD2 4.17Å; L742-L986 HydrophobicContact CD1-CD2 4.17Å; M745-L986 HydrophobicContact CE-CB 4.3Å; M745-L986 HydrophobicContact CE-CD2 3.78Å; M745-L986 HydrophobicContact CE-CG 3.77Å; S982-L986 WeakPolarHBondContact O-CB 3.13Å; S982-L986 PolarHBondContact O-N 3.36Å; L983-L986 PolarHBondContact O-N 3.2Å; K984-L986 VanDerWaalsContact C-N 3.35Å; L986-F989 PolarHBondContact O-N 3.08Å; L986-L990 HydrophobicContact CD1-CD1 3.94Å; L986-L990 HydrophobicContact CD1-CG 4.11Å; L986-L990 HydrophobicContact CG-CD1 3.97Å; L986-L990 WeakPolarHBondContact O-CB 3.41Å; L986-L990 WeakPolarHBondContact O-CG 3.42Å; L986-L990 PolarHBondContact O-N 3.44Å
987	I	71.8	Confident	67.5	Low	39 Å²	39	52 Å²	52	20%	0.2	29%	0.287	C	S	.	.	H	α-helix	trans	-59.6	-53.8	172.7	-70.4	170.4	0	0	0	109.8	M745 L983 F989 L990 E991 V1002	M745-I987 HydrophobicContact CE-CD1 4.45Å; M745-I987 HydrophobicContact CE-CG1 3.52Å; M745-I987 HydrophobicContact SD-CG1 4.46Å; L983-I987 HydrophobicContact CD1-CD1 4.19Å; L983-I987 HydrophobicContact CD1-CG1 4.37Å; L983-I987 HydrophobicContact CG-CD1 3.97Å; L983-I987 VanDerWaalsContact O-CG1 3.32Å; L983-I987 WeakPolarHBondContact O-CG1 3.48Å; L983-I987 PolarHBondContact O-N 3.37Å; I987-F989 PolarHBondContact O-N 2.84Å; I987-L990 PolarHBondContact O-N 3.21Å; I987-L990 VanDerWaalsContact O-N 3.15Å; I987-E991 HydrophobicContact CG2-CG 4.35Å; I987-E991 WeakPolarHBondContact O-CG 3.25Å; I987-E991 PolarHBondContact O-N 3.41Å; I987-V1002 HydrophobicContact CG2-CG1 3.93Å
988	N	74.7	Confident	68.8	Low	93 Å²	93	48.7 Å²	48.7	50%	0.497	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-34.7	179.9	-69.8	3.6	0	0	0	112.6	K984 K985 Q992	K984-N988 WeakPolarHBondContact O-CB 3.36Å; K984-N988 PolarHBondContact O-N 3.33Å; K984-N988 VanDerWaalsContact O-N 3.09Å; K984-N988 PolarHBondContact O-OD1 3.42Å; K985-N988 PolarHBondContact O-N 2.77Å; N988-Q992 WeakPolarHBondContact O-CG 3.24Å
989	F	77.5	Confident	70.5	Confident	50 Å²	50	53 Å²	53	22%	0.219	29%	0.288	C	S	.	.	H	α-helix	trans	-70.2	-47.6	175.1	-178.9	-92.5	0	0	0	112.2	C690 T694 L698 K985 L986 I987 E991 Q992 S993	C690-F989 HydrophobicContact CB-CE1 3.78Å; C690-F989 HydrophobicContact CB-CE2 4.37Å; C690-F989 HydrophobicContact CB-CZ 3.44Å; C690-F989 VanDerWaalsContact CB-CZ 3.44Å; T694-F989 HydrophobicContact CG2-CD2 4.46Å; T694-F989 HydrophobicContact CG2-CE2 3.95Å; T694-F989 HydrophobicContact CG2-CZ 4.45Å; L698-F989 HydrophobicContact CD1-CG 4.44Å; K985-F989 WeakPolarHBondContact O-CB 3.36Å; K985-F989 PolarHBondContact O-N 3.28Å; L986-F989 PolarHBondContact O-N 3.08Å; I987-F989 PolarHBondContact O-N 2.84Å; F989-E991 VanDerWaalsContact C-N 3.33Å; F989-E991 PolarHBondContact O-N 3.1Å; F989-Q992 CarbonylContact O-C 3.56Å; F989-Q992 WeakPolarHBondContact O-CA 3.23Å; F989-Q992 WeakPolarHBondContact O-CB 3.39Å; F989-Q992 PolarHBondContact O-N 3.41Å; F989-S993 PolarHBondContact O-N 2.87Å
990	L	76.5	Confident	71.5	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-68.8	-30.2	-178.8	-70.1	171.9	0	0	0	112.9	L688 M745 L986 I987 Q992 S993 L998 V1002	L688-L990 HydrophobicContact CD2-CD2 4.15Å; M745-L990 HydrophobicContact CE-CD1 4.14Å; M745-L990 HydrophobicContact SD-CD1 3.79Å; L986-L990 HydrophobicContact CD1-CD1 3.94Å; L986-L990 HydrophobicContact CD1-CG 4.11Å; L986-L990 HydrophobicContact CG-CD1 3.97Å; L986-L990 WeakPolarHBondContact O-CB 3.41Å; L986-L990 WeakPolarHBondContact O-CG 3.42Å; L986-L990 PolarHBondContact O-N 3.44Å; I987-L990 PolarHBondContact O-N 3.21Å; I987-L990 VanDerWaalsContact O-N 3.15Å; L990-Q992 PolarHBondContact O-N 3.2Å; L990-S993 VanDerWaalsContact O-CB 3.29Å; L990-S993 WeakPolarHBondContact O-CB 3.27Å; L990-S993 PolarHBondContact O-N 2.95Å; L990-L998 HydrophobicContact CD2-CD1 4.42Å; L990-V1002 HydrophobicContact CB-CG1 4.5Å; L990-V1002 HydrophobicContact CB-CG2 3.83Å; L990-V1002 HydrophobicContact CD1-CG2 4.17Å
991	E	76.1	Confident	72.6	Confident	49 Å²	49	52.4 Å²	52.4	23%	0.229	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-24.1	168.3	-71.2	-171.4	158.2	0	0	113.2	I987 F989 R999 V1002 K1006	I987-E991 HydrophobicContact CG2-CG 4.35Å; I987-E991 WeakPolarHBondContact O-CG 3.25Å; I987-E991 PolarHBondContact O-N 3.41Å; F989-E991 VanDerWaalsContact C-N 3.33Å; F989-E991 PolarHBondContact O-N 3.1Å; E991-R999 VanDerWaalsContact O-CD 3.27Å; E991-R999 WeakPolarHBondContact O-CD 3.4Å; E991-R999 WeakPolarHBondContact O-CG 3.23Å; E991-V1002 HydrophobicContact CG-CB 4.46Å; E991-V1002 HydrophobicContact CG-CG1 3.62Å; E991-K1006 WeakPolarHBondContact OE1-CD 3.49Å; E991-K1006 WeakPolarHBondContact OE1-CE 3.24Å; E991-K1006 IonicContact OE1-NZ 3.46Å; E991-K1006 PolarHBondContact OE1-NZ 2.98Å; E991-K1006 IonicContact OE2-NZ 2.88Å; E991-K1006 PolarHBondContact OE2-NZ 2.78Å
992	Q	76.8	Confident	73.6	Confident	161 Å²	161	49.8 Å²	49.8	75%	0.752	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-1.2	176.5	-64.6	177.1	6.3	0	0	113	N988 F989 L990	N988-Q992 WeakPolarHBondContact O-CG 3.24Å; F989-Q992 CarbonylContact O-C 3.56Å; F989-Q992 WeakPolarHBondContact O-CA 3.23Å; F989-Q992 WeakPolarHBondContact O-CB 3.39Å; F989-Q992 PolarHBondContact O-N 3.41Å; L990-Q992 PolarHBondContact O-N 3.2Å
993	S	77.8	Confident	74.5	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.028	27%	0.269	C	S	.	.			trans	-58.8	143.2	177.6	-176.9	0	0	0	0	110.8	F989 L990 V995 R999	F989-S993 PolarHBondContact O-N 2.87Å; L990-S993 VanDerWaalsContact O-CB 3.29Å; L990-S993 WeakPolarHBondContact O-CB 3.27Å; L990-S993 PolarHBondContact O-N 2.95Å; S993-V995 PolarHBondContact O-N 3.14Å; S993-R999 VanDerWaalsContact O-CD 3.24Å; S993-R999 WeakPolarHBondContact O-CD 3.38Å; S993-R999 VanDerWaalsContact O-CG 3.24Å; S993-R999 WeakPolarHBondContact O-CG 3.43Å; S993-R999 PolarHBondContact O-NH1 2.94Å
994	S	71.9	Confident	74.8	Confident	87 Å²	87	51.8 Å²	51.8	61%	0.608	27%	0.269	S	S	*	.	S	Bend	trans	-66.5	-21	177.9	53.4	0	0	0	0	113.2	A996 R999	S994-A996 PolarHBondContact O-N 2.72Å; S994-R999 PolarHBondContact O-NH1 3.26Å
995	V	77.1	Confident	74.9	Confident	24 Å²	24	46.6 Å²	46.6	15%	0.145	25%	0.247	C	C	.	.			trans	-76.3	118.7	179.6	-171.1	0	0	0	0	111.7	H689 S993 S997 L998 R999	H689-V995 HydrophobicContact CB-CG2 4.15Å; H689-V995 WeakPolarHBondContact CD2-CG2 2.94Å; H689-V995 VanDerWaalsContact CG-CG2 3.48Å; H689-V995 WeakPolarHBondContact NE2-CG2 3.48Å; S993-V995 PolarHBondContact O-N 3.14Å; V995-S997 VanDerWaalsContact CG1-OG 3.28Å; V995-S997 WeakPolarHBondContact CG1-OG 3.23Å; V995-S997 PolarHBondContact O-N 3.46Å; V995-L998 HydrophobicContact CB-CB 4.18Å; V995-L998 HydrophobicContact CB-CD1 4.04Å; V995-L998 HydrophobicContact CB-CG 4.06Å; V995-L998 HydrophobicContact CG1-CB 4.49Å; V995-L998 HydrophobicContact CG1-CD1 4.47Å; V995-L998 HydrophobicContact CG1-CG 4.12Å; V995-L998 HydrophobicContact CG2-CD1 4.2Å; V995-L998 PolarHBondContact O-N 3.25Å; V995-R999 PolarHBondContact O-N 3.19Å; V995-R999 VanDerWaalsContact O-N 3.17Å
996	A	77.3	Confident	74.6	Confident	64 Å²	64	48.4 Å²	48.4	53%	0.529	26%	0.255	S	S	.	.	H	α-helix	trans	-61.3	-38.6	-178.5	0	0	0	0	0	113.7	S994 R999 M1000	S994-A996 PolarHBondContact O-N 2.72Å; A996-R999 PolarHBondContact O-N 3.1Å; A996-M1000 WeakPolarHBondContact O-CB 3.47Å; A996-M1000 PolarHBondContact O-N 3.26Å
997	S	75.3	Confident	73.6	Confident	12 Å²	12	57.5 Å²	57.5	8%	0.084	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-43.1	178.1	58.4	0	0	0	0	112.3	N641 G646 V995 R999 M1000 I1001	N641-S997 WeakPolarHBondContact O-CB 3.43Å; G646-S997 VanDerWaalsContact O-CB 3.29Å; G646-S997 WeakPolarHBondContact O-CB 3.33Å; G646-S997 PolarHBondContact O-OG 3.47Å; V995-S997 VanDerWaalsContact CG1-OG 3.28Å; V995-S997 WeakPolarHBondContact CG1-OG 3.23Å; V995-S997 PolarHBondContact O-N 3.46Å; S997-R999 PolarHBondContact O-N 2.93Å; S997-M1000 PolarHBondContact O-N 3.47Å; S997-I1001 WeakPolarHBondContact O-CB 3.38Å; S997-I1001 VanDerWaalsContact O-CG1 3.23Å; S997-I1001 WeakPolarHBondContact O-CG1 3.48Å; S997-I1001 PolarHBondContact O-N 3.46Å
998	L	78.1	Confident	72.6	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-62.1	-43.5	175.9	-66.9	-178.6	0	0	0	111.7	L651 L990 V995 I1001 V1002	L651-L998 HydrophobicContact CD2-CD2 4.01Å; L651-L998 HydrophobicContact CG-CD2 4.38Å; L990-L998 HydrophobicContact CD2-CD1 4.42Å; V995-L998 HydrophobicContact CB-CB 4.18Å; V995-L998 HydrophobicContact CB-CD1 4.04Å; V995-L998 HydrophobicContact CB-CG 4.06Å; V995-L998 HydrophobicContact CG1-CB 4.49Å; V995-L998 HydrophobicContact CG1-CD1 4.47Å; V995-L998 HydrophobicContact CG1-CG 4.12Å; V995-L998 HydrophobicContact CG2-CD1 4.2Å; V995-L998 PolarHBondContact O-N 3.25Å; L998-I1001 PolarHBondContact O-N 3.1Å; L998-V1002 WeakPolarHBondContact O-CG2 3.31Å; L998-V1002 PolarHBondContact O-N 2.93Å
999	R	82.5	Confident	71.3	Confident	102 Å²	102	65.8 Å²	65.8	39%	0.385	32%	0.324	S	S	.	.	H	α-helix	trans	-60.4	-45.8	173.5	-66.4	-163.9	-58	-85.3	2.4	112	E991 S993 S994 V995 A996 S997 V1002 S1003	E991-R999 VanDerWaalsContact O-CD 3.27Å; E991-R999 WeakPolarHBondContact O-CD 3.4Å; E991-R999 WeakPolarHBondContact O-CG 3.23Å; S993-R999 VanDerWaalsContact O-CD 3.24Å; S993-R999 WeakPolarHBondContact O-CD 3.38Å; S993-R999 VanDerWaalsContact O-CG 3.24Å; S993-R999 WeakPolarHBondContact O-CG 3.43Å; S993-R999 PolarHBondContact O-NH1 2.94Å; S994-R999 PolarHBondContact O-NH1 3.26Å; V995-R999 PolarHBondContact O-N 3.19Å; V995-R999 VanDerWaalsContact O-N 3.17Å; A996-R999 PolarHBondContact O-N 3.1Å; S997-R999 PolarHBondContact O-N 2.93Å; R999-V1002 PolarHBondContact O-N 3.08Å; R999-S1003 WeakPolarHBondContact O-CB 3.45Å; R999-S1003 PolarHBondContact O-N 3.38Å
1000	M	74.6	Confident	70.1	Confident	80 Å²	80	65.1 Å²	65.1	39%	0.394	32%	0.323	S	S	.	.	H	α-helix	trans	-60.2	-49.4	179.1	-172.8	-177.9	81.1	0	0	111.1	E642 A996 S997 V1002 S1003	E642-M1000 HydrophobicContact CG-CE 3.71Å; E642-M1000 VanDerWaalsContact OE1-CE 3.31Å; E642-M1000 WeakPolarHBondContact OE1-CE 3.48Å; A996-M1000 WeakPolarHBondContact O-CB 3.47Å; A996-M1000 PolarHBondContact O-N 3.26Å; S997-M1000 PolarHBondContact O-N 3.47Å; M1000-V1002 PolarHBondContact O-N 2.94Å; M1000-S1003 WeakPolarHBondContact O-CB 3.33Å; M1000-S1003 PolarHBondContact O-N 3.05Å; M1000-S1003 PolarHBondContact O-OG 2.82Å
1001	I	75.4	Confident	69	Low	0 Å²	0	70 Å²	70	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-59.9	-47.7	179.7	-74.7	171.6	0	0	0	111.7	I749 S997 L998 S1003 L1004	I749-I1001 HydrophobicContact CB-CG2 4.23Å; I749-I1001 HydrophobicContact CD1-CG2 3.4Å; I749-I1001 VanDerWaalsContact CD1-CG2 3.4Å; I749-I1001 HydrophobicContact CG1-CG2 3.64Å; I749-I1001 HydrophobicContact CG2-CG2 3.52Å; S997-I1001 WeakPolarHBondContact O-CB 3.38Å; S997-I1001 VanDerWaalsContact O-CG1 3.23Å; S997-I1001 WeakPolarHBondContact O-CG1 3.48Å; S997-I1001 PolarHBondContact O-N 3.46Å; L998-I1001 PolarHBondContact O-N 3.1Å; I1001-S1003 VanDerWaalsContact C-N 3.3Å; I1001-S1003 PolarHBondContact O-N 2.92Å; I1001-L1004 WeakPolarHBondContact O-CB 3.46Å; I1001-L1004 PolarHBondContact O-N 2.78Å
1002	V	75.8	Confident	68.3	Low	1 Å²	1	67.7 Å²	67.7	1%	0.006	33%	0.331	C	S	.	.	H	α-helix	trans	-70	-28.5	-179.6	174.7	0	0	0	0	111.8	M745 I987 L990 E991 L998 R999 M1000 L1004 L1005	M745-V1002 HydrophobicContact SD-CG2 4.19Å; I987-V1002 HydrophobicContact CG2-CG1 3.93Å; L990-V1002 HydrophobicContact CB-CG1 4.5Å; L990-V1002 HydrophobicContact CB-CG2 3.83Å; L990-V1002 HydrophobicContact CD1-CG2 4.17Å; E991-V1002 HydrophobicContact CG-CB 4.46Å; E991-V1002 HydrophobicContact CG-CG1 3.62Å; L998-V1002 WeakPolarHBondContact O-CG2 3.31Å; L998-V1002 PolarHBondContact O-N 2.93Å; R999-V1002 PolarHBondContact O-N 3.08Å; M1000-V1002 PolarHBondContact O-N 2.94Å; V1002-L1004 PolarHBondContact O-N 3.23Å; V1002-L1005 HydrophobicContact CG1-CD1 4.37Å; V1002-L1005 WeakPolarHBondContact O-CB 3.13Å; V1002-L1005 PolarHBondContact O-N 2.73Å
1003	S	76.2	Confident	67.6	Low	52 Å²	52	62.9 Å²	62.9	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-26.5	173.6	82	0	0	0	0	113.6	R999 M1000 I1001 L1005 K1006	R999-S1003 WeakPolarHBondContact O-CB 3.45Å; R999-S1003 PolarHBondContact O-N 3.38Å; M1000-S1003 WeakPolarHBondContact O-CB 3.33Å; M1000-S1003 PolarHBondContact O-N 3.05Å; M1000-S1003 PolarHBondContact O-OG 2.82Å; I1001-S1003 VanDerWaalsContact C-N 3.3Å; I1001-S1003 PolarHBondContact O-N 2.92Å; S1003-L1005 PolarHBondContact O-N 3.02Å; S1003-K1006 PolarHBondContact O-N 2.75Å
1004	L	70.1	Confident	66.9	Low	34 Å²	34	66 Å²	66	18%	0.178	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.6	174.8	-58.1	174.3	0	0	0	113.2	S752 L753 I1001 V1002	S752-L1004 PolarHBondContact OG-O 2.84Å; L753-L1004 HydrophobicContact CD2-CD1 3.56Å; L753-L1004 HydrophobicContact CG-CD1 3.99Å; I1001-L1004 WeakPolarHBondContact O-CB 3.46Å; I1001-L1004 PolarHBondContact O-N 2.78Å; V1002-L1004 PolarHBondContact O-N 3.23Å
1005	L	67.9	Low	66.2	Low	20 Å²	20	62.1 Å²	62.1	11%	0.105	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-13.8	178.4	-61.4	173.8	0	0	0	113.5	M745 D748 I749 V1002 S1003 K1008	M745-L1005 HydrophobicContact CG-CD1 3.54Å; M745-L1005 HydrophobicContact SD-CD1 4.18Å; D748-L1005 HydrophobicContact CB-CD2 3.53Å; I749-L1005 HydrophobicContact CG1-CD1 4.14Å; I749-L1005 HydrophobicContact CG1-CD2 4.08Å; I749-L1005 HydrophobicContact CG1-CG 4.18Å; V1002-L1005 HydrophobicContact CG1-CD1 4.37Å; V1002-L1005 WeakPolarHBondContact O-CB 3.13Å; V1002-L1005 PolarHBondContact O-N 2.73Å; S1003-L1005 PolarHBondContact O-N 3.02Å; L1005-K1008 WeakPolarHBondContact O-CE 3.49Å
1006	K	62.2	Low	65.5	Low	142 Å²	142	63.1 Å²	63.1	62%	0.617	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-25.3	176.6	-85.1	175.5	168.5	153.7	0	113.5	E991 S1003 K1008	E991-K1006 WeakPolarHBondContact OE1-CD 3.49Å; E991-K1006 WeakPolarHBondContact OE1-CE 3.24Å; E991-K1006 IonicContact OE1-NZ 3.46Å; E991-K1006 PolarHBondContact OE1-NZ 2.98Å; E991-K1006 IonicContact OE2-NZ 2.88Å; E991-K1006 PolarHBondContact OE2-NZ 2.78Å; S1003-K1006 PolarHBondContact O-N 2.75Å; K1006-K1008 PolarHBondContact O-N 3.35Å
1007	Y	51	Low	64.4	Low	192 Å²	192	61.8 Å²	61.8	75%	0.753	30%	0.299	S	S	*	.			trans	-83.1	108.3	174.5	-75.1	-87.1	0	0	0	109.8
1008	K	49.8	Very low	63.3	Low	116 Å²	116	69 Å²	69	50%	0.504	34%	0.337	S	S	.	.			trans	-129.4	15.8	178.2	-70.3	-168.7	175.1	-173	0	114.4	L1005 K1006 D1010	L1005-K1008 WeakPolarHBondContact O-CE 3.49Å; K1006-K1008 PolarHBondContact O-N 3.35Å; K1008-D1010 PolarHBondContact O-N 2.9Å
1009	E	46.5	Very low	61.8	Low	189 Å²	189	74.5 Å²	74.5	88%	0.883	38%	0.375	S	S	*	.			trans	-78.2	60.2	169.4	-70.5	-163.5	168.3	0	0	111.5
1010	D	54	Low	59.8	Low	37 Å²	37	73 Å²	73	20%	0.198	38%	0.381	C	S	.	.			trans	-81.5	153.5	171.4	-57	-48.5	0	0	0	110.6	R560 K1008 L1012 S1013	R560-D1010 IonicContact CZ-OD2 3.17Å; R560-D1010 IonicContact NH1-OD2 2.79Å; R560-D1010 PolarHBondContact NH1-OD2 3.31Å; K1008-D1010 PolarHBondContact O-N 2.9Å; D1010-L1012 PolarHBondContact O-N 3.21Å; D1010-L1012 VanDerWaalsContact O-N 3.08Å; D1010-S1013 WeakPolarHBondContact O-CB 3.43Å; D1010-S1013 PolarHBondContact O-N 3.34Å; D1010-S1013 PolarHBondContact O-OG 3.47Å
1011	Y	52.2	Low	58.3	Low	102 Å²	102	73.7 Å²	73.7	40%	0.4	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-17.5	170.2	-69.8	-75.4	0	0	0	113.7	E534	E534-Y1011 WeakPolarHBondContact OE1-CD2 3.32Å
1012	L	61.8	Low	56.9	Low	2 Å²	2	82 Å²	82	1%	0.01	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	1.2	174.9	-66.9	175.7	0	0	0	114	L530 R560 D1010 S1014 F1015	L530-L1012 HydrophobicContact CD2-CD1 4.3Å; L530-L1012 HydrophobicContact CD2-CD2 3.96Å; L530-L1012 HydrophobicContact CG-CD1 4.12Å; L530-L1012 HydrophobicContact CG-CD2 4.05Å; R560-L1012 HydrophobicContact CB-CD1 3.81Å; D1010-L1012 PolarHBondContact O-N 3.21Å; D1010-L1012 VanDerWaalsContact O-N 3.08Å; L1012-S1014 VanDerWaalsContact C-N 3.26Å; L1012-S1014 PolarHBondContact O-N 2.62Å; L1012-F1015 HydrophobicContact CD2-CD2 4.07Å; L1012-F1015 HydrophobicContact CD2-CE2 4.3Å; L1012-F1015 PolarHBondContact O-N 3.37Å; L1012-F1015 VanDerWaalsContact O-N 3.14Å
1013	S	61.7	Low	55.9	Low	59 Å²	59	85.6 Å²	85.6	41%	0.413	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-62.5	-29	-179	55.3	0	0	0	0	113.9	D1010 F1015 L1016	D1010-S1013 WeakPolarHBondContact O-CB 3.43Å; D1010-S1013 PolarHBondContact O-N 3.34Å; D1010-S1013 PolarHBondContact O-OG 3.47Å; S1013-F1015 PolarHBondContact O-N 3.36Å; S1013-L1016 PolarHBondContact O-N 3.2Å
1014	S	62.5	Low	55.1	Low	71 Å²	71	83.7 Å²	83.7	50%	0.497	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-68.2	-13.9	175.1	52.7	0	0	0	0	114.7	L1012 L1016 S1039	L1012-S1014 VanDerWaalsContact C-N 3.26Å; L1012-S1014 PolarHBondContact O-N 2.62Å; S1014-L1016 VanDerWaalsContact C-N 3.32Å; S1014-S1039 PolarHBondContact O-OG 2.72Å; S1014-S1039 VanDerWaalsContact O-OG 3.14Å
1015	F	59	Low	54.7	Low	5 Å²	5	83.4 Å²	83.4	2%	0.022	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-93.4	11.4	177.6	-61.7	-92.9	0	0	0	112.5	L530 I776 L1012 S1013 L1036 S1039 L1040	L530-F1015 HydrophobicContact CD2-CB 4.09Å; L530-F1015 HydrophobicContact CD2-CG 4.42Å; I776-F1015 HydrophobicContact CD1-CE1 4.24Å; I776-F1015 HydrophobicContact CD1-CE2 4.17Å; I776-F1015 HydrophobicContact CD1-CZ 3.51Å; L1012-F1015 HydrophobicContact CD2-CD2 4.07Å; L1012-F1015 HydrophobicContact CD2-CE2 4.3Å; L1012-F1015 PolarHBondContact O-N 3.37Å; L1012-F1015 VanDerWaalsContact O-N 3.14Å; S1013-F1015 PolarHBondContact O-N 3.36Å; F1015-L1036 HydrophobicContact CB-CD1 4.12Å; F1015-L1036 HydrophobicContact CD1-CD1 4.06Å; F1015-L1036 HydrophobicContact CG-CD1 4.5Å; F1015-S1039 VanDerWaalsContact CE1-CB 3.47Å; F1015-L1040 HydrophobicContact CD1-CD2 4.38Å; F1015-L1040 HydrophobicContact CD1-CG 4.45Å; F1015-L1040 HydrophobicContact CE1-CD2 3.93Å; F1015-L1040 HydrophobicContact CE1-CG 4.29Å
1016	L	61	Low	54.9	Low	45 Å²	45	82.5 Å²	82.5	24%	0.236	43%	0.434	C	S	.	.	S	Bend	trans	-126.7	144.6	178.7	-85.4	173.4	0	0	0	112.1	L562 S1013 S1014 I1032	L562-L1016 HydrophobicContact CD2-CD2 3.58Å; L562-L1016 HydrophobicContact CD2-CG 4.26Å; S1013-L1016 PolarHBondContact O-N 3.2Å; S1014-L1016 VanDerWaalsContact C-N 3.32Å; L1016-I1032 HydrophobicContact CD2-CG1 4.25Å; L1016-I1032 HydrophobicContact CD2-CG2 4.42Å
1017	P	55.4	Low	55.4	Low	36 Å²	36	77.2 Å²	77.2	23%	0.234	42%	0.415	C	S	.	.			trans	-67.4	141.3	172.5	28.4	-34.6	0	0	0	111.1	S1019 S1031 I1032	P1017-S1019 PolarHBondContact O-N 3.49Å; P1017-S1031 WeakPolarHBondContact CB-OG 3.5Å; P1017-I1032 HydrophobicContact CG-CG1 4.06Å
1018	N	51	Low	56.5	Low	162 Å²	162	72.5 Å²	72.5	87%	0.866	40%	0.4	S	S	*	.			trans	-61.9	110.7	168.7	-75.2	-50.8	0	0	0	109.2	S1020	N1018-S1020 PolarHBondContact O-N 3.35Å
1019	S	46.8	Very low	57.8	Low	117 Å²	117	67.5 Å²	67.5	82%	0.818	38%	0.379	S	S	*	.			trans	-60.3	107	-169.6	61.2	0	0	0	0	112.3	P1017	P1017-S1019 PolarHBondContact O-N 3.49Å
1020	S	40	Very low	59.5	Low	71 Å²	71	59.8 Å²	59.8	50%	0.497	34%	0.342	S	S	.	.			trans	-98.2	137.5	173.5	67	0	0	0	0	110.5	N1018 H1022 I1023	N1018-S1020 PolarHBondContact O-N 3.35Å; S1020-H1022 PolarHBondContact O-N 2.86Å; S1020-I1023 VanDerWaalsContact OG-CD1 3.3Å; S1020-I1023 WeakPolarHBondContact OG-CD1 3.35Å; S1020-I1023 WeakPolarHBondContact OG-CG1 3.39Å
1021	S	44.4	Very low	60.8	Low	95 Å²	95	59.5 Å²	59.5	66%	0.664	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	12.4	-165	46.8	0	0	0	0	116.2
1022	H	45.2	Very low	62.3	Low	174 Å²	174	55.7 Å²	55.7	81%	0.806	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.8	9.2	-168.1	-59.5	-66.3	0	0	0	114.6	S1020	S1020-H1022 PolarHBondContact O-N 2.86Å
1023	I	54.4	Low	63.6	Low	76 Å²	76	55.6 Å²	55.6	39%	0.39	33%	0.329	S	S	.	.			trans	-86.3	133.5	170.8	-60.5	177.4	0	0	0	108.1	S1020 S1027 E1028	S1020-I1023 VanDerWaalsContact OG-CD1 3.3Å; S1020-I1023 WeakPolarHBondContact OG-CD1 3.35Å; S1020-I1023 WeakPolarHBondContact OG-CG1 3.39Å; I1023-S1027 VanDerWaalsContact CG2-CB 3.48Å; I1023-E1028 HydrophobicContact CG2-CB 4.36Å
1024	G	59.4	Low	64.7	Low	13 Å²	13	55.5 Å²	55.5	13%	0.134	32%	0.324	C	S	.	.			trans	-72.6	152.2	175.1	0	0	0	0	0	112.1	D909 Y976 Y1026 S1027 E1028	D909-G1024 VanDerWaalsContact OD1-C 3.31Å; D909-G1024 VanDerWaalsContact OD1-CA 3.24Å; D909-G1024 WeakPolarHBondContact OD1-CA 3.37Å; Y976-G1024 WeakPolarHBondContact OH-CA 3.43Å; G1024-Y1026 PolarHBondContact O-N 3.46Å; G1024-S1027 CarbonylContact O-C 3.54Å; G1024-S1027 WeakPolarHBondContact O-CA 3.27Å; G1024-S1027 PolarHBondContact O-N 2.71Å; G1024-E1028 PolarHBondContact O-N 2.75Å
1025	V	61.4	Low	65.8	Low	27 Å²	27	53.6 Å²	53.6	16%	0.164	31%	0.309	C	S	.	.	H	α-helix	trans	-60.4	-24.7	-168.9	-178.4	0	0	0	0	113.2	P975 Y976 V1029	P975-V1025 HydrophobicContact CB-CG1 4.48Å; Y976-V1025 HydrophobicContact CD2-CB 3.83Å; Y976-V1025 HydrophobicContact CD2-CG2 4.04Å; Y976-V1025 HydrophobicContact CE2-CB 4.3Å; Y976-V1025 VanDerWaalsContact CE2-N 3.26Å; Y976-V1025 HydrophobicContact CG-CG2 4.46Å; V1025-V1029 PolarHBondContact O-N 2.71Å
1026	Y	73.4	Confident	67.2	Low	1 Å²	1	53.4 Å²	53.4	0%	0.004	31%	0.308	C	S	.	.	H	α-helix	trans	-77.2	-45	174.6	-51	-68.9	0	0	0	111.6	F819 L908 D909 A912 W972 F973 Y976 G1024 E1028 V1029 K1030	F819-Y1026 HydrophobicContact CD2-CE1 4.26Å; F819-Y1026 HydrophobicContact CE1-CD1 4.27Å; F819-Y1026 AromaticContact CE1-CE1 3.77Å; F819-Y1026 HydrophobicContact CE1-CE1 3.77Å; F819-Y1026 AromaticContact CE2-CD1 3.6Å; F819-Y1026 HydrophobicContact CE2-CD1 3.6Å; F819-Y1026 AromaticContact CE2-CE1 3.51Å; F819-Y1026 HydrophobicContact CE2-CE1 3.51Å; F819-Y1026 AromaticContact CZ-CD1 3.36Å; F819-Y1026 HydrophobicContact CZ-CD1 3.36Å; F819-Y1026 AromaticContact CZ-CE1 3.25Å; F819-Y1026 HydrophobicContact CZ-CE1 3.25Å; L908-Y1026 HydrophobicContact CB-CD1 4.21Å; L908-Y1026 HydrophobicContact CB-CD2 3.7Å; L908-Y1026 HydrophobicContact CB-CE1 4.45Å; L908-Y1026 HydrophobicContact CB-CE2 3.97Å; L908-Y1026 HydrophobicContact CB-CG 3.85Å; L908-Y1026 HydrophobicContact CD1-CD1 4.37Å; D909-Y1026 HydrophobicContact CB-CD2 4.47Å; D909-Y1026 WeakPolarHBondContact OD1-CD2 3.46Å; A912-Y1026 HydrophobicContact CB-CE2 4.18Å; W972-Y1026 PolarHBondContact O-OH 2.55Å; F973-Y1026 WeakPolarHBondContact CA-OH 3.36Å; F973-Y1026 HydrophobicContact CD1-CE2 4.04Å; F973-Y1026 AromaticContact CD1-CZ 3.91Å; F973-Y1026 WeakPolarHBondContact CD1-OH 3.23Å; F973-Y1026 HydrophobicContact CE1-CE2 4.08Å; Y976-Y1026 AromaticContact CD2-CD2 3.81Å; Y976-Y1026 HydrophobicContact CD2-CD2 3.81Å; Y976-Y1026 AromaticContact CD2-CE2 3.35Å; Y976-Y1026 HydrophobicContact CD2-CE2 3.35Å; Y976-Y1026 AromaticContact CE2-CD2 3.63Å; Y976-Y1026 HydrophobicContact CE2-CD2 3.63Å; Y976-Y1026 AromaticContact CE2-CE2 3.62Å; Y976-Y1026 HydrophobicContact CE2-CE2 3.62Å; Y976-Y1026 HydrophobicContact CG-CE2 4.34Å; G1024-Y1026 PolarHBondContact O-N 3.46Å; Y1026-E1028 PolarHBondContact O-N 2.84Å; Y1026-V1029 PolarHBondContact O-N 2.98Å; Y1026-K1030 PolarHBondContact O-N 3.04Å
1027	S	71.8	Confident	68.6	Low	31 Å²	31	52.4 Å²	52.4	22%	0.217	30%	0.304	C	S	.	.	H	α-helix	trans	-64.6	-23.4	169.3	-71.4	0	0	0	0	113.5	D909 I1023 G1024 S1031	D909-S1027 VanDerWaalsContact OD2-CB 3.32Å; D909-S1027 WeakPolarHBondContact OD2-CB 3.11Å; D909-S1027 PolarHBondContact OD2-N 2.96Å; D909-S1027 VanDerWaalsContact OD2-N 3.16Å; D909-S1027 PolarHBondContact OD2-OG 2.64Å; I1023-S1027 VanDerWaalsContact CG2-CB 3.48Å; G1024-S1027 CarbonylContact O-C 3.54Å; G1024-S1027 WeakPolarHBondContact O-CA 3.27Å; G1024-S1027 PolarHBondContact O-N 2.71Å; S1027-S1031 WeakPolarHBondContact O-CB 3.14Å; S1027-S1031 PolarHBondContact O-N 3.01Å
1028	E	73.8	Confident	70.1	Confident	93 Å²	93	57.7 Å²	57.7	44%	0.435	32%	0.32	S	S	.	.	H	α-helix	trans	-68.8	-44.1	172.2	-175	175.1	-154.5	0	0	111.1	I1023 G1024 Y1026 K1030 S1031 I1032	I1023-E1028 HydrophobicContact CG2-CB 4.36Å; G1024-E1028 PolarHBondContact O-N 2.75Å; Y1026-E1028 PolarHBondContact O-N 2.84Å; E1028-K1030 VanDerWaalsContact C-N 3.32Å; E1028-K1030 PolarHBondContact O-N 2.97Å; E1028-S1031 PolarHBondContact O-N 3.22Å; E1028-S1031 VanDerWaalsContact O-N 3.13Å; E1028-I1032 HydrophobicContact CG-CD1 4.09Å; E1028-I1032 WeakPolarHBondContact O-CG1 3.37Å; E1028-I1032 PolarHBondContact O-N 3.07Å
1029	V	78.7	Confident	71.9	Confident	12 Å²	12	51 Å²	51	7%	0.073	29%	0.286	C	S	.	.	H	α-helix	trans	-56.4	-46.4	172.1	169.3	0	0	0	0	110.9	L563 I823 Y826 V1025 Y1026 I1032 M1033	L563-V1029 HydrophobicContact CD2-CB 4.28Å; L563-V1029 HydrophobicContact CD2-CG1 3.9Å; L563-V1029 HydrophobicContact CD2-CG2 3.97Å; I823-V1029 HydrophobicContact CD1-CG2 4.25Å; I823-V1029 HydrophobicContact CG1-CG1 4.43Å; I823-V1029 HydrophobicContact CG1-CG2 4.44Å; I823-V1029 HydrophobicContact CG2-CG1 4.03Å; Y826-V1029 HydrophobicContact CD1-CG1 4.09Å; Y826-V1029 HydrophobicContact CE1-CG1 4.23Å; V1025-V1029 PolarHBondContact O-N 2.71Å; Y1026-V1029 PolarHBondContact O-N 2.98Å; V1029-I1032 PolarHBondContact O-N 3.01Å; V1029-M1033 PolarHBondContact O-N 2.9Å; V1029-M1033 VanDerWaalsContact O-N 3.1Å
1030	K	80.9	Confident	74	Confident	27 Å²	27	45.5 Å²	45.5	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-49.6	173	178.8	175.7	177.1	-173.9	0	111.3	D872 T874 Y1026 E1028 I1032 M1033 D1034	D872-K1030 HydrophobicContact CB-CD 4.18Å; D872-K1030 PolarHBondContact O-NZ 2.8Å; T874-K1030 HydrophobicContact CG2-CD 4.49Å; T874-K1030 PolarHBondContact OG1-NZ 2.84Å; T874-K1030 VanDerWaalsContact OG1-NZ 3.16Å; Y1026-K1030 PolarHBondContact O-N 3.04Å; E1028-K1030 VanDerWaalsContact C-N 3.32Å; E1028-K1030 PolarHBondContact O-N 2.97Å; K1030-I1032 VanDerWaalsContact C-N 3.27Å; K1030-I1032 PolarHBondContact O-N 3.2Å; K1030-M1033 PolarHBondContact O-N 3.2Å; K1030-M1033 VanDerWaalsContact O-N 3.1Å; K1030-D1034 WeakPolarHBondContact CE-OD2 3.19Å; K1030-D1034 WeakPolarHBondContact O-CB 3.44Å; K1030-D1034 PolarHBondContact O-N 3.31Å
1031	S	82.1	Confident	76.3	Confident	30 Å²	30	44.3 Å²	44.3	21%	0.21	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-31.5	-178.4	-170	0	0	0	0	113.4	P1017 S1027 E1028 T1035	P1017-S1031 WeakPolarHBondContact CB-OG 3.5Å; S1027-S1031 WeakPolarHBondContact O-CB 3.14Å; S1027-S1031 PolarHBondContact O-N 3.01Å; E1028-S1031 PolarHBondContact O-N 3.22Å; E1028-S1031 VanDerWaalsContact O-N 3.13Å; S1031-T1035 WeakPolarHBondContact O-CB 3.49Å; S1031-T1035 PolarHBondContact O-N 2.81Å; S1031-T1035 VanDerWaalsContact O-N 3.16Å; S1031-T1035 PolarHBondContact O-OG1 2.91Å
1032	I	83.5	Confident	78.3	Confident	22 Å²	22	44 Å²	44	11%	0.113	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-49.3	172.6	-70.3	165.1	0	0	0	109.8	L562 L1016 P1017 E1028 V1029 K1030 T1035 L1036	L562-I1032 HydrophobicContact CB-CG2 4.49Å; L562-I1032 HydrophobicContact CD1-CG2 4.18Å; L562-I1032 HydrophobicContact CD2-CG2 4.17Å; L1016-I1032 HydrophobicContact CD2-CG1 4.25Å; L1016-I1032 HydrophobicContact CD2-CG2 4.42Å; P1017-I1032 HydrophobicContact CG-CG1 4.06Å; E1028-I1032 HydrophobicContact CG-CD1 4.09Å; E1028-I1032 WeakPolarHBondContact O-CG1 3.37Å; E1028-I1032 PolarHBondContact O-N 3.07Å; V1029-I1032 PolarHBondContact O-N 3.01Å; K1030-I1032 VanDerWaalsContact C-N 3.27Å; K1030-I1032 PolarHBondContact O-N 3.2Å; I1032-T1035 PolarHBondContact O-N 3.04Å; I1032-L1036 VanDerWaalsContact O-CB 3.31Å; I1032-L1036 WeakPolarHBondContact O-CB 3.43Å; I1032-L1036 PolarHBondContact O-N 3.4Å
1033	M	88.7	Confident	80.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-67.4	-39.9	179.6	-68.9	-52.2	-57.8	0	0	112.9	L528 L563 Y826 A827 C830 F831 V1029 K1030 T1035 L1036 T1037	L528-M1033 HydrophobicContact CD1-SD 4.16Å; L563-M1033 HydrophobicContact CD1-CG 4.3Å; L563-M1033 HydrophobicContact CD1-SD 3.79Å; Y826-M1033 HydrophobicContact CE1-CB 4.18Å; Y826-M1033 HydrophobicContact CE1-CG 4Å; A827-M1033 HydrophobicContact CB-CE 3.88Å; A827-M1033 HydrophobicContact CB-CG 4.3Å; A827-M1033 HydrophobicContact CB-SD 3.81Å; C830-M1033 HydrophobicContact CB-CE 3.84Å; F831-M1033 HydrophobicContact CD2-CE 4.27Å; F831-M1033 HydrophobicContact CE2-CE 3.77Å; F831-M1033 HydrophobicContact CZ-CE 3.92Å; V1029-M1033 PolarHBondContact O-N 2.9Å; V1029-M1033 VanDerWaalsContact O-N 3.1Å; K1030-M1033 PolarHBondContact O-N 3.2Å; K1030-M1033 VanDerWaalsContact O-N 3.1Å; M1033-T1035 VanDerWaalsContact C-N 3.29Å; M1033-T1035 PolarHBondContact O-N 3.42Å; M1033-L1036 HydrophobicContact CE-CD2 4.39Å; M1033-L1036 PolarHBondContact O-N 3.01Å; M1033-L1036 HydrophobicContact SD-CD2 4.32Å; M1033-T1037 HydrophobicContact CE-CG2 4.2Å; M1033-T1037 WeakPolarHBondContact O-CB 3.44Å; M1033-T1037 WeakPolarHBondContact O-CG2 3.48Å; M1033-T1037 PolarHBondContact O-N 2.91Å; M1033-T1037 PolarHBondContact O-OG1 3.09Å
1034	D	85.4	Confident	81.7	Confident	58 Å²	58	32.6 Å²	32.6	31%	0.31	17%	0.17	S	C	.	.	H	α-helix	trans	-63.4	-33	174.7	-85	-13.5	0	0	0	112.2	K1030 R1038	K1030-D1034 WeakPolarHBondContact CE-OD2 3.19Å; K1030-D1034 WeakPolarHBondContact O-CB 3.44Å; K1030-D1034 PolarHBondContact O-N 3.31Å; D1034-R1038 WeakPolarHBondContact O-CB 3.36Å; D1034-R1038 PolarHBondContact O-N 3.13Å; D1034-R1038 PolarHBondContact O-NH1 3.42Å
1035	T	85.4	Confident	82.9	Confident	31 Å²	31	33.7 Å²	33.7	19%	0.19	18%	0.177	C	C	.	.	H	α-helix	trans	-77.7	-50.4	175.7	-52.2	0	0	0	0	110.1	S1031 I1032 M1033 T1037 R1038 S1039	S1031-T1035 WeakPolarHBondContact O-CB 3.49Å; S1031-T1035 PolarHBondContact O-N 2.81Å; S1031-T1035 VanDerWaalsContact O-N 3.16Å; S1031-T1035 PolarHBondContact O-OG1 2.91Å; I1032-T1035 PolarHBondContact O-N 3.04Å; M1033-T1035 VanDerWaalsContact C-N 3.29Å; M1033-T1035 PolarHBondContact O-N 3.42Å; T1035-T1037 PolarHBondContact O-N 3.38Å; T1035-R1038 PolarHBondContact O-N 3.36Å; T1035-S1039 WeakPolarHBondContact O-CB 3.22Å; T1035-S1039 PolarHBondContact O-N 3.45Å; T1035-S1039 PolarHBondContact O-OG 2.99Å; T1035-S1039 VanDerWaalsContact O-OG 3.1Å
1036	L	89.3	Confident	83.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.7	-52.2	-179.9	178.5	63.9	0	0	0	112	L528 L530 L562 F831 F1015 I1032 M1033 R1038 S1039 L1040	L528-L1036 HydrophobicContact CD1-CD2 3.93Å; L528-L1036 HydrophobicContact CD2-CD2 4.45Å; L530-L1036 HydrophobicContact CD1-CD1 4.36Å; L530-L1036 HydrophobicContact CD2-CD1 4.08Å; L562-L1036 HydrophobicContact CD1-CD1 4.49Å; L562-L1036 HydrophobicContact CD1-CD2 3.84Å; F831-L1036 HydrophobicContact CE1-CD2 4.35Å; F831-L1036 HydrophobicContact CZ-CD2 3.82Å; F1015-L1036 HydrophobicContact CB-CD1 4.12Å; F1015-L1036 HydrophobicContact CD1-CD1 4.06Å; F1015-L1036 HydrophobicContact CG-CD1 4.5Å; I1032-L1036 VanDerWaalsContact O-CB 3.31Å; I1032-L1036 WeakPolarHBondContact O-CB 3.43Å; I1032-L1036 PolarHBondContact O-N 3.4Å; M1033-L1036 HydrophobicContact CE-CD2 4.39Å; M1033-L1036 PolarHBondContact O-N 3.01Å; M1033-L1036 HydrophobicContact SD-CD2 4.32Å; L1036-R1038 PolarHBondContact O-N 3.28Å; L1036-S1039 PolarHBondContact O-N 3.18Å; L1036-L1040 HydrophobicContact CD1-CD1 3.9Å; L1036-L1040 HydrophobicContact CD1-CG 4.27Å; L1036-L1040 HydrophobicContact CG-CD1 3.96Å; L1036-L1040 WeakPolarHBondContact O-CB 3.34Å; L1036-L1040 WeakPolarHBondContact O-CG 3.2Å; L1036-L1040 PolarHBondContact O-N 3.42Å
1037	T	90	Very high	84	Confident	25 Å²	25	36.6 Å²	36.6	15%	0.153	19%	0.189	C	C	.	.	H	α-helix	trans	-66.8	-36	-177.9	55.8	0	0	0	0	112.4	C830 L834 M1033 T1035 Y1041	C830-T1037 HydrophobicContact CB-CG2 4.19Å; L834-T1037 HydrophobicContact CD2-CG2 4.3Å; M1033-T1037 HydrophobicContact CE-CG2 4.2Å; M1033-T1037 WeakPolarHBondContact O-CB 3.44Å; M1033-T1037 WeakPolarHBondContact O-CG2 3.48Å; M1033-T1037 PolarHBondContact O-N 2.91Å; M1033-T1037 PolarHBondContact O-OG1 3.09Å; T1035-T1037 PolarHBondContact O-N 3.38Å; T1037-Y1041 WeakPolarHBondContact O-CB 3.21Å; T1037-Y1041 PolarHBondContact O-N 3.42Å
1038	R	87.6	Confident	84.2	Confident	146 Å²	146	35.6 Å²	35.6	55%	0.551	18%	0.183	S	C	*	.	H	α-helix	trans	-64.9	-51.4	173.1	177.5	175.4	-76.1	95.9	-4.2	111.8	D1034 T1035 L1036 L1040 Y1041 D1042	D1034-R1038 WeakPolarHBondContact O-CB 3.36Å; D1034-R1038 PolarHBondContact O-N 3.13Å; D1034-R1038 PolarHBondContact O-NH1 3.42Å; T1035-R1038 PolarHBondContact O-N 3.36Å; L1036-R1038 PolarHBondContact O-N 3.28Å; R1038-L1040 VanDerWaalsContact C-N 3.26Å; R1038-L1040 PolarHBondContact O-N 2.91Å; R1038-Y1041 CarbonylContact O-C 3.51Å; R1038-Y1041 WeakPolarHBondContact O-CA 3.18Å; R1038-Y1041 WeakPolarHBondContact O-CB 3.26Å; R1038-Y1041 PolarHBondContact O-N 3.12Å; R1038-D1042 WeakPolarHBondContact CG-OD2 3.43Å; R1038-D1042 VanDerWaalsContact O-CG 3.26Å; R1038-D1042 PolarHBondContact O-N 2.81Å
1039	S	87.1	Confident	84.2	Confident	23 Å²	23	32.5 Å²	32.5	16%	0.161	17%	0.171	C	C	.	.	H	α-helix	trans	-59.5	-37.5	178.5	-60.5	0	0	0	0	111.9	S1014 F1015 T1035 L1036 D1042 C1043	S1014-S1039 PolarHBondContact O-OG 2.72Å; S1014-S1039 VanDerWaalsContact O-OG 3.14Å; F1015-S1039 VanDerWaalsContact CE1-CB 3.47Å; T1035-S1039 WeakPolarHBondContact O-CB 3.22Å; T1035-S1039 PolarHBondContact O-N 3.45Å; T1035-S1039 PolarHBondContact O-OG 2.99Å; T1035-S1039 VanDerWaalsContact O-OG 3.1Å; L1036-S1039 PolarHBondContact O-N 3.18Å; S1039-D1042 PolarHBondContact O-N 3.17Å; S1039-C1043 PolarHBondContact O-N 3.4Å; S1039-C1043 PolarHBondContact O-SG 3.28Å
1040	L	90.6	Very high	83.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-69.2	-38.2	173.2	-64.7	170.4	0	0	0	112.6	V449 I776 V778 F831 L834 F1015 L1036 R1038 A1044	V449-L1040 HydrophobicContact CG1-CD2 3.77Å; V449-L1040 HydrophobicContact CG2-CD2 4.17Å; I776-L1040 HydrophobicContact CG2-CD2 4.05Å; V778-L1040 HydrophobicContact CG2-CD1 4.1Å; V778-L1040 HydrophobicContact CG2-CD2 4.36Å; F831-L1040 HydrophobicContact CE1-CD1 4.17Å; L834-L1040 HydrophobicContact CD2-CB 3.96Å; L834-L1040 HydrophobicContact CD2-CD1 4.12Å; F1015-L1040 HydrophobicContact CD1-CD2 4.38Å; F1015-L1040 HydrophobicContact CD1-CG 4.45Å; F1015-L1040 HydrophobicContact CE1-CD2 3.93Å; F1015-L1040 HydrophobicContact CE1-CG 4.29Å; L1036-L1040 HydrophobicContact CD1-CD1 3.9Å; L1036-L1040 HydrophobicContact CD1-CG 4.27Å; L1036-L1040 HydrophobicContact CG-CD1 3.96Å; L1036-L1040 WeakPolarHBondContact O-CB 3.34Å; L1036-L1040 WeakPolarHBondContact O-CG 3.2Å; L1036-L1040 PolarHBondContact O-N 3.42Å; R1038-L1040 VanDerWaalsContact C-N 3.26Å; R1038-L1040 PolarHBondContact O-N 2.91Å; L1040-A1044 VanDerWaalsContact O-CB 3.3Å; L1040-A1044 WeakPolarHBondContact O-CB 3.42Å; L1040-A1044 PolarHBondContact O-N 2.98Å
1041	Y	90.2	Very high	83.3	Confident	47 Å²	47	39.3 Å²	39.3	18%	0.184	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-39.5	172.9	-177.2	-86.3	0	0	0	111.9	L834 D837 L842 Q845 T1037 R1038 A1044 A1045	L834-Y1041 HydrophobicContact CD1-CD2 4.23Å; D837-Y1041 HydrophobicContact CB-CD2 4.17Å; D837-Y1041 HydrophobicContact CB-CE2 4Å; L842-Y1041 HydrophobicContact CD1-CE2 4.43Å; L842-Y1041 HydrophobicContact CD2-CE1 4.37Å; L842-Y1041 HydrophobicContact CD2-CE2 4.19Å; L842-Y1041 VanDerWaalsContact CD2-OH 3.29Å; L842-Y1041 WeakPolarHBondContact CD2-OH 3.37Å; L842-Y1041 HydrophobicContact CG-CE2 4.03Å; Q845-Y1041 PolarHBondContact NE2-OH 2.97Å; Q845-Y1041 PolarHBondContact OE1-OH 3.06Å; T1037-Y1041 WeakPolarHBondContact O-CB 3.21Å; T1037-Y1041 PolarHBondContact O-N 3.42Å; R1038-Y1041 CarbonylContact O-C 3.51Å; R1038-Y1041 WeakPolarHBondContact O-CA 3.18Å; R1038-Y1041 WeakPolarHBondContact O-CB 3.26Å; R1038-Y1041 PolarHBondContact O-N 3.12Å; Y1041-A1044 CarbonylContact O-C 3.49Å; Y1041-A1044 WeakPolarHBondContact O-CA 3.47Å; Y1041-A1044 WeakPolarHBondContact O-CB 3.4Å; Y1041-A1044 PolarHBondContact O-N 3.34Å; Y1041-A1044 VanDerWaalsContact O-N 3.08Å; Y1041-A1045 HydrophobicContact CE1-CB 4.32Å; Y1041-A1045 WeakPolarHBondContact O-CB 3.36Å; Y1041-A1045 PolarHBondContact O-N 3.1Å
1042	D	85.6	Confident	82.4	Confident	87 Å²	87	38.7 Å²	38.7	47%	0.465	20%	0.197	S	C	.	.	H	α-helix	trans	-67.5	-42.1	178.8	-66.7	-26.9	0	0	0	110.8	R1038 S1039 A1044 A1045 H1046	R1038-D1042 WeakPolarHBondContact CG-OD2 3.43Å; R1038-D1042 VanDerWaalsContact O-CG 3.26Å; R1038-D1042 PolarHBondContact O-N 2.81Å; S1039-D1042 PolarHBondContact O-N 3.17Å; D1042-A1044 VanDerWaalsContact C-N 3.27Å; D1042-A1044 PolarHBondContact O-N 3.38Å; D1042-A1045 PolarHBondContact O-N 2.74Å; D1042-H1046 VanDerWaalsContact O-CB 3.3Å; D1042-H1046 WeakPolarHBondContact O-CB 3.47Å; D1042-H1046 PolarHBondContact O-N 3.32Å
1043	C	85.2	Confident	81.4	Confident	11 Å²	11	42.2 Å²	42.2	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-58	-39.7	167.4	-69	0	0	0	0	111.9	Q447 V449 S1039 N1047	Q447-C1043 PolarHBondContact OE1-SG 2.98Å; V449-C1043 HydrophobicContact CG2-CB 4.08Å; S1039-C1043 PolarHBondContact O-N 3.4Å; S1039-C1043 PolarHBondContact O-SG 3.28Å; C1043-N1047 PolarHBondContact O-N 2.96Å; C1043-N1047 VanDerWaalsContact O-N 3.13Å; C1043-N1047 PolarHBondContact O-ND2 2.69Å; C1043-N1047 VanDerWaalsContact O-ND2 3.1Å
1044	A	86.6	Confident	80.5	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-70.6	-38.7	-179.7	0	0	0	0	0	112.7	L842 L1040 Y1041 D1042 N1047 A1048 S1066 M1068	L842-A1044 HydrophobicContact CD1-CB 4.22Å; L1040-A1044 VanDerWaalsContact O-CB 3.3Å; L1040-A1044 WeakPolarHBondContact O-CB 3.42Å; L1040-A1044 PolarHBondContact O-N 2.98Å; Y1041-A1044 CarbonylContact O-C 3.49Å; Y1041-A1044 WeakPolarHBondContact O-CA 3.47Å; Y1041-A1044 WeakPolarHBondContact O-CB 3.4Å; Y1041-A1044 PolarHBondContact O-N 3.34Å; Y1041-A1044 VanDerWaalsContact O-N 3.08Å; D1042-A1044 VanDerWaalsContact C-N 3.27Å; D1042-A1044 PolarHBondContact O-N 3.38Å; A1044-N1047 PolarHBondContact O-N 3.18Å; A1044-A1048 VanDerWaalsContact O-CB 3.32Å; A1044-A1048 WeakPolarHBondContact O-CB 3.39Å; A1044-A1048 PolarHBondContact O-N 3.48Å; A1044-S1066 VanDerWaalsContact CA-O 3.22Å; A1044-S1066 WeakPolarHBondContact CA-O 3.37Å; A1044-S1066 VanDerWaalsContact O-O 3.11Å; A1044-M1068 HydrophobicContact CB-CB 4.33Å; A1044-M1068 HydrophobicContact CB-CE 3.98Å
1045	A	83.9	Confident	79.1	Confident	35 Å²	35	42.2 Å²	42.2	29%	0.289	22%	0.217	S	C	.	.	H	α-helix	trans	-70.3	-38.5	175.6	0	0	0	0	0	112.2	L842 Y1041 D1042 N1047 A1048 S1049	L842-A1045 HydrophobicContact CD2-CB 4.08Å; Y1041-A1045 HydrophobicContact CE1-CB 4.32Å; Y1041-A1045 WeakPolarHBondContact O-CB 3.36Å; Y1041-A1045 PolarHBondContact O-N 3.1Å; D1042-A1045 PolarHBondContact O-N 2.74Å; A1045-N1047 VanDerWaalsContact C-N 3.26Å; A1045-N1047 PolarHBondContact O-N 2.66Å; A1045-A1048 CarbonylContact O-C 3.41Å; A1045-A1048 PolarHBondContact O-N 3.17Å; A1045-S1049 PolarHBondContact O-N 2.94Å
1046	H	79.9	Confident	77.8	Confident	89 Å²	89	40.8 Å²	40.8	41%	0.412	21%	0.209	S	C	.	.	H	α-helix	trans	-68.5	-23.2	174.2	179.8	-104.6	0	0	0	113.3	R418 D1042	R418-H1046 PolarHBondContact NH1-O 3.13Å; R418-H1046 PolarHBondContact NH2-CE1 3.08Å; R418-H1046 PolarHBondContact NH2-O 2.95Å; D1042-H1046 VanDerWaalsContact O-CB 3.3Å; D1042-H1046 WeakPolarHBondContact O-CB 3.47Å; D1042-H1046 PolarHBondContact O-N 3.32Å
1047	N	78.7	Confident	76.6	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-82.4	-40.6	166.2	-76.3	-44.5	0	0	0	111.7	R418 Q447 Q448 C1043 A1044 A1045 S1049 S1057 S1066	R418-N1047 PolarHBondContact NH1-OD1 3.07Å; Q447-N1047 PolarHBondContact O-ND2 2.77Å; Q447-N1047 PolarHBondContact O-OD1 3.45Å; Q448-N1047 PolarHBondContact NE2-ND2 2.86Å; Q448-N1047 PolarHBondContact NE2-OD1 3.47Å; C1043-N1047 PolarHBondContact O-N 2.96Å; C1043-N1047 VanDerWaalsContact O-N 3.13Å; C1043-N1047 PolarHBondContact O-ND2 2.69Å; C1043-N1047 VanDerWaalsContact O-ND2 3.1Å; A1044-N1047 PolarHBondContact O-N 3.18Å; A1045-N1047 VanDerWaalsContact C-N 3.26Å; A1045-N1047 PolarHBondContact O-N 2.66Å; N1047-S1049 PolarHBondContact O-N 3.37Å; N1047-S1057 WeakPolarHBondContact O-CA 3.32Å; N1047-S1066 WeakPolarHBondContact CB-O 3.43Å
1048	A	75.7	Confident	75.3	Confident	10 Å²	10	40.1 Å²	40.1	8%	0.083	21%	0.206	C	C	.	.	S	Bend	trans	-69.5	24.5	175.1	0	0	0	0	0	115.3	L842 A1044 A1045 Y1050	L842-A1048 HydrophobicContact CD1-CB 4.12Å; A1044-A1048 VanDerWaalsContact O-CB 3.32Å; A1044-A1048 WeakPolarHBondContact O-CB 3.39Å; A1044-A1048 PolarHBondContact O-N 3.48Å; A1045-A1048 CarbonylContact O-C 3.41Å; A1045-A1048 PolarHBondContact O-N 3.17Å; A1048-Y1050 PolarHBondContact O-N 2.86Å
1049	S	73.7	Confident	74.4	Confident	27 Å²	27	34 Å²	34	19%	0.189	18%	0.183	C	C	.	.			trans	-42.2	129.4	-176	-177.1	0	0	0	0	113.2	A1045 N1047 N1051 D1054 R1173	A1045-S1049 PolarHBondContact O-N 2.94Å; N1047-S1049 PolarHBondContact O-N 3.37Å; S1049-N1051 PolarHBondContact O-N 2.99Å; S1049-D1054 WeakPolarHBondContact CB-OD2 3.36Å; S1049-D1054 WeakPolarHBondContact OG-CB 3.14Å; S1049-D1054 PolarHBondContact OG-OD2 2.8Å; S1049-R1173 PolarHBondContact O-NH2 2.92Å
1050	Y	70.7	Confident	73.7	Confident	97 Å²	97	34.2 Å²	34.2	38%	0.38	18%	0.182	S	C	.	.	S	Bend	trans	-62.1	-19.7	-172.6	-62.2	-77.6	0	0	0	114.2	H849 A1048 R1173	H849-Y1050 HydrophobicContact CB-CD1 3.59Å; H849-Y1050 HydrophobicContact CB-CE1 3.74Å; H849-Y1050 HydrophobicContact CB-CG 4.42Å; H849-Y1050 AromaticContact CD2-CD1 3.4Å; H849-Y1050 WeakPolarHBondContact CD2-CD1 3.45Å; H849-Y1050 AromaticContact CD2-CD2 3.67Å; H849-Y1050 AromaticContact CD2-CE1 3.72Å; H849-Y1050 AromaticContact CD2-CE2 3.98Å; H849-Y1050 AromaticContact CD2-CG 3.37Å; H849-Y1050 AromaticContact CG-CD1 3.51Å; H849-Y1050 AromaticContact CG-CE1 3.96Å; H849-Y1050 AromaticContact CG-CG 3.84Å; H849-Y1050 AromaticContact NE2-CD2 3.94Å; H849-Y1050 AromaticContact NE2-CG 3.74Å; A1048-Y1050 PolarHBondContact O-N 2.86Å; Y1050-R1173 PolarHBondContact O-NH1 3.1Å
1051	N	69.8	Low	73.1	Confident	85 Å²	85	34.4 Å²	34.4	46%	0.455	18%	0.184	S	C	.	.			trans	-86.1	117.8	172.7	-176.4	1.7	0	0	0	110.5	S1049 N1053 D1054	S1049-N1051 PolarHBondContact O-N 2.99Å; N1051-N1053 PolarHBondContact O-N 2.89Å; N1051-N1053 WeakPolarHBondContact OD1-CB 3.36Å; N1051-N1053 PolarHBondContact OD1-N 3.05Å; N1051-D1054 WeakPolarHBondContact O-CB 3.3Å; N1051-D1054 PolarHBondContact O-N 3.09Å
1052	P	62.8	Low	72.4	Confident	18 Å²	18	32.3 Å²	32.3	12%	0.117	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.8	176.8	32.2	-37.1	0	0	0	113.3	R1173 N1227	P1052-R1173 HydrophobicContact CB-CG 4.39Å; P1052-N1227 WeakPolarHBondContact CD-OD1 3.17Å; P1052-N1227 HydrophobicContact CG-CB 4.49Å; P1052-N1227 WeakPolarHBondContact CG-OD1 3.33Å
1053	N	63.2	Low	72.2	Confident	96 Å²	96	28.8 Å²	28.8	51%	0.513	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	2.2	168.2	-55.3	-9.4	0	0	0	111.7	N1051 S1175	N1051-N1053 PolarHBondContact O-N 2.89Å; N1051-N1053 WeakPolarHBondContact OD1-CB 3.36Å; N1051-N1053 PolarHBondContact OD1-N 3.05Å; N1053-S1175 VanDerWaalsContact OD1-CB 3.31Å; N1053-S1175 WeakPolarHBondContact OD1-CB 3.47Å; N1053-S1175 PolarHBondContact OD1-OG 3.04Å
1054	D	69	Low	72.2	Confident	31 Å²	31	28.2 Å²	28.2	17%	0.166	16%	0.157	C	C	.	.			trans	-68.1	125.3	169.8	-175.9	-45.2	0	0	0	109.6	R418 S1049 N1051 G1056 S1057	R418-D1054 IonicContact CZ-OD1 2.64Å; R418-D1054 IonicContact NH2-OD1 2.66Å; R418-D1054 PolarHBondContact NH2-OD1 3.02Å; R418-D1054 IonicContact NH2-OD2 2.69Å; R418-D1054 PolarHBondContact NH2-OD2 2.9Å; S1049-D1054 WeakPolarHBondContact CB-OD2 3.36Å; S1049-D1054 WeakPolarHBondContact OG-CB 3.14Å; S1049-D1054 PolarHBondContact OG-OD2 2.8Å; N1051-D1054 WeakPolarHBondContact O-CB 3.3Å; N1051-D1054 PolarHBondContact O-N 3.09Å; D1054-G1056 VanDerWaalsContact C-N 3.28Å; D1054-G1056 PolarHBondContact O-N 2.79Å; D1054-G1056 PolarHBondContact OD1-N 3.5Å; D1054-S1057 WeakPolarHBondContact O-CB 3.45Å; D1054-S1057 PolarHBondContact O-N 2.67Å; D1054-S1057 VanDerWaalsContact O-N 3.12Å; D1054-S1057 PolarHBondContact O-OG 2.63Å
1055	P	56.5	Low	71.8	Confident	26 Å²	26	29 Å²	29	17%	0.169	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-33.2	-176.6	-28.5	37.3	0	0	0	115.6	R418 Y421 S1057	R418-P1055 HydrophobicContact CG-CB 4.45Å; Y421-P1055 HydrophobicContact CD1-CG 3.85Å; Y421-P1055 HydrophobicContact CD2-CB 3.55Å; Y421-P1055 HydrophobicContact CD2-CG 3.69Å; Y421-P1055 HydrophobicContact CE2-CB 4.26Å; Y421-P1055 HydrophobicContact CE2-CG 4.45Å; Y421-P1055 HydrophobicContact CG-CB 3.73Å; Y421-P1055 HydrophobicContact CG-CG 3.32Å; P1055-S1057 VanDerWaalsContact C-N 3.29Å
1056	G	57.1	Low	71.7	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.01	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-4.6	-178.1	0	0	0	0	0	113.9	D1054 G1058	D1054-G1056 VanDerWaalsContact C-N 3.28Å; D1054-G1056 PolarHBondContact O-N 2.79Å; D1054-G1056 PolarHBondContact OD1-N 3.5Å; G1056-G1058 VanDerWaalsContact C-N 3.31Å; G1056-G1058 PolarHBondContact O-N 2.9Å
1057	S	64.3	Low	71.8	Confident	8 Å²	8	23.1 Å²	23.1	6%	0.056	13%	0.129	C	C	.	.			trans	-71.4	-20.5	-163.2	71.9	0	0	0	0	115.2	N1047 D1054 P1055 F1059	N1047-S1057 WeakPolarHBondContact O-CA 3.32Å; D1054-S1057 WeakPolarHBondContact O-CB 3.45Å; D1054-S1057 PolarHBondContact O-N 2.67Å; D1054-S1057 VanDerWaalsContact O-N 3.12Å; D1054-S1057 PolarHBondContact O-OG 2.63Å; P1055-S1057 VanDerWaalsContact C-N 3.29Å; S1057-F1059 VanDerWaalsContact CB-CD2 3.5Å; S1057-F1059 WeakPolarHBondContact O-CD2 3.47Å; S1057-F1059 WeakPolarHBondContact O-CE2 3.43Å; S1057-F1059 PolarHBondContact O-N 2.84Å
1058	G	63.5	Low	72.3	Confident	3 Å²	3	23.1 Å²	23.1	3%	0.031	13%	0.128	C	C	.	.			trans	63.8	3.6	170.2	0	0	0	0	0	116.1	R414 G1056 D1061	R414-G1058 PolarHBondContact NH2-O 3.05Å; G1056-G1058 VanDerWaalsContact C-N 3.31Å; G1056-G1058 PolarHBondContact O-N 2.9Å; G1058-D1061 VanDerWaalsContact O-CG 3.22Å
1059	F	69.2	Low	73.1	Confident	17 Å²	17	22.6 Å²	22.6	8%	0.075	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	143.9	176.4	-60.9	-81.5	0	0	0	109.9	R846 S1057 D1061 P1065 R1173	R846-F1059 VanDerWaalsContact NH1-CD1 3.3Å; S1057-F1059 VanDerWaalsContact CB-CD2 3.5Å; S1057-F1059 WeakPolarHBondContact O-CD2 3.47Å; S1057-F1059 WeakPolarHBondContact O-CE2 3.43Å; S1057-F1059 PolarHBondContact O-N 2.84Å; F1059-D1061 PolarHBondContact O-N 3.45Å; F1059-P1065 HydrophobicContact CD1-CB 3.77Å; F1059-P1065 HydrophobicContact CE1-CB 3.14Å; F1059-P1065 HydrophobicContact CE1-CG 4.4Å; F1059-P1065 HydrophobicContact CZ-CB 3.65Å; F1059-R1173 HydrophobicContact CB-CG 3.9Å; F1059-R1173 HydrophobicContact CD1-CG 3.56Å; F1059-R1173 HydrophobicContact CD2-CG 4.31Å; F1059-R1173 VanDerWaalsContact CD2-NE 3.33Å; F1059-R1173 HydrophobicContact CE1-CG 4.17Å; F1059-R1173 VanDerWaalsContact CE2-NE 3.32Å; F1059-R1173 HydrophobicContact CG-CG 3.63Å
1060	N	72.5	Confident	74.1	Confident	28 Å²	28	21.4 Å²	21.4	15%	0.15	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	-6.4	177.4	-31.4	-55.5	0	0	0	116.3	G1062 D1172 R1173 L1174 I1235	N1060-G1062 PolarHBondContact O-N 2.93Å; N1060-D1172 WeakPolarHBondContact CA-OD1 3.48Å; N1060-R1173 VanDerWaalsContact CG-O 3.24Å; N1060-R1173 PolarHBondContact ND2-O 2.85Å; N1060-R1173 VanDerWaalsContact OD1-C 3.32Å; N1060-R1173 PolarHBondContact OD1-N 3.31Å; N1060-R1173 PolarHBondContact OD1-O 2.99Å; N1060-L1174 WeakPolarHBondContact ND2-CD2 3.5Å; N1060-I1235 HydrophobicContact CB-CD1 3.63Å; N1060-I1235 WeakPolarHBondContact OD1-CD1 3.48Å
1061	D	76.9	Confident	75.3	Confident	5 Å²	5	16.8 Å²	16.8	3%	0.027	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	7.3	167.6	71.7	24.2	0	0	0	112.9	V396 R397 L410 R414 R417 G1058 F1059 G1063	V396-D1061 CarbonylContact C-O 3.55Å; V396-D1061 WeakPolarHBondContact CA-O 3.33Å; V396-D1061 HydrophobicContact CG2-CB 4.43Å; R397-D1061 WeakPolarHBondContact CB-O 3.42Å; R397-D1061 PolarHBondContact N-O 3.3Å; L410-D1061 HydrophobicContact CD1-CB 4.32Å; R414-D1061 WeakPolarHBondContact CG-OD2 3.41Å; R414-D1061 IonicContact CZ-OD1 2.66Å; R414-D1061 IonicContact CZ-OD2 3.92Å; R414-D1061 IonicContact NE-OD1 3.12Å; R414-D1061 PolarHBondContact NE-OD1 2.81Å; R414-D1061 IonicContact NE-OD2 3.17Å; R414-D1061 PolarHBondContact NE-OD2 2.81Å; R414-D1061 IonicContact NH2-OD1 3.94Å; R414-D1061 PolarHBondContact NH2-OD1 3.46Å; R414-D1061 IonicContact NH2-OD2 3.04Å; R417-D1061 IonicContact CZ-OD2 3.22Å; R417-D1061 IonicContact NH1-OD2 2.63Å; R417-D1061 PolarHBondContact NH1-OD2 2.77Å; G1058-D1061 VanDerWaalsContact O-CG 3.22Å; F1059-D1061 PolarHBondContact O-N 3.45Å; D1061-G1063 PolarHBondContact O-N 3.49Å; D1061-G1063 PolarHBondContact OD1-N 2.92Å
1062	G	75.5	Confident	76.5	Confident	3 Å²	3	12.8 Å²	12.8	3%	0.031	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	6.1	178.6	0	0	0	0	0	114.6	G368 R397 N1060	G368-G1062 CarbonylContact C-O 3.21Å; G368-G1062 WeakPolarHBondContact CA-O 3.34Å; R397-G1062 WeakPolarHBondContact CD-O 3.22Å; N1060-G1062 PolarHBondContact O-N 2.93Å
1063	G	81.9	Confident	78	Confident	12 Å²	12	12 Å²	12	12%	0.124	7%	0.071	C	C	.	.	S	Bend	trans	-87.6	178.3	171.7	0	0	0	0	0	114.3	G368 R414 D1061	G368-G1063 CarbonylContact O-C 3.53Å; G368-G1063 WeakPolarHBondContact O-CA 3.48Å; R414-G1063 VanDerWaalsContact NH2-C 3.3Å; R414-G1063 VanDerWaalsContact NH2-CA 3.34Å; D1061-G1063 PolarHBondContact O-N 3.49Å; D1061-G1063 PolarHBondContact OD1-N 2.92Å
1064	P	85.2	Confident	79.5	Confident	0 Å²	0	7.5 Å²	7.5	0%	0	5%	0.047	C	C	.	.			trans	-63.4	133.8	173.5	27.4	-34.7	0	0	0	110.9	I369 R414 S1066 G1067 M1068 H1069	I369-P1064 HydrophobicContact CB-CB 4.49Å; I369-P1064 HydrophobicContact CG1-CB 4.49Å; I369-P1064 HydrophobicContact CG2-CB 4.15Å; R414-P1064 VanDerWaalsContact CZ-O 3.3Å; R414-P1064 PolarHBondContact NH1-O 3.25Å; R414-P1064 PolarHBondContact NH2-O 3.4Å; P1064-S1066 PolarHBondContact O-N 3.1Å; P1064-G1067 PolarHBondContact O-N 3.43Å; P1064-M1068 WeakPolarHBondContact CB-O 3.37Å; P1064-M1068 VanDerWaalsContact CG-O 3.31Å; P1064-M1068 WeakPolarHBondContact CG-O 3.35Å; P1064-H1069 WeakPolarHBondContact CD-ND1 3.41Å; P1064-H1069 HydrophobicContact CG-CB 4.42Å; P1064-H1069 WeakPolarHBondContact CG-ND1 3.27Å
1065	P	77.4	Confident	80.4	Confident	17 Å²	17	6.5 Å²	6.5	11%	0.11	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-19.8	-176.1	27.1	-35.9	0	0	0	113.8	F1059	F1059-P1065 HydrophobicContact CD1-CB 3.77Å; F1059-P1065 HydrophobicContact CE1-CB 3.14Å; F1059-P1065 HydrophobicContact CE1-CG 4.4Å; F1059-P1065 HydrophobicContact CZ-CB 3.65Å
1066	S	82.7	Confident	81.9	Confident	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.033	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	5.7	-175.9	54.2	0	0	0	0	114.1	S838 A1044 N1047 P1064 M1068	S838-S1066 WeakPolarHBondContact O-CB 3.24Å; S838-S1066 PolarHBondContact O-OG 2.96Å; A1044-S1066 VanDerWaalsContact CA-O 3.22Å; A1044-S1066 WeakPolarHBondContact CA-O 3.37Å; A1044-S1066 VanDerWaalsContact O-O 3.11Å; N1047-S1066 WeakPolarHBondContact CB-O 3.43Å; P1064-S1066 PolarHBondContact O-N 3.1Å; S1066-M1068 PolarHBondContact O-N 2.75Å
1067	G	81.8	Confident	83.3	Confident	1 Å²	1	5.5 Å²	5.5	1%	0.01	4%	0.035	C	C	.	.	S	Bend	trans	63.1	4.3	-178.6	0	0	0	0	0	115.4	Q448 V449 P1064 H1069	Q448-G1067 PolarHBondContact OE1-O 3.13Å; V449-G1067 PolarHBondContact N-O 2.9Å; V449-G1067 VanDerWaalsContact N-O 3.15Å; P1064-G1067 PolarHBondContact O-N 3.43Å; G1067-H1069 PolarHBondContact O-CD2 2.73Å; G1067-H1069 VanDerWaalsContact O-CD2 3.29Å
1068	M	89.4	Confident	83.9	Confident	0 Å²	0	8.5 Å²	8.5	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	115.8	172.1	-177.9	155.9	54.1	0	0	109.3	V449 C451 L834 S838 A1044 P1064 S1066 W1070	V449-M1068 HydrophobicContact CB-CB 4.09Å; V449-M1068 HydrophobicContact CB-CG 3.92Å; V449-M1068 HydrophobicContact CB-SD 4.22Å; V449-M1068 HydrophobicContact CG1-CB 4.47Å; V449-M1068 HydrophobicContact CG1-CG 3.76Å; V449-M1068 HydrophobicContact CG1-SD 3.64Å; V449-M1068 CarbonylContact O-C 3.51Å; V449-M1068 WeakPolarHBondContact O-CA 3.38Å; C451-M1068 VanDerWaalsContact SG-SD 3.67Å; L834-M1068 HydrophobicContact CD1-CE 4.06Å; L834-M1068 HydrophobicContact CD2-CE 4.18Å; L834-M1068 HydrophobicContact CD2-SD 4.32Å; L834-M1068 HydrophobicContact CG-CE 3.89Å; S838-M1068 WeakPolarHBondContact OG-CE 3.49Å; A1044-M1068 HydrophobicContact CB-CB 4.33Å; A1044-M1068 HydrophobicContact CB-CE 3.98Å; P1064-M1068 WeakPolarHBondContact CB-O 3.37Å; P1064-M1068 VanDerWaalsContact CG-O 3.31Å; P1064-M1068 WeakPolarHBondContact CG-O 3.35Å; S1066-M1068 PolarHBondContact O-N 2.75Å; M1068-W1070 HydrophobicContact CE-CZ2 3.71Å; M1068-W1070 HydrophobicContact CG-CZ2 4.27Å; M1068-W1070 HydrophobicContact SD-CZ2 3.89Å
1069	H	92.8	Very high	84.6	Confident	0 Å²	0	9.4 Å²	9.4	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131.2	-173.5	-56	-98.2	0	0	0	109.3	V407 I411 R414 Q448 V449 L450 C451 P1064 G1067	V407-H1069 HydrophobicContact CG1-CB 3.77Å; I411-H1069 HydrophobicContact CD1-CB 4.43Å; I411-H1069 VanDerWaalsContact CG1-CD2 3.49Å; I411-H1069 WeakPolarHBondContact CG1-CD2 3.29Å; I411-H1069 WeakPolarHBondContact CG1-NE2 3.46Å; R414-H1069 PolarHBondContact NH1-CE1 3.37Å; Q448-H1069 PolarHBondContact OE1-NE2 3.46Å; V449-H1069 PolarHBondContact O-CD2 2.81Å; V449-H1069 PolarHBondContact O-N 2.85Å; L450-H1069 WeakPolarHBondContact CA-O 3.39Å; L450-H1069 HydrophobicContact CD1-CB 4.05Å; L450-H1069 WeakPolarHBondContact CD1-O 3.4Å; C451-H1069 PolarHBondContact N-O 3.07Å; P1064-H1069 WeakPolarHBondContact CD-ND1 3.41Å; P1064-H1069 HydrophobicContact CG-CB 4.42Å; P1064-H1069 WeakPolarHBondContact CG-ND1 3.27Å; G1067-H1069 PolarHBondContact O-CD2 2.73Å; G1067-H1069 VanDerWaalsContact O-CD2 3.29Å
1070	W	94.4	Very high	85.1	Confident	2 Å²	2	8.6 Å²	8.6	1%	0.008	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.1	-174	-69.1	98.3	0	0	0	111.1	L371 C451 L453 F831 L834 Y835 S838 N839 M1068	L371-W1070 PolarHBondContact N-O 3.06Å; C451-W1070 HydrophobicContact CB-CD2 4Å; C451-W1070 HydrophobicContact CB-CE3 3.41Å; C451-W1070 VanDerWaalsContact CB-CE3 3.41Å; C451-W1070 HydrophobicContact CB-CH2 3.87Å; C451-W1070 HydrophobicContact CB-CZ2 4.38Å; C451-W1070 HydrophobicContact CB-CZ3 3.33Å; L453-W1070 HydrophobicContact CD1-CE3 3.84Å; L453-W1070 HydrophobicContact CD1-CZ3 3.58Å; L453-W1070 HydrophobicContact CG-CE3 4.22Å; L453-W1070 HydrophobicContact CG-CZ3 3.97Å; F831-W1070 WeakPolarHBondContact O-CH2 3.3Å; L834-W1070 HydrophobicContact CB-CH2 4.44Å; L834-W1070 HydrophobicContact CD2-CH2 4.4Å; L834-W1070 HydrophobicContact CG-CH2 4.31Å; L834-W1070 HydrophobicContact CG-CZ2 4.2Å; Y835-W1070 VanDerWaalsContact CA-CZ2 3.44Å; Y835-W1070 HydrophobicContact CD2-CB 4.41Å; Y835-W1070 AromaticContact CD2-CD1 3.95Å; Y835-W1070 AromaticContact CD2-CD2 3.78Å; Y835-W1070 HydrophobicContact CD2-CD2 3.78Å; Y835-W1070 AromaticContact CD2-CE2 3.91Å; Y835-W1070 HydrophobicContact CD2-CE3 4.32Å; Y835-W1070 AromaticContact CD2-CG 3.81Å; Y835-W1070 HydrophobicContact CD2-CG 3.81Å; Y835-W1070 AromaticContact CD2-NE1 3.98Å; Y835-W1070 HydrophobicContact CE2-CG 4.36Å; S838-W1070 PolarHBondContact OG-NE1 2.87Å; N839-W1070 PolarHBondContact ND2-NE1 3Å; M1068-W1070 HydrophobicContact CE-CZ2 3.71Å; M1068-W1070 HydrophobicContact CG-CZ2 4.27Å; M1068-W1070 HydrophobicContact SD-CZ2 3.89Å
1071	I	96.1	Very high	85.3	Confident	0 Å²	0	7.4 Å²	7.4	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	115	172.9	-49.5	-176.6	0	0	0	109.8	L371 L450 C451 L452 L453 I463	L371-I1071 HydrophobicContact CB-CG1 4.13Å; L371-I1071 HydrophobicContact CB-CG2 4.22Å; L371-I1071 HydrophobicContact CD2-CD1 4.19Å; L371-I1071 HydrophobicContact CD2-CG1 4.45Å; L371-I1071 HydrophobicContact CD2-CG2 4.27Å; L371-I1071 HydrophobicContact CG-CG2 4.48Å; L371-I1071 CarbonylContact O-C 3.59Å; L371-I1071 VanDerWaalsContact O-CA 3.29Å; L371-I1071 WeakPolarHBondContact O-CA 3.42Å; L450-I1071 HydrophobicContact CD1-CD1 3.83Å; L450-I1071 HydrophobicContact CD1-CG1 3.87Å; C451-I1071 PolarHBondContact O-N 3.12Å; L452-I1071 HydrophobicContact CD2-CB 3.77Å; L452-I1071 HydrophobicContact CD2-CD1 3.94Å; L452-I1071 HydrophobicContact CD2-CG1 4.06Å; L453-I1071 PolarHBondContact N-O 2.76Å; I463-I1071 HydrophobicContact CD1-CG2 4.46Å; I463-I1071 HydrophobicContact CG2-CD1 3.8Å; I463-I1071 HydrophobicContact CG2-CG2 4.42Å
1072	H	94.9	Very high	85.2	Confident	1 Å²	1	8.3 Å²	8.3	1%	0.005	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.5	177.6	-53.2	-91.7	0	0	0	110.3	N370 L371 I372 S373 L453 Y835 F1074 I1157	N370-H1072 PolarHBondContact ND2-NE2 3.42Å; L371-H1072 PolarHBondContact O-N 2.9Å; I372-H1072 WeakPolarHBondContact CA-O 3.47Å; I372-H1072 HydrophobicContact CD1-CB 3.93Å; S373-H1072 PolarHBondContact N-O 3.4Å; L453-H1072 CarbonylContact O-C 3.58Å; L453-H1072 WeakPolarHBondContact O-CA 3.4Å; Y835-H1072 AromaticContact CE2-CE1 3.99Å; Y835-H1072 AromaticContact CE2-NE2 3.64Å; H1072-F1074 HydrophobicContact CB-CE1 4.25Å; H1072-I1157 HydrophobicContact CB-CD1 3.96Å
1073	C	94.8	Very high	85	Confident	0 Å²	0	10.4 Å²	10.4	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	114	-168.4	-53.6	0	0	0	0	109.9	S373 L453 G454 S458 K460 I463	S373-C1073 CarbonylContact O-C 3.57Å; S373-C1073 WeakPolarHBondContact O-CA 3.48Å; L453-C1073 WeakPolarHBondContact O-CB 3.04Å; L453-C1073 PolarHBondContact O-N 3.05Å; G454-C1073 VanDerWaalsContact CA-O 3.29Å; G454-C1073 WeakPolarHBondContact CA-O 3.42Å; S458-C1073 WeakPolarHBondContact CB-O 3.49Å; S458-C1073 WeakPolarHBondContact O-CB 3.44Å; S458-C1073 WeakPolarHBondContact OG-CB 2.96Å; S458-C1073 PolarHBondContact OG-O 3.17Å; K460-C1073 HydrophobicContact CG-CB 3.9Å; I463-C1073 VanDerWaalsContact CD1-SG 3.56Å
1074	F	93.4	Very high	84.2	Confident	2 Å²	2	14 Å²	14	1%	0.009	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	152.3	-170.8	-78.5	15.1	0	0	0	112.9	F353 I372 S373 I374 N375 H1072 I1150 Q1153 I1154 I1157	F353-F1074 HydrophobicContact CE2-CD2 4.47Å; F353-F1074 HydrophobicContact CE2-CE2 4.01Å; I372-F1074 HydrophobicContact CG2-CD2 4.41Å; S373-F1074 PolarHBondContact O-N 2.92Å; I374-F1074 HydrophobicContact CG1-CB 4.27Å; N375-F1074 PolarHBondContact N-O 3.03Å; H1072-F1074 HydrophobicContact CB-CE1 4.25Å; F1074-I1150 HydrophobicContact CB-CD1 4.39Å; F1074-I1150 HydrophobicContact CD2-CD1 4.22Å; F1074-Q1153 HydrophobicContact CD1-CB 4.15Å; F1074-Q1153 HydrophobicContact CD2-CB 4.08Å; F1074-Q1153 HydrophobicContact CE1-CB 3.98Å; F1074-Q1153 HydrophobicContact CE2-CB 3.92Å; F1074-Q1153 HydrophobicContact CG-CB 4.2Å; F1074-Q1153 HydrophobicContact CZ-CB 3.86Å; F1074-I1154 HydrophobicContact CE2-CG1 3.91Å; F1074-I1154 HydrophobicContact CZ-CG1 4.45Å; F1074-I1157 HydrophobicContact CE1-CD1 3.92Å; F1074-I1157 HydrophobicContact CE1-CG1 4.47Å; F1074-I1157 HydrophobicContact CZ-CD1 3.85Å; F1074-I1157 HydrophobicContact CZ-CG1 4.28Å
1075	L	88.5	Confident	82.9	Confident	10 Å²	10	15.6 Å²	15.6	5%	0.052	9%	0.092	C	C	.	.			trans	-95.1	124.1	172.1	-68	169	0	0	0	109	R455 G457 V1077 A1080 L1149 I1150	R455-L1075 HydrophobicContact CB-CD1 3.77Å; R455-L1075 HydrophobicContact CB-CG 4.38Å; R455-L1075 HydrophobicContact CG-CD1 4.47Å; G457-L1075 WeakPolarHBondContact O-CD2 3.43Å; L1075-V1077 VanDerWaalsContact C-N 3.34Å; L1075-A1080 HydrophobicContact CD2-CB 3.95Å; L1075-L1149 HydrophobicContact CB-CD2 3.9Å; L1075-L1149 WeakPolarHBondContact O-CD2 3.35Å; L1075-I1150 WeakPolarHBondContact O-CD1 3.06Å
1076	P	88.7	Confident	81.5	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	-66.7	-37.7	171.8	30	-37.1	0	0	0	111.1	Y357 I374 N375 M377 A1080 I1145 C1146	Y357-P1076 HydrophobicContact CE1-CB 4.16Å; Y357-P1076 HydrophobicContact CE2-CB 4.19Å; Y357-P1076 HydrophobicContact CE2-CG 4.41Å; Y357-P1076 WeakPolarHBondContact OH-CG 2.96Å; I374-P1076 HydrophobicContact CG2-CB 4.06Å; I374-P1076 HydrophobicContact CG2-CG 4.45Å; N375-P1076 WeakPolarHBondContact O-CG 3.49Å; M377-P1076 HydrophobicContact CG-CG 4.15Å; M377-P1076 HydrophobicContact SD-CG 3.75Å; P1076-A1080 HydrophobicContact CG-CB 3.86Å; P1076-I1145 HydrophobicContact CB-CG1 4.35Å; P1076-C1146 WeakPolarHBondContact O-CB 3.44Å; P1076-C1146 PolarHBondContact O-N 2.92Å
1077	V	84.5	Confident	79.6	Confident	7 Å²	7	23.6 Å²	23.6	4%	0.042	13%	0.129	C	C	.	.	S	Bend	trans	-138.1	157.7	174	-67.2	0	0	0	0	110.5	M377 L1075 T1079 A1080 R1144 C1146 L1149	M377-V1077 HydrophobicContact CE-CG2 4.16Å; M377-V1077 HydrophobicContact SD-CG2 3.71Å; L1075-V1077 VanDerWaalsContact C-N 3.34Å; V1077-T1079 PolarHBondContact O-N 3.48Å; V1077-T1079 VanDerWaalsContact O-N 3.15Å; V1077-A1080 HydrophobicContact CG2-CB 4.01Å; V1077-A1080 WeakPolarHBondContact O-CB 3.28Å; V1077-A1080 PolarHBondContact O-N 2.97Å; V1077-R1144 HydrophobicContact CG1-CB 4.02Å; V1077-R1144 HydrophobicContact CG1-CG 3.82Å; V1077-C1146 HydrophobicContact CG1-CB 4.12Å; V1077-L1149 VanDerWaalsContact C-CD2 3.4Å
1078	S	78.7	Confident	77.4	Confident	70 Å²	70	30.1 Å²	30.1	49%	0.49	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.7	-177.4	52.5	0	0	0	0	113.7
1079	T	77.4	Confident	75	Confident	22 Å²	22	32 Å²	32	14%	0.135	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	4.7	175.5	47	0	0	0	0	113.6	L520 V1077 G1081 L1082 V1139	L520-T1079 HydrophobicContact CD2-CG2 4.18Å; V1077-T1079 PolarHBondContact O-N 3.48Å; V1077-T1079 VanDerWaalsContact O-N 3.15Å; T1079-G1081 PolarHBondContact O-N 3.22Å; T1079-L1082 HydrophobicContact CG2-CD1 4.44Å; T1079-L1082 WeakPolarHBondContact O-CB 3.3Å; T1079-L1082 PolarHBondContact O-N 3.4Å; T1079-V1139 HydrophobicContact CG2-CG1 4.08Å; T1079-V1139 PolarHBondContact OG1-O 2.87Å; T1079-V1139 VanDerWaalsContact OG1-O 3.09Å
1080	A	80.9	Confident	72.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-64.9	-23.5	-173.2	0	0	0	0	0	114.2	N375 M377 L1075 P1076 V1077 L1082 C1083	N375-A1080 PolarHBondContact ND2-O 3.4Å; M377-A1080 HydrophobicContact CE-CB 4.44Å; M377-A1080 HydrophobicContact CG-CB 3.7Å; M377-A1080 HydrophobicContact SD-CB 3.47Å; M377-A1080 WeakPolarHBondContact SD-CB 3.47Å; L1075-A1080 HydrophobicContact CD2-CB 3.95Å; P1076-A1080 HydrophobicContact CG-CB 3.86Å; V1077-A1080 HydrophobicContact CG2-CB 4.01Å; V1077-A1080 WeakPolarHBondContact O-CB 3.28Å; V1077-A1080 PolarHBondContact O-N 2.97Å; A1080-L1082 PolarHBondContact O-N 2.84Å; A1080-C1083 PolarHBondContact O-N 3.48Å; A1080-C1083 PolarHBondContact O-SG 3.42Å
1081	G	75.3	Confident	69.5	Low	4 Å²	4	37 Å²	37	4%	0.041	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-72.5	0.2	170.5	0	0	0	0	0	114.7	L520 N521 T522 T1079	L520-G1081 CarbonylContact O-C 3.52Å; L520-G1081 WeakPolarHBondContact O-CA 3.32Å; N521-G1081 WeakPolarHBondContact CA-O 3.15Å; N521-G1081 PolarHBondContact OD1-O 3.03Å; T522-G1081 PolarHBondContact N-O 3.08Å; T522-G1081 VanDerWaalsContact N-O 3.12Å; T522-G1081 PolarHBondContact OG1-O 3.36Å; T1079-G1081 PolarHBondContact O-N 3.22Å
1082	L	75.6	Confident	66.6	Low	24 Å²	24	42.8 Å²	42.8	13%	0.126	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-105.3	9.4	176.4	-57.4	177.6	0	0	0	112.7	L520 T522 T1079 A1080 E1084 L1085 L1140	L520-L1082 HydrophobicContact CD2-CD1 4.39Å; T522-L1082 HydrophobicContact CG2-CD2 4.36Å; T1079-L1082 HydrophobicContact CG2-CD1 4.44Å; T1079-L1082 WeakPolarHBondContact O-CB 3.3Å; T1079-L1082 PolarHBondContact O-N 3.4Å; A1080-L1082 PolarHBondContact O-N 2.84Å; L1082-E1084 PolarHBondContact O-N 3.02Å; L1082-E1084 VanDerWaalsContact O-N 3.1Å; L1082-L1085 HydrophobicContact CB-CD1 4.25Å; L1082-L1085 HydrophobicContact CD2-CD1 4.3Å; L1082-L1085 WeakPolarHBondContact O-CB 3.32Å; L1082-L1085 PolarHBondContact O-N 2.9Å; L1082-L1140 HydrophobicContact CB-CD2 4.02Å; L1082-L1140 WeakPolarHBondContact O-CD2 3.42Å
1083	C	69.8	Low	63.8	Low	46 Å²	46	45.4 Å²	45.4	31%	0.311	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-10.7	-177.6	62.3	0	0	0	0	114.9	M377 A1080 L1085	M377-C1083 HydrophobicContact CB-CB 3.84Å; M377-C1083 HydrophobicContact CE-CB 4.33Å; M377-C1083 HydrophobicContact CG-CB 4.09Å; A1080-C1083 PolarHBondContact O-N 3.48Å; A1080-C1083 PolarHBondContact O-SG 3.42Å; C1083-L1085 VanDerWaalsContact C-N 3.31Å
1084	E	65.4	Low	61.1	Low	89 Å²	89	48.6 Å²	48.6	42%	0.416	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-7.9	172.1	-57.4	179.9	146.2	0	0	113.2	T522 L1082	T522-E1084 VanDerWaalsContact CB-OE2 3.26Å; T522-E1084 WeakPolarHBondContact CB-OE2 3.18Å; T522-E1084 HydrophobicContact CG2-CB 4.34Å; T522-E1084 PolarHBondContact OG1-OE2 2.79Å; L1082-E1084 PolarHBondContact O-N 3.02Å; L1082-E1084 VanDerWaalsContact O-N 3.1Å
1085	L	59.4	Low	58.2	Low	32 Å²	32	51.3 Å²	51.3	17%	0.168	27%	0.272	C	S	.	.	S	Bend	trans	-86.7	119.4	172.9	-59.6	179.3	0	0	0	109.6	T522 L1082 C1083 L1140	T522-L1085 HydrophobicContact CG2-CD1 4.24Å; T522-L1085 HydrophobicContact CG2-CD2 3.63Å; T522-L1085 HydrophobicContact CG2-CG 3.64Å; L1082-L1085 HydrophobicContact CB-CD1 4.25Å; L1082-L1085 HydrophobicContact CD2-CD1 4.3Å; L1082-L1085 WeakPolarHBondContact O-CB 3.32Å; L1082-L1085 PolarHBondContact O-N 2.9Å; C1083-L1085 VanDerWaalsContact C-N 3.31Å; L1085-L1140 WeakPolarHBondContact O-CD1 3.48Å
1086	N	46.9	Very low	55.5	Low	37 Å²	37	57.3 Å²	57.3	20%	0.198	30%	0.3	C	S	.	.			trans	-60.9	150.1	-177.3	-61	2.2	0	0	0	113	E1088 I1089 T2324 I2325 Q2326	N1086-E1088 PolarHBondContact O-N 2.71Å; N1086-E1088 VanDerWaalsContact O-N 3.07Å; N1086-I1089 PolarHBondContact O-N 3.41Å; N1086-T2324 WeakPolarHBondContact OD1-CG2 3.36Å; N1086-I2325 PolarHBondContact ND2-O 3.09Å; N1086-Q2326 WeakPolarHBondContact ND2-CB 3.44Å; N1086-Q2326 PolarHBondContact ND2-OE1 3.49Å
1087	E	42.6	Very low	53	Low	149 Å²	149	60 Å²	60	70%	0.696	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-15.6	-178.2	-60.3	-173.6	156.3	0	0	113.7
1088	E	36.1	Very low	50.6	Low	137 Å²	137	63.7 Å²	63.7	64%	0.64	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-16.4	-176.6	-62.8	-159.8	155.5	0	0	115.9	N1086 P1090	N1086-E1088 PolarHBondContact O-N 2.71Å; N1086-E1088 VanDerWaalsContact O-N 3.07Å; E1088-P1090 WeakPolarHBondContact O-CD 3.39Å; E1088-P1090 VanDerWaalsContact O-N 3.12Å
1089	I	39.1	Very low	48	Very low	41 Å²	41	66.9 Å²	66.9	21%	0.21	34%	0.336	C	S	.	.			trans	-70.2	109.6	-174.1	-57.4	178.2	0	0	0	109.7	N1086 Q1093 L1094	N1086-I1089 PolarHBondContact O-N 3.41Å; I1089-Q1093 HydrophobicContact CG2-CB 3.98Å; I1089-L1094 HydrophobicContact CG2-CG 4.23Å
1090	P	34.8	Very low	45.7	Very low	72 Å²	72	71.1 Å²	71.1	47%	0.468	36%	0.363	S	S	.	.			trans	-67.6	141.9	-177.1	-16.8	32.7	0	0	0	109.8	E1088 N1092 Q1093 L1094	E1088-P1090 WeakPolarHBondContact O-CD 3.39Å; E1088-P1090 VanDerWaalsContact O-N 3.12Å; P1090-N1092 PolarHBondContact O-N 2.69Å; P1090-Q1093 WeakPolarHBondContact O-CA 3.39Å; P1090-Q1093 WeakPolarHBondContact O-CB 3.33Å; P1090-Q1093 PolarHBondContact O-N 2.59Å; P1090-L1094 PolarHBondContact O-N 3.48Å
1091	I	36.9	Very low	43	Very low	33 Å²	33	76.3 Å²	76.3	17%	0.169	40%	0.4	C	S	.	.	H	α-helix	trans	-58.6	-26.7	-172.1	-58.7	170.7	0	0	0	113	Q1093 L1094 M1095 L1126 M1130 K1136	I1091-Q1093 VanDerWaalsContact C-N 3.28Å; I1091-Q1093 PolarHBondContact O-N 2.89Å; I1091-L1094 WeakPolarHBondContact O-CB 3.48Å; I1091-L1094 PolarHBondContact O-N 3.34Å; I1091-L1094 VanDerWaalsContact O-N 3.1Å; I1091-M1095 WeakPolarHBondContact O-CG 3.25Å; I1091-M1095 PolarHBondContact O-N 2.7Å; I1091-L1126 HydrophobicContact CG2-CD2 4.01Å; I1091-M1130 HydrophobicContact CD1-SD 4.49Å; I1091-M1130 HydrophobicContact CG2-CE 4.21Å; I1091-M1130 HydrophobicContact CG2-CG 4.48Å; I1091-M1130 HydrophobicContact CG2-SD 3.62Å; I1091-K1136 HydrophobicContact CD1-CB 4.04Å; I1091-K1136 HydrophobicContact CD1-CG 4.33Å; I1091-K1136 WeakPolarHBondContact CD1-O 3.37Å
1092	N	35.1	Very low	40.6	Very low	122 Å²	122	83.9 Å²	83.9	65%	0.652	44%	0.44	S	S	*	.	H	α-helix	trans	-59.9	-36.3	171.4	-68.8	3.1	0	0	0	112.5	P1090 M1095 Q1096	P1090-N1092 PolarHBondContact O-N 2.69Å; N1092-M1095 WeakPolarHBondContact O-CB 3.15Å; N1092-M1095 PolarHBondContact O-N 2.86Å; N1092-Q1096 WeakPolarHBondContact O-CG 3.47Å; N1092-Q1096 PolarHBondContact O-N 3.34Å
1093	Q	36.3	Very low	38.2	Very low	57 Å²	57	88.1 Å²	88.1	27%	0.266	46%	0.462	S	S	.	.	H	α-helix	trans	-69.5	-32.8	174.1	-69.2	-171	-7.3	0	0	112.4	R614 I1089 P1090 I1091 M1095 Q1096 I1097	R614-Q1093 PolarHBondContact NH2-O 3.33Å; I1089-Q1093 HydrophobicContact CG2-CB 3.98Å; P1090-Q1093 WeakPolarHBondContact O-CA 3.39Å; P1090-Q1093 WeakPolarHBondContact O-CB 3.33Å; P1090-Q1093 PolarHBondContact O-N 2.59Å; I1091-Q1093 VanDerWaalsContact C-N 3.28Å; I1091-Q1093 PolarHBondContact O-N 2.89Å; Q1093-M1095 VanDerWaalsContact C-N 3.34Å; Q1093-Q1096 CarbonylContact O-C 3.02Å; Q1093-Q1096 PolarHBondContact O-N 2.87Å; Q1093-I1097 WeakPolarHBondContact O-CG1 3.23Å; Q1093-I1097 PolarHBondContact O-N 3.25Å; Q1093-I1097 VanDerWaalsContact O-N 3.07Å
1094	L	36.8	Very low	36.1	Very low	66 Å²	66	96 Å²	96	35%	0.346	49%	0.485	S	S	.	.	H	α-helix	trans	-65.1	-36.4	171.7	-81.3	163.5	0	0	0	111.8	I1089 P1090 I1091 Q1096 I1097 L1126	I1089-L1094 HydrophobicContact CG2-CG 4.23Å; P1090-L1094 PolarHBondContact O-N 3.48Å; I1091-L1094 WeakPolarHBondContact O-CB 3.48Å; I1091-L1094 PolarHBondContact O-N 3.34Å; I1091-L1094 VanDerWaalsContact O-N 3.1Å; L1094-Q1096 VanDerWaalsContact C-N 3.32Å; L1094-I1097 HydrophobicContact CD2-CD1 4.25Å; L1094-L1126 HydrophobicContact CB-CD1 4.26Å
1095	M	32.7	Very low	34.1	Very low	59 Å²	59	100.1 Å²	100.1	29%	0.291	51%	0.509	S	S	.	.	H	α-helix	trans	-66.2	-34.6	171.4	-58.9	-101.5	-73.2	0	0	111.7	I1091 N1092 Q1093 L1126 M1130	I1091-M1095 WeakPolarHBondContact O-CG 3.25Å; I1091-M1095 PolarHBondContact O-N 2.7Å; N1092-M1095 WeakPolarHBondContact O-CB 3.15Å; N1092-M1095 PolarHBondContact O-N 2.86Å; Q1093-M1095 VanDerWaalsContact C-N 3.34Å; M1095-L1126 HydrophobicContact CG-CD1 4.21Å; M1095-L1126 HydrophobicContact SD-CB 3.81Å; M1095-L1126 HydrophobicContact SD-CD1 4.21Å; M1095-M1130 HydrophobicContact SD-CE 4Å
1096	Q	33.5	Very low	32.5	Very low	137 Å²	137	104.5 Å²	104.5	64%	0.64	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	8.2	-179	-69.8	176.2	-22.5	0	0	115.2	R614 N1092 Q1093 L1094	R614-Q1096 VanDerWaalsContact NH2-C 3.27Å; R614-Q1096 PolarHBondContact NH2-O 3Å; N1092-Q1096 WeakPolarHBondContact O-CG 3.47Å; N1092-Q1096 PolarHBondContact O-N 3.34Å; Q1093-Q1096 CarbonylContact O-C 3.02Å; Q1093-Q1096 PolarHBondContact O-N 2.87Å; L1094-Q1096 VanDerWaalsContact C-N 3.32Å
1097	I	35.5	Very low	31.6	Very low	55 Å²	55	110.4 Å²	110.4	28%	0.282	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.9	-25.7	176.3	-86.3	169.5	0	0	0	112	Q1093 L1094	Q1093-I1097 WeakPolarHBondContact O-CG1 3.23Å; Q1093-I1097 PolarHBondContact O-N 3.25Å; Q1093-I1097 VanDerWaalsContact O-N 3.07Å; L1094-I1097 HydrophobicContact CD2-CD1 4.25Å
1098	N	32.9	Very low	30.9	Very low	85 Å²	85	111 Å²	111	46%	0.455	58%	0.578	S	S	.	*	S	Bend	trans	-128.3	19.4	-159.1	-96.3	-11.4	0	0	0	116.3	G575	G575-N1098 WeakPolarHBondContact CA-ND2 3.36Å; G575-N1098 PolarHBondContact O-ND2 3.38Å
1099	Y	25.4	Very low	30.5	Very low	137 Å²	137	111.1 Å²	111.1	54%	0.537	58%	0.582	S	S	.	*			trans	-129.7	120.6	174.6	-74.3	-73.9	0	0	0	112.2	S1122	Y1099-S1122 WeakPolarHBondContact OH-CB 3.27Å
1100	P	28.4	Very low	29.9	Very low	111 Å²	111	115.2 Å²	115.2	72%	0.721	61%	0.605	S	S	*	*			trans	-67.5	143.9	159.2	31.4	-32.4	0	0	0	108.9
1101	S	24.5	Very low	29.7	Very low	110 Å²	110	120.9 Å²	120.9	77%	0.769	62%	0.624	S	S	*	*			trans	-75.2	133.6	169.1	-61.7	0	0	0	0	109	D1103	S1101-D1103 PolarHBondContact O-N 2.94Å
1102	N	24.4	Very low	29.1	Very low	163 Å²	163	126 Å²	126	87%	0.872	65%	0.651	S	S	*	*			trans	-71.3	96.9	172.8	-82	-11.3	0	0	0	109.7
1103	D	25.6	Very low	28.8	Very low	113 Å²	113	127.9 Å²	127.9	60%	0.604	66%	0.661	S	S	*	*			trans	-140.7	108.3	166.9	-98.8	-54.2	0	0	0	112.2	S1101	S1101-D1103 PolarHBondContact O-N 2.94Å
1104	R	25	Very low	28.2	Very low	210 Å²	210	132 Å²	132	79%	0.792	69%	0.685	S	S	*	*			trans	66.9	73.8	140.3	-56.4	173.5	-148.3	-142.6	-2.1	119.9
1105	L	24.4	Very low	27.7	Very low	176 Å²	176	136.3 Å²	136.3	92%	0.921	71%	0.708	S	S	*	*	S	Bend		-130.8	130.4	119.8	-66.5	173.4	0	0	0	105.8
1106	T	26.6	Very low	27.5	Very low	125 Å²	125	141.6 Å²	141.6	77%	0.767	74%	0.738	S	S	*	*			cis	-125.8	172	11.1	51.4	0	0	0	0	111.9
1107	N	27.4	Very low	27.1	Very low	161 Å²	161	142.2 Å²	142.2	86%	0.861	74%	0.744	S	S	*	*			trans	-155.5	88.6	165.3	-119.8	5.3	0	0	0	109.8
1108	D	27.9	Very low	26.7	Very low	162 Å²	162	146.4 Å²	146.4	87%	0.866	77%	0.767	S	S	*	*			trans	-112.6	107.9	157.5	-82.6	-47.7	0	0	0	107.4
1109	D	27.5	Very low	26.3	Very low	138 Å²	138	150.9 Å²	150.9	74%	0.738	78%	0.784	S	S	*	*			trans	37.6	121.7	156.8	-85.2	13.1	0	0	0	123.2
1110	N	27.1	Very low	26.4	Very low	127 Å²	127	151.3 Å²	151.3	68%	0.679	80%	0.796	S	S	*	*			trans	66.1	95.8	138.2	-62.3	-52.3	0	0	0	119.8
1111	H	29.9	Very low	26.3	Very low	191 Å²	191	150.9 Å²	150.9	88%	0.884	79%	0.792	S	S	*	*				-163.5	155.9	97.8	-112.1	-81.1	0	0	0	113.8
1112	I	25.4	Very low	26.5	Very low	140 Å²	140	149.3 Å²	149.3	72%	0.718	78%	0.781	S	S	*	*			trans	-85.4	133.9	-171.4	-64	160.1	0	0	0	112.5
1113	N	27.2	Very low	26.9	Very low	162 Å²	162	145.8 Å²	145.8	87%	0.866	76%	0.762	S	S	*	*			trans	-157	124.4	135.7	-110.3	-28.7	0	0	0	112
1114	N	25	Very low	27.5	Very low	143 Å²	143	143.4 Å²	143.4	77%	0.765	75%	0.754	S	S	*	*			trans	-89.5	112.3	176.6	-74.9	-32.9	0	0	0	110.2
1115	N	25.5	Very low	28.2	Very low	158 Å²	158	137.8 Å²	137.8	85%	0.845	74%	0.736	S	S	*	*			trans	-179.2	99.3	147.7	-93.5	-27.3	0	0	0	109.6
1116	D	28	Very low	28.8	Very low	170 Å²	170	131.8 Å²	131.8	91%	0.909	70%	0.704	S	S	*	*			trans	-168.2	117.7	135.7	-101.7	-25.1	0	0	0	110.1
1117	I	26.1	Very low	29.4	Very low	149 Å²	149	131.4 Å²	131.4	76%	0.764	69%	0.692	S	S	*	*			trans	-121.1	135.4	173.2	-59.5	177	0	0	0	106.6
1118	N	25.7	Very low	29.9	Very low	144 Å²	144	127.8 Å²	127.8	77%	0.77	67%	0.67	S	S	*	*			trans	79.7	94.1	-176.4	-43.9	-72.4	0	0	0	115.8
1119	H	25.8	Very low	30.3	Very low	178 Å²	178	123.4 Å²	123.4	82%	0.824	65%	0.646	S	S	*	*			trans	-156.9	110.4	134.1	-102.3	-69.7	0	0	0	109.9
1120	N	26.2	Very low	30.8	Very low	147 Å²	147	119.5 Å²	119.5	79%	0.786	62%	0.624	S	S	*	*			trans	-147.5	69.8	180	-134.1	-16.6	0	0	0	110
1121	T	26.9	Very low	31.4	Very low	101 Å²	101	121 Å²	121	62%	0.62	62%	0.624	S	S	*	*			trans	-98.6	11.7	-162	33.9	0	0	0	0	115.5
1122	S	29.7	Very low	31.6	Very low	77 Å²	77	118.5 Å²	118.5	54%	0.538	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.3	-11.5	-173	-47.4	0	0	0	0	115.9	Y1099 S1124	Y1099-S1122 WeakPolarHBondContact OH-CB 3.27Å; S1122-S1124 PolarHBondContact O-N 3.17Å
1123	N	31.4	Very low	32.2	Very low	90 Å²	90	116.5 Å²	116.5	48%	0.481	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.6	3.7	-171.4	-78.8	-38.2	0	0	0	115.9	F1125 F1127	N1123-F1125 PolarHBondContact O-N 3.45Å; N1123-F1127 WeakPolarHBondContact O-CB 3.49Å
1124	S	38.3	Very low	32.6	Very low	63 Å²	63	113.5 Å²	113.5	44%	0.441	58%	0.581	S	S	.	*	H	α-helix	trans	-62.1	-44.3	-167.7	-161.6	0	0	0	0	114.9	S1122 F1127 E1128	S1122-S1124 PolarHBondContact O-N 3.17Å; S1124-F1127 CarbonylContact O-C 3.51Å; S1124-F1127 WeakPolarHBondContact O-CB 3.28Å; S1124-F1127 PolarHBondContact O-N 3.09Å; S1124-E1128 PolarHBondContact O-N 2.98Å; S1124-E1128 PolarHBondContact OG-OE2 2.9Å
1125	F	39.4	Very low	33	Very low	92 Å²	92	111.8 Å²	111.8	40%	0.404	57%	0.572	S	S	.	*	H	α-helix	trans	-64.8	-51.9	-161.8	178.4	-108.8	0	0	0	114.6	N1123 F1127 E1128 L1129	N1123-F1125 PolarHBondContact O-N 3.45Å; F1125-F1127 VanDerWaalsContact C-N 3.25Å; F1125-F1127 PolarHBondContact O-N 2.82Å; F1125-E1128 PolarHBondContact O-N 2.85Å; F1125-L1129 HydrophobicContact CD1-CD1 4.46Å; F1125-L1129 HydrophobicContact CE1-CD1 3.83Å; F1125-L1129 HydrophobicContact CE2-CD1 4.23Å; F1125-L1129 HydrophobicContact CZ-CD1 3.7Å; F1125-L1129 PolarHBondContact O-N 3.31Å; F1125-L1129 VanDerWaalsContact O-N 3.08Å
1126	L	38.6	Very low	33.5	Very low	50 Å²	50	112.2 Å²	112.2	26%	0.262	57%	0.566	S	S	.	*	H	α-helix	trans	-69	-29.8	177.9	-126.2	166.4	0	0	0	110.8	I1091 L1094 M1095 L1129 M1130	I1091-L1126 HydrophobicContact CG2-CD2 4.01Å; L1094-L1126 HydrophobicContact CB-CD1 4.26Å; M1095-L1126 HydrophobicContact CG-CD1 4.21Å; M1095-L1126 HydrophobicContact SD-CB 3.81Å; M1095-L1126 HydrophobicContact SD-CD1 4.21Å; L1126-L1129 PolarHBondContact O-N 2.98Å; L1126-M1130 HydrophobicContact CB-CE 4.46Å; L1126-M1130 HydrophobicContact CD2-CE 4.18Å; L1126-M1130 HydrophobicContact CD2-CG 4.37Å; L1126-M1130 WeakPolarHBondContact O-CB 3.48Å; L1126-M1130 WeakPolarHBondContact O-CE 3.43Å; L1126-M1130 WeakPolarHBondContact O-CG 3.3Å; L1126-M1130 PolarHBondContact O-N 2.88Å
1127	F	38.3	Very low	34.1	Very low	116 Å²	116	111.1 Å²	111.1	51%	0.509	56%	0.56	S	S	.	*	H	α-helix	trans	-71.1	-34	175.7	-156.8	-100.5	0	0	0	113	N1123 S1124 F1125 M1130 K1131	N1123-F1127 WeakPolarHBondContact O-CB 3.49Å; S1124-F1127 CarbonylContact O-C 3.51Å; S1124-F1127 WeakPolarHBondContact O-CB 3.28Å; S1124-F1127 PolarHBondContact O-N 3.09Å; F1125-F1127 VanDerWaalsContact C-N 3.25Å; F1125-F1127 PolarHBondContact O-N 2.82Å; F1127-M1130 HydrophobicContact CD2-CE 4.38Å; F1127-K1131 HydrophobicContact CD1-CD 4.4Å; F1127-K1131 HydrophobicContact CE1-CD 4.43Å; F1127-K1131 WeakPolarHBondContact O-CB 3.47Å; F1127-K1131 WeakPolarHBondContact O-CG 3.43Å; F1127-K1131 PolarHBondContact O-N 3.19Å
1128	E	38	Very low	34.7	Very low	86 Å²	86	106.5 Å²	106.5	40%	0.402	54%	0.537	S	S	.	.	H	α-helix	trans	-71.4	-39.1	171.1	-78.7	-178.4	89	0	0	112.3	S1124 F1125 K1131 R1132	S1124-E1128 PolarHBondContact O-N 2.98Å; S1124-E1128 PolarHBondContact OG-OE2 2.9Å; F1125-E1128 PolarHBondContact O-N 2.85Å; E1128-K1131 PolarHBondContact O-N 3.02Å; E1128-R1132 PolarHBondContact O-N 3.49Å
1129	L	36.8	Very low	35.8	Very low	70 Å²	70	102.6 Å²	102.6	37%	0.366	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-44	172.3	-96.7	163.5	0	0	0	111.6	F1125 L1126 R1132 Y1133	F1125-L1129 HydrophobicContact CD1-CD1 4.46Å; F1125-L1129 HydrophobicContact CE1-CD1 3.83Å; F1125-L1129 HydrophobicContact CE2-CD1 4.23Å; F1125-L1129 HydrophobicContact CZ-CD1 3.7Å; F1125-L1129 PolarHBondContact O-N 3.31Å; F1125-L1129 VanDerWaalsContact O-N 3.08Å; L1126-L1129 PolarHBondContact O-N 2.98Å; L1129-R1132 PolarHBondContact O-N 3.22Å; L1129-Y1133 HydrophobicContact CD2-CD2 4.24Å; L1129-Y1133 HydrophobicContact CD2-CE2 4.09Å; L1129-Y1133 PolarHBondContact O-N 3.13Å
1130	M	37.4	Very low	37	Very low	55 Å²	55	96 Å²	96	27%	0.271	49%	0.489	S	S	.	.	H	α-helix	trans	-64.6	-37.6	172.1	-75.4	-173.5	-78	0	0	112.5	I1091 M1095 L1126 F1127 R1132 Y1133 P1134	I1091-M1130 HydrophobicContact CD1-SD 4.49Å; I1091-M1130 HydrophobicContact CG2-CE 4.21Å; I1091-M1130 HydrophobicContact CG2-CG 4.48Å; I1091-M1130 HydrophobicContact CG2-SD 3.62Å; M1095-M1130 HydrophobicContact SD-CE 4Å; L1126-M1130 HydrophobicContact CB-CE 4.46Å; L1126-M1130 HydrophobicContact CD2-CE 4.18Å; L1126-M1130 HydrophobicContact CD2-CG 4.37Å; L1126-M1130 WeakPolarHBondContact O-CB 3.48Å; L1126-M1130 WeakPolarHBondContact O-CE 3.43Å; L1126-M1130 WeakPolarHBondContact O-CG 3.3Å; L1126-M1130 PolarHBondContact O-N 2.88Å; F1127-M1130 HydrophobicContact CD2-CE 4.38Å; M1130-R1132 VanDerWaalsContact C-N 3.28Å; M1130-R1132 PolarHBondContact O-N 3.3Å; M1130-Y1133 CarbonylContact O-C 3.56Å; M1130-Y1133 PolarHBondContact O-N 3.39Å; M1130-Y1133 VanDerWaalsContact O-N 3.16Å; M1130-P1134 WeakPolarHBondContact O-CA 3.4Å; M1130-P1134 VanDerWaalsContact O-N 3.17Å
1131	K	39.6	Very low	38.3	Very low	158 Å²	158	90.5 Å²	90.5	69%	0.687	46%	0.462	S	S	*	.	H	α-helix	trans	-63.4	-30.9	173.7	-91	-176	170.6	179.6	0	113.4	F1127 E1128	F1127-K1131 HydrophobicContact CD1-CD 4.4Å; F1127-K1131 HydrophobicContact CE1-CD 4.43Å; F1127-K1131 WeakPolarHBondContact O-CB 3.47Å; F1127-K1131 WeakPolarHBondContact O-CG 3.43Å; F1127-K1131 PolarHBondContact O-N 3.19Å; E1128-K1131 PolarHBondContact O-N 3.02Å
1132	R	35	Very low	39.8	Very low	140 Å²	140	86.1 Å²	86.1	53%	0.528	44%	0.435	S	S	.	.	H	α-helix	trans	-79.5	-26.7	172.6	-75.4	-174.5	176.3	161.4	4	113.1	E1128 L1129 M1130	E1128-R1132 PolarHBondContact O-N 3.49Å; L1129-R1132 PolarHBondContact O-N 3.22Å; M1130-R1132 VanDerWaalsContact C-N 3.28Å; M1130-R1132 PolarHBondContact O-N 3.3Å
1133	Y	37.8	Very low	41.3	Very low	97 Å²	97	82.5 Å²	82.5	38%	0.38	41%	0.41	S	S	.	.			trans	-134.5	78.2	-178.2	-52.2	-56.7	0	0	0	110.8	L1129 M1130 N1135	L1129-Y1133 HydrophobicContact CD2-CD2 4.24Å; L1129-Y1133 HydrophobicContact CD2-CE2 4.09Å; L1129-Y1133 PolarHBondContact O-N 3.13Å; M1130-Y1133 CarbonylContact O-C 3.56Å; M1130-Y1133 PolarHBondContact O-N 3.39Å; M1130-Y1133 VanDerWaalsContact O-N 3.16Å; Y1133-N1135 VanDerWaalsContact C-N 3.25Å; Y1133-N1135 PolarHBondContact O-N 3.49Å
1134	P	34.6	Very low	43.1	Very low	99 Å²	99	79.3 Å²	79.3	64%	0.643	39%	0.391	S	S	*	.			trans	-69.7	-15.7	-168.4	26	-35.4	0	0	0	115.1	M1130	M1130-P1134 WeakPolarHBondContact O-CA 3.4Å; M1130-P1134 VanDerWaalsContact O-N 3.17Å
1135	N	35	Very low	45.1	Very low	108 Å²	108	76.3 Å²	76.3	58%	0.578	37%	0.37	S	S	*	.	S	Bend	trans	-88.1	116.8	-179.4	-67.9	-11.9	0	0	0	110.7	Y1133 N1137 L1138	Y1133-N1135 VanDerWaalsContact C-N 3.25Å; Y1133-N1135 PolarHBondContact O-N 3.49Å; N1135-N1137 PolarHBondContact O-N 3.48Å; N1135-L1138 HydrophobicContact CB-CD1 3.57Å; N1135-L1138 HydrophobicContact CB-CG 3.77Å; N1135-L1138 PolarHBondContact O-N 3.05Å
1136	K	35	Very low	47.3	Very low	167 Å²	167	74.3 Å²	74.3	73%	0.726	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-13.8	-163.2	-63.3	175.2	-179	174.1	0	116	I1091	I1091-K1136 HydrophobicContact CD1-CB 4.04Å; I1091-K1136 HydrophobicContact CD1-CG 4.33Å; I1091-K1136 WeakPolarHBondContact CD1-O 3.37Å
1137	N	40.2	Very low	49.4	Very low	147 Å²	147	73 Å²	73	79%	0.786	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	2.7	-175	-57.8	21.7	0	0	0	113.1	N1135	N1135-N1137 PolarHBondContact O-N 3.48Å
1138	L	39.7	Very low	51.5	Low	52 Å²	52	70.6 Å²	70.6	27%	0.272	35%	0.354	S	S	.	.			trans	-92.6	6.3	-165.8	-64.6	-169.7	0	0	0	116.8	F117 N1135 R1144	F117-L1138 HydrophobicContact CD1-CD2 4.4Å; F117-L1138 HydrophobicContact CE1-CB 3.79Å; F117-L1138 HydrophobicContact CE1-CD1 4.11Å; F117-L1138 HydrophobicContact CE1-CD2 3.82Å; F117-L1138 HydrophobicContact CE1-CG 4.11Å; F117-L1138 HydrophobicContact CE2-CD1 4.09Å; F117-L1138 HydrophobicContact CZ-CB 3.75Å; F117-L1138 HydrophobicContact CZ-CD1 3.57Å; F117-L1138 HydrophobicContact CZ-CD2 4.16Å; F117-L1138 HydrophobicContact CZ-CG 4.04Å; N1135-L1138 HydrophobicContact CB-CD1 3.57Å; N1135-L1138 HydrophobicContact CB-CG 3.77Å; N1135-L1138 PolarHBondContact O-N 3.05Å; L1138-R1144 PolarHBondContact O-NH1 3.31Å; L1138-R1144 VanDerWaalsContact O-NH1 3.08Å
1139	V	48.4	Very low	53.7	Low	62 Å²	62	67 Å²	67	38%	0.376	34%	0.337	S	S	.	.	S	Bend	trans	-87.5	-30.1	-170.7	-177.5	0	0	0	0	113.4	T1079	T1079-V1139 HydrophobicContact CG2-CG1 4.08Å; T1079-V1139 PolarHBondContact OG1-O 2.87Å; T1079-V1139 VanDerWaalsContact OG1-O 3.09Å
1140	L	50.3	Low	56.2	Low	39 Å²	39	63.7 Å²	63.7	20%	0.204	32%	0.319	C	S	.	.	S	Bend	trans	-115.2	-1.4	-171.3	-70.1	168.1	0	0	0	114.5	M377 L1082 L1085 P1142	M377-L1140 VanDerWaalsContact CE-O 3.29Å; M377-L1140 WeakPolarHBondContact CE-O 3.48Å; L1082-L1140 HydrophobicContact CB-CD2 4.02Å; L1082-L1140 WeakPolarHBondContact O-CD2 3.42Å; L1085-L1140 WeakPolarHBondContact O-CD1 3.48Å; L1140-P1142 WeakPolarHBondContact O-CD 3.39Å; L1140-P1142 VanDerWaalsContact O-N 3.14Å
1141	S	53.8	Low	58.5	Low	32 Å²	32	62 Å²	62	22%	0.224	31%	0.31	C	S	.	.			trans	-56.5	118.5	-177.2	-177.6	0	0	0	0	111.8	A1143 R1144	S1141-A1143 PolarHBondContact O-N 2.74Å; S1141-R1144 WeakPolarHBondContact O-CB 3.36Å; S1141-R1144 PolarHBondContact O-N 2.99Å; S1141-R1144 VanDerWaalsContact O-N 3.14Å
1142	P	58.3	Low	60.6	Low	8 Å²	8	55.5 Å²	55.5	5%	0.052	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	0.2	179.8	31.9	-37.9	0	0	0	112.9	R109 Y357 M377 M378 L1140 R1144	R109-P1142 PolarHBondContact NH2-O 3.18Å; Y357-P1142 PolarHBondContact OH-O 3.32Å; M377-P1142 HydrophobicContact CB-CB 3.7Å; M378-P1142 HydrophobicContact CB-CB 4.42Å; M378-P1142 HydrophobicContact CE-CB 3.7Å; M378-P1142 HydrophobicContact CE-CG 3.46Å; M378-P1142 VanDerWaalsContact CE-CG 3.46Å; L1140-P1142 WeakPolarHBondContact O-CD 3.39Å; L1140-P1142 VanDerWaalsContact O-N 3.14Å; P1142-R1144 VanDerWaalsContact C-N 3.32Å
1143	A	61.5	Low	63.2	Low	2 Å²	2	48.9 Å²	48.9	2%	0.017	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.7	171.8	0	0	0	0	0	113.3	I118 E120 S1141	I118-A1143 HydrophobicContact CB-CB 4.35Å; I118-A1143 WeakPolarHBondContact CB-O 3.37Å; I118-A1143 WeakPolarHBondContact CG1-O 3.37Å; I118-A1143 PolarHBondContact N-O 3.4Å; I118-A1143 WeakPolarHBondContact O-CB 3.18Å; E120-A1143 HydrophobicContact CB-CB 4.43Å; E120-A1143 HydrophobicContact CG-CB 3.64Å; E120-A1143 WeakPolarHBondContact OE1-CB 3.08Å; S1141-A1143 PolarHBondContact O-N 2.74Å
1144	R	68.8	Low	65.7	Low	22 Å²	22	44.3 Å²	44.3	8%	0.083	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-98.2	134.3	-168.8	-161.4	-179.7	-173.8	177.9	-2.4	112.3	G116 F117 V1077 L1138 S1141 P1142	G116-R1144 WeakPolarHBondContact O-CA 3.38Å; F117-R1144 HydrophobicContact CD1-CB 4.2Å; F117-R1144 HydrophobicContact CD1-CG 3.84Å; F117-R1144 HydrophobicContact CE1-CB 4.47Å; F117-R1144 HydrophobicContact CE1-CG 3.92Å; F117-R1144 HydrophobicContact CG-CG 4.35Å; F117-R1144 HydrophobicContact CZ-CG 4.48Å; F117-R1144 VanDerWaalsContact CZ-NE 3.27Å; V1077-R1144 HydrophobicContact CG1-CB 4.02Å; V1077-R1144 HydrophobicContact CG1-CG 3.82Å; L1138-R1144 PolarHBondContact O-NH1 3.31Å; L1138-R1144 VanDerWaalsContact O-NH1 3.08Å; S1141-R1144 WeakPolarHBondContact O-CB 3.36Å; S1141-R1144 PolarHBondContact O-N 2.99Å; S1141-R1144 VanDerWaalsContact O-N 3.14Å; P1142-R1144 VanDerWaalsContact C-N 3.32Å
1145	I	81.3	Confident	68	Low	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.238	C	C	.	.			trans	-134.8	121.2	174.9	-170.1	160.8	0	0	0	111.5	L112 G116 I118 I354 Y357 P1076 V1147 I1150	L112-I1145 HydrophobicContact CD1-CG2 3.79Å; G116-I1145 PolarHBondContact O-N 2.91Å; I118-I1145 HydrophobicContact CD1-CG2 4.27Å; I118-I1145 HydrophobicContact CG1-CG2 4.45Å; I354-I1145 HydrophobicContact CG1-CD1 4.04Å; I354-I1145 HydrophobicContact CG1-CG1 4.5Å; I354-I1145 HydrophobicContact CG1-CG2 4.15Å; Y357-I1145 HydrophobicContact CD1-CB 4.36Å; Y357-I1145 HydrophobicContact CD1-CD1 4.02Å; Y357-I1145 HydrophobicContact CE1-CB 4.47Å; Y357-I1145 HydrophobicContact CG-CD1 4.18Å; P1076-I1145 HydrophobicContact CB-CG1 4.35Å; I1145-V1147 PolarHBondContact O-N 2.84Å; I1145-I1150 HydrophobicContact CD1-CD1 4.4Å; I1145-I1150 HydrophobicContact CD1-CG1 4.08Å; I1145-I1150 HydrophobicContact CG1-CG1 3.91Å
1146	C	84.4	Confident	70.1	Confident	50 Å²	50	41.4 Å²	41.4	34%	0.338	21%	0.212	S	C	.	.			trans	-87.4	99.3	179.2	-179.7	0	0	0	0	109.7	P1076 V1077 N1148 L1149 I1150	P1076-C1146 WeakPolarHBondContact O-CB 3.44Å; P1076-C1146 PolarHBondContact O-N 2.92Å; V1077-C1146 HydrophobicContact CG1-CB 4.12Å; C1146-N1148 VanDerWaalsContact C-N 3.25Å; C1146-N1148 PolarHBondContact O-N 2.93Å; C1146-L1149 HydrophobicContact CB-CB 3.86Å; C1146-L1149 WeakPolarHBondContact O-CB 3.47Å; C1146-L1149 PolarHBondContact O-N 3.38Å; C1146-I1150 PolarHBondContact O-N 2.84Å; C1146-I1150 VanDerWaalsContact O-N 3.1Å
1147	V	83.4	Confident	72.4	Confident	22 Å²	22	33.6 Å²	33.6	13%	0.133	18%	0.178	C	C	.	.	H	α-helix	trans	-48.5	-47.3	-179.6	-172.1	0	0	0	0	111.7	Y292 T350 I354 I1145 L1149 I1150 R1151	Y292-V1147 HydrophobicContact CD1-CG1 3.97Å; Y292-V1147 HydrophobicContact CE1-CG1 3.84Å; T350-V1147 HydrophobicContact CG2-CG1 3.88Å; I354-V1147 HydrophobicContact CD1-CG2 4.03Å; I1145-V1147 PolarHBondContact O-N 2.84Å; V1147-L1149 VanDerWaalsContact C-N 3.35Å; V1147-L1149 PolarHBondContact O-N 3.09Å; V1147-I1150 PolarHBondContact O-N 2.93Å; V1147-R1151 HydrophobicContact CG1-CG 4.41Å; V1147-R1151 WeakPolarHBondContact O-CB 3.46Å; V1147-R1151 VanDerWaalsContact O-CG 3.23Å; V1147-R1151 WeakPolarHBondContact O-CG 3.38Å; V1147-R1151 PolarHBondContact O-N 3.37Å
1148	N	82.5	Confident	74.4	Confident	67 Å²	67	27.1 Å²	27.1	36%	0.358	14%	0.143	S	C	.	.	H	α-helix	trans	-66.5	-29.8	179.9	-80.2	-6.3	0	0	0	114.3	K289 C1146 A1152	K289-N1148 PolarHBondContact O-ND2 3.27Å; C1146-N1148 VanDerWaalsContact C-N 3.25Å; C1146-N1148 PolarHBondContact O-N 2.93Å; N1148-A1152 WeakPolarHBondContact O-CB 3.48Å; N1148-A1152 PolarHBondContact O-N 3.49Å; N1148-A1152 VanDerWaalsContact O-N 3.13Å
1149	L	84.7	Confident	76.7	Confident	10 Å²	10	24.7 Å²	24.7	5%	0.052	13%	0.13	C	C	.	.	H	α-helix	trans	-71.8	-47.6	174.8	176.7	59.7	0	0	0	110.6	R455 T961 L1075 V1077 C1146 V1147 R1151 A1152 Q1153	R455-L1149 VanDerWaalsContact NH1-CD1 3.31Å; T961-L1149 HydrophobicContact CG2-CD1 4.11Å; L1075-L1149 HydrophobicContact CB-CD2 3.9Å; L1075-L1149 WeakPolarHBondContact O-CD2 3.35Å; V1077-L1149 VanDerWaalsContact C-CD2 3.4Å; C1146-L1149 HydrophobicContact CB-CB 3.86Å; C1146-L1149 WeakPolarHBondContact O-CB 3.47Å; C1146-L1149 PolarHBondContact O-N 3.38Å; V1147-L1149 VanDerWaalsContact C-N 3.35Å; V1147-L1149 PolarHBondContact O-N 3.09Å; L1149-R1151 PolarHBondContact O-N 3.22Å; L1149-A1152 PolarHBondContact O-N 2.9Å; L1149-Q1153 HydrophobicContact CD1-CG 4.39Å; L1149-Q1153 WeakPolarHBondContact O-CG 3.33Å; L1149-Q1153 PolarHBondContact O-N 3.25Å
1150	I	88.2	Confident	78.5	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59	-48	176.9	-65.2	-65.6	0	0	0	110.5	T350 F353 F1074 L1075 I1145 C1146 V1147 A1152 Q1153 I1154	T350-I1150 HydrophobicContact CG2-CG2 4.11Å; F353-I1150 HydrophobicContact CD2-CG2 3.92Å; F1074-I1150 HydrophobicContact CB-CD1 4.39Å; F1074-I1150 HydrophobicContact CD2-CD1 4.22Å; L1075-I1150 WeakPolarHBondContact O-CD1 3.06Å; I1145-I1150 HydrophobicContact CD1-CD1 4.4Å; I1145-I1150 HydrophobicContact CD1-CG1 4.08Å; I1145-I1150 HydrophobicContact CG1-CG1 3.91Å; C1146-I1150 PolarHBondContact O-N 2.84Å; C1146-I1150 VanDerWaalsContact O-N 3.1Å; V1147-I1150 PolarHBondContact O-N 2.93Å; I1150-A1152 VanDerWaalsContact C-N 3.34Å; I1150-A1152 PolarHBondContact O-N 3.48Å; I1150-Q1153 PolarHBondContact O-N 2.93Å; I1150-Q1153 VanDerWaalsContact O-N 3.09Å; I1150-I1154 HydrophobicContact CG2-CD1 3.85Å; I1150-I1154 HydrophobicContact CG2-CG1 4.39Å; I1150-I1154 WeakPolarHBondContact O-CG1 3.35Å; I1150-I1154 PolarHBondContact O-N 2.87Å
1151	R	86.7	Confident	80	Confident	20 Å²	20	23.5 Å²	23.5	8%	0.075	12%	0.122	C	C	.	.	H	α-helix	trans	-53.6	-47.2	174	-75	178.2	73.1	175.3	15.3	112.5	F288 G291 E346 T350 V1147 L1149 Q1153 I1154 R1155	F288-R1151 PolarHBondContact O-NH1 2.91Å; F288-R1151 VanDerWaalsContact O-NH1 3.1Å; G291-R1151 PolarHBondContact O-NH1 3.48Å; E346-R1151 HydrophobicContact CG-CG 4.38Å; E346-R1151 WeakPolarHBondContact OE1-CB 3.4Å; E346-R1151 WeakPolarHBondContact OE1-CG 3.49Å; E346-R1151 IonicContact OE1-CZ 3.46Å; E346-R1151 IonicContact OE1-NE 2.77Å; E346-R1151 PolarHBondContact OE1-NE 3.13Å; E346-R1151 IonicContact OE1-NH2 3.98Å; E346-R1151 PolarHBondContact OE1-NH2 3.48Å; T350-R1151 HydrophobicContact CG2-CG 4.14Å; V1147-R1151 HydrophobicContact CG1-CG 4.41Å; V1147-R1151 WeakPolarHBondContact O-CB 3.46Å; V1147-R1151 VanDerWaalsContact O-CG 3.23Å; V1147-R1151 WeakPolarHBondContact O-CG 3.38Å; V1147-R1151 PolarHBondContact O-N 3.37Å; L1149-R1151 PolarHBondContact O-N 3.22Å; R1151-Q1153 PolarHBondContact O-N 2.88Å; R1151-I1154 PolarHBondContact O-N 3.44Å; R1151-R1155 WeakPolarHBondContact O-CG 3.5Å; R1151-R1155 PolarHBondContact O-N 3Å
1152	A	83.1	Confident	81.3	Confident	22 Å²	22	22.2 Å²	22.2	18%	0.182	11%	0.113	C	C	.	.	H	α-helix	trans	-67.1	-32.7	177.3	0	0	0	0	0	113.3	T961 N1148 L1149 I1150 G1156	T961-A1152 HydrophobicContact CG2-CB 3.34Å; N1148-A1152 WeakPolarHBondContact O-CB 3.48Å; N1148-A1152 PolarHBondContact O-N 3.49Å; N1148-A1152 VanDerWaalsContact O-N 3.13Å; L1149-A1152 PolarHBondContact O-N 2.9Å; I1150-A1152 VanDerWaalsContact C-N 3.34Å; I1150-A1152 PolarHBondContact O-N 3.48Å; A1152-G1156 PolarHBondContact O-N 3.29Å
1153	Q	90	Very high	82.7	Confident	1 Å²	1	22 Å²	22	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-71.2	-39.3	173.2	-70	-158.1	-116.3	0	0	112.6	L959 F1074 L1149 I1150 R1151 G1156 I1157	L959-Q1153 HydrophobicContact CD2-CG 4.19Å; F1074-Q1153 HydrophobicContact CD1-CB 4.15Å; F1074-Q1153 HydrophobicContact CD2-CB 4.08Å; F1074-Q1153 HydrophobicContact CE1-CB 3.98Å; F1074-Q1153 HydrophobicContact CE2-CB 3.92Å; F1074-Q1153 HydrophobicContact CG-CB 4.2Å; F1074-Q1153 HydrophobicContact CZ-CB 3.86Å; L1149-Q1153 HydrophobicContact CD1-CG 4.39Å; L1149-Q1153 WeakPolarHBondContact O-CG 3.33Å; L1149-Q1153 PolarHBondContact O-N 3.25Å; I1150-Q1153 PolarHBondContact O-N 2.93Å; I1150-Q1153 VanDerWaalsContact O-N 3.09Å; R1151-Q1153 PolarHBondContact O-N 2.88Å; Q1153-G1156 PolarHBondContact O-N 3.36Å; Q1153-I1157 PolarHBondContact O-N 2.88Å
1154	I	88.8	Confident	83.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.2	-49.2	172.6	-69.4	165.8	0	0	0	110.6	V349 T350 F353 F1074 I1150 R1151 G1156 E1158 L1159 I1160	V349-I1154 HydrophobicContact CG1-CD1 3.89Å; V349-I1154 HydrophobicContact CG1-CG1 4.42Å; T350-I1154 VanDerWaalsContact OG1-CD1 3.32Å; T350-I1154 WeakPolarHBondContact OG1-CD1 3.32Å; F353-I1154 HydrophobicContact CD2-CD1 4.03Å; F353-I1154 HydrophobicContact CD2-CG1 4.46Å; F353-I1154 HydrophobicContact CE2-CD1 3.9Å; F353-I1154 HydrophobicContact CE2-CG1 3.91Å; F1074-I1154 HydrophobicContact CE2-CG1 3.91Å; F1074-I1154 HydrophobicContact CZ-CG1 4.45Å; I1150-I1154 HydrophobicContact CG2-CD1 3.85Å; I1150-I1154 HydrophobicContact CG2-CG1 4.39Å; I1150-I1154 WeakPolarHBondContact O-CG1 3.35Å; I1150-I1154 PolarHBondContact O-N 2.87Å; R1151-I1154 PolarHBondContact O-N 3.44Å; I1154-G1156 VanDerWaalsContact C-N 3.34Å; I1154-E1158 PolarHBondContact O-N 2.91Å; I1154-L1159 HydrophobicContact CG2-CB 4.3Å; I1154-L1159 PolarHBondContact O-N 3.15Å; I1154-L1159 VanDerWaalsContact O-N 3.09Å; I1154-I1160 HydrophobicContact CG2-CD1 3.73Å; I1154-I1160 HydrophobicContact CG2-CG1 3.8Å
1155	R	84.3	Confident	84.3	Confident	144 Å²	144	25 Å²	25	54%	0.543	13%	0.127	S	C	.	.	H	α-helix	trans	-60.6	-43.1	176.1	-71	172.1	-179.2	-159.1	-8	111.9	E346 R1151 I1157 E1158	E346-R1155 VanDerWaalsContact CD-NH2 3.33Å; E346-R1155 IonicContact OE1-CZ 2.61Å; E346-R1155 IonicContact OE1-NE 2.95Å; E346-R1155 PolarHBondContact OE1-NE 3.09Å; E346-R1155 VanDerWaalsContact OE1-NE 3.09Å; E346-R1155 IonicContact OE1-NH2 3.25Å; E346-R1155 PolarHBondContact OE1-NH2 2.82Å; E346-R1155 VanDerWaalsContact OE1-NH2 3.07Å; E346-R1155 IonicContact OE2-CZ 3.96Å; E346-R1155 IonicContact OE2-NE 2.78Å; E346-R1155 PolarHBondContact OE2-NE 2.9Å; E346-R1155 IonicContact OE2-NH2 3.76Å; E346-R1155 PolarHBondContact OE2-NH2 2.97Å; R1151-R1155 WeakPolarHBondContact O-CG 3.5Å; R1151-R1155 PolarHBondContact O-N 3Å; R1155-I1157 VanDerWaalsContact C-N 3.34Å; R1155-I1157 PolarHBondContact O-N 2.97Å; R1155-E1158 WeakPolarHBondContact O-CA 3.19Å; R1155-E1158 PolarHBondContact O-N 3.21Å
1156	G	79.3	Confident	84.3	Confident	2 Å²	2	25.3 Å²	25.3	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-73.6	-16.2	-171.4	0	0	0	0	0	116.7	N958 A1152 Q1153 I1154	N958-G1156 VanDerWaalsContact O-CA 3.25Å; N958-G1156 WeakPolarHBondContact O-CA 3.28Å; A1152-G1156 PolarHBondContact O-N 3.29Å; Q1153-G1156 PolarHBondContact O-N 3.36Å; I1154-G1156 VanDerWaalsContact C-N 3.34Å
1157	I	83.5	Confident	84.2	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.021	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	10	166.2	63.6	163.2	0	0	0	112	L959 H1072 F1074 Q1153 R1155 L1159	L959-I1157 HydrophobicContact CD1-CG2 3.54Å; L959-I1157 HydrophobicContact CG-CG2 4.19Å; H1072-I1157 HydrophobicContact CB-CD1 3.96Å; F1074-I1157 HydrophobicContact CE1-CD1 3.92Å; F1074-I1157 HydrophobicContact CE1-CG1 4.47Å; F1074-I1157 HydrophobicContact CZ-CD1 3.85Å; F1074-I1157 HydrophobicContact CZ-CG1 4.28Å; Q1153-I1157 PolarHBondContact O-N 2.88Å; R1155-I1157 VanDerWaalsContact C-N 3.34Å; R1155-I1157 PolarHBondContact O-N 2.97Å; I1157-L1159 HydrophobicContact CD1-CB 3.94Å; I1157-L1159 HydrophobicContact CD1-CD1 4.34Å; I1157-L1159 HydrophobicContact CD1-CD2 4.47Å; I1157-L1159 HydrophobicContact CD1-CG 4.48Å; I1157-L1159 HydrophobicContact CG1-CB 3.9Å; I1157-L1159 PolarHBondContact O-N 3.07Å; I1157-L1159 VanDerWaalsContact O-N 3.11Å
1158	E	82.1	Confident	84.1	Confident	10 Å²	10	29.5 Å²	29.5	5%	0.047	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.4	37.3	-172	-50.2	-147.4	147.8	0	0	114.8	F836 R863 I1154 R1155 I1160 N1161 T1162	F836-E1158 HydrophobicContact CE1-CB 4.39Å; F836-E1158 HydrophobicContact CZ-CB 4.01Å; F836-E1158 HydrophobicContact CZ-CG 4.24Å; R863-E1158 VanDerWaalsContact CD-OE1 3.28Å; R863-E1158 WeakPolarHBondContact CD-OE1 3.31Å; R863-E1158 IonicContact CZ-OE1 2.72Å; R863-E1158 IonicContact NE-OE1 3.96Å; R863-E1158 IonicContact NH1-OE1 3.37Å; R863-E1158 PolarHBondContact NH1-OE1 2.77Å; I1154-E1158 PolarHBondContact O-N 2.91Å; R1155-E1158 WeakPolarHBondContact O-CA 3.19Å; R1155-E1158 PolarHBondContact O-N 3.21Å; E1158-I1160 PolarHBondContact O-N 2.68Å; E1158-I1160 VanDerWaalsContact O-N 3.09Å; E1158-N1161 HydrophobicContact CB-CB 4.03Å; E1158-N1161 VanDerWaalsContact CD-ND2 3.34Å; E1158-N1161 WeakPolarHBondContact O-CA 3.46Å; E1158-N1161 WeakPolarHBondContact O-CB 3.37Å; E1158-N1161 PolarHBondContact O-N 3.21Å; E1158-N1161 PolarHBondContact OE2-ND2 2.85Å; E1158-T1162 PolarHBondContact O-N 2.92Å; E1158-T1162 VanDerWaalsContact O-N 3.08Å
1159	L	86.6	Confident	84	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-55.6	-37.4	-170	-179	61.4	0	0	0	113.2	L338 V349 F353 A366 I372 I1154 I1157 L1163	L338-L1159 HydrophobicContact CD1-CD2 4.07Å; V349-L1159 HydrophobicContact CG1-CD2 4.45Å; F353-L1159 HydrophobicContact CE2-CD2 4.48Å; F353-L1159 HydrophobicContact CZ-CD2 4.15Å; A366-L1159 HydrophobicContact CB-CD1 3.95Å; I372-L1159 HydrophobicContact CD1-CD1 4.23Å; I372-L1159 HydrophobicContact CD1-CD2 4.14Å; I372-L1159 HydrophobicContact CG1-CD2 4.46Å; I1154-L1159 HydrophobicContact CG2-CB 4.3Å; I1154-L1159 PolarHBondContact O-N 3.15Å; I1154-L1159 VanDerWaalsContact O-N 3.09Å; I1157-L1159 HydrophobicContact CD1-CB 3.94Å; I1157-L1159 HydrophobicContact CD1-CD1 4.34Å; I1157-L1159 HydrophobicContact CD1-CD2 4.47Å; I1157-L1159 HydrophobicContact CD1-CG 4.48Å; I1157-L1159 HydrophobicContact CG1-CB 3.9Å; I1157-L1159 PolarHBondContact O-N 3.07Å; I1157-L1159 VanDerWaalsContact O-N 3.11Å; L1159-L1163 HydrophobicContact CD1-CD1 4.15Å; L1159-L1163 HydrophobicContact CD1-CG 4.16Å; L1159-L1163 HydrophobicContact CG-CD1 3.92Å; L1159-L1163 HydrophobicContact CG-CG 4.36Å; L1159-L1163 VanDerWaalsContact O-CB 3.3Å; L1159-L1163 WeakPolarHBondContact O-CB 3.3Å; L1159-L1163 VanDerWaalsContact O-CG 3.27Å; L1159-L1163 WeakPolarHBondContact O-CG 3.35Å; L1159-L1163 PolarHBondContact O-N 2.88Å
1160	I	86.9	Confident	84	Confident	24 Å²	24	26.7 Å²	26.7	12%	0.123	13%	0.126	C	C	.	.	H	α-helix	trans	-64.8	-43.7	177.8	-62.4	163.1	0	0	0	110.2	E346 I1154 E1158 L1163 Q1164	E346-I1160 HydrophobicContact CB-CD1 3.63Å; E346-I1160 HydrophobicContact CG-CD1 3.92Å; I1154-I1160 HydrophobicContact CG2-CD1 3.73Å; I1154-I1160 HydrophobicContact CG2-CG1 3.8Å; E1158-I1160 PolarHBondContact O-N 2.68Å; E1158-I1160 VanDerWaalsContact O-N 3.09Å; I1160-L1163 PolarHBondContact O-N 2.96Å; I1160-Q1164 HydrophobicContact CG2-CG 4.38Å; I1160-Q1164 WeakPolarHBondContact O-CB 3.42Å; I1160-Q1164 VanDerWaalsContact O-CG 3.26Å; I1160-Q1164 WeakPolarHBondContact O-CG 3.36Å; I1160-Q1164 PolarHBondContact O-N 3.18Å
1161	N	81.4	Confident	83.5	Confident	52 Å²	52	27.5 Å²	27.5	28%	0.278	13%	0.131	S	C	.	.	H	α-helix	trans	-62.7	-47.9	179	-60.6	-2.6	0	0	0	109.8	F861 E1158 Q1164 A1165	F861-N1161 HydrophobicContact CD1-CB 3.91Å; F861-N1161 HydrophobicContact CE1-CB 3.82Å; F861-N1161 WeakPolarHBondContact CE1-O 3.34Å; E1158-N1161 HydrophobicContact CB-CB 4.03Å; E1158-N1161 VanDerWaalsContact CD-ND2 3.34Å; E1158-N1161 WeakPolarHBondContact O-CA 3.46Å; E1158-N1161 WeakPolarHBondContact O-CB 3.37Å; E1158-N1161 PolarHBondContact O-N 3.21Å; E1158-N1161 PolarHBondContact OE2-ND2 2.85Å; N1161-Q1164 PolarHBondContact O-N 3.4Å; N1161-A1165 WeakPolarHBondContact O-CB 3.34Å; N1161-A1165 PolarHBondContact O-N 2.74Å
1162	T	82	Confident	83.2	Confident	6 Å²	6	26.9 Å²	26.9	4%	0.037	13%	0.129	C	C	.	.	H	α-helix	trans	-67	-40.1	178	-37.6	0	0	0	0	112.7	Y835 I840 E1158 A1165 V1166	Y835-T1162 HydrophobicContact CE1-CG2 4.44Å; Y835-T1162 WeakPolarHBondContact OH-CB 3.33Å; Y835-T1162 WeakPolarHBondContact OH-CG2 3.44Å; Y835-T1162 PolarHBondContact OH-OG1 2.76Å; I840-T1162 HydrophobicContact CD1-CG2 4.38Å; E1158-T1162 PolarHBondContact O-N 2.92Å; E1158-T1162 VanDerWaalsContact O-N 3.08Å; T1162-A1165 PolarHBondContact O-N 3.31Å; T1162-V1166 HydrophobicContact CG2-CG2 4.23Å; T1162-V1166 WeakPolarHBondContact O-CG2 3.11Å; T1162-V1166 PolarHBondContact O-N 2.91Å
1163	L	86.5	Confident	83.1	Confident	4 Å²	4	25.9 Å²	25.9	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-63.6	-41.7	176.5	-78.6	173.6	0	0	0	112	L338 I339 I344 A366 L1159 I1160 A1165 K1167	L338-L1163 HydrophobicContact CB-CD1 3.82Å; L338-L1163 HydrophobicContact CD1-CD1 4.1Å; I339-L1163 HydrophobicContact CB-CD2 4.31Å; I339-L1163 HydrophobicContact CD1-CB 4.47Å; I339-L1163 HydrophobicContact CD1-CD2 3.95Å; I339-L1163 VanDerWaalsContact CD1-O 3.23Å; I339-L1163 WeakPolarHBondContact CD1-O 3.45Å; I344-L1163 HydrophobicContact CD1-CB 4.28Å; I344-L1163 HydrophobicContact CG2-CB 3.97Å; I344-L1163 HydrophobicContact CG2-CD1 4.18Å; A366-L1163 HydrophobicContact CB-CD2 3.8Å; A366-L1163 HydrophobicContact CB-CG 4.44Å; L1159-L1163 HydrophobicContact CD1-CD1 4.15Å; L1159-L1163 HydrophobicContact CD1-CG 4.16Å; L1159-L1163 HydrophobicContact CG-CD1 3.92Å; L1159-L1163 HydrophobicContact CG-CG 4.36Å; L1159-L1163 VanDerWaalsContact O-CB 3.3Å; L1159-L1163 WeakPolarHBondContact O-CB 3.3Å; L1159-L1163 VanDerWaalsContact O-CG 3.27Å; L1159-L1163 WeakPolarHBondContact O-CG 3.35Å; L1159-L1163 PolarHBondContact O-N 2.88Å; I1160-L1163 PolarHBondContact O-N 2.96Å; L1163-A1165 VanDerWaalsContact C-N 3.33Å; L1163-K1167 VanDerWaalsContact O-CB 3.28Å; L1163-K1167 WeakPolarHBondContact O-CB 3.33Å; L1163-K1167 PolarHBondContact O-N 2.71Å
1164	Q	83.8	Confident	82.7	Confident	81 Å²	81	26.1 Å²	26.1	38%	0.379	12%	0.122	S	C	.	.	H	α-helix	trans	-65.3	-38.1	173.8	-71.9	176.9	4.2	0	0	111.3	I344 I1160 N1161 Q1168	I344-Q1164 HydrophobicContact CB-CG 4.43Å; I344-Q1164 HydrophobicContact CG2-CG 4.41Å; I344-Q1164 PolarHBondContact O-NE2 2.86Å; I1160-Q1164 HydrophobicContact CG2-CG 4.38Å; I1160-Q1164 WeakPolarHBondContact O-CB 3.42Å; I1160-Q1164 VanDerWaalsContact O-CG 3.26Å; I1160-Q1164 WeakPolarHBondContact O-CG 3.36Å; I1160-Q1164 PolarHBondContact O-N 3.18Å; N1161-Q1164 PolarHBondContact O-N 3.4Å; Q1164-Q1168 WeakPolarHBondContact O-CG 3.36Å; Q1164-Q1168 PolarHBondContact O-N 3.15Å
1165	A	81.3	Confident	82.4	Confident	6 Å²	6	26.6 Å²	26.6	5%	0.05	13%	0.125	C	C	.	.	H	α-helix	trans	-63.4	-51.3	177.3	0	0	0	0	0	112.4	I840 I856 F861 N1161 T1162 L1163 K1167 Q1168 S1169	I840-A1165 HydrophobicContact CD1-CB 4.44Å; I856-A1165 VanDerWaalsContact CD1-CA 3.49Å; I856-A1165 HydrophobicContact CD1-CB 4.04Å; I856-A1165 VanDerWaalsContact CD1-O 3.28Å; I856-A1165 WeakPolarHBondContact CD1-O 3.24Å; F861-A1165 HydrophobicContact CE1-CB 3.94Å; F861-A1165 HydrophobicContact CZ-CB 3.92Å; N1161-A1165 WeakPolarHBondContact O-CB 3.34Å; N1161-A1165 PolarHBondContact O-N 2.74Å; T1162-A1165 PolarHBondContact O-N 3.31Å; L1163-A1165 VanDerWaalsContact C-N 3.33Å; A1165-K1167 VanDerWaalsContact C-N 3.32Å; A1165-K1167 PolarHBondContact O-N 2.88Å; A1165-Q1168 CarbonylContact O-C 3.5Å; A1165-Q1168 PolarHBondContact O-N 3.34Å; A1165-S1169 PolarHBondContact O-N 3.09Å
1166	V	80.6	Confident	82.3	Confident	6 Å²	6	20.3 Å²	20.3	4%	0.036	10%	0.102	C	C	.	.	H	α-helix	trans	-71	-26.8	-178.5	-177.1	0	0	0	0	112	S367 I369 T1162 Q1168 P1171	S367-V1166 WeakPolarHBondContact OG-CG1 3.32Å; I369-V1166 HydrophobicContact CD1-CG1 3.98Å; I369-V1166 HydrophobicContact CD1-CG2 3.83Å; T1162-V1166 HydrophobicContact CG2-CG2 4.23Å; T1162-V1166 WeakPolarHBondContact O-CG2 3.11Å; T1162-V1166 PolarHBondContact O-N 2.91Å; V1166-Q1168 PolarHBondContact O-N 3.45Å; V1166-P1171 HydrophobicContact CG1-CB 4.43Å; V1166-P1171 HydrophobicContact CG1-CG 4.08Å
1167	K	82.8	Confident	82.3	Confident	75 Å²	75	25.3 Å²	25.3	33%	0.326	12%	0.123	S	C	.	.	H	α-helix	trans	-66.3	-24	170.4	-166	159.7	-177.7	169.7	0	113.2	I339 L341 R342 I344 L1163 A1165 R1231	I339-K1167 HydrophobicContact CD1-CB 3.71Å; I339-K1167 HydrophobicContact CD1-CD 4.33Å; I339-K1167 HydrophobicContact CD1-CG 4.32Å; I339-K1167 PolarHBondContact O-NZ 3.41Å; L341-K1167 PolarHBondContact O-NZ 2.79Å; R342-K1167 PolarHBondContact O-NZ 3.43Å; I344-K1167 HydrophobicContact CD1-CD 3.6Å; I344-K1167 HydrophobicContact CG1-CD 4.5Å; L1163-K1167 VanDerWaalsContact O-CB 3.28Å; L1163-K1167 WeakPolarHBondContact O-CB 3.33Å; L1163-K1167 PolarHBondContact O-N 2.71Å; A1165-K1167 VanDerWaalsContact C-N 3.32Å; A1165-K1167 PolarHBondContact O-N 2.88Å; K1167-R1231 PolarHBondContact O-NH1 2.95Å
1168	Q	81.9	Confident	82	Confident	84 Å²	84	27.9 Å²	27.9	39%	0.393	14%	0.135	S	C	.	.	H	α-helix	trans	-97.4	-25.8	179.5	-73.6	179.4	31	0	0	112.9	P855 I856 Q1164 A1165 V1166	P855-Q1168 VanDerWaalsContact CG-O 3.3Å; P855-Q1168 WeakPolarHBondContact CG-O 3.23Å; I856-Q1168 HydrophobicContact CD1-CB 3.37Å; I856-Q1168 HydrophobicContact CD1-CG 4.29Å; I856-Q1168 HydrophobicContact CG1-CB 4.27Å; Q1164-Q1168 WeakPolarHBondContact O-CG 3.36Å; Q1164-Q1168 PolarHBondContact O-N 3.15Å; A1165-Q1168 CarbonylContact O-C 3.5Å; A1165-Q1168 PolarHBondContact O-N 3.34Å; V1166-Q1168 PolarHBondContact O-N 3.45Å
1169	S	80.6	Confident	82.1	Confident	7 Å²	7	27.4 Å²	27.4	5%	0.049	13%	0.133	C	C	.	.	S	Bend	trans	-81	-174.1	172.4	96.9	0	0	0	0	112.8	D843 A1165	D843-S1169 VanDerWaalsContact OD2-CB 3.32Å; D843-S1169 WeakPolarHBondContact OD2-CB 3.28Å; D843-S1169 PolarHBondContact OD2-OG 3.45Å; A1165-S1169 PolarHBondContact O-N 3.09Å
1170	Y	84.5	Confident	81.8	Confident	12 Å²	12	27.9 Å²	27.9	5%	0.047	14%	0.136	C	C	.	.			trans	-127.6	68.3	-172	-56.4	-91.9	0	0	0	110.5	R846 P855 D1172 E1219 Q1222 L1230 R1231	R846-Y1170 PolarHBondContact NH2-O 2.79Å; P855-Y1170 HydrophobicContact CG-CE2 4.11Å; Y1170-D1172 PolarHBondContact O-N 3.39Å; Y1170-E1219 WeakPolarHBondContact CE1-O 3.24Å; Y1170-E1219 PolarHBondContact OH-O 2.71Å; Y1170-Q1222 HydrophobicContact CD1-CG 4.47Å; Y1170-Q1222 HydrophobicContact CD2-CG 4.32Å; Y1170-Q1222 HydrophobicContact CE1-CG 4.05Å; Y1170-Q1222 HydrophobicContact CE2-CG 3.89Å; Y1170-L1230 CarbonylContact C-O 3.37Å; Y1170-L1230 WeakPolarHBondContact CA-O 3.33Å; Y1170-R1231 HydrophobicContact CD1-CG 3.74Å; Y1170-R1231 HydrophobicContact CE1-CG 3.8Å; Y1170-R1231 PolarHBondContact OH-NH2 3.01Å
1171	P	76.9	Confident	81.2	Confident	17 Å²	17	31.7 Å²	31.7	11%	0.11	16%	0.157	C	C	.	.			trans	-63.4	-43.5	-168.5	24	-34	0	0	0	113.3	R846 V1166 T1232	R846-P1171 PolarHBondContact NH1-O 2.8Å; R846-P1171 PolarHBondContact NH2-O 3.27Å; V1166-P1171 HydrophobicContact CG1-CB 4.43Å; V1166-P1171 HydrophobicContact CG1-CG 4.08Å; P1171-T1232 HydrophobicContact CG-CG2 4.43Å; P1171-T1232 WeakPolarHBondContact CG-OG1 3.44Å
1172	D	80.9	Confident	81	Confident	7 Å²	7	34.7 Å²	34.7	4%	0.037	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	141.9	178.1	-76.2	-42.6	0	0	0	110.6	Y398 N1060 Y1170 L1230 I1235	Y398-D1172 PolarHBondContact OH-OD2 3.2Å; N1060-D1172 WeakPolarHBondContact CA-OD1 3.48Å; Y1170-D1172 PolarHBondContact O-N 3.39Å; D1172-L1230 HydrophobicContact CB-CB 4.11Å; D1172-L1230 PolarHBondContact N-O 2.99Å; D1172-L1230 PolarHBondContact O-N 3.3Å; D1172-I1235 HydrophobicContact CB-CD1 3.86Å; D1172-I1235 HydrophobicContact CB-CG1 4.35Å
1173	R	81.6	Confident	81	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	145.6	177.4	65.5	167.1	-172.6	151.7	16.7	114.4	R846 S1049 Y1050 P1052 F1059 N1060 I1228 Y1229	R846-R1173 VanDerWaalsContact NH1-CD 3.29Å; S1049-R1173 PolarHBondContact O-NH2 2.92Å; Y1050-R1173 PolarHBondContact O-NH1 3.1Å; P1052-R1173 HydrophobicContact CB-CG 4.39Å; F1059-R1173 HydrophobicContact CB-CG 3.9Å; F1059-R1173 HydrophobicContact CD1-CG 3.56Å; F1059-R1173 HydrophobicContact CD2-CG 4.31Å; F1059-R1173 VanDerWaalsContact CD2-NE 3.33Å; F1059-R1173 HydrophobicContact CE1-CG 4.17Å; F1059-R1173 VanDerWaalsContact CE2-NE 3.32Å; F1059-R1173 HydrophobicContact CG-CG 3.63Å; N1060-R1173 VanDerWaalsContact CG-O 3.24Å; N1060-R1173 PolarHBondContact ND2-O 2.85Å; N1060-R1173 VanDerWaalsContact OD1-C 3.32Å; N1060-R1173 PolarHBondContact OD1-N 3.31Å; N1060-R1173 PolarHBondContact OD1-O 2.99Å; R1173-I1228 CarbonylContact C-O 3.42Å; R1173-I1228 WeakPolarHBondContact CA-O 3.42Å; R1173-I1228 VanDerWaalsContact CB-O 3.24Å; R1173-I1228 WeakPolarHBondContact CB-O 2.97Å; R1173-Y1229 HydrophobicContact CB-CD1 3.84Å; R1173-Y1229 HydrophobicContact CB-CE1 4.04Å; R1173-Y1229 HydrophobicContact CB-CG 4.28Å; R1173-Y1229 VanDerWaalsContact CD-CE1 3.48Å; R1173-Y1229 HydrophobicContact CG-CE1 4.31Å; R1173-Y1229 PolarHBondContact NH1-OH 3.23Å
1174	L	80.9	Confident	80.5	Confident	6 Å²	6	35 Å²	35	3%	0.031	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	151.9	177	-73.1	158.7	0	0	0	110	N1060 E1178 F1179 F1183 N1227 I1228 I1235	N1060-L1174 WeakPolarHBondContact ND2-CD2 3.5Å; L1174-E1178 HydrophobicContact CD2-CG 3.92Å; L1174-F1179 HydrophobicContact CB-CB 4.2Å; L1174-F1179 HydrophobicContact CD1-CB 4.38Å; L1174-F1179 HydrophobicContact CD1-CD2 3.88Å; L1174-F1183 HydrophobicContact CD1-CE2 3.89Å; L1174-N1227 CarbonylContact O-C 3.57Å; L1174-N1227 WeakPolarHBondContact O-CA 3.46Å; L1174-I1228 HydrophobicContact CB-CG2 4.01Å; L1174-I1228 PolarHBondContact N-O 2.84Å; L1174-I1228 PolarHBondContact O-N 2.89Å; L1174-I1235 HydrophobicContact CD1-CD1 3.81Å; L1174-I1235 HydrophobicContact CD1-CG1 4.4Å; L1174-I1235 HydrophobicContact CG-CD1 4.15Å
1175	S	82.5	Confident	79.8	Confident	11 Å²	11	32.4 Å²	32.4	8%	0.077	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	145.7	162.5	59.2	0	0	0	0	108.9	N1053 K1177 E1178 F1179	N1053-S1175 VanDerWaalsContact OD1-CB 3.31Å; N1053-S1175 WeakPolarHBondContact OD1-CB 3.47Å; N1053-S1175 PolarHBondContact OD1-OG 3.04Å; S1175-K1177 PolarHBondContact O-N 2.92Å; S1175-E1178 PolarHBondContact O-N 2.95Å; S1175-E1178 VanDerWaalsContact OG-CB 3.32Å; S1175-E1178 WeakPolarHBondContact OG-CB 3.41Å; S1175-F1179 PolarHBondContact O-N 3.05Å
1176	L	82.8	Confident	79.4	Confident	11 Å²	11	33.2 Å²	33.2	6%	0.058	16%	0.16	C	C	.	.	H	α-helix	trans	-60	-34.4	-175.1	-66.1	164.1	0	0	0	112	C1180 N1203 K1204 V1207 L1223 N1226 I1228	L1176-C1180 PolarHBondContact O-N 3.18Å; L1176-C1180 PolarHBondContact O-SG 2.7Å; L1176-N1203 HydrophobicContact CB-CB 3.85Å; L1176-K1204 HydrophobicContact CD1-CD 4.43Å; L1176-K1204 HydrophobicContact CD1-CG 3.54Å; L1176-V1207 HydrophobicContact CD2-CB 4.42Å; L1176-V1207 HydrophobicContact CD2-CG1 4.5Å; L1176-V1207 HydrophobicContact CD2-CG2 3.93Å; L1176-L1223 HydrophobicContact CD2-CD2 3.95Å; L1176-N1226 WeakPolarHBondContact CD1-O 3.17Å; L1176-N1226 VanDerWaalsContact CG-O 3.26Å; L1176-N1226 WeakPolarHBondContact CG-O 3.05Å; L1176-N1226 PolarHBondContact N-O 3.35Å; L1176-N1226 VanDerWaalsContact N-O 3.08Å; L1176-I1228 HydrophobicContact CD2-CB 4.01Å; L1176-I1228 HydrophobicContact CD2-CG2 4.42Å
1177	K	77.6	Confident	78.9	Confident	107 Å²	107	33.3 Å²	33.3	47%	0.465	16%	0.161	S	C	.	.	H	α-helix	trans	-63.9	-43.3	174	-176.8	165.3	178.1	168.5	0	112.1	S1175 C1180 N1181 E1200	S1175-K1177 PolarHBondContact O-N 2.92Å; K1177-C1180 PolarHBondContact O-N 2.96Å; K1177-N1181 WeakPolarHBondContact O-CB 3.1Å; K1177-N1181 PolarHBondContact O-N 3.42Å; K1177-N1181 PolarHBondContact O-ND2 2.75Å; K1177-N1181 PolarHBondContact O-OD1 2.84Å; K1177-E1200 WeakPolarHBondContact CE-OE1 3.43Å; K1177-E1200 IonicContact NZ-OE1 2.63Å; K1177-E1200 PolarHBondContact NZ-OE1 3.28Å
1178	E	77.3	Confident	77.9	Confident	58 Å²	58	34.4 Å²	34.4	27%	0.271	18%	0.176	S	C	.	.	H	α-helix	trans	-70.5	-37.3	178.7	-175.3	66	175	0	0	112.4	L1174 S1175 N1181 R1182	L1174-E1178 HydrophobicContact CD2-CG 3.92Å; S1175-E1178 PolarHBondContact O-N 2.95Å; S1175-E1178 VanDerWaalsContact OG-CB 3.32Å; S1175-E1178 WeakPolarHBondContact OG-CB 3.41Å; E1178-N1181 PolarHBondContact O-N 2.87Å; E1178-R1182 WeakPolarHBondContact O-CB 3.28Å; E1178-R1182 WeakPolarHBondContact O-CG 3.46Å; E1178-R1182 PolarHBondContact O-N 3.04Å; E1178-R1182 IonicContact OE1-CZ 2.71Å; E1178-R1182 IonicContact OE1-NE 3.21Å; E1178-R1182 PolarHBondContact OE1-NE 3.41Å; E1178-R1182 IonicContact OE1-NH2 3.16Å; E1178-R1182 PolarHBondContact OE1-NH2 3.36Å
1179	F	84.8	Confident	76.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-61.1	-47.4	172.2	-173.3	-76.6	0	0	0	111.2	L1174 S1175 R1182 F1183 V1207 I1210 L1211 I1228 L1230 L1238	L1174-F1179 HydrophobicContact CB-CB 4.2Å; L1174-F1179 HydrophobicContact CD1-CB 4.38Å; L1174-F1179 HydrophobicContact CD1-CD2 3.88Å; S1175-F1179 PolarHBondContact O-N 3.05Å; F1179-R1182 PolarHBondContact O-N 2.97Å; F1179-F1183 HydrophobicContact CD1-CB 4.43Å; F1179-F1183 HydrophobicContact CD1-CD2 4.13Å; F1179-F1183 AromaticContact CD2-CD2 3.7Å; F1179-F1183 HydrophobicContact CD2-CD2 3.7Å; F1179-F1183 HydrophobicContact CD2-CE2 4.03Å; F1179-F1183 HydrophobicContact CE1-CB 4.1Å; F1179-F1183 HydrophobicContact CE1-CD2 4.14Å; F1179-F1183 AromaticContact CE2-CD2 3.7Å; F1179-F1183 HydrophobicContact CE2-CD2 3.7Å; F1179-F1183 HydrophobicContact CE2-CE2 4.09Å; F1179-F1183 AromaticContact CG-CD2 3.92Å; F1179-F1183 HydrophobicContact CG-CD2 3.92Å; F1179-F1183 HydrophobicContact CZ-CB 4.37Å; F1179-F1183 AromaticContact CZ-CD2 3.92Å; F1179-F1183 HydrophobicContact CZ-CD2 3.92Å; F1179-F1183 HydrophobicContact CZ-CG 4.43Å; F1179-F1183 WeakPolarHBondContact O-CB 3.43Å; F1179-F1183 WeakPolarHBondContact O-CD2 3.4Å; F1179-F1183 PolarHBondContact O-N 2.93Å; F1179-V1207 HydrophobicContact CB-CG2 4.47Å; F1179-V1207 HydrophobicContact CD1-CB 4.35Å; F1179-V1207 HydrophobicContact CD1-CG1 3.97Å; F1179-V1207 HydrophobicContact CD1-CG2 3.76Å; F1179-V1207 HydrophobicContact CE1-CG1 4Å; F1179-V1207 HydrophobicContact CE1-CG2 4.42Å; F1179-V1207 HydrophobicContact CG-CG1 4.46Å; F1179-V1207 HydrophobicContact CG-CG2 4.35Å; F1179-I1210 HydrophobicContact CD1-CD1 4.5Å; F1179-I1210 HydrophobicContact CE1-CB 4.35Å; F1179-I1210 HydrophobicContact CE1-CD1 4.19Å; F1179-I1210 HydrophobicContact CE1-CG2 4Å; F1179-I1210 HydrophobicContact CZ-CG2 4.45Å; F1179-L1211 HydrophobicContact CZ-CD1 4.23Å; F1179-L1211 HydrophobicContact CZ-CD2 3.88Å; F1179-L1211 HydrophobicContact CZ-CG 3.99Å; F1179-I1228 HydrophobicContact CB-CG2 3.88Å; F1179-I1228 HydrophobicContact CD2-CD1 4.31Å; F1179-I1228 HydrophobicContact CD2-CG2 3.74Å; F1179-I1228 HydrophobicContact CE2-CD1 4.18Å; F1179-I1228 HydrophobicContact CG-CG2 3.98Å; F1179-L1230 HydrophobicContact CE2-CD1 4.2Å; F1179-L1238 HydrophobicContact CE2-CD1 3.69Å; F1179-L1238 HydrophobicContact CZ-CD1 3.92Å
1180	C	80.8	Confident	75.7	Confident	11 Å²	11	39.1 Å²	39.1	7%	0.074	21%	0.211	C	C	.	.	H	α-helix	trans	-57.9	-50.3	174.3	-73	0	0	0	0	111.3	L1176 K1177 R1182 F1183 V1184	L1176-C1180 PolarHBondContact O-N 3.18Å; L1176-C1180 PolarHBondContact O-SG 2.7Å; K1177-C1180 PolarHBondContact O-N 2.96Å; C1180-R1182 VanDerWaalsContact C-N 3.3Å; C1180-R1182 PolarHBondContact O-N 3.47Å; C1180-F1183 PolarHBondContact O-N 2.86Å; C1180-V1184 WeakPolarHBondContact O-CB 3.29Å; C1180-V1184 WeakPolarHBondContact O-CG1 3.38Å; C1180-V1184 PolarHBondContact O-N 3.47Å
1181	N	74.9	Confident	74.3	Confident	104 Å²	104	42.3 Å²	42.3	56%	0.556	24%	0.235	S	C	*	.	H	α-helix	trans	-55.7	-43.5	179.8	-72.5	-15.6	0	0	0	112.6	K1177 E1178	K1177-N1181 WeakPolarHBondContact O-CB 3.1Å; K1177-N1181 PolarHBondContact O-N 3.42Å; K1177-N1181 PolarHBondContact O-ND2 2.75Å; K1177-N1181 PolarHBondContact O-OD1 2.84Å; E1178-N1181 PolarHBondContact O-N 2.87Å
1182	R	77.3	Confident	73.3	Confident	115 Å²	115	45 Å²	45	43%	0.434	25%	0.245	S	C	.	.	H	α-helix	trans	-75.3	-41.6	-179	-70.3	-175.7	-171.4	-153.5	2.2	113.5	E1178 F1179 C1180 L1242	E1178-R1182 WeakPolarHBondContact O-CB 3.28Å; E1178-R1182 WeakPolarHBondContact O-CG 3.46Å; E1178-R1182 PolarHBondContact O-N 3.04Å; E1178-R1182 IonicContact OE1-CZ 2.71Å; E1178-R1182 IonicContact OE1-NE 3.21Å; E1178-R1182 PolarHBondContact OE1-NE 3.41Å; E1178-R1182 IonicContact OE1-NH2 3.16Å; E1178-R1182 PolarHBondContact OE1-NH2 3.36Å; F1179-R1182 PolarHBondContact O-N 2.97Å; C1180-R1182 VanDerWaalsContact C-N 3.3Å; C1180-R1182 PolarHBondContact O-N 3.47Å; R1182-L1242 WeakPolarHBondContact O-CD1 3.48Å
1183	F	80	Confident	72.3	Confident	3 Å²	3	45.7 Å²	45.7	1%	0.013	25%	0.248	C	C	.	.	H	α-helix	trans	-116.6	-2	-163	-57.5	-62.7	0	0	0	115.7	L1174 F1179 C1180 S1185 L1186 L1238 I1239 L1242	L1174-F1183 HydrophobicContact CD1-CE2 3.89Å; F1179-F1183 HydrophobicContact CD1-CB 4.43Å; F1179-F1183 HydrophobicContact CD1-CD2 4.13Å; F1179-F1183 AromaticContact CD2-CD2 3.7Å; F1179-F1183 HydrophobicContact CD2-CD2 3.7Å; F1179-F1183 HydrophobicContact CD2-CE2 4.03Å; F1179-F1183 HydrophobicContact CE1-CB 4.1Å; F1179-F1183 HydrophobicContact CE1-CD2 4.14Å; F1179-F1183 AromaticContact CE2-CD2 3.7Å; F1179-F1183 HydrophobicContact CE2-CD2 3.7Å; F1179-F1183 HydrophobicContact CE2-CE2 4.09Å; F1179-F1183 AromaticContact CG-CD2 3.92Å; F1179-F1183 HydrophobicContact CG-CD2 3.92Å; F1179-F1183 HydrophobicContact CZ-CB 4.37Å; F1179-F1183 AromaticContact CZ-CD2 3.92Å; F1179-F1183 HydrophobicContact CZ-CD2 3.92Å; F1179-F1183 HydrophobicContact CZ-CG 4.43Å; F1179-F1183 WeakPolarHBondContact O-CB 3.43Å; F1179-F1183 WeakPolarHBondContact O-CD2 3.4Å; F1179-F1183 PolarHBondContact O-N 2.93Å; C1180-F1183 PolarHBondContact O-N 2.86Å; F1183-S1185 PolarHBondContact O-N 3.21Å; F1183-L1186 HydrophobicContact CB-CD1 4.37Å; F1183-L1186 HydrophobicContact CD1-CD1 4.17Å; F1183-L1186 WeakPolarHBondContact O-CB 3.49Å; F1183-L1186 PolarHBondContact O-N 3.43Å; F1183-L1238 HydrophobicContact CD1-CB 3.95Å; F1183-L1238 HydrophobicContact CD2-CD1 4.46Å; F1183-L1238 HydrophobicContact CE1-CB 3.56Å; F1183-L1238 HydrophobicContact CE2-CB 4.49Å; F1183-L1238 HydrophobicContact CE2-CD1 4.33Å; F1183-L1238 HydrophobicContact CZ-CB 3.86Å; F1183-L1238 HydrophobicContact CZ-CD1 4.47Å; F1183-I1239 HydrophobicContact CE1-CG1 4.07Å; F1183-I1239 HydrophobicContact CZ-CG1 4.08Å; F1183-L1242 HydrophobicContact CD1-CD1 3.73Å; F1183-L1242 HydrophobicContact CE1-CD1 4.34Å
1184	V	76.6	Confident	71.2	Confident	13 Å²	13	55.2 Å²	55.2	8%	0.079	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-62.9	-21.4	177.2	72.7	0	0	0	0	113.4	C1180 L1186 L1187 I1193 I1210	C1180-V1184 WeakPolarHBondContact O-CB 3.29Å; C1180-V1184 WeakPolarHBondContact O-CG1 3.38Å; C1180-V1184 PolarHBondContact O-N 3.47Å; V1184-L1186 PolarHBondContact O-N 3.06Å; V1184-L1187 HydrophobicContact CG2-CD1 3.94Å; V1184-L1187 PolarHBondContact O-N 3.04Å; V1184-I1193 HydrophobicContact CG2-CG1 4.45Å; V1184-I1210 HydrophobicContact CB-CD1 4.38Å
1185	S	69.9	Low	70.1	Confident	28 Å²	28	60.9 Å²	60.9	20%	0.196	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-68.7	-8.6	172.6	45.5	0	0	0	0	114.5	F1183 L1187	F1183-S1185 PolarHBondContact O-N 3.21Å; S1185-L1187 VanDerWaalsContact C-N 3.33Å
1186	L	72.2	Confident	68.8	Low	22 Å²	22	61.8 Å²	61.8	12%	0.115	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-83.7	-4.1	172.9	-70.5	171.6	0	0	0	113.6	F1183 V1184 L1214 L1238 R1241 L1242	F1183-L1186 HydrophobicContact CB-CD1 4.37Å; F1183-L1186 HydrophobicContact CD1-CD1 4.17Å; F1183-L1186 WeakPolarHBondContact O-CB 3.49Å; F1183-L1186 PolarHBondContact O-N 3.43Å; V1184-L1186 PolarHBondContact O-N 3.06Å; L1186-L1214 HydrophobicContact CB-CD1 4.11Å; L1186-L1214 HydrophobicContact CB-CD2 4.36Å; L1186-L1214 HydrophobicContact CD1-CD1 3.77Å; L1186-L1238 HydrophobicContact CD1-CD2 4.33Å; L1186-R1241 HydrophobicContact CD2-CB 4.41Å; L1186-L1242 HydrophobicContact CD1-CB 4.49Å; L1186-L1242 HydrophobicContact CD1-CD1 4.3Å; L1186-L1242 HydrophobicContact CD2-CB 4.3Å; L1186-L1242 HydrophobicContact CG-CD1 4.13Å
1187	L	70.5	Confident	67.6	Low	8 Å²	8	68.8 Å²	68.8	4%	0.042	34%	0.344	C	S	.	.			trans	-81.5	127.8	177.9	-71.9	171.4	0	0	0	111.5	V1184 S1185 N1189 I1193 L1196 E1209 I1210	V1184-L1187 HydrophobicContact CG2-CD1 3.94Å; V1184-L1187 PolarHBondContact O-N 3.04Å; S1185-L1187 VanDerWaalsContact C-N 3.33Å; L1187-N1189 PolarHBondContact O-N 3.22Å; L1187-I1193 HydrophobicContact CB-CD1 4.35Å; L1187-I1193 HydrophobicContact CB-CG1 4.3Å; L1187-L1196 HydrophobicContact CD1-CD1 3.83Å; L1187-E1209 HydrophobicContact CD2-CG 4.45Å; L1187-I1210 HydrophobicContact CD1-CG1 3.88Å; L1187-I1210 HydrophobicContact CD2-CG1 3.99Å; L1187-I1210 HydrophobicContact CG-CG1 3.86Å
1188	P	61.1	Low	66.6	Low	99 Å²	99	71.4 Å²	71.4	64%	0.643	36%	0.358	S	S	*	.	S	Bend	trans	-65.6	-6.4	-179.3	-24.6	34.7	0	0	0	116.7
1189	N	62	Low	65.5	Low	92 Å²	92	72.6 Å²	72.6	49%	0.492	37%	0.367	S	S	.	.			trans	-112.4	93.1	-169.3	-75.1	-52.9	0	0	0	112.2	L1187 S1191 K1192 I1193	L1187-N1189 PolarHBondContact O-N 3.22Å; N1189-S1191 PolarHBondContact O-N 2.7Å; N1189-S1191 VanDerWaalsContact O-N 3.17Å; N1189-K1192 HydrophobicContact CB-CB 4.17Å; N1189-K1192 PolarHBondContact O-N 2.85Å; N1189-K1192 VanDerWaalsContact O-N 3.08Å; N1189-I1193 PolarHBondContact O-N 2.91Å
1190	S	54.7	Low	64	Low	98 Å²	98	79 Å²	79	69%	0.685	40%	0.397	S	S	*	.	H	α-helix	trans	-57.5	-27.8	-179.7	61.2	0	0	0	0	114.8
1191	S	55.6	Low	62.9	Low	79 Å²	79	83.4 Å²	83.4	55%	0.552	43%	0.427	S	S	*	.	H	α-helix	trans	-64.9	-52.3	171.8	50.3	0	0	0	0	112	N1189 I1193 R1194	N1189-S1191 PolarHBondContact O-N 2.7Å; N1189-S1191 VanDerWaalsContact O-N 3.17Å; S1191-I1193 VanDerWaalsContact C-N 3.31Å; S1191-I1193 PolarHBondContact O-N 3.25Å; S1191-R1194 PolarHBondContact O-N 2.84Å; S1191-R1194 VanDerWaalsContact O-N 3.13Å
1192	K	55.8	Low	62.1	Low	73 Å²	73	82.7 Å²	82.7	32%	0.317	42%	0.423	S	S	.	.	H	α-helix	trans	-58.7	-41.1	177.4	-105.3	-167.6	176.6	-166.4	0	111.9	N1189 R1194 E1195 L1196 E1209	N1189-K1192 HydrophobicContact CB-CB 4.17Å; N1189-K1192 PolarHBondContact O-N 2.85Å; N1189-K1192 VanDerWaalsContact O-N 3.08Å; K1192-R1194 PolarHBondContact O-N 3.38Å; K1192-R1194 VanDerWaalsContact O-N 3.09Å; K1192-E1195 PolarHBondContact O-N 3.33Å; K1192-E1195 VanDerWaalsContact O-N 3.09Å; K1192-L1196 HydrophobicContact CB-CD1 4.09Å; K1192-L1196 WeakPolarHBondContact O-CB 3.27Å; K1192-L1196 WeakPolarHBondContact O-CD1 3.25Å; K1192-L1196 WeakPolarHBondContact O-CG 2.96Å; K1192-L1196 PolarHBondContact O-N 3.48Å; K1192-E1209 IonicContact NZ-OE1 2.62Å; K1192-E1209 PolarHBondContact NZ-OE1 3.26Å; K1192-E1209 IonicContact NZ-OE2 2.71Å; K1192-E1209 PolarHBondContact NZ-OE2 3.22Å
1193	I	60.4	Low	61.7	Low	22 Å²	22	79 Å²	79	11%	0.113	41%	0.412	C	S	.	.	H	α-helix	trans	-55.2	-31.6	179.1	-65.7	173.8	0	0	0	111.9	V1184 L1187 N1189 S1191 K1197	V1184-I1193 HydrophobicContact CG2-CG1 4.45Å; L1187-I1193 HydrophobicContact CB-CD1 4.35Å; L1187-I1193 HydrophobicContact CB-CG1 4.3Å; N1189-I1193 PolarHBondContact O-N 2.91Å; S1191-I1193 VanDerWaalsContact C-N 3.31Å; S1191-I1193 PolarHBondContact O-N 3.25Å; I1193-K1197 HydrophobicContact CG2-CD 4.49Å; I1193-K1197 WeakPolarHBondContact O-CB 3.32Å; I1193-K1197 WeakPolarHBondContact O-CG 3.32Å; I1193-K1197 PolarHBondContact O-N 3.48Å
1194	R	58.4	Low	61.6	Low	199 Å²	199	83 Å²	83	75%	0.751	43%	0.429	S	S	*	.	H	α-helix	trans	-75.3	-42.8	176.4	-67.8	-176.1	176.6	-176.8	-0.4	113.1	S1191 K1192 L1196 K1197	S1191-R1194 PolarHBondContact O-N 2.84Å; S1191-R1194 VanDerWaalsContact O-N 3.13Å; K1192-R1194 PolarHBondContact O-N 3.38Å; K1192-R1194 VanDerWaalsContact O-N 3.09Å; R1194-L1196 VanDerWaalsContact C-N 3.35Å; R1194-K1197 PolarHBondContact O-N 2.92Å
1195	E	57.8	Low	61.5	Low	125 Å²	125	85.8 Å²	85.8	58%	0.584	45%	0.449	S	S	*	.	H	α-helix	trans	-65.4	-39.1	176.3	-62.3	-179.1	144	0	0	112	K1192 Q1198 N1199	K1192-E1195 PolarHBondContact O-N 3.33Å; K1192-E1195 VanDerWaalsContact O-N 3.09Å; E1195-Q1198 PolarHBondContact O-N 2.99Å; E1195-N1199 PolarHBondContact O-ND2 2.93Å; E1195-N1199 VanDerWaalsContact O-ND2 3.15Å
1196	L	53.9	Low	61.7	Low	31 Å²	31	84.7 Å²	84.7	16%	0.162	44%	0.441	C	S	.	.	H	α-helix	trans	-67.9	-35.8	179.9	-66.4	168.3	0	0	0	112	L1187 K1192 R1194 Q1198 I1206	L1187-L1196 HydrophobicContact CD1-CD1 3.83Å; K1192-L1196 HydrophobicContact CB-CD1 4.09Å; K1192-L1196 WeakPolarHBondContact O-CB 3.27Å; K1192-L1196 WeakPolarHBondContact O-CD1 3.25Å; K1192-L1196 WeakPolarHBondContact O-CG 2.96Å; K1192-L1196 PolarHBondContact O-N 3.48Å; R1194-L1196 VanDerWaalsContact C-N 3.35Å; L1196-Q1198 PolarHBondContact O-N 3Å; L1196-I1206 HydrophobicContact CB-CD1 4.33Å; L1196-I1206 HydrophobicContact CD1-CG2 4.18Å; L1196-I1206 HydrophobicContact CD2-CB 4.43Å; L1196-I1206 HydrophobicContact CD2-CD1 3.82Å; L1196-I1206 HydrophobicContact CD2-CG1 3.78Å; L1196-I1206 HydrophobicContact CD2-CG2 4.06Å
1197	K	57.7	Low	62.1	Low	158 Å²	158	83.7 Å²	83.7	69%	0.687	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-9.2	175.1	-80.3	-175.4	176	-174.3	0	114.6	I1193 R1194	I1193-K1197 HydrophobicContact CG2-CD 4.49Å; I1193-K1197 WeakPolarHBondContact O-CB 3.32Å; I1193-K1197 WeakPolarHBondContact O-CG 3.32Å; I1193-K1197 PolarHBondContact O-N 3.48Å; R1194-K1197 PolarHBondContact O-N 2.92Å
1198	Q	57.6	Low	62.6	Low	161 Å²	161	86.9 Å²	86.9	75%	0.752	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-10.5	-179.8	-69.3	-177	-6.7	0	0	114.3	E1195 L1196	E1195-Q1198 PolarHBondContact O-N 2.99Å; L1196-Q1198 PolarHBondContact O-N 3Å
1199	N	54.2	Low	63.4	Low	84 Å²	84	85.2 Å²	85.2	45%	0.449	43%	0.434	S	S	.	.			trans	-120.8	82.3	-174.1	-72.4	-75.7	0	0	0	112.4	E1195 S1201 L1202	E1195-N1199 PolarHBondContact O-ND2 2.93Å; E1195-N1199 VanDerWaalsContact O-ND2 3.15Å; N1199-S1201 PolarHBondContact O-N 3.36Å; N1199-L1202 PolarHBondContact O-N 3.39Å
1200	E	52.6	Low	64.3	Low	135 Å²	135	80.9 Å²	80.9	63%	0.631	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-58.5	-17.3	179	-67	-156.7	111.4	0	0	114.6	K1177 N1203	K1177-E1200 WeakPolarHBondContact CE-OE1 3.43Å; K1177-E1200 IonicContact NZ-OE1 2.63Å; K1177-E1200 PolarHBondContact NZ-OE1 3.28Å; E1200-N1203 PolarHBondContact O-ND2 3.14Å
1201	S	56.9	Low	65.7	Low	102 Å²	102	76.2 Å²	76.2	71%	0.713	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-76.7	-16.6	-177.9	55.9	0	0	0	0	114.9	N1199	N1199-S1201 PolarHBondContact O-N 3.36Å
1202	L	58.1	Low	66.9	Low	90 Å²	90	76.4 Å²	76.4	47%	0.471	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-96.7	-0.5	-166.5	-119.6	84.6	0	0	0	116.2	N1199 K1204 S1205 I1206	N1199-L1202 PolarHBondContact O-N 3.39Å; L1202-K1204 VanDerWaalsContact C-N 3.3Å; L1202-K1204 PolarHBondContact O-N 2.96Å; L1202-S1205 PolarHBondContact O-N 3.02Å; L1202-I1206 HydrophobicContact CB-CD1 4.26Å; L1202-I1206 HydrophobicContact CB-CG1 4.27Å
1203	N	69.6	Low	67.9	Low	38 Å²	38	75.4 Å²	75.4	20%	0.203	38%	0.375	C	S	.	.	H	α-helix	trans	-44.5	-42	-159.8	-63.1	-51	0	0	0	116.2	L1176 E1200 S1205 I1206 V1207	L1176-N1203 HydrophobicContact CB-CB 3.85Å; E1200-N1203 PolarHBondContact O-ND2 3.14Å; N1203-S1205 VanDerWaalsContact C-N 3.32Å; N1203-S1205 PolarHBondContact O-N 2.92Å; N1203-I1206 WeakPolarHBondContact O-CB 3.46Å; N1203-I1206 PolarHBondContact O-N 3.13Å; N1203-V1207 WeakPolarHBondContact O-CG2 3.33Å; N1203-V1207 PolarHBondContact O-N 3.12Å
1204	K	77.3	Confident	68.7	Low	86 Å²	86	75.4 Å²	75.4	37%	0.374	38%	0.375	S	S	.	.	H	α-helix	trans	-57.4	-40.5	179.1	-72	-168	175.2	-162.6	0	113.9	L1176 L1202 H1208 G1224 S1225	L1176-K1204 HydrophobicContact CD1-CD 4.43Å; L1176-K1204 HydrophobicContact CD1-CG 3.54Å; L1202-K1204 VanDerWaalsContact C-N 3.3Å; L1202-K1204 PolarHBondContact O-N 2.96Å; K1204-H1208 PolarHBondContact O-N 3.08Å; K1204-G1224 WeakPolarHBondContact CE-O 3.48Å; K1204-G1224 PolarHBondContact NZ-O 3.26Å; K1204-S1225 WeakPolarHBondContact CE-O 3.18Å; K1204-S1225 PolarHBondContact NZ-O 3.19Å
1205	S	75.7	Confident	69.8	Low	71 Å²	71	74.3 Å²	74.3	50%	0.497	38%	0.378	S	S	.	.	H	α-helix	trans	-69.3	-39.4	180	-163.7	0	0	0	0	111.1	L1202 N1203 H1208 E1209	L1202-S1205 PolarHBondContact O-N 3.02Å; N1203-S1205 VanDerWaalsContact C-N 3.32Å; N1203-S1205 PolarHBondContact O-N 2.92Å; S1205-H1208 PolarHBondContact O-N 3.28Å; S1205-E1209 PolarHBondContact O-N 2.74Å
1206	I	74.6	Confident	70.9	Confident	6 Å²	6	69.3 Å²	69.3	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-62.2	-47.1	178.8	-42.8	-174.7	0	0	0	110.5	L1196 L1202 N1203 H1208 E1209 I1210	L1196-I1206 HydrophobicContact CB-CD1 4.33Å; L1196-I1206 HydrophobicContact CD1-CG2 4.18Å; L1196-I1206 HydrophobicContact CD2-CB 4.43Å; L1196-I1206 HydrophobicContact CD2-CD1 3.82Å; L1196-I1206 HydrophobicContact CD2-CG1 3.78Å; L1196-I1206 HydrophobicContact CD2-CG2 4.06Å; L1202-I1206 HydrophobicContact CB-CD1 4.26Å; L1202-I1206 HydrophobicContact CB-CG1 4.27Å; N1203-I1206 WeakPolarHBondContact O-CB 3.46Å; N1203-I1206 PolarHBondContact O-N 3.13Å; I1206-H1208 VanDerWaalsContact C-N 3.33Å; I1206-H1208 PolarHBondContact O-N 3.19Å; I1206-E1209 PolarHBondContact O-N 2.9Å; I1206-I1210 HydrophobicContact CG2-CD1 4.08Å; I1206-I1210 WeakPolarHBondContact O-CG1 3.49Å; I1206-I1210 PolarHBondContact O-N 3.1Å
1207	V	80.1	Confident	72.2	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-61.4	-40.8	177.7	175	0	0	0	0	111.4	L1176 F1179 N1203 L1211 L1223 I1228	L1176-V1207 HydrophobicContact CD2-CB 4.42Å; L1176-V1207 HydrophobicContact CD2-CG1 4.5Å; L1176-V1207 HydrophobicContact CD2-CG2 3.93Å; F1179-V1207 HydrophobicContact CB-CG2 4.47Å; F1179-V1207 HydrophobicContact CD1-CB 4.35Å; F1179-V1207 HydrophobicContact CD1-CG1 3.97Å; F1179-V1207 HydrophobicContact CD1-CG2 3.76Å; F1179-V1207 HydrophobicContact CE1-CG1 4Å; F1179-V1207 HydrophobicContact CE1-CG2 4.42Å; F1179-V1207 HydrophobicContact CG-CG1 4.46Å; F1179-V1207 HydrophobicContact CG-CG2 4.35Å; N1203-V1207 WeakPolarHBondContact O-CG2 3.33Å; N1203-V1207 PolarHBondContact O-N 3.12Å; V1207-L1211 HydrophobicContact CG1-CD1 4.02Å; V1207-L1211 PolarHBondContact O-N 3.3Å; V1207-L1211 VanDerWaalsContact O-N 3.09Å; V1207-L1223 HydrophobicContact CB-CD2 4.49Å; V1207-L1223 HydrophobicContact CG1-CD2 3.81Å; V1207-I1228 HydrophobicContact CG1-CB 4.47Å; V1207-I1228 HydrophobicContact CG1-CD1 3.51Å
1208	H	81.4	Confident	73.3	Confident	75 Å²	75	66 Å²	66	35%	0.347	35%	0.352	S	S	.	.	H	α-helix	trans	-63.1	-42.7	173.6	-114.2	-52	0	0	0	112.5	K1204 S1205 I1206 N1212 F1221 L1223	K1204-H1208 PolarHBondContact O-N 3.08Å; S1205-H1208 PolarHBondContact O-N 3.28Å; I1206-H1208 VanDerWaalsContact C-N 3.33Å; I1206-H1208 PolarHBondContact O-N 3.19Å; H1208-N1212 VanDerWaalsContact O-CB 3.23Å; H1208-N1212 WeakPolarHBondContact O-CB 3.39Å; H1208-N1212 PolarHBondContact O-N 3.43Å; H1208-N1212 PolarHBondContact O-ND2 3.19Å; H1208-N1212 PolarHBondContact O-OD1 3.02Å; H1208-F1221 AromaticContact CE1-CE2 3.52Å; H1208-F1221 AromaticContact CE1-CZ 3.55Å; H1208-F1221 AromaticContact ND1-CE2 3.72Å; H1208-F1221 AromaticContact ND1-CZ 3.56Å; H1208-L1223 WeakPolarHBondContact CD2-CD1 3.26Å
1209	E	77.9	Confident	74.4	Confident	65 Å²	65	63 Å²	63	30%	0.304	34%	0.338	S	S	.	.	H	α-helix	trans	-65	-43.5	178.3	-171.5	170.6	177	0	0	111.8	L1187 K1192 S1205 I1206 S1213	L1187-E1209 HydrophobicContact CD2-CG 4.45Å; K1192-E1209 IonicContact NZ-OE1 2.62Å; K1192-E1209 PolarHBondContact NZ-OE1 3.26Å; K1192-E1209 IonicContact NZ-OE2 2.71Å; K1192-E1209 PolarHBondContact NZ-OE2 3.22Å; S1205-E1209 PolarHBondContact O-N 2.74Å; I1206-E1209 PolarHBondContact O-N 2.9Å; E1209-S1213 VanDerWaalsContact O-CB 3.3Å; E1209-S1213 WeakPolarHBondContact O-CB 3.33Å; E1209-S1213 PolarHBondContact O-N 3.03Å; E1209-S1213 PolarHBondContact O-OG 3.15Å
1210	I	80.6	Confident	75.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-56.4	-56.1	174.7	-66.6	162.8	0	0	0	110.3	F1179 V1184 L1187 I1206 N1212 S1213 L1214	F1179-I1210 HydrophobicContact CD1-CD1 4.5Å; F1179-I1210 HydrophobicContact CE1-CB 4.35Å; F1179-I1210 HydrophobicContact CE1-CD1 4.19Å; F1179-I1210 HydrophobicContact CE1-CG2 4Å; F1179-I1210 HydrophobicContact CZ-CG2 4.45Å; V1184-I1210 HydrophobicContact CB-CD1 4.38Å; L1187-I1210 HydrophobicContact CD1-CG1 3.88Å; L1187-I1210 HydrophobicContact CD2-CG1 3.99Å; L1187-I1210 HydrophobicContact CG-CG1 3.86Å; I1206-I1210 HydrophobicContact CG2-CD1 4.08Å; I1206-I1210 WeakPolarHBondContact O-CG1 3.49Å; I1206-I1210 PolarHBondContact O-N 3.1Å; I1210-N1212 PolarHBondContact O-N 3.3Å; I1210-S1213 PolarHBondContact O-N 3.43Å; I1210-S1213 PolarHBondContact O-OG 3.03Å; I1210-L1214 HydrophobicContact CG2-CD1 3.87Å; I1210-L1214 WeakPolarHBondContact O-CG 3.32Å; I1210-L1214 PolarHBondContact O-N 2.81Å; I1210-L1214 VanDerWaalsContact O-N 3.14Å
1211	L	84	Confident	77.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66.8	-38	-174.4	-71.2	169.6	0	0	0	113.1	F1179 V1207 L1214 H1215 Y1216 F1221 I1228 L1238	F1179-L1211 HydrophobicContact CZ-CD1 4.23Å; F1179-L1211 HydrophobicContact CZ-CD2 3.88Å; F1179-L1211 HydrophobicContact CZ-CG 3.99Å; V1207-L1211 HydrophobicContact CG1-CD1 4.02Å; V1207-L1211 PolarHBondContact O-N 3.3Å; V1207-L1211 VanDerWaalsContact O-N 3.09Å; L1211-L1214 CarbonylContact O-C 3.29Å; L1211-L1214 PolarHBondContact O-N 3.3Å; L1211-H1215 PolarHBondContact O-N 2.87Å; L1211-Y1216 HydrophobicContact CD2-CD2 3.82Å; L1211-Y1216 HydrophobicContact CD2-CE2 4.46Å; L1211-Y1216 HydrophobicContact CD2-CG 4.26Å; L1211-Y1216 PolarHBondContact O-N 3.43Å; L1211-Y1216 VanDerWaalsContact O-N 3.08Å; L1211-F1221 HydrophobicContact CB-CE1 4Å; L1211-F1221 HydrophobicContact CB-CZ 4.14Å; L1211-F1221 HydrophobicContact CD1-CB 4.26Å; L1211-F1221 HydrophobicContact CD1-CD1 3.81Å; L1211-F1221 HydrophobicContact CD1-CD2 3.77Å; L1211-F1221 HydrophobicContact CD1-CE1 3.97Å; L1211-F1221 HydrophobicContact CD1-CE2 3.94Å; L1211-F1221 HydrophobicContact CD1-CG 3.71Å; L1211-F1221 HydrophobicContact CD1-CZ 4.03Å; L1211-I1228 HydrophobicContact CD1-CD1 3.52Å; L1211-L1238 HydrophobicContact CD2-CD1 4.37Å; L1211-L1238 HydrophobicContact CD2-CD2 4.45Å
1212	N	80.8	Confident	79	Confident	84 Å²	84	50.3 Å²	50.3	45%	0.449	26%	0.264	S	S	.	.	H	α-helix	trans	-65.7	-40.6	175.2	-69.3	-1	0	0	0	111.6	H1208 I1210 L1214 H1215	H1208-N1212 VanDerWaalsContact O-CB 3.23Å; H1208-N1212 WeakPolarHBondContact O-CB 3.39Å; H1208-N1212 PolarHBondContact O-N 3.43Å; H1208-N1212 PolarHBondContact O-ND2 3.19Å; H1208-N1212 PolarHBondContact O-OD1 3.02Å; I1210-N1212 PolarHBondContact O-N 3.3Å; N1212-L1214 PolarHBondContact O-N 3.4Å; N1212-H1215 PolarHBondContact O-N 3.32Å; N1212-H1215 VanDerWaalsContact O-N 3.13Å
1213	S	76.5	Confident	80.3	Confident	51 Å²	51	47.7 Å²	47.7	36%	0.357	25%	0.251	S	S	.	.	H	α-helix	trans	-65.5	-23.8	176	73	0	0	0	0	113.4	E1209 I1210	E1209-S1213 VanDerWaalsContact O-CB 3.3Å; E1209-S1213 WeakPolarHBondContact O-CB 3.33Å; E1209-S1213 PolarHBondContact O-N 3.03Å; E1209-S1213 PolarHBondContact O-OG 3.15Å; I1210-S1213 PolarHBondContact O-N 3.43Å; I1210-S1213 PolarHBondContact O-OG 3.03Å
1214	L	78	Confident	81.1	Confident	22 Å²	22	46 Å²	46	12%	0.115	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	10.9	176.6	-67.6	172	0	0	0	112.9	L1186 I1210 L1211 N1212 Y1216 L1238 R1241	L1186-L1214 HydrophobicContact CB-CD1 4.11Å; L1186-L1214 HydrophobicContact CB-CD2 4.36Å; L1186-L1214 HydrophobicContact CD1-CD1 3.77Å; I1210-L1214 HydrophobicContact CG2-CD1 3.87Å; I1210-L1214 WeakPolarHBondContact O-CG 3.32Å; I1210-L1214 PolarHBondContact O-N 2.81Å; I1210-L1214 VanDerWaalsContact O-N 3.14Å; L1211-L1214 CarbonylContact O-C 3.29Å; L1211-L1214 PolarHBondContact O-N 3.3Å; N1212-L1214 PolarHBondContact O-N 3.4Å; L1214-Y1216 VanDerWaalsContact C-N 3.28Å; L1214-Y1216 HydrophobicContact CB-CD2 3.74Å; L1214-Y1216 HydrophobicContact CB-CE2 3.88Å; L1214-Y1216 PolarHBondContact O-N 3.42Å; L1214-L1238 HydrophobicContact CD1-CD2 3.74Å; L1214-R1241 PolarHBondContact O-NH1 2.8Å
1215	H	81.7	Confident	81.3	Confident	176 Å²	176	44.7 Å²	44.7	82%	0.815	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	28.4	178.4	-55.1	-57.5	0	0	0	115.5	L1211 N1212	L1211-H1215 PolarHBondContact O-N 2.87Å; N1212-H1215 PolarHBondContact O-N 3.32Å; N1212-H1215 VanDerWaalsContact O-N 3.13Å
1216	Y	80.6	Confident	81.5	Confident	21 Å²	21	46.8 Å²	46.8	8%	0.082	25%	0.249	C	C	.	.			trans	-78.3	132.1	171.2	-74	-77	0	0	0	111.3	L1211 L1214 I1234 Q1237 L1238	L1211-Y1216 HydrophobicContact CD2-CD2 3.82Å; L1211-Y1216 HydrophobicContact CD2-CE2 4.46Å; L1211-Y1216 HydrophobicContact CD2-CG 4.26Å; L1211-Y1216 PolarHBondContact O-N 3.43Å; L1211-Y1216 VanDerWaalsContact O-N 3.08Å; L1214-Y1216 VanDerWaalsContact C-N 3.28Å; L1214-Y1216 HydrophobicContact CB-CD2 3.74Å; L1214-Y1216 HydrophobicContact CB-CE2 3.88Å; L1214-Y1216 PolarHBondContact O-N 3.42Å; Y1216-I1234 HydrophobicContact CD1-CD1 3.99Å; Y1216-I1234 HydrophobicContact CD1-CG2 4.47Å; Y1216-I1234 HydrophobicContact CE1-CD1 3.74Å; Y1216-I1234 HydrophobicContact CE1-CG2 4.13Å; Y1216-Q1237 WeakPolarHBondContact OH-CB 3.39Å; Y1216-L1238 HydrophobicContact CD2-CD2 4.47Å; Y1216-L1238 HydrophobicContact CE2-CD2 3.62Å; Y1216-L1238 HydrophobicContact CE2-CG 4.34Å
1217	S	81.3	Confident	82	Confident	28 Å²	28	47 Å²	47	20%	0.196	25%	0.25	C	S	.	.			trans	-66.7	143.7	176	170.2	0	0	0	0	111.2	E1219 T1220	S1217-E1219 PolarHBondContact O-N 3.19Å; S1217-E1219 PolarHBondContact OG-N 2.76Å; S1217-T1220 PolarHBondContact O-N 3.23Å; S1217-T1220 PolarHBondContact O-OG1 3.14Å
1218	P	80.1	Confident	82.4	Confident	92 Å²	92	47 Å²	47	60%	0.597	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-53.8	-20.4	172	-26.8	35.6	0	0	0	114.7	T1220 F1221	P1218-T1220 VanDerWaalsContact C-N 3.27Å; P1218-T1220 PolarHBondContact O-N 2.78Å; P1218-F1221 VanDerWaalsContact O-O 3.06Å
1219	E	80.6	Confident	82.7	Confident	98 Å²	98	43.5 Å²	43.5	46%	0.458	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-71.4	-18.3	174.7	-60.9	-177.3	146.3	0	0	114	H253 Y1170 S1217 R1231	H253-E1219 IonicContact CE1-OE2 2.73Å; H253-E1219 IonicContact ND1-OE2 2.94Å; H253-E1219 PolarHBondContact ND1-OE2 3.4Å; Y1170-E1219 WeakPolarHBondContact CE1-O 3.24Å; Y1170-E1219 PolarHBondContact OH-O 2.71Å; S1217-E1219 PolarHBondContact O-N 3.19Å; S1217-E1219 PolarHBondContact OG-N 2.76Å; E1219-R1231 VanDerWaalsContact O-CZ 3.3Å; E1219-R1231 PolarHBondContact O-NE 2.85Å; E1219-R1231 PolarHBondContact O-NH2 2.85Å
1220	T	83.1	Confident	83.2	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.031	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-86.7	-8.5	-173.2	63.5	0	0	0	0	113.6	S1217 P1218 R1231 I1234	S1217-T1220 PolarHBondContact O-N 3.23Å; S1217-T1220 PolarHBondContact O-OG1 3.14Å; P1218-T1220 VanDerWaalsContact C-N 3.27Å; P1218-T1220 PolarHBondContact O-N 2.78Å; T1220-R1231 PolarHBondContact O-N 2.87Å; T1220-I1234 HydrophobicContact CG2-CD1 4.42Å
1221	F	88.3	Confident	83.3	Confident	8 Å²	8	42.9 Å²	42.9	4%	0.035	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	158.7	-178.2	66.3	-85.2	0	0	0	113.1	H1208 L1211 P1218 L1223 I1228 Y1229 L1230	H1208-F1221 AromaticContact CE1-CE2 3.52Å; H1208-F1221 AromaticContact CE1-CZ 3.55Å; H1208-F1221 AromaticContact ND1-CE2 3.72Å; H1208-F1221 AromaticContact ND1-CZ 3.56Å; L1211-F1221 HydrophobicContact CB-CE1 4Å; L1211-F1221 HydrophobicContact CB-CZ 4.14Å; L1211-F1221 HydrophobicContact CD1-CB 4.26Å; L1211-F1221 HydrophobicContact CD1-CD1 3.81Å; L1211-F1221 HydrophobicContact CD1-CD2 3.77Å; L1211-F1221 HydrophobicContact CD1-CE1 3.97Å; L1211-F1221 HydrophobicContact CD1-CE2 3.94Å; L1211-F1221 HydrophobicContact CD1-CG 3.71Å; L1211-F1221 HydrophobicContact CD1-CZ 4.03Å; P1218-F1221 VanDerWaalsContact O-O 3.06Å; F1221-L1223 HydrophobicContact CD2-CD2 4.3Å; F1221-L1223 HydrophobicContact CD2-CG 4.26Å; F1221-L1223 HydrophobicContact CE2-CD1 4.48Å; F1221-L1223 HydrophobicContact CE2-CG 4.36Å; F1221-I1228 HydrophobicContact CB-CD1 4.09Å; F1221-I1228 HydrophobicContact CB-CG1 4.44Å; F1221-I1228 HydrophobicContact CD2-CD1 4.26Å; F1221-I1228 HydrophobicContact CG-CD1 4.47Å; F1221-Y1229 CarbonylContact C-O 3.43Å; F1221-Y1229 WeakPolarHBondContact CA-O 3.02Å; F1221-Y1229 WeakPolarHBondContact CB-O 3.49Å; F1221-L1230 HydrophobicContact CB-CD2 3.6Å
1222	Q	88	Confident	83	Confident	41 Å²	41	43.8 Å²	43.8	19%	0.192	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	146.3	168.4	-69.4	-170.7	-8.5	0	0	110.8	L852 Y1170 Y1229	L852-Q1222 HydrophobicContact CD1-CB 3.86Å; L852-Q1222 HydrophobicContact CD2-CB 4.2Å; Y1170-Q1222 HydrophobicContact CD1-CG 4.47Å; Y1170-Q1222 HydrophobicContact CD2-CG 4.32Å; Y1170-Q1222 HydrophobicContact CE1-CG 4.05Å; Y1170-Q1222 HydrophobicContact CE2-CG 3.89Å; Q1222-Y1229 PolarHBondContact N-O 2.61Å; Q1222-Y1229 PolarHBondContact O-N 2.88Å
1223	L	86.8	Confident	82.6	Confident	35 Å²	35	41.7 Å²	41.7	18%	0.183	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	94.5	-178.6	-60.3	179.7	0	0	0	110.7	L1176 V1207 H1208 F1221 I1228	L1176-L1223 HydrophobicContact CD2-CD2 3.95Å; V1207-L1223 HydrophobicContact CB-CD2 4.49Å; V1207-L1223 HydrophobicContact CG1-CD2 3.81Å; H1208-L1223 WeakPolarHBondContact CD2-CD1 3.26Å; F1221-L1223 HydrophobicContact CD2-CD2 4.3Å; F1221-L1223 HydrophobicContact CD2-CG 4.26Å; F1221-L1223 HydrophobicContact CE2-CD1 4.48Å; F1221-L1223 HydrophobicContact CE2-CG 4.36Å; L1223-I1228 HydrophobicContact CD2-CB 3.85Å; L1223-I1228 HydrophobicContact CD2-CD1 3.91Å; L1223-I1228 HydrophobicContact CD2-CG1 3.86Å
1224	G	85.1	Confident	82.9	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.01	21%	0.208	C	C	.	.			trans	-67.3	-176.5	172.9	0	0	0	0	0	112.1	D850 K1204 N1226 N1227	D850-G1224 WeakPolarHBondContact O-CA 3.32Å; K1204-G1224 WeakPolarHBondContact CE-O 3.48Å; K1204-G1224 PolarHBondContact NZ-O 3.26Å; G1224-N1226 PolarHBondContact O-N 3.14Å; G1224-N1227 PolarHBondContact N-O 2.77Å
1225	S	82.3	Confident	83	Confident	59 Å²	59	39 Å²	39	41%	0.413	20%	0.203	S	C	.	.	S	Bend	trans	-48.6	-53.5	179	72.4	0	0	0	0	113.2	D850 K1204	D850-S1225 PolarHBondContact O-N 3.38Å; D850-S1225 WeakPolarHBondContact OD1-CA 3.49Å; D850-S1225 WeakPolarHBondContact OD1-CB 3.07Å; D850-S1225 PolarHBondContact OD1-N 2.87Å; D850-S1225 PolarHBondContact OD1-OG 3.31Å; K1204-S1225 WeakPolarHBondContact CE-O 3.18Å; K1204-S1225 PolarHBondContact NZ-O 3.19Å
1226	N	79.2	Confident	82.4	Confident	115 Å²	115	32.2 Å²	32.2	62%	0.615	18%	0.175	S	C	*	.	S	Bend	trans	-124.2	-7.1	-173.8	-70	-43.2	0	0	0	114.2	D850 L1176 G1224	D850-N1226 PolarHBondContact OD1-N 2.9Å; L1176-N1226 WeakPolarHBondContact CD1-O 3.17Å; L1176-N1226 VanDerWaalsContact CG-O 3.26Å; L1176-N1226 WeakPolarHBondContact CG-O 3.05Å; L1176-N1226 PolarHBondContact N-O 3.35Å; L1176-N1226 VanDerWaalsContact N-O 3.08Å; G1224-N1226 PolarHBondContact O-N 3.14Å
1227	N	85.9	Confident	82.2	Confident	11 Å²	11	35.4 Å²	35.4	6%	0.059	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	150.6	-168	-54.9	-44.5	0	0	0	111.6	D850 P1052 L1174 G1224 Y1229	D850-N1227 PolarHBondContact OD2-ND2 3.49Å; P1052-N1227 WeakPolarHBondContact CD-OD1 3.17Å; P1052-N1227 HydrophobicContact CG-CB 4.49Å; P1052-N1227 WeakPolarHBondContact CG-OD1 3.33Å; L1174-N1227 CarbonylContact O-C 3.57Å; L1174-N1227 WeakPolarHBondContact O-CA 3.46Å; G1224-N1227 PolarHBondContact N-O 2.77Å; N1227-Y1229 HydrophobicContact CB-CE2 3.86Å
1228	I	87.9	Confident	82	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	134.5	163.4	177	166.2	0	0	0	109.5	R1173 L1174 L1176 F1179 V1207 L1211 F1221 L1223 L1230	R1173-I1228 CarbonylContact C-O 3.42Å; R1173-I1228 WeakPolarHBondContact CA-O 3.42Å; R1173-I1228 VanDerWaalsContact CB-O 3.24Å; R1173-I1228 WeakPolarHBondContact CB-O 2.97Å; L1174-I1228 HydrophobicContact CB-CG2 4.01Å; L1174-I1228 PolarHBondContact N-O 2.84Å; L1174-I1228 PolarHBondContact O-N 2.89Å; L1176-I1228 HydrophobicContact CD2-CB 4.01Å; L1176-I1228 HydrophobicContact CD2-CG2 4.42Å; F1179-I1228 HydrophobicContact CB-CG2 3.88Å; F1179-I1228 HydrophobicContact CD2-CD1 4.31Å; F1179-I1228 HydrophobicContact CD2-CG2 3.74Å; F1179-I1228 HydrophobicContact CE2-CD1 4.18Å; F1179-I1228 HydrophobicContact CG-CG2 3.98Å; V1207-I1228 HydrophobicContact CG1-CB 4.47Å; V1207-I1228 HydrophobicContact CG1-CD1 3.51Å; L1211-I1228 HydrophobicContact CD1-CD1 3.52Å; F1221-I1228 HydrophobicContact CB-CD1 4.09Å; F1221-I1228 HydrophobicContact CB-CG1 4.44Å; F1221-I1228 HydrophobicContact CD2-CD1 4.26Å; F1221-I1228 HydrophobicContact CG-CD1 4.47Å; L1223-I1228 HydrophobicContact CD2-CB 3.85Å; L1223-I1228 HydrophobicContact CD2-CD1 3.91Å; L1223-I1228 HydrophobicContact CD2-CG1 3.86Å; I1228-L1230 HydrophobicContact CD1-CD2 3.65Å; I1228-L1230 HydrophobicContact CD1-CG 4.23Å; I1228-L1230 HydrophobicContact CG1-CD2 3.93Å; I1228-L1230 HydrophobicContact CG1-CG 4.08Å
1229	Y	87.8	Confident	81.5	Confident	1 Å²	1	33.4 Å²	33.4	0%	0.004	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	138.2	172	-67	-96.6	0	0	0	108.9	R846 L847 D850 L852 R1173 F1221 Q1222 N1227	R846-Y1229 HydrophobicContact CG-CE1 3.99Å; L847-Y1229 HydrophobicContact CD2-CD1 3.66Å; L847-Y1229 HydrophobicContact CD2-CD2 4.41Å; L847-Y1229 HydrophobicContact CD2-CE1 3.95Å; L847-Y1229 HydrophobicContact CD2-CG 3.93Å; D850-Y1229 HydrophobicContact CB-CE2 3.87Å; D850-Y1229 WeakPolarHBondContact OD2-CE2 3.42Å; D850-Y1229 VanDerWaalsContact OD2-CZ 3.31Å; D850-Y1229 PolarHBondContact OD2-OH 3.03Å; L852-Y1229 HydrophobicContact CD1-CD2 3.49Å; L852-Y1229 VanDerWaalsContact CD1-CD2 3.49Å; L852-Y1229 HydrophobicContact CD1-CE2 3.89Å; L852-Y1229 HydrophobicContact CD1-CG 4.14Å; R1173-Y1229 HydrophobicContact CB-CD1 3.84Å; R1173-Y1229 HydrophobicContact CB-CE1 4.04Å; R1173-Y1229 HydrophobicContact CB-CG 4.28Å; R1173-Y1229 VanDerWaalsContact CD-CE1 3.48Å; R1173-Y1229 HydrophobicContact CG-CE1 4.31Å; R1173-Y1229 PolarHBondContact NH1-OH 3.23Å; F1221-Y1229 CarbonylContact C-O 3.43Å; F1221-Y1229 WeakPolarHBondContact CA-O 3.02Å; F1221-Y1229 WeakPolarHBondContact CB-O 3.49Å; Q1222-Y1229 PolarHBondContact N-O 2.61Å; Q1222-Y1229 PolarHBondContact O-N 2.88Å; N1227-Y1229 HydrophobicContact CB-CE2 3.86Å
1230	L	87.7	Confident	80.7	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	145	-172.1	-68	175.4	0	0	0	110.5	Y1170 D1172 F1179 F1221 I1228 I1234 I1235	Y1170-L1230 CarbonylContact C-O 3.37Å; Y1170-L1230 WeakPolarHBondContact CA-O 3.33Å; D1172-L1230 HydrophobicContact CB-CB 4.11Å; D1172-L1230 PolarHBondContact N-O 2.99Å; D1172-L1230 PolarHBondContact O-N 3.3Å; F1179-L1230 HydrophobicContact CE2-CD1 4.2Å; F1221-L1230 HydrophobicContact CB-CD2 3.6Å; I1228-L1230 HydrophobicContact CD1-CD2 3.65Å; I1228-L1230 HydrophobicContact CD1-CG 4.23Å; I1228-L1230 HydrophobicContact CG1-CD2 3.93Å; I1228-L1230 HydrophobicContact CG1-CG 4.08Å; L1230-I1234 HydrophobicContact CB-CB 4.35Å; L1230-I1234 HydrophobicContact CD1-CG2 4.38Å; L1230-I1234 HydrophobicContact CD2-CG2 4.02Å; L1230-I1235 HydrophobicContact CD1-CD1 3.88Å; L1230-I1235 HydrophobicContact CD1-CG1 3.38Å
1231	R	84.2	Confident	79.9	Confident	52 Å²	52	34.2 Å²	34.2	20%	0.196	17%	0.172	C	C	.	.			trans	-66.2	155.2	167.1	-67	-167	-168.9	-123.4	0.1	110.9	K1167 Y1170 E1219 T1220 I1234	K1167-R1231 PolarHBondContact O-NH1 2.95Å; Y1170-R1231 HydrophobicContact CD1-CG 3.74Å; Y1170-R1231 HydrophobicContact CE1-CG 3.8Å; Y1170-R1231 PolarHBondContact OH-NH2 3.01Å; E1219-R1231 VanDerWaalsContact O-CZ 3.3Å; E1219-R1231 PolarHBondContact O-NE 2.85Å; E1219-R1231 PolarHBondContact O-NH2 2.85Å; T1220-R1231 PolarHBondContact O-N 2.87Å; R1231-I1234 HydrophobicContact CB-CG1 4.17Å; R1231-I1234 WeakPolarHBondContact O-CB 3.33Å; R1231-I1234 WeakPolarHBondContact O-CG1 3.25Å; R1231-I1234 PolarHBondContact O-N 2.84Å
1232	T	76.4	Confident	78.7	Confident	20 Å²	20	35.8 Å²	35.8	12%	0.123	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	141.3	178.5	-28.4	0	0	0	0	111.7	Y398 P1171 I1234	Y398-T1232 HydrophobicContact CE1-CG2 4.26Å; Y398-T1232 WeakPolarHBondContact OH-CG2 3.49Å; P1171-T1232 HydrophobicContact CG-CG2 4.43Å; P1171-T1232 WeakPolarHBondContact CG-OG1 3.44Å; T1232-I1234 PolarHBondContact O-N 3.48Å
1233	F	74	Confident	77	Confident	39 Å²	39	35.7 Å²	35.7	17%	0.171	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	-6.8	-177.7	-57.5	-86.8	0	0	0	117.5	I339 K340 Y398 I1235 P1236 Q1237	I339-F1233 HydrophobicContact CG2-CD2 4.46Å; I339-F1233 HydrophobicContact CG2-CE2 3.48Å; I339-F1233 VanDerWaalsContact CG2-CE2 3.48Å; I339-F1233 HydrophobicContact CG2-CZ 4.14Å; K340-F1233 HydrophobicContact CD-CZ 4.49Å; K340-F1233 VanDerWaalsContact CE-CE1 3.45Å; K340-F1233 VanDerWaalsContact CE-CZ 3.4Å; K340-F1233 HydrophobicContact CG-CE2 4.35Å; K340-F1233 HydrophobicContact CG-CZ 4.3Å; Y398-F1233 HydrophobicContact CD1-CD1 4Å; Y398-F1233 AromaticContact CD1-CE1 3.38Å; Y398-F1233 HydrophobicContact CD1-CE1 3.38Å; Y398-F1233 AromaticContact CD1-CZ 3.79Å; Y398-F1233 HydrophobicContact CD1-CZ 3.79Å; Y398-F1233 HydrophobicContact CE1-CD1 4.02Å; Y398-F1233 AromaticContact CE1-CE1 3.58Å; Y398-F1233 HydrophobicContact CE1-CE1 3.58Å; Y398-F1233 HydrophobicContact CE1-CE2 4.15Å; Y398-F1233 HydrophobicContact CE1-CG 4.48Å; Y398-F1233 AromaticContact CE1-CZ 3.63Å; Y398-F1233 HydrophobicContact CE1-CZ 3.63Å; Y398-F1233 HydrophobicContact CG-CE1 4.28Å; F1233-I1235 VanDerWaalsContact C-N 3.33Å; F1233-I1235 PolarHBondContact O-N 2.8Å; F1233-P1236 WeakPolarHBondContact O-CD 3.49Å; F1233-Q1237 VanDerWaalsContact O-CG 3.31Å; F1233-Q1237 WeakPolarHBondContact O-CG 3.31Å; F1233-Q1237 PolarHBondContact O-N 2.95Å
1234	I	82.7	Confident	75.2	Confident	13 Å²	13	36.9 Å²	36.9	7%	0.067	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-38.6	176.4	-59	-68	0	0	0	111.2	Y1216 T1220 L1230 R1231 T1232 Q1237 L1238	Y1216-I1234 HydrophobicContact CD1-CD1 3.99Å; Y1216-I1234 HydrophobicContact CD1-CG2 4.47Å; Y1216-I1234 HydrophobicContact CE1-CD1 3.74Å; Y1216-I1234 HydrophobicContact CE1-CG2 4.13Å; T1220-I1234 HydrophobicContact CG2-CD1 4.42Å; L1230-I1234 HydrophobicContact CB-CB 4.35Å; L1230-I1234 HydrophobicContact CD1-CG2 4.38Å; L1230-I1234 HydrophobicContact CD2-CG2 4.02Å; R1231-I1234 HydrophobicContact CB-CG1 4.17Å; R1231-I1234 WeakPolarHBondContact O-CB 3.33Å; R1231-I1234 WeakPolarHBondContact O-CG1 3.25Å; R1231-I1234 PolarHBondContact O-N 2.84Å; T1232-I1234 PolarHBondContact O-N 3.48Å; I1234-Q1237 PolarHBondContact O-N 3.49Å; I1234-L1238 HydrophobicContact CG2-CD1 4.04Å; I1234-L1238 HydrophobicContact CG2-CG 4.37Å; I1234-L1238 WeakPolarHBondContact O-CG 3.41Å; I1234-L1238 PolarHBondContact O-N 2.89Å
1235	I	78.2	Confident	73.5	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-50.7	176.4	-66.9	-178.5	0	0	0	112.2	N1060 D1172 L1174 L1230 F1233 Q1237 L1238 I1239	N1060-I1235 HydrophobicContact CB-CD1 3.63Å; N1060-I1235 WeakPolarHBondContact OD1-CD1 3.48Å; D1172-I1235 HydrophobicContact CB-CD1 3.86Å; D1172-I1235 HydrophobicContact CB-CG1 4.35Å; L1174-I1235 HydrophobicContact CD1-CD1 3.81Å; L1174-I1235 HydrophobicContact CD1-CG1 4.4Å; L1174-I1235 HydrophobicContact CG-CD1 4.15Å; L1230-I1235 HydrophobicContact CD1-CD1 3.88Å; L1230-I1235 HydrophobicContact CD1-CG1 3.38Å; F1233-I1235 VanDerWaalsContact C-N 3.33Å; F1233-I1235 PolarHBondContact O-N 2.8Å; I1235-Q1237 VanDerWaalsContact C-N 3.25Å; I1235-Q1237 PolarHBondContact O-N 3.37Å; I1235-L1238 PolarHBondContact O-N 2.89Å; I1235-L1238 VanDerWaalsContact O-N 3.08Å; I1235-I1239 HydrophobicContact CG2-CD1 3.65Å; I1235-I1239 HydrophobicContact CG2-CG1 4.21Å; I1235-I1239 WeakPolarHBondContact O-CG1 3.39Å; I1235-I1239 PolarHBondContact O-N 3.01Å
1236	P	69.6	Low	71.6	Confident	34 Å²	34	40.1 Å²	40.1	22%	0.221	21%	0.207	C	C	.	.	H	α-helix	trans	-49.9	-41.6	168.9	-32.4	35.3	0	0	0	114.1	Y398 F1233 H1240	Y398-P1236 HydrophobicContact CD2-CG 3.43Å; Y398-P1236 VanDerWaalsContact CD2-CG 3.43Å; Y398-P1236 HydrophobicContact CE2-CG 3.65Å; Y398-P1236 HydrophobicContact CG-CG 4Å; F1233-P1236 WeakPolarHBondContact O-CD 3.49Å; P1236-H1240 WeakPolarHBondContact O-CB 3.37Å; P1236-H1240 PolarHBondContact O-N 3.28Å
1237	Q	76	Confident	69.7	Low	89 Å²	89	42.7 Å²	42.7	42%	0.416	22%	0.215	S	C	.	.	H	α-helix	trans	-67.3	-36.1	176.9	-69.7	170.8	11.8	0	0	113.1	Y1216 F1233 I1234 I1235 R1241	Y1216-Q1237 WeakPolarHBondContact OH-CB 3.39Å; F1233-Q1237 VanDerWaalsContact O-CG 3.31Å; F1233-Q1237 WeakPolarHBondContact O-CG 3.31Å; F1233-Q1237 PolarHBondContact O-N 2.95Å; I1234-Q1237 PolarHBondContact O-N 3.49Å; I1235-Q1237 VanDerWaalsContact C-N 3.25Å; I1235-Q1237 PolarHBondContact O-N 3.37Å; Q1237-R1241 WeakPolarHBondContact O-CB 3.42Å; Q1237-R1241 WeakPolarHBondContact O-CG 3.46Å; Q1237-R1241 PolarHBondContact O-N 3.47Å
1238	L	78	Confident	67.6	Low	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-70.6	-44.8	175.3	-71.2	169.3	0	0	0	112.1	F1179 F1183 L1186 L1211 L1214 Y1216 I1234 I1235 H1240 R1241 L1242	F1179-L1238 HydrophobicContact CE2-CD1 3.69Å; F1179-L1238 HydrophobicContact CZ-CD1 3.92Å; F1183-L1238 HydrophobicContact CD1-CB 3.95Å; F1183-L1238 HydrophobicContact CD2-CD1 4.46Å; F1183-L1238 HydrophobicContact CE1-CB 3.56Å; F1183-L1238 HydrophobicContact CE2-CB 4.49Å; F1183-L1238 HydrophobicContact CE2-CD1 4.33Å; F1183-L1238 HydrophobicContact CZ-CB 3.86Å; F1183-L1238 HydrophobicContact CZ-CD1 4.47Å; L1186-L1238 HydrophobicContact CD1-CD2 4.33Å; L1211-L1238 HydrophobicContact CD2-CD1 4.37Å; L1211-L1238 HydrophobicContact CD2-CD2 4.45Å; L1214-L1238 HydrophobicContact CD1-CD2 3.74Å; Y1216-L1238 HydrophobicContact CD2-CD2 4.47Å; Y1216-L1238 HydrophobicContact CE2-CD2 3.62Å; Y1216-L1238 HydrophobicContact CE2-CG 4.34Å; I1234-L1238 HydrophobicContact CG2-CD1 4.04Å; I1234-L1238 HydrophobicContact CG2-CG 4.37Å; I1234-L1238 WeakPolarHBondContact O-CG 3.41Å; I1234-L1238 PolarHBondContact O-N 2.89Å; I1235-L1238 PolarHBondContact O-N 2.89Å; I1235-L1238 VanDerWaalsContact O-N 3.08Å; L1238-H1240 VanDerWaalsContact C-N 3.31Å; L1238-H1240 PolarHBondContact O-N 2.72Å; L1238-R1241 PolarHBondContact O-N 2.93Å; L1238-L1242 WeakPolarHBondContact O-CB 3.47Å; L1238-L1242 PolarHBondContact O-N 3.5Å
1239	I	68.9	Low	65.4	Low	77 Å²	77	46.9 Å²	46.9	40%	0.395	24%	0.239	S	C	.	.	H	α-helix	trans	-61.6	-42.2	174.6	-66.2	172.2	0	0	0	110.5	F1183 I1235 L1242 S1243	F1183-I1239 HydrophobicContact CE1-CG1 4.07Å; F1183-I1239 HydrophobicContact CZ-CG1 4.08Å; I1235-I1239 HydrophobicContact CG2-CD1 3.65Å; I1235-I1239 HydrophobicContact CG2-CG1 4.21Å; I1235-I1239 WeakPolarHBondContact O-CG1 3.39Å; I1235-I1239 PolarHBondContact O-N 3.01Å; I1239-L1242 PolarHBondContact O-N 3.27Å; I1239-S1243 PolarHBondContact O-N 2.94Å; I1239-S1243 PolarHBondContact O-OG 3.31Å
1240	H	63.5	Low	63.3	Low	47 Å²	47	52 Å²	52	22%	0.218	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-52.4	172	-179.9	-83.6	0	0	0	111	P1236 L1238 L1242 S1243 Y1244	P1236-H1240 WeakPolarHBondContact O-CB 3.37Å; P1236-H1240 PolarHBondContact O-N 3.28Å; L1238-H1240 VanDerWaalsContact C-N 3.31Å; L1238-H1240 PolarHBondContact O-N 2.72Å; H1240-L1242 PolarHBondContact O-N 2.91Å; H1240-S1243 PolarHBondContact O-N 3.39Å; H1240-S1243 VanDerWaalsContact O-N 3.11Å; H1240-S1243 PolarHBondContact O-OG 3.3Å; H1240-Y1244 AromaticContact CD2-CE2 3.75Å; H1240-Y1244 AromaticContact CE1-CE2 3.27Å; H1240-Y1244 WeakPolarHBondContact CE1-CE2 3.48Å; H1240-Y1244 AromaticContact CE1-CZ 3.75Å; H1240-Y1244 AromaticContact CG-CE2 3.82Å; H1240-Y1244 AromaticContact ND1-CE2 3.53Å; H1240-Y1244 AromaticContact NE2-CE2 3.41Å; H1240-Y1244 WeakPolarHBondContact NE2-CE2 3.39Å; H1240-Y1244 AromaticContact NE2-CZ 3.57Å; H1240-Y1244 PolarHBondContact NE2-OH 3.35Å; H1240-Y1244 WeakPolarHBondContact O-CD2 3.34Å; H1240-Y1244 WeakPolarHBondContact O-CE2 3.43Å
1241	R	66.5	Low	61	Low	73 Å²	73	53.4 Å²	53.4	28%	0.275	27%	0.273	S	S	.	.	H	α-helix	trans	-59.1	-33.9	177.6	-76.1	-179.5	179.1	-178.2	0.8	112.7	D250 L1186 L1214 Q1237 L1238 S1243 Y1244	D250-R1241 IonicContact OD1-NH2 2.65Å; D250-R1241 PolarHBondContact OD1-NH2 3.2Å; L1186-R1241 HydrophobicContact CD2-CB 4.41Å; L1214-R1241 PolarHBondContact O-NH1 2.8Å; Q1237-R1241 WeakPolarHBondContact O-CB 3.42Å; Q1237-R1241 WeakPolarHBondContact O-CG 3.46Å; Q1237-R1241 PolarHBondContact O-N 3.47Å; L1238-R1241 PolarHBondContact O-N 2.93Å; R1241-S1243 VanDerWaalsContact C-N 3.26Å; R1241-S1243 PolarHBondContact O-N 3.01Å; R1241-Y1244 PolarHBondContact O-N 2.86Å
1242	L	63.3	Low	59	Low	41 Å²	41	56.2 Å²	56.2	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-69.3	-17.9	178.6	-160.2	133.9	0	0	0	114.5	R1182 F1183 L1186 L1238 I1239 H1240 S1245	R1182-L1242 WeakPolarHBondContact O-CD1 3.48Å; F1183-L1242 HydrophobicContact CD1-CD1 3.73Å; F1183-L1242 HydrophobicContact CE1-CD1 4.34Å; L1186-L1242 HydrophobicContact CD1-CB 4.49Å; L1186-L1242 HydrophobicContact CD1-CD1 4.3Å; L1186-L1242 HydrophobicContact CD2-CB 4.3Å; L1186-L1242 HydrophobicContact CG-CD1 4.13Å; L1238-L1242 WeakPolarHBondContact O-CB 3.47Å; L1238-L1242 PolarHBondContact O-N 3.5Å; I1239-L1242 PolarHBondContact O-N 3.27Å; H1240-L1242 PolarHBondContact O-N 2.91Å; L1242-S1245 PolarHBondContact O-OG 2.95Å
1243	S	53.3	Low	57.3	Low	40 Å²	40	62 Å²	62	28%	0.28	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-1.2	178.6	26.2	0	0	0	0	114.4	I1239 H1240 R1241	I1239-S1243 PolarHBondContact O-N 2.94Å; I1239-S1243 PolarHBondContact O-OG 3.31Å; H1240-S1243 PolarHBondContact O-N 3.39Å; H1240-S1243 VanDerWaalsContact O-N 3.11Å; H1240-S1243 PolarHBondContact O-OG 3.3Å; R1241-S1243 VanDerWaalsContact C-N 3.26Å; R1241-S1243 PolarHBondContact O-N 3.01Å
1244	Y	48.3	Very low	55.9	Low	59 Å²	59	63.3 Å²	63.3	23%	0.231	32%	0.322	C	S	.	.	S	Bend	trans	-122.4	4	175.2	-50	-99.1	0	0	0	114.5	L234 Y235 K238 H1240 R1241 P1246	L234-Y1244 PolarHBondContact O-OH 3.44Å; Y235-Y1244 VanDerWaalsContact CA-OH 3.25Å; Y235-Y1244 WeakPolarHBondContact CA-OH 3.28Å; Y235-Y1244 HydrophobicContact CD2-CE1 4.11Å; Y235-Y1244 PolarHBondContact N-OH 2.67Å; Y235-Y1244 VanDerWaalsContact N-OH 3.13Å; K238-Y1244 HydrophobicContact CB-CE1 4.17Å; K238-Y1244 HydrophobicContact CD-CD1 4.3Å; K238-Y1244 HydrophobicContact CD-CE1 4.01Å; H1240-Y1244 AromaticContact CD2-CE2 3.75Å; H1240-Y1244 AromaticContact CE1-CE2 3.27Å; H1240-Y1244 WeakPolarHBondContact CE1-CE2 3.48Å; H1240-Y1244 AromaticContact CE1-CZ 3.75Å; H1240-Y1244 AromaticContact CG-CE2 3.82Å; H1240-Y1244 AromaticContact ND1-CE2 3.53Å; H1240-Y1244 AromaticContact NE2-CE2 3.41Å; H1240-Y1244 WeakPolarHBondContact NE2-CE2 3.39Å; H1240-Y1244 AromaticContact NE2-CZ 3.57Å; H1240-Y1244 PolarHBondContact NE2-OH 3.35Å; H1240-Y1244 WeakPolarHBondContact O-CD2 3.34Å; H1240-Y1244 WeakPolarHBondContact O-CE2 3.43Å; R1241-Y1244 PolarHBondContact O-N 2.86Å; Y1244-P1246 WeakPolarHBondContact O-CD 3.21Å
1245	S	49.4	Very low	54.3	Low	21 Å²	21	67.6 Å²	67.6	15%	0.147	34%	0.344	C	S	.	.			trans	-65.6	111.9	177.6	41.2	0	0	0	0	110.4	L1242 E1247 L1248	L1242-S1245 PolarHBondContact O-OG 2.95Å; S1245-E1247 VanDerWaalsContact C-N 3.26Å; S1245-E1247 PolarHBondContact O-N 2.66Å; S1245-E1247 VanDerWaalsContact O-N 3.16Å; S1245-L1248 PolarHBondContact O-N 3.13Å
1246	P	42.4	Very low	52.9	Low	108 Å²	108	74.2 Å²	74.2	70%	0.701	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-24.2	-166.4	-24.4	35.8	0	0	0	115	Y1244	Y1244-P1246 WeakPolarHBondContact O-CD 3.21Å
1247	E	39.9	Very low	52	Low	169 Å²	169	76.1 Å²	76.1	79%	0.79	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-8.3	-172.5	-57.5	-176.1	151.4	0	0	114	S1245	S1245-E1247 VanDerWaalsContact C-N 3.26Å; S1245-E1247 PolarHBondContact O-N 2.66Å; S1245-E1247 VanDerWaalsContact O-N 3.16Å
1248	L	40.9	Very low	50.8	Low	78 Å²	78	75.2 Å²	75.2	41%	0.408	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.6	15.6	-161.1	-93.3	137.7	0	0	0	114.5	S1245 I1250	S1245-L1248 PolarHBondContact O-N 3.13Å; L1248-I1250 PolarHBondContact O-N 3.45Å
1249	S	42.1	Very low	49.5	Very low	20 Å²	20	78.7 Å²	78.7	14%	0.14	40%	0.404	C	S	.	.			trans	-76	118.7	178.5	-174.1	0	0	0	0	112	D1251 Q1252	S1249-D1251 PolarHBondContact O-N 2.79Å; S1249-D1251 WeakPolarHBondContact OG-CB 3.15Å; S1249-D1251 PolarHBondContact OG-N 3.42Å; S1249-Q1252 PolarHBondContact O-N 3.06Å
1250	I	43	Very low	49.1	Very low	109 Å²	109	80.4 Å²	80.4	56%	0.559	41%	0.414	S	S	*	.	H	α-helix	trans	-54.6	-23.2	168.7	-66	168.3	0	0	0	111	L1248 E1253 L1254	L1248-I1250 PolarHBondContact O-N 3.45Å; I1250-E1253 PolarHBondContact O-N 2.83Å; I1250-L1254 HydrophobicContact CG2-CD1 3.73Å; I1250-L1254 WeakPolarHBondContact O-CB 3.46Å; I1250-L1254 PolarHBondContact O-N 3Å
1251	D	40.8	Very low	48.7	Very low	29 Å²	29	81.2 Å²	81.2	16%	0.155	42%	0.424	C	S	.	.	H	α-helix	trans	-71.1	-27.3	174.8	-68.4	-31.5	0	0	0	113.8	K225 Y226 S1249 I1255	K225-D1251 VanDerWaalsContact CE-OD1 3.3Å; K225-D1251 WeakPolarHBondContact CE-OD1 3.47Å; K225-D1251 VanDerWaalsContact NZ-CG 3.35Å; K225-D1251 IonicContact NZ-OD1 2.71Å; K225-D1251 PolarHBondContact NZ-OD1 2.7Å; K225-D1251 IonicContact NZ-OD2 2.74Å; Y226-D1251 WeakPolarHBondContact CE1-OD2 3.32Å; Y226-D1251 PolarHBondContact OH-OD2 3.07Å; S1249-D1251 PolarHBondContact O-N 2.79Å; S1249-D1251 WeakPolarHBondContact OG-CB 3.15Å; S1249-D1251 PolarHBondContact OG-N 3.42Å; D1251-I1255 VanDerWaalsContact O-CB 3.25Å; D1251-I1255 WeakPolarHBondContact O-CB 3.46Å; D1251-I1255 WeakPolarHBondContact O-CD1 3.48Å; D1251-I1255 WeakPolarHBondContact O-CG1 3.24Å; D1251-I1255 PolarHBondContact O-N 3.32Å
1252	Q	41.2	Very low	47.9	Very low	111 Å²	111	83.2 Å²	83.2	52%	0.519	44%	0.435	S	S	.	.	H	α-helix	trans	-73.4	-42.2	172.4	-75.3	-172.7	-2.3	0	0	111	S1249 L1254 I1255 H1256	S1249-Q1252 PolarHBondContact O-N 3.06Å; Q1252-L1254 VanDerWaalsContact C-N 3.32Å; Q1252-L1254 PolarHBondContact O-N 3.36Å; Q1252-I1255 CarbonylContact O-C 3.59Å; Q1252-I1255 PolarHBondContact O-N 3.48Å; Q1252-I1255 VanDerWaalsContact O-N 3.1Å; Q1252-H1256 PolarHBondContact O-CD2 3.33Å; Q1252-H1256 VanDerWaalsContact O-CD2 3.3Å; Q1252-H1256 PolarHBondContact O-N 3.21Å
1253	E	41.9	Very low	47.7	Very low	142 Å²	142	84 Å²	84	66%	0.664	44%	0.443	S	S	*	.	H	α-helix	trans	-60.8	-42	170.7	-71.4	-170.1	147.4	0	0	111	I1250 I1255 H1256 V1257	I1250-E1253 PolarHBondContact O-N 2.83Å; E1253-I1255 VanDerWaalsContact C-N 3.34Å; E1253-I1255 PolarHBondContact O-N 2.91Å; E1253-H1256 PolarHBondContact O-N 3.11Å; E1253-V1257 WeakPolarHBondContact O-CB 3.39Å; E1253-V1257 WeakPolarHBondContact O-CG2 3.16Å; E1253-V1257 PolarHBondContact O-N 2.9Å
1254	L	43.4	Very low	48.2	Very low	66 Å²	66	89.9 Å²	89.9	35%	0.346	46%	0.461	S	S	.	.	H	α-helix	trans	-65.8	-30.9	172	-104.9	95.2	0	0	0	113.3	I1250 Q1252 H1256 Q1258	I1250-L1254 HydrophobicContact CG2-CD1 3.73Å; I1250-L1254 WeakPolarHBondContact O-CB 3.46Å; I1250-L1254 PolarHBondContact O-N 3Å; Q1252-L1254 VanDerWaalsContact C-N 3.32Å; Q1252-L1254 PolarHBondContact O-N 3.36Å; L1254-H1256 VanDerWaalsContact C-N 3.32Å; L1254-Q1258 WeakPolarHBondContact O-CA 3.49Å; L1254-Q1258 WeakPolarHBondContact O-CB 3.37Å; L1254-Q1258 WeakPolarHBondContact O-CG 3.27Å; L1254-Q1258 PolarHBondContact O-N 2.97Å
1255	I	48.8	Very low	48.6	Very low	103 Å²	103	92 Å²	92	53%	0.528	48%	0.475	S	S	.	.	H	α-helix	trans	-76.3	-21.3	176	-75.6	163.8	0	0	0	111.8	D1251 Q1252 E1253 P1259	D1251-I1255 VanDerWaalsContact O-CB 3.25Å; D1251-I1255 WeakPolarHBondContact O-CB 3.46Å; D1251-I1255 WeakPolarHBondContact O-CD1 3.48Å; D1251-I1255 WeakPolarHBondContact O-CG1 3.24Å; D1251-I1255 PolarHBondContact O-N 3.32Å; Q1252-I1255 CarbonylContact O-C 3.59Å; Q1252-I1255 PolarHBondContact O-N 3.48Å; Q1252-I1255 VanDerWaalsContact O-N 3.1Å; E1253-I1255 VanDerWaalsContact C-N 3.34Å; E1253-I1255 PolarHBondContact O-N 2.91Å; I1255-P1259 WeakPolarHBondContact O-CD 3.43Å; I1255-P1259 WeakPolarHBondContact O-CG 3.46Å
1256	H	49.7	Very low	49	Very low	143 Å²	143	95.3 Å²	95.3	66%	0.662	49%	0.49	S	S	*	.	H	α-helix	trans	-84.6	-38.5	168.4	-80.2	-69.8	0	0	0	113	Q1252 E1253 L1254 P1259	Q1252-H1256 PolarHBondContact O-CD2 3.33Å; Q1252-H1256 VanDerWaalsContact O-CD2 3.3Å; Q1252-H1256 PolarHBondContact O-N 3.21Å; E1253-H1256 PolarHBondContact O-N 3.11Å; L1254-H1256 VanDerWaalsContact C-N 3.32Å; H1256-P1259 WeakPolarHBondContact O-CD 3.32Å
1257	V	50	Low	49.9	Very low	74 Å²	74	93.8 Å²	93.8	45%	0.448	48%	0.476	S	S	.	.	H	α-helix	trans	-81.3	-25.2	179.1	174.3	0	0	0	0	112.6	E1253 D1260 C1261	E1253-V1257 WeakPolarHBondContact O-CB 3.39Å; E1253-V1257 WeakPolarHBondContact O-CG2 3.16Å; E1253-V1257 PolarHBondContact O-N 2.9Å; V1257-D1260 PolarHBondContact O-N 2.89Å; V1257-C1261 WeakPolarHBondContact O-CB 3.22Å; V1257-C1261 PolarHBondContact O-N 3.26Å
1258	Q	50.9	Low	50.4	Low	70 Å²	70	87.6 Å²	87.6	33%	0.327	45%	0.451	S	S	.	.	H	α-helix	trans	-64.4	-39.4	174.9	-85.5	-178.9	9.5	0	0	113.5	L1254 K1262	L1254-Q1258 WeakPolarHBondContact O-CA 3.49Å; L1254-Q1258 WeakPolarHBondContact O-CB 3.37Å; L1254-Q1258 WeakPolarHBondContact O-CG 3.27Å; L1254-Q1258 PolarHBondContact O-N 2.97Å; Q1258-K1262 WeakPolarHBondContact O-CA 3.47Å; Q1258-K1262 WeakPolarHBondContact O-CB 3.46Å; Q1258-K1262 WeakPolarHBondContact O-CG 2.92Å; Q1258-K1262 PolarHBondContact O-N 2.74Å
1259	P	52.4	Low	50.8	Low	72 Å²	72	86.1 Å²	86.1	47%	0.468	45%	0.447	S	S	.	.	H	α-helix	trans	-55.7	-46.5	166	-30	35.3	0	0	0	113.1	I1255 H1256 K1262 S1263	I1255-P1259 WeakPolarHBondContact O-CD 3.43Å; I1255-P1259 WeakPolarHBondContact O-CG 3.46Å; H1256-P1259 WeakPolarHBondContact O-CD 3.32Å; P1259-K1262 CarbonylContact O-C 3.55Å; P1259-K1262 PolarHBondContact O-N 3.06Å; P1259-S1263 WeakPolarHBondContact O-CB 3.19Å; P1259-S1263 PolarHBondContact O-N 3.09Å
1260	D	59.9	Low	51	Low	114 Å²	114	88.8 Å²	88.8	61%	0.61	46%	0.46	S	S	*	.	H	α-helix	trans	-70.8	-44.6	-177.8	-66.2	-14.8	0	0	0	112	V1257 K1262 S1263 Y1264	V1257-D1260 PolarHBondContact O-N 2.89Å; D1260-K1262 VanDerWaalsContact C-N 3.32Å; D1260-K1262 PolarHBondContact O-N 2.79Å; D1260-S1263 PolarHBondContact O-N 2.89Å; D1260-Y1264 WeakPolarHBondContact O-CB 3.44Å; D1260-Y1264 PolarHBondContact O-N 3.37Å
1261	C	54	Low	51.2	Low	64 Å²	64	89.7 Å²	89.7	43%	0.432	46%	0.462	S	S	.	.	H	α-helix	trans	-68	-29.9	172.5	-70.8	0	0	0	0	112.3	V1257 I1265	V1257-C1261 WeakPolarHBondContact O-CB 3.22Å; V1257-C1261 PolarHBondContact O-N 3.26Å; C1261-I1265 WeakPolarHBondContact O-CB 3.25Å; C1261-I1265 WeakPolarHBondContact O-CD1 3.48Å; C1261-I1265 WeakPolarHBondContact O-CG1 3.2Å; C1261-I1265 PolarHBondContact O-N 3.34Å
1262	K	49.7	Very low	51.3	Low	114 Å²	114	94.1 Å²	94.1	50%	0.496	48%	0.482	S	S	.	.	H	α-helix	trans	-72.9	-37.8	169.8	-85.2	-179.2	173.3	176.9	0	111.6	Q1258 P1259 D1260 I1265 I1266	Q1258-K1262 WeakPolarHBondContact O-CA 3.47Å; Q1258-K1262 WeakPolarHBondContact O-CB 3.46Å; Q1258-K1262 WeakPolarHBondContact O-CG 2.92Å; Q1258-K1262 PolarHBondContact O-N 2.74Å; P1259-K1262 CarbonylContact O-C 3.55Å; P1259-K1262 PolarHBondContact O-N 3.06Å; D1260-K1262 VanDerWaalsContact C-N 3.32Å; D1260-K1262 PolarHBondContact O-N 2.79Å; K1262-I1265 PolarHBondContact O-N 2.86Å; K1262-I1266 HydrophobicContact CB-CD1 4.33Å; K1262-I1266 WeakPolarHBondContact O-CA 3.43Å; K1262-I1266 WeakPolarHBondContact O-CB 3.4Å; K1262-I1266 WeakPolarHBondContact O-CD1 3.48Å; K1262-I1266 WeakPolarHBondContact O-CG1 3.39Å; K1262-I1266 PolarHBondContact O-N 3.08Å
1263	S	59.3	Low	51.4	Low	57 Å²	57	94.6 Å²	94.6	40%	0.399	48%	0.484	S	S	.	.	H	α-helix	trans	-58.9	-59.6	171.1	-162	0	0	0	0	107.1	P1259 D1260 I1265 I1266 D1267	P1259-S1263 WeakPolarHBondContact O-CB 3.19Å; P1259-S1263 PolarHBondContact O-N 3.09Å; D1260-S1263 PolarHBondContact O-N 2.89Å; S1263-I1265 VanDerWaalsContact C-N 3.31Å; S1263-I1265 PolarHBondContact O-N 2.97Å; S1263-I1265 VanDerWaalsContact O-N 3.14Å; S1263-I1266 CarbonylContact O-C 3.4Å; S1263-I1266 WeakPolarHBondContact O-CA 3.26Å; S1263-I1266 PolarHBondContact O-N 3.01Å; S1263-D1267 VanDerWaalsContact O-CB 3.29Å; S1263-D1267 WeakPolarHBondContact O-CB 3.47Å; S1263-D1267 PolarHBondContact O-N 3.12Å; S1263-D1267 PolarHBondContact OG-OD2 3.41Å
1264	Y	64	Low	51.6	Low	164 Å²	164	91.9 Å²	91.9	64%	0.643	48%	0.477	S	S	*	.	H	α-helix	trans	-52.6	-42.1	178.7	-168.6	-95.9	0	0	0	114.2	D1260 C1268	D1260-Y1264 WeakPolarHBondContact O-CB 3.44Å; D1260-Y1264 PolarHBondContact O-N 3.37Å; Y1264-C1268 WeakPolarHBondContact O-CB 3.31Å; Y1264-C1268 PolarHBondContact O-N 3.34Å; Y1264-C1268 PolarHBondContact O-SG 2.82Å; Y1264-C1268 VanDerWaalsContact O-SG 3.37Å
1265	I	57.4	Low	51.8	Low	105 Å²	105	93.2 Å²	93.2	54%	0.538	48%	0.483	S	S	.	.	H	α-helix	trans	-71.9	-37.3	175.1	-70.9	166.8	0	0	0	111.8	C1261 K1262 S1263 D1267 S1269	C1261-I1265 WeakPolarHBondContact O-CB 3.25Å; C1261-I1265 WeakPolarHBondContact O-CD1 3.48Å; C1261-I1265 WeakPolarHBondContact O-CG1 3.2Å; C1261-I1265 PolarHBondContact O-N 3.34Å; K1262-I1265 PolarHBondContact O-N 2.86Å; S1263-I1265 VanDerWaalsContact C-N 3.31Å; S1263-I1265 PolarHBondContact O-N 2.97Å; S1263-I1265 VanDerWaalsContact O-N 3.14Å; I1265-D1267 VanDerWaalsContact C-N 3.35Å; I1265-S1269 WeakPolarHBondContact O-CA 3.47Å; I1265-S1269 WeakPolarHBondContact O-CB 3.5Å; I1265-S1269 PolarHBondContact O-N 3.11Å; I1265-S1269 PolarHBondContact O-OG 3.47Å
1266	I	57.6	Low	51.8	Low	89 Å²	89	92 Å²	92	46%	0.456	48%	0.477	S	S	.	.	H	α-helix	trans	-69.3	-35	174	-73.4	165	0	0	0	110.1	K1262 S1263 S1269 N1270	K1262-I1266 HydrophobicContact CB-CD1 4.33Å; K1262-I1266 WeakPolarHBondContact O-CA 3.43Å; K1262-I1266 WeakPolarHBondContact O-CB 3.4Å; K1262-I1266 WeakPolarHBondContact O-CD1 3.48Å; K1262-I1266 WeakPolarHBondContact O-CG1 3.39Å; K1262-I1266 PolarHBondContact O-N 3.08Å; S1263-I1266 CarbonylContact O-C 3.4Å; S1263-I1266 WeakPolarHBondContact O-CA 3.26Å; S1263-I1266 PolarHBondContact O-N 3.01Å; I1266-S1269 CarbonylContact O-C 3.48Å; I1266-S1269 PolarHBondContact O-N 3.19Å; I1266-N1270 WeakPolarHBondContact CG2-ND2 3.27Å; I1266-N1270 WeakPolarHBondContact O-CA 3.47Å; I1266-N1270 WeakPolarHBondContact O-CB 3.22Å; I1266-N1270 PolarHBondContact O-N 2.78Å; I1266-N1270 PolarHBondContact O-ND2 2.66Å; I1266-N1270 PolarHBondContact O-OD1 3.02Å
1267	D	60.3	Low	51.7	Low	76 Å²	76	88.2 Å²	88.2	41%	0.406	46%	0.464	S	S	.	.	H	α-helix	trans	-73.3	-47.6	-179.8	-65.1	-39.6	0	0	0	109.2	S1263 I1265 S1269 N1270 E1271	S1263-D1267 VanDerWaalsContact O-CB 3.29Å; S1263-D1267 WeakPolarHBondContact O-CB 3.47Å; S1263-D1267 PolarHBondContact O-N 3.12Å; S1263-D1267 PolarHBondContact OG-OD2 3.41Å; I1265-D1267 VanDerWaalsContact C-N 3.35Å; D1267-S1269 VanDerWaalsContact C-N 3.32Å; D1267-S1269 PolarHBondContact O-N 3.37Å; D1267-N1270 CarbonylContact O-C 3.53Å; D1267-N1270 PolarHBondContact O-N 3.28Å; D1267-N1270 VanDerWaalsContact O-N 3.15Å; D1267-E1271 WeakPolarHBondContact O-CG 3.43Å; D1267-E1271 PolarHBondContact O-N 3Å
1268	C	50.6	Low	51.5	Low	39 Å²	39	89.3 Å²	89.3	26%	0.264	46%	0.464	S	S	.	.	H	α-helix	trans	-64.9	-32.2	168.6	-69.4	0	0	0	0	113	Y1264 N1270 Q1272	Y1264-C1268 WeakPolarHBondContact O-CB 3.31Å; Y1264-C1268 PolarHBondContact O-N 3.34Å; Y1264-C1268 PolarHBondContact O-SG 2.82Å; Y1264-C1268 VanDerWaalsContact O-SG 3.37Å; C1268-N1270 VanDerWaalsContact C-N 3.34Å; C1268-Q1272 WeakPolarHBondContact O-CB 3.02Å; C1268-Q1272 WeakPolarHBondContact O-CG 3.09Å; C1268-Q1272 PolarHBondContact O-N 2.8Å
1269	S	49.2	Very low	51.2	Low	48 Å²	48	91.2 Å²	91.2	34%	0.336	48%	0.477	S	S	.	.	H	α-helix	trans	-76.4	-22.4	173.3	-61	0	0	0	0	112.4	I1265 I1266 D1267 Q1273	I1265-S1269 WeakPolarHBondContact O-CA 3.47Å; I1265-S1269 WeakPolarHBondContact O-CB 3.5Å; I1265-S1269 PolarHBondContact O-N 3.11Å; I1265-S1269 PolarHBondContact O-OG 3.47Å; I1266-S1269 CarbonylContact O-C 3.48Å; I1266-S1269 PolarHBondContact O-N 3.19Å; D1267-S1269 VanDerWaalsContact C-N 3.32Å; D1267-S1269 PolarHBondContact O-N 3.37Å; S1269-Q1273 WeakPolarHBondContact O-CA 3.3Å; S1269-Q1273 WeakPolarHBondContact O-CB 3.29Å; S1269-Q1273 VanDerWaalsContact O-CG 3.23Å; S1269-Q1273 WeakPolarHBondContact O-CG 3.37Å; S1269-Q1273 PolarHBondContact O-N 3.37Å
1270	N	46.3	Very low	50.8	Low	75 Å²	75	94.3 Å²	94.3	40%	0.401	48%	0.483	S	S	.	.	H	α-helix	trans	-83.2	-34.7	173.5	-75.8	-19.6	0	0	0	109.7	I1266 D1267 C1268 Q1273 V1274	I1266-N1270 WeakPolarHBondContact CG2-ND2 3.27Å; I1266-N1270 WeakPolarHBondContact O-CA 3.47Å; I1266-N1270 WeakPolarHBondContact O-CB 3.22Å; I1266-N1270 PolarHBondContact O-N 2.78Å; I1266-N1270 PolarHBondContact O-ND2 2.66Å; I1266-N1270 PolarHBondContact O-OD1 3.02Å; D1267-N1270 CarbonylContact O-C 3.53Å; D1267-N1270 PolarHBondContact O-N 3.28Å; D1267-N1270 VanDerWaalsContact O-N 3.15Å; C1268-N1270 VanDerWaalsContact C-N 3.34Å; N1270-Q1273 PolarHBondContact O-N 2.88Å; N1270-V1274 WeakPolarHBondContact O-CA 3.46Å; N1270-V1274 WeakPolarHBondContact O-CB 3.26Å; N1270-V1274 WeakPolarHBondContact O-CG2 3.34Å; N1270-V1274 PolarHBondContact O-N 3.35Å
1271	E	48	Very low	50.2	Low	128 Å²	128	92.9 Å²	92.9	60%	0.598	47%	0.474	S	S	*	.	H	α-helix	trans	-62.4	-49.1	165.6	-73.3	-177.1	144.9	0	0	109.9	D1267 Q1273 V1274 I1275	D1267-E1271 WeakPolarHBondContact O-CG 3.43Å; D1267-E1271 PolarHBondContact O-N 3Å; E1271-Q1273 PolarHBondContact O-N 3.47Å; E1271-V1274 PolarHBondContact O-N 3.14Å; E1271-I1275 WeakPolarHBondContact O-CB 3.27Å; E1271-I1275 WeakPolarHBondContact O-CD1 3.43Å; E1271-I1275 VanDerWaalsContact O-CG1 3.24Å; E1271-I1275 WeakPolarHBondContact O-CG1 3.47Å; E1271-I1275 PolarHBondContact O-N 2.89Å
1272	Q	43.1	Very low	49.9	Very low	123 Å²	123	93.4 Å²	93.4	58%	0.575	47%	0.473	S	S	*	.	H	α-helix	trans	-66.6	-34.7	175.3	-74	-172.8	3.8	0	0	113.1	C1268 I1276	C1268-Q1272 WeakPolarHBondContact O-CB 3.02Å; C1268-Q1272 WeakPolarHBondContact O-CG 3.09Å; C1268-Q1272 PolarHBondContact O-N 2.8Å; Q1272-I1276 WeakPolarHBondContact O-CB 3.47Å; Q1272-I1276 WeakPolarHBondContact O-CD1 3.01Å; Q1272-I1276 WeakPolarHBondContact O-CG1 3.35Å; Q1272-I1276 PolarHBondContact O-N 2.97Å
1273	Q	42.9	Very low	49.8	Very low	121 Å²	121	91.3 Å²	91.3	57%	0.565	47%	0.471	S	S	*	.	H	α-helix	trans	-74.7	-32.5	173	-82.1	-169.2	21	0	0	112.3	S1269 N1270 E1271 T1277	S1269-Q1273 WeakPolarHBondContact O-CA 3.3Å; S1269-Q1273 WeakPolarHBondContact O-CB 3.29Å; S1269-Q1273 VanDerWaalsContact O-CG 3.23Å; S1269-Q1273 WeakPolarHBondContact O-CG 3.37Å; S1269-Q1273 PolarHBondContact O-N 3.37Å; N1270-Q1273 PolarHBondContact O-N 2.88Å; E1271-Q1273 PolarHBondContact O-N 3.47Å; Q1273-T1277 WeakPolarHBondContact O-CA 3.49Å; Q1273-T1277 WeakPolarHBondContact O-CB 3.45Å; Q1273-T1277 PolarHBondContact O-N 3.44Å; Q1273-T1277 PolarHBondContact O-OG1 2.99Å
1274	V	45.9	Very low	49.4	Very low	85 Å²	85	94.8 Å²	94.8	52%	0.515	48%	0.48	S	S	.	.	H	α-helix	trans	-63.3	-47.8	170.2	164.1	0	0	0	0	108.6	N1270 E1271 T1277 E1278	N1270-V1274 WeakPolarHBondContact O-CA 3.46Å; N1270-V1274 WeakPolarHBondContact O-CB 3.26Å; N1270-V1274 WeakPolarHBondContact O-CG2 3.34Å; N1270-V1274 PolarHBondContact O-N 3.35Å; E1271-V1274 PolarHBondContact O-N 3.14Å; V1274-T1277 PolarHBondContact O-N 2.84Å; V1274-E1278 HydrophobicContact CG1-CG 4.45Å; V1274-E1278 VanDerWaalsContact O-CB 3.3Å; V1274-E1278 WeakPolarHBondContact O-CB 3.29Å; V1274-E1278 WeakPolarHBondContact O-CG 3.49Å; V1274-E1278 PolarHBondContact O-N 3.43Å
1275	I	48.5	Very low	48.8	Very low	94 Å²	94	91.2 Å²	91.2	48%	0.482	47%	0.471	S	S	.	.	H	α-helix	trans	-61.1	-50.4	176	-66.8	162.2	0	0	0	111.6	E1271 T1277 E1278 D1279	E1271-I1275 WeakPolarHBondContact O-CB 3.27Å; E1271-I1275 WeakPolarHBondContact O-CD1 3.43Å; E1271-I1275 VanDerWaalsContact O-CG1 3.24Å; E1271-I1275 WeakPolarHBondContact O-CG1 3.47Å; E1271-I1275 PolarHBondContact O-N 2.89Å; I1275-T1277 VanDerWaalsContact C-N 3.3Å; I1275-T1277 PolarHBondContact O-N 3.07Å; I1275-E1278 PolarHBondContact O-N 3.18Å; I1275-D1279 WeakPolarHBondContact O-CB 3.29Å; I1275-D1279 PolarHBondContact O-N 3.31Å
1276	I	48.3	Very low	48.9	Very low	78 Å²	78	88.4 Å²	88.4	40%	0.4	46%	0.459	S	S	.	.	H	α-helix	trans	-69.9	-27.5	-178.8	-69.6	165.9	0	0	0	111.9	Q1272 K1280	Q1272-I1276 WeakPolarHBondContact O-CB 3.47Å; Q1272-I1276 WeakPolarHBondContact O-CD1 3.01Å; Q1272-I1276 WeakPolarHBondContact O-CG1 3.35Å; Q1272-I1276 PolarHBondContact O-N 2.97Å; I1276-K1280 HydrophobicContact CG2-CD 3.98Å; I1276-K1280 VanDerWaalsContact O-CB 3.31Å; I1276-K1280 WeakPolarHBondContact O-CB 3.34Å; I1276-K1280 WeakPolarHBondContact O-CD 3.49Å; I1276-K1280 WeakPolarHBondContact O-CG 3.32Å; I1276-K1280 PolarHBondContact O-N 3.19Å
1277	T	48.4	Very low	48.9	Very low	62 Å²	62	89.2 Å²	89.2	38%	0.38	46%	0.461	S	S	.	.	H	α-helix	trans	-84.2	-34	176.8	-55	0	0	0	0	110.3	Q1273 V1274 I1275 K1280 I1281	Q1273-T1277 WeakPolarHBondContact O-CA 3.49Å; Q1273-T1277 WeakPolarHBondContact O-CB 3.45Å; Q1273-T1277 PolarHBondContact O-N 3.44Å; Q1273-T1277 PolarHBondContact O-OG1 2.99Å; V1274-T1277 PolarHBondContact O-N 2.84Å; I1275-T1277 VanDerWaalsContact C-N 3.3Å; I1275-T1277 PolarHBondContact O-N 3.07Å; T1277-K1280 PolarHBondContact O-N 3.43Å; T1277-I1281 HydrophobicContact CG2-CD1 3.54Å; T1277-I1281 HydrophobicContact CG2-CG1 3.88Å; T1277-I1281 WeakPolarHBondContact O-CA 3.19Å; T1277-I1281 WeakPolarHBondContact O-CB 3.33Å; T1277-I1281 WeakPolarHBondContact O-CG1 3.49Å; T1277-I1281 PolarHBondContact O-N 3.24Å
1278	E	44.9	Very low	48.7	Very low	98 Å²	98	93.4 Å²	93.4	46%	0.458	48%	0.476	S	S	.	.	H	α-helix	trans	-61.4	-44.4	163.8	-75.5	-172.2	132.8	0	0	110.4	V1274 I1275 K1280 I1281 N1282	V1274-E1278 HydrophobicContact CG1-CG 4.45Å; V1274-E1278 VanDerWaalsContact O-CB 3.3Å; V1274-E1278 WeakPolarHBondContact O-CB 3.29Å; V1274-E1278 WeakPolarHBondContact O-CG 3.49Å; V1274-E1278 PolarHBondContact O-N 3.43Å; I1275-E1278 PolarHBondContact O-N 3.18Å; E1278-K1280 VanDerWaalsContact C-N 3.27Å; E1278-K1280 PolarHBondContact O-N 3.32Å; E1278-I1281 PolarHBondContact O-N 3.29Å; E1278-N1282 WeakPolarHBondContact O-CA 3.44Å; E1278-N1282 WeakPolarHBondContact O-CB 3.23Å; E1278-N1282 VanDerWaalsContact O-CG 3.25Å; E1278-N1282 PolarHBondContact O-N 2.92Å; E1278-N1282 PolarHBondContact O-ND2 3.48Å
1279	D	44.4	Very low	49	Very low	110 Å²	110	99.2 Å²	99.2	59%	0.588	49%	0.493	S	S	*	.	H	α-helix	trans	-72.3	-11.3	177.3	-84.5	-17.6	0	0	0	114.7	I1275 P1283	I1275-D1279 WeakPolarHBondContact O-CB 3.29Å; I1275-D1279 PolarHBondContact O-N 3.31Å; D1279-P1283 WeakPolarHBondContact O-CD 3.47Å; D1279-P1283 WeakPolarHBondContact O-CG 3.38Å
1280	K	44.3	Very low	49.5	Very low	136 Å²	136	99.7 Å²	99.7	59%	0.591	49%	0.494	S	S	*	.	H	α-helix	trans	-103.6	-33.7	171.5	-75.3	172.8	-177.8	174.6	0	113	I1276 T1277 E1278 P1283 H1284	I1276-K1280 HydrophobicContact CG2-CD 3.98Å; I1276-K1280 VanDerWaalsContact O-CB 3.31Å; I1276-K1280 WeakPolarHBondContact O-CB 3.34Å; I1276-K1280 WeakPolarHBondContact O-CD 3.49Å; I1276-K1280 WeakPolarHBondContact O-CG 3.32Å; I1276-K1280 PolarHBondContact O-N 3.19Å; T1277-K1280 PolarHBondContact O-N 3.43Å; E1278-K1280 VanDerWaalsContact C-N 3.27Å; E1278-K1280 PolarHBondContact O-N 3.32Å; K1280-P1283 WeakPolarHBondContact O-CD 3.47Å; K1280-P1283 WeakPolarHBondContact O-CG 3.25Å; K1280-H1284 PolarHBondContact O-N 2.94Å
1281	I	47.8	Very low	50	Low	84 Å²	84	100.1 Å²	100.1	43%	0.431	50%	0.497	S	S	.	.	H	α-helix	trans	-73.8	-34.1	172.3	-69.9	-176.3	0	0	0	109.9	T1277 E1278 H1284 I1285	T1277-I1281 HydrophobicContact CG2-CD1 3.54Å; T1277-I1281 HydrophobicContact CG2-CG1 3.88Å; T1277-I1281 WeakPolarHBondContact O-CA 3.19Å; T1277-I1281 WeakPolarHBondContact O-CB 3.33Å; T1277-I1281 WeakPolarHBondContact O-CG1 3.49Å; T1277-I1281 PolarHBondContact O-N 3.24Å; E1278-I1281 PolarHBondContact O-N 3.29Å; I1281-H1284 CarbonylContact O-C 3.52Å; I1281-H1284 PolarHBondContact O-N 3.41Å; I1281-I1285 HydrophobicContact CG2-CB 4.43Å; I1281-I1285 HydrophobicContact CG2-CD1 3.29Å; I1281-I1285 HydrophobicContact CG2-CG1 3.61Å; I1281-I1285 WeakPolarHBondContact O-CA 3.44Å; I1281-I1285 VanDerWaalsContact O-CB 3.23Å; I1281-I1285 WeakPolarHBondContact O-CB 3.42Å; I1281-I1285 WeakPolarHBondContact O-CG1 3.23Å; I1281-I1285 PolarHBondContact O-N 2.82Å
1282	N	47	Very low	50.4	Low	76 Å²	76	96.9 Å²	96.9	41%	0.406	49%	0.491	S	S	.	.	H	α-helix	trans	-58.6	-52.8	174.4	-86	-45.1	0	0	0	112.6	E1278 H1284 V1286	E1278-N1282 WeakPolarHBondContact O-CA 3.44Å; E1278-N1282 WeakPolarHBondContact O-CB 3.23Å; E1278-N1282 VanDerWaalsContact O-CG 3.25Å; E1278-N1282 PolarHBondContact O-N 2.92Å; E1278-N1282 PolarHBondContact O-ND2 3.48Å; N1282-H1284 PolarHBondContact O-N 3.35Å; N1282-V1286 WeakPolarHBondContact O-CA 3.44Å; N1282-V1286 WeakPolarHBondContact O-CB 3.13Å; N1282-V1286 WeakPolarHBondContact O-CG2 3.28Å; N1282-V1286 PolarHBondContact O-N 3.18Å
1283	P	48.1	Very low	51	Low	69 Å²	69	98.1 Å²	98.1	45%	0.448	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-32.8	174.6	24.2	-32.2	0	0	0	112.6	D1279 K1280 Q1287	D1279-P1283 WeakPolarHBondContact O-CD 3.47Å; D1279-P1283 WeakPolarHBondContact O-CG 3.38Å; K1280-P1283 WeakPolarHBondContact O-CD 3.47Å; K1280-P1283 WeakPolarHBondContact O-CG 3.25Å; P1283-Q1287 WeakPolarHBondContact O-CA 3.49Å; P1283-Q1287 WeakPolarHBondContact O-CB 3.4Å; P1283-Q1287 PolarHBondContact O-N 3.47Å
1284	H	50.1	Low	51.4	Low	130 Å²	130	97.7 Å²	97.7	60%	0.602	49%	0.493	S	S	*	.	H	α-helix	trans	-77.4	-33.3	177.3	-102	-57.4	0	0	0	114.9	K1280 I1281 N1282 K1288	K1280-H1284 PolarHBondContact O-N 2.94Å; I1281-H1284 CarbonylContact O-C 3.52Å; I1281-H1284 PolarHBondContact O-N 3.41Å; N1282-H1284 PolarHBondContact O-N 3.35Å; H1284-K1288 VanDerWaalsContact O-CB 3.28Å; H1284-K1288 WeakPolarHBondContact O-CB 3.49Å; H1284-K1288 PolarHBondContact O-N 2.94Å
1285	I	52.1	Low	51.6	Low	89 Å²	89	99.7 Å²	99.7	46%	0.456	50%	0.497	S	S	.	.	H	α-helix	trans	-73.9	-48.6	171.1	-75	-174.9	0	0	0	108.6	I1281 Q1287 K1288 Y1289	I1281-I1285 HydrophobicContact CG2-CB 4.43Å; I1281-I1285 HydrophobicContact CG2-CD1 3.29Å; I1281-I1285 HydrophobicContact CG2-CG1 3.61Å; I1281-I1285 WeakPolarHBondContact O-CA 3.44Å; I1281-I1285 VanDerWaalsContact O-CB 3.23Å; I1281-I1285 WeakPolarHBondContact O-CB 3.42Å; I1281-I1285 WeakPolarHBondContact O-CG1 3.23Å; I1281-I1285 PolarHBondContact O-N 2.82Å; I1285-Q1287 VanDerWaalsContact C-N 3.29Å; I1285-Q1287 PolarHBondContact O-N 2.65Å; I1285-K1288 CarbonylContact O-C 3.53Å; I1285-K1288 WeakPolarHBondContact O-CA 3.45Å; I1285-K1288 PolarHBondContact O-N 3.25Å; I1285-K1288 VanDerWaalsContact O-N 3.11Å; I1285-Y1289 VanDerWaalsContact O-CB 3.28Å; I1285-Y1289 WeakPolarHBondContact O-CB 3.11Å; I1285-Y1289 PolarHBondContact O-N 3.5Å
1286	V	58.5	Low	51.7	Low	47 Å²	47	97.7 Å²	97.7	29%	0.285	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-35.9	176	179	0	0	0	0	110.4	N1282 Y1289 T1290 L2143	N1282-V1286 WeakPolarHBondContact O-CA 3.44Å; N1282-V1286 WeakPolarHBondContact O-CB 3.13Å; N1282-V1286 WeakPolarHBondContact O-CG2 3.28Å; N1282-V1286 PolarHBondContact O-N 3.18Å; V1286-Y1289 CarbonylContact O-C 3.53Å; V1286-Y1289 PolarHBondContact O-N 2.7Å; V1286-T1290 HydrophobicContact CG1-CG2 3.96Å; V1286-T1290 WeakPolarHBondContact O-CB 3.33Å; V1286-T1290 WeakPolarHBondContact O-CG2 3.42Å; V1286-T1290 PolarHBondContact O-N 2.64Å; V1286-T1290 PolarHBondContact O-OG1 3.42Å; V1286-L2143 HydrophobicContact CB-CD1 4.23Å; V1286-L2143 HydrophobicContact CG1-CD1 3.7Å; V1286-L2143 HydrophobicContact CG2-CD1 4.48Å
1287	Q	58.4	Low	51.7	Low	106 Å²	106	100.3 Å²	100.3	50%	0.495	50%	0.5	S	S	.	.	H	α-helix	trans	-72.6	-31.7	171.9	-166.8	174.6	31.1	0	0	112.5	P1283 I1285 Y1289 T1290 N1291	P1283-Q1287 WeakPolarHBondContact O-CA 3.49Å; P1283-Q1287 WeakPolarHBondContact O-CB 3.4Å; P1283-Q1287 PolarHBondContact O-N 3.47Å; I1285-Q1287 VanDerWaalsContact C-N 3.29Å; I1285-Q1287 PolarHBondContact O-N 2.65Å; Q1287-Y1289 VanDerWaalsContact C-N 3.32Å; Q1287-T1290 WeakPolarHBondContact CA-OG1 3.31Å; Q1287-N1291 WeakPolarHBondContact O-CA 3.22Å; Q1287-N1291 WeakPolarHBondContact O-CB 3.29Å; Q1287-N1291 PolarHBondContact O-N 2.95Å; Q1287-N1291 PolarHBondContact O-OD1 3.34Å; Q1287-N1291 VanDerWaalsContact O-OD1 3.12Å
1288	K	56.3	Low	51.7	Low	164 Å²	164	101.1 Å²	101.1	71%	0.713	50%	0.502	S	S	*	.	H	α-helix	trans	-69.9	-27.9	166.4	-89.5	-170.9	173.2	-178.3	0	112.5	H1284 I1285 A1292	H1284-K1288 VanDerWaalsContact O-CB 3.28Å; H1284-K1288 WeakPolarHBondContact O-CB 3.49Å; H1284-K1288 PolarHBondContact O-N 2.94Å; I1285-K1288 CarbonylContact O-C 3.53Å; I1285-K1288 WeakPolarHBondContact O-CA 3.45Å; I1285-K1288 PolarHBondContact O-N 3.25Å; I1285-K1288 VanDerWaalsContact O-N 3.11Å; K1288-A1292 WeakPolarHBondContact O-CA 3.37Å; K1288-A1292 WeakPolarHBondContact O-CB 3.39Å; K1288-A1292 PolarHBondContact O-N 3.4Å
1289	Y	55.7	Low	51.8	Low	160 Å²	160	100 Å²	100	63%	0.627	50%	0.498	S	S	*	.	H	α-helix	trans	-87.3	-31.4	-179.8	-130.8	-80.5	0	0	0	111.5	I1285 V1286 Q1287 K1293	I1285-Y1289 VanDerWaalsContact O-CB 3.28Å; I1285-Y1289 WeakPolarHBondContact O-CB 3.11Å; I1285-Y1289 PolarHBondContact O-N 3.5Å; V1286-Y1289 CarbonylContact O-C 3.53Å; V1286-Y1289 PolarHBondContact O-N 2.7Å; Q1287-Y1289 VanDerWaalsContact C-N 3.32Å; Y1289-K1293 WeakPolarHBondContact O-CA 3.39Å; Y1289-K1293 WeakPolarHBondContact O-CB 3.11Å; Y1289-K1293 PolarHBondContact O-N 3.41Å
1290	T	60.1	Low	51.5	Low	59 Å²	59	98.9 Å²	98.9	36%	0.362	49%	0.489	S	S	.	.	H	α-helix	trans	-79.8	-35.8	168.4	59.7	0	0	0	0	109.9	V1286 Q1287 K1293 E1294	V1286-T1290 HydrophobicContact CG1-CG2 3.96Å; V1286-T1290 WeakPolarHBondContact O-CB 3.33Å; V1286-T1290 WeakPolarHBondContact O-CG2 3.42Å; V1286-T1290 PolarHBondContact O-N 2.64Å; V1286-T1290 PolarHBondContact O-OG1 3.42Å; Q1287-T1290 WeakPolarHBondContact CA-OG1 3.31Å; T1290-K1293 CarbonylContact O-C 3.6Å; T1290-K1293 PolarHBondContact O-N 3.49Å; T1290-E1294 WeakPolarHBondContact O-CA 3.44Å; T1290-E1294 WeakPolarHBondContact O-CB 3.41Å; T1290-E1294 VanDerWaalsContact O-CG 3.24Å; T1290-E1294 WeakPolarHBondContact O-CG 3.35Å; T1290-E1294 PolarHBondContact O-N 3Å
1291	N	58.1	Low	51.6	Low	84 Å²	84	94.8 Å²	94.8	45%	0.449	47%	0.473	S	S	.	.	H	α-helix	trans	-70.5	-37.5	169.7	-66.6	13.7	0	0	0	110.6	Q1287 H1295	Q1287-N1291 WeakPolarHBondContact O-CA 3.22Å; Q1287-N1291 WeakPolarHBondContact O-CB 3.29Å; Q1287-N1291 PolarHBondContact O-N 2.95Å; Q1287-N1291 PolarHBondContact O-OD1 3.34Å; Q1287-N1291 VanDerWaalsContact O-OD1 3.12Å; N1291-H1295 WeakPolarHBondContact O-CA 3.32Å; N1291-H1295 WeakPolarHBondContact O-CB 3.45Å; N1291-H1295 PolarHBondContact O-N 2.97Å
1292	A	56.5	Low	51.2	Low	59 Å²	59	94.8 Å²	94.8	49%	0.488	47%	0.474	S	S	.	.	H	α-helix	trans	-71.5	-29.9	172.8	0	0	0	0	0	112.4	K1288 A1296	K1288-A1292 WeakPolarHBondContact O-CA 3.37Å; K1288-A1292 WeakPolarHBondContact O-CB 3.39Å; K1288-A1292 PolarHBondContact O-N 3.4Å; A1292-A1296 WeakPolarHBondContact O-CA 3.33Å; A1292-A1296 WeakPolarHBondContact O-CB 3.48Å; A1292-A1296 PolarHBondContact O-N 2.76Å
1293	K	54.2	Low	50.5	Low	149 Å²	149	96.6 Å²	96.6	65%	0.648	48%	0.48	S	S	*	.	H	α-helix	trans	-87.4	-24	177.4	-170.3	175.5	-177.2	-179.8	0	113.2	Y1289 T1290 Y1297	Y1289-K1293 WeakPolarHBondContact O-CA 3.39Å; Y1289-K1293 WeakPolarHBondContact O-CB 3.11Å; Y1289-K1293 PolarHBondContact O-N 3.41Å; T1290-K1293 CarbonylContact O-C 3.6Å; T1290-K1293 PolarHBondContact O-N 3.49Å; K1293-Y1297 WeakPolarHBondContact O-CA 3.4Å; K1293-Y1297 WeakPolarHBondContact O-CB 3.08Å; K1293-Y1297 PolarHBondContact O-N 2.78Å
1294	E	51.8	Low	49.9	Very low	113 Å²	113	98.9 Å²	98.9	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-83.2	-32.8	166.9	-74.1	-175.2	162.7	0	0	110.1	T1290 Y1297 N1298	T1290-E1294 WeakPolarHBondContact O-CA 3.44Å; T1290-E1294 WeakPolarHBondContact O-CB 3.41Å; T1290-E1294 VanDerWaalsContact O-CG 3.24Å; T1290-E1294 WeakPolarHBondContact O-CG 3.35Å; T1290-E1294 PolarHBondContact O-N 3Å; E1294-Y1297 PolarHBondContact O-N 3.35Å; E1294-N1298 WeakPolarHBondContact O-CA 3.41Å; E1294-N1298 WeakPolarHBondContact O-CB 3.31Å; E1294-N1298 PolarHBondContact O-N 2.74Å; E1294-N1298 PolarHBondContact O-ND2 2.9Å; E1294-N1298 VanDerWaalsContact O-ND2 3.08Å
1295	H	50.3	Low	49.3	Very low	127 Å²	127	99.9 Å²	99.9	59%	0.588	49%	0.488	S	S	*	.	H	α-helix	trans	-75.4	-28.8	169.8	-154.7	-35.7	0	0	0	110.6	N1291 I1299	N1291-H1295 WeakPolarHBondContact O-CA 3.32Å; N1291-H1295 WeakPolarHBondContact O-CB 3.45Å; N1291-H1295 PolarHBondContact O-N 2.97Å; H1295-I1299 WeakPolarHBondContact ND1-CD1 3.33Å; H1295-I1299 WeakPolarHBondContact O-CA 3.28Å; H1295-I1299 WeakPolarHBondContact O-CB 3.15Å; H1295-I1299 WeakPolarHBondContact O-CD1 3.36Å; H1295-I1299 WeakPolarHBondContact O-CG1 3.47Å; H1295-I1299 PolarHBondContact O-N 2.96Å
1296	A	50.7	Low	48.5	Very low	51 Å²	51	101.7 Å²	101.7	42%	0.421	50%	0.497	S	S	.	.	H	α-helix	trans	-81.7	-21.4	166.9	0	0	0	0	0	113.7	A1292 E1300	A1292-A1296 WeakPolarHBondContact O-CA 3.33Å; A1292-A1296 WeakPolarHBondContact O-CB 3.48Å; A1292-A1296 PolarHBondContact O-N 2.76Å; A1296-E1300 VanDerWaalsContact O-CB 3.27Å; A1296-E1300 WeakPolarHBondContact O-CB 3.42Å; A1296-E1300 WeakPolarHBondContact O-CG 3.26Å; A1296-E1300 PolarHBondContact O-N 3.02Å
1297	Y	47.5	Very low	46.9	Very low	134 Å²	134	105.9 Å²	105.9	53%	0.525	52%	0.518	S	S	.	.	H	α-helix	trans	-89.5	-24.2	173.4	-175	-109.8	0	0	0	111.9	K1293 E1294 I1301	K1293-Y1297 WeakPolarHBondContact O-CA 3.4Å; K1293-Y1297 WeakPolarHBondContact O-CB 3.08Å; K1293-Y1297 PolarHBondContact O-N 2.78Å; E1294-Y1297 PolarHBondContact O-N 3.35Å; Y1297-I1301 HydrophobicContact CD1-CD1 3.73Å; Y1297-I1301 HydrophobicContact CE1-CD1 3.41Å; Y1297-I1301 VanDerWaalsContact CE1-CD1 3.41Å; Y1297-I1301 HydrophobicContact CE1-CG1 4.42Å; Y1297-I1301 HydrophobicContact CE2-CD1 4.44Å; Y1297-I1301 HydrophobicContact CG-CD1 4.38Å; Y1297-I1301 WeakPolarHBondContact O-CA 3.49Å; Y1297-I1301 WeakPolarHBondContact O-CB 3.15Å; Y1297-I1301 WeakPolarHBondContact O-CG1 3.3Å; Y1297-I1301 PolarHBondContact O-N 3.21Å
1298	N	47.9	Very low	45.6	Very low	79 Å²	79	103.6 Å²	103.6	42%	0.422	52%	0.517	S	S	.	.	H	α-helix	trans	-86.5	-23.3	166	-65	-31.4	0	0	0	111.2	E1294 N1302	E1294-N1298 WeakPolarHBondContact O-CA 3.41Å; E1294-N1298 WeakPolarHBondContact O-CB 3.31Å; E1294-N1298 PolarHBondContact O-N 2.74Å; E1294-N1298 PolarHBondContact O-ND2 2.9Å; E1294-N1298 VanDerWaalsContact O-ND2 3.08Å; N1298-N1302 WeakPolarHBondContact O-CB 3.45Å; N1298-N1302 PolarHBondContact O-N 3.43Å; N1298-N1302 PolarHBondContact O-ND2 2.99Å
1299	I	47.1	Very low	44.4	Very low	74 Å²	74	101.8 Å²	101.8	38%	0.379	53%	0.525	S	S	.	.	H	α-helix	trans	-72	-46.1	159.1	-74.7	165.6	0	0	0	109	H1295 I1301 N1302 E1303	H1295-I1299 WeakPolarHBondContact ND1-CD1 3.33Å; H1295-I1299 WeakPolarHBondContact O-CA 3.28Å; H1295-I1299 WeakPolarHBondContact O-CB 3.15Å; H1295-I1299 WeakPolarHBondContact O-CD1 3.36Å; H1295-I1299 WeakPolarHBondContact O-CG1 3.47Å; H1295-I1299 PolarHBondContact O-N 2.96Å; I1299-I1301 VanDerWaalsContact C-N 3.32Å; I1299-I1301 PolarHBondContact O-N 3.35Å; I1299-N1302 PolarHBondContact O-N 3.21Å; I1299-E1303 VanDerWaalsContact CG2-CD 3.41Å; I1299-E1303 HydrophobicContact CG2-CG 3.96Å; I1299-E1303 WeakPolarHBondContact O-CA 3.28Å; I1299-E1303 WeakPolarHBondContact O-CB 3.47Å; I1299-E1303 VanDerWaalsContact O-CG 3.22Å; I1299-E1303 WeakPolarHBondContact O-CG 3.33Å; I1299-E1303 PolarHBondContact O-N 3.5Å
1300	E	39.8	Very low	43	Very low	87 Å²	87	99.6 Å²	99.6	41%	0.407	53%	0.531	S	S	.	.	H	α-helix	trans	-60.5	-38.3	172.3	-84.7	-159.5	119.4	0	0	112.1	A1296 K1304	A1296-E1300 VanDerWaalsContact O-CB 3.27Å; A1296-E1300 WeakPolarHBondContact O-CB 3.42Å; A1296-E1300 WeakPolarHBondContact O-CG 3.26Å; A1296-E1300 PolarHBondContact O-N 3.02Å; E1300-K1304 HydrophobicContact CB-CD 4.39Å; E1300-K1304 WeakPolarHBondContact O-CA 3.29Å; E1300-K1304 WeakPolarHBondContact O-CB 3.5Å; E1300-K1304 VanDerWaalsContact O-CD 3.22Å; E1300-K1304 WeakPolarHBondContact O-CD 3.19Å; E1300-K1304 WeakPolarHBondContact O-CG 3.43Å; E1300-K1304 PolarHBondContact O-N 2.93Å; E1300-K1304 WeakPolarHBondContact OE1-CE 3.3Å; E1300-K1304 IonicContact OE1-NZ 3.38Å; E1300-K1304 PolarHBondContact OE1-NZ 2.88Å; E1300-K1304 IonicContact OE2-NZ 2.7Å; E1300-K1304 PolarHBondContact OE2-NZ 2.87Å; E1300-K1304 VanDerWaalsContact OE2-NZ 3.13Å
1301	I	46.2	Very low	41.5	Very low	49 Å²	49	101.4 Å²	101.4	25%	0.251	55%	0.546	S	S	.	.	H	α-helix	trans	-73.6	-43.5	177.9	-78.5	171.4	0	0	0	110.6	Y1297 I1299 K1304 Q1305	Y1297-I1301 HydrophobicContact CD1-CD1 3.73Å; Y1297-I1301 HydrophobicContact CE1-CD1 3.41Å; Y1297-I1301 VanDerWaalsContact CE1-CD1 3.41Å; Y1297-I1301 HydrophobicContact CE1-CG1 4.42Å; Y1297-I1301 HydrophobicContact CE2-CD1 4.44Å; Y1297-I1301 HydrophobicContact CG-CD1 4.38Å; Y1297-I1301 WeakPolarHBondContact O-CA 3.49Å; Y1297-I1301 WeakPolarHBondContact O-CB 3.15Å; Y1297-I1301 WeakPolarHBondContact O-CG1 3.3Å; Y1297-I1301 PolarHBondContact O-N 3.21Å; I1299-I1301 VanDerWaalsContact C-N 3.32Å; I1299-I1301 PolarHBondContact O-N 3.35Å; I1301-K1304 CarbonylContact O-C 3.53Å; I1301-K1304 PolarHBondContact O-N 3.22Å; I1301-Q1305 HydrophobicContact CG2-CG 4.19Å; I1301-Q1305 WeakPolarHBondContact O-CB 3.37Å; I1301-Q1305 VanDerWaalsContact O-CG 3.23Å; I1301-Q1305 WeakPolarHBondContact O-CG 3.35Å; I1301-Q1305 PolarHBondContact O-N 2.77Å
1302	N	38	Very low	40.2	Very low	84 Å²	84	103.1 Å²	103.1	45%	0.449	56%	0.559	S	S	.	*	H	α-helix	trans	-69.2	-34.5	175.9	-71	-40.8	0	0	0	111.7	N1298 I1299 Q1305 I1306	N1298-N1302 WeakPolarHBondContact O-CB 3.45Å; N1298-N1302 PolarHBondContact O-N 3.43Å; N1298-N1302 PolarHBondContact O-ND2 2.99Å; I1299-N1302 PolarHBondContact O-N 3.21Å; N1302-Q1305 PolarHBondContact O-N 2.97Å; N1302-I1306 HydrophobicContact CB-CD1 4.2Å; N1302-I1306 WeakPolarHBondContact O-CA 3.31Å; N1302-I1306 WeakPolarHBondContact O-CB 3.35Å; N1302-I1306 WeakPolarHBondContact O-CG1 3.44Å; N1302-I1306 PolarHBondContact O-N 3.07Å
1303	E	32.6	Very low	38.8	Very low	115 Å²	115	108.4 Å²	108.4	54%	0.537	57%	0.573	S	S	.	*	H	α-helix	trans	-70.2	-38.2	172	-70.1	179.7	157.9	0	0	111.3	I1299 Q1305 N1307	I1299-E1303 VanDerWaalsContact CG2-CD 3.41Å; I1299-E1303 HydrophobicContact CG2-CG 3.96Å; I1299-E1303 WeakPolarHBondContact O-CA 3.28Å; I1299-E1303 WeakPolarHBondContact O-CB 3.47Å; I1299-E1303 VanDerWaalsContact O-CG 3.22Å; I1299-E1303 WeakPolarHBondContact O-CG 3.33Å; I1299-E1303 PolarHBondContact O-N 3.5Å; E1303-Q1305 VanDerWaalsContact C-N 3.34Å; E1303-N1307 WeakPolarHBondContact O-CA 2.98Å; E1303-N1307 WeakPolarHBondContact O-CB 3.4Å; E1303-N1307 PolarHBondContact O-N 3.43Å
1304	K	35.6	Very low	37.5	Very low	117 Å²	117	105.4 Å²	105.4	51%	0.509	57%	0.571	S	S	.	*	H	α-helix	trans	-77.1	-12.5	173.3	-67.8	164.3	-166.4	171.6	0	114	E1300 I1301 A1308	E1300-K1304 HydrophobicContact CB-CD 4.39Å; E1300-K1304 WeakPolarHBondContact O-CA 3.29Å; E1300-K1304 WeakPolarHBondContact O-CB 3.5Å; E1300-K1304 VanDerWaalsContact O-CD 3.22Å; E1300-K1304 WeakPolarHBondContact O-CD 3.19Å; E1300-K1304 WeakPolarHBondContact O-CG 3.43Å; E1300-K1304 PolarHBondContact O-N 2.93Å; E1300-K1304 WeakPolarHBondContact OE1-CE 3.3Å; E1300-K1304 IonicContact OE1-NZ 3.38Å; E1300-K1304 PolarHBondContact OE1-NZ 2.88Å; E1300-K1304 IonicContact OE2-NZ 2.7Å; E1300-K1304 PolarHBondContact OE2-NZ 2.87Å; E1300-K1304 VanDerWaalsContact OE2-NZ 3.13Å; I1301-K1304 CarbonylContact O-C 3.53Å; I1301-K1304 PolarHBondContact O-N 3.22Å; K1304-A1308 WeakPolarHBondContact O-CB 3.37Å
1305	Q	37.8	Very low	36.6	Very low	150 Å²	150	105.5 Å²	105.5	70%	0.701	58%	0.576	S	S	*	*	H	α-helix	trans	-103	-27.5	174.6	-73.1	-176.8	-4.9	0	0	112.8	I1301 N1302 E1303	I1301-Q1305 HydrophobicContact CG2-CG 4.19Å; I1301-Q1305 WeakPolarHBondContact O-CB 3.37Å; I1301-Q1305 VanDerWaalsContact O-CG 3.23Å; I1301-Q1305 WeakPolarHBondContact O-CG 3.35Å; I1301-Q1305 PolarHBondContact O-N 2.77Å; N1302-Q1305 PolarHBondContact O-N 2.97Å; E1303-Q1305 VanDerWaalsContact C-N 3.34Å
1306	I	34.6	Very low	35.5	Very low	128 Å²	128	107.9 Å²	107.9	66%	0.656	58%	0.584	S	S	*	*	H	α-helix	trans	-94.5	-25.9	178.8	-59.4	171.2	0	0	0	111.5	N1302	N1302-I1306 HydrophobicContact CB-CD1 4.2Å; N1302-I1306 WeakPolarHBondContact O-CA 3.31Å; N1302-I1306 WeakPolarHBondContact O-CB 3.35Å; N1302-I1306 WeakPolarHBondContact O-CG1 3.44Å; N1302-I1306 PolarHBondContact O-N 3.07Å
1307	N	25	Very low	34.3	Very low	135 Å²	135	112.9 Å²	112.9	72%	0.722	60%	0.604	S	S	*	*	S	Bend	trans	-116.9	45.5	176.5	-69.3	-54.2	0	0	0	114.1	E1303	E1303-N1307 WeakPolarHBondContact O-CA 2.98Å; E1303-N1307 WeakPolarHBondContact O-CB 3.4Å; E1303-N1307 PolarHBondContact O-N 3.43Å
1308	A	31.6	Very low	33.2	Very low	58 Å²	58	113.3 Å²	113.3	48%	0.479	62%	0.615	S	S	.	*			trans	-144.3	64.3	176.8	0	0	0	0	0	115.6	K1304	K1304-A1308 WeakPolarHBondContact O-CB 3.37Å
1309	S	31.9	Very low	32.3	Very low	126 Å²	126	114.4 Å²	114.4	88%	0.881	63%	0.625	S	S	*	*	S	Bend	trans	-160.9	92.5	159.6	-83.6	0	0	0	0	114.9
1310	P	26.6	Very low	31.3	Very low	114 Å²	114	116.3 Å²	116.3	74%	0.74	64%	0.64	S	S	*	*	S	Bend	cis	-103.7	152.9	-40.6	36.8	-27.6	0	0	0	111.3
1311	S	27.7	Very low	30.8	Very low	97 Å²	97	121.6 Å²	121.6	68%	0.678	66%	0.657	S	S	*	*			trans	58	132.2	155.3	61.8	0	0	0	0	121.5
1312	V	29.9	Very low	29.9	Very low	119 Å²	119	127.9 Å²	127.9	72%	0.721	69%	0.685	S	S	*	*			trans	81.9	136	145.9	169.9	0	0	0	0	118.7
1313	E	27.6	Very low	29.4	Very low	170 Å²	170	131 Å²	131	79%	0.794	70%	0.7	S	S	*	*			trans	58.2	110.2	160.4	-79.8	159.8	-153.7	0	0	121.7
1314	S	28.3	Very low	29	Very low	86 Å²	86	128.8 Å²	128.8	60%	0.601	71%	0.709	S	S	*	*				48.6	129.2	129.3	72.5	0	0	0	0	119.4
1315	N	31.3	Very low	28.4	Very low	116 Å²	116	128.3 Å²	128.3	62%	0.62	72%	0.721	S	S	*	*				-160.6	131.9	66.2	-88.7	-72.4	0	0	0	109.5
1316	K	28.4	Very low	27.8	Very low	176 Å²	176	126.8 Å²	126.8	77%	0.765	72%	0.721	S	S	*	*				57.1	132.9	91.1	-60.1	-175.1	-168	157.6	0	114.5	N1318	K1316-N1318 PolarHBondContact O-N 2.58Å; K1316-N1318 VanDerWaalsContact O-N 3.14Å
1317	N	25.1	Very low	27.5	Very low	157 Å²	157	126.3 Å²	126.3	84%	0.84	73%	0.726	S	S	*	*	S	Bend	trans	-47.7	118.8	144.1	-76	-16.6	0	0	0	108.5
1318	N	25.2	Very low	27.5	Very low	143 Å²	143	126 Å²	126	77%	0.765	72%	0.723	S	S	*	*	S	Bend	trans	-66.1	134.7	171.7	-139.7	0.9	0	0	0	108.2	K1316	K1316-N1318 PolarHBondContact O-N 2.58Å; K1316-N1318 VanDerWaalsContact O-N 3.14Å
1319	T	28	Very low	27.1	Very low	101 Å²	101	131.2 Å²	131.2	62%	0.62	74%	0.742	S	S	*	*			trans	50.7	106.9	168.9	53.6	0	0	0	0	116.1	Y1321	T1319-Y1321 HydrophobicContact CG2-CE2 4.46Å
1320	V	26.7	Very low	26.8	Very low	115 Å²	115	134.7 Å²	134.7	70%	0.697	74%	0.741	S	S	*	*			cis	48.5	84.8	40.6	-170.1	0	0	0	0	112.2
1321	Y	29	Very low	26.7	Very low	197 Å²	197	135.1 Å²	135.1	77%	0.773	74%	0.742	S	S	*	*			trans	-172.3	112.1	148.1	-80.8	-61.7	0	0	0	104	T1319	T1319-Y1321 HydrophobicContact CG2-CE2 4.46Å
1322	E	27.8	Very low	26.8	Very low	181 Å²	181	136.9 Å²	136.9	85%	0.846	74%	0.744	S	S	*	*			cis	65.5	48	26.5	-151.1	168.2	-134	0	0	113.9
1323	I	26.5	Very low	27.4	Very low	149 Å²	149	138.7 Å²	138.7	76%	0.764	75%	0.749	S	S	*	*			trans	-135.9	124.9	154.9	-54.2	176.7	0	0	0	105.5
1324	G	24.5	Very low	27.4	Very low	69 Å²	69	138 Å²	138	71%	0.711	75%	0.751	S	S	*	*			cis	105.2	38.7	1.3	0	0	0	0	0	114.8
1325	S	23.7	Very low	27.1	Very low	108 Å²	108	139 Å²	139	76%	0.755	76%	0.758	S	S	*	*			trans	170.6	132.7	150.8	-84.5	0	0	0	0	113.6
1326	V	24.2	Very low	27	Very low	117 Å²	117	139.4 Å²	139.4	71%	0.709	77%	0.765	S	S	*	*			trans	66.2	141.1	159.8	-176.7	0	0	0	0	117.6	I1328	V1326-I1328 HydrophobicContact CG1-CD1 4.01Å; V1326-I1328 HydrophobicContact CG2-CD1 4.38Å
1327	P	29.1	Very low	27	Very low	118 Å²	118	138.6 Å²	138.6	77%	0.766	77%	0.767	S	S	*	*			cis	-91.1	137.6	-13.4	2.7	18.9	0	0	0	111.1
1328	I	25.3	Very low	26.9	Very low	129 Å²	129	139 Å²	139	66%	0.662	76%	0.763	S	S	*	*				98.5	113	53	-74.7	168.9	0	0	0	112.2	V1326	V1326-I1328 HydrophobicContact CG1-CD1 4.01Å; V1326-I1328 HydrophobicContact CG2-CD1 4.38Å
1329	L	23.5	Very low	26.8	Very low	167 Å²	167	136.6 Å²	136.6	87%	0.874	76%	0.757	S	S	*	*			trans	69.2	118.2	165.1	-65.7	166.9	0	0	0	120.3
1330	K	25.2	Very low	26.5	Very low	199 Å²	199	139.6 Å²	139.6	87%	0.865	76%	0.764	S	S	*	*			trans	-125.1	173.8	160.8	-101	-170.3	173.4	-174.5	0	107.8
1331	V	23.7	Very low	26.5	Very low	123 Å²	123	143 Å²	143	75%	0.745	77%	0.77	S	S	*	*			trans	87.6	83	166.1	-163.8	0	0	0	0	116.4
1332	D	31.1	Very low	26.2	Very low	135 Å²	135	137.7 Å²	137.7	72%	0.722	76%	0.761	S	S	*	*				58.1	128.9	115.3	-50.3	-0.7	0	0	0	122.9
1333	N	41.5	Very low	26	Very low	156 Å²	156	137 Å²	137	83%	0.834	76%	0.758	S	S	*	*			trans	57.3	99.2	143	-59.6	-19.9	0	0	0	121.2
1334	D	28	Very low	25.9	Very low	155 Å²	155	132.4 Å²	132.4	83%	0.829	74%	0.737	S	S	*	*			trans	-157.8	149	142.9	-146.8	-15.9	0	0	0	114.4
1335	S	21.9	Very low	25.8	Very low	107 Å²	107	134.3 Å²	134.3	75%	0.748	73%	0.73	S	S	*	*			trans	60.1	155.1	159	72.5	0	0	0	0	122.8
1336	T	28.9	Very low	25.7	Very low	126 Å²	126	134.3 Å²	134.3	77%	0.773	72%	0.717	S	S	*	*			trans	-86.2	-176.3	164	43.3	0	0	0	0	111.3
1337	I	28.8	Very low	25.6	Very low	159 Å²	159	132.4 Å²	132.4	82%	0.815	71%	0.708	S	S	*	*			trans	81.5	97.1	-167.7	-50	166.7	0	0	0	110.4
1338	H	23.4	Very low	25.8	Very low	164 Å²	164	131.4 Å²	131.4	76%	0.759	70%	0.7	S	S	*	*			cis	72.4	82.3	27.5	-143.9	-56.4	0	0	0	114.1
1339	C	22.4	Very low	26	Very low	93 Å²	93	132.3 Å²	132.3	63%	0.628	70%	0.703	S	S	*	*				174.2	145.3	117.7	-91.2	0	0	0	0	114.4
1340	E	22.2	Very low	26.3	Very low	165 Å²	165	130.7 Å²	130.7	77%	0.771	69%	0.693	S	S	*	*			trans	40.5	123.4	143.2	-59.3	172	179.9	0	0	119.3
1341	K	26.8	Very low	26.4	Very low	187 Å²	187	129.7 Å²	129.7	81%	0.813	69%	0.689	S	S	*	*				-142.8	143.1	58	-78.3	156	-176.2	173.3	0	111.4
1342	S	22.3	Very low	26.4	Very low	84 Å²	84	128.7 Å²	128.7	59%	0.587	69%	0.687	S	S	*	*				68.1	148.1	51.7	109.5	0	0	0	0	111.8
1343	E	23.2	Very low	26.2	Very low	166 Å²	166	129 Å²	129	78%	0.776	68%	0.684	S	S	*	*			cis	-169.1	-171	-4.3	-123.9	164.3	159.8	0	0	108.9
1344	T	23.5	Very low	25.3	Very low	53 Å²	53	129.2 Å²	129.2	33%	0.325	68%	0.68	S	S	.	*			trans	-31.7	151.9	166.7	54.6	0	0	0	0	121.2	F1542	T1344-F1542 HydrophobicContact CG2-CE1 4.33Å; T1344-F1542 HydrophobicContact CG2-CE2 4.32Å; T1344-F1542 HydrophobicContact CG2-CZ 3.95Å; T1344-F1542 WeakPolarHBondContact OG1-CE2 3.4Å; T1344-F1542 WeakPolarHBondContact OG1-CZ 3.45Å
1345	L	22.9	Very low	25.2	Very low	109 Å²	109	127.7 Å²	127.7	57%	0.571	67%	0.671	S	S	*	*				-127.1	-169.4	116.4	-79.8	-177.7	0	0	0	106.1	P1539 G1540	L1345-P1539 HydrophobicContact CB-CG 3.77Å; L1345-P1539 WeakPolarHBondContact O-CB 3.5Å; L1345-G1540 WeakPolarHBondContact O-CA 3.34Å; L1345-G1540 PolarHBondContact O-N 3.15Å
1346	K	21.7	Very low	25.6	Very low	109 Å²	109	126.9 Å²	126.9	47%	0.474	66%	0.656	S	S	.	*	B	Isolated β-bridge	cis	100.6	59.2	7.9	-134.9	144.9	-135.6	172.5	0	120.2	G1540 Q1541 F1542	K1346-G1540 CarbonylContact C-O 3.52Å; K1346-G1540 WeakPolarHBondContact CA-O 3.45Å; K1346-G1540 PolarHBondContact N-O 3.48Å; K1346-Q1541 WeakPolarHBondContact CA-O 3.49Å; K1346-Q1541 WeakPolarHBondContact CB-O 3.18Å; K1346-Q1541 PolarHBondContact N-O 3.15Å; K1346-Q1541 VanDerWaalsContact N-O 3.14Å; K1346-F1542 HydrophobicContact CD-CB 4.05Å; K1346-F1542 VanDerWaalsContact NZ-CB 3.28Å; K1346-F1542 PolarHBondContact NZ-O 2.83Å
1347	S	22.3	Very low	25.7	Very low	76 Å²	76	123.5 Å²	123.5	53%	0.531	64%	0.636	S	S	.	*			trans	65.4	132.1	154.1	63.1	0	0	0	0	123.2	P1539 G1540	S1347-P1539 VanDerWaalsContact CA-O 3.29Å; S1347-P1539 WeakPolarHBondContact CA-O 3.41Å; S1347-P1539 PolarHBondContact N-O 2.83Å; S1347-G1540 PolarHBondContact N-O 2.95Å
1348	T	33.7	Very low	25.5	Very low	97 Å²	97	121 Å²	121	60%	0.595	63%	0.628	S	S	*	*			trans	-12.6	151.2	142.3	4.5	0	0	0	0	119.7
1349	M	28.6	Very low	25.8	Very low	148 Å²	148	118 Å²	118	73%	0.729	62%	0.617	S	S	*	*			trans	78.5	141	156.3	-63.5	166.7	65.2	0	0	116.4
1350	M	30	Very low	26.1	Very low	134 Å²	134	120.6 Å²	120.6	66%	0.66	62%	0.618	S	S	*	*			cis	-165.2	162.1	3.6	-129	-174	178.1	0	0	113.5
1351	K	27.4	Very low	26.4	Very low	178 Å²	178	120 Å²	120	77%	0.774	62%	0.615	S	S	*	*			trans	66.4	95.4	146.5	-72.5	169.6	173.4	176.7	0	120.3
1352	S	24.6	Very low	26.3	Very low	101 Å²	101	116.5 Å²	116.5	71%	0.706	60%	0.602	S	S	*	*			trans	174.5	130	141.1	47.6	0	0	0	0	105.5
1353	E	26.4	Very low	26.4	Very low	143 Å²	143	117.8 Å²	117.8	67%	0.668	61%	0.606	S	S	*	*			cis	-136.6	150.2	15	-102.4	150.3	-162.6	0	0	108.8
1354	E	22.2	Very low	26.7	Very low	160 Å²	160	116.9 Å²	116.9	75%	0.748	61%	0.606	S	S	*	*				49.9	116.6	90.4	-48.1	-165.7	161.9	0	0	114.5
1355	L	26.3	Very low	26.7	Very low	123 Å²	123	118.1 Å²	118.1	64%	0.644	62%	0.617	S	S	*	*			trans	99	87.6	158.1	-45.2	179.1	0	0	0	115.8	P1357	L1355-P1357 HydrophobicContact CD2-CG 4.15Å
1356	E	30.1	Very low	27.1	Very low	90 Å²	90	121.2 Å²	121.2	42%	0.421	63%	0.629	S	S	.	*				-48.8	117	75.3	-154.9	-119.2	-71.8	0	0	114.2	N1359 T1530 L1532	E1356-N1359 PolarHBondContact OE2-ND2 2.68Å; E1356-T1530 HydrophobicContact CB-CG2 3.98Å; E1356-T1530 HydrophobicContact CG-CG2 3.64Å; E1356-L1532 HydrophobicContact CB-CB 4.3Å; E1356-L1532 HydrophobicContact CB-CD1 4.24Å; E1356-L1532 HydrophobicContact CG-CD1 4.49Å
1357	P	31.4	Very low	27.1	Very low	55 Å²	55	121.3 Å²	121.3	36%	0.357	64%	0.643	S	S	.	*				-154.8	-145.6	93.4	41.8	-20.8	0	0	0	111.7	L1355	L1355-P1357 HydrophobicContact CD2-CG 4.15Å
1358	T	25.1	Very low	27.2	Very low	106 Å²	106	121.9 Å²	121.9	65%	0.65	65%	0.652	S	S	*	*			trans	53.7	64.4	165.2	42.9	0	0	0	0	109.9
1359	N	28.1	Very low	26.7	Very low	100 Å²	100	123.2 Å²	123.2	54%	0.535	66%	0.66	S	S	.	*			cis	50.5	175	47.6	-52.4	-39.1	0	0	0	111	E1356	E1356-N1359 PolarHBondContact OE2-ND2 2.68Å
1360	K	28.9	Very low	26.4	Very low	148 Å²	148	123.4 Å²	123.4	64%	0.643	66%	0.661	S	S	*	*			trans	70.8	128.9	153.1	-72.5	173.1	179	-178.8	0	117.1
1361	E	28.2	Very low	26.1	Very low	152 Å²	152	123.2 Å²	123.2	71%	0.71	66%	0.662	S	S	*	*			cis	-112.9	136.9	-7.1	-96.3	81.4	-144.6	0	0	109.1
1362	H	24.7	Very low	26.2	Very low	115 Å²	115	121.2 Å²	121.2	53%	0.532	66%	0.659	S	S	.	*				61.1	145	69.5	-90.2	-59.1	0	0	0	114.5
1363	V	26.1	Very low	26.1	Very low	111 Å²	111	124.5 Å²	124.5	67%	0.673	66%	0.661	S	S	*	*			trans	61	94.5	149.4	177.5	0	0	0	0	115.8
1364	N	28.8	Very low	26.1	Very low	147 Å²	147	125 Å²	125	79%	0.786	66%	0.663	S	S	*	*				-161.3	152.7	98.8	-88.9	-43.4	0	0	0	108.7
1365	S	22.8	Very low	26.2	Very low	78 Å²	78	122.1 Å²	122.1	55%	0.545	66%	0.657	S	S	.	*			cis	172.8	157	-21.1	52.6	0	0	0	0	105.8
1366	Q	30.9	Very low	26.5	Very low	175 Å²	175	122 Å²	122	82%	0.818	66%	0.661	S	S	*	*			trans	69.8	117.5	176	-51.2	169.8	-2.5	0	0	113.1
1367	S	22	Very low	26.4	Very low	111 Å²	111	123.4 Å²	123.4	78%	0.776	67%	0.671	S	S	*	*			cis	63	158.7	0.4	71	0	0	0	0	118.2
1368	A	24.5	Very low	26.3	Very low	88 Å²	88	125.9 Å²	125.9	73%	0.727	69%	0.69	S	S	*	*			trans	78.3	148.7	-175.4	0	0	0	0	0	116.1
1369	T	23.4	Very low	26.5	Very low	124 Å²	124	126.9 Å²	126.9	76%	0.761	69%	0.685	S	S	*	*			cis	-174.9	159.5	-26.5	35.2	0	0	0	0	107.1
1370	M	23.2	Very low	26.5	Very low	152 Å²	152	132.8 Å²	132.8	75%	0.749	70%	0.7	S	S	*	*			trans	57.9	135.8	146.2	-81.9	-99.1	-75	0	0	121.2
1371	I	23	Very low	26.6	Very low	131 Å²	131	128.5 Å²	128.5	67%	0.672	70%	0.697	S	S	*	*			trans	70.4	148	150.3	-73.9	178.4	0	0	0	117.3	K1373	I1371-K1373 PolarHBondContact O-N 3.37Å
1372	D	29	Very low	27.2	Very low	136 Å²	136	130.8 Å²	130.8	73%	0.727	71%	0.705	S	S	*	*			trans	-48.5	127.2	168.9	-41.7	-89.4	0	0	0	111.6
1373	K	23.9	Very low	27.4	Very low	169 Å²	169	130.8 Å²	130.8	74%	0.735	72%	0.717	S	S	*	*				-161.2	135.6	90.7	-96.7	170.3	178.5	174.7	0	109.8	I1371	I1371-K1373 PolarHBondContact O-N 3.37Å
1374	E	25.3	Very low	27.2	Very low	153 Å²	153	130.5 Å²	130.5	72%	0.715	72%	0.719	S	S	*	*				61.9	139	72.6	-166.1	-171.3	-142.9	0	0	110.7
1375	V	24.9	Very low	27	Very low	101 Å²	101	131 Å²	131	61%	0.612	72%	0.721	S	S	*	*			trans	75	90.6	-166.5	-171	0	0	0	0	110.2	L1377	V1375-L1377 HydrophobicContact CG1-CD1 4.06Å; V1375-L1377 HydrophobicContact CG1-CG 4.27Å
1376	T	31.7	Very low	27.1	Very low	120 Å²	120	131.9 Å²	131.9	74%	0.736	73%	0.727	S	S	*	*				53.8	160.7	60.1	90	0	0	0	0	112.9
1377	L	28.6	Very low	26.7	Very low	120 Å²	120	131 Å²	131	63%	0.628	73%	0.726	S	S	*	*			trans	66.4	160.7	-158.9	-37.3	166.1	0	0	0	111.2	V1375 K1379	V1375-L1377 HydrophobicContact CG1-CD1 4.06Å; V1375-L1377 HydrophobicContact CG1-CG 4.27Å; L1377-K1379 HydrophobicContact CD2-CD 4.07Å; L1377-K1379 VanDerWaalsContact CD2-CE 3.44Å; L1377-K1379 HydrophobicContact CD2-CG 4.16Å
1378	S	29.4	Very low	26.8	Very low	107 Å²	107	130.1 Å²	130.1	75%	0.748	72%	0.72	S	S	*	*	S	Bend	cis	-98.2	100.4	-16.3	-156.2	0	0	0	0	107.2
1379	K	29.7	Very low	27	Very low	127 Å²	127	135.9 Å²	135.9	55%	0.552	72%	0.723	S	S	*	*				67.9	126.6	101.2	-72.9	165	166.9	154	0	112.1	L1377	L1377-K1379 HydrophobicContact CD2-CD 4.07Å; L1377-K1379 VanDerWaalsContact CD2-CE 3.44Å; L1377-K1379 HydrophobicContact CD2-CG 4.16Å
1380	R	27	Very low	27.1	Very low	224 Å²	224	136 Å²	136	85%	0.845	72%	0.719	S	S	*	*			cis	-154.1	165	25.6	-124.1	152.6	-175.4	162.2	-5.5	113.3
1381	G	30.7	Very low	27.5	Very low	58 Å²	58	134.1 Å²	134.1	60%	0.598	72%	0.716	S	S	*	*			trans	-48.4	159.3	-177.2	0	0	0	0	0	115.6
1382	K	41.4	Very low	28.2	Very low	199 Å²	199	135.1 Å²	135.1	87%	0.865	72%	0.723	S	S	*	*			cis	-139	160.2	39.7	-61.5	111.2	174.9	-168.9	0	111.7
1383	C	30.2	Very low	28.5	Very low	116 Å²	116	134 Å²	134	78%	0.784	72%	0.723	S	S	*	*			cis	-159.4	169.7	-16.8	-106.5	0	0	0	0	108.8
1384	S	21.5	Very low	28.6	Very low	104 Å²	104	133.2 Å²	133.2	73%	0.727	73%	0.727	S	S	*	*			trans	-76.9	169.9	169.6	52.7	0	0	0	0	112.8
1385	I	24.7	Very low	28.9	Very low	158 Å²	158	133.7 Å²	133.7	81%	0.81	73%	0.729	S	S	*	*				-168.5	143.6	118.7	-103.6	163.3	0	0	0	112.6
1386	S	23.5	Very low	29	Very low	97 Å²	97	134 Å²	134	68%	0.678	73%	0.731	S	S	*	*			trans	-109.5	166.1	161.4	54.9	0	0	0	0	108.3
1387	I	22.6	Very low	28.6	Very low	156 Å²	156	134.6 Å²	134.6	80%	0.8	72%	0.721	S	S	*	*			trans	95.5	137.5	-165.4	-58.3	155.6	0	0	0	110
1388	S	24.7	Very low	28.4	Very low	92 Å²	92	133.6 Å²	133.6	64%	0.643	71%	0.711	S	S	*	*			cis	-171.7	-141.2	-21.3	62	0	0	0	0	109.2
1389	R	28.1	Very low	28.5	Very low	210 Å²	210	131.3 Å²	131.3	79%	0.792	70%	0.695	S	S	*	*			trans	-16.4	153.9	133.8	-70.5	178.7	176.9	152.1	-1.3	115.8
1390	D	26.4	Very low	28.4	Very low	126 Å²	126	129.3 Å²	129.3	67%	0.674	71%	0.71	S	S	*	*			cis	-162.7	168.2	2.3	-101.5	-24.1	0	0	0	111.1
1391	T	31.8	Very low	28.5	Very low	112 Å²	112	122.5 Å²	122.5	69%	0.687	70%	0.697	S	S	*	*			trans	25.9	126.1	151.1	62.3	0	0	0	0	123.4
1392	D	37.1	Very low	28.2	Very low	153 Å²	153	127.5 Å²	127.5	82%	0.818	71%	0.708	S	S	*	*				53	-144.5	129.8	-50.4	-29.7	0	0	0	118.8
1393	P	35.8	Very low	28.2	Very low	113 Å²	113	124.5 Å²	124.5	73%	0.734	70%	0.7	S	S	*	*				-125.4	-178.4	-123.9	37.7	-17.3	0	0	0	116.3
1394	N	26.7	Very low	28.5	Very low	152 Å²	152	124.8 Å²	124.8	81%	0.813	69%	0.693	S	S	*	*			trans	82.2	153.3	158.7	-105.4	-19	0	0	0	120.4
1395	Q	31.1	Very low	29.1	Very low	162 Å²	162	124.1 Å²	124.1	76%	0.757	69%	0.685	S	S	*	*			trans	68.9	92.2	155.2	-76.6	-174.2	-1.3	0	0	121.6
1396	T	25.6	Very low	29.5	Very low	107 Å²	107	118.5 Å²	118.5	66%	0.656	67%	0.665	S	S	*	*				62.1	132.3	116.6	52.7	0	0	0	0	123.1
1397	Y	23.9	Very low	29.7	Very low	133 Å²	133	117.1 Å²	117.1	52%	0.522	66%	0.656	S	S	.	*			trans	84.8	107.3	137.2	-77	-47.4	0	0	0	122.5	S1408 E1409	Y1397-S1408 VanDerWaalsContact CE1-OG 3.23Å; Y1397-S1408 WeakPolarHBondContact CE1-OG 3.38Å; Y1397-S1408 PolarHBondContact OH-OG 2.89Å; Y1397-E1409 PolarHBondContact OH-OE1 3.25Å; Y1397-E1409 VanDerWaalsContact OH-OE1 3.05Å
1398	K	24.7	Very low	29.8	Very low	99 Å²	99	112.9 Å²	112.9	43%	0.43	64%	0.64	S	S	.	*				78.4	100.1	127.2	-82.5	161.5	-175.4	169.8	0	119.4	V1405 S1407	K1398-V1405 HydrophobicContact CD-CG1 4.11Å; K1398-V1405 HydrophobicContact CG-CG1 4.36Å; K1398-S1407 VanDerWaalsContact CE-CA 3.41Å; K1398-S1407 WeakPolarHBondContact CE-OG 3.4Å; K1398-S1407 PolarHBondContact NZ-OG 3.24Å
1399	C	30.5	Very low	29.9	Very low	60 Å²	60	114.1 Å²	114.1	41%	0.405	64%	0.635	S	S	.	*			trans	47.2	81.2	130.1	-62.7	0	0	0	0	117.8	S1401 L1404 G1406	C1399-S1401 PolarHBondContact O-N 2.86Å; C1399-S1401 PolarHBondContact O-OG 3.48Å; C1399-L1404 PolarHBondContact SG-O 3.28Å; C1399-L1404 VanDerWaalsContact SG-O 3.4Å; C1399-G1406 WeakPolarHBondContact SG-CA 3.46Å
1400	G	28.7	Very low	29.8	Very low	84 Å²	84	109.8 Å²	109.8	87%	0.866	63%	0.632	S	S	*	*			trans	-62.3	3.2	167.3	0	0	0	0	0	116
1401	S	28.9	Very low	29.6	Very low	81 Å²	81	109.1 Å²	109.1	57%	0.566	63%	0.628	S	S	*	*	S	Bend	trans	67.9	172.4	175	-61	0	0	0	0	112.2	C1399 I1403	C1399-S1401 PolarHBondContact O-N 2.86Å; C1399-S1401 PolarHBondContact O-OG 3.48Å; S1401-I1403 VanDerWaalsContact CB-N 3.33Å
1402	I	25.3	Very low	29.1	Very low	163 Å²	163	108.3 Å²	108.3	84%	0.836	62%	0.615	S	S	*	*	S	Bend	cis	-91.6	93.1	27.8	-53	-174.6	0	0	0	112.3
1403	I	40.1	Very low	28.8	Very low	136 Å²	136	101.6 Å²	101.6	70%	0.697	58%	0.58	S	S	*	*	S	Bend	trans	74	106.6	161.1	-55.5	168.7	0	0	0	113.3	S1401	S1401-I1403 VanDerWaalsContact CB-N 3.33Å
1404	L	36.8	Very low	28.1	Very low	123 Å²	123	100.2 Å²	100.2	64%	0.644	57%	0.566	S	S	*	*			cis	-151.9	-173	7.5	-108.7	166.7	0	0	0	111.6	C1399	C1399-L1404 PolarHBondContact SG-O 3.28Å; C1399-L1404 VanDerWaalsContact SG-O 3.4Å
1405	V	34.8	Very low	28.1	Very low	90 Å²	90	95.3 Å²	95.3	55%	0.545	54%	0.542	S	S	.	.			trans	-30.7	135.9	158	-177.7	0	0	0	0	112.5	K1398	K1398-V1405 HydrophobicContact CD-CG1 4.11Å; K1398-V1405 HydrophobicContact CG-CG1 4.36Å
1406	G	31.8	Very low	27.8	Very low	39 Å²	39	87.7 Å²	87.7	40%	0.402	51%	0.507	S	S	.	.			cis	116.4	-165.8	10.6	0	0	0	0	0	111.7	C1399	C1399-G1406 WeakPolarHBondContact SG-CA 3.46Å
1407	S	28.4	Very low	27.7	Very low	69 Å²	69	86.5 Å²	86.5	48%	0.483	50%	0.496	S	S	.	.			trans	81.2	135.2	-171.4	-26.1	0	0	0	0	110	K1398	K1398-S1407 VanDerWaalsContact CE-CA 3.41Å; K1398-S1407 WeakPolarHBondContact CE-OG 3.4Å; K1398-S1407 PolarHBondContact NZ-OG 3.24Å
1408	S	25.5	Very low	27.8	Very low	66 Å²	66	83.8 Å²	83.8	46%	0.462	49%	0.491	S	S	.	.				90.7	148.3	71.7	-71	0	0	0	0	112	Y1397	Y1397-S1408 VanDerWaalsContact CE1-OG 3.23Å; Y1397-S1408 WeakPolarHBondContact CE1-OG 3.38Å; Y1397-S1408 PolarHBondContact OH-OG 2.89Å
1409	E	26.7	Very low	27.7	Very low	118 Å²	118	81.6 Å²	81.6	55%	0.551	48%	0.484	S	S	*	.			cis	-114.7	-144.9	-13.5	-118.7	109	-131.3	0	0	106.5	Y1397 I1411	Y1397-E1409 PolarHBondContact OH-OE1 3.25Å; Y1397-E1409 VanDerWaalsContact OH-OE1 3.05Å; E1409-I1411 HydrophobicContact CB-CD1 4.31Å; E1409-I1411 HydrophobicContact CB-CG1 4.28Å
1410	T	24.8	Very low	27.3	Very low	119 Å²	119	83.5 Å²	83.5	73%	0.73	49%	0.494	S	S	*	.			cis	32.7	153.7	45.2	41.4	0	0	0	0	111.6
1411	I	22.7	Very low	27	Very low	113 Å²	113	87.5 Å²	87.5	58%	0.579	49%	0.49	S	S	*	.				-146.8	139.2	53.3	-93.5	161.3	0	0	0	103.8	E1409	E1409-I1411 HydrophobicContact CB-CD1 4.31Å; E1409-I1411 HydrophobicContact CB-CG1 4.28Å
1412	K	21.7	Very low	26.8	Very low	95 Å²	95	87.8 Å²	87.8	41%	0.413	50%	0.497	S	S	.	.				54.6	164.3	68.6	-103.1	-141.3	167.8	-118.3	0	110.7	E1645	K1412-E1645 WeakPolarHBondContact CE-OE1 3.47Å; K1412-E1645 WeakPolarHBondContact CE-OE2 3.5Å; K1412-E1645 IonicContact NZ-OE1 2.96Å; K1412-E1645 PolarHBondContact NZ-OE1 3.08Å; K1412-E1645 IonicContact NZ-OE2 3.25Å; K1412-E1645 PolarHBondContact NZ-OE2 2.89Å
1413	P	30.2	Very low	26.8	Very low	12 Å²	12	88 Å²	88	8%	0.078	49%	0.494	C	S	.	.			trans	-134.5	136.8	-147.7	48.8	-31.3	0	0	0	110	E1641 L1642 E1645 N1646	P1413-E1641 WeakPolarHBondContact CG-O 3.45Å; P1413-L1642 VanDerWaalsContact C-CB 3.48Å; P1413-L1642 CarbonylContact C-O 3.55Å; P1413-L1642 HydrophobicContact CB-CB 3.64Å; P1413-L1642 HydrophobicContact CB-CD1 3.13Å; P1413-L1642 HydrophobicContact CB-CD2 4.42Å; P1413-L1642 HydrophobicContact CB-CG 3.69Å; P1413-E1645 WeakPolarHBondContact CD-OE2 3.33Å; P1413-E1645 HydrophobicContact CG-CB 3.82Å; P1413-E1645 HydrophobicContact CG-CG 3.91Å; P1413-E1645 VanDerWaalsContact CG-OE2 3.28Å; P1413-E1645 WeakPolarHBondContact CG-OE2 3.44Å; P1413-N1646 PolarHBondContact O-ND2 2.91Å
1414	N	22.3	Very low	26.1	Very low	84 Å²	84	87.1 Å²	87.1	45%	0.449	49%	0.491	S	S	.	.			trans	-145.6	116	176.8	-63.6	81.9	0	0	0	113.5	E1416 L1642 N1646	N1414-E1416 PolarHBondContact ND2-O 2.66Å; N1414-L1642 WeakPolarHBondContact CA-O 3.37Å; N1414-L1642 VanDerWaalsContact N-CD2 3.29Å; N1414-L1642 PolarHBondContact N-O 2.9Å; N1414-L1642 WeakPolarHBondContact O-CD2 3.4Å; N1414-N1646 PolarHBondContact ND2-ND2 2.91Å; N1414-N1646 VanDerWaalsContact ND2-ND2 3.15Å; N1414-N1646 PolarHBondContact ND2-OD1 3.11Å
1415	P	25.7	Very low	25.5	Very low	49 Å²	49	88.1 Å²	88.1	32%	0.318	50%	0.497	S	S	.	.	S	Bend		-118.5	54.4	118.1	37.9	-38.1	0	0	0	110.8	D1639 L1642 A1643 T1726 L1730	P1415-D1639 WeakPolarHBondContact CD-O 3.37Å; P1415-D1639 WeakPolarHBondContact CG-O 3.12Å; P1415-L1642 VanDerWaalsContact CD-C 3.49Å; P1415-L1642 HydrophobicContact CG-CB 4.49Å; P1415-A1643 HydrophobicContact CG-CB 4.37Å; P1415-T1726 WeakPolarHBondContact O-CB 3.22Å; P1415-T1726 PolarHBondContact O-OG1 2.65Å; P1415-T1726 VanDerWaalsContact O-OG1 3.12Å; P1415-L1730 HydrophobicContact CB-CD1 4.49Å; P1415-L1730 HydrophobicContact CG-CD1 3.49Å; P1415-L1730 VanDerWaalsContact CG-CD1 3.49Å
1416	E	24.9	Very low	25.7	Very low	2 Å²	2	90 Å²	90	1%	0.009	51%	0.514	C	S	.	.			trans	-139.6	105.8	164.8	-85.9	-167.3	-179.2	0	0	106.7	N1414 A1643 N1646 R1647 L1723 I1727	N1414-E1416 PolarHBondContact ND2-O 2.66Å; E1416-A1643 VanDerWaalsContact CD-C 3.41Å; E1416-A1643 HydrophobicContact CG-CB 3.85Å; E1416-N1646 HydrophobicContact CB-CB 3.65Å; E1416-N1646 VanDerWaalsContact O-CG 3.3Å; E1416-N1646 PolarHBondContact O-ND2 3.46Å; E1416-R1647 WeakPolarHBondContact OE2-CA 3.45Å; E1416-R1647 VanDerWaalsContact OE2-CB 3.28Å; E1416-R1647 WeakPolarHBondContact OE2-CB 3.47Å; E1416-R1647 PolarHBondContact OE2-N 3.46Å; E1416-L1723 HydrophobicContact CB-CD2 3.72Å; E1416-L1723 HydrophobicContact CB-CG 4.46Å; E1416-L1723 VanDerWaalsContact CD-CB 3.42Å; E1416-L1723 HydrophobicContact CG-CB 3.95Å; E1416-L1723 HydrophobicContact CG-CD2 3.8Å; E1416-L1723 HydrophobicContact CG-CG 4.23Å; E1416-L1723 WeakPolarHBondContact OE1-CB 3.41Å; E1416-L1723 WeakPolarHBondContact OE2-CD1 3.28Å; E1416-I1727 WeakPolarHBondContact OE1-CD1 3.43Å; E1416-I1727 WeakPolarHBondContact OE1-CG1 3.42Å
1417	D	24	Very low	25.3	Very low	81 Å²	81	96.4 Å²	96.4	43%	0.433	54%	0.536	S	S	.	.				-164	156.4	102.9	-139	-44.3	0	0	0	111.1	Q1719 L1723	D1417-Q1719 WeakPolarHBondContact OD1-CB 3.4Å; D1417-Q1719 VanDerWaalsContact OD1-CG 3.26Å; D1417-Q1719 WeakPolarHBondContact OD1-CG 3.24Å; D1417-Q1719 PolarHBondContact OD1-NE2 3.03Å; D1417-L1723 HydrophobicContact CB-CD2 4.26Å; D1417-L1723 WeakPolarHBondContact OD1-CD2 3.17Å
1418	N	24.8	Very low	25.2	Very low	77 Å²	77	99.5 Å²	99.5	41%	0.412	55%	0.545	S	S	.	.			trans	-119.7	-172	-173.9	-147.4	-40.5	0	0	0	110.6	Q1719 D1722	N1418-Q1719 WeakPolarHBondContact O-CG 3.47Å; N1418-Q1719 PolarHBondContact O-NE2 3.26Å; N1418-D1722 HydrophobicContact CB-CB 3.49Å; N1418-D1722 VanDerWaalsContact CB-CB 3.49Å; N1418-D1722 VanDerWaalsContact ND2-CB 3.31Å; N1418-D1722 WeakPolarHBondContact ND2-CB 3.3Å; N1418-D1722 PolarHBondContact ND2-OD2 2.9Å
1419	N	22.7	Very low	25.3	Very low	53 Å²	53	101.9 Å²	101.9	28%	0.283	56%	0.557	S	S	.	*			trans	46.1	94.6	168.1	-63.5	-67.4	0	0	0	116.9	L1718 Q1719 D1722	N1419-L1718 PolarHBondContact ND2-O 2.9Å; N1419-Q1719 HydrophobicContact CB-CG 4.03Å; N1419-D1722 PolarHBondContact ND2-OD2 3.08Å
1420	V	23.7	Very low	25.4	Very low	100 Å²	100	102.6 Å²	102.6	61%	0.606	56%	0.564	S	S	*	*				-154.3	126.8	110.2	134.1	0	0	0	0	112	L1715	V1420-L1715 HydrophobicContact CG2-CD1 3.63Å; V1420-L1715 HydrophobicContact CG2-CD2 3.83Å; V1420-L1715 HydrophobicContact CG2-CG 3.93Å
1421	E	22.4	Very low	25.5	Very low	168 Å²	168	104.8 Å²	104.8	79%	0.785	56%	0.564	S	S	*	*			trans	43.5	117.1	151.4	-57.9	-174.9	155.1	0	0	121.1
1422	A	23.8	Very low	25.7	Very low	86 Å²	86	106.2 Å²	106.2	71%	0.711	57%	0.568	S	S	*	*				91.7	113	120.3	0	0	0	0	0	119.9
1423	E	25.3	Very low	25.8	Very low	168 Å²	168	108.4 Å²	108.4	79%	0.785	58%	0.583	S	S	*	*				71.6	100.7	128	-63.4	-158.1	163.6	0	0	119.9
1424	N	24.8	Very low	25.4	Very low	118 Å²	118	118.6 Å²	118.6	63%	0.631	62%	0.62	S	S	*	*				76.1	101.4	126.8	-65.1	-49.9	0	0	0	118.3
1425	N	23.7	Very low	25.5	Very low	144 Å²	144	122.4 Å²	122.4	77%	0.77	64%	0.639	S	S	*	*				38.7	118.1	109.9	-65.5	-53.5	0	0	0	116.6	M1427	N1425-M1427 VanDerWaalsContact C-N 3.32Å; N1425-M1427 PolarHBondContact O-N 2.72Å
1426	S	40.3	Very low	25.4	Very low	130 Å²	130	126.1 Å²	126.1	91%	0.909	66%	0.661	S	S	*	*			trans	-61.4	87.3	169.4	59.6	0	0	0	0	112.1	I1428	S1426-I1428 PolarHBondContact O-N 3.09Å; S1426-I1428 VanDerWaalsContact O-N 3.08Å
1427	M	22.6	Very low	25.4	Very low	173 Å²	173	132.5 Å²	132.5	85%	0.852	70%	0.695	S	S	*	*			trans	-74.6	100	172.2	-161.2	-161.4	175.6	0	0	108.9	N1425	N1425-M1427 VanDerWaalsContact C-N 3.32Å; N1425-M1427 PolarHBondContact O-N 2.72Å
1428	I	27.4	Very low	25.8	Very low	134 Å²	134	133.9 Å²	133.9	69%	0.687	71%	0.708	S	S	*	*				177.5	103.1	122.8	-89	158	0	0	0	111.4	S1426	S1426-I1428 PolarHBondContact O-N 3.09Å; S1426-I1428 VanDerWaalsContact O-N 3.08Å
1429	V	27.4	Very low	25.7	Very low	115 Å²	115	134.2 Å²	134.2	70%	0.697	71%	0.713	S	S	*	*			trans	81.6	132.5	132	175.3	0	0	0	0	121.6
1430	N	29	Very low	25.9	Very low	133 Å²	133	133.6 Å²	133.6	71%	0.711	71%	0.713	S	S	*	*			trans	75.7	98.4	155.2	-74.8	-15.8	0	0	0	123.1
1431	K	26.3	Very low	26	Very low	166 Å²	166	136 Å²	136	72%	0.722	72%	0.717	S	S	*	*				67	143.2	101.5	-88.6	178.7	147.2	-137.1	0	123.6
1432	E	26.7	Very low	26.1	Very low	143 Å²	143	133.5 Å²	133.5	67%	0.668	71%	0.71	S	S	*	*			trans	80.8	147.2	148.7	-74	164.7	-145.5	0	0	120
1433	I	24.4	Very low	26	Very low	140 Å²	140	133.4 Å²	133.4	72%	0.718	70%	0.703	S	S	*	*				-165.2	138.2	-53.1	-113.4	164.6	0	0	0	111.3
1434	R	21.1	Very low	25.8	Very low	226 Å²	226	129.9 Å²	129.9	85%	0.853	70%	0.697	S	S	*	*			trans	48.3	123.2	162.2	-67.1	170.6	178.3	171.8	-1.5	120.7
1435	L	25.5	Very low	25.7	Very low	164 Å²	164	128.9 Å²	128.9	86%	0.859	70%	0.7	S	S	*	*				176.4	108.1	111.6	-95.2	164.8	0	0	0	115.2
1436	V	23.7	Very low	25.6	Very low	127 Å²	127	128.7 Å²	128.7	77%	0.77	70%	0.698	S	S	*	*			trans	38.4	120.3	135.5	-175.2	0	0	0	0	122.1
1437	N	24.2	Very low	24.8	Very low	137 Å²	137	128.8 Å²	128.8	73%	0.733	69%	0.688	S	S	*	*			trans	10.2	162	136.2	-80	23.7	0	0	0	123.3
1438	P	31.4	Very low	25	Very low	110 Å²	110	128.3 Å²	128.3	71%	0.714	69%	0.686	S	S	*	*			cis	-128.1	139.4	0.7	22	1.5	0	0	0	117
1439	T	24.5	Very low	24.8	Very low	84 Å²	84	125.8 Å²	125.8	52%	0.515	68%	0.68	S	S	.	*				0.1	144.6	128.1	53.9	0	0	0	0	118.5
1440	S	26.3	Very low	24.7	Very low	40 Å²	40	126.1 Å²	126.1	28%	0.28	68%	0.683	S	S	.	*			cis	-167.5	154.5	-2.9	41.6	0	0	0	0	107.6	D2258	S1440-D2258 VanDerWaalsContact CB-O 3.27Å; S1440-D2258 WeakPolarHBondContact CB-O 3.34Å; S1440-D2258 PolarHBondContact OG-N 3.36Å; S1440-D2258 VanDerWaalsContact OG-N 3.09Å; S1440-D2258 PolarHBondContact OG-O 3.08Å
1441	H	25.3	Very low	24.6	Very low	149 Å²	149	127.9 Å²	127.9	69%	0.69	69%	0.687	S	S	*	*			cis	73.9	127.2	38.4	-69.4	-31.7	0	0	0	115
1442	N	24.8	Very low	24.5	Very low	117 Å²	117	126 Å²	126	63%	0.626	69%	0.689	S	S	*	*			cis	-163.7	137.3	-15.8	-129.3	37.2	0	0	0	110.9	S1444	N1442-S1444 PolarHBondContact O-N 2.96Å
1443	S	21	Very low	24.3	Very low	83 Å²	83	126.7 Å²	126.7	58%	0.58	69%	0.692	S	S	*	*				-3.7	114.3	125.6	39.7	0	0	0	0	115.8
1444	S	21.5	Very low	24.4	Very low	94 Å²	94	126 Å²	126	66%	0.657	70%	0.697	S	S	*	*				86.8	127.8	77	73.7	0	0	0	0	115.2	N1442	N1442-S1444 PolarHBondContact O-N 2.96Å
1445	S	22.7	Very low	24.7	Very low	98 Å²	98	123.8 Å²	123.8	69%	0.685	69%	0.693	S	S	*	*			trans	54.9	134.7	141.5	77.1	0	0	0	0	119.4
1446	L	22.4	Very low	24.8	Very low	140 Å²	140	120.8 Å²	120.8	73%	0.733	68%	0.684	S	S	*	*				-178.5	166.1	70.6	-108.1	163.8	0	0	0	110.3
1447	N	22.6	Very low	24.8	Very low	131 Å²	131	121.4 Å²	121.4	70%	0.701	68%	0.682	S	S	*	*			trans	59.1	115.8	160.4	-56	-26.4	0	0	0	117.3
1448	M	27.1	Very low	24.7	Very low	163 Å²	163	120.6 Å²	120.6	80%	0.803	68%	0.682	S	S	*	*				-154.5	118.4	62	-88.5	-74.7	-73.6	0	0	113.5
1449	S	23.2	Very low	24.3	Very low	82 Å²	82	124.2 Å²	124.2	57%	0.573	69%	0.69	S	S	*	*			trans	55.1	113.6	136.4	-50.5	0	0	0	0	122
1450	T	25.7	Very low	24.3	Very low	121 Å²	121	124.9 Å²	124.9	74%	0.742	70%	0.696	S	S	*	*				56.8	132.6	127.5	60.8	0	0	0	0	120
1451	E	26.1	Very low	24.1	Very low	171 Å²	171	128.5 Å²	128.5	80%	0.799	71%	0.711	S	S	*	*			cis	-167.2	-175.7	1	-130	175.7	-179.4	0	0	109.1
1452	V	24.6	Very low	23.9	Very low	126 Å²	126	127.1 Å²	127.1	76%	0.764	71%	0.713	S	S	*	*			trans	67.6	116.2	171.7	-173.9	0	0	0	0	114.1
1453	E	22.5	Very low	23.8	Very low	158 Å²	158	126.7 Å²	126.7	74%	0.738	71%	0.709	S	S	*	*			cis	-148.9	157.9	-5.8	-117.4	174.4	-151.9	0	0	106.5
1454	P	25.4	Very low	23.8	Very low	125 Å²	125	126.9 Å²	126.9	81%	0.812	71%	0.707	S	S	*	*			cis	-135.2	123.8	46.3	34	-13.9	0	0	0	116
1455	K	28.6	Very low	23.8	Very low	180 Å²	180	130.3 Å²	130.3	78%	0.783	71%	0.707	S	S	*	*				-101.3	157	125.7	-80.8	-179.9	179.2	174	0	105.8
1456	P	27.3	Very low	23.8	Very low	101 Å²	101	130 Å²	130	66%	0.656	70%	0.698	S	S	*	*			cis	-142.4	-161.5	30.1	43.2	-23.3	0	0	0	114.8
1457	N	24.1	Very low	23.9	Very low	139 Å²	139	126 Å²	126	74%	0.743	68%	0.681	S	S	*	*			trans	-6.4	179.1	132.5	-44.9	-22.6	0	0	0	118.9
1458	T	21.3	Very low	24	Very low	120 Å²	120	125.8 Å²	125.8	74%	0.736	68%	0.679	S	S	*	*			trans	68.6	133.4	175.2	50.3	0	0	0	0	113.1
1459	Q	23.8	Very low	24.1	Very low	186 Å²	186	119.1 Å²	119.1	87%	0.869	65%	0.652	S	S	*	*			cis	45.7	86.7	19.2	-154.9	-162	66.7	0	0	112.5
1460	P	24.9	Very low	24.2	Very low	98 Å²	98	120.3 Å²	120.3	64%	0.636	65%	0.652	S	S	*	*				-147.3	-167.9	83.8	29	-5.4	0	0	0	114.1
1461	I	21.7	Very low	24.3	Very low	117 Å²	117	119.7 Å²	119.7	60%	0.6	64%	0.644	S	S	*	*			trans	77.8	115.4	159.2	-47.5	-173.3	0	0	0	114.3	I1463	I1461-I1463 HydrophobicContact CG2-CB 3.67Å; I1461-I1463 HydrophobicContact CG2-CD1 3.7Å; I1461-I1463 HydrophobicContact CG2-CG1 3.53Å
1462	T	21.7	Very low	24.3	Very low	119 Å²	119	118 Å²	118	73%	0.73	64%	0.64	S	S	*	*			cis	68.5	52.3	10	-28.4	0	0	0	0	116.5
1463	I	22.3	Very low	24.3	Very low	108 Å²	108	118.6 Å²	118.6	55%	0.554	64%	0.638	S	S	*	*			trans	-140.4	136.3	161	-86	172.3	0	0	0	107.3	I1461 Y1465	I1461-I1463 HydrophobicContact CG2-CB 3.67Å; I1461-I1463 HydrophobicContact CG2-CD1 3.7Å; I1461-I1463 HydrophobicContact CG2-CG1 3.53Å; I1463-Y1465 HydrophobicContact CD1-CD2 4.44Å; I1463-Y1465 HydrophobicContact CG1-CD2 3.95Å
1464	T	20	Very low	24.6	Very low	87 Å²	87	117.7 Å²	117.7	53%	0.534	64%	0.643	S	S	.	*			cis	40.1	68.2	-23.1	43.5	0	0	0	0	118.8	R2050	T1464-R2050 PolarHBondContact OG1-NH1 3.38Å
1465	Y	22.6	Very low	24.5	Very low	167 Å²	167	120.1 Å²	120.1	66%	0.655	64%	0.644	S	S	*	*				-107.2	135.1	109.6	-72	-77.4	0	0	0	105.7	I1463 T1489	I1463-Y1465 HydrophobicContact CD1-CD2 4.44Å; I1463-Y1465 HydrophobicContact CG1-CD2 3.95Å; Y1465-T1489 HydrophobicContact CD1-CG2 3.88Å; Y1465-T1489 HydrophobicContact CE1-CG2 3.86Å
1466	D	21.8	Very low	24.3	Very low	91 Å²	91	118 Å²	118	49%	0.487	64%	0.641	S	S	.	*				58.3	89.7	59.6	-87.1	-23.5	0	0	0	114
1467	S	24.3	Very low	24.1	Very low	56 Å²	56	121.5 Å²	121.5	39%	0.392	65%	0.645	S	S	.	*				79.8	150.4	65.3	80.3	0	0	0	0	114.9	K1487 S1488	S1467-K1487 CarbonylContact O-C 3.15Å; S1467-K1487 WeakPolarHBondContact O-CA 3.28Å; S1467-S1488 WeakPolarHBondContact O-CA 3.23Å; S1467-S1488 PolarHBondContact O-N 2.84Å
1468	I	25.7	Very low	24.1	Very low	126 Å²	126	121.5 Å²	121.5	65%	0.646	65%	0.646	S	S	*	*			trans	80.9	110.6	154.6	-64.4	161.4	0	0	0	121.4	R1486 K1487 S1488	I1468-R1486 CarbonylContact O-C 3.55Å; I1468-K1487 CarbonylContact O-C 3.56Å; I1468-K1487 WeakPolarHBondContact O-CA 3.46Å; I1468-K1487 PolarHBondContact O-N 3.04Å; I1468-S1488 PolarHBondContact O-N 3.09Å
1469	G	28	Very low	24.3	Very low	23 Å²	23	124.1 Å²	124.1	24%	0.237	65%	0.651	C	S	.	*			trans	84.6	113	143.4	0	0	0	0	0	120.5	P1485 R1486	G1469-P1485 CarbonylContact C-O 2.75Å; G1469-P1485 WeakPolarHBondContact CA-O 3.44Å; G1469-P1485 PolarHBondContact N-O 2.98Å; G1469-R1486 VanDerWaalsContact C-C 3.46Å; G1469-R1486 CarbonylContact O-C 3.47Å
1470	N	26.8	Very low	24.3	Very low	108 Å²	108	120.9 Å²	120.9	58%	0.578	64%	0.64	S	S	*	*				-178.5	111.2	84.9	-87	15.6	0	0	0	112.1	P1485 R1486	N1470-P1485 PolarHBondContact N-O 3.18Å; N1470-R1486 VanDerWaalsContact N-CB 3.32Å
1471	D	26.7	Very low	24.3	Very low	108 Å²	108	125.2 Å²	125.2	58%	0.578	65%	0.649	S	S	*	*				96.5	122.9	107.1	-65.6	-4.9	0	0	0	125.8
1472	L	25.9	Very low	24.4	Very low	135 Å²	135	128 Å²	128	71%	0.707	66%	0.66	S	S	*	*				98.2	123.9	126.9	-77.8	166.5	0	0	0	123.1
1473	N	25	Very low	24.4	Very low	138 Å²	138	128 Å²	128	74%	0.738	66%	0.659	S	S	*	*			trans	101.7	142.3	139.9	-70.1	-31	0	0	0	123.1
1474	V	28.8	Very low	25	Very low	139 Å²	139	132.2 Å²	132.2	84%	0.842	67%	0.673	S	S	*	*			trans	89.3	132.8	161.7	-162.1	0	0	0	0	118.7
1475	E	22.6	Very low	25.7	Very low	176 Å²	176	131.2 Å²	131.2	82%	0.822	67%	0.668	S	S	*	*			trans	-79.3	150.4	175.5	-49.7	156.5	102.3	0	0	112.1
1476	L	23.9	Very low	25.6	Very low	137 Å²	137	132.6 Å²	132.6	72%	0.717	67%	0.672	S	S	*	*				-176.8	170.7	126.5	-103.6	164.9	0	0	0	113.4	N1480	L1476-N1480 PolarHBondContact O-ND2 3.44Å
1477	K	24.2	Very low	25.7	Very low	173 Å²	173	136.3 Å²	136.3	75%	0.752	68%	0.684	S	S	*	*			trans	-61.4	154.3	175.4	-58.1	153.7	-176.5	172.8	0	111.6
1478	D	24.4	Very low	25.6	Very low	140 Å²	140	137.3 Å²	137.3	75%	0.749	69%	0.691	S	S	*	*	S	Bend	trans	57	116.5	169.9	-49.3	-33.2	0	0	0	115.8
1479	M	25.3	Very low	25.4	Very low	174 Å²	174	134.5 Å²	134.5	86%	0.857	68%	0.68	S	S	*	*			cis	-148.2	80	1.7	-87.2	-96.3	-77.4	0	0	106.1	K1481	M1479-K1481 PolarHBondContact O-N 2.81Å
1480	N	23.6	Very low	25.1	Very low	118 Å²	118	140.2 Å²	140.2	63%	0.631	70%	0.704	S	S	*	*			trans	-94.2	102.5	-139.9	-69.7	-31.2	0	0	0	117.1	L1476	L1476-N1480 PolarHBondContact O-ND2 3.44Å
1481	K	25.4	Very low	24.9	Very low	190 Å²	190	143.2 Å²	143.2	83%	0.826	71%	0.714	S	S	*	*				-68.3	137.3	126.7	-66.1	173.5	177.9	173.3	0	108.5	M1479	M1479-K1481 PolarHBondContact O-N 2.81Å
1482	Q	22.8	Very low	24.8	Very low	176 Å²	176	143.2 Å²	143.2	82%	0.822	72%	0.723	S	S	*	*			trans	-174.2	154.8	133.1	-111	174.9	81.5	0	0	117.2
1483	V	21.6	Very low	24.7	Very low	119 Å²	119	141.6 Å²	141.6	72%	0.721	72%	0.723	S	S	*	*			trans	75.4	105.3	152.5	175.1	0	0	0	0	121.1
1484	K	36.3	Very low	24.6	Very low	195 Å²	195	143.5 Å²	143.5	85%	0.848	73%	0.725	S	S	*	*			trans	-83.3	162.1	146.9	-89.5	-178.6	177.2	177	0	109.1
1485	P	33.8	Very low	24.2	Very low	66 Å²	66	145.6 Å²	145.6	43%	0.429	72%	0.723	S	S	.	*				-165.3	-173.9	68.4	38.2	-11.6	0	0	0	120.2	G1469 N1470	G1469-P1485 CarbonylContact C-O 2.75Å; G1469-P1485 WeakPolarHBondContact CA-O 3.44Å; G1469-P1485 PolarHBondContact N-O 2.98Å; N1470-P1485 PolarHBondContact N-O 3.18Å
1486	R	21.5	Very low	24.2	Very low	196 Å²	196	143.2 Å²	143.2	74%	0.74	72%	0.721	S	S	*	*				119.6	27.7	116.9	-116.9	-166.3	-174.9	164	3.6	134	I1468 G1469 N1470	I1468-R1486 CarbonylContact O-C 3.55Å; G1469-R1486 VanDerWaalsContact C-C 3.46Å; G1469-R1486 CarbonylContact O-C 3.47Å; N1470-R1486 VanDerWaalsContact N-CB 3.32Å
1487	K	23	Very low	24.1	Very low	170 Å²	170	143.1 Å²	143.1	74%	0.739	72%	0.721	S	S	*	*			trans	74.7	107.9	163.3	-51.5	177.8	168.3	-169.4	0	122.3	S1467 I1468	S1467-K1487 CarbonylContact O-C 3.15Å; S1467-K1487 WeakPolarHBondContact O-CA 3.28Å; I1468-K1487 CarbonylContact O-C 3.56Å; I1468-K1487 WeakPolarHBondContact O-CA 3.46Å; I1468-K1487 PolarHBondContact O-N 3.04Å
1488	S	21.4	Very low	24.1	Very low	76 Å²	76	141.3 Å²	141.3	53%	0.531	72%	0.72	S	S	.	*				169.3	124	112.7	61.4	0	0	0	0	117.2	S1467 I1468	S1467-S1488 WeakPolarHBondContact O-CA 3.23Å; S1467-S1488 PolarHBondContact O-N 2.84Å; I1468-S1488 PolarHBondContact O-N 3.09Å
1489	T	22	Very low	24	Very low	68 Å²	68	143.2 Å²	143.2	42%	0.417	72%	0.724	S	S	.	*			trans	54.8	140.8	135.2	56.6	0	0	0	0	126.3	Y1465	Y1465-T1489 HydrophobicContact CD1-CG2 3.88Å; Y1465-T1489 HydrophobicContact CE1-CG2 3.86Å
1490	L	21.1	Very low	24	Very low	142 Å²	142	139.6 Å²	139.6	74%	0.743	72%	0.716	S	S	*	*			trans	87.7	94.7	139.6	-78.4	166.2	0	0	0	122.6
1491	H	24.1	Very low	24	Very low	171 Å²	171	140.9 Å²	140.9	79%	0.792	72%	0.718	S	S	*	*				64	138.6	119.9	-129.5	-86.7	0	0	0	124.8
1492	S	23.4	Very low	24	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	71%	0.714	S	S	*	*			trans	74.2	157.7	153.1	38.8	0	0	0	0	121.4
1493	S	25.1	Very low	24.6	Very low	100 Å²	100	140.2 Å²	140.2	70%	0.699	72%	0.715	S	S	*	*			trans	-131.1	157.9	-179.1	54.3	0	0	0	0	111.9
1494	F	21.8	Very low	24.7	Very low	179 Å²	179	141.6 Å²	141.6	79%	0.785	72%	0.717	S	S	*	*			trans	75	130.4	171.7	-73	-76.5	0	0	0	120.5
1495	F	21.8	Very low	24.2	Very low	183 Å²	183	136.8 Å²	136.8	80%	0.803	70%	0.704	S	S	*	*			trans	64.1	131.5	173.7	-61.4	-72.4	0	0	0	116.4
1496	T	21.7	Very low	23.8	Very low	126 Å²	126	140.7 Å²	140.7	77%	0.773	72%	0.72	S	S	*	*			cis	-141.1	168.5	14.3	-4.2	0	0	0	0	112
1497	D	21.8	Very low	24	Very low	134 Å²	134	136.7 Å²	136.7	72%	0.717	71%	0.709	S	S	*	*			trans	-68.4	167.8	179.6	-46.5	-93.6	0	0	0	114.9
1498	N	23.4	Very low	24.4	Very low	136 Å²	136	134.5 Å²	134.5	73%	0.727	71%	0.71	S	S	*	*			trans	61.1	102	166.3	-71.4	8.8	0	0	0	116.5
1499	E	23.9	Very low	25	Very low	179 Å²	179	138.8 Å²	138.8	84%	0.836	73%	0.727	S	S	*	*				100.7	171.8	82.5	-91.2	-172.1	161.7	0	0	111.5
1500	S	24.3	Very low	25.6	Very low	99 Å²	99	146.6 Å²	146.6	69%	0.692	75%	0.749	S	S	*	*			trans	-66.5	137	-162.4	43	0	0	0	0	117.2
1501	E	24.5	Very low	26.2	Very low	145 Å²	145	144 Å²	144	68%	0.678	74%	0.742	S	S	*	*			trans	71.2	145.3	145.5	-65.7	179.5	175.7	0	0	122
1502	K	24.8	Very low	26.4	Very low	169 Å²	169	140.6 Å²	140.6	74%	0.735	73%	0.734	S	S	*	*			trans	85.3	142.1	160.6	-61.9	126.3	178.2	151	0	117.8
1503	Q	35.8	Very low	26.3	Very low	183 Å²	183	137.7 Å²	137.7	86%	0.855	71%	0.713	S	S	*	*			trans	70.1	111	171.7	-59	178.8	4.7	0	0	114.7
1504	I	23.7	Very low	26.4	Very low	148 Å²	148	137.8 Å²	137.8	76%	0.759	71%	0.713	S	S	*	*			cis	-147.7	139.4	8.3	-59	-175.6	0	0	0	112.5
1505	V	24.7	Very low	26.4	Very low	94 Å²	94	138.6 Å²	138.6	57%	0.57	72%	0.717	S	S	*	*			trans	3.8	126.9	158.3	-175.6	0	0	0	0	118.8	P1513	V1505-P1513 HydrophobicContact CG1-CG 3.83Å
1506	I	25.4	Very low	26.7	Very low	148 Å²	148	136.7 Å²	136.7	76%	0.759	72%	0.715	S	S	*	*			cis	86.7	94	16.3	-45.2	163.6	0	0	0	117.6
1507	Q	26.1	Very low	26.8	Very low	112 Å²	112	136.3 Å²	136.3	52%	0.523	71%	0.713	S	S	.	*			trans	-173.7	166.9	144.5	-119.3	-169.9	-9.1	0	0	115.7	T1512 P1513	Q1507-T1512 PolarHBondContact OE1-O 3.2Å; Q1507-P1513 HydrophobicContact CB-CG 4.48Å; Q1507-P1513 HydrophobicContact CG-CB 4.33Å; Q1507-P1513 HydrophobicContact CG-CG 4.08Å
1508	T	31.8	Very low	27.2	Very low	123 Å²	123	135.4 Å²	135.4	76%	0.755	71%	0.714	S	S	*	*	S	Bend	trans	-84.3	148.1	178.9	42.7	0	0	0	0	114.1
1509	N	33.5	Very low	27.2	Very low	166 Å²	166	137 Å²	137	89%	0.888	72%	0.717	S	S	*	*	S	Bend	trans	53.2	65.8	171.5	-148.5	28.3	0	0	0	115.9
1510	R	35.1	Very low	27.3	Very low	232 Å²	232	132.6 Å²	132.6	88%	0.875	71%	0.707	S	S	*	*	S	Bend	trans	57.9	99.2	-176.4	-82.6	-169.4	173.7	-174.2	-1	114.9
1511	S	33.9	Very low	27.8	Very low	87 Å²	87	135.5 Å²	135.5	61%	0.608	71%	0.709	S	S	*	*	S	Bend	trans	68.1	145.4	154.1	38.8	0	0	0	0	119.3
1512	T	28	Very low	27.8	Very low	101 Å²	101	136.2 Å²	136.2	62%	0.62	71%	0.712	S	S	*	*			trans	56.6	105.5	149.8	51.1	0	0	0	0	120.4	Q1507 S1514	Q1507-T1512 PolarHBondContact OE1-O 3.2Å; T1512-S1514 PolarHBondContact O-N 3.24Å
1513	P	22.3	Very low	27.8	Very low	48 Å²	48	133.2 Å²	133.2	31%	0.312	70%	0.704	S	S	.	*			trans	-85.4	91.2	146.4	31	-19.9	0	0	0	109.6	V1505 Q1507	V1505-P1513 HydrophobicContact CG1-CG 3.83Å; Q1507-P1513 HydrophobicContact CB-CG 4.48Å; Q1507-P1513 HydrophobicContact CG-CB 4.33Å; Q1507-P1513 HydrophobicContact CG-CG 4.08Å
1514	S	25.7	Very low	27.4	Very low	102 Å²	102	128.9 Å²	128.9	71%	0.713	69%	0.694	S	S	*	*			trans	-74.5	115.3	130.7	49.7	0	0	0	0	105.6	T1512 D1516	T1512-S1514 PolarHBondContact O-N 3.24Å; S1514-D1516 PolarHBondContact O-N 3.49Å
1515	F	23.2	Very low	27.9	Very low	195 Å²	195	129.1 Å²	129.1	86%	0.855	69%	0.692	S	S	*	*	S	Bend	trans	-78.4	72.1	-176.5	-138.1	-67.5	0	0	0	110.1
1516	D	26.9	Very low	28	Very low	143 Å²	143	132.5 Å²	132.5	77%	0.765	70%	0.701	S	S	*	*			trans	-162.8	131	156.8	-103.7	-29.1	0	0	0	111.3	S1514	S1514-D1516 PolarHBondContact O-N 3.49Å
1517	T	23.8	Very low	28	Very low	118 Å²	118	133.8 Å²	133.8	72%	0.724	70%	0.702	S	S	*	*			trans	-63.5	142.9	153.9	43.2	0	0	0	0	109
1518	P	29.9	Very low	27.9	Very low	116 Å²	116	132.4 Å²	132.4	75%	0.753	70%	0.701	S	S	*	*				-122.1	140.2	73.1	-0.3	22.2	0	0	0	115.5
1519	E	25	Very low	27.9	Very low	168 Å²	168	132.9 Å²	132.9	79%	0.785	69%	0.694	S	S	*	*				17.2	139.6	122.2	-53	-172.3	125.1	0	0	120.3
1520	S	26.2	Very low	27.5	Very low	88 Å²	88	129.1 Å²	129.1	62%	0.615	68%	0.678	S	S	*	*			trans	73.8	140	158.7	83.2	0	0	0	0	116.3
1521	H	33.2	Very low	26.9	Very low	160 Å²	160	122.3 Å²	122.3	74%	0.741	66%	0.659	S	S	*	*			cis	-119.2	133.2	3.7	-76.2	-80.8	0	0	0	108.2
1522	Q	24.2	Very low	26.5	Very low	159 Å²	159	121.2 Å²	121.2	74%	0.743	65%	0.646	S	S	*	*			cis	60.8	112.9	36.7	-155.8	-165.8	70	0	0	112.4
1523	N	25.5	Very low	26.7	Very low	107 Å²	107	120.8 Å²	120.8	57%	0.572	64%	0.639	S	S	*	*			trans	69.9	145.3	-150.8	-46.1	-73.8	0	0	0	110.7
1524	S	27.8	Very low	27.1	Very low	92 Å²	92	122.3 Å²	122.3	64%	0.643	65%	0.651	S	S	*	*			cis	-148.5	170.2	2.4	36.5	0	0	0	0	111.5
1525	Q	34.7	Very low	27.1	Very low	153 Å²	153	124.6 Å²	124.6	72%	0.715	65%	0.65	S	S	*	*			trans	33.8	116.9	140.4	-70.6	149.1	-32.9	0	0	117.3
1526	Q	26.1	Very low	27.3	Very low	164 Å²	164	123.4 Å²	123.4	77%	0.766	65%	0.647	S	S	*	*				51.2	123	75.4	-171.4	-156.3	66.7	0	0	111.3
1527	K	25.7	Very low	27.2	Very low	176 Å²	176	122.5 Å²	122.5	77%	0.765	65%	0.647	S	S	*	*			trans	67.2	124.8	166	-103.6	-169.5	176.3	-177	0	115.2
1528	V	24.1	Very low	27.4	Very low	82 Å²	82	122 Å²	122	50%	0.497	65%	0.647	S	S	.	*				79.2	110.9	126.4	156.4	0	0	0	0	116.2
1529	Q	30.9	Very low	27.2	Very low	133 Å²	133	119.3 Å²	119.3	62%	0.621	63%	0.629	S	S	*	*				41.5	97.5	102.8	-99.2	-178	-37.8	0	0	113.5	N1531	Q1529-N1531 HydrophobicContact CB-CB 3.44Å; Q1529-N1531 VanDerWaalsContact CB-CB 3.44Å; Q1529-N1531 HydrophobicContact CG-CB 3.83Å; Q1529-N1531 WeakPolarHBondContact O-CB 3.31Å
1530	T	24.9	Very low	27.2	Very low	88 Å²	88	113.1 Å²	113.1	54%	0.54	61%	0.61	S	S	.	*			trans	-124.7	64.3	151.6	54.9	0	0	0	0	106.9	E1356 L1532	E1356-T1530 HydrophobicContact CB-CG2 3.98Å; E1356-T1530 HydrophobicContact CG-CG2 3.64Å; T1530-L1532 HydrophobicContact CG2-CD1 3.92Å
1531	N	23.7	Very low	27.1	Very low	89 Å²	89	115.2 Å²	115.2	48%	0.476	61%	0.611	S	S	.	*			cis	53.7	-136.1	47.2	-170.3	37.8	0	0	0	109.2	Q1529 L1533	Q1529-N1531 HydrophobicContact CB-CB 3.44Å; Q1529-N1531 VanDerWaalsContact CB-CB 3.44Å; Q1529-N1531 HydrophobicContact CG-CB 3.83Å; Q1529-N1531 WeakPolarHBondContact O-CB 3.31Å; N1531-L1533 PolarHBondContact O-N 2.78Å
1532	L	25.7	Very low	26.8	Very low	64 Å²	64	111.2 Å²	111.2	34%	0.335	59%	0.591	S	S	.	*			trans	40.4	76.9	154.3	-77.8	156.7	0	0	0	116.1	E1356 T1530	E1356-L1532 HydrophobicContact CB-CB 4.3Å; E1356-L1532 HydrophobicContact CB-CD1 4.24Å; E1356-L1532 HydrophobicContact CG-CD1 4.49Å; T1530-L1532 HydrophobicContact CG2-CD1 3.92Å
1533	L	30.8	Very low	26.8	Very low	91 Å²	91	110.4 Å²	110.4	48%	0.476	59%	0.587	S	S	.	*			cis	-154.4	144.8	-5	-151.4	61.7	0	0	0	111.9	N1531	N1531-L1533 PolarHBondContact O-N 2.78Å
1534	S	30.2	Very low	26.9	Very low	81 Å²	81	110.2 Å²	110.2	57%	0.566	60%	0.595	S	S	*	*			trans	53.2	-147.7	150	59.5	0	0	0	0	111.6
1535	Q	27.3	Very low	26.9	Very low	149 Å²	149	111.5 Å²	111.5	70%	0.696	59%	0.594	S	S	*	*			cis	-132.1	154.5	-14	-147.2	139.8	53.5	0	0	108.7
1536	E	27.1	Very low	26.6	Very low	170 Å²	170	108.8 Å²	108.8	79%	0.794	59%	0.592	S	S	*	*			trans	67	107.1	-176	-52.3	-174.7	148.7	0	0	112.3
1537	V	23.5	Very low	26.7	Very low	124 Å²	124	107.1 Å²	107.1	75%	0.752	59%	0.588	S	S	*	*				65.8	128.1	70.5	-177.9	0	0	0	0	111.2
1538	C	28.2	Very low	26.8	Very low	108 Å²	108	105.6 Å²	105.6	73%	0.73	59%	0.587	S	S	*	*			trans	-9.5	154.6	146.5	-86	0	0	0	0	117.6
1539	P	26.4	Very low	26.9	Very low	59 Å²	59	106.9 Å²	106.9	38%	0.383	59%	0.592	S	S	.	*			cis	-141.2	-149.4	41.9	27.7	-1.2	0	0	0	115.3	L1345 S1347	L1345-P1539 HydrophobicContact CB-CG 3.77Å; L1345-P1539 WeakPolarHBondContact O-CB 3.5Å; S1347-P1539 VanDerWaalsContact CA-O 3.29Å; S1347-P1539 WeakPolarHBondContact CA-O 3.41Å; S1347-P1539 PolarHBondContact N-O 2.83Å
1540	G	23.9	Very low	26.6	Very low	38 Å²	38	106.9 Å²	106.9	39%	0.392	60%	0.596	S	S	.	*	B	Isolated β-bridge	trans	-73.3	-160.1	-158.3	0	0	0	0	0	118.1	L1345 K1346 S1347	L1345-G1540 WeakPolarHBondContact O-CA 3.34Å; L1345-G1540 PolarHBondContact O-N 3.15Å; K1346-G1540 CarbonylContact C-O 3.52Å; K1346-G1540 WeakPolarHBondContact CA-O 3.45Å; K1346-G1540 PolarHBondContact N-O 3.48Å; S1347-G1540 PolarHBondContact N-O 2.95Å
1541	Q	25.6	Very low	26.9	Very low	133 Å²	133	111.2 Å²	111.2	62%	0.621	61%	0.607	S	S	*	*				65.9	119.7	92.5	-70.5	-164.8	4.3	0	0	116.3	K1346	K1346-Q1541 WeakPolarHBondContact CA-O 3.49Å; K1346-Q1541 WeakPolarHBondContact CB-O 3.18Å; K1346-Q1541 PolarHBondContact N-O 3.15Å; K1346-Q1541 VanDerWaalsContact N-O 3.14Å
1542	F	25.5	Very low	26.9	Very low	76 Å²	76	113.3 Å²	113.3	33%	0.333	62%	0.623	S	S	.	*				-171.1	129.4	99.1	-114.7	-42.7	0	0	0	113	T1344 K1346	T1344-F1542 HydrophobicContact CG2-CE1 4.33Å; T1344-F1542 HydrophobicContact CG2-CE2 4.32Å; T1344-F1542 HydrophobicContact CG2-CZ 3.95Å; T1344-F1542 WeakPolarHBondContact OG1-CE2 3.4Å; T1344-F1542 WeakPolarHBondContact OG1-CZ 3.45Å; K1346-F1542 HydrophobicContact CD-CB 4.05Å; K1346-F1542 VanDerWaalsContact NZ-CB 3.28Å; K1346-F1542 PolarHBondContact NZ-O 2.83Å
1543	Q	25.4	Very low	27	Very low	141 Å²	141	114 Å²	114	66%	0.659	65%	0.645	S	S	*	*			trans	65.6	160.9	145.1	-87.2	157.6	2.6	0	0	118
1544	S	26.9	Very low	26.9	Very low	104 Å²	104	112.8 Å²	112.8	73%	0.727	66%	0.655	S	S	*	*			cis	-155	164	11.3	9.8	0	0	0	0	109
1545	N	28.2	Very low	26.8	Very low	118 Å²	118	115.9 Å²	115.9	63%	0.631	66%	0.664	S	S	*	*			cis	-167.6	166.8	-1.4	-107.7	-2.5	0	0	0	106.7
1546	S	28.6	Very low	26.7	Very low	96 Å²	96	115.8 Å²	115.8	67%	0.671	67%	0.667	S	S	*	*			cis	-179.9	169	-7.3	46.9	0	0	0	0	108
1547	L	28	Very low	26.7	Very low	129 Å²	129	115.1 Å²	115.1	68%	0.675	66%	0.664	S	S	*	*			cis	-173.2	-170.8	-25.5	-91.1	169.2	0	0	0	103.3
1548	L	28.1	Very low	26.9	Very low	145 Å²	145	114.4 Å²	114.4	76%	0.759	66%	0.656	S	S	*	*			cis	-147	162.4	7.8	-91.9	97	0	0	0	106.3
1549	N	25.6	Very low	26.8	Very low	109 Å²	109	115.1 Å²	115.1	58%	0.583	65%	0.653	S	S	*	*			cis	-163.4	162.6	-20.9	-113	13.4	0	0	0	109.7
1550	N	25.8	Very low	26.7	Very low	133 Å²	133	118.4 Å²	118.4	71%	0.711	67%	0.666	S	S	*	*			trans	82.5	144.9	-178.2	-57.5	-89.3	0	0	0	114.4
1551	K	29.5	Very low	26.7	Very low	179 Å²	179	122.7 Å²	122.7	78%	0.778	68%	0.68	S	S	*	*			cis	-151.8	-168.3	-9.3	-126.5	172.8	-174.4	177.1	0	113.5
1552	T	25.3	Very low	27	Very low	133 Å²	133	125.5 Å²	125.5	82%	0.816	69%	0.69	S	S	*	*			trans	-91.8	157.8	-172.5	49	0	0	0	0	113.8
1553	G	27.3	Very low	27.1	Very low	77 Å²	77	126.9 Å²	126.9	79%	0.794	71%	0.706	S	S	*	*			cis	156.8	156.5	-5.9	0	0	0	0	0	113.7
1554	G	28.8	Very low	27	Very low	67 Å²	67	125.2 Å²	125.2	69%	0.691	71%	0.706	S	S	*	*			trans	81.9	125	174.9	0	0	0	0	0	115.5
1555	I	28.1	Very low	27	Very low	145 Å²	145	126.1 Å²	126.1	74%	0.744	71%	0.707	S	S	*	*			cis	61.3	136.1	8.1	2.8	176.4	0	0	0	115.6
1556	L	24.9	Very low	27.1	Very low	147 Å²	147	125.5 Å²	125.5	77%	0.77	71%	0.709	S	S	*	*			cis	-128.9	160.4	8.6	-66.5	142.8	0	0	0	110.5
1557	Q	28	Very low	26.9	Very low	156 Å²	156	123.5 Å²	123.5	73%	0.729	69%	0.691	S	S	*	*			cis	83.8	150.6	23.2	-142.3	-166.2	-18.3	0	0	116
1558	N	26.5	Very low	27	Very low	110 Å²	110	121.8 Å²	121.8	59%	0.588	68%	0.681	S	S	*	*			trans	78.9	138.5	168.9	-64.8	48.2	0	0	0	116
1559	D	26.1	Very low	27	Very low	123 Å²	123	117.8 Å²	117.8	66%	0.658	66%	0.664	S	S	*	*			cis	-167.2	176.8	0.2	-131	-30.3	0	0	0	116.6
1560	I	24.3	Very low	27.4	Very low	127 Å²	127	114.7 Å²	114.7	65%	0.651	65%	0.65	S	S	*	*			trans	80.4	119.2	140.2	-82.1	163.4	0	0	0	122.2
1561	N	24.8	Very low	27.8	Very low	128 Å²	128	112.1 Å²	112.1	68%	0.684	64%	0.636	S	S	*	*			trans	57.6	121.9	147.9	-63.2	-18.1	0	0	0	121
1562	K	30.4	Very low	28.1	Very low	192 Å²	192	107.7 Å²	107.7	84%	0.835	62%	0.624	S	S	*	*				75.2	145.3	61.4	-75.5	-172.5	179	-177.9	0	113.4
1563	P	28.1	Very low	28.5	Very low	105 Å²	105	107.4 Å²	107.4	68%	0.682	61%	0.614	S	S	*	*			cis	-128.8	172.7	27.4	41.2	-26.5	0	0	0	117.4
1564	V	24.4	Very low	28.8	Very low	107 Å²	107	105.5 Å²	105.5	65%	0.648	59%	0.585	S	S	*	*			trans	-141.9	120.3	164.7	171.9	0	0	0	0	108.1
1565	T	25.7	Very low	29.1	Very low	123 Å²	123	104.9 Å²	104.9	76%	0.755	57%	0.573	S	S	*	*			trans	-165.8	148.9	170.9	41	0	0	0	0	109.2
1566	P	30.2	Very low	29.6	Very low	104 Å²	104	102.5 Å²	102.5	68%	0.675	56%	0.561	S	S	*	*			cis	-141.2	113.8	-19.1	34	-13	0	0	0	113.2
1567	D	24.6	Very low	30	Very low	55 Å²	55	102.9 Å²	102.9	29%	0.294	56%	0.556	S	S	.	*	S	Bend	trans	-124.2	136.7	165	-161.3	63.8	0	0	0	112.2	P1569 R1911 D1915	D1567-P1569 WeakPolarHBondContact O-CD 3.29Å; D1567-R1911 VanDerWaalsContact CB-NH2 3.32Å; D1567-R1911 VanDerWaalsContact N-NH2 3.19Å; D1567-R1911 PolarHBondContact O-NH2 3Å; D1567-D1915 WeakPolarHBondContact CB-OD1 3.45Å
1568	M	30.6	Very low	30.2	Very low	93 Å²	93	100.5 Å²	100.5	46%	0.458	55%	0.548	S	S	.	.			trans	5	84.5	-172	-79.4	-67.9	-68.7	0	0	118.8
1569	P	28.7	Very low	30.6	Very low	61 Å²	61	101.1 Å²	101.1	40%	0.396	55%	0.548	S	S	.	.			trans	-89.3	-17	176.8	-10.8	29.5	0	0	0	116.2	D1567 I1571 Q1573	D1567-P1569 WeakPolarHBondContact O-CD 3.29Å; P1569-I1571 PolarHBondContact O-N 3.28Å; P1569-Q1573 HydrophobicContact CB-CG 4.34Å; P1569-Q1573 WeakPolarHBondContact O-CB 3.01Å; P1569-Q1573 WeakPolarHBondContact O-CG 3.29Å; P1569-Q1573 PolarHBondContact O-N 3.32Å
1570	S	34.2	Very low	31	Very low	43 Å²	43	100.9 Å²	100.9	30%	0.301	55%	0.546	S	S	.	.	H	α-helix	trans	-63.5	-48.6	-160.1	55.8	0	0	0	0	114.8	T1572 Q1573 L1574	S1570-T1572 PolarHBondContact O-N 3.29Å; S1570-Q1573 PolarHBondContact O-N 2.89Å; S1570-L1574 PolarHBondContact O-N 2.78Å; S1570-L1574 VanDerWaalsContact O-N 3.12Å
1571	I	33.3	Very low	31.1	Very low	79 Å²	79	101.5 Å²	101.5	41%	0.405	55%	0.551	S	S	.	*	H	α-helix	trans	-64.6	-43	-175.7	-47.7	-167.7	0	0	0	111	P1569 A1575 L1777	P1569-I1571 PolarHBondContact O-N 3.28Å; I1571-A1575 PolarHBondContact O-N 3.36Å; I1571-L1777 HydrophobicContact CB-CD1 4.26Å; I1571-L1777 HydrophobicContact CD1-CD1 4.47Å; I1571-L1777 HydrophobicContact CG1-CD1 3.84Å; I1571-L1777 HydrophobicContact CG1-CD2 3.92Å; I1571-L1777 HydrophobicContact CG1-CG 4.46Å; I1571-L1777 HydrophobicContact CG2-CD1 4.19Å
1572	T	35.4	Very low	31.3	Very low	87 Å²	87	102.4 Å²	102.4	53%	0.534	56%	0.556	S	S	.	*	H	α-helix	trans	-72.3	-36	-178.8	-36	0	0	0	0	112.2	S1570 A1575 I1576	S1570-T1572 PolarHBondContact O-N 3.29Å; T1572-A1575 PolarHBondContact O-N 3.29Å; T1572-I1576 HydrophobicContact CG2-CD1 4.1Å; T1572-I1576 WeakPolarHBondContact O-CG1 3.43Å; T1572-I1576 PolarHBondContact O-N 2.86Å; T1572-I1576 VanDerWaalsContact O-N 3.09Å
1573	Q	34.5	Very low	31.3	Very low	127 Å²	127	101 Å²	101	59%	0.593	55%	0.552	S	S	*	*	H	α-helix	trans	-74.4	-25.9	178.8	-71.7	-175.6	3.8	0	0	113.5	P1569 S1570 K1577	P1569-Q1573 HydrophobicContact CB-CG 4.34Å; P1569-Q1573 WeakPolarHBondContact O-CB 3.01Å; P1569-Q1573 WeakPolarHBondContact O-CG 3.29Å; P1569-Q1573 PolarHBondContact O-N 3.32Å; S1570-Q1573 PolarHBondContact O-N 2.89Å; Q1573-K1577 PolarHBondContact O-N 3.35Å
1574	L	32.7	Very low	31.4	Very low	36 Å²	36	100.8 Å²	100.8	19%	0.188	55%	0.545	C	S	.	.	H	α-helix	trans	-70.6	-44.2	169.5	-76.6	167.1	0	0	0	111.7	S1570 I1576 K1577 L1578 L1777 E1781 M1784	S1570-L1574 PolarHBondContact O-N 2.78Å; S1570-L1574 VanDerWaalsContact O-N 3.12Å; L1574-I1576 PolarHBondContact O-N 3.23Å; L1574-K1577 PolarHBondContact O-N 3.16Å; L1574-L1578 PolarHBondContact O-N 2.8Å; L1574-L1578 VanDerWaalsContact O-N 3.11Å; L1574-L1777 HydrophobicContact CD1-CD1 3.89Å; L1574-L1777 HydrophobicContact CD1-CG 4.37Å; L1574-E1781 HydrophobicContact CD1-CG 3.88Å; L1574-M1784 HydrophobicContact CD2-CE 3.58Å; L1574-M1784 HydrophobicContact CD2-SD 4.02Å
1575	A	35.9	Very low	31.8	Very low	54 Å²	54	102.5 Å²	102.5	45%	0.446	55%	0.55	S	S	.	*	H	α-helix	trans	-58.1	-46.8	175.5	0	0	0	0	0	112.3	I1571 T1572 K1577 L1578 E1579	I1571-A1575 PolarHBondContact O-N 3.36Å; T1572-A1575 PolarHBondContact O-N 3.29Å; A1575-K1577 VanDerWaalsContact C-N 3.31Å; A1575-K1577 PolarHBondContact O-N 3.02Å; A1575-L1578 PolarHBondContact O-N 3.05Å; A1575-E1579 PolarHBondContact O-N 3.16Å
1576	I	37.5	Very low	32	Very low	95 Å²	95	105.3 Å²	105.3	49%	0.487	56%	0.555	S	S	.	*	H	α-helix	trans	-69.6	-26.2	-179.2	-67.3	168.7	0	0	0	112.3	T1572 L1574 N1580	T1572-I1576 HydrophobicContact CG2-CD1 4.1Å; T1572-I1576 WeakPolarHBondContact O-CG1 3.43Å; T1572-I1576 PolarHBondContact O-N 2.86Å; T1572-I1576 VanDerWaalsContact O-N 3.09Å; L1574-I1576 PolarHBondContact O-N 3.23Å; I1576-N1580 PolarHBondContact O-ND2 2.88Å
1577	K	34.8	Very low	32.3	Very low	155 Å²	155	104.9 Å²	104.9	67%	0.674	55%	0.554	S	S	*	*	H	α-helix	trans	-71.7	-45.4	171.6	-88.1	-175.6	170.9	-178.1	0	112.4	Q1573 L1574 A1575 E1579 N1580	Q1573-K1577 PolarHBondContact O-N 3.35Å; L1574-K1577 PolarHBondContact O-N 3.16Å; A1575-K1577 VanDerWaalsContact C-N 3.31Å; A1575-K1577 PolarHBondContact O-N 3.02Å; K1577-E1579 PolarHBondContact O-N 3.22Å; K1577-N1580 PolarHBondContact O-N 3.37Å
1578	L	32.4	Very low	33	Very low	106 Å²	106	107.4 Å²	107.4	56%	0.555	57%	0.568	S	S	*	*	H	α-helix	trans	-65	-25.9	-179.9	-73.9	165.6	0	0	0	113.1	L1574 A1575 N1580	L1574-L1578 PolarHBondContact O-N 2.8Å; L1574-L1578 VanDerWaalsContact O-N 3.11Å; A1575-L1578 PolarHBondContact O-N 3.05Å; L1578-N1580 VanDerWaalsContact C-N 3.29Å; L1578-N1580 PolarHBondContact O-N 2.76Å
1579	E	34.5	Very low	33.6	Very low	124 Å²	124	105.3 Å²	105.3	58%	0.579	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-6.7	179.2	-161.1	163.9	-143.1	0	0	114.3	S155 A1575 K1577	S155-E1579 VanDerWaalsContact CB-OE1 3.24Å; S155-E1579 WeakPolarHBondContact CB-OE1 3.34Å; A1575-E1579 PolarHBondContact O-N 3.16Å; K1577-E1579 PolarHBondContact O-N 3.22Å
1580	N	33.3	Very low	34.4	Very low	117 Å²	117	108.6 Å²	108.6	63%	0.626	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-25.5	-178.6	-79.8	-85.3	0	0	0	114.7	I1576 K1577 L1578 N1582	I1576-N1580 PolarHBondContact O-ND2 2.88Å; K1577-N1580 PolarHBondContact O-N 3.37Å; L1578-N1580 VanDerWaalsContact C-N 3.29Å; L1578-N1580 PolarHBondContact O-N 2.76Å; N1580-N1582 PolarHBondContact O-N 2.9Å
1581	D	26.1	Very low	35.1	Very low	140 Å²	140	110.1 Å²	110.1	75%	0.749	58%	0.576	S	S	*	*	S	Bend	trans	-91.3	96.6	179.2	-79.4	-36.3	0	0	0	111.5	Q1583	D1581-Q1583 VanDerWaalsContact C-N 3.29Å; D1581-Q1583 PolarHBondContact O-N 3.42Å
1582	N	29.6	Very low	36.2	Very low	148 Å²	148	109 Å²	109	79%	0.791	57%	0.57	S	S	*	*			trans	-71.6	71.2	-179.2	-87.2	-80.2	0	0	0	113.6	N1580	N1580-N1582 PolarHBondContact O-N 2.9Å
1583	Q	31.6	Very low	36.9	Very low	162 Å²	162	108.2 Å²	108.2	76%	0.757	56%	0.56	S	S	*	*			trans	-175.4	109.3	158	-106.9	146.2	99	0	0	110.6	D1581	D1581-Q1583 VanDerWaalsContact C-N 3.29Å; D1581-Q1583 PolarHBondContact O-N 3.42Å
1584	L	29	Very low	37.8	Very low	101 Å²	101	103.6 Å²	103.6	53%	0.529	54%	0.539	S	S	.	.			trans	179.6	117.2	147.3	-98.2	143.5	0	0	0	111.1	V1787	L1584-V1787 HydrophobicContact CD1-CG1 3.19Å; L1584-V1787 HydrophobicContact CD2-CG1 3.72Å; L1584-V1787 HydrophobicContact CG-CG1 4.09Å
1585	N	32.7	Very low	38.7	Very low	142 Å²	142	106.2 Å²	106.2	76%	0.759	55%	0.549	S	S	*	.			trans	-101.3	120.9	168.9	-69.2	-51	0	0	0	108.8
1586	H	30.1	Very low	39.8	Very low	183 Å²	183	104 Å²	104	85%	0.847	53%	0.529	S	S	*	.	S	Bend	trans	167.2	-11.6	139.1	-95.9	-61.3	0	0	0	115.7
1587	S	36.1	Very low	40.7	Very low	95 Å²	95	104 Å²	104	66%	0.664	53%	0.527	S	S	*	.			trans	-101	7	-164.4	44.1	0	0	0	0	117.5	S1589	S1587-S1589 PolarHBondContact O-N 3.12Å
1588	D	40.6	Very low	41.8	Very low	108 Å²	108	102.5 Å²	102.5	58%	0.578	52%	0.518	S	S	*	.	H	α-helix	trans	-64.2	-9.6	-170.2	-60.7	-59.7	0	0	0	116.7	I1592	D1588-I1592 HydrophobicContact CB-CD1 4.36Å; D1588-I1592 VanDerWaalsContact O-CD1 3.31Å; D1588-I1592 WeakPolarHBondContact O-CD1 3.18Å; D1588-I1592 VanDerWaalsContact O-CG1 3.25Å; D1588-I1592 WeakPolarHBondContact O-CG1 3.35Å
1589	S	43	Very low	43.2	Very low	48 Å²	48	97.5 Å²	97.5	34%	0.336	49%	0.492	S	S	.	.	H	α-helix	trans	-69.4	-36.4	-174.6	-171.1	0	0	0	0	113.9	N121 S1587	N121-S1589 PolarHBondContact OD1-O 3.17Å; N121-S1589 PolarHBondContact OD1-OG 3.16Å; S1587-S1589 PolarHBondContact O-N 3.12Å
1590	E	45	Very low	44.6	Very low	131 Å²	131	96.8 Å²	96.8	61%	0.612	49%	0.487	S	S	*	.	H	α-helix	trans	-93.6	-39.5	-171.8	-58.9	-151.8	131.5	0	0	113.2	I1592 K1593 I1594	E1590-I1592 PolarHBondContact O-N 3.12Å; E1590-K1593 WeakPolarHBondContact O-CB 3.42Å; E1590-K1593 PolarHBondContact O-N 3.04Å; E1590-K1593 VanDerWaalsContact O-N 3.07Å; E1590-I1594 WeakPolarHBondContact O-CG1 3.37Å; E1590-I1594 PolarHBondContact O-N 3.07Å
1591	L	48.3	Very low	46	Very low	74 Å²	74	91.8 Å²	91.8	39%	0.387	46%	0.462	S	S	.	.	H	α-helix	trans	-59.9	-35	179.4	-164	71.9	0	0	0	112	I1594 K1595 L1780	L1591-I1594 PolarHBondContact O-N 3.02Å; L1591-K1595 PolarHBondContact O-N 2.59Å; L1591-L1780 HydrophobicContact CD1-CD1 3.82Å
1592	I	56.3	Low	48	Very low	55 Å²	55	88 Å²	88	28%	0.282	44%	0.441	S	S	.	.	H	α-helix	trans	-75.8	-33	178.3	-50.4	174.2	0	0	0	111.3	E124 D1588 E1590 I1594 L1596	E124-I1592 HydrophobicContact CB-CG2 4.39Å; D1588-I1592 HydrophobicContact CB-CD1 4.36Å; D1588-I1592 VanDerWaalsContact O-CD1 3.31Å; D1588-I1592 WeakPolarHBondContact O-CD1 3.18Å; D1588-I1592 VanDerWaalsContact O-CG1 3.25Å; D1588-I1592 WeakPolarHBondContact O-CG1 3.35Å; E1590-I1592 PolarHBondContact O-N 3.12Å; I1592-I1594 VanDerWaalsContact C-N 3.32Å; I1592-L1596 VanDerWaalsContact O-CB 3.26Å; I1592-L1596 WeakPolarHBondContact O-CB 3.45Å; I1592-L1596 PolarHBondContact O-N 3.47Å
1593	K	50.1	Low	49.8	Very low	72 Å²	72	84 Å²	84	31%	0.313	42%	0.418	S	S	.	.	H	α-helix	trans	-63.5	-37.2	168.7	-76.3	178.6	-176.6	171.8	0	112.3	R122 E1590 L1596 E1597	R122-K1593 HydrophobicContact CB-CG 4.4Å; R122-K1593 WeakPolarHBondContact O-CG 3.43Å; E1590-K1593 WeakPolarHBondContact O-CB 3.42Å; E1590-K1593 PolarHBondContact O-N 3.04Å; E1590-K1593 VanDerWaalsContact O-N 3.07Å; K1593-L1596 WeakPolarHBondContact O-CB 3.39Å; K1593-L1596 PolarHBondContact O-N 3.12Å; K1593-E1597 PolarHBondContact O-N 3.07Å
1594	I	53.6	Low	51.9	Low	30 Å²	30	81.1 Å²	81.1	15%	0.154	40%	0.4	C	S	.	.	H	α-helix	trans	-68.9	-44.5	179	-64.5	164.9	0	0	0	110.4	E1590 L1591 I1592 L1596 E1597 Y1598 K1776 L1780	E1590-I1594 WeakPolarHBondContact O-CG1 3.37Å; E1590-I1594 PolarHBondContact O-N 3.07Å; L1591-I1594 PolarHBondContact O-N 3.02Å; I1592-I1594 VanDerWaalsContact C-N 3.32Å; I1594-L1596 PolarHBondContact O-N 3.45Å; I1594-E1597 PolarHBondContact O-N 2.84Å; I1594-Y1598 WeakPolarHBondContact O-CB 3Å; I1594-Y1598 PolarHBondContact O-N 3.07Å; I1594-K1776 HydrophobicContact CD1-CB 4.05Å; I1594-K1776 HydrophobicContact CD1-CD 4.46Å; I1594-K1776 HydrophobicContact CD1-CG 4.19Å; I1594-K1776 HydrophobicContact CG1-CB 4.48Å; I1594-K1776 HydrophobicContact CG1-CD 4.06Å; I1594-K1776 HydrophobicContact CG1-CG 4.33Å; I1594-L1780 HydrophobicContact CD1-CD1 3.83Å
1595	K	53	Low	54	Low	91 Å²	91	77.2 Å²	77.2	40%	0.396	38%	0.38	S	S	.	.	H	α-helix	trans	-53.8	-42.9	169.7	-76.9	-174	176	-176.4	0	111.4	S155 L1591 S1599	S155-K1595 PolarHBondContact O-NZ 3.09Å; L1591-K1595 PolarHBondContact O-N 2.59Å; K1595-S1599 WeakPolarHBondContact O-CB 3.43Å; K1595-S1599 PolarHBondContact O-N 3.23Å
1596	L	57.2	Low	55.9	Low	7 Å²	7	76.6 Å²	76.6	4%	0.037	37%	0.37	C	S	.	.	H	α-helix	trans	-68.5	-35.2	-176.3	176.7	53.9	0	0	0	115.3	L105 R122 E124 I1592 K1593 I1594 S1599	L105-L1596 HydrophobicContact CB-CD1 3.95Å; L105-L1596 HydrophobicContact CB-CD2 4.42Å; L105-L1596 HydrophobicContact CD1-CD1 4.02Å; L105-L1596 HydrophobicContact CD1-CD2 3.64Å; L105-L1596 HydrophobicContact CD1-CG 4.06Å; L105-L1596 HydrophobicContact CG-CD1 3.99Å; L105-L1596 HydrophobicContact CG-CD2 3.58Å; L105-L1596 HydrophobicContact CG-CG 4.27Å; R122-L1596 HydrophobicContact CB-CD2 4.16Å; E124-L1596 HydrophobicContact CB-CB 3.81Å; E124-L1596 HydrophobicContact CB-CD1 4.13Å; E124-L1596 HydrophobicContact CB-CG 4.47Å; I1592-L1596 VanDerWaalsContact O-CB 3.26Å; I1592-L1596 WeakPolarHBondContact O-CB 3.45Å; I1592-L1596 PolarHBondContact O-N 3.47Å; K1593-L1596 WeakPolarHBondContact O-CB 3.39Å; K1593-L1596 PolarHBondContact O-N 3.12Å; I1594-L1596 PolarHBondContact O-N 3.45Å; L1596-S1599 WeakPolarHBondContact O-CB 3.19Å
1597	E	56.6	Low	58	Low	95 Å²	95	70.3 Å²	70.3	44%	0.444	34%	0.341	S	S	.	.	H	α-helix	trans	-77.1	-50.7	176.4	-71.8	171.5	163.3	0	0	111.1	K1593 I1594 S1599 K1600 A1601 K1776	K1593-E1597 PolarHBondContact O-N 3.07Å; I1594-E1597 PolarHBondContact O-N 2.84Å; E1597-S1599 PolarHBondContact O-N 3.15Å; E1597-S1599 VanDerWaalsContact O-N 3.08Å; E1597-K1600 PolarHBondContact O-N 3.37Å; E1597-K1600 VanDerWaalsContact O-N 3.16Å; E1597-A1601 PolarHBondContact O-N 3.24Å; E1597-K1776 IonicContact OE1-NZ 3.49Å; E1597-K1776 IonicContact OE2-NZ 3.49Å; E1597-K1776 PolarHBondContact OE2-NZ 3.37Å
1598	Y	58.4	Low	60	Low	124 Å²	124	66 Å²	66	49%	0.486	31%	0.31	S	S	.	.	H	α-helix	trans	-53.2	-32.5	173.4	-176.5	-99.8	0	0	0	112.2	I1594 L1602	I1594-Y1598 WeakPolarHBondContact O-CB 3Å; I1594-Y1598 PolarHBondContact O-N 3.07Å; Y1598-L1602 HydrophobicContact CE1-CD1 4.41Å; Y1598-L1602 PolarHBondContact O-N 3.46Å
1599	S	62.7	Low	61.6	Low	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.3	-48.1	178.9	151.9	0	0	0	0	115.3	R103 E124 K1595 L1596 E1597 L1602 E1603	R103-S1599 WeakPolarHBondContact CD-OG 3.43Å; R103-S1599 PolarHBondContact NE-OG 3.03Å; R103-S1599 PolarHBondContact NH1-O 2.92Å; E124-S1599 WeakPolarHBondContact OE1-CB 3.4Å; E124-S1599 PolarHBondContact OE1-OG 3.39Å; E124-S1599 WeakPolarHBondContact OE2-CB 3.22Å; E124-S1599 PolarHBondContact OE2-OG 3.17Å; E124-S1599 VanDerWaalsContact OE2-OG 3.05Å; K1595-S1599 WeakPolarHBondContact O-CB 3.43Å; K1595-S1599 PolarHBondContact O-N 3.23Å; L1596-S1599 WeakPolarHBondContact O-CB 3.19Å; E1597-S1599 PolarHBondContact O-N 3.15Å; E1597-S1599 VanDerWaalsContact O-N 3.08Å; S1599-L1602 PolarHBondContact O-N 2.87Å; S1599-E1603 PolarHBondContact O-N 3.01Å
1600	K	63.4	Low	63.2	Low	109 Å²	109	65.6 Å²	65.6	47%	0.474	31%	0.31	S	S	.	.	H	α-helix	trans	-73.3	-38.9	-178.3	-70.9	179	174.2	-171.2	0	111.3	L105 E1597 L1602 E1603 R1604	L105-K1600 VanDerWaalsContact CD1-NZ 3.29Å; E1597-K1600 PolarHBondContact O-N 3.37Å; E1597-K1600 VanDerWaalsContact O-N 3.16Å; K1600-L1602 PolarHBondContact O-N 3.1Å; K1600-E1603 PolarHBondContact O-N 2.84Å; K1600-E1603 VanDerWaalsContact O-N 3.1Å; K1600-R1604 PolarHBondContact O-N 3.28Å
1601	A	61.7	Low	64.9	Low	12 Å²	12	63.4 Å²	63.4	10%	0.099	30%	0.301	C	S	.	.	H	α-helix	trans	-52.3	-45.5	169.8	0	0	0	0	0	111.2	E1597 E1603 R1604 I1605 N1769	E1597-A1601 PolarHBondContact O-N 3.24Å; A1601-E1603 VanDerWaalsContact C-N 3.26Å; A1601-E1603 PolarHBondContact O-N 3.17Å; A1601-R1604 PolarHBondContact O-N 3.3Å; A1601-R1604 VanDerWaalsContact O-N 3.17Å; A1601-I1605 WeakPolarHBondContact O-CB 3.48Å; A1601-I1605 WeakPolarHBondContact O-CD1 3.39Å; A1601-I1605 VanDerWaalsContact O-CG1 3.24Å; A1601-I1605 WeakPolarHBondContact O-CG1 3.26Å; A1601-I1605 PolarHBondContact O-N 3.03Å; A1601-N1769 HydrophobicContact CB-CB 4.41Å; A1601-N1769 VanDerWaalsContact CB-CG 3.46Å; A1601-N1769 WeakPolarHBondContact CB-ND2 3.46Å; A1601-N1769 WeakPolarHBondContact CB-OD1 3.3Å
1602	L	68.1	Low	66.5	Low	61 Å²	61	60.2 Å²	60.2	32%	0.319	29%	0.285	S	S	.	.	H	α-helix	trans	-69	-15.2	-179.7	-147.7	93.1	0	0	0	115.3	Y1598 S1599 K1600	Y1598-L1602 HydrophobicContact CE1-CD1 4.41Å; Y1598-L1602 PolarHBondContact O-N 3.46Å; S1599-L1602 PolarHBondContact O-N 2.87Å; K1600-L1602 PolarHBondContact O-N 3.1Å
1603	E	69.2	Low	67.6	Low	64 Å²	64	61.9 Å²	61.9	30%	0.299	29%	0.294	S	S	.	.	H	α-helix	trans	-88	-41.9	168.2	-71.5	-169.9	151.6	0	0	110.4	R158 S1599 K1600 A1601 I1605 K1606 E1607	R158-E1603 IonicContact CZ-OE1 3.41Å; R158-E1603 IonicContact NH1-OE1 2.7Å; R158-E1603 PolarHBondContact NH1-OE1 2.87Å; R158-E1603 IonicContact NH2-OE1 2.69Å; R158-E1603 PolarHBondContact NH2-OE1 3.41Å; S1599-E1603 PolarHBondContact O-N 3.01Å; K1600-E1603 PolarHBondContact O-N 2.84Å; K1600-E1603 VanDerWaalsContact O-N 3.1Å; A1601-E1603 VanDerWaalsContact C-N 3.26Å; A1601-E1603 PolarHBondContact O-N 3.17Å; E1603-I1605 PolarHBondContact O-N 2.75Å; E1603-K1606 PolarHBondContact O-N 3.35Å; E1603-K1606 VanDerWaalsContact O-N 3.17Å; E1603-E1607 PolarHBondContact O-N 3.07Å
1604	R	75	Confident	69.1	Low	101 Å²	101	62.4 Å²	62.4	38%	0.381	30%	0.3	S	S	.	.	H	α-helix	trans	-59.2	-45	176.8	-178.1	57.2	-179.2	164.3	3.9	113.6	K1600 A1601 K1606 E1607 L1608	K1600-R1604 PolarHBondContact O-N 3.28Å; A1601-R1604 PolarHBondContact O-N 3.3Å; A1601-R1604 VanDerWaalsContact O-N 3.17Å; R1604-K1606 PolarHBondContact O-N 2.91Å; R1604-E1607 WeakPolarHBondContact CD-OE2 3.38Å; R1604-E1607 IonicContact CZ-OE2 2.79Å; R1604-E1607 IonicContact NE-OE2 3.67Å; R1604-E1607 IonicContact NH1-OE2 3.19Å; R1604-E1607 PolarHBondContact NH1-OE2 3.12Å; R1604-E1607 WeakPolarHBondContact O-CB 3.48Å; R1604-E1607 PolarHBondContact O-N 3.17Å; R1604-L1608 PolarHBondContact O-N 3.49Å
1605	I	72.5	Confident	70.6	Confident	20 Å²	20	62.4 Å²	62.4	10%	0.103	30%	0.3	C	S	.	.	H	α-helix	trans	-53.8	-38.6	176.8	-75	165.6	0	0	0	111.3	A1601 E1603 E1609 Y1762 Y1766	A1601-I1605 WeakPolarHBondContact O-CB 3.48Å; A1601-I1605 WeakPolarHBondContact O-CD1 3.39Å; A1601-I1605 VanDerWaalsContact O-CG1 3.24Å; A1601-I1605 WeakPolarHBondContact O-CG1 3.26Å; A1601-I1605 PolarHBondContact O-N 3.03Å; E1603-I1605 PolarHBondContact O-N 2.75Å; I1605-E1609 WeakPolarHBondContact O-CB 3.49Å; I1605-E1609 PolarHBondContact O-N 3.26Å; I1605-E1609 VanDerWaalsContact O-N 3.12Å; I1605-Y1762 HydrophobicContact CB-CE2 4.45Å; I1605-Y1762 HydrophobicContact CG2-CD2 4.22Å; I1605-Y1762 HydrophobicContact CG2-CE2 3.46Å; I1605-Y1762 VanDerWaalsContact CG2-CE2 3.46Å; I1605-Y1762 WeakPolarHBondContact O-CD2 3.3Å; I1605-Y1762 WeakPolarHBondContact O-CE2 3.39Å; I1605-Y1766 HydrophobicContact CD1-CD2 4.15Å
1606	K	72.9	Confident	72.1	Confident	128 Å²	128	61.9 Å²	61.9	56%	0.557	30%	0.298	S	S	*	.	H	α-helix	trans	-75.2	-23.6	-179.6	-66	-178.3	178.3	-170.3	0	114	E1603 R1604 A1610	E1603-K1606 PolarHBondContact O-N 3.35Å; E1603-K1606 VanDerWaalsContact O-N 3.17Å; R1604-K1606 PolarHBondContact O-N 2.91Å; K1606-A1610 WeakPolarHBondContact O-CB 3.31Å; K1606-A1610 PolarHBondContact O-N 3.08Å; K1606-A1610 VanDerWaalsContact O-N 3.12Å
1607	E	75	Confident	73.2	Confident	52 Å²	52	65.4 Å²	65.4	24%	0.243	32%	0.323	C	S	.	.	H	α-helix	trans	-70	-46.3	174.5	-59.8	173.1	174.5	0	0	110.5	E1603 R1604 A1610 M1611 F2319	E1603-E1607 PolarHBondContact O-N 3.07Å; R1604-E1607 WeakPolarHBondContact CD-OE2 3.38Å; R1604-E1607 IonicContact CZ-OE2 2.79Å; R1604-E1607 IonicContact NE-OE2 3.67Å; R1604-E1607 IonicContact NH1-OE2 3.19Å; R1604-E1607 PolarHBondContact NH1-OE2 3.12Å; R1604-E1607 WeakPolarHBondContact O-CB 3.48Å; R1604-E1607 PolarHBondContact O-N 3.17Å; E1607-A1610 PolarHBondContact O-N 2.6Å; E1607-M1611 WeakPolarHBondContact O-CG 3.22Å; E1607-M1611 PolarHBondContact O-N 2.72Å; E1607-M1611 VanDerWaalsContact O-N 3.07Å; E1607-F2319 VanDerWaalsContact CD-CZ 3.43Å; E1607-F2319 HydrophobicContact CG-CE1 4.28Å; E1607-F2319 HydrophobicContact CG-CE2 4.25Å; E1607-F2319 HydrophobicContact CG-CZ 3.6Å; E1607-F2319 WeakPolarHBondContact OE1-CE1 3.48Å; E1607-F2319 WeakPolarHBondContact OE1-CZ 3.47Å
1608	L	77.5	Confident	74.6	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-63.8	-43.1	177.4	-65.5	167.8	0	0	0	111.1	R1604 A1610 M1611 S1612 I1758 Y1762	R1604-L1608 PolarHBondContact O-N 3.49Å; L1608-A1610 PolarHBondContact O-N 3Å; L1608-M1611 HydrophobicContact CD2-CE 3.88Å; L1608-M1611 PolarHBondContact O-N 3.01Å; L1608-S1612 PolarHBondContact O-N 2.79Å; L1608-I1758 HydrophobicContact CB-CG2 4.46Å; L1608-I1758 HydrophobicContact CD2-CG2 4.35Å; L1608-Y1762 HydrophobicContact CB-CD2 3.97Å
1609	E	74.5	Confident	76	Confident	90 Å²	90	61.5 Å²	61.5	42%	0.421	31%	0.308	S	S	.	.	H	α-helix	trans	-57.5	-44.8	173.6	-168.9	174.4	-144.1	0	0	112.4	I1605 S1612 N1613 Y1762	I1605-E1609 WeakPolarHBondContact O-CB 3.49Å; I1605-E1609 PolarHBondContact O-N 3.26Å; I1605-E1609 VanDerWaalsContact O-N 3.12Å; E1609-S1612 PolarHBondContact O-N 2.9Å; E1609-N1613 PolarHBondContact O-N 3.3Å; E1609-N1613 PolarHBondContact O-ND2 2.89Å; E1609-Y1762 HydrophobicContact CB-CE2 4.06Å
1610	A	76.8	Confident	76.9	Confident	59 Å²	59	64.8 Å²	64.8	49%	0.488	33%	0.331	S	S	.	.	H	α-helix	trans	-65.1	-41	177.5	0	0	0	0	0	112.7	K1606 E1607 L1608 N1613 D1614	K1606-A1610 WeakPolarHBondContact O-CB 3.31Å; K1606-A1610 PolarHBondContact O-N 3.08Å; K1606-A1610 VanDerWaalsContact O-N 3.12Å; E1607-A1610 PolarHBondContact O-N 2.6Å; L1608-A1610 PolarHBondContact O-N 3Å; A1610-N1613 PolarHBondContact O-N 2.81Å; A1610-D1614 PolarHBondContact O-N 2.73Å
1611	M	80.6	Confident	77.9	Confident	85 Å²	85	62.4 Å²	62.4	42%	0.419	33%	0.331	S	S	.	.	H	α-helix	trans	-68.8	-38.3	177.6	-69.3	-174.2	-65.3	0	0	112.6	E1607 L1608 N1613 D1614 L1615 I1758	E1607-M1611 WeakPolarHBondContact O-CG 3.22Å; E1607-M1611 PolarHBondContact O-N 2.72Å; E1607-M1611 VanDerWaalsContact O-N 3.07Å; L1608-M1611 HydrophobicContact CD2-CE 3.88Å; L1608-M1611 PolarHBondContact O-N 3.01Å; M1611-N1613 VanDerWaalsContact C-N 3.27Å; M1611-N1613 PolarHBondContact O-N 2.85Å; M1611-D1614 PolarHBondContact O-N 3.34Å; M1611-L1615 PolarHBondContact O-N 2.81Å; M1611-I1758 HydrophobicContact CB-CD1 4.24Å
1612	S	81.9	Confident	79.1	Confident	7 Å²	7	63.6 Å²	63.6	5%	0.049	34%	0.336	C	S	.	.	H	α-helix	trans	-58.3	-40.5	174	-168.1	0	0	0	0	111.5	L1608 E1609 K1616	L1608-S1612 PolarHBondContact O-N 2.79Å; E1609-S1612 PolarHBondContact O-N 2.9Å; S1612-K1616 WeakPolarHBondContact O-CB 3.41Å; S1612-K1616 WeakPolarHBondContact O-CD 3.36Å; S1612-K1616 VanDerWaalsContact O-CG 3.26Å; S1612-K1616 WeakPolarHBondContact O-CG 3.39Å; S1612-K1616 PolarHBondContact O-N 2.77Å; S1612-K1616 PolarHBondContact OG-NZ 3.03Å
1613	N	78.4	Confident	79.9	Confident	89 Å²	89	63.6 Å²	63.6	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-70.3	-39.9	-179.3	-73.7	-42.4	0	0	0	113.6	E1609 A1610 M1611 K1616 C1617	E1609-N1613 PolarHBondContact O-N 3.3Å; E1609-N1613 PolarHBondContact O-ND2 2.89Å; A1610-N1613 PolarHBondContact O-N 2.81Å; M1611-N1613 VanDerWaalsContact C-N 3.27Å; M1611-N1613 PolarHBondContact O-N 2.85Å; N1613-K1616 PolarHBondContact O-N 3.4Å; N1613-C1617 PolarHBondContact O-N 2.84Å; N1613-C1617 PolarHBondContact O-SG 2.89Å
1614	D	81.4	Confident	80.6	Confident	83 Å²	83	66 Å²	66	44%	0.444	35%	0.353	S	S	.	.	H	α-helix	trans	-65	-39.5	175.7	177.7	68.1	0	0	0	112.3	A1610 M1611 C1617 K1618	A1610-D1614 PolarHBondContact O-N 2.73Å; M1611-D1614 PolarHBondContact O-N 3.34Å; D1614-C1617 PolarHBondContact O-N 2.76Å; D1614-K1618 PolarHBondContact O-N 3.4Å; D1614-K1618 VanDerWaalsContact O-N 3.11Å; D1614-K1618 IonicContact OD1-NZ 2.68Å; D1614-K1618 WeakPolarHBondContact OD2-CE 3.3Å; D1614-K1618 IonicContact OD2-NZ 3.83Å; D1614-K1618 PolarHBondContact OD2-NZ 3.21Å
1615	L	85.6	Confident	81.1	Confident	30 Å²	30	66 Å²	66	16%	0.157	36%	0.356	C	S	.	.	H	α-helix	trans	-66.4	-40	172.7	-68.3	178.8	0	0	0	112.3	M1611 C1617 K1618 L1619 L1751 D1754 I1755 I1758	M1611-L1615 PolarHBondContact O-N 2.81Å; L1615-C1617 VanDerWaalsContact C-N 3.31Å; L1615-C1617 PolarHBondContact O-N 3.2Å; L1615-K1618 PolarHBondContact O-N 3.1Å; L1615-K1618 VanDerWaalsContact O-N 3.17Å; L1615-L1619 WeakPolarHBondContact O-CB 3.27Å; L1615-L1619 PolarHBondContact O-N 3.33Å; L1615-L1751 HydrophobicContact CD2-CD2 4.04Å; L1615-D1754 HydrophobicContact CD1-CB 4.23Å; L1615-I1755 HydrophobicContact CB-CD1 3.98Å; L1615-I1755 HydrophobicContact CB-CG1 3.48Å; L1615-I1755 VanDerWaalsContact CB-CG1 3.48Å; L1615-I1755 HydrophobicContact CD1-CG1 4.11Å; L1615-I1755 HydrophobicContact CG-CG1 4.45Å; L1615-I1758 HydrophobicContact CD1-CD1 3.79Å
1616	K	85.3	Confident	81.9	Confident	80 Å²	80	66 Å²	66	35%	0.348	36%	0.357	S	S	.	.	H	α-helix	trans	-60.8	-38	174.7	-78.3	163.6	176.8	154.8	0	112.3	S1612 N1613 L1619 S1620 I1755	S1612-K1616 WeakPolarHBondContact O-CB 3.41Å; S1612-K1616 WeakPolarHBondContact O-CD 3.36Å; S1612-K1616 VanDerWaalsContact O-CG 3.26Å; S1612-K1616 WeakPolarHBondContact O-CG 3.39Å; S1612-K1616 PolarHBondContact O-N 2.77Å; S1612-K1616 PolarHBondContact OG-NZ 3.03Å; N1613-K1616 PolarHBondContact O-N 3.4Å; K1616-L1619 PolarHBondContact O-N 2.65Å; K1616-S1620 PolarHBondContact O-N 2.81Å; K1616-I1755 HydrophobicContact CG-CD1 4.08Å; K1616-I1755 HydrophobicContact CG-CG2 4.32Å
1617	C	79.3	Confident	82.4	Confident	82 Å²	82	62.9 Å²	62.9	55%	0.554	36%	0.355	S	S	*	.	H	α-helix	trans	-64	-42.7	171.8	-73.2	0	0	0	0	112.7	N1613 D1614 L1615 S1620 A1621	N1613-C1617 PolarHBondContact O-N 2.84Å; N1613-C1617 PolarHBondContact O-SG 2.89Å; D1614-C1617 PolarHBondContact O-N 2.76Å; L1615-C1617 VanDerWaalsContact C-N 3.31Å; L1615-C1617 PolarHBondContact O-N 3.2Å; C1617-S1620 PolarHBondContact O-N 2.79Å; C1617-S1620 PolarHBondContact O-OG 2.83Å; C1617-A1621 PolarHBondContact O-N 3.28Å
1618	K	85.7	Confident	82.9	Confident	104 Å²	104	65.8 Å²	65.8	45%	0.452	37%	0.368	S	S	.	.	H	α-helix	trans	-65.6	-39.9	176	-73.4	162.5	-179.6	163.7	0	112.2	D1614 L1615 A1621 L1622 L1751	D1614-K1618 PolarHBondContact O-N 3.4Å; D1614-K1618 VanDerWaalsContact O-N 3.11Å; D1614-K1618 IonicContact OD1-NZ 2.68Å; D1614-K1618 WeakPolarHBondContact OD2-CE 3.3Å; D1614-K1618 IonicContact OD2-NZ 3.83Å; D1614-K1618 PolarHBondContact OD2-NZ 3.21Å; L1615-K1618 PolarHBondContact O-N 3.1Å; L1615-K1618 VanDerWaalsContact O-N 3.17Å; K1618-A1621 PolarHBondContact O-N 2.73Å; K1618-L1622 PolarHBondContact O-N 3.27Å; K1618-L1622 VanDerWaalsContact O-N 3.14Å; K1618-L1751 HydrophobicContact CB-CD1 4.43Å
1619	L	89.1	Confident	83.5	Confident	33 Å²	33	69.3 Å²	69.3	17%	0.173	38%	0.382	C	S	.	.	H	α-helix	trans	-60.8	-43.1	175.4	-172.2	77.4	0	0	0	111.7	L1615 K1616 T1623 I1748 L1751 R1752 I1755	L1615-L1619 WeakPolarHBondContact O-CB 3.27Å; L1615-L1619 PolarHBondContact O-N 3.33Å; K1616-L1619 PolarHBondContact O-N 2.65Å; L1619-T1623 WeakPolarHBondContact O-CB 3.34Å; L1619-T1623 PolarHBondContact O-N 3.05Å; L1619-T1623 PolarHBondContact O-OG1 2.9Å; L1619-I1748 HydrophobicContact CD1-CG2 3.91Å; L1619-I1748 WeakPolarHBondContact CD1-O 3.14Å; L1619-L1751 HydrophobicContact CD1-CB 3.78Å; L1619-R1752 HydrophobicContact CD1-CG 3.83Å; L1619-R1752 HydrophobicContact CD2-CG 4.23Å; L1619-I1755 HydrophobicContact CB-CD1 4.01Å; L1619-I1755 HydrophobicContact CD2-CD1 3.86Å; L1619-I1755 HydrophobicContact CG-CD1 4.37Å
1620	S	80.4	Confident	84.1	Confident	68 Å²	68	70.1 Å²	70.1	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-66.3	-42	-179	70.7	0	0	0	0	112.3	K1616 C1617 T1623 I1624	K1616-S1620 PolarHBondContact O-N 2.81Å; C1617-S1620 PolarHBondContact O-N 2.79Å; C1617-S1620 PolarHBondContact O-OG 2.83Å; S1620-T1623 PolarHBondContact O-N 3.07Å; S1620-I1624 WeakPolarHBondContact O-CG1 3.41Å; S1620-I1624 PolarHBondContact O-N 3.08Å
1621	A	84.5	Confident	84.6	Confident	59 Å²	59	71.7 Å²	71.7	49%	0.488	38%	0.381	S	S	.	.	H	α-helix	trans	-60.8	-51	175.6	0	0	0	0	0	112.2	C1617 K1618 T1623 I1624 E1625	C1617-A1621 PolarHBondContact O-N 3.28Å; K1618-A1621 PolarHBondContact O-N 2.73Å; A1621-T1623 VanDerWaalsContact C-N 3.28Å; A1621-T1623 PolarHBondContact O-N 3.49Å; A1621-I1624 PolarHBondContact O-N 2.82Å; A1621-E1625 PolarHBondContact O-N 3.46Å; A1621-E1625 VanDerWaalsContact O-N 3.11Å
1622	L	87	Confident	84.8	Confident	37 Å²	37	71.1 Å²	71.1	19%	0.194	38%	0.38	C	S	.	.	H	α-helix	trans	-62.9	-32.3	177.2	-98.9	160.7	0	0	0	112.9	K1618 I1624 E1625 N1626 T1747 I1748 L1751	K1618-L1622 PolarHBondContact O-N 3.27Å; K1618-L1622 VanDerWaalsContact O-N 3.14Å; L1622-I1624 VanDerWaalsContact C-N 3.35Å; L1622-E1625 PolarHBondContact O-N 2.91Å; L1622-N1626 WeakPolarHBondContact O-CB 3.4Å; L1622-N1626 PolarHBondContact O-N 2.84Å; L1622-T1747 HydrophobicContact CD1-CG2 3.77Å; L1622-I1748 HydrophobicContact CB-CD1 4.47Å; L1622-I1748 HydrophobicContact CB-CG1 3.93Å; L1622-L1751 HydrophobicContact CD1-CD1 3.55Å
1623	T	84.8	Confident	85	Confident	61 Å²	61	71.3 Å²	71.3	37%	0.374	38%	0.381	S	S	.	.	H	α-helix	trans	-67	-36	176.7	-57.8	0	0	0	0	111.9	L1619 S1620 A1621 A1627	L1619-T1623 WeakPolarHBondContact O-CB 3.34Å; L1619-T1623 PolarHBondContact O-N 3.05Å; L1619-T1623 PolarHBondContact O-OG1 2.9Å; S1620-T1623 PolarHBondContact O-N 3.07Å; A1621-T1623 VanDerWaalsContact C-N 3.28Å; A1621-T1623 PolarHBondContact O-N 3.49Å; T1623-A1627 PolarHBondContact O-N 2.85Å; T1623-A1627 VanDerWaalsContact O-N 3.12Å
1624	I	85.2	Confident	85.3	Confident	116 Å²	116	71.2 Å²	71.2	60%	0.595	38%	0.381	S	S	*	.	H	α-helix	trans	-68.3	-43.2	173.7	-64.9	163.5	0	0	0	110.5	S1620 A1621 L1622 A1627 H1628	S1620-I1624 WeakPolarHBondContact O-CG1 3.41Å; S1620-I1624 PolarHBondContact O-N 3.08Å; A1621-I1624 PolarHBondContact O-N 2.82Å; L1622-I1624 VanDerWaalsContact C-N 3.35Å; I1624-A1627 WeakPolarHBondContact O-CB 3.46Å; I1624-A1627 PolarHBondContact O-N 3.1Å; I1624-H1628 PolarHBondContact O-N 3.21Å
1625	E	84.1	Confident	85.5	Confident	99 Å²	99	73 Å²	73	46%	0.463	38%	0.381	S	S	.	.	H	α-helix	trans	-64.5	-40	178.6	-162.1	170.9	-135.7	0	0	111.9	A1621 L1622 A1627 H1628 Y1629	A1621-E1625 PolarHBondContact O-N 3.46Å; A1621-E1625 VanDerWaalsContact O-N 3.11Å; L1622-E1625 PolarHBondContact O-N 2.91Å; E1625-A1627 PolarHBondContact O-N 3.42Å; E1625-H1628 WeakPolarHBondContact O-CB 3.21Å; E1625-H1628 PolarHBondContact O-N 2.89Å; E1625-H1628 VanDerWaalsContact O-N 3.15Å; E1625-Y1629 HydrophobicContact CG-CD2 4.48Å; E1625-Y1629 HydrophobicContact CG-CE2 3.85Å; E1625-Y1629 WeakPolarHBondContact O-CD2 3.26Å; E1625-Y1629 PolarHBondContact O-N 3.48Å
1626	N	89	Confident	85.5	Confident	21 Å²	21	72.2 Å²	72.2	11%	0.112	38%	0.379	C	S	.	.	H	α-helix	trans	-66.6	-35.1	174.2	-165.1	33.6	0	0	0	113.1	L1622 H1628 Y1629 K1630 A1744 E1745 I1748	L1622-N1626 WeakPolarHBondContact O-CB 3.4Å; L1622-N1626 PolarHBondContact O-N 2.84Å; N1626-H1628 PolarHBondContact O-N 3.49Å; N1626-Y1629 PolarHBondContact O-N 2.66Å; N1626-K1630 WeakPolarHBondContact O-CB 3.34Å; N1626-K1630 PolarHBondContact O-N 2.73Å; N1626-A1744 HydrophobicContact CB-CB 3.91Å; N1626-A1744 WeakPolarHBondContact OD1-CB 3.19Å; N1626-E1745 WeakPolarHBondContact ND2-CG 3.49Å; N1626-I1748 HydrophobicContact CB-CD1 3.58Å
1627	A	84	Confident	85.7	Confident	62 Å²	62	71.4 Å²	71.4	51%	0.512	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-34.2	172.3	0	0	0	0	0	112	T1623 I1624 E1625 Q1631	T1623-A1627 PolarHBondContact O-N 2.85Å; T1623-A1627 VanDerWaalsContact O-N 3.12Å; I1624-A1627 WeakPolarHBondContact O-CB 3.46Å; I1624-A1627 PolarHBondContact O-N 3.1Å; E1625-A1627 PolarHBondContact O-N 3.42Å; A1627-Q1631 PolarHBondContact O-N 3.4Å
1628	H	86.1	Confident	86	Confident	114 Å²	114	70.1 Å²	70.1	53%	0.528	37%	0.366	S	S	.	.	H	α-helix	trans	-68.2	-43.8	171.5	-100	-73	0	0	0	112.9	I1624 E1625 N1626 K1630 Q1631 N1632	I1624-H1628 PolarHBondContact O-N 3.21Å; E1625-H1628 WeakPolarHBondContact O-CB 3.21Å; E1625-H1628 PolarHBondContact O-N 2.89Å; E1625-H1628 VanDerWaalsContact O-N 3.15Å; N1626-H1628 PolarHBondContact O-N 3.49Å; H1628-K1630 VanDerWaalsContact C-N 3.3Å; H1628-K1630 PolarHBondContact O-N 3.37Å; H1628-Q1631 PolarHBondContact O-N 3.15Å; H1628-N1632 PolarHBondContact O-N 3.21Å; H1628-N1632 VanDerWaalsContact O-N 3.09Å
1629	Y	89.2	Confident	86	Confident	76 Å²	76	68.2 Å²	68.2	30%	0.298	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-40.1	173.8	-69.6	-52.4	0	0	0	111.8	E1625 N1626 N1632 C1633 N1740 A1744	E1625-Y1629 HydrophobicContact CG-CD2 4.48Å; E1625-Y1629 HydrophobicContact CG-CE2 3.85Å; E1625-Y1629 WeakPolarHBondContact O-CD2 3.26Å; E1625-Y1629 PolarHBondContact O-N 3.48Å; N1626-Y1629 PolarHBondContact O-N 2.66Å; Y1629-N1632 PolarHBondContact O-N 2.93Å; Y1629-C1633 PolarHBondContact O-N 3.19Å; Y1629-C1633 PolarHBondContact O-SG 3.16Å; Y1629-N1740 HydrophobicContact CD1-CB 4Å; Y1629-N1740 HydrophobicContact CE1-CB 4.08Å; Y1629-N1740 HydrophobicContact CG-CB 4.41Å; Y1629-A1744 HydrophobicContact CD2-CB 4.02Å; Y1629-A1744 HydrophobicContact CE2-CB 4.39Å
1630	K	88.3	Confident	86.1	Confident	107 Å²	107	66.8 Å²	66.8	47%	0.465	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-48.5	175.3	-173.4	161.7	-178	162.8	0	112.3	N1626 H1628 N1632 C1633 D1634	N1626-K1630 WeakPolarHBondContact O-CB 3.34Å; N1626-K1630 PolarHBondContact O-N 2.73Å; H1628-K1630 VanDerWaalsContact C-N 3.3Å; H1628-K1630 PolarHBondContact O-N 3.37Å; K1630-N1632 PolarHBondContact O-N 2.88Å; K1630-C1633 WeakPolarHBondContact O-CA 3.36Å; K1630-C1633 WeakPolarHBondContact O-CB 3.33Å; K1630-C1633 PolarHBondContact O-N 3.46Å; K1630-D1634 VanDerWaalsContact O-CG 3.29Å; K1630-D1634 PolarHBondContact O-N 3.48Å
1631	Q	86.7	Confident	86.3	Confident	92 Å²	92	67.5 Å²	67.5	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-60.7	-29.7	177.9	-165.9	-175.5	60.6	0	0	112.5	A1627 H1628 R1635	A1627-Q1631 PolarHBondContact O-N 3.4Å; H1628-Q1631 PolarHBondContact O-N 3.15Å; Q1631-R1635 WeakPolarHBondContact O-CG 3.41Å; Q1631-R1635 PolarHBondContact O-N 2.92Å; Q1631-R1635 VanDerWaalsContact O-N 3.1Å
1632	N	85.9	Confident	86.5	Confident	74 Å²	74	66.4 Å²	66.4	40%	0.396	34%	0.335	S	S	.	.	H	α-helix	trans	-73.8	-37.5	172.9	-71	-3	0	0	0	112.5	H1628 Y1629 K1630 R1635 A1636	H1628-N1632 PolarHBondContact O-N 3.21Å; H1628-N1632 VanDerWaalsContact O-N 3.09Å; Y1629-N1632 PolarHBondContact O-N 2.93Å; K1630-N1632 PolarHBondContact O-N 2.88Å; N1632-R1635 PolarHBondContact OD1-NH1 3.37Å; N1632-A1636 WeakPolarHBondContact O-CB 3.5Å; N1632-A1636 PolarHBondContact O-N 3Å
1633	C	84.9	Confident	86.5	Confident	10 Å²	10	64.6 Å²	64.6	7%	0.068	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-47	170.7	-59.8	0	0	0	0	111.2	Y1629 K1630 R1635 A1636 R1637 A1737	Y1629-C1633 PolarHBondContact O-N 3.19Å; Y1629-C1633 PolarHBondContact O-SG 3.16Å; K1630-C1633 WeakPolarHBondContact O-CA 3.36Å; K1630-C1633 WeakPolarHBondContact O-CB 3.33Å; K1630-C1633 PolarHBondContact O-N 3.46Å; C1633-R1635 VanDerWaalsContact C-N 3.31Å; C1633-R1635 PolarHBondContact O-N 2.88Å; C1633-A1636 PolarHBondContact O-N 2.97Å; C1633-R1637 WeakPolarHBondContact O-CB 3.22Å; C1633-R1637 PolarHBondContact O-N 2.79Å; C1633-A1737 VanDerWaalsContact SG-C 3.52Å
1634	D	84.4	Confident	86.8	Confident	88 Å²	88	64.3 Å²	64.3	47%	0.471	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-37.7	-179.7	-62.9	-28.1	0	0	0	111.4	K1630 S1638	K1630-D1634 VanDerWaalsContact O-CG 3.29Å; K1630-D1634 PolarHBondContact O-N 3.48Å; D1634-S1638 WeakPolarHBondContact O-CB 3.44Å; D1634-S1638 PolarHBondContact O-N 3.06Å
1635	R	85.9	Confident	86.8	Confident	120 Å²	120	62.3 Å²	62.3	45%	0.453	31%	0.308	S	S	.	.	H	α-helix	trans	-65.5	-52.7	170.9	-75.3	-166.7	-154.4	91	5.1	112.1	Q1631 N1632 C1633 R1637 S1638 D1639	Q1631-R1635 WeakPolarHBondContact O-CG 3.41Å; Q1631-R1635 PolarHBondContact O-N 2.92Å; Q1631-R1635 VanDerWaalsContact O-N 3.1Å; N1632-R1635 PolarHBondContact OD1-NH1 3.37Å; C1633-R1635 VanDerWaalsContact C-N 3.31Å; C1633-R1635 PolarHBondContact O-N 2.88Å; R1635-R1637 PolarHBondContact O-N 2.82Å; R1635-S1638 CarbonylContact O-C 3.59Å; R1635-S1638 WeakPolarHBondContact O-CA 3.46Å; R1635-S1638 VanDerWaalsContact O-CB 3.3Å; R1635-S1638 WeakPolarHBondContact O-CB 3.35Å; R1635-S1638 PolarHBondContact O-N 3.02Å; R1635-D1639 PolarHBondContact O-N 2.86Å
1636	A	86.6	Confident	87	Confident	14 Å²	14	58.3 Å²	58.3	12%	0.116	29%	0.29	C	S	.	.	H	α-helix	trans	-62.1	-31.1	-177.7	0	0	0	0	0	112.7	N1632 C1633 L1640 L1734	N1632-A1636 WeakPolarHBondContact O-CB 3.5Å; N1632-A1636 PolarHBondContact O-N 3Å; C1633-A1636 PolarHBondContact O-N 2.97Å; A1636-L1640 WeakPolarHBondContact O-CB 3.33Å; A1636-L1640 PolarHBondContact O-N 2.92Å; A1636-L1734 HydrophobicContact CB-CB 3.99Å; A1636-L1734 HydrophobicContact CB-CD1 3.96Å; A1636-L1734 HydrophobicContact CB-CG 4.41Å
1637	R	88.3	Confident	87	Confident	62 Å²	62	60.1 Å²	60.1	23%	0.234	30%	0.295	C	S	.	.	H	α-helix	trans	-68.8	-44.1	170.1	177.3	-178.9	-83.4	-139.5	-4.1	111.2	C1633 R1635 D1639 L1640 E1641 L1734 D2376 N2377	C1633-R1637 WeakPolarHBondContact O-CB 3.22Å; C1633-R1637 PolarHBondContact O-N 2.79Å; R1635-R1637 PolarHBondContact O-N 2.82Å; R1637-D1639 VanDerWaalsContact C-N 3.3Å; R1637-D1639 PolarHBondContact O-N 2.8Å; R1637-L1640 WeakPolarHBondContact O-CB 3Å; R1637-L1640 PolarHBondContact O-N 2.68Å; R1637-L1640 VanDerWaalsContact O-N 3.14Å; R1637-E1641 PolarHBondContact O-N 2.85Å; R1637-L1734 HydrophobicContact CB-CD1 3.66Å; R1637-D2376 IonicContact CZ-OD1 2.79Å; R1637-D2376 IonicContact CZ-OD2 2.7Å; R1637-D2376 IonicContact NE-OD1 2.69Å; R1637-D2376 IonicContact NE-OD2 3.55Å; R1637-D2376 PolarHBondContact NE-OD2 2.83Å; R1637-D2376 IonicContact NH2-OD1 3.54Å; R1637-D2376 PolarHBondContact NH2-OD1 2.88Å; R1637-D2376 IonicContact NH2-OD2 2.71Å; R1637-D2376 PolarHBondContact NH2-OD2 2.9Å; R1637-N2377 PolarHBondContact NH1-OD1 2.94Å; R1637-N2377 PolarHBondContact NH2-OD1 2.89Å
1638	S	85.3	Confident	87.1	Confident	55 Å²	55	60.9 Å²	60.9	39%	0.385	29%	0.289	S	S	.	.	H	α-helix	trans	-57.7	-48	174.1	-163.9	0	0	0	0	109.7	D1634 R1635 L1640 E1641 L1642	D1634-S1638 WeakPolarHBondContact O-CB 3.44Å; D1634-S1638 PolarHBondContact O-N 3.06Å; R1635-S1638 CarbonylContact O-C 3.59Å; R1635-S1638 WeakPolarHBondContact O-CA 3.46Å; R1635-S1638 VanDerWaalsContact O-CB 3.3Å; R1635-S1638 WeakPolarHBondContact O-CB 3.35Å; R1635-S1638 PolarHBondContact O-N 3.02Å; S1638-L1640 PolarHBondContact O-N 2.91Å; S1638-E1641 PolarHBondContact O-N 2.86Å; S1638-L1642 WeakPolarHBondContact O-CA 3.36Å; S1638-L1642 WeakPolarHBondContact O-CB 3.46Å; S1638-L1642 WeakPolarHBondContact O-CD1 3.32Å; S1638-L1642 WeakPolarHBondContact O-CG 3.4Å; S1638-L1642 PolarHBondContact O-N 2.91Å; S1638-L1642 WeakPolarHBondContact OG-CD1 3.5Å
1639	D	87.3	Confident	87.1	Confident	64 Å²	64	59.6 Å²	59.6	34%	0.342	28%	0.284	S	S	.	.	H	α-helix	trans	-62.3	-24.5	177.1	-62.9	-32.4	0	0	0	113.1	P1415 R1635 R1637 A1643 L1730	P1415-D1639 WeakPolarHBondContact CD-O 3.37Å; P1415-D1639 WeakPolarHBondContact CG-O 3.12Å; R1635-D1639 PolarHBondContact O-N 2.86Å; R1637-D1639 VanDerWaalsContact C-N 3.3Å; R1637-D1639 PolarHBondContact O-N 2.8Å; D1639-A1643 PolarHBondContact O-N 3.1Å; D1639-L1730 HydrophobicContact CB-CD2 4.08Å; D1639-L1730 WeakPolarHBondContact O-CD1 3.33Å
1640	L	89.8	Confident	86.9	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-76	-51.3	167.6	154.3	68.5	0	0	0	113.5	A1636 R1637 S1638 L1642 A1643 E1644 I2374 D2376	A1636-L1640 WeakPolarHBondContact O-CB 3.33Å; A1636-L1640 PolarHBondContact O-N 2.92Å; R1637-L1640 WeakPolarHBondContact O-CB 3Å; R1637-L1640 PolarHBondContact O-N 2.68Å; R1637-L1640 VanDerWaalsContact O-N 3.14Å; S1638-L1640 PolarHBondContact O-N 2.91Å; L1640-L1642 PolarHBondContact O-N 2.9Å; L1640-A1643 WeakPolarHBondContact O-CA 3.38Å; L1640-A1643 VanDerWaalsContact O-CB 3.26Å; L1640-A1643 WeakPolarHBondContact O-CB 3.35Å; L1640-A1643 PolarHBondContact O-N 2.76Å; L1640-E1644 HydrophobicContact CD1-CG 4.1Å; L1640-E1644 PolarHBondContact O-N 2.71Å; L1640-E1644 VanDerWaalsContact O-N 3.12Å; L1640-I2374 HydrophobicContact CD1-CD1 3.55Å; L1640-I2374 HydrophobicContact CD1-CG1 3.78Å; L1640-I2374 HydrophobicContact CD2-CD1 3.73Å; L1640-I2374 HydrophobicContact CD2-CG1 3.84Å; L1640-I2374 HydrophobicContact CG-CD1 4.21Å; L1640-I2374 HydrophobicContact CG-CG1 4.46Å; L1640-D2376 HydrophobicContact CD2-CB 3.31Å
1641	E	85.2	Confident	86.8	Confident	83 Å²	83	54 Å²	54	39%	0.388	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-31.8	178.6	-69.4	-177.2	169	0	0	109.8	P1413 R1637 S1638 A1643 E1645 N2377	P1413-E1641 WeakPolarHBondContact CG-O 3.45Å; R1637-E1641 PolarHBondContact O-N 2.85Å; S1638-E1641 PolarHBondContact O-N 2.86Å; E1641-A1643 VanDerWaalsContact C-N 3.26Å; E1641-A1643 PolarHBondContact O-N 3.13Å; E1641-E1645 PolarHBondContact O-N 3.28Å; E1641-N2377 PolarHBondContact OE1-ND2 3.22Å
1642	L	88.8	Confident	86.7	Confident	36 Å²	36	55.3 Å²	55.3	19%	0.188	27%	0.268	C	S	.	.	H	α-helix	trans	-55.9	-34	164.2	-64.8	-0.2	0	0	0	112.8	P1413 N1414 P1415 S1638 L1640 N1646	P1413-L1642 VanDerWaalsContact C-CB 3.48Å; P1413-L1642 CarbonylContact C-O 3.55Å; P1413-L1642 HydrophobicContact CB-CB 3.64Å; P1413-L1642 HydrophobicContact CB-CD1 3.13Å; P1413-L1642 HydrophobicContact CB-CD2 4.42Å; P1413-L1642 HydrophobicContact CB-CG 3.69Å; N1414-L1642 WeakPolarHBondContact CA-O 3.37Å; N1414-L1642 VanDerWaalsContact N-CD2 3.29Å; N1414-L1642 PolarHBondContact N-O 2.9Å; N1414-L1642 WeakPolarHBondContact O-CD2 3.4Å; P1415-L1642 VanDerWaalsContact CD-C 3.49Å; P1415-L1642 HydrophobicContact CG-CB 4.49Å; S1638-L1642 WeakPolarHBondContact O-CA 3.36Å; S1638-L1642 WeakPolarHBondContact O-CB 3.46Å; S1638-L1642 WeakPolarHBondContact O-CD1 3.32Å; S1638-L1642 WeakPolarHBondContact O-CG 3.4Å; S1638-L1642 PolarHBondContact O-N 2.91Å; S1638-L1642 WeakPolarHBondContact OG-CD1 3.5Å; L1640-L1642 PolarHBondContact O-N 2.9Å; L1642-N1646 PolarHBondContact O-ND2 3.41Å
1643	A	87.8	Confident	86.6	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-74.6	-69.4	174.4	0	0	0	0	0	110	P1415 E1416 D1639 L1640 E1641 E1645 N1646 I1727 L1730	P1415-A1643 HydrophobicContact CG-CB 4.37Å; E1416-A1643 VanDerWaalsContact CD-C 3.41Å; E1416-A1643 HydrophobicContact CG-CB 3.85Å; D1639-A1643 PolarHBondContact O-N 3.1Å; L1640-A1643 WeakPolarHBondContact O-CA 3.38Å; L1640-A1643 VanDerWaalsContact O-CB 3.26Å; L1640-A1643 WeakPolarHBondContact O-CB 3.35Å; L1640-A1643 PolarHBondContact O-N 2.76Å; E1641-A1643 VanDerWaalsContact C-N 3.26Å; E1641-A1643 PolarHBondContact O-N 3.13Å; A1643-E1645 VanDerWaalsContact C-N 3.26Å; A1643-E1645 PolarHBondContact O-N 3.09Å; A1643-N1646 PolarHBondContact O-N 3.29Å; A1643-N1646 PolarHBondContact O-ND2 3.16Å; A1643-I1727 HydrophobicContact CB-CD1 4.16Å; A1643-I1727 HydrophobicContact CB-CG1 3.41Å; A1643-I1727 VanDerWaalsContact CB-CG1 3.41Å; A1643-L1730 HydrophobicContact CB-CD1 4.25Å
1644	E	89.2	Confident	86.6	Confident	54 Å²	54	57.4 Å²	57.4	25%	0.252	28%	0.276	S	S	.	.	H	α-helix	trans	-55	-29.6	-164.4	-71.8	-173.9	164	0	0	116.4	L1640 N1646 R1647 I1648 I1727	L1640-E1644 HydrophobicContact CD1-CG 4.1Å; L1640-E1644 PolarHBondContact O-N 2.71Å; L1640-E1644 VanDerWaalsContact O-N 3.12Å; E1644-N1646 VanDerWaalsContact C-N 3.27Å; E1644-N1646 PolarHBondContact O-N 3.43Å; E1644-R1647 WeakPolarHBondContact O-CB 3.27Å; E1644-R1647 PolarHBondContact O-N 3.5Å; E1644-I1648 WeakPolarHBondContact O-CG1 3.19Å; E1644-I1648 PolarHBondContact O-N 3.41Å; E1644-I1727 HydrophobicContact CB-CD1 4.46Å; E1644-I1727 HydrophobicContact CG-CD1 3.59Å; E1644-I1727 HydrophobicContact CG-CG1 4.45Å
1645	E	86.9	Confident	86.6	Confident	75 Å²	75	58.9 Å²	58.9	35%	0.35	28%	0.279	S	S	.	.	H	α-helix	trans	-66.6	-24.5	179.5	-82	-132.8	95.9	0	0	114.2	K1412 P1413 E1641 A1643 Q1649	K1412-E1645 WeakPolarHBondContact CE-OE1 3.47Å; K1412-E1645 WeakPolarHBondContact CE-OE2 3.5Å; K1412-E1645 IonicContact NZ-OE1 2.96Å; K1412-E1645 PolarHBondContact NZ-OE1 3.08Å; K1412-E1645 IonicContact NZ-OE2 3.25Å; K1412-E1645 PolarHBondContact NZ-OE2 2.89Å; P1413-E1645 WeakPolarHBondContact CD-OE2 3.33Å; P1413-E1645 HydrophobicContact CG-CB 3.82Å; P1413-E1645 HydrophobicContact CG-CG 3.91Å; P1413-E1645 VanDerWaalsContact CG-OE2 3.28Å; P1413-E1645 WeakPolarHBondContact CG-OE2 3.44Å; E1641-E1645 PolarHBondContact O-N 3.28Å; A1643-E1645 VanDerWaalsContact C-N 3.26Å; A1643-E1645 PolarHBondContact O-N 3.09Å; E1645-Q1649 PolarHBondContact O-N 3.11Å
1646	N	86.6	Confident	86.6	Confident	15 Å²	15	57 Å²	57	8%	0.08	28%	0.28	C	S	.	.	H	α-helix	trans	-82.4	-41	176.5	-58.2	-73	0	0	0	110.7	P1413 N1414 E1416 L1642 A1643 E1644 I1648 Q1649 A1650	P1413-N1646 PolarHBondContact O-ND2 2.91Å; N1414-N1646 PolarHBondContact ND2-ND2 2.91Å; N1414-N1646 VanDerWaalsContact ND2-ND2 3.15Å; N1414-N1646 PolarHBondContact ND2-OD1 3.11Å; E1416-N1646 HydrophobicContact CB-CB 3.65Å; E1416-N1646 VanDerWaalsContact O-CG 3.3Å; E1416-N1646 PolarHBondContact O-ND2 3.46Å; L1642-N1646 PolarHBondContact O-ND2 3.41Å; A1643-N1646 PolarHBondContact O-N 3.29Å; A1643-N1646 PolarHBondContact O-ND2 3.16Å; E1644-N1646 VanDerWaalsContact C-N 3.27Å; E1644-N1646 PolarHBondContact O-N 3.43Å; N1646-I1648 PolarHBondContact O-N 3.34Å; N1646-I1648 VanDerWaalsContact O-N 3.17Å; N1646-Q1649 CarbonylContact O-C 3.49Å; N1646-Q1649 WeakPolarHBondContact O-CA 3.33Å; N1646-Q1649 WeakPolarHBondContact O-CB 3.35Å; N1646-Q1649 PolarHBondContact O-N 3.32Å; N1646-A1650 PolarHBondContact O-N 2.85Å
1647	R	90.4	Very high	86.5	Confident	59 Å²	59	57.3 Å²	57.3	22%	0.223	28%	0.28	C	S	.	.	H	α-helix	trans	-48.7	-42.8	169.6	-144.6	-176.6	59	62.2	8.5	112	E1416 E1644 E1651 L1720 L1723	E1416-R1647 WeakPolarHBondContact OE2-CA 3.45Å; E1416-R1647 VanDerWaalsContact OE2-CB 3.28Å; E1416-R1647 WeakPolarHBondContact OE2-CB 3.47Å; E1416-R1647 PolarHBondContact OE2-N 3.46Å; E1644-R1647 WeakPolarHBondContact O-CB 3.27Å; E1644-R1647 PolarHBondContact O-N 3.5Å; R1647-E1651 IonicContact CZ-OE1 3.5Å; R1647-E1651 IonicContact NH1-OE1 3.35Å; R1647-E1651 PolarHBondContact NH1-OE1 2.96Å; R1647-E1651 IonicContact NH2-OE1 3.39Å; R1647-E1651 WeakPolarHBondContact O-CB 3.07Å; R1647-E1651 PolarHBondContact O-N 3.44Å; R1647-L1720 HydrophobicContact CG-CD2 3.94Å; R1647-L1723 HydrophobicContact CB-CD1 4.22Å; R1647-L1723 HydrophobicContact CG-CB 4.11Å; R1647-L1723 HydrophobicContact CG-CD1 4.18Å
1648	I	85.9	Confident	86.2	Confident	77 Å²	77	57.6 Å²	57.6	40%	0.395	29%	0.286	S	S	.	.	H	α-helix	trans	-68.8	-38	176.4	-66.4	167.8	0	0	0	111.8	E1644 N1646 Q1652	E1644-I1648 WeakPolarHBondContact O-CG1 3.19Å; E1644-I1648 PolarHBondContact O-N 3.41Å; N1646-I1648 PolarHBondContact O-N 3.34Å; N1646-I1648 VanDerWaalsContact O-N 3.17Å; I1648-Q1652 WeakPolarHBondContact O-CB 3.38Å; I1648-Q1652 VanDerWaalsContact O-CG 3.27Å; I1648-Q1652 WeakPolarHBondContact O-CG 3.37Å; I1648-Q1652 PolarHBondContact O-N 2.89Å
1649	Q	85.3	Confident	86.1	Confident	87 Å²	87	59.6 Å²	59.6	41%	0.407	29%	0.292	S	S	.	.	H	α-helix	trans	-68.9	-42.2	173.8	-71.4	-167.8	3.6	0	0	112.6	E1645 N1646 Q1652 Q1653	E1645-Q1649 PolarHBondContact O-N 3.11Å; N1646-Q1649 CarbonylContact O-C 3.49Å; N1646-Q1649 WeakPolarHBondContact O-CA 3.33Å; N1646-Q1649 WeakPolarHBondContact O-CB 3.35Å; N1646-Q1649 PolarHBondContact O-N 3.32Å; Q1649-Q1652 PolarHBondContact O-N 2.78Å; Q1649-Q1653 WeakPolarHBondContact O-CG 3.42Å; Q1649-Q1653 PolarHBondContact O-N 3.27Å
1650	A	85.4	Confident	86	Confident	3 Å²	3	62.1 Å²	62.1	3%	0.025	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-40.2	175.7	0	0	0	0	0	111.7	N1646 Q1653 T1654 L1720 L1723	N1646-A1650 PolarHBondContact O-N 2.85Å; A1650-Q1653 PolarHBondContact O-N 3.42Å; A1650-T1654 VanDerWaalsContact O-CB 3.24Å; A1650-T1654 WeakPolarHBondContact O-CB 3.37Å; A1650-T1654 PolarHBondContact O-N 2.77Å; A1650-T1654 PolarHBondContact O-OG1 3.35Å; A1650-L1720 HydrophobicContact CB-CD2 3.8Å; A1650-L1720 HydrophobicContact CB-CG 3.92Å; A1650-L1723 HydrophobicContact CB-CD1 3.99Å
1651	E	86.7	Confident	85.7	Confident	63 Å²	63	62.8 Å²	62.8	29%	0.294	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-44.1	170.1	-93.3	-160.9	-137.8	0	0	112.3	R1647 T1654 K1655 L1720	R1647-E1651 IonicContact CZ-OE1 3.5Å; R1647-E1651 IonicContact NH1-OE1 3.35Å; R1647-E1651 PolarHBondContact NH1-OE1 2.96Å; R1647-E1651 IonicContact NH2-OE1 3.39Å; R1647-E1651 WeakPolarHBondContact O-CB 3.07Å; R1647-E1651 PolarHBondContact O-N 3.44Å; E1651-T1654 PolarHBondContact O-N 3.13Å; E1651-K1655 WeakPolarHBondContact O-CB 3.11Å; E1651-K1655 WeakPolarHBondContact O-CG 3.18Å; E1651-K1655 PolarHBondContact O-N 2.9Å; E1651-K1655 IonicContact OE2-NZ 3.84Å; E1651-K1655 PolarHBondContact OE2-NZ 3.4Å; E1651-L1720 HydrophobicContact CG-CD2 4.04Å
1652	Q	83.2	Confident	85.3	Confident	119 Å²	119	63 Å²	63	56%	0.556	30%	0.304	S	S	*	.	H	α-helix	trans	-67.2	-43.5	179.5	-76.1	179.2	30	0	0	111.8	I1648 Q1649 K1655 V1656	I1648-Q1652 WeakPolarHBondContact O-CB 3.38Å; I1648-Q1652 VanDerWaalsContact O-CG 3.27Å; I1648-Q1652 WeakPolarHBondContact O-CG 3.37Å; I1648-Q1652 PolarHBondContact O-N 2.89Å; Q1649-Q1652 PolarHBondContact O-N 2.78Å; Q1652-K1655 PolarHBondContact O-N 3.1Å; Q1652-V1656 WeakPolarHBondContact O-CG2 3.44Å; Q1652-V1656 PolarHBondContact O-N 3.1Å
1653	Q	85.2	Confident	84.9	Confident	109 Å²	109	66.3 Å²	66.3	51%	0.509	32%	0.318	S	S	.	.	H	α-helix	trans	-62.5	-43.4	174.1	-70.9	-170.8	55.2	0	0	111.3	Q1649 A1650 K1655 V1656 I1657 L1716	Q1649-Q1653 WeakPolarHBondContact O-CG 3.42Å; Q1649-Q1653 PolarHBondContact O-N 3.27Å; A1650-Q1653 PolarHBondContact O-N 3.42Å; Q1653-K1655 PolarHBondContact O-N 2.86Å; Q1653-V1656 PolarHBondContact O-N 3.07Å; Q1653-V1656 VanDerWaalsContact O-N 3.15Å; Q1653-I1657 WeakPolarHBondContact O-CG1 3.48Å; Q1653-I1657 PolarHBondContact O-N 3.23Å; Q1653-L1716 HydrophobicContact CB-CD2 3.32Å; Q1653-L1716 HydrophobicContact CG-CD2 4.45Å
1654	T	85.1	Confident	84.3	Confident	19 Å²	19	66.4 Å²	66.4	12%	0.117	32%	0.319	C	S	.	.	H	α-helix	trans	-58.1	-44.1	173.5	-61.3	0	0	0	0	111.6	A1650 E1651 V1656 I1657 N1658 L1720	A1650-T1654 VanDerWaalsContact O-CB 3.24Å; A1650-T1654 WeakPolarHBondContact O-CB 3.37Å; A1650-T1654 PolarHBondContact O-N 2.77Å; A1650-T1654 PolarHBondContact O-OG1 3.35Å; E1651-T1654 PolarHBondContact O-N 3.13Å; T1654-V1656 PolarHBondContact O-N 3.3Å; T1654-I1657 PolarHBondContact O-N 2.99Å; T1654-N1658 WeakPolarHBondContact CG2-ND2 3.4Å; T1654-N1658 WeakPolarHBondContact O-CB 3.48Å; T1654-N1658 PolarHBondContact O-N 2.77Å; T1654-N1658 PolarHBondContact O-ND2 3.18Å; T1654-L1720 HydrophobicContact CG2-CD1 4.49Å
1655	K	84.2	Confident	83.8	Confident	120 Å²	120	67.3 Å²	67.3	52%	0.522	32%	0.323	S	S	.	.	H	α-helix	trans	-62.8	-40	174.4	-79.9	161.7	178.6	150.1	0	112.4	E1651 Q1652 Q1653 L1659	E1651-K1655 WeakPolarHBondContact O-CB 3.11Å; E1651-K1655 WeakPolarHBondContact O-CG 3.18Å; E1651-K1655 PolarHBondContact O-N 2.9Å; E1651-K1655 IonicContact OE2-NZ 3.84Å; E1651-K1655 PolarHBondContact OE2-NZ 3.4Å; Q1652-K1655 PolarHBondContact O-N 3.1Å; Q1653-K1655 PolarHBondContact O-N 2.86Å; K1655-L1659 WeakPolarHBondContact O-CB 3.49Å; K1655-L1659 WeakPolarHBondContact O-CG 3.3Å; K1655-L1659 PolarHBondContact O-N 3.42Å
1656	V	85	Confident	83.2	Confident	79 Å²	79	69.2 Å²	69.2	48%	0.479	33%	0.331	S	S	.	.	H	α-helix	trans	-68.6	-39.4	176.3	171	0	0	0	0	112	Q1652 Q1653 T1654 L1659 K1660	Q1652-V1656 WeakPolarHBondContact O-CG2 3.44Å; Q1652-V1656 PolarHBondContact O-N 3.1Å; Q1653-V1656 PolarHBondContact O-N 3.07Å; Q1653-V1656 VanDerWaalsContact O-N 3.15Å; T1654-V1656 PolarHBondContact O-N 3.3Å; V1656-L1659 PolarHBondContact O-N 3.19Å; V1656-K1660 WeakPolarHBondContact O-CG 3.33Å; V1656-K1660 PolarHBondContact O-N 3.15Å
1657	I	85.7	Confident	82.5	Confident	22 Å²	22	74.7 Å²	74.7	11%	0.113	35%	0.35	C	S	.	.	H	α-helix	trans	-66.4	-43.9	175.1	-69.2	170.2	0	0	0	110.3	Q1653 T1654 L1659 K1660 L1661 L1709 A1712 N1713 L1716	Q1653-I1657 WeakPolarHBondContact O-CG1 3.48Å; Q1653-I1657 PolarHBondContact O-N 3.23Å; T1654-I1657 PolarHBondContact O-N 2.99Å; I1657-L1659 PolarHBondContact O-N 2.97Å; I1657-K1660 PolarHBondContact O-N 3.45Å; I1657-L1661 WeakPolarHBondContact O-CB 3.26Å; I1657-L1661 PolarHBondContact O-N 3.11Å; I1657-L1709 HydrophobicContact CG2-CD2 4.43Å; I1657-L1709 WeakPolarHBondContact CG2-O 3.45Å; I1657-A1712 HydrophobicContact CD1-CB 4.08Å; I1657-N1713 HydrophobicContact CG2-CB 3.77Å; I1657-L1716 HydrophobicContact CD1-CD1 4.11Å; I1657-L1716 HydrophobicContact CD1-CD2 4.11Å
1658	N	81.4	Confident	81.6	Confident	68 Å²	68	74.9 Å²	74.9	36%	0.364	35%	0.353	S	S	.	.	H	α-helix	trans	-62.8	-40.3	175.4	-79.4	-69.5	0	0	0	112.5	T1654 K1660 L1661 E1662 N1713	T1654-N1658 WeakPolarHBondContact CG2-ND2 3.4Å; T1654-N1658 WeakPolarHBondContact O-CB 3.48Å; T1654-N1658 PolarHBondContact O-N 2.77Å; T1654-N1658 PolarHBondContact O-ND2 3.18Å; N1658-K1660 PolarHBondContact O-N 2.92Å; N1658-L1661 PolarHBondContact O-N 3.49Å; N1658-E1662 WeakPolarHBondContact O-CB 3.18Å; N1658-E1662 PolarHBondContact O-N 3.42Å; N1658-N1713 PolarHBondContact ND2-OD1 2.84Å; N1658-N1713 PolarHBondContact OD1-ND2 3.4Å
1659	L	84	Confident	80.7	Confident	96 Å²	96	76.5 Å²	76.5	50%	0.503	36%	0.362	S	S	.	.	H	α-helix	trans	-64.9	-37.3	173.5	-79.4	167.3	0	0	0	112.8	K1655 V1656 I1657 Q1663	K1655-L1659 WeakPolarHBondContact O-CB 3.49Å; K1655-L1659 WeakPolarHBondContact O-CG 3.3Å; K1655-L1659 PolarHBondContact O-N 3.42Å; V1656-L1659 PolarHBondContact O-N 3.19Å; I1657-L1659 PolarHBondContact O-N 2.97Å; L1659-Q1663 WeakPolarHBondContact O-CB 3.5Å; L1659-Q1663 VanDerWaalsContact O-CG 3.28Å; L1659-Q1663 WeakPolarHBondContact O-CG 3.42Å; L1659-Q1663 PolarHBondContact O-N 3.34Å
1660	K	83.5	Confident	79.8	Confident	117 Å²	117	77.7 Å²	77.7	51%	0.509	37%	0.371	S	S	.	.	H	α-helix	trans	-66.6	-41.1	171.7	-76.2	-179.9	178.9	-179	0	111.7	V1656 I1657 N1658 Q1663 A1664 L1709	V1656-K1660 WeakPolarHBondContact O-CG 3.33Å; V1656-K1660 PolarHBondContact O-N 3.15Å; I1657-K1660 PolarHBondContact O-N 3.45Å; N1658-K1660 PolarHBondContact O-N 2.92Å; K1660-Q1663 PolarHBondContact O-N 2.78Å; K1660-A1664 WeakPolarHBondContact O-CB 3.43Å; K1660-A1664 PolarHBondContact O-N 3.49Å; K1660-L1709 HydrophobicContact CB-CD1 4Å; K1660-L1709 HydrophobicContact CB-CD2 3.72Å; K1660-L1709 HydrophobicContact CD-CD2 4.01Å
1661	L	83.5	Confident	78.8	Confident	17 Å²	17	80.7 Å²	80.7	9%	0.089	39%	0.386	C	S	.	.	H	α-helix	trans	-63.3	-47.3	177.7	-172.6	70.6	0	0	0	110.6	I1657 N1658 Q1663 A1664 E1665 L1706 L1709 R1710	I1657-L1661 WeakPolarHBondContact O-CB 3.26Å; I1657-L1661 PolarHBondContact O-N 3.11Å; N1658-L1661 PolarHBondContact O-N 3.49Å; L1661-Q1663 VanDerWaalsContact C-N 3.31Å; L1661-Q1663 PolarHBondContact O-N 3.16Å; L1661-A1664 PolarHBondContact O-N 2.82Å; L1661-E1665 WeakPolarHBondContact O-CB 3.29Å; L1661-E1665 WeakPolarHBondContact O-CG 3.45Å; L1661-E1665 PolarHBondContact O-N 3.08Å; L1661-L1706 HydrophobicContact CD1-CD2 4.04Å; L1661-L1706 HydrophobicContact CD1-CG 4.36Å; L1661-L1709 HydrophobicContact CD1-CB 3.88Å; L1661-R1710 HydrophobicContact CD1-CG 3.63Å; L1661-R1710 HydrophobicContact CD2-CG 4.3Å
1662	E	78.3	Confident	77.4	Confident	88 Å²	88	79.6 Å²	79.6	41%	0.411	38%	0.382	S	S	.	.	H	α-helix	trans	-62.9	-36.3	176.3	-160.3	-154	157.7	0	0	111.7	N1658 K1666	N1658-E1662 WeakPolarHBondContact O-CB 3.18Å; N1658-E1662 PolarHBondContact O-N 3.42Å; E1662-K1666 HydrophobicContact CG-CD 4.47Å; E1662-K1666 WeakPolarHBondContact O-CB 3.17Å; E1662-K1666 WeakPolarHBondContact O-CG 3.17Å; E1662-K1666 PolarHBondContact O-N 2.82Å; E1662-K1666 VanDerWaalsContact OE1-CE 3.29Å; E1662-K1666 WeakPolarHBondContact OE1-CE 3.48Å; E1662-K1666 IonicContact OE1-NZ 2.62Å; E1662-K1666 PolarHBondContact OE1-NZ 2.94Å
1663	Q	78.8	Confident	76.1	Confident	105 Å²	105	79.2 Å²	79.2	49%	0.491	38%	0.38	S	S	.	.	H	α-helix	trans	-70.2	-38.7	173	-75.6	-178.3	26.2	0	0	112.9	L1659 K1660 L1661 R1667	L1659-Q1663 WeakPolarHBondContact O-CB 3.5Å; L1659-Q1663 VanDerWaalsContact O-CG 3.28Å; L1659-Q1663 WeakPolarHBondContact O-CG 3.42Å; L1659-Q1663 PolarHBondContact O-N 3.34Å; K1660-Q1663 PolarHBondContact O-N 2.78Å; L1661-Q1663 VanDerWaalsContact C-N 3.31Å; L1661-Q1663 PolarHBondContact O-N 3.16Å; Q1663-R1667 WeakPolarHBondContact O-CB 3.31Å; Q1663-R1667 VanDerWaalsContact O-CG 3.24Å; Q1663-R1667 WeakPolarHBondContact O-CG 3.47Å; Q1663-R1667 PolarHBondContact O-N 2.84Å
1664	A	76.3	Confident	74.7	Confident	2 Å²	2	77.2 Å²	77.2	2%	0.017	38%	0.379	C	S	.	.	H	α-helix	trans	-67.3	-43.6	175.3	0	0	0	0	0	111	K1660 L1661 R1667 H1668 L1706 L1709	K1660-A1664 WeakPolarHBondContact O-CB 3.43Å; K1660-A1664 PolarHBondContact O-N 3.49Å; L1661-A1664 PolarHBondContact O-N 2.82Å; A1664-R1667 PolarHBondContact O-N 3.18Å; A1664-H1668 WeakPolarHBondContact O-CB 3.49Å; A1664-H1668 PolarHBondContact O-N 3.46Å; A1664-L1706 HydrophobicContact CB-CD1 4.49Å; A1664-L1706 HydrophobicContact CB-CG 4.26Å; A1664-L1709 HydrophobicContact CB-CD1 4Å
1665	E	77.5	Confident	73.1	Confident	73 Å²	73	80 Å²	80	34%	0.341	39%	0.392	S	S	.	.	H	α-helix	trans	-65.3	-41.8	174.6	-73.3	-179.6	172.3	0	0	111.4	L1661 H1668 L1669 L1706 R1710	L1661-E1665 WeakPolarHBondContact O-CB 3.29Å; L1661-E1665 WeakPolarHBondContact O-CG 3.45Å; L1661-E1665 PolarHBondContact O-N 3.08Å; E1665-H1668 PolarHBondContact O-N 3.49Å; E1665-L1669 VanDerWaalsContact O-CB 3.32Å; E1665-L1669 WeakPolarHBondContact O-CB 3.35Å; E1665-L1669 PolarHBondContact O-N 3.24Å; E1665-L1706 HydrophobicContact CG-CD1 3.91Å; E1665-L1706 HydrophobicContact CG-CD2 4.2Å; E1665-L1706 HydrophobicContact CG-CG 4.21Å; E1665-R1710 IonicContact OE1-CZ 3.09Å; E1665-R1710 IonicContact OE1-NE 2.68Å; E1665-R1710 PolarHBondContact OE1-NE 3.03Å; E1665-R1710 IonicContact OE1-NH2 2.61Å; E1665-R1710 PolarHBondContact OE1-NH2 3.16Å
1666	K	75.3	Confident	71.2	Confident	116 Å²	116	80 Å²	80	50%	0.504	39%	0.392	S	S	.	.	H	α-helix	trans	-64.2	-38	171.5	-83.7	171.9	169.1	166.5	0	113.1	E1662 L1669 L1670	E1662-K1666 HydrophobicContact CG-CD 4.47Å; E1662-K1666 WeakPolarHBondContact O-CB 3.17Å; E1662-K1666 WeakPolarHBondContact O-CG 3.17Å; E1662-K1666 PolarHBondContact O-N 2.82Å; E1662-K1666 VanDerWaalsContact OE1-CE 3.29Å; E1662-K1666 WeakPolarHBondContact OE1-CE 3.48Å; E1662-K1666 IonicContact OE1-NZ 2.62Å; E1662-K1666 PolarHBondContact OE1-NZ 2.94Å; K1666-L1669 PolarHBondContact O-N 3.17Å; K1666-L1670 WeakPolarHBondContact O-CB 3.17Å; K1666-L1670 PolarHBondContact O-N 3.07Å
1667	R	72.2	Confident	69.3	Low	129 Å²	129	82.7 Å²	82.7	49%	0.487	40%	0.404	S	S	.	.	H	α-helix	trans	-64.3	-43.9	172.5	-78.1	172.2	-176.4	168.2	4.5	111.3	Q1663 A1664 L1669 L1670 L1671 L1702	Q1663-R1667 WeakPolarHBondContact O-CB 3.31Å; Q1663-R1667 VanDerWaalsContact O-CG 3.24Å; Q1663-R1667 WeakPolarHBondContact O-CG 3.47Å; Q1663-R1667 PolarHBondContact O-N 2.84Å; A1664-R1667 PolarHBondContact O-N 3.18Å; R1667-L1669 VanDerWaalsContact C-N 3.33Å; R1667-L1670 PolarHBondContact O-N 3.45Å; R1667-L1671 WeakPolarHBondContact O-CB 3.44Å; R1667-L1671 PolarHBondContact O-N 3.01Å; R1667-L1702 HydrophobicContact CB-CD2 4.08Å
1668	H	70.7	Confident	67.4	Low	63 Å²	63	85.9 Å²	85.9	29%	0.292	43%	0.433	S	S	.	.	H	α-helix	trans	-63.3	-39.4	175.7	-168.2	-67.2	0	0	0	111.4	A1664 E1665 L1671 L1672 L1706	A1664-H1668 WeakPolarHBondContact O-CB 3.49Å; A1664-H1668 PolarHBondContact O-N 3.46Å; E1665-H1668 PolarHBondContact O-N 3.49Å; H1668-L1671 PolarHBondContact O-N 3.25Å; H1668-L1672 WeakPolarHBondContact ND1-CD1 3.37Å; H1668-L1672 WeakPolarHBondContact O-CB 3.27Å; H1668-L1672 VanDerWaalsContact O-CG 3.27Å; H1668-L1672 WeakPolarHBondContact O-CG 3.48Å; H1668-L1672 PolarHBondContact O-N 3.37Å; H1668-L1706 HydrophobicContact CB-CD1 4.19Å
1669	L	67.9	Low	65.4	Low	111 Å²	111	85.4 Å²	85.4	58%	0.581	44%	0.436	S	S	*	.	H	α-helix	trans	-68.6	-42.7	176.2	-155.2	79.3	0	0	0	112.1	E1665 K1666 R1667 L1671 L1672 E1673	E1665-L1669 VanDerWaalsContact O-CB 3.32Å; E1665-L1669 WeakPolarHBondContact O-CB 3.35Å; E1665-L1669 PolarHBondContact O-N 3.24Å; K1666-L1669 PolarHBondContact O-N 3.17Å; R1667-L1669 VanDerWaalsContact C-N 3.33Å; L1669-L1671 VanDerWaalsContact C-N 3.33Å; L1669-L1672 WeakPolarHBondContact O-CB 3.35Å; L1669-L1672 PolarHBondContact O-N 3.03Å; L1669-E1673 VanDerWaalsContact O-CB 3.28Å; L1669-E1673 WeakPolarHBondContact O-CB 3.4Å; L1669-E1673 PolarHBondContact O-N 2.98Å
1670	L	65.3	Low	63.1	Low	112 Å²	112	84.7 Å²	84.7	59%	0.586	45%	0.452	S	S	*	.	H	α-helix	trans	-64.9	-35.1	172.8	-93.3	157.1	0	0	0	112.3	K1666 R1667 E1673 S1674	K1666-L1670 WeakPolarHBondContact O-CB 3.17Å; K1666-L1670 PolarHBondContact O-N 3.07Å; R1667-L1670 PolarHBondContact O-N 3.45Å; L1670-E1673 PolarHBondContact O-N 3.09Å; L1670-S1674 VanDerWaalsContact O-CB 3.29Å; L1670-S1674 WeakPolarHBondContact O-CB 3.5Å; L1670-S1674 PolarHBondContact O-N 3.11Å; L1670-S1674 PolarHBondContact O-OG 3.09Å
1671	L	64.2	Low	60.8	Low	66 Å²	66	87.6 Å²	87.6	35%	0.346	47%	0.467	S	S	.	.	H	α-helix	trans	-64.3	-50.4	173.4	-155.6	84	0	0	0	110	R1667 H1668 L1669 E1673 S1674 L1675 P1699	R1667-L1671 WeakPolarHBondContact O-CB 3.44Å; R1667-L1671 PolarHBondContact O-N 3.01Å; H1668-L1671 PolarHBondContact O-N 3.25Å; L1669-L1671 VanDerWaalsContact C-N 3.33Å; L1671-E1673 VanDerWaalsContact C-N 3.31Å; L1671-E1673 PolarHBondContact O-N 3.08Å; L1671-S1674 PolarHBondContact O-N 3.25Å; L1671-S1674 PolarHBondContact O-OG 3.25Å; L1671-L1675 WeakPolarHBondContact O-CG 3.41Å; L1671-L1675 PolarHBondContact O-N 3.26Å; L1671-P1699 HydrophobicContact CD2-CG 4.27Å
1672	L	59	Low	58.5	Low	41 Å²	41	94.4 Å²	94.4	22%	0.215	50%	0.503	C	S	.	.	H	α-helix	trans	-55	-43.7	173.5	-75.4	166.9	0	0	0	112.3	H1668 L1669 L1675 K1676 Y1691	H1668-L1672 WeakPolarHBondContact ND1-CD1 3.37Å; H1668-L1672 WeakPolarHBondContact O-CB 3.27Å; H1668-L1672 VanDerWaalsContact O-CG 3.27Å; H1668-L1672 WeakPolarHBondContact O-CG 3.48Å; H1668-L1672 PolarHBondContact O-N 3.37Å; L1669-L1672 WeakPolarHBondContact O-CB 3.35Å; L1669-L1672 PolarHBondContact O-N 3.03Å; L1672-L1675 PolarHBondContact O-N 3.2Å; L1672-K1676 VanDerWaalsContact O-CB 3.29Å; L1672-K1676 WeakPolarHBondContact O-CB 3.31Å; L1672-K1676 PolarHBondContact O-N 2.94Å; L1672-Y1691 HydrophobicContact CD2-CD1 3.9Å; L1672-Y1691 HydrophobicContact CD2-CE1 3.3Å; L1672-Y1691 HydrophobicContact CD2-CE2 4.15Å; L1672-Y1691 VanDerWaalsContact CD2-CZ 3.45Å
1673	E	54.7	Low	56.3	Low	110 Å²	110	97.4 Å²	97.4	51%	0.514	52%	0.521	S	S	.	.	H	α-helix	trans	-72.4	-34.9	-179.1	-168.8	163.5	-122.9	0	0	112.2	L1669 L1670 L1671 K1676 N1677	L1669-E1673 VanDerWaalsContact O-CB 3.28Å; L1669-E1673 WeakPolarHBondContact O-CB 3.4Å; L1669-E1673 PolarHBondContact O-N 2.98Å; L1670-E1673 PolarHBondContact O-N 3.09Å; L1671-E1673 VanDerWaalsContact C-N 3.31Å; L1671-E1673 PolarHBondContact O-N 3.08Å; E1673-K1676 PolarHBondContact O-N 2.83Å; E1673-N1677 WeakPolarHBondContact O-CB 3.4Å; E1673-N1677 PolarHBondContact O-N 2.9Å; E1673-N1677 PolarHBondContact O-ND2 3.09Å
1674	S	56.5	Low	54.1	Low	68 Å²	68	100.2 Å²	100.2	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-68	-36.8	172.2	73.2	0	0	0	0	112.6	L1670 L1671 A1678	L1670-S1674 VanDerWaalsContact O-CB 3.29Å; L1670-S1674 WeakPolarHBondContact O-CB 3.5Å; L1670-S1674 PolarHBondContact O-N 3.11Å; L1670-S1674 PolarHBondContact O-OG 3.09Å; L1671-S1674 PolarHBondContact O-N 3.25Å; L1671-S1674 PolarHBondContact O-OG 3.25Å; S1674-A1678 PolarHBondContact O-N 3.44Å
1675	L	50.6	Low	52.1	Low	76 Å²	76	106.1 Å²	106.1	40%	0.398	57%	0.565	S	S	.	*	H	α-helix	trans	-66.9	-43.9	171.4	-71.3	165.8	0	0	0	111	L1671 L1672 N1677 A1678 S1679	L1671-L1675 WeakPolarHBondContact O-CG 3.41Å; L1671-L1675 PolarHBondContact O-N 3.26Å; L1672-L1675 PolarHBondContact O-N 3.2Å; L1675-N1677 VanDerWaalsContact C-N 3.28Å; L1675-N1677 PolarHBondContact O-N 2.72Å; L1675-A1678 WeakPolarHBondContact O-CB 3.39Å; L1675-A1678 PolarHBondContact O-N 2.97Å; L1675-S1679 PolarHBondContact O-N 2.87Å; L1675-S1679 PolarHBondContact O-OG 3.22Å
1676	K	45	Very low	49.8	Very low	120 Å²	120	109.8 Å²	109.8	52%	0.522	59%	0.587	S	S	.	*	H	α-helix	trans	-59.7	-37.7	176.8	-165.1	177.8	-175.5	-175.2	0	112.2	L1672 E1673 A1678 S1679	L1672-K1676 VanDerWaalsContact O-CB 3.29Å; L1672-K1676 WeakPolarHBondContact O-CB 3.31Å; L1672-K1676 PolarHBondContact O-N 2.94Å; E1673-K1676 PolarHBondContact O-N 2.83Å; K1676-A1678 VanDerWaalsContact C-N 3.29Å; K1676-A1678 PolarHBondContact O-N 3.43Å; K1676-S1679 CarbonylContact O-C 3.44Å; K1676-S1679 PolarHBondContact O-N 3.11Å
1677	N	46	Very low	47.7	Very low	137 Å²	137	109.5 Å²	109.5	73%	0.733	60%	0.595	S	S	*	*	H	α-helix	trans	-73	-15.3	174.6	-75.4	-50	0	0	0	114.1	E1673 L1675	E1673-N1677 WeakPolarHBondContact O-CB 3.4Å; E1673-N1677 PolarHBondContact O-N 2.9Å; E1673-N1677 PolarHBondContact O-ND2 3.09Å; L1675-N1677 VanDerWaalsContact C-N 3.28Å; L1675-N1677 PolarHBondContact O-N 2.72Å
1678	A	45.5	Very low	45.8	Very low	88 Å²	88	110.6 Å²	110.6	73%	0.727	62%	0.616	S	S	*	*	H	α-helix	trans	-86	-18.4	173	0	0	0	0	0	113.3	S1674 L1675 K1676	S1674-A1678 PolarHBondContact O-N 3.44Å; L1675-A1678 WeakPolarHBondContact O-CB 3.39Å; L1675-A1678 PolarHBondContact O-N 2.97Å; K1676-A1678 VanDerWaalsContact C-N 3.29Å; K1676-A1678 PolarHBondContact O-N 3.43Å
1679	S	38.6	Very low	44.1	Very low	59 Å²	59	111.2 Å²	111.2	41%	0.413	63%	0.632	S	S	.	*	S	Bend	trans	-127.5	88.6	-178.4	63.2	0	0	0	0	111.7	L1675 K1676 Q1681	L1675-S1679 PolarHBondContact O-N 2.87Å; L1675-S1679 PolarHBondContact O-OG 3.22Å; K1676-S1679 CarbonylContact O-C 3.44Å; K1676-S1679 PolarHBondContact O-N 3.11Å; S1679-Q1681 PolarHBondContact O-N 3.01Å
1680	G	36	Very low	42.5	Very low	81 Å²	81	113.2 Å²	113.2	84%	0.835	64%	0.639	S	S	*	*			trans	-69.4	95.2	-175.2	0	0	0	0	0	114.7
1681	Q	34.3	Very low	41.3	Very low	178 Å²	178	114.4 Å²	114.4	83%	0.832	64%	0.636	S	S	*	*			trans	-155.1	135.7	161.7	-110.1	171.1	19.4	0	0	111.4	S1679	S1679-Q1681 PolarHBondContact O-N 3.01Å
1682	D	35.9	Very low	40.2	Very low	159 Å²	159	117.3 Å²	117.3	85%	0.85	66%	0.657	S	S	*	*			trans	-91.2	125.6	-178	-68.9	-59.9	0	0	0	112.8
1683	I	32.3	Very low	39.4	Very low	151 Å²	151	122.3 Å²	122.3	77%	0.774	68%	0.683	S	S	*	*			trans	-139.1	139.9	162.7	-57.9	-177	0	0	0	109.4
1684	H	33.3	Very low	38.4	Very low	164 Å²	164	123.5 Å²	123.5	76%	0.759	69%	0.691	S	S	*	*			trans	-98.3	147.4	178.5	-120.5	-63.3	0	0	0	111.6
1685	N	34.3	Very low	37.7	Very low	127 Å²	127	126.2 Å²	126.2	68%	0.679	69%	0.692	S	S	*	*			trans	39.8	98.6	155.7	-58.5	6.8	0	0	0	118.7
1686	N	27.5	Very low	37.4	Very low	149 Å²	149	128.3 Å²	128.3	80%	0.797	71%	0.71	S	S	*	*				179.5	160.1	114.3	-91.9	-23.1	0	0	0	113.8
1687	T	31	Very low	37.2	Very low	110 Å²	110	130 Å²	130	68%	0.675	73%	0.725	S	S	*	*			trans	46.8	116	156.7	46.7	0	0	0	0	120	A1689	T1687-A1689 PolarHBondContact O-N 2.78Å
1688	T	33	Very low	37	Very low	152 Å²	152	126.6 Å²	126.6	93%	0.933	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	21.6	177.3	40.4	0	0	0	0	116.3
1689	A	35.2	Very low	37.2	Very low	77 Å²	77	125.9 Å²	125.9	64%	0.636	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-25.4	-168.4	0	0	0	0	0	115.8	T1687	T1687-A1689 PolarHBondContact O-N 2.78Å
1690	E	34.6	Very low	38	Very low	152 Å²	152	130.6 Å²	130.6	71%	0.71	72%	0.719	S	S	*	*	S	Bend	trans	-95.3	-6.4	-169.9	-66.6	-169.7	127.7	0	0	115.1	T1692 I1693	E1690-T1692 PolarHBondContact O-N 3.37Å; E1690-T1692 VanDerWaalsContact O-N 3.16Å; E1690-I1693 PolarHBondContact O-N 2.82Å
1691	Y	38.8	Very low	39.3	Very low	137 Å²	137	131.3 Å²	131.3	54%	0.537	71%	0.709	S	S	.	*	G	3₁₀ helix	trans	-65.3	-22.9	-172.6	-118.1	-81.9	0	0	0	114.6	L1672 I1693	L1672-Y1691 HydrophobicContact CD2-CD1 3.9Å; L1672-Y1691 HydrophobicContact CD2-CE1 3.3Å; L1672-Y1691 HydrophobicContact CD2-CE2 4.15Å; L1672-Y1691 VanDerWaalsContact CD2-CZ 3.45Å; Y1691-I1693 VanDerWaalsContact C-N 3.28Å; Y1691-I1693 PolarHBondContact O-N 3.5Å
1692	T	41.4	Very low	40.4	Very low	127 Å²	127	124.7 Å²	124.7	78%	0.779	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-75.9	-8.6	-173.2	-33.9	0	0	0	0	114.3	E1690	E1690-T1692 PolarHBondContact O-N 3.37Å; E1690-T1692 VanDerWaalsContact O-N 3.16Å
1693	I	42.7	Very low	41.9	Very low	147 Å²	147	121.7 Å²	121.7	75%	0.754	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-105.3	-18.1	-168.9	-63.8	179	0	0	0	113.4	E1690 Y1691	E1690-I1693 PolarHBondContact O-N 2.82Å; Y1691-I1693 VanDerWaalsContact C-N 3.28Å; Y1691-I1693 PolarHBondContact O-N 3.5Å
1694	L	33.9	Very low	43.8	Very low	134 Å²	134	117.8 Å²	117.8	70%	0.702	65%	0.646	S	S	*	*	S	Bend	trans	-107.4	-8.8	-169.5	-70.2	172.4	0	0	0	116.1
1695	Y	41.2	Very low	45.8	Very low	126 Å²	126	113.9 Å²	113.9	49%	0.494	63%	0.628	S	S	.	*			trans	-135.9	98.2	-179.4	-72.3	-79	0	0	0	112
1696	P	44.1	Very low	47.8	Very low	119 Å²	119	108.2 Å²	108.2	77%	0.773	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-30	179.9	-21.1	34.2	0	0	0	114.6	A1698	P1696-A1698 PolarHBondContact O-N 2.91Å
1697	D	41.3	Very low	50.2	Low	157 Å²	157	105.5 Å²	105.5	84%	0.84	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	32.7	-168.7	-59	-58.2	0	0	0	113.6
1698	A	41.3	Very low	52.5	Low	65 Å²	65	106.2 Å²	106.2	54%	0.537	58%	0.579	S	S	.	*			trans	-72.8	137	170.6	0	0	0	0	0	110.3	P1696 E1700	P1696-A1698 PolarHBondContact O-N 2.91Å; A1698-E1700 PolarHBondContact O-N 2.99Å; A1698-E1700 VanDerWaalsContact O-N 3.08Å
1699	P	51.2	Low	54.9	Low	72 Å²	72	100 Å²	100	47%	0.468	54%	0.54	S	S	.	.			trans	-72	107.1	-174.2	27.9	-34.4	0	0	0	111.9	L1671 P1701 L1702	L1671-P1699 HydrophobicContact CD2-CG 4.27Å; P1699-P1701 VanDerWaalsContact C-N 3.34Å; P1699-P1701 WeakPolarHBondContact O-CD 3.23Å; P1699-P1701 VanDerWaalsContact O-N 3.1Å; P1699-L1702 PolarHBondContact O-N 3.11Å
1700	E	55.2	Low	57.2	Low	158 Å²	158	102.2 Å²	102.2	74%	0.738	53%	0.532	S	S	*	.	H	α-helix	trans	-41.2	-45	-179.1	-72.8	-167.2	127.9	0	0	116.2	A1698 L1702 L1703 T1704	A1698-E1700 PolarHBondContact O-N 2.99Å; A1698-E1700 VanDerWaalsContact O-N 3.08Å; E1700-L1702 PolarHBondContact O-N 3.27Å; E1700-L1703 PolarHBondContact O-N 2.83Å; E1700-T1704 PolarHBondContact O-N 2.87Å; E1700-T1704 VanDerWaalsContact O-N 3.16Å; E1700-T1704 PolarHBondContact O-OG1 2.86Å
1701	P	62.2	Low	59.6	Low	96 Å²	96	98.2 Å²	98.2	62%	0.623	52%	0.521	S	S	*	.	H	α-helix	trans	-55.2	-34.9	-168.1	-29.8	37	0	0	0	114.9	P1699 E1705	P1699-P1701 VanDerWaalsContact C-N 3.34Å; P1699-P1701 WeakPolarHBondContact O-CD 3.23Å; P1699-P1701 VanDerWaalsContact O-N 3.1Å; P1701-E1705 VanDerWaalsContact O-CB 3.32Å; P1701-E1705 WeakPolarHBondContact O-CB 3.28Å; P1701-E1705 PolarHBondContact O-N 3.38Å
1702	L	58.4	Low	61.7	Low	39 Å²	39	93.3 Å²	93.3	20%	0.204	51%	0.508	C	S	.	.	H	α-helix	trans	-70.5	-32.1	-179.3	-102.7	165.6	0	0	0	113	R1667 P1699 E1700 L1706	R1667-L1702 HydrophobicContact CB-CD2 4.08Å; P1699-L1702 PolarHBondContact O-N 3.11Å; E1700-L1702 PolarHBondContact O-N 3.27Å; L1702-L1706 WeakPolarHBondContact O-CB 3.39Å; L1702-L1706 PolarHBondContact O-N 2.82Å
1703	L	65.9	Low	63.8	Low	96 Å²	96	88.3 Å²	88.3	50%	0.503	48%	0.477	S	S	.	.	H	α-helix	trans	-80.2	-34.5	178	-167.4	66.5	0	0	0	111.1	E1700 N1707	E1700-L1703 PolarHBondContact O-N 2.83Å; L1703-N1707 PolarHBondContact O-N 3.07Å; L1703-N1707 VanDerWaalsContact O-N 3.14Å; L1703-N1707 PolarHBondContact O-ND2 2.86Å
1704	T	73.1	Confident	65.8	Low	70 Å²	70	88.1 Å²	88.1	43%	0.429	47%	0.473	S	S	.	.	H	α-helix	trans	-65.2	-45.6	172.4	-42	0	0	0	0	111.5	E1700 L1706 N1707 Q1708	E1700-T1704 PolarHBondContact O-N 2.87Å; E1700-T1704 VanDerWaalsContact O-N 3.16Å; E1700-T1704 PolarHBondContact O-OG1 2.86Å; T1704-L1706 PolarHBondContact O-N 2.99Å; T1704-N1707 PolarHBondContact O-N 3.11Å; T1704-Q1708 WeakPolarHBondContact O-CG 3.36Å; T1704-Q1708 PolarHBondContact O-N 2.76Å
1705	E	74.5	Confident	68.4	Low	81 Å²	81	84.8 Å²	84.8	38%	0.379	46%	0.455	S	S	.	.	H	α-helix	trans	-58	-46.2	176.3	-176.6	177	-153.6	0	0	111.3	P1701 N1707 Q1708 L1709	P1701-E1705 VanDerWaalsContact O-CB 3.32Å; P1701-E1705 WeakPolarHBondContact O-CB 3.28Å; P1701-E1705 PolarHBondContact O-N 3.38Å; E1705-N1707 PolarHBondContact O-N 3.12Å; E1705-Q1708 PolarHBondContact O-N 2.83Å; E1705-L1709 HydrophobicContact CG-CD1 4.04Å; E1705-L1709 WeakPolarHBondContact O-CB 3.19Å; E1705-L1709 VanDerWaalsContact O-CG 3.3Å; E1705-L1709 WeakPolarHBondContact O-CG 3.3Å; E1705-L1709 PolarHBondContact O-N 3.12Å
1706	L	77.5	Confident	70.5	Confident	9 Å²	9	79.4 Å²	79.4	5%	0.047	44%	0.435	C	S	.	.	H	α-helix	trans	-65.9	-40.1	-178.6	-153.4	161.8	0	0	0	112.2	L1661 A1664 E1665 H1668 L1702 T1704 L1709 R1710	L1661-L1706 HydrophobicContact CD1-CD2 4.04Å; L1661-L1706 HydrophobicContact CD1-CG 4.36Å; A1664-L1706 HydrophobicContact CB-CD1 4.49Å; A1664-L1706 HydrophobicContact CB-CG 4.26Å; E1665-L1706 HydrophobicContact CG-CD1 3.91Å; E1665-L1706 HydrophobicContact CG-CD2 4.2Å; E1665-L1706 HydrophobicContact CG-CG 4.21Å; H1668-L1706 HydrophobicContact CB-CD1 4.19Å; L1702-L1706 WeakPolarHBondContact O-CB 3.39Å; L1702-L1706 PolarHBondContact O-N 2.82Å; T1704-L1706 PolarHBondContact O-N 2.99Å; L1706-L1709 PolarHBondContact O-N 3.19Å; L1706-R1710 HydrophobicContact CD2-CG 4.38Å; L1706-R1710 WeakPolarHBondContact O-CG 3.2Å; L1706-R1710 PolarHBondContact O-N 2.83Å; L1706-R1710 VanDerWaalsContact O-N 3.11Å
1707	N	77.3	Confident	72.4	Confident	91 Å²	91	77.1 Å²	77.1	49%	0.487	42%	0.419	S	S	.	.	H	α-helix	trans	-68.6	-40	176	-75.2	-31.6	0	0	0	112.8	L1703 T1704 E1705 L1709 R1710 S1711	L1703-N1707 PolarHBondContact O-N 3.07Å; L1703-N1707 VanDerWaalsContact O-N 3.14Å; L1703-N1707 PolarHBondContact O-ND2 2.86Å; T1704-N1707 PolarHBondContact O-N 3.11Å; E1705-N1707 PolarHBondContact O-N 3.12Å; N1707-L1709 VanDerWaalsContact C-N 3.35Å; N1707-R1710 PolarHBondContact O-N 3.29Å; N1707-S1711 PolarHBondContact O-N 3.31Å; N1707-S1711 VanDerWaalsContact O-N 3.16Å
1708	Q	79.8	Confident	74.6	Confident	126 Å²	126	74.3 Å²	74.3	59%	0.589	40%	0.403	S	S	*	.	H	α-helix	trans	-64	-38.7	174.3	-73.5	177.2	-6.4	0	0	112.2	T1704 E1705 R1710 S1711 A1712	T1704-Q1708 WeakPolarHBondContact O-CG 3.36Å; T1704-Q1708 PolarHBondContact O-N 2.76Å; E1705-Q1708 PolarHBondContact O-N 2.83Å; Q1708-R1710 VanDerWaalsContact C-N 3.33Å; Q1708-R1710 PolarHBondContact O-N 3.11Å; Q1708-S1711 PolarHBondContact O-OG 3.48Å; Q1708-A1712 WeakPolarHBondContact O-CB 3.4Å; Q1708-A1712 PolarHBondContact O-N 3.24Å
1709	L	83.4	Confident	76.9	Confident	21 Å²	21	72.8 Å²	72.8	11%	0.11	39%	0.385	C	S	.	.	H	α-helix	trans	-65.1	-35.3	175	-73.5	167.7	0	0	0	112.1	I1657 K1660 L1661 A1664 E1705 L1706 N1707 N1713	I1657-L1709 HydrophobicContact CG2-CD2 4.43Å; I1657-L1709 WeakPolarHBondContact CG2-O 3.45Å; K1660-L1709 HydrophobicContact CB-CD1 4Å; K1660-L1709 HydrophobicContact CB-CD2 3.72Å; K1660-L1709 HydrophobicContact CD-CD2 4.01Å; L1661-L1709 HydrophobicContact CD1-CB 3.88Å; A1664-L1709 HydrophobicContact CB-CD1 4Å; E1705-L1709 HydrophobicContact CG-CD1 4.04Å; E1705-L1709 WeakPolarHBondContact O-CB 3.19Å; E1705-L1709 VanDerWaalsContact O-CG 3.3Å; E1705-L1709 WeakPolarHBondContact O-CG 3.3Å; E1705-L1709 PolarHBondContact O-N 3.12Å; L1706-L1709 PolarHBondContact O-N 3.19Å; N1707-L1709 VanDerWaalsContact C-N 3.35Å; L1709-N1713 WeakPolarHBondContact O-CB 3.38Å; L1709-N1713 PolarHBondContact O-N 3.26Å
1710	R	84.1	Confident	78.7	Confident	123 Å²	123	70.7 Å²	70.7	46%	0.464	37%	0.37	S	S	.	.	H	α-helix	trans	-69.4	-43.6	176.7	-74.5	-176.4	175.9	170.2	-0.8	113.3	L1661 E1665 L1706 N1707 Q1708 N1713 Q1714	L1661-R1710 HydrophobicContact CD1-CG 3.63Å; L1661-R1710 HydrophobicContact CD2-CG 4.3Å; E1665-R1710 IonicContact OE1-CZ 3.09Å; E1665-R1710 IonicContact OE1-NE 2.68Å; E1665-R1710 PolarHBondContact OE1-NE 3.03Å; E1665-R1710 IonicContact OE1-NH2 2.61Å; E1665-R1710 PolarHBondContact OE1-NH2 3.16Å; L1706-R1710 HydrophobicContact CD2-CG 4.38Å; L1706-R1710 WeakPolarHBondContact O-CG 3.2Å; L1706-R1710 PolarHBondContact O-N 2.83Å; L1706-R1710 VanDerWaalsContact O-N 3.11Å; N1707-R1710 PolarHBondContact O-N 3.29Å; Q1708-R1710 VanDerWaalsContact C-N 3.33Å; Q1708-R1710 PolarHBondContact O-N 3.11Å; R1710-N1713 PolarHBondContact O-N 2.93Å; R1710-Q1714 PolarHBondContact O-N 3.12Å
1711	S	84	Confident	80.2	Confident	69 Å²	69	66.2 Å²	66.2	48%	0.483	35%	0.354	S	S	.	.	H	α-helix	trans	-65.7	-41.5	178.7	60.8	0	0	0	0	112	N1707 Q1708 N1713 Q1714 L1715	N1707-S1711 PolarHBondContact O-N 3.31Å; N1707-S1711 VanDerWaalsContact O-N 3.16Å; Q1708-S1711 PolarHBondContact O-OG 3.48Å; S1711-N1713 VanDerWaalsContact C-N 3.29Å; S1711-N1713 PolarHBondContact O-N 3.43Å; S1711-Q1714 PolarHBondContact O-N 2.88Å; S1711-L1715 WeakPolarHBondContact O-CB 3.36Å; S1711-L1715 PolarHBondContact O-N 3.15Å; S1711-L1715 VanDerWaalsContact O-N 3.16Å
1712	A	83.6	Confident	81.4	Confident	33 Å²	33	63.9 Å²	63.9	27%	0.273	34%	0.336	S	S	.	.	H	α-helix	trans	-60.8	-36.4	174.7	0	0	0	0	0	112.8	I1657 Q1708 L1715 L1716	I1657-A1712 HydrophobicContact CD1-CB 4.08Å; Q1708-A1712 WeakPolarHBondContact O-CB 3.4Å; Q1708-A1712 PolarHBondContact O-N 3.24Å; A1712-L1715 PolarHBondContact O-N 3.21Å; A1712-L1716 WeakPolarHBondContact O-CD1 3.41Å; A1712-L1716 PolarHBondContact O-N 3.23Å; A1712-L1716 VanDerWaalsContact O-N 3.13Å
1713	N	84.6	Confident	82.9	Confident	22 Å²	22	62.1 Å²	62.1	12%	0.118	33%	0.326	C	S	.	.	H	α-helix	trans	-67.9	-42.6	179.1	-151.9	10.6	0	0	0	112.1	I1657 N1658 L1709 R1710 S1711 L1715 T1717	I1657-N1713 HydrophobicContact CG2-CB 3.77Å; N1658-N1713 PolarHBondContact ND2-OD1 2.84Å; N1658-N1713 PolarHBondContact OD1-ND2 3.4Å; L1709-N1713 WeakPolarHBondContact O-CB 3.38Å; L1709-N1713 PolarHBondContact O-N 3.26Å; R1710-N1713 PolarHBondContact O-N 2.93Å; S1711-N1713 VanDerWaalsContact C-N 3.29Å; S1711-N1713 PolarHBondContact O-N 3.43Å; N1713-L1715 VanDerWaalsContact C-N 3.32Å; N1713-L1715 PolarHBondContact O-N 3.48Å; N1713-T1717 WeakPolarHBondContact O-CB 3.28Å; N1713-T1717 PolarHBondContact O-N 3.24Å; N1713-T1717 VanDerWaalsContact O-N 3.09Å; N1713-T1717 PolarHBondContact O-OG1 2.82Å
1714	Q	85.4	Confident	84	Confident	143 Å²	143	62.4 Å²	62.4	67%	0.668	33%	0.325	S	S	*	.	H	α-helix	trans	-62.7	-40	174.7	-71	-171.6	-80.2	0	0	112.1	R1710 S1711 T1717 L1718	R1710-Q1714 PolarHBondContact O-N 3.12Å; S1711-Q1714 PolarHBondContact O-N 2.88Å; Q1714-T1717 WeakPolarHBondContact O-CB 3.48Å; Q1714-T1717 PolarHBondContact O-N 3.37Å; Q1714-L1718 PolarHBondContact O-N 3.02Å
1715	L	87.4	Confident	84.6	Confident	64 Å²	64	63.4 Å²	63.4	34%	0.335	33%	0.328	S	S	.	.	H	α-helix	trans	-66.7	-45	-176.5	-166.9	157	0	0	0	111.7	V1420 S1711 A1712 N1713 T1717 L1718 Q1719	V1420-L1715 HydrophobicContact CG2-CD1 3.63Å; V1420-L1715 HydrophobicContact CG2-CD2 3.83Å; V1420-L1715 HydrophobicContact CG2-CG 3.93Å; S1711-L1715 WeakPolarHBondContact O-CB 3.36Å; S1711-L1715 PolarHBondContact O-N 3.15Å; S1711-L1715 VanDerWaalsContact O-N 3.16Å; A1712-L1715 PolarHBondContact O-N 3.21Å; N1713-L1715 VanDerWaalsContact C-N 3.32Å; N1713-L1715 PolarHBondContact O-N 3.48Å; L1715-T1717 VanDerWaalsContact C-N 3.3Å; L1715-T1717 PolarHBondContact O-N 3.32Å; L1715-L1718 PolarHBondContact O-N 3.46Å; L1715-Q1719 PolarHBondContact O-N 2.9Å; L1715-Q1719 VanDerWaalsContact O-N 3.16Å
1716	L	85.6	Confident	85.3	Confident	14 Å²	14	62.4 Å²	62.4	7%	0.073	33%	0.327	C	S	.	.	H	α-helix	trans	-68.4	-26.9	171.8	-90.4	79.6	0	0	0	113.5	Q1653 I1657 A1712 Q1719 L1720	Q1653-L1716 HydrophobicContact CB-CD2 3.32Å; Q1653-L1716 HydrophobicContact CG-CD2 4.45Å; I1657-L1716 HydrophobicContact CD1-CD1 4.11Å; I1657-L1716 HydrophobicContact CD1-CD2 4.11Å; A1712-L1716 WeakPolarHBondContact O-CD1 3.41Å; A1712-L1716 PolarHBondContact O-N 3.23Å; A1712-L1716 VanDerWaalsContact O-N 3.13Å; L1716-Q1719 PolarHBondContact O-N 2.75Å; L1716-L1720 PolarHBondContact O-N 3.34Å
1717	T	85.5	Confident	85.8	Confident	71 Å²	71	62.2 Å²	62.2	44%	0.436	33%	0.327	S	S	.	.	H	α-helix	trans	-67.2	-39.4	174.6	-55.9	0	0	0	0	110.9	N1713 Q1714 L1715 L1720 T1721	N1713-T1717 WeakPolarHBondContact O-CB 3.28Å; N1713-T1717 PolarHBondContact O-N 3.24Å; N1713-T1717 VanDerWaalsContact O-N 3.09Å; N1713-T1717 PolarHBondContact O-OG1 2.82Å; Q1714-T1717 WeakPolarHBondContact O-CB 3.48Å; Q1714-T1717 PolarHBondContact O-N 3.37Å; L1715-T1717 VanDerWaalsContact C-N 3.3Å; L1715-T1717 PolarHBondContact O-N 3.32Å; T1717-L1720 PolarHBondContact O-N 2.98Å; T1717-T1721 PolarHBondContact O-N 3.49Å; T1717-T1721 PolarHBondContact O-OG1 3.38Å
1718	L	87.5	Confident	86.2	Confident	97 Å²	97	58.8 Å²	58.8	51%	0.508	31%	0.312	S	S	.	.	H	α-helix	trans	-66.8	-41.2	174.9	-75.4	169.5	0	0	0	112.3	N1419 Q1714 L1715 T1721 D1722	N1419-L1718 PolarHBondContact ND2-O 2.9Å; Q1714-L1718 PolarHBondContact O-N 3.02Å; L1715-L1718 PolarHBondContact O-N 3.46Å; L1718-T1721 PolarHBondContact O-N 2.75Å; L1718-T1721 PolarHBondContact O-OG1 3.03Å; L1718-D1722 PolarHBondContact O-N 3.12Å
1719	Q	89.2	Confident	86.5	Confident	34 Å²	34	57.7 Å²	57.7	16%	0.159	31%	0.31	C	S	.	.	H	α-helix	trans	-50.6	-62.7	168.5	-75	-171.9	-54.1	0	0	110	D1417 N1418 N1419 L1715 L1716 T1721 D1722 L1723	D1417-Q1719 WeakPolarHBondContact OD1-CB 3.4Å; D1417-Q1719 VanDerWaalsContact OD1-CG 3.26Å; D1417-Q1719 WeakPolarHBondContact OD1-CG 3.24Å; D1417-Q1719 PolarHBondContact OD1-NE2 3.03Å; N1418-Q1719 WeakPolarHBondContact O-CG 3.47Å; N1418-Q1719 PolarHBondContact O-NE2 3.26Å; N1419-Q1719 HydrophobicContact CB-CG 4.03Å; L1715-Q1719 PolarHBondContact O-N 2.9Å; L1715-Q1719 VanDerWaalsContact O-N 3.16Å; L1716-Q1719 PolarHBondContact O-N 2.75Å; Q1719-T1721 PolarHBondContact O-N 3.47Å; Q1719-D1722 WeakPolarHBondContact O-CA 3.45Å; Q1719-D1722 PolarHBondContact O-N 2.91Å; Q1719-L1723 VanDerWaalsContact O-CG 3.24Å; Q1719-L1723 WeakPolarHBondContact O-CG 3.17Å; Q1719-L1723 PolarHBondContact O-N 3.27Å
1720	L	88.1	Confident	86.8	Confident	27 Å²	27	58.3 Å²	58.3	14%	0.141	31%	0.314	C	S	.	.	H	α-helix	trans	-49.9	-35.4	-177.1	-81.5	165.5	0	0	0	114.8	R1647 A1650 E1651 T1654 L1716 T1717 L1723 Q1724	R1647-L1720 HydrophobicContact CG-CD2 3.94Å; A1650-L1720 HydrophobicContact CB-CD2 3.8Å; A1650-L1720 HydrophobicContact CB-CG 3.92Å; E1651-L1720 HydrophobicContact CG-CD2 4.04Å; T1654-L1720 HydrophobicContact CG2-CD1 4.49Å; L1716-L1720 PolarHBondContact O-N 3.34Å; T1717-L1720 PolarHBondContact O-N 2.98Å; L1720-L1723 HydrophobicContact CD2-CD1 4.35Å; L1720-Q1724 WeakPolarHBondContact O-CG 3.34Å; L1720-Q1724 PolarHBondContact O-N 2.55Å; L1720-Q1724 PolarHBondContact O-OE1 2.95Å
1721	T	87.6	Confident	87.1	Confident	65 Å²	65	52.8 Å²	52.8	40%	0.399	29%	0.293	S	S	.	.	H	α-helix	trans	-72.3	-34.5	175.7	43.1	0	0	0	0	114.2	T1717 L1718 Q1719 N1725	T1717-T1721 PolarHBondContact O-N 3.49Å; T1717-T1721 PolarHBondContact O-OG1 3.38Å; L1718-T1721 PolarHBondContact O-N 2.75Å; L1718-T1721 PolarHBondContact O-OG1 3.03Å; Q1719-T1721 PolarHBondContact O-N 3.47Å; T1721-N1725 PolarHBondContact O-ND2 3.24Å; T1721-N1725 VanDerWaalsContact O-ND2 3.14Å
1722	D	86.7	Confident	87.2	Confident	47 Å²	47	54.3 Å²	54.3	25%	0.251	29%	0.291	S	S	.	.	H	α-helix	trans	-74	-33.8	175.5	-79.9	-49.3	0	0	0	112.1	N1418 N1419 L1718 Q1719 Q1724 N1725 T1726	N1418-D1722 HydrophobicContact CB-CB 3.49Å; N1418-D1722 VanDerWaalsContact CB-CB 3.49Å; N1418-D1722 VanDerWaalsContact ND2-CB 3.31Å; N1418-D1722 WeakPolarHBondContact ND2-CB 3.3Å; N1418-D1722 PolarHBondContact ND2-OD2 2.9Å; N1419-D1722 PolarHBondContact ND2-OD2 3.08Å; L1718-D1722 PolarHBondContact O-N 3.12Å; Q1719-D1722 WeakPolarHBondContact O-CA 3.45Å; Q1719-D1722 PolarHBondContact O-N 2.91Å; D1722-Q1724 VanDerWaalsContact C-N 3.34Å; D1722-Q1724 PolarHBondContact O-N 3.25Å; D1722-N1725 WeakPolarHBondContact O-CB 3.47Å; D1722-N1725 PolarHBondContact O-N 3.44Å; D1722-N1725 VanDerWaalsContact O-N 3.09Å; D1722-T1726 PolarHBondContact O-N 3.38Å
1723	L	90.1	Very high	87.3	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-55.3	-49.4	175	-61.4	-160.2	0	0	0	111.3	E1416 D1417 R1647 A1650 Q1719 L1720 N1725 T1726 I1727	E1416-L1723 HydrophobicContact CB-CD2 3.72Å; E1416-L1723 HydrophobicContact CB-CG 4.46Å; E1416-L1723 VanDerWaalsContact CD-CB 3.42Å; E1416-L1723 HydrophobicContact CG-CB 3.95Å; E1416-L1723 HydrophobicContact CG-CD2 3.8Å; E1416-L1723 HydrophobicContact CG-CG 4.23Å; E1416-L1723 WeakPolarHBondContact OE1-CB 3.41Å; E1416-L1723 WeakPolarHBondContact OE2-CD1 3.28Å; D1417-L1723 HydrophobicContact CB-CD2 4.26Å; D1417-L1723 WeakPolarHBondContact OD1-CD2 3.17Å; R1647-L1723 HydrophobicContact CB-CD1 4.22Å; R1647-L1723 HydrophobicContact CG-CB 4.11Å; R1647-L1723 HydrophobicContact CG-CD1 4.18Å; A1650-L1723 HydrophobicContact CB-CD1 3.99Å; Q1719-L1723 VanDerWaalsContact O-CG 3.24Å; Q1719-L1723 WeakPolarHBondContact O-CG 3.17Å; Q1719-L1723 PolarHBondContact O-N 3.27Å; L1720-L1723 HydrophobicContact CD2-CD1 4.35Å; L1723-N1725 PolarHBondContact O-N 3.13Å; L1723-T1726 PolarHBondContact O-N 2.83Å; L1723-T1726 PolarHBondContact O-OG1 3.5Å; L1723-T1726 VanDerWaalsContact O-OG1 3.07Å; L1723-I1727 WeakPolarHBondContact O-CB 3.38Å; L1723-I1727 PolarHBondContact O-N 2.84Å; L1723-I1727 VanDerWaalsContact O-N 3.12Å
1724	Q	88.8	Confident	87.5	Confident	103 Å²	103	57 Å²	57	48%	0.481	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-28.6	177.8	-67.2	175.5	-70.4	0	0	113.2	L1720 D1722 G1728	L1720-Q1724 WeakPolarHBondContact O-CG 3.34Å; L1720-Q1724 PolarHBondContact O-N 2.55Å; L1720-Q1724 PolarHBondContact O-OE1 2.95Å; D1722-Q1724 VanDerWaalsContact C-N 3.34Å; D1722-Q1724 PolarHBondContact O-N 3.25Å; Q1724-G1728 PolarHBondContact O-N 2.91Å; Q1724-G1728 VanDerWaalsContact O-N 3.09Å
1725	N	86.4	Confident	87.6	Confident	90 Å²	90	55.1 Å²	55.1	48%	0.481	29%	0.292	S	S	.	.	H	α-helix	trans	-77.1	-41.3	178	-66.5	-41.5	0	0	0	112.5	T1721 D1722 L1723 G1728 D1729	T1721-N1725 PolarHBondContact O-ND2 3.24Å; T1721-N1725 VanDerWaalsContact O-ND2 3.14Å; D1722-N1725 WeakPolarHBondContact O-CB 3.47Å; D1722-N1725 PolarHBondContact O-N 3.44Å; D1722-N1725 VanDerWaalsContact O-N 3.09Å; L1723-N1725 PolarHBondContact O-N 3.13Å; N1725-G1728 VanDerWaalsContact O-CA 3.31Å; N1725-G1728 WeakPolarHBondContact O-CA 3.23Å; N1725-G1728 PolarHBondContact O-N 3.3Å; N1725-D1729 PolarHBondContact O-N 2.87Å
1726	T	88.9	Confident	87.6	Confident	60 Å²	60	55.8 Å²	55.8	37%	0.368	30%	0.299	S	S	.	.	H	α-helix	trans	-67.7	-39.9	177.2	43.5	0	0	0	0	111.5	P1415 D1722 L1723 G1728 D1729 L1730	P1415-T1726 WeakPolarHBondContact O-CB 3.22Å; P1415-T1726 PolarHBondContact O-OG1 2.65Å; P1415-T1726 VanDerWaalsContact O-OG1 3.12Å; D1722-T1726 PolarHBondContact O-N 3.38Å; L1723-T1726 PolarHBondContact O-N 2.83Å; L1723-T1726 PolarHBondContact O-OG1 3.5Å; L1723-T1726 VanDerWaalsContact O-OG1 3.07Å; T1726-G1728 PolarHBondContact O-N 3.42Å; T1726-D1729 PolarHBondContact O-N 2.84Å; T1726-L1730 WeakPolarHBondContact O-CD1 3.45Å; T1726-L1730 WeakPolarHBondContact O-CG 3.34Å; T1726-L1730 PolarHBondContact O-N 2.72Å
1727	I	88.2	Confident	87.7	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-50	-44.4	163.3	-83.3	-174.6	0	0	0	111.7	E1416 A1643 E1644 L1723 D1729 L1730 K1731	E1416-I1727 WeakPolarHBondContact OE1-CD1 3.43Å; E1416-I1727 WeakPolarHBondContact OE1-CG1 3.42Å; A1643-I1727 HydrophobicContact CB-CD1 4.16Å; A1643-I1727 HydrophobicContact CB-CG1 3.41Å; A1643-I1727 VanDerWaalsContact CB-CG1 3.41Å; E1644-I1727 HydrophobicContact CB-CD1 4.46Å; E1644-I1727 HydrophobicContact CG-CD1 3.59Å; E1644-I1727 HydrophobicContact CG-CG1 4.45Å; L1723-I1727 WeakPolarHBondContact O-CB 3.38Å; L1723-I1727 PolarHBondContact O-N 2.84Å; L1723-I1727 VanDerWaalsContact O-N 3.12Å; I1727-D1729 VanDerWaalsContact C-N 3.31Å; I1727-D1729 PolarHBondContact O-N 2.69Å; I1727-L1730 PolarHBondContact O-N 3.44Å; I1727-K1731 HydrophobicContact CG2-CD 3.98Å; I1727-K1731 VanDerWaalsContact O-CD 3.31Å; I1727-K1731 WeakPolarHBondContact O-CD 3.07Å; I1727-K1731 PolarHBondContact O-N 3.28Å; I1727-K1731 VanDerWaalsContact O-N 3.16Å
1728	G	85.2	Confident	87.6	Confident	18 Å²	18	56.3 Å²	56.3	19%	0.186	30%	0.296	C	S	.	.	H	α-helix	trans	-58.1	-28.8	-175.8	0	0	0	0	0	116.6	Q1724 N1725 T1726 K1731	Q1724-G1728 PolarHBondContact O-N 2.91Å; Q1724-G1728 VanDerWaalsContact O-N 3.09Å; N1725-G1728 VanDerWaalsContact O-CA 3.31Å; N1725-G1728 WeakPolarHBondContact O-CA 3.23Å; N1725-G1728 PolarHBondContact O-N 3.3Å; T1726-G1728 PolarHBondContact O-N 3.42Å; G1728-K1731 WeakPolarHBondContact O-CB 3.32Å
1729	D	86.6	Confident	87.5	Confident	103 Å²	103	54.2 Å²	54.2	55%	0.551	29%	0.293	S	S	*	.	H	α-helix	trans	-98	-37.4	178.2	-78.8	-34.2	0	0	0	113	N1725 T1726 I1727 K1731 K1732 D1733	N1725-D1729 PolarHBondContact O-N 2.87Å; T1726-D1729 PolarHBondContact O-N 2.84Å; I1727-D1729 VanDerWaalsContact C-N 3.31Å; I1727-D1729 PolarHBondContact O-N 2.69Å; D1729-K1731 PolarHBondContact O-N 2.9Å; D1729-K1732 PolarHBondContact O-N 2.82Å; D1729-K1732 IonicContact OD1-NZ 3.53Å; D1729-K1732 PolarHBondContact OD1-NZ 2.85Å; D1729-D1733 PolarHBondContact O-N 2.97Å
1730	L	90.1	Very high	87.4	Confident	34 Å²	34	56 Å²	56	18%	0.178	30%	0.303	C	S	.	.	H	α-helix	trans	-57	-34.4	173.6	-67	162.1	0	0	0	112	P1415 D1639 A1643 T1726 I1727 K1732 D1733 L1734	P1415-L1730 HydrophobicContact CB-CD1 4.49Å; P1415-L1730 HydrophobicContact CG-CD1 3.49Å; P1415-L1730 VanDerWaalsContact CG-CD1 3.49Å; D1639-L1730 HydrophobicContact CB-CD2 4.08Å; D1639-L1730 WeakPolarHBondContact O-CD1 3.33Å; A1643-L1730 HydrophobicContact CB-CD1 4.25Å; T1726-L1730 WeakPolarHBondContact O-CD1 3.45Å; T1726-L1730 WeakPolarHBondContact O-CG 3.34Å; T1726-L1730 PolarHBondContact O-N 2.72Å; I1727-L1730 PolarHBondContact O-N 3.44Å; L1730-K1732 VanDerWaalsContact C-N 3.29Å; L1730-K1732 PolarHBondContact O-N 2.76Å; L1730-D1733 PolarHBondContact O-N 3.12Å; L1730-L1734 PolarHBondContact O-N 3.47Å; L1730-L1734 VanDerWaalsContact O-N 3.07Å
1731	K	89.1	Confident	87.5	Confident	7 Å²	7	55.7 Å²	55.7	3%	0.03	30%	0.301	C	S	.	.	H	α-helix	trans	-33.7	-56.6	162.2	-118.8	115.2	-111.4	-144.8	0	113	I1727 G1728 D1729 E1735 D2373 I2374	I1727-K1731 HydrophobicContact CG2-CD 3.98Å; I1727-K1731 VanDerWaalsContact O-CD 3.31Å; I1727-K1731 WeakPolarHBondContact O-CD 3.07Å; I1727-K1731 PolarHBondContact O-N 3.28Å; I1727-K1731 VanDerWaalsContact O-N 3.16Å; G1728-K1731 WeakPolarHBondContact O-CB 3.32Å; D1729-K1731 PolarHBondContact O-N 2.9Å; K1731-E1735 WeakPolarHBondContact O-CG 3.28Å; K1731-E1735 PolarHBondContact O-N 3.1Å; K1731-D2373 VanDerWaalsContact CG-O 3.3Å; K1731-D2373 WeakPolarHBondContact CG-O 3.38Å; K1731-D2373 IonicContact NZ-OD1 2.7Å; K1731-D2373 PolarHBondContact NZ-OD1 3Å; K1731-D2373 IonicContact NZ-OD2 2.66Å; K1731-D2373 PolarHBondContact NZ-OD2 3.25Å; K1731-I2374 HydrophobicContact CD-CD1 4.18Å; K1731-I2374 VanDerWaalsContact CE-CA 3.5Å; K1731-I2374 VanDerWaalsContact CE-CB 3.41Å; K1731-I2374 HydrophobicContact CG-CD1 3.9Å
1732	K	86.1	Confident	87.3	Confident	101 Å²	101	56.4 Å²	56.4	44%	0.439	30%	0.3	S	S	.	.	H	α-helix	trans	-81.3	-36.3	-173.3	-67	170.4	-168.5	137.4	0	113.1	D1729 L1730 L1734 E1735 T1736	D1729-K1732 PolarHBondContact O-N 2.82Å; D1729-K1732 IonicContact OD1-NZ 3.53Å; D1729-K1732 PolarHBondContact OD1-NZ 2.85Å; L1730-K1732 VanDerWaalsContact C-N 3.29Å; L1730-K1732 PolarHBondContact O-N 2.76Å; K1732-L1734 VanDerWaalsContact C-N 3.28Å; K1732-L1734 PolarHBondContact O-N 3.43Å; K1732-E1735 PolarHBondContact O-N 3.24Å; K1732-T1736 WeakPolarHBondContact O-CB 3.49Å; K1732-T1736 WeakPolarHBondContact O-CG2 3.45Å; K1732-T1736 PolarHBondContact O-N 3.08Å; K1732-T1736 PolarHBondContact O-OG1 2.99Å
1733	D	85.4	Confident	87.3	Confident	109 Å²	109	61.2 Å²	61.2	58%	0.583	32%	0.318	S	S	*	.	H	α-helix	trans	-65.5	-36.8	-179.9	-81.7	4.7	0	0	0	110.5	D1729 L1730 T1736 A1737	D1729-D1733 PolarHBondContact O-N 2.97Å; L1730-D1733 PolarHBondContact O-N 3.12Å; D1733-T1736 PolarHBondContact O-OG1 2.89Å; D1733-A1737 WeakPolarHBondContact O-CB 3.43Å; D1733-A1737 PolarHBondContact O-N 3.4Å
1734	L	89.8	Confident	87.1	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-71.5	-45.1	171	-173.3	127.5	0	0	0	112.9	A1636 R1637 L1730 K1732 T1736 A1737 Y1738 N2375 D2376	A1636-L1734 HydrophobicContact CB-CB 3.99Å; A1636-L1734 HydrophobicContact CB-CD1 3.96Å; A1636-L1734 HydrophobicContact CB-CG 4.41Å; R1637-L1734 HydrophobicContact CB-CD1 3.66Å; L1730-L1734 PolarHBondContact O-N 3.47Å; L1730-L1734 VanDerWaalsContact O-N 3.07Å; K1732-L1734 VanDerWaalsContact C-N 3.28Å; K1732-L1734 PolarHBondContact O-N 3.43Å; L1734-T1736 VanDerWaalsContact C-N 3.28Å; L1734-T1736 PolarHBondContact O-N 3.24Å; L1734-A1737 PolarHBondContact O-N 3.01Å; L1734-Y1738 WeakPolarHBondContact O-CB 3.48Å; L1734-Y1738 PolarHBondContact O-N 2.76Å; L1734-N2375 WeakPolarHBondContact CD2-ND2 3.42Å; L1734-N2375 WeakPolarHBondContact CD2-O 3.46Å; L1734-D2376 WeakPolarHBondContact CD1-OD2 3.43Å; L1734-D2376 HydrophobicContact CD2-CB 4.32Å; L1734-D2376 WeakPolarHBondContact CD2-OD2 3.12Å
1735	E	87.8	Confident	86.9	Confident	104 Å²	104	60.7 Å²	60.7	49%	0.486	32%	0.317	S	S	.	.	H	α-helix	trans	-54.2	-44.4	175.1	-80.3	-169	151.2	0	0	112.4	K1731 K1732 Y1738 A1739 N2375	K1731-E1735 WeakPolarHBondContact O-CG 3.28Å; K1731-E1735 PolarHBondContact O-N 3.1Å; K1732-E1735 PolarHBondContact O-N 3.24Å; E1735-Y1738 PolarHBondContact O-N 2.98Å; E1735-A1739 WeakPolarHBondContact O-CB 3.34Å; E1735-A1739 PolarHBondContact O-N 2.89Å; E1735-N2375 HydrophobicContact CG-CB 3.65Å
1736	T	87.2	Confident	86.8	Confident	78 Å²	78	62.7 Å²	62.7	48%	0.479	32%	0.321	S	S	.	.	H	α-helix	trans	-72.1	-33.9	179.8	56.2	0	0	0	0	112.7	K1732 D1733 L1734 N1740	K1732-T1736 WeakPolarHBondContact O-CB 3.49Å; K1732-T1736 WeakPolarHBondContact O-CG2 3.45Å; K1732-T1736 PolarHBondContact O-N 3.08Å; K1732-T1736 PolarHBondContact O-OG1 2.99Å; D1733-T1736 PolarHBondContact O-OG1 2.89Å; L1734-T1736 VanDerWaalsContact C-N 3.28Å; L1734-T1736 PolarHBondContact O-N 3.24Å; T1736-N1740 PolarHBondContact O-N 2.82Å; T1736-N1740 PolarHBondContact O-ND2 3.08Å
1737	A	87.4	Confident	86.7	Confident	15 Å²	15	63 Å²	63	12%	0.124	32%	0.324	C	S	.	.	H	α-helix	trans	-63.2	-46.8	169.6	0	0	0	0	0	111.7	C1633 D1733 L1734 A1739 N1740 H1741	C1633-A1737 VanDerWaalsContact SG-C 3.52Å; D1733-A1737 WeakPolarHBondContact O-CB 3.43Å; D1733-A1737 PolarHBondContact O-N 3.4Å; L1734-A1737 PolarHBondContact O-N 3.01Å; A1737-A1739 PolarHBondContact O-N 3.47Å; A1737-N1740 PolarHBondContact O-N 3.09Å; A1737-N1740 VanDerWaalsContact O-N 3.11Å; A1737-H1741 PolarHBondContact O-N 2.98Å
1738	Y	84.4	Confident	86.7	Confident	81 Å²	81	63.2 Å²	63.2	32%	0.318	33%	0.325	S	S	.	.	H	α-helix	trans	-64.6	-37.9	-178.8	-145	-76	0	0	0	112.2	L1734 E1735 N1740 H1741 Q1742	L1734-Y1738 WeakPolarHBondContact O-CB 3.48Å; L1734-Y1738 PolarHBondContact O-N 2.76Å; E1735-Y1738 PolarHBondContact O-N 2.98Å; Y1738-N1740 VanDerWaalsContact C-N 3.29Å; Y1738-N1740 PolarHBondContact O-N 2.88Å; Y1738-H1741 PolarHBondContact O-N 2.65Å; Y1738-Q1742 HydrophobicContact CD1-CG 4.43Å; Y1738-Q1742 PolarHBondContact O-N 2.71Å
1739	A	85.4	Confident	86.7	Confident	54 Å²	54	68.1 Å²	68.1	45%	0.446	34%	0.343	S	S	.	.	H	α-helix	trans	-63.7	-32.4	174.2	0	0	0	0	0	113	E1735 A1737 K1743	E1735-A1739 WeakPolarHBondContact O-CB 3.34Å; E1735-A1739 PolarHBondContact O-N 2.89Å; A1737-A1739 PolarHBondContact O-N 3.47Å; A1739-K1743 PolarHBondContact O-N 3.22Å
1740	N	85.8	Confident	86.7	Confident	70 Å²	70	69.8 Å²	69.8	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-75.9	-41.5	174.8	-71.1	-44.9	0	0	0	111.8	Y1629 T1736 A1737 Y1738 Q1742 K1743 A1744	Y1629-N1740 HydrophobicContact CD1-CB 4Å; Y1629-N1740 HydrophobicContact CE1-CB 4.08Å; Y1629-N1740 HydrophobicContact CG-CB 4.41Å; T1736-N1740 PolarHBondContact O-N 2.82Å; T1736-N1740 PolarHBondContact O-ND2 3.08Å; A1737-N1740 PolarHBondContact O-N 3.09Å; A1737-N1740 VanDerWaalsContact O-N 3.11Å; Y1738-N1740 VanDerWaalsContact C-N 3.29Å; Y1738-N1740 PolarHBondContact O-N 2.88Å; N1740-Q1742 PolarHBondContact O-N 2.91Å; N1740-K1743 WeakPolarHBondContact O-CB 3.39Å; N1740-K1743 PolarHBondContact O-N 3.33Å; N1740-A1744 PolarHBondContact O-N 3.3Å
1741	H	90.4	Very high	86.6	Confident	21 Å²	21	69.3 Å²	69.3	10%	0.097	34%	0.342	C	S	.	.	H	α-helix	trans	-55.3	-50	172.2	-171.1	-78	0	0	0	111.8	A1737 Y1738 K1743 A1744 E1745	A1737-H1741 PolarHBondContact O-N 2.98Å; Y1738-H1741 PolarHBondContact O-N 2.65Å; H1741-K1743 VanDerWaalsContact C-N 3.27Å; H1741-K1743 PolarHBondContact O-N 2.96Å; H1741-A1744 PolarHBondContact O-N 3.14Å; H1741-A1744 VanDerWaalsContact O-N 3.11Å; H1741-E1745 IonicContact CE1-OE1 3.28Å; H1741-E1745 PolarHBondContact CE1-OE1 2.99Å; H1741-E1745 IonicContact CE1-OE2 2.68Å; H1741-E1745 PolarHBondContact CE1-OE2 3.47Å; H1741-E1745 IonicContact ND1-OE1 3.7Å; H1741-E1745 IonicContact ND1-OE2 3.76Å; H1741-E1745 PolarHBondContact ND1-OE2 3.08Å; H1741-E1745 PolarHBondContact O-N 2.8Å
1742	Q	84	Confident	86.5	Confident	80 Å²	80	75.4 Å²	75.4	37%	0.374	37%	0.365	S	S	.	.	H	α-helix	trans	-59.4	-34.7	177.7	-84.3	-156.9	28.6	0	0	113.6	Y1738 N1740 K1746	Y1738-Q1742 HydrophobicContact CD1-CG 4.43Å; Y1738-Q1742 PolarHBondContact O-N 2.71Å; N1740-Q1742 PolarHBondContact O-N 2.91Å; Q1742-K1746 WeakPolarHBondContact O-CB 3.37Å; Q1742-K1746 WeakPolarHBondContact O-CD 3.48Å; Q1742-K1746 VanDerWaalsContact O-CG 3.29Å; Q1742-K1746 WeakPolarHBondContact O-CG 3.29Å; Q1742-K1746 PolarHBondContact O-N 2.89Å; Q1742-K1746 VanDerWaalsContact O-N 3.12Å
1743	K	85.4	Confident	86.5	Confident	148 Å²	148	75.5 Å²	75.5	64%	0.643	37%	0.37	S	S	*	.	H	α-helix	trans	-68.1	-42.8	175.3	-86.7	178.4	174.5	172.4	0	111.6	A1739 N1740 H1741 T1747	A1739-K1743 PolarHBondContact O-N 3.22Å; N1740-K1743 WeakPolarHBondContact O-CB 3.39Å; N1740-K1743 PolarHBondContact O-N 3.33Å; H1741-K1743 VanDerWaalsContact C-N 3.27Å; H1741-K1743 PolarHBondContact O-N 2.96Å; K1743-T1747 WeakPolarHBondContact O-CB 3.09Å; K1743-T1747 PolarHBondContact O-N 3.27Å; K1743-T1747 PolarHBondContact O-OG1 2.95Å
1744	A	86.3	Confident	86.2	Confident	6 Å²	6	73.1 Å²	73.1	5%	0.05	36%	0.357	C	S	.	.	H	α-helix	trans	-65	-46.8	177.7	0	0	0	0	0	111.4	N1626 Y1629 N1740 H1741 T1747 I1748	N1626-A1744 HydrophobicContact CB-CB 3.91Å; N1626-A1744 WeakPolarHBondContact OD1-CB 3.19Å; Y1629-A1744 HydrophobicContact CD2-CB 4.02Å; Y1629-A1744 HydrophobicContact CE2-CB 4.39Å; N1740-A1744 PolarHBondContact O-N 3.3Å; H1741-A1744 PolarHBondContact O-N 3.14Å; H1741-A1744 VanDerWaalsContact O-N 3.11Å; A1744-T1747 PolarHBondContact O-N 2.96Å; A1744-T1747 VanDerWaalsContact O-N 3.15Å; A1744-I1748 WeakPolarHBondContact O-CG1 3.48Å; A1744-I1748 PolarHBondContact O-N 2.91Å
1745	E	84.5	Confident	85.9	Confident	88 Å²	88	73.6 Å²	73.6	41%	0.411	36%	0.359	S	S	.	.	H	α-helix	trans	-56.8	-51.7	175.1	-77.6	-176.3	126.6	0	0	112.9	N1626 H1741 T1747 I1748 E1749	N1626-E1745 WeakPolarHBondContact ND2-CG 3.49Å; H1741-E1745 IonicContact CE1-OE1 3.28Å; H1741-E1745 PolarHBondContact CE1-OE1 2.99Å; H1741-E1745 IonicContact CE1-OE2 2.68Å; H1741-E1745 PolarHBondContact CE1-OE2 3.47Å; H1741-E1745 IonicContact ND1-OE1 3.7Å; H1741-E1745 IonicContact ND1-OE2 3.76Å; H1741-E1745 PolarHBondContact ND1-OE2 3.08Å; H1741-E1745 PolarHBondContact O-N 2.8Å; E1745-T1747 PolarHBondContact O-N 2.78Å; E1745-T1747 VanDerWaalsContact O-N 3.14Å; E1745-I1748 PolarHBondContact O-N 2.67Å; E1745-I1748 VanDerWaalsContact O-N 3.12Å; E1745-E1749 WeakPolarHBondContact O-CB 2.98Å; E1745-E1749 PolarHBondContact O-N 3.28Å
1746	K	85.6	Confident	85.5	Confident	131 Å²	131	72.3 Å²	72.3	57%	0.57	36%	0.358	S	S	*	.	H	α-helix	trans	-59.4	-27.7	178.7	-74.5	166.1	178.6	160.2	0	112.7	Q1742 K1750	Q1742-K1746 WeakPolarHBondContact O-CB 3.37Å; Q1742-K1746 WeakPolarHBondContact O-CD 3.48Å; Q1742-K1746 VanDerWaalsContact O-CG 3.29Å; Q1742-K1746 WeakPolarHBondContact O-CG 3.29Å; Q1742-K1746 PolarHBondContact O-N 2.89Å; Q1742-K1746 VanDerWaalsContact O-N 3.12Å; K1746-K1750 PolarHBondContact O-N 3.05Å
1747	T	85.4	Confident	85.4	Confident	68 Å²	68	73.7 Å²	73.7	42%	0.417	36%	0.355	S	S	.	.	H	α-helix	trans	-80.8	-41.3	176.4	-51.5	0	0	0	0	111.9	L1622 K1743 A1744 E1745 K1750 L1751	L1622-T1747 HydrophobicContact CD1-CG2 3.77Å; K1743-T1747 WeakPolarHBondContact O-CB 3.09Å; K1743-T1747 PolarHBondContact O-N 3.27Å; K1743-T1747 PolarHBondContact O-OG1 2.95Å; A1744-T1747 PolarHBondContact O-N 2.96Å; A1744-T1747 VanDerWaalsContact O-N 3.15Å; E1745-T1747 PolarHBondContact O-N 2.78Å; E1745-T1747 VanDerWaalsContact O-N 3.14Å; T1747-K1750 PolarHBondContact O-N 3.44Å; T1747-L1751 WeakPolarHBondContact O-CG 3.46Å; T1747-L1751 PolarHBondContact O-N 3.41Å
1748	I	88.3	Confident	85	Confident	10 Å²	10	74.5 Å²	74.5	5%	0.051	36%	0.357	C	S	.	.	H	α-helix	trans	-60.7	-45.4	173.2	-72.6	167.4	0	0	0	110.8	L1619 L1622 N1626 A1744 E1745 L1751 R1752	L1619-I1748 HydrophobicContact CD1-CG2 3.91Å; L1619-I1748 WeakPolarHBondContact CD1-O 3.14Å; L1622-I1748 HydrophobicContact CB-CD1 4.47Å; L1622-I1748 HydrophobicContact CB-CG1 3.93Å; N1626-I1748 HydrophobicContact CB-CD1 3.58Å; A1744-I1748 WeakPolarHBondContact O-CG1 3.48Å; A1744-I1748 PolarHBondContact O-N 2.91Å; E1745-I1748 PolarHBondContact O-N 2.67Å; E1745-I1748 VanDerWaalsContact O-N 3.12Å; I1748-L1751 PolarHBondContact O-N 2.89Å; I1748-R1752 WeakPolarHBondContact O-CG 3.4Å; I1748-R1752 PolarHBondContact O-N 3.38Å
1749	E	85.7	Confident	84.6	Confident	120 Å²	120	73.9 Å²	73.9	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-66	-39.9	-178.2	-169.9	143.4	-115.3	0	0	111.8	E1745 R1752 I1753	E1745-E1749 WeakPolarHBondContact O-CB 2.98Å; E1745-E1749 PolarHBondContact O-N 3.28Å; E1749-R1752 WeakPolarHBondContact O-CB 3.36Å; E1749-R1752 PolarHBondContact O-N 3.35Å; E1749-I1753 WeakPolarHBondContact O-CG1 3.33Å; E1749-I1753 PolarHBondContact O-N 2.86Å; E1749-I1753 VanDerWaalsContact O-N 3.08Å
1750	K	86.2	Confident	84	Confident	138 Å²	138	76 Å²	76	60%	0.6	36%	0.361	S	S	*	.	H	α-helix	trans	-60.3	-45.8	171.1	-169.6	-179.2	178.1	-173.2	0	112.1	K1746 T1747 R1752 I1753 D1754	K1746-K1750 PolarHBondContact O-N 3.05Å; T1747-K1750 PolarHBondContact O-N 3.44Å; K1750-R1752 VanDerWaalsContact C-N 3.3Å; K1750-R1752 PolarHBondContact O-N 3.22Å; K1750-I1753 PolarHBondContact O-N 3.49Å; K1750-D1754 PolarHBondContact O-N 3.47Å
1751	L	89	Confident	83.5	Confident	24 Å²	24	75.6 Å²	75.6	13%	0.126	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-34.4	176.1	-74.7	172.7	0	0	0	112.7	L1615 K1618 L1619 L1622 T1747 I1748 I1755	L1615-L1751 HydrophobicContact CD2-CD2 4.04Å; K1618-L1751 HydrophobicContact CB-CD1 4.43Å; L1619-L1751 HydrophobicContact CD1-CB 3.78Å; L1622-L1751 HydrophobicContact CD1-CD1 3.55Å; T1747-L1751 WeakPolarHBondContact O-CG 3.46Å; T1747-L1751 PolarHBondContact O-N 3.41Å; I1748-L1751 PolarHBondContact O-N 2.89Å; L1751-I1755 WeakPolarHBondContact O-CB 3.42Å; L1751-I1755 WeakPolarHBondContact O-CD1 3.46Å; L1751-I1755 WeakPolarHBondContact O-CG1 3.39Å; L1751-I1755 PolarHBondContact O-N 3.46Å
1752	R	87.3	Confident	82.8	Confident	136 Å²	136	77.7 Å²	77.7	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-63.2	-47.3	173.4	-71.9	176.8	-179.3	-179.2	0.4	111.5	L1619 I1748 E1749 K1750 D1754 I1755 T1756	L1619-R1752 HydrophobicContact CD1-CG 3.83Å; L1619-R1752 HydrophobicContact CD2-CG 4.23Å; I1748-R1752 WeakPolarHBondContact O-CG 3.4Å; I1748-R1752 PolarHBondContact O-N 3.38Å; E1749-R1752 WeakPolarHBondContact O-CB 3.36Å; E1749-R1752 PolarHBondContact O-N 3.35Å; K1750-R1752 VanDerWaalsContact C-N 3.3Å; K1750-R1752 PolarHBondContact O-N 3.22Å; R1752-D1754 VanDerWaalsContact C-N 3.34Å; R1752-D1754 PolarHBondContact O-N 2.7Å; R1752-I1755 PolarHBondContact O-N 2.89Å; R1752-T1756 PolarHBondContact O-N 2.9Å; R1752-T1756 PolarHBondContact O-OG1 3.47Å; R1752-T1756 VanDerWaalsContact O-OG1 3.09Å
1753	I	84.5	Confident	82.2	Confident	103 Å²	103	77.9 Å²	77.9	53%	0.528	37%	0.365	S	S	.	.	H	α-helix	trans	-59.5	-44.5	178.3	-66.7	163.5	0	0	0	111	E1749 K1750 I1755 T1756 R1757	E1749-I1753 WeakPolarHBondContact O-CG1 3.33Å; E1749-I1753 PolarHBondContact O-N 2.86Å; E1749-I1753 VanDerWaalsContact O-N 3.08Å; K1750-I1753 PolarHBondContact O-N 3.49Å; I1753-I1755 VanDerWaalsContact C-N 3.34Å; I1753-I1755 PolarHBondContact O-N 2.99Å; I1753-T1756 WeakPolarHBondContact CA-OG1 3.48Å; I1753-T1756 PolarHBondContact O-N 3.38Å; I1753-T1756 PolarHBondContact O-OG1 3.31Å; I1753-R1757 WeakPolarHBondContact O-CB 3.39Å; I1753-R1757 PolarHBondContact O-N 3.29Å
1754	D	80.9	Confident	81.5	Confident	59 Å²	59	73.5 Å²	73.5	32%	0.316	36%	0.357	S	S	.	.	H	α-helix	trans	-66.1	-34.5	177.6	-70.6	-33.7	0	0	0	112.1	L1615 K1750 R1752 I1758	L1615-D1754 HydrophobicContact CD1-CB 4.23Å; K1750-D1754 PolarHBondContact O-N 3.47Å; R1752-D1754 VanDerWaalsContact C-N 3.34Å; R1752-D1754 PolarHBondContact O-N 2.7Å; D1754-I1758 WeakPolarHBondContact O-CG1 3.43Å; D1754-I1758 PolarHBondContact O-N 3.42Å
1755	I	82.9	Confident	80.8	Confident	11 Å²	11	76.4 Å²	76.4	6%	0.056	37%	0.371	C	S	.	.	H	α-helix	trans	-67.8	-48.7	174	-71.9	161.9	0	0	0	111.5	L1615 K1616 L1619 L1751 R1752 I1753 R1757 I1758 Q1759	L1615-I1755 HydrophobicContact CB-CD1 3.98Å; L1615-I1755 HydrophobicContact CB-CG1 3.48Å; L1615-I1755 VanDerWaalsContact CB-CG1 3.48Å; L1615-I1755 HydrophobicContact CD1-CG1 4.11Å; L1615-I1755 HydrophobicContact CG-CG1 4.45Å; K1616-I1755 HydrophobicContact CG-CD1 4.08Å; K1616-I1755 HydrophobicContact CG-CG2 4.32Å; L1619-I1755 HydrophobicContact CB-CD1 4.01Å; L1619-I1755 HydrophobicContact CD2-CD1 3.86Å; L1619-I1755 HydrophobicContact CG-CD1 4.37Å; L1751-I1755 WeakPolarHBondContact O-CB 3.42Å; L1751-I1755 WeakPolarHBondContact O-CD1 3.46Å; L1751-I1755 WeakPolarHBondContact O-CG1 3.39Å; L1751-I1755 PolarHBondContact O-N 3.46Å; R1752-I1755 PolarHBondContact O-N 2.89Å; I1753-I1755 VanDerWaalsContact C-N 3.34Å; I1753-I1755 PolarHBondContact O-N 2.99Å; I1755-R1757 VanDerWaalsContact C-N 3.33Å; I1755-R1757 PolarHBondContact O-N 3.42Å; I1755-I1758 PolarHBondContact O-N 3.46Å; I1755-Q1759 PolarHBondContact O-N 3.1Å; I1755-Q1759 VanDerWaalsContact O-N 3.13Å
1756	T	80	Confident	80	Confident	77 Å²	77	76.6 Å²	76.6	47%	0.472	37%	0.369	S	S	.	.	H	α-helix	trans	-59.2	-45.7	177.4	38	0	0	0	0	110.6	R1752 I1753 I1758 Q1759 D1760	R1752-T1756 PolarHBondContact O-N 2.9Å; R1752-T1756 PolarHBondContact O-OG1 3.47Å; R1752-T1756 VanDerWaalsContact O-OG1 3.09Å; I1753-T1756 WeakPolarHBondContact CA-OG1 3.48Å; I1753-T1756 PolarHBondContact O-N 3.38Å; I1753-T1756 PolarHBondContact O-OG1 3.31Å; T1756-I1758 VanDerWaalsContact C-N 3.29Å; T1756-I1758 PolarHBondContact O-N 3.47Å; T1756-Q1759 CarbonylContact O-C 3.58Å; T1756-Q1759 WeakPolarHBondContact O-CA 3.34Å; T1756-Q1759 WeakPolarHBondContact O-CB 3.45Å; T1756-Q1759 PolarHBondContact O-N 3.41Å; T1756-D1760 PolarHBondContact O-N 3.37Å
1757	R	84.2	Confident	79.2	Confident	108 Å²	108	74.7 Å²	74.7	41%	0.408	36%	0.362	S	S	.	.	H	α-helix	trans	-59.1	-37.2	179.6	-177.9	-178.3	159.4	-147.5	-16.2	113.3	I1753 I1755 Q1759 D1760 E1761	I1753-R1757 WeakPolarHBondContact O-CB 3.39Å; I1753-R1757 PolarHBondContact O-N 3.29Å; I1755-R1757 VanDerWaalsContact C-N 3.33Å; I1755-R1757 PolarHBondContact O-N 3.42Å; R1757-Q1759 VanDerWaalsContact C-N 3.32Å; R1757-D1760 WeakPolarHBondContact CA-OD2 3.33Å; R1757-D1760 PolarHBondContact O-N 3.17Å; R1757-E1761 IonicContact CZ-OE1 2.64Å; R1757-E1761 VanDerWaalsContact CZ-OE1 3.27Å; R1757-E1761 IonicContact NE-OE1 2.65Å; R1757-E1761 PolarHBondContact NE-OE1 3.26Å; R1757-E1761 IonicContact NH2-OE1 2.66Å; R1757-E1761 PolarHBondContact NH2-OE1 2.92Å; R1757-E1761 WeakPolarHBondContact O-CB 3.34Å; R1757-E1761 WeakPolarHBondContact O-CG 3.18Å; R1757-E1761 PolarHBondContact O-N 2.85Å
1758	I	78.7	Confident	78.3	Confident	31 Å²	31	74.2 Å²	74.2	16%	0.159	37%	0.365	C	S	.	.	H	α-helix	trans	-73.8	-26	176.7	-69.2	-179.6	0	0	0	111.7	L1608 M1611 L1615 D1754 I1755 T1756 Y1762	L1608-I1758 HydrophobicContact CB-CG2 4.46Å; L1608-I1758 HydrophobicContact CD2-CG2 4.35Å; M1611-I1758 HydrophobicContact CB-CD1 4.24Å; L1615-I1758 HydrophobicContact CD1-CD1 3.79Å; D1754-I1758 WeakPolarHBondContact O-CG1 3.43Å; D1754-I1758 PolarHBondContact O-N 3.42Å; I1755-I1758 PolarHBondContact O-N 3.46Å; T1756-I1758 VanDerWaalsContact C-N 3.29Å; T1756-I1758 PolarHBondContact O-N 3.47Å; I1758-Y1762 WeakPolarHBondContact O-CB 3.29Å; I1758-Y1762 PolarHBondContact O-N 3.44Å; I1758-Y1762 VanDerWaalsContact O-N 3.13Å
1759	Q	75.1	Confident	77.2	Confident	69 Å²	69	75.8 Å²	75.8	32%	0.322	37%	0.373	S	S	.	.	H	α-helix	trans	-73.8	-42.6	169.6	-70.3	-174.7	-136.8	0	0	111.6	I1755 T1756 R1757 E1761 Y1762 E1763	I1755-Q1759 PolarHBondContact O-N 3.1Å; I1755-Q1759 VanDerWaalsContact O-N 3.13Å; T1756-Q1759 CarbonylContact O-C 3.58Å; T1756-Q1759 WeakPolarHBondContact O-CA 3.34Å; T1756-Q1759 WeakPolarHBondContact O-CB 3.45Å; T1756-Q1759 PolarHBondContact O-N 3.41Å; R1757-Q1759 VanDerWaalsContact C-N 3.32Å; Q1759-E1761 VanDerWaalsContact C-N 3.32Å; Q1759-E1761 PolarHBondContact O-N 3.05Å; Q1759-Y1762 WeakPolarHBondContact O-CA 3.09Å; Q1759-Y1762 WeakPolarHBondContact O-CB 3.34Å; Q1759-Y1762 PolarHBondContact O-N 2.71Å; Q1759-E1763 PolarHBondContact O-N 2.7Å
1760	D	74.7	Confident	76.3	Confident	98 Å²	98	74.4 Å²	74.4	52%	0.524	36%	0.363	S	S	.	.	H	α-helix	trans	-58.1	-43.8	173.4	-51.3	-30.8	0	0	0	111.1	T1756 R1757 Y1762 A1764	T1756-D1760 PolarHBondContact O-N 3.37Å; R1757-D1760 WeakPolarHBondContact CA-OD2 3.33Å; R1757-D1760 PolarHBondContact O-N 3.17Å; D1760-Y1762 VanDerWaalsContact C-N 3.31Å; D1760-Y1762 PolarHBondContact O-N 3.42Å; D1760-A1764 VanDerWaalsContact O-CB 3.31Å; D1760-A1764 WeakPolarHBondContact O-CB 3.33Å; D1760-A1764 PolarHBondContact O-N 3.07Å; D1760-A1764 VanDerWaalsContact O-N 3.07Å
1761	E	73.9	Confident	75.5	Confident	62 Å²	62	71.8 Å²	71.8	29%	0.29	36%	0.358	S	S	.	.	H	α-helix	trans	-68.9	-24.1	175.4	-73.4	-176.8	-164.1	0	0	112.7	R1757 Q1759 D1765	R1757-E1761 IonicContact CZ-OE1 2.64Å; R1757-E1761 VanDerWaalsContact CZ-OE1 3.27Å; R1757-E1761 IonicContact NE-OE1 2.65Å; R1757-E1761 PolarHBondContact NE-OE1 3.26Å; R1757-E1761 IonicContact NH2-OE1 2.66Å; R1757-E1761 PolarHBondContact NH2-OE1 2.92Å; R1757-E1761 WeakPolarHBondContact O-CB 3.34Å; R1757-E1761 WeakPolarHBondContact O-CG 3.18Å; R1757-E1761 PolarHBondContact O-N 2.85Å; Q1759-E1761 VanDerWaalsContact C-N 3.32Å; Q1759-E1761 PolarHBondContact O-N 3.05Å; E1761-D1765 PolarHBondContact O-N 3.31Å
1762	Y	76.4	Confident	74.2	Confident	65 Å²	65	72.7 Å²	72.7	26%	0.255	37%	0.37	S	S	.	.	H	α-helix	trans	-77.9	-45.7	174	174.4	-76.8	0	0	0	112.1	I1605 L1608 E1609 I1758 Q1759 D1760 Y1766	I1605-Y1762 HydrophobicContact CB-CE2 4.45Å; I1605-Y1762 HydrophobicContact CG2-CD2 4.22Å; I1605-Y1762 HydrophobicContact CG2-CE2 3.46Å; I1605-Y1762 VanDerWaalsContact CG2-CE2 3.46Å; I1605-Y1762 WeakPolarHBondContact O-CD2 3.3Å; I1605-Y1762 WeakPolarHBondContact O-CE2 3.39Å; L1608-Y1762 HydrophobicContact CB-CD2 3.97Å; E1609-Y1762 HydrophobicContact CB-CE2 4.06Å; I1758-Y1762 WeakPolarHBondContact O-CB 3.29Å; I1758-Y1762 PolarHBondContact O-N 3.44Å; I1758-Y1762 VanDerWaalsContact O-N 3.13Å; Q1759-Y1762 WeakPolarHBondContact O-CA 3.09Å; Q1759-Y1762 WeakPolarHBondContact O-CB 3.34Å; Q1759-Y1762 PolarHBondContact O-N 2.71Å; D1760-Y1762 VanDerWaalsContact C-N 3.31Å; D1760-Y1762 PolarHBondContact O-N 3.42Å; Y1762-Y1766 WeakPolarHBondContact O-CB 3.22Å; Y1762-Y1766 PolarHBondContact O-N 3.05Å
1763	E	71.9	Confident	72.9	Confident	83 Å²	83	67.2 Å²	67.2	39%	0.388	35%	0.35	S	S	.	.	H	α-helix	trans	-69.6	-42.5	-177.6	-72.9	169.2	175.7	0	0	110.4	Q1759 D1765 Y1766 E1767	Q1759-E1763 PolarHBondContact O-N 2.7Å; E1763-D1765 PolarHBondContact O-N 3.16Å; E1763-Y1766 WeakPolarHBondContact O-CB 3.32Å; E1763-Y1766 PolarHBondContact O-N 2.86Å; E1763-Y1766 VanDerWaalsContact O-N 3.11Å; E1763-E1767 WeakPolarHBondContact O-CG 3.45Å; E1763-E1767 PolarHBondContact O-N 3.19Å
1764	A	71	Confident	71.9	Confident	57 Å²	57	66.4 Å²	66.4	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-61	-43	174.5	0	0	0	0	0	113.5	D1760 Y1766 A1768	D1760-A1764 VanDerWaalsContact O-CB 3.31Å; D1760-A1764 WeakPolarHBondContact O-CB 3.33Å; D1760-A1764 PolarHBondContact O-N 3.07Å; D1760-A1764 VanDerWaalsContact O-N 3.07Å; A1764-Y1766 VanDerWaalsContact C-N 3.3Å; A1764-Y1766 PolarHBondContact O-N 3Å; A1764-A1768 WeakPolarHBondContact O-CB 3.33Å; A1764-A1768 PolarHBondContact O-N 3.49Å; A1764-A1768 VanDerWaalsContact O-N 3.08Å
1765	D	69.9	Low	71.3	Confident	66 Å²	66	67.3 Å²	67.3	35%	0.353	35%	0.352	S	S	.	.	H	α-helix	trans	-65	-34.2	174.6	-97.5	0.2	0	0	0	111.3	E1761 E1763 N1769	E1761-D1765 PolarHBondContact O-N 3.31Å; E1763-D1765 PolarHBondContact O-N 3.16Å; D1765-N1769 PolarHBondContact O-N 3.5Å; D1765-N1769 PolarHBondContact O-ND2 3.25Å
1766	Y	69.2	Low	70.1	Confident	92 Å²	92	69.7 Å²	69.7	36%	0.361	36%	0.362	S	S	.	.	H	α-helix	trans	-69.5	-47.4	177	-176.1	-91.1	0	0	0	112.2	I1605 Y1762 E1763 A1764 N1769 R1770	I1605-Y1766 HydrophobicContact CD1-CD2 4.15Å; Y1762-Y1766 WeakPolarHBondContact O-CB 3.22Å; Y1762-Y1766 PolarHBondContact O-N 3.05Å; E1763-Y1766 WeakPolarHBondContact O-CB 3.32Å; E1763-Y1766 PolarHBondContact O-N 2.86Å; E1763-Y1766 VanDerWaalsContact O-N 3.11Å; A1764-Y1766 VanDerWaalsContact C-N 3.3Å; A1764-Y1766 PolarHBondContact O-N 3Å; Y1766-N1769 PolarHBondContact O-N 3.18Å; Y1766-R1770 PolarHBondContact O-N 3.4Å
1767	E	68.5	Low	69.1	Low	91 Å²	91	67.1 Å²	67.1	43%	0.425	35%	0.345	S	S	.	.	H	α-helix	trans	-69.7	-40	-178	-70.4	-156.9	111.2	0	0	113.8	E1763 N1769 R1770 T1771	E1763-E1767 WeakPolarHBondContact O-CG 3.45Å; E1763-E1767 PolarHBondContact O-N 3.19Å; E1767-N1769 PolarHBondContact O-N 2.92Å; E1767-R1770 PolarHBondContact O-N 3.06Å; E1767-R1770 VanDerWaalsContact O-N 3.13Å; E1767-T1771 PolarHBondContact O-N 3.13Å; E1767-T1771 PolarHBondContact O-OG1 2.98Å
1768	A	65.6	Low	68.2	Low	58 Å²	58	69.6 Å²	69.6	48%	0.479	36%	0.355	S	S	.	.	H	α-helix	trans	-57.8	-37.7	172.7	0	0	0	0	0	111.1	A1764 T1771 A1772	A1764-A1768 WeakPolarHBondContact O-CB 3.33Å; A1764-A1768 PolarHBondContact O-N 3.49Å; A1764-A1768 VanDerWaalsContact O-N 3.08Å; A1768-T1771 PolarHBondContact O-OG1 3.45Å; A1768-A1772 VanDerWaalsContact O-CB 3.24Å; A1768-A1772 WeakPolarHBondContact O-CB 3.32Å; A1768-A1772 PolarHBondContact O-N 2.92Å
1769	N	65.2	Low	67.1	Low	44 Å²	44	73.7 Å²	73.7	24%	0.235	37%	0.373	C	S	.	.	H	α-helix	trans	-73.2	-40.4	173.6	-82.8	-78.2	0	0	0	112.9	A1601 D1765 Y1766 E1767 N1773	A1601-N1769 HydrophobicContact CB-CB 4.41Å; A1601-N1769 VanDerWaalsContact CB-CG 3.46Å; A1601-N1769 WeakPolarHBondContact CB-ND2 3.46Å; A1601-N1769 WeakPolarHBondContact CB-OD1 3.3Å; D1765-N1769 PolarHBondContact O-N 3.5Å; D1765-N1769 PolarHBondContact O-ND2 3.25Å; Y1766-N1769 PolarHBondContact O-N 3.18Å; E1767-N1769 PolarHBondContact O-N 2.92Å; N1769-N1773 WeakPolarHBondContact O-CB 3.41Å; N1769-N1773 PolarHBondContact O-N 3.03Å; N1769-N1773 VanDerWaalsContact O-N 3.1Å; N1769-N1773 PolarHBondContact O-ND2 3.17Å
1770	R	66.6	Low	66	Low	91 Å²	91	73.5 Å²	73.5	34%	0.343	37%	0.374	S	S	.	.	H	α-helix	trans	-60	-48.2	177.6	-179.2	174.2	167	117.4	-15.9	111.5	Y1766 E1767 Q1774	Y1766-R1770 PolarHBondContact O-N 3.4Å; E1767-R1770 PolarHBondContact O-N 3.06Å; E1767-R1770 VanDerWaalsContact O-N 3.13Å; R1770-Q1774 PolarHBondContact O-N 3.4Å; R1770-Q1774 VanDerWaalsContact O-N 3.14Å
1771	T	69.5	Low	65	Low	82 Å²	82	72.5 Å²	72.5	50%	0.503	37%	0.366	S	S	.	.	H	α-helix	trans	-67.2	-46.2	179.5	51.8	0	0	0	0	112.5	E1767 A1768 N1773 Q1774 V1775	E1767-T1771 PolarHBondContact O-N 3.13Å; E1767-T1771 PolarHBondContact O-OG1 2.98Å; A1768-T1771 PolarHBondContact O-OG1 3.45Å; T1771-N1773 VanDerWaalsContact C-N 3.3Å; T1771-N1773 PolarHBondContact O-N 3.47Å; T1771-Q1774 PolarHBondContact O-N 3.47Å; T1771-V1775 PolarHBondContact O-N 3.5Å
1772	A	61.8	Low	64.4	Low	44 Å²	44	76.4 Å²	76.4	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-59	-39.1	177.2	0	0	0	0	0	112.8	A1768 K1776	A1768-A1772 VanDerWaalsContact O-CB 3.24Å; A1768-A1772 WeakPolarHBondContact O-CB 3.32Å; A1768-A1772 PolarHBondContact O-N 2.92Å; A1772-K1776 PolarHBondContact O-N 2.98Å
1773	N	60.2	Low	63.3	Low	20 Å²	20	75.7 Å²	75.7	11%	0.107	39%	0.392	C	S	.	.	H	α-helix	trans	-73.3	-33	177.7	-76.8	-72.3	0	0	0	113	N1769 T1771 V1775 K1776 L1777	N1769-N1773 WeakPolarHBondContact O-CB 3.41Å; N1769-N1773 PolarHBondContact O-N 3.03Å; N1769-N1773 VanDerWaalsContact O-N 3.1Å; N1769-N1773 PolarHBondContact O-ND2 3.17Å; T1771-N1773 VanDerWaalsContact C-N 3.3Å; T1771-N1773 PolarHBondContact O-N 3.47Å; N1773-V1775 VanDerWaalsContact C-N 3.32Å; N1773-V1775 PolarHBondContact O-N 3.25Å; N1773-K1776 PolarHBondContact O-N 3.49Å; N1773-L1777 WeakPolarHBondContact O-CB 3.29Å; N1773-L1777 PolarHBondContact O-N 3.31Å
1774	Q	63.3	Low	62.1	Low	86 Å²	86	74.3 Å²	74.3	40%	0.402	39%	0.386	S	S	.	.	H	α-helix	trans	-64.7	-32	173.6	-79.2	-170.3	-2.2	0	0	113.7	R1770 T1771 R1778	R1770-Q1774 PolarHBondContact O-N 3.4Å; R1770-Q1774 VanDerWaalsContact O-N 3.14Å; T1771-Q1774 PolarHBondContact O-N 3.47Å; Q1774-R1778 PolarHBondContact O-N 3.23Å
1775	V	68.5	Low	61.8	Low	78 Å²	78	77.2 Å²	77.2	47%	0.473	39%	0.39	S	S	.	.	H	α-helix	trans	-71.3	-46.2	175.2	176.9	0	0	0	0	110.5	T1771 N1773 L1777 R1778 Q1779	T1771-V1775 PolarHBondContact O-N 3.5Å; N1773-V1775 VanDerWaalsContact C-N 3.32Å; N1773-V1775 PolarHBondContact O-N 3.25Å; V1775-L1777 VanDerWaalsContact C-N 3.3Å; V1775-L1777 PolarHBondContact O-N 3.35Å; V1775-R1778 PolarHBondContact O-N 3.11Å; V1775-Q1779 PolarHBondContact O-N 3.35Å
1776	K	57.6	Low	61.6	Low	61 Å²	61	79 Å²	79	27%	0.265	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-34	176.2	-84.6	154.4	167.1	166.7	0	113.1	I1594 E1597 A1772 N1773 Q1779 L1780	I1594-K1776 HydrophobicContact CD1-CB 4.05Å; I1594-K1776 HydrophobicContact CD1-CD 4.46Å; I1594-K1776 HydrophobicContact CD1-CG 4.19Å; I1594-K1776 HydrophobicContact CG1-CB 4.48Å; I1594-K1776 HydrophobicContact CG1-CD 4.06Å; I1594-K1776 HydrophobicContact CG1-CG 4.33Å; E1597-K1776 IonicContact OE1-NZ 3.49Å; E1597-K1776 IonicContact OE2-NZ 3.49Å; E1597-K1776 PolarHBondContact OE2-NZ 3.37Å; A1772-K1776 PolarHBondContact O-N 2.98Å; N1773-K1776 PolarHBondContact O-N 3.49Å; K1776-Q1779 PolarHBondContact O-N 2.85Å; K1776-L1780 PolarHBondContact O-N 2.67Å
1777	L	58.6	Low	60.7	Low	24 Å²	24	77 Å²	77	13%	0.126	40%	0.395	C	S	.	.	H	α-helix	trans	-63.6	-48.5	176.1	-165	71.6	0	0	0	112	I1571 L1574 N1773 V1775 Q1779 L1780 E1781	I1571-L1777 HydrophobicContact CB-CD1 4.26Å; I1571-L1777 HydrophobicContact CD1-CD1 4.47Å; I1571-L1777 HydrophobicContact CG1-CD1 3.84Å; I1571-L1777 HydrophobicContact CG1-CD2 3.92Å; I1571-L1777 HydrophobicContact CG1-CG 4.46Å; I1571-L1777 HydrophobicContact CG2-CD1 4.19Å; L1574-L1777 HydrophobicContact CD1-CD1 3.89Å; L1574-L1777 HydrophobicContact CD1-CG 4.37Å; N1773-L1777 WeakPolarHBondContact O-CB 3.29Å; N1773-L1777 PolarHBondContact O-N 3.31Å; V1775-L1777 VanDerWaalsContact C-N 3.3Å; V1775-L1777 PolarHBondContact O-N 3.35Å; L1777-Q1779 VanDerWaalsContact C-N 3.27Å; L1777-Q1779 PolarHBondContact O-N 3.19Å; L1777-L1780 WeakPolarHBondContact O-CB 3.23Å; L1777-L1780 PolarHBondContact O-N 2.92Å; L1777-E1781 WeakPolarHBondContact O-CG 3.31Å; L1777-E1781 PolarHBondContact O-N 2.93Å
1778	R	65.3	Low	60	Low	159 Å²	159	78.2 Å²	78.2	60%	0.6	40%	0.401	S	S	*	.	H	α-helix	trans	-59.2	-37.5	179.1	-95.5	-179	-80.7	-174.1	-9	112.8	Q1774 V1775 L1780 E1781 E1782	Q1774-R1778 PolarHBondContact O-N 3.23Å; V1775-R1778 PolarHBondContact O-N 3.11Å; R1778-L1780 VanDerWaalsContact C-N 3.35Å; R1778-E1781 PolarHBondContact O-N 3.17Å; R1778-E1782 WeakPolarHBondContact O-CB 3.44Å; R1778-E1782 PolarHBondContact O-N 2.99Å
1779	Q	56.3	Low	60	Low	117 Å²	117	81.3 Å²	81.3	55%	0.547	41%	0.406	S	S	.	.	H	α-helix	trans	-66.9	-35	176.5	-68.8	174.3	-28.6	0	0	112.4	V1775 K1776 L1777 A1783	V1775-Q1779 PolarHBondContact O-N 3.35Å; K1776-Q1779 PolarHBondContact O-N 2.85Å; L1777-Q1779 VanDerWaalsContact C-N 3.27Å; L1777-Q1779 PolarHBondContact O-N 3.19Å; Q1779-A1783 WeakPolarHBondContact O-CB 3.47Å; Q1779-A1783 PolarHBondContact O-N 3.26Å; Q1779-A1783 VanDerWaalsContact O-N 3.09Å
1780	L	51.7	Low	59.8	Low	65 Å²	65	84.9 Å²	84.9	34%	0.34	42%	0.421	S	S	.	.	H	α-helix	trans	-73.1	-37.6	173.7	-76.5	165.6	0	0	0	112.7	L1591 I1594 K1776 L1777 R1778 A1783 M1784	L1591-L1780 HydrophobicContact CD1-CD1 3.82Å; I1594-L1780 HydrophobicContact CD1-CD1 3.83Å; K1776-L1780 PolarHBondContact O-N 2.67Å; L1777-L1780 WeakPolarHBondContact O-CB 3.23Å; L1777-L1780 PolarHBondContact O-N 2.92Å; R1778-L1780 VanDerWaalsContact C-N 3.35Å; L1780-A1783 PolarHBondContact O-N 2.79Å; L1780-M1784 VanDerWaalsContact O-CB 3.3Å; L1780-M1784 WeakPolarHBondContact O-CB 3.44Å; L1780-M1784 PolarHBondContact O-N 2.69Å
1781	E	54.2	Low	59	Low	78 Å²	78	83.3 Å²	83.3	36%	0.364	42%	0.419	S	S	.	.	H	α-helix	trans	-62	-43.4	174.2	-70.5	171.7	151.5	0	0	111.4	L1574 L1777 R1778 M1784 H1785	L1574-E1781 HydrophobicContact CD1-CG 3.88Å; L1777-E1781 WeakPolarHBondContact O-CG 3.31Å; L1777-E1781 PolarHBondContact O-N 2.93Å; R1778-E1781 PolarHBondContact O-N 3.17Å; E1781-M1784 PolarHBondContact O-N 3.14Å; E1781-H1785 PolarHBondContact O-N 2.88Å
1782	E	60.8	Low	58.9	Low	144 Å²	144	82.8 Å²	82.8	67%	0.673	42%	0.416	S	S	*	.	H	α-helix	trans	-67.2	-41.9	177.8	-166	166.3	-130.9	0	0	112.1	R1778 H1785	R1778-E1782 WeakPolarHBondContact O-CB 3.44Å; R1778-E1782 PolarHBondContact O-N 2.99Å; E1782-H1785 PolarHBondContact O-N 3.46Å
1783	A	54.6	Low	59	Low	49 Å²	49	88.1 Å²	88.1	41%	0.405	43%	0.427	S	S	.	.	H	α-helix	trans	-64.5	-38.9	173.7	0	0	0	0	0	113	Q1779 L1780 H1785 I1786 V1787	Q1779-A1783 WeakPolarHBondContact O-CB 3.47Å; Q1779-A1783 PolarHBondContact O-N 3.26Å; Q1779-A1783 VanDerWaalsContact O-N 3.09Å; L1780-A1783 PolarHBondContact O-N 2.79Å; A1783-H1785 VanDerWaalsContact C-N 3.31Å; A1783-H1785 PolarHBondContact O-N 2.78Å; A1783-I1786 PolarHBondContact O-N 2.61Å; A1783-V1787 WeakPolarHBondContact O-CG2 3.29Å; A1783-V1787 PolarHBondContact O-N 3.07Å
1784	M	46.7	Very low	58.7	Low	55 Å²	55	92.2 Å²	92.2	27%	0.271	45%	0.448	S	S	.	.	H	α-helix	trans	-65.1	-32.7	178.7	-174.3	-178.7	62.8	0	0	112.3	L1574 L1780 E1781 V1787 Q1788	L1574-M1784 HydrophobicContact CD2-CE 3.58Å; L1574-M1784 HydrophobicContact CD2-SD 4.02Å; L1780-M1784 VanDerWaalsContact O-CB 3.3Å; L1780-M1784 WeakPolarHBondContact O-CB 3.44Å; L1780-M1784 PolarHBondContact O-N 2.69Å; E1781-M1784 PolarHBondContact O-N 3.14Å; M1784-V1787 PolarHBondContact O-N 2.84Å; M1784-Q1788 PolarHBondContact O-N 3.44Å
1785	H	63.5	Low	58.5	Low	118 Å²	118	92.6 Å²	92.6	55%	0.546	46%	0.456	S	S	.	.	H	α-helix	trans	-62.7	-46.7	175.8	-171.7	-70.4	0	0	0	112.1	E1781 E1782 A1783 V1787 Q1788 E1789	E1781-H1785 PolarHBondContact O-N 2.88Å; E1782-H1785 PolarHBondContact O-N 3.46Å; A1783-H1785 VanDerWaalsContact C-N 3.31Å; A1783-H1785 PolarHBondContact O-N 2.78Å; H1785-V1787 VanDerWaalsContact C-N 3.27Å; H1785-V1787 PolarHBondContact O-N 3.29Å; H1785-Q1788 PolarHBondContact O-N 3.33Å; H1785-E1789 IonicContact CE1-OE2 2.68Å; H1785-E1789 IonicContact ND1-OE2 3.22Å; H1785-E1789 PolarHBondContact O-N 3.29Å; H1785-E1789 VanDerWaalsContact O-N 3.11Å
1786	I	65.4	Low	58.5	Low	104 Å²	104	96.5 Å²	96.5	53%	0.533	46%	0.462	S	S	.	.	H	α-helix	trans	-58.9	-42.8	178.3	-61.3	169.3	0	0	0	110.4	A1783 E1789 E1790	A1783-I1786 PolarHBondContact O-N 2.61Å; I1786-E1789 PolarHBondContact O-N 3.28Å; I1786-E1790 PolarHBondContact O-N 2.9Å
1787	V	50.5	Low	58.8	Low	50 Å²	50	96.9 Å²	96.9	30%	0.303	47%	0.467	S	S	.	.	H	α-helix	trans	-69.1	-33.6	179.7	170.5	0	0	0	0	112.3	L1584 A1783 M1784 H1785 N1791	L1584-V1787 HydrophobicContact CD1-CG1 3.19Å; L1584-V1787 HydrophobicContact CD2-CG1 3.72Å; L1584-V1787 HydrophobicContact CG-CG1 4.09Å; A1783-V1787 WeakPolarHBondContact O-CG2 3.29Å; A1783-V1787 PolarHBondContact O-N 3.07Å; M1784-V1787 PolarHBondContact O-N 2.84Å; H1785-V1787 VanDerWaalsContact C-N 3.27Å; H1785-V1787 PolarHBondContact O-N 3.29Å; V1787-N1791 PolarHBondContact O-N 3.15Å; V1787-N1791 VanDerWaalsContact O-N 3.08Å
1788	Q	54.5	Low	58.8	Low	116 Å²	116	101.5 Å²	101.5	54%	0.542	49%	0.486	S	S	.	.	H	α-helix	trans	-66.1	-38.4	171	-77.7	-169.8	-31.5	0	0	112.3	M1784 H1785 N1791 T1792	M1784-Q1788 PolarHBondContact O-N 3.44Å; H1785-Q1788 PolarHBondContact O-N 3.33Å; Q1788-N1791 PolarHBondContact O-N 3.41Å; Q1788-T1792 WeakPolarHBondContact O-CG2 3.37Å; Q1788-T1792 PolarHBondContact O-N 3.14Å
1789	E	66	Low	58.9	Low	123 Å²	123	99.9 Å²	99.9	58%	0.575	49%	0.485	S	S	*	.	H	α-helix	trans	-60.1	-47.1	175	-74.6	-170.8	100.9	0	0	111.9	H1785 I1786 N1791 T1792 R1793	H1785-E1789 IonicContact CE1-OE2 2.68Å; H1785-E1789 IonicContact ND1-OE2 3.22Å; H1785-E1789 PolarHBondContact O-N 3.29Å; H1785-E1789 VanDerWaalsContact O-N 3.11Å; I1786-E1789 PolarHBondContact O-N 3.28Å; E1789-N1791 PolarHBondContact O-N 3.5Å; E1789-T1792 PolarHBondContact O-N 3.43Å; E1789-T1792 PolarHBondContact O-OG1 3.07Å; E1789-R1793 PolarHBondContact O-N 2.91Å; E1789-R1793 VanDerWaalsContact O-N 3.1Å
1790	E	60.3	Low	59.4	Low	119 Å²	119	100.4 Å²	100.4	56%	0.556	49%	0.488	S	S	*	.	H	α-helix	trans	-61.6	-42.9	175.8	-72.7	-153.3	119.1	0	0	112.9	I1786 T1792 R1793 L1794	I1786-E1790 PolarHBondContact O-N 2.9Å; E1790-T1792 PolarHBondContact O-N 2.76Å; E1790-R1793 WeakPolarHBondContact O-CA 3.34Å; E1790-R1793 WeakPolarHBondContact O-CB 3.45Å; E1790-R1793 PolarHBondContact O-N 3.09Å; E1790-L1794 PolarHBondContact O-N 2.69Å
1791	N	50.5	Low	59.4	Low	58 Å²	58	102.2 Å²	102.2	31%	0.31	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-36.9	177.3	-91.9	-9.8	0	0	0	112.6	V1787 Q1788 E1789 R1793 T1795	V1787-N1791 PolarHBondContact O-N 3.15Å; V1787-N1791 VanDerWaalsContact O-N 3.08Å; Q1788-N1791 PolarHBondContact O-N 3.41Å; E1789-N1791 PolarHBondContact O-N 3.5Å; N1791-R1793 VanDerWaalsContact C-N 3.26Å; N1791-R1793 PolarHBondContact O-N 3.07Å; N1791-T1795 WeakPolarHBondContact O-CB 3.1Å; N1791-T1795 PolarHBondContact O-N 2.98Å; N1791-T1795 PolarHBondContact O-OG1 3.16Å
1792	T	66.2	Low	59.8	Low	70 Å²	70	102.3 Å²	102.3	43%	0.429	50%	0.498	S	S	.	.	H	α-helix	trans	-68.7	-26.7	173.2	73.2	0	0	0	0	112.5	Q1788 E1789 E1790 R1796	Q1788-T1792 WeakPolarHBondContact O-CG2 3.37Å; Q1788-T1792 PolarHBondContact O-N 3.14Å; E1789-T1792 PolarHBondContact O-N 3.43Å; E1789-T1792 PolarHBondContact O-OG1 3.07Å; E1790-T1792 PolarHBondContact O-N 2.76Å; T1792-R1796 VanDerWaalsContact CB-NH1 3.33Å; T1792-R1796 WeakPolarHBondContact O-CG 3.48Å; T1792-R1796 PolarHBondContact O-N 3.28Å; T1792-R1796 PolarHBondContact O-NH1 2.94Å; T1792-R1796 PolarHBondContact OG1-NH1 3.5Å
1793	R	63.4	Low	60.1	Low	157 Å²	157	101 Å²	101	59%	0.592	49%	0.494	S	S	*	.	H	α-helix	trans	-71.5	-52.9	173.8	-179.1	-178.2	168.7	-160.5	-3.2	110.8	E1789 E1790 N1791 T1795 R1796 D1797	E1789-R1793 PolarHBondContact O-N 2.91Å; E1789-R1793 VanDerWaalsContact O-N 3.1Å; E1790-R1793 WeakPolarHBondContact O-CA 3.34Å; E1790-R1793 WeakPolarHBondContact O-CB 3.45Å; E1790-R1793 PolarHBondContact O-N 3.09Å; N1791-R1793 VanDerWaalsContact C-N 3.26Å; N1791-R1793 PolarHBondContact O-N 3.07Å; R1793-T1795 PolarHBondContact O-N 3.48Å; R1793-R1796 WeakPolarHBondContact O-CA 3.47Å; R1793-R1796 WeakPolarHBondContact O-CB 3.22Å; R1793-R1796 PolarHBondContact O-N 3.06Å; R1793-D1797 PolarHBondContact O-N 2.76Å
1794	L	53.8	Low	60.4	Low	106 Å²	106	103.8 Å²	103.8	56%	0.555	50%	0.499	S	S	*	.	H	α-helix	trans	-57.5	-34.1	177	-70.5	170.9	0	0	0	112.6	E1790 R1796 D1797 K1798	E1790-L1794 PolarHBondContact O-N 2.69Å; L1794-R1796 VanDerWaalsContact C-N 3.35Å; L1794-D1797 PolarHBondContact O-N 2.92Å; L1794-K1798 VanDerWaalsContact O-CB 3.28Å; L1794-K1798 WeakPolarHBondContact O-CB 3.15Å; L1794-K1798 PolarHBondContact O-N 2.73Å
1795	T	59.2	Low	60.8	Low	93 Å²	93	105 Å²	105	57%	0.571	51%	0.51	S	S	*	.	H	α-helix	trans	-66.2	-34.8	175	-56.3	0	0	0	0	112.4	N1791 R1793 H1799	N1791-T1795 WeakPolarHBondContact O-CB 3.1Å; N1791-T1795 PolarHBondContact O-N 2.98Å; N1791-T1795 PolarHBondContact O-OG1 3.16Å; R1793-T1795 PolarHBondContact O-N 3.48Å; T1795-H1799 PolarHBondContact O-N 3.12Å; T1795-H1799 VanDerWaalsContact O-N 3.13Å
1796	R	68.5	Low	60.9	Low	161 Å²	161	102.8 Å²	102.8	61%	0.608	51%	0.507	S	S	*	.	H	α-helix	trans	-71.4	-45.8	174.3	-67.9	172.1	-176.3	100.4	-10.5	111.1	T1792 R1793 L1794 K1798 H1799 Q1800	T1792-R1796 VanDerWaalsContact CB-NH1 3.33Å; T1792-R1796 WeakPolarHBondContact O-CG 3.48Å; T1792-R1796 PolarHBondContact O-N 3.28Å; T1792-R1796 PolarHBondContact O-NH1 2.94Å; T1792-R1796 PolarHBondContact OG1-NH1 3.5Å; R1793-R1796 WeakPolarHBondContact O-CA 3.47Å; R1793-R1796 WeakPolarHBondContact O-CB 3.22Å; R1793-R1796 PolarHBondContact O-N 3.06Å; L1794-R1796 VanDerWaalsContact C-N 3.35Å; R1796-K1798 VanDerWaalsContact C-N 3.3Å; R1796-K1798 PolarHBondContact O-N 2.95Å; R1796-H1799 PolarHBondContact O-N 2.97Å; R1796-H1799 VanDerWaalsContact O-N 3.1Å; R1796-Q1800 PolarHBondContact O-N 3.46Å
1797	D	65.1	Low	60.9	Low	68 Å²	68	101.9 Å²	101.9	36%	0.364	51%	0.507	S	S	.	.	H	α-helix	trans	-60.5	-41.4	178.4	-61.5	-17.6	0	0	0	110.6	R1793 L1794 Q1800 L1801	R1793-D1797 PolarHBondContact O-N 2.76Å; L1794-D1797 PolarHBondContact O-N 2.92Å; D1797-Q1800 PolarHBondContact O-N 3.09Å; D1797-L1801 WeakPolarHBondContact O-CG 3.08Å; D1797-L1801 PolarHBondContact O-N 2.98Å; D1797-L1801 VanDerWaalsContact O-N 3.12Å
1798	K	58.8	Low	61	Low	122 Å²	122	104.4 Å²	104.4	53%	0.53	52%	0.518	S	S	.	.	H	α-helix	trans	-58.5	-48.3	170.9	175.2	-178.8	165.3	-177.3	0	112.3	L1794 R1796 Q1800 L1801 E1802	L1794-K1798 VanDerWaalsContact O-CB 3.28Å; L1794-K1798 WeakPolarHBondContact O-CB 3.15Å; L1794-K1798 PolarHBondContact O-N 2.73Å; R1796-K1798 VanDerWaalsContact C-N 3.3Å; R1796-K1798 PolarHBondContact O-N 2.95Å; K1798-Q1800 PolarHBondContact O-N 3.46Å; K1798-L1801 WeakPolarHBondContact O-CB 3.17Å; K1798-L1801 PolarHBondContact O-N 3.34Å; K1798-L1801 VanDerWaalsContact O-N 3.13Å; K1798-E1802 WeakPolarHBondContact CE-OE1 3.33Å; K1798-E1802 HydrophobicContact CG-CG 4.42Å; K1798-E1802 IonicContact NZ-OE1 2.78Å; K1798-E1802 WeakPolarHBondContact O-CG 3.39Å; K1798-E1802 PolarHBondContact O-N 2.84Å
1799	H	67.7	Low	61	Low	124 Å²	124	103.4 Å²	103.4	57%	0.574	52%	0.516	S	S	*	.	H	α-helix	trans	-67.9	-27.9	-176.9	-140.9	38.6	0	0	0	112.2	T1795 R1796 E1802 L1803	T1795-H1799 PolarHBondContact O-N 3.12Å; T1795-H1799 VanDerWaalsContact O-N 3.13Å; R1796-H1799 PolarHBondContact O-N 2.97Å; R1796-H1799 VanDerWaalsContact O-N 3.1Å; H1799-E1802 IonicContact CE1-OE2 2.66Å; H1799-E1802 IonicContact CG-OE2 3.4Å; H1799-E1802 IonicContact ND1-OE2 3.68Å; H1799-E1802 PolarHBondContact ND1-OE2 3.17Å; H1799-E1802 PolarHBondContact O-N 3.48Å; H1799-L1803 WeakPolarHBondContact O-CG 3.09Å; H1799-L1803 PolarHBondContact O-N 3.48Å; H1799-L1803 VanDerWaalsContact O-N 3.17Å
1800	Q	66.7	Low	60.7	Low	129 Å²	129	102.9 Å²	102.9	60%	0.603	52%	0.517	S	S	*	.	H	α-helix	trans	-68.7	-40.2	171	-171.2	166.7	-23.4	0	0	112	R1796 D1797 K1798 L1803 E1804	R1796-Q1800 PolarHBondContact O-N 3.46Å; D1797-Q1800 PolarHBondContact O-N 3.09Å; K1798-Q1800 PolarHBondContact O-N 3.46Å; Q1800-L1803 WeakPolarHBondContact O-CB 3.04Å; Q1800-L1803 PolarHBondContact O-N 2.99Å; Q1800-E1804 PolarHBondContact O-N 3.44Å; Q1800-E1804 VanDerWaalsContact O-N 3.15Å
1801	L	51.3	Low	60.3	Low	103 Å²	103	103.9 Å²	103.9	54%	0.539	52%	0.521	S	S	.	.	H	α-helix	trans	-67.5	-35.6	172.3	-68.5	166.7	0	0	0	112.7	D1797 K1798 L1803 E1804 V1805	D1797-L1801 WeakPolarHBondContact O-CG 3.08Å; D1797-L1801 PolarHBondContact O-N 2.98Å; D1797-L1801 VanDerWaalsContact O-N 3.12Å; K1798-L1801 WeakPolarHBondContact O-CB 3.17Å; K1798-L1801 PolarHBondContact O-N 3.34Å; K1798-L1801 VanDerWaalsContact O-N 3.13Å; L1801-L1803 VanDerWaalsContact C-N 3.26Å; L1801-L1803 PolarHBondContact O-N 3.43Å; L1801-E1804 PolarHBondContact O-N 3.26Å; L1801-V1805 WeakPolarHBondContact O-CB 3.23Å; L1801-V1805 WeakPolarHBondContact O-CG2 3.38Å; L1801-V1805 PolarHBondContact O-N 2.85Å
1802	E	61.7	Low	60.1	Low	79 Å²	79	106.7 Å²	106.7	37%	0.369	54%	0.536	S	S	.	.	H	α-helix	trans	-64.5	-30.5	174.1	-73.1	173.3	153.4	0	0	112.1	K1798 H1799 S1806	K1798-E1802 WeakPolarHBondContact CE-OE1 3.33Å; K1798-E1802 HydrophobicContact CG-CG 4.42Å; K1798-E1802 IonicContact NZ-OE1 2.78Å; K1798-E1802 WeakPolarHBondContact O-CG 3.39Å; K1798-E1802 PolarHBondContact O-N 2.84Å; H1799-E1802 IonicContact CE1-OE2 2.66Å; H1799-E1802 IonicContact CG-OE2 3.4Å; H1799-E1802 IonicContact ND1-OE2 3.68Å; H1799-E1802 PolarHBondContact ND1-OE2 3.17Å; H1799-E1802 PolarHBondContact O-N 3.48Å; E1802-S1806 WeakPolarHBondContact O-CB 3.37Å; E1802-S1806 PolarHBondContact O-N 3.05Å; E1802-S1806 PolarHBondContact O-OG 2.87Å
1803	L	68.6	Low	59.3	Low	116 Å²	116	107.3 Å²	107.3	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-71.5	-42.9	171.2	-73.3	166.5	0	0	0	112.3	H1799 Q1800 L1801 S1806 T1807	H1799-L1803 WeakPolarHBondContact O-CG 3.09Å; H1799-L1803 PolarHBondContact O-N 3.48Å; H1799-L1803 VanDerWaalsContact O-N 3.17Å; Q1800-L1803 WeakPolarHBondContact O-CB 3.04Å; Q1800-L1803 PolarHBondContact O-N 2.99Å; L1801-L1803 VanDerWaalsContact C-N 3.26Å; L1801-L1803 PolarHBondContact O-N 3.43Å; L1803-S1806 WeakPolarHBondContact O-CB 3.14Å; L1803-S1806 PolarHBondContact O-N 3.44Å; L1803-S1806 VanDerWaalsContact O-N 3.15Å; L1803-T1807 PolarHBondContact O-N 3.06Å; L1803-T1807 PolarHBondContact O-OG1 2.83Å
1804	E	59	Low	58.5	Low	109 Å²	109	105.8 Å²	105.8	51%	0.509	55%	0.547	S	S	.	.	H	α-helix	trans	-62.2	-43.7	174.8	-71.6	-174.1	150.2	0	0	111.9	Q1800 L1801 S1806 T1807 L1808	Q1800-E1804 PolarHBondContact O-N 3.44Å; Q1800-E1804 VanDerWaalsContact O-N 3.15Å; L1801-E1804 PolarHBondContact O-N 3.26Å; E1804-S1806 VanDerWaalsContact C-N 3.29Å; E1804-S1806 PolarHBondContact O-N 3.47Å; E1804-T1807 WeakPolarHBondContact CA-OG1 2.93Å; E1804-T1807 PolarHBondContact O-N 2.97Å; E1804-T1807 PolarHBondContact O-OG1 3.28Å; E1804-L1808 WeakPolarHBondContact O-CG 3.47Å; E1804-L1808 PolarHBondContact O-N 2.88Å
1805	V	56.6	Low	57.8	Low	81 Å²	81	104.6 Å²	104.6	49%	0.491	55%	0.553	S	S	.	*	H	α-helix	trans	-62.9	-35.4	173.2	170.9	0	0	0	0	111.4	L1801 N1809	L1801-V1805 WeakPolarHBondContact O-CB 3.23Å; L1801-V1805 WeakPolarHBondContact O-CG2 3.38Å; L1801-V1805 PolarHBondContact O-N 2.85Å; V1805-N1809 PolarHBondContact O-N 2.68Å; V1805-N1809 PolarHBondContact O-ND2 2.96Å
1806	S	64.1	Low	56.6	Low	70 Å²	70	104.6 Å²	104.6	49%	0.49	56%	0.556	S	S	.	*	H	α-helix	trans	-67.7	-39.3	174.8	-63.1	0	0	0	0	112.2	E1802 L1803 E1804 L1810	E1802-S1806 WeakPolarHBondContact O-CB 3.37Å; E1802-S1806 PolarHBondContact O-N 3.05Å; E1802-S1806 PolarHBondContact O-OG 2.87Å; L1803-S1806 WeakPolarHBondContact O-CB 3.14Å; L1803-S1806 PolarHBondContact O-N 3.44Å; L1803-S1806 VanDerWaalsContact O-N 3.15Å; E1804-S1806 VanDerWaalsContact C-N 3.29Å; E1804-S1806 PolarHBondContact O-N 3.47Å; S1806-L1810 PolarHBondContact O-N 2.98Å; S1806-L1810 VanDerWaalsContact O-N 3.13Å
1807	T	65.9	Low	55	Low	85 Å²	85	104 Å²	104	52%	0.521	57%	0.565	S	S	.	*	H	α-helix	trans	-66.4	-41.6	173.9	42	0	0	0	0	112.6	L1803 E1804 N1809 L1810 E1811	L1803-T1807 PolarHBondContact O-N 3.06Å; L1803-T1807 PolarHBondContact O-OG1 2.83Å; E1804-T1807 WeakPolarHBondContact CA-OG1 2.93Å; E1804-T1807 PolarHBondContact O-N 2.97Å; E1804-T1807 PolarHBondContact O-OG1 3.28Å; T1807-N1809 PolarHBondContact O-N 3.38Å; T1807-L1810 WeakPolarHBondContact O-CA 3.45Å; T1807-L1810 WeakPolarHBondContact O-CB 3Å; T1807-L1810 PolarHBondContact O-N 3.15Å; T1807-L1810 VanDerWaalsContact O-N 3.08Å; T1807-E1811 PolarHBondContact O-N 2.85Å
1808	L	52.6	Low	53.8	Low	104 Å²	104	108.1 Å²	108.1	55%	0.545	59%	0.587	S	S	.	*	H	α-helix	trans	-65.2	-36.9	176.8	-71.9	167.7	0	0	0	112.5	E1804 L1810 E1811 L1812	E1804-L1808 WeakPolarHBondContact O-CG 3.47Å; E1804-L1808 PolarHBondContact O-N 2.88Å; L1808-L1810 VanDerWaalsContact C-N 3.29Å; L1808-L1810 PolarHBondContact O-N 3.29Å; L1808-E1811 PolarHBondContact O-N 3.35Å; L1808-L1812 PolarHBondContact O-N 2.82Å
1809	N	54.3	Low	53.3	Low	94 Å²	94	104.9 Å²	104.9	50%	0.503	59%	0.589	S	S	.	*	H	α-helix	trans	-66.5	-30.5	171.8	-82	-73.6	0	0	0	112.7	V1805 T1807 L1812 S1813	V1805-N1809 PolarHBondContact O-N 2.68Å; V1805-N1809 PolarHBondContact O-ND2 2.96Å; T1807-N1809 PolarHBondContact O-N 3.38Å; N1809-L1812 PolarHBondContact O-N 2.93Å; N1809-S1813 PolarHBondContact O-N 3.15Å
1810	L	60.5	Low	52.4	Low	113 Å²	113	103.2 Å²	103.2	59%	0.592	58%	0.584	S	S	*	*	H	α-helix	trans	-70.3	-39.5	174.3	-129.5	166.9	0	0	0	111.1	S1806 T1807 L1808 S1813 N1814	S1806-L1810 PolarHBondContact O-N 2.98Å; S1806-L1810 VanDerWaalsContact O-N 3.13Å; T1807-L1810 WeakPolarHBondContact O-CA 3.45Å; T1807-L1810 WeakPolarHBondContact O-CB 3Å; T1807-L1810 PolarHBondContact O-N 3.15Å; T1807-L1810 VanDerWaalsContact O-N 3.08Å; L1808-L1810 VanDerWaalsContact C-N 3.29Å; L1808-L1810 PolarHBondContact O-N 3.29Å; L1810-S1813 PolarHBondContact O-N 3.44Å; L1810-S1813 PolarHBondContact O-OG 3.05Å; L1810-N1814 PolarHBondContact O-ND2 3.26Å
1811	E	52.1	Low	51.7	Low	139 Å²	139	101.6 Å²	101.6	65%	0.65	58%	0.578	S	S	*	*	H	α-helix	trans	-63	-43.6	170.2	-67.2	-174.8	154.8	0	0	111.4	T1807 L1808 S1813 N1814	T1807-E1811 PolarHBondContact O-N 2.85Å; L1808-E1811 PolarHBondContact O-N 3.35Å; E1811-S1813 VanDerWaalsContact C-N 3.26Å; E1811-S1813 PolarHBondContact O-N 2.95Å; E1811-N1814 PolarHBondContact O-N 3.41Å; E1811-N1814 VanDerWaalsContact O-N 3.14Å
1812	L	45.8	Very low	51.9	Low	117 Å²	117	102.3 Å²	102.3	61%	0.613	58%	0.579	S	S	*	*	H	α-helix	trans	-58	-37.2	174.7	-145.6	88.1	0	0	0	112.5	L1808 N1809 N1814 A1815	L1808-L1812 PolarHBondContact O-N 2.82Å; N1809-L1812 PolarHBondContact O-N 2.93Å; L1812-N1814 PolarHBondContact O-N 2.97Å; L1812-N1814 VanDerWaalsContact O-N 3.16Å; L1812-A1815 WeakPolarHBondContact O-CB 3.38Å; L1812-A1815 PolarHBondContact O-N 3.21Å; L1812-A1815 VanDerWaalsContact O-N 3.12Å
1813	S	50.4	Low	52	Low	84 Å²	84	102.7 Å²	102.7	59%	0.587	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-13.9	-179.9	78	0	0	0	0	114.7	N1809 L1810 E1811	N1809-S1813 PolarHBondContact O-N 3.15Å; L1810-S1813 PolarHBondContact O-N 3.44Å; L1810-S1813 PolarHBondContact O-OG 3.05Å; E1811-S1813 VanDerWaalsContact C-N 3.26Å; E1811-S1813 PolarHBondContact O-N 2.95Å
1814	N	46.6	Very low	51.9	Low	124 Å²	124	99.7 Å²	99.7	66%	0.663	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-7.3	176.1	-69.8	-76.4	0	0	0	113.3	L1810 E1811 L1812 S1816	L1810-N1814 PolarHBondContact O-ND2 3.26Å; E1811-N1814 PolarHBondContact O-N 3.41Å; E1811-N1814 VanDerWaalsContact O-N 3.14Å; L1812-N1814 PolarHBondContact O-N 2.97Å; L1812-N1814 VanDerWaalsContact O-N 3.16Å; N1814-S1816 PolarHBondContact O-N 2.84Å; N1814-S1816 VanDerWaalsContact O-N 3.1Å
1815	A	38.2	Very low	51.7	Low	82 Å²	82	100.4 Å²	100.4	68%	0.678	57%	0.569	S	S	*	*			trans	-84.2	75.9	177.2	0	0	0	0	0	111.5	L1812	L1812-A1815 WeakPolarHBondContact O-CB 3.38Å; L1812-A1815 PolarHBondContact O-N 3.21Å; L1812-A1815 VanDerWaalsContact O-N 3.12Å
1816	S	34	Very low	52.2	Low	93 Å²	93	104.5 Å²	104.5	65%	0.65	58%	0.576	S	S	*	*			trans	-65.7	145.2	179.3	63.6	0	0	0	0	114	N1814	N1814-S1816 PolarHBondContact O-N 2.84Å; N1814-S1816 VanDerWaalsContact O-N 3.1Å
1817	N	35.6	Very low	52.3	Low	149 Å²	149	102.6 Å²	102.6	80%	0.797	56%	0.559	S	S	*	*			trans	83.5	89.7	168.5	-37.9	-64.3	0	0	0	117.4
1818	D	40.1	Very low	52	Low	154 Å²	154	102.9 Å²	102.9	82%	0.824	55%	0.554	S	S	*	*				-150.9	151.9	121	-133.2	-34.1	0	0	0	112.3
1819	G	47.6	Very low	51.9	Low	54 Å²	54	103.7 Å²	103.7	56%	0.557	56%	0.558	S	S	*	*			trans	-94	-18.7	-170.5	0	0	0	0	0	115.6	I1821	G1819-I1821 VanDerWaalsContact C-N 3.29Å; G1819-I1821 PolarHBondContact O-N 3.21Å
1820	D	48.1	Very low	52.5	Low	89 Å²	89	106.9 Å²	106.9	48%	0.476	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.8	34.7	-161	-75.3	0.1	0	0	0	114.4	S8 E9	S8-D1820 WeakPolarHBondContact CB-O 3.02Å; S8-D1820 PolarHBondContact OG-O 2.96Å; E9-D1820 HydrophobicContact CB-CB 4.29Å; E9-D1820 VanDerWaalsContact CD-C 3.42Å; E9-D1820 VanDerWaalsContact CD-O 3.27Å; E9-D1820 WeakPolarHBondContact CG-O 3.42Å
1821	I	52.3	Low	52.7	Low	94 Å²	94	105.1 Å²	105.1	48%	0.482	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.6	-25.6	173.3	-61.8	-179.9	0	0	0	112.1	D7 E9 G1819	D7-I1821 HydrophobicContact CB-CG1 4.37Å; E9-I1821 PolarHBondContact OE1-N 2.68Å; G1819-I1821 VanDerWaalsContact C-N 3.29Å; G1819-I1821 PolarHBondContact O-N 3.21Å
1822	E	55.7	Low	52.8	Low	118 Å²	118	104.2 Å²	104.2	55%	0.551	56%	0.556	S	S	*	*	H	α-helix	trans	-76.5	-34.4	-175.7	-153.7	-161.3	125.7	0	0	113.2	R1826	E1822-R1826 WeakPolarHBondContact O-CG 3.34Å; E1822-R1826 PolarHBondContact O-N 3.05Å; E1822-R1826 IonicContact OE1-CZ 3.28Å; E1822-R1826 IonicContact OE1-NE 3.67Å; E1822-R1826 PolarHBondContact OE1-NE 3.31Å; E1822-R1826 IonicContact OE1-NH2 3.4Å; E1822-R1826 PolarHBondContact OE1-NH2 3.29Å
1823	H	63.3	Low	53.1	Low	87 Å²	87	106.3 Å²	106.3	40%	0.403	56%	0.561	S	S	.	*	H	α-helix	trans	-80.8	-20.6	-173.7	-172.2	3.8	0	0	0	112.2	E9 V10 K1827	E9-H1823 VanDerWaalsContact OE1-C 3.28Å; E9-H1823 VanDerWaalsContact OE1-CA 3.24Å; E9-H1823 WeakPolarHBondContact OE1-CA 3.49Å; E9-H1823 WeakPolarHBondContact OE1-CB 3.07Å; E9-H1823 PolarHBondContact OE1-N 2.98Å; E9-H1823 WeakPolarHBondContact OE2-CB 3.25Å; V10-H1823 HydrophobicContact CG2-CB 4.36Å; V10-H1823 VanDerWaalsContact CG2-CD2 3.47Å; V10-H1823 WeakPolarHBondContact CG2-CD2 3.07Å; H1823-K1827 WeakPolarHBondContact CE1-CE 3.19Å; H1823-K1827 PolarHBondContact CE1-NZ 2.91Å; H1823-K1827 VanDerWaalsContact CE1-NZ 3.35Å; H1823-K1827 PolarHBondContact NE2-NZ 2.91Å; H1823-K1827 WeakPolarHBondContact O-CB 3.1Å; H1823-K1827 WeakPolarHBondContact O-CG 2.93Å; H1823-K1827 PolarHBondContact O-N 3.03Å; H1823-K1827 VanDerWaalsContact O-N 3.08Å
1824	K	67.4	Low	53.4	Low	54 Å²	54	105.2 Å²	105.2	24%	0.235	55%	0.553	C	S	.	*	H	α-helix	trans	-64	-54.1	172.1	-139.9	-166.5	-155.6	154.5	0	111.4	D7 S8 E9 R1826 K1827 E1828	D7-K1824 IonicContact OD1-NZ 2.82Å; D7-K1824 PolarHBondContact OD1-NZ 2.85Å; D7-K1824 IonicContact OD2-NZ 3.79Å; D7-K1824 PolarHBondContact OD2-NZ 3.14Å; S8-K1824 VanDerWaalsContact CB-CE 3.49Å; S8-K1824 WeakPolarHBondContact OG-CD 3.14Å; S8-K1824 WeakPolarHBondContact OG-CE 3.38Å; S8-K1824 PolarHBondContact OG-NZ 3.48Å; E9-K1824 HydrophobicContact CG-CB 3.7Å; E9-K1824 HydrophobicContact CG-CG 3.89Å; E9-K1824 PolarHBondContact OE1-N 3.3Å; K1824-R1826 VanDerWaalsContact C-N 3.33Å; K1824-R1826 PolarHBondContact O-N 3.44Å; K1824-K1827 WeakPolarHBondContact O-CA 3.38Å; K1824-K1827 WeakPolarHBondContact O-CB 3.03Å; K1824-K1827 PolarHBondContact O-N 2.88Å; K1824-E1828 PolarHBondContact O-N 3.05Å
1825	L	55.1	Low	53.4	Low	124 Å²	124	104.2 Å²	104.2	65%	0.649	55%	0.547	S	S	*	.	H	α-helix	trans	-61.8	-41.5	177.8	-67.8	169.8	0	0	0	111	K1827 E1828	L1825-K1827 PolarHBondContact O-N 3.46Å; L1825-E1828 PolarHBondContact O-N 3.48Å
1826	R	66.5	Low	53.6	Low	167 Å²	167	105.8 Å²	105.8	63%	0.63	54%	0.544	S	S	*	.	H	α-helix	trans	-62.9	-17.4	171.5	-70.2	179.2	-178.4	-85.4	5.4	114.2	E1822 K1824	E1822-R1826 WeakPolarHBondContact O-CG 3.34Å; E1822-R1826 PolarHBondContact O-N 3.05Å; E1822-R1826 IonicContact OE1-CZ 3.28Å; E1822-R1826 IonicContact OE1-NE 3.67Å; E1822-R1826 PolarHBondContact OE1-NE 3.31Å; E1822-R1826 IonicContact OE1-NH2 3.4Å; E1822-R1826 PolarHBondContact OE1-NH2 3.29Å; K1824-R1826 VanDerWaalsContact C-N 3.33Å; K1824-R1826 PolarHBondContact O-N 3.44Å
1827	K	67.4	Low	54.4	Low	29 Å²	29	104 Å²	104	13%	0.126	54%	0.535	C	S	.	.	H	α-helix	trans	-90.5	-32.7	178.6	-94.9	170.4	170	162.7	0	113.9	K11 H1823 K1824 L1825 K1830 I1831	K11-K1827 VanDerWaalsContact O-CD 3.31Å; K11-K1827 WeakPolarHBondContact O-CD 3.39Å; K11-K1827 WeakPolarHBondContact O-CE 3.34Å; K11-K1827 PolarHBondContact O-NZ 3.28Å; K11-K1827 VanDerWaalsContact O-NZ 3.12Å; H1823-K1827 WeakPolarHBondContact CE1-CE 3.19Å; H1823-K1827 PolarHBondContact CE1-NZ 2.91Å; H1823-K1827 VanDerWaalsContact CE1-NZ 3.35Å; H1823-K1827 PolarHBondContact NE2-NZ 2.91Å; H1823-K1827 WeakPolarHBondContact O-CB 3.1Å; H1823-K1827 WeakPolarHBondContact O-CG 2.93Å; H1823-K1827 PolarHBondContact O-N 3.03Å; H1823-K1827 VanDerWaalsContact O-N 3.08Å; K1824-K1827 WeakPolarHBondContact O-CA 3.38Å; K1824-K1827 WeakPolarHBondContact O-CB 3.03Å; K1824-K1827 PolarHBondContact O-N 2.88Å; L1825-K1827 PolarHBondContact O-N 3.46Å; K1827-K1830 WeakPolarHBondContact O-CB 3.25Å; K1827-K1830 PolarHBondContact O-N 2.78Å; K1827-K1830 VanDerWaalsContact O-N 3.17Å; K1827-I1831 PolarHBondContact O-N 2.59Å
1828	E	59.3	Low	54.9	Low	92 Å²	92	102.8 Å²	102.8	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-74.9	-39.9	-178.9	-57.1	-161.4	147.6	0	0	111.6	K11 K1824 L1825 K1830 I1831 I1832	K11-E1828 IonicContact NZ-OE1 2.76Å; K11-E1828 PolarHBondContact NZ-OE1 3.5Å; K1824-E1828 PolarHBondContact O-N 3.05Å; L1825-E1828 PolarHBondContact O-N 3.48Å; E1828-K1830 PolarHBondContact O-N 3.14Å; E1828-I1831 PolarHBondContact O-N 3.27Å; E1828-I1831 VanDerWaalsContact O-N 3.11Å; E1828-I1832 PolarHBondContact O-N 2.82Å
1829	L	50.3	Low	55	Low	121 Å²	121	103.4 Å²	103.4	63%	0.634	52%	0.519	S	S	*	.	H	α-helix	trans	-57.7	-19.7	167	-94.2	168	0	0	0	114.1
1830	K	65.5	Low	54.6	Low	160 Å²	160	107.1 Å²	107.1	70%	0.696	52%	0.522	S	S	*	.	H	α-helix	trans	-90.4	-24.5	178.6	-159.2	168.8	-175.1	174.8	0	113.3	K1827 E1828 S1834	K1827-K1830 WeakPolarHBondContact O-CB 3.25Å; K1827-K1830 PolarHBondContact O-N 2.78Å; K1827-K1830 VanDerWaalsContact O-N 3.17Å; E1828-K1830 PolarHBondContact O-N 3.14Å; K1830-S1834 PolarHBondContact O-N 3.13Å
1831	I	65.9	Low	54.2	Low	76 Å²	76	106.3 Å²	106.3	39%	0.39	53%	0.528	S	S	.	.	H	α-helix	trans	-77.3	-42.7	174.4	-71.3	175.4	0	0	0	111	K11 K1827 E1828 K1833 S1834 L1835	K11-I1831 HydrophobicContact CD-CD1 4.29Å; K1827-I1831 PolarHBondContact O-N 2.59Å; E1828-I1831 PolarHBondContact O-N 3.27Å; E1828-I1831 VanDerWaalsContact O-N 3.11Å; I1831-K1833 PolarHBondContact O-N 3.41Å; I1831-S1834 PolarHBondContact O-N 3.14Å; I1831-S1834 VanDerWaalsContact O-N 3.09Å; I1831-S1834 PolarHBondContact O-OG 3.09Å; I1831-L1835 HydrophobicContact CG2-CD1 3.99Å; I1831-L1835 PolarHBondContact O-N 3.19Å
1832	I	54.9	Low	53.4	Low	120 Å²	120	107.7 Å²	107.7	62%	0.615	54%	0.535	S	S	*	.	H	α-helix	trans	-61.3	-33.6	178.8	-62.8	172.3	0	0	0	110.8	E1828	E1828-I1832 PolarHBondContact O-N 2.82Å
1833	K	51.8	Low	52.4	Low	161 Å²	161	109.1 Å²	109.1	70%	0.7	55%	0.546	S	S	*	.	H	α-helix	trans	-78.7	-19.4	176.1	-70.6	-171	176.1	-171.3	0	115.1	I1831	I1831-K1833 PolarHBondContact O-N 3.41Å
1834	S	56.6	Low	51	Low	62 Å²	62	111.8 Å²	111.8	43%	0.434	56%	0.561	S	S	.	*	H	α-helix	trans	-82.4	-38.8	174.2	57.5	0	0	0	0	112.4	K1830 I1831 L1836 A1837 E1838	K1830-S1834 PolarHBondContact O-N 3.13Å; I1831-S1834 PolarHBondContact O-N 3.14Å; I1831-S1834 VanDerWaalsContact O-N 3.09Å; I1831-S1834 PolarHBondContact O-OG 3.09Å; S1834-L1836 PolarHBondContact O-N 3.2Å; S1834-A1837 PolarHBondContact O-N 3.39Å; S1834-E1838 WeakPolarHBondContact O-CB 3.35Å; S1834-E1838 PolarHBondContact O-N 2.9Å; S1834-E1838 VanDerWaalsContact O-N 3.11Å
1835	L	45.6	Very low	49.2	Very low	103 Å²	103	116.7 Å²	116.7	54%	0.539	59%	0.585	S	S	.	*	H	α-helix	trans	-65.3	-21.7	-178.9	-75	166.3	0	0	0	114.2	I1831	I1831-L1835 HydrophobicContact CG2-CD1 3.99Å; I1831-L1835 PolarHBondContact O-N 3.19Å
1836	L	43.1	Very low	47.9	Very low	115 Å²	115	118.4 Å²	118.4	60%	0.602	59%	0.594	S	S	*	*	H	α-helix	trans	-77.6	-48.9	177.4	-137.4	162.2	0	0	0	110.9	S1834 E1838 K1839	S1834-L1836 PolarHBondContact O-N 3.2Å; L1836-E1838 VanDerWaalsContact C-N 3.28Å; L1836-E1838 PolarHBondContact O-N 3.23Å; L1836-K1839 PolarHBondContact O-N 3.45Å
1837	A	50.9	Low	45.9	Very low	56 Å²	56	116.1 Å²	116.1	46%	0.463	60%	0.603	S	S	.	*	H	α-helix	trans	-65.3	-29	176.6	0	0	0	0	0	113.5	S1834 K1839 E1840 A1841	S1834-A1837 PolarHBondContact O-N 3.39Å; A1837-K1839 VanDerWaalsContact C-N 3.29Å; A1837-K1839 PolarHBondContact O-N 3.26Å; A1837-E1840 PolarHBondContact O-N 3.04Å; A1837-A1841 PolarHBondContact O-N 3.23Å; A1837-A1841 VanDerWaalsContact O-N 3.12Å
1838	E	46.5	Very low	44.1	Very low	122 Å²	122	118.4 Å²	118.4	57%	0.57	62%	0.623	S	S	*	*	H	α-helix	trans	-70.2	-23	179.8	-164.8	161.9	-144	0	0	113.1	S1834 L1836	S1834-E1838 WeakPolarHBondContact O-CB 3.35Å; S1834-E1838 PolarHBondContact O-N 2.9Å; S1834-E1838 VanDerWaalsContact O-N 3.11Å; L1836-E1838 VanDerWaalsContact C-N 3.28Å; L1836-E1838 PolarHBondContact O-N 3.23Å
1839	K	41.4	Very low	42.7	Very low	167 Å²	167	120.9 Å²	120.9	73%	0.726	64%	0.64	S	S	*	*	H	α-helix	trans	-80.5	-34.8	169.9	-92.2	-168.8	172	-174.5	0	113.5	L1836 A1837	L1836-K1839 PolarHBondContact O-N 3.45Å; A1837-K1839 VanDerWaalsContact C-N 3.29Å; A1837-K1839 PolarHBondContact O-N 3.26Å
1840	E	38.4	Very low	42	Very low	133 Å²	133	120.4 Å²	120.4	62%	0.621	64%	0.643	S	S	*	*	H	α-helix	trans	-73.8	-32.9	-178.7	-65.4	177.8	143.3	0	0	111.8	A1837 L1842	A1837-E1840 PolarHBondContact O-N 3.04Å; E1840-L1842 PolarHBondContact O-N 3.13Å
1841	A	39.6	Very low	40.1	Very low	71 Å²	71	117.9 Å²	117.9	59%	0.587	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-73.1	-21	176.8	0	0	0	0	0	114.5	A1837 I1843	A1837-A1841 PolarHBondContact O-N 3.23Å; A1837-A1841 VanDerWaalsContact O-N 3.12Å; A1841-I1843 PolarHBondContact O-N 3.17Å
1842	L	36.9	Very low	38.3	Very low	123 Å²	123	121.6 Å²	121.6	64%	0.644	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-84.3	-4.2	-171.8	-105.7	168.9	0	0	0	115.1	E1840	E1840-L1842 PolarHBondContact O-N 3.13Å
1843	I	34.7	Very low	37.1	Very low	149 Å²	149	118.9 Å²	118.9	76%	0.764	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-95.7	-14.4	-176.8	-68.8	176.2	0	0	0	112.6	A1841	A1841-I1843 PolarHBondContact O-N 3.17Å
1844	I	33.1	Very low	36.3	Very low	142 Å²	142	119.6 Å²	119.6	73%	0.728	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	-24.1	-162.9	-70	177.8	0	0	0	115.3
1845	E	29.3	Very low	35.5	Very low	157 Å²	157	121.2 Å²	121.2	73%	0.734	68%	0.676	S	S	*	*			trans	-132.5	32.6	-166.3	-134.5	170.1	-161.5	0	0	117.3
1846	L	28.1	Very low	35.5	Very low	160 Å²	160	122.6 Å²	122.6	84%	0.838	68%	0.68	S	S	*	*	S	Bend	trans	-131.1	102.2	159.8	-73.3	175.1	0	0	0	108.9
1847	S	25.4	Very low	35.5	Very low	119 Å²	119	121 Å²	121	83%	0.832	67%	0.67	S	S	*	*	S	Bend	cis	-140.3	166.9	9.3	58.6	0	0	0	0	112.7
1848	S	29.2	Very low	35.4	Very low	78 Å²	78	125.1 Å²	125.1	55%	0.545	68%	0.678	S	S	.	*			trans	-138.1	159.7	-172.7	59.3	0	0	0	0	113.8
1849	N	30.5	Very low	35.5	Very low	144 Å²	144	127.5 Å²	127.5	77%	0.77	69%	0.686	S	S	*	*			trans	81.1	157.3	162.1	-55.1	-44.2	0	0	0	117.1
1850	P	34.1	Very low	35.7	Very low	110 Å²	110	125.2 Å²	125.2	71%	0.714	68%	0.682	S	S	*	*				-141.5	-172.1	-83.6	34.5	-12.2	0	0	0	115.7
1851	S	26.5	Very low	36.1	Very low	108 Å²	108	126.9 Å²	126.9	76%	0.755	68%	0.682	S	S	*	*			trans	62.8	105	154.6	55.9	0	0	0	0	119.5
1852	D	27.6	Very low	37.1	Very low	154 Å²	154	127.6 Å²	127.6	82%	0.824	68%	0.676	S	S	*	*				-153.5	-175.8	104.8	-137	-34.7	0	0	0	111.5
1853	S	29.5	Very low	37.8	Very low	63 Å²	63	128.9 Å²	128.9	44%	0.441	67%	0.672	S	S	.	*			trans	70.4	49.3	169.5	78.7	0	0	0	0	120.3	S1855	S1853-S1855 PolarHBondContact O-N 3.44Å
1854	Q	34.7	Very low	38.9	Very low	175 Å²	175	125.2 Å²	125.2	82%	0.818	66%	0.657	S	S	*	*	H	α-helix	trans	-59	-8.7	179.1	-78.5	-170.4	-15.7	0	0	118.3
1855	S	41.4	Very low	40.4	Very low	97 Å²	97	123.2 Å²	123.2	68%	0.678	65%	0.648	S	S	*	*	H	α-helix	trans	-82.4	-30.5	-177.1	62.8	0	0	0	0	114.7	S1853	S1853-S1855 PolarHBondContact O-N 3.44Å
1856	Q	43.7	Very low	42.1	Very low	132 Å²	132	120.5 Å²	120.5	62%	0.617	64%	0.635	S	S	*	*	H	α-helix	trans	-84.5	-29.8	179.4	-75.8	165.4	-55.7	0	0	112.3	K1858 K1859 L1860	Q1856-K1858 PolarHBondContact O-N 2.95Å; Q1856-K1859 PolarHBondContact O-N 3.39Å; Q1856-L1860 PolarHBondContact O-N 2.99Å
1857	I	43.7	Very low	43.5	Very low	80 Å²	80	116.2 Å²	116.2	41%	0.41	61%	0.613	S	S	.	*	H	α-helix	trans	-57.9	-32.9	177.9	-62.5	176.4	0	0	0	111.8	L1860 R1861	I1857-L1860 PolarHBondContact O-N 3.18Å; I1857-R1861 PolarHBondContact O-N 3.44Å; I1857-R1861 VanDerWaalsContact O-N 3.13Å
1858	K	48.7	Very low	45.4	Very low	144 Å²	144	115 Å²	115	63%	0.626	60%	0.597	S	S	*	*	H	α-helix	trans	-67.4	-49.6	-179.8	-166.1	172	-177.9	-179.5	0	112.6	Q1856 L1860 R1861 D1862	Q1856-K1858 PolarHBondContact O-N 2.95Å; K1858-L1860 PolarHBondContact O-N 2.98Å; K1858-L1860 VanDerWaalsContact O-N 3.14Å; K1858-R1861 PolarHBondContact O-N 3.13Å; K1858-D1862 VanDerWaalsContact O-CG 3.27Å; K1858-D1862 PolarHBondContact O-N 3.46Å
1859	K	48.9	Very low	47.3	Very low	171 Å²	171	118.1 Å²	118.1	74%	0.743	60%	0.603	S	S	*	*	H	α-helix	trans	-63.5	-19.2	176.9	-73.3	-169.8	173.7	-172.2	0	114	Q1856	Q1856-K1859 PolarHBondContact O-N 3.39Å
1860	L	44.9	Very low	49.1	Very low	120 Å²	120	116.7 Å²	116.7	63%	0.628	59%	0.594	S	S	*	*	H	α-helix	trans	-87.7	-22.1	174.3	-70.2	170.3	0	0	0	113	Q1856 I1857 K1858 V1864	Q1856-L1860 PolarHBondContact O-N 2.99Å; I1857-L1860 PolarHBondContact O-N 3.18Å; K1858-L1860 PolarHBondContact O-N 2.98Å; K1858-L1860 VanDerWaalsContact O-N 3.14Å; L1860-V1864 VanDerWaalsContact O-CG2 3.29Å; L1860-V1864 WeakPolarHBondContact O-CG2 3.49Å; L1860-V1864 PolarHBondContact O-N 3.42Å
1861	R	48.7	Very low	50.6	Low	168 Å²	168	114.7 Å²	114.7	63%	0.634	58%	0.578	S	S	*	*	H	α-helix	trans	-74.4	-52.3	170.6	-74.5	-178.5	-179.1	-166.5	-2.4	111.3	I1857 K1858 R1863 V1864 D1865	I1857-R1861 PolarHBondContact O-N 3.44Å; I1857-R1861 VanDerWaalsContact O-N 3.13Å; K1858-R1861 PolarHBondContact O-N 3.13Å; R1861-R1863 PolarHBondContact O-N 2.94Å; R1861-V1864 PolarHBondContact O-N 3.12Å; R1861-D1865 VanDerWaalsContact O-CG 3.29Å; R1861-D1865 PolarHBondContact O-N 3.31Å
1862	D	60.4	Low	52.6	Low	85 Å²	85	113.4 Å²	113.4	46%	0.455	56%	0.56	S	S	.	*	H	α-helix	trans	-53.1	-25.7	-179.8	-49.2	-21.6	0	0	0	112.4	K1858	K1858-D1862 VanDerWaalsContact O-CG 3.27Å; K1858-D1862 PolarHBondContact O-N 3.46Å
1863	R	51.3	Low	54.8	Low	150 Å²	150	110.5 Å²	110.5	57%	0.566	54%	0.543	S	S	*	.	H	α-helix	trans	-96.4	-14.3	178.7	-171.3	52.9	174.7	178.3	4.7	115.1	R1861 E1866	R1861-R1863 PolarHBondContact O-N 2.94Å; R1863-E1866 WeakPolarHBondContact CD-OE2 3.43Å; R1863-E1866 IonicContact CZ-OE2 3.57Å; R1863-E1866 IonicContact NE-OE2 3.73Å; R1863-E1866 IonicContact NH1-OE2 2.67Å; R1863-E1866 PolarHBondContact NH1-OE2 2.92Å
1864	V	57.4	Low	56.5	Low	73 Å²	73	110.9 Å²	110.9	44%	0.442	54%	0.54	S	S	.	.	H	α-helix	trans	-82.3	-40.5	168.1	165.2	0	0	0	0	109.7	L1860 R1861 E1866 L1867 D1868	L1860-V1864 VanDerWaalsContact O-CG2 3.29Å; L1860-V1864 WeakPolarHBondContact O-CG2 3.49Å; L1860-V1864 PolarHBondContact O-N 3.42Å; R1861-V1864 PolarHBondContact O-N 3.12Å; V1864-E1866 VanDerWaalsContact C-N 3.27Å; V1864-E1866 PolarHBondContact O-N 3.46Å; V1864-L1867 WeakPolarHBondContact O-CA 3.47Å; V1864-L1867 WeakPolarHBondContact O-CB 3.25Å; V1864-L1867 PolarHBondContact O-N 2.73Å; V1864-D1868 PolarHBondContact O-N 3.22Å
1865	D	65.3	Low	58.2	Low	100 Å²	100	105.6 Å²	105.6	54%	0.535	52%	0.517	S	S	.	.	H	α-helix	trans	-57.2	-39.7	178	-57.7	-29.6	0	0	0	111.5	R1861 L1867 D1868 E1869	R1861-D1865 VanDerWaalsContact O-CG 3.29Å; R1861-D1865 PolarHBondContact O-N 3.31Å; D1865-L1867 VanDerWaalsContact C-N 3.31Å; D1865-L1867 PolarHBondContact O-N 3.48Å; D1865-D1868 PolarHBondContact O-N 3.45Å; D1865-E1869 PolarHBondContact O-N 3Å
1866	E	64	Low	59.8	Low	99 Å²	99	108.6 Å²	108.6	46%	0.463	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-27.6	172.7	-73.2	-178.1	141.1	0	0	114.4	R1863 V1864	R1863-E1866 WeakPolarHBondContact CD-OE2 3.43Å; R1863-E1866 IonicContact CZ-OE2 3.57Å; R1863-E1866 IonicContact NE-OE2 3.73Å; R1863-E1866 IonicContact NH1-OE2 2.67Å; R1863-E1866 PolarHBondContact NH1-OE2 2.92Å; V1864-E1866 VanDerWaalsContact C-N 3.27Å; V1864-E1866 PolarHBondContact O-N 3.46Å
1867	L	58.6	Low	61.2	Low	70 Å²	70	107.7 Å²	107.7	37%	0.366	51%	0.51	S	S	.	.	H	α-helix	trans	-85.5	-33.3	179.8	-70.4	170.3	0	0	0	111.6	V1864 D1865 L1870 N1871	V1864-L1867 WeakPolarHBondContact O-CA 3.47Å; V1864-L1867 WeakPolarHBondContact O-CB 3.25Å; V1864-L1867 PolarHBondContact O-N 2.73Å; D1865-L1867 VanDerWaalsContact C-N 3.31Å; D1865-L1867 PolarHBondContact O-N 3.48Å; L1867-L1870 PolarHBondContact O-N 3.39Å; L1867-N1871 PolarHBondContact O-N 2.91Å; L1867-N1871 VanDerWaalsContact O-N 3.07Å; L1867-N1871 PolarHBondContact O-ND2 3.19Å
1868	D	65.1	Low	62.3	Low	93 Å²	93	110.1 Å²	110.1	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-68.8	-36.3	173.8	-76.9	-26.6	0	0	0	111.9	V1864 D1865 L1870 N1871 E1872	V1864-D1868 PolarHBondContact O-N 3.22Å; D1865-D1868 PolarHBondContact O-N 3.45Å; D1868-L1870 PolarHBondContact O-N 3.18Å; D1868-N1871 WeakPolarHBondContact O-CB 3.22Å; D1868-N1871 PolarHBondContact O-N 3.32Å; D1868-E1872 PolarHBondContact O-N 3.4Å
1869	E	68.5	Low	63.5	Low	145 Å²	145	111.6 Å²	111.6	68%	0.678	52%	0.519	S	S	*	.	H	α-helix	trans	-65.2	-36.1	175.2	-165.4	170.9	-131.3	0	0	112.6	D1865 E1872 I1873	D1865-E1869 PolarHBondContact O-N 3Å; E1869-E1872 WeakPolarHBondContact O-CB 3.41Å; E1869-E1872 PolarHBondContact O-N 3.14Å; E1869-I1873 PolarHBondContact O-N 3.35Å
1870	L	69.2	Low	64.7	Low	113 Å²	113	106 Å²	106	59%	0.592	50%	0.504	S	S	*	.	H	α-helix	trans	-68.5	-38.1	171.4	-81	167.8	0	0	0	112.6	L1867 D1868 E1872 I1873 L1874	L1867-L1870 PolarHBondContact O-N 3.39Å; D1868-L1870 PolarHBondContact O-N 3.18Å; L1870-E1872 VanDerWaalsContact C-N 3.31Å; L1870-E1872 PolarHBondContact O-N 3.24Å; L1870-I1873 PolarHBondContact O-N 3.21Å; L1870-L1874 PolarHBondContact O-N 2.93Å
1871	N	63.8	Low	66	Low	68 Å²	68	104.1 Å²	104.1	36%	0.364	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-35.3	172.9	-89.6	-43.4	0	0	0	112.4	L1867 D1868 L1874 N1875	L1867-N1871 PolarHBondContact O-N 2.91Å; L1867-N1871 VanDerWaalsContact O-N 3.07Å; L1867-N1871 PolarHBondContact O-ND2 3.19Å; D1868-N1871 WeakPolarHBondContact O-CB 3.22Å; D1868-N1871 PolarHBondContact O-N 3.32Å; N1871-L1874 PolarHBondContact O-N 3.38Å; N1871-N1875 WeakPolarHBondContact O-CB 3.42Å; N1871-N1875 PolarHBondContact O-N 3.22Å; N1871-N1875 PolarHBondContact O-ND2 2.95Å
1872	E	69.9	Low	67.2	Low	82 Å²	82	100.5 Å²	100.5	38%	0.383	49%	0.485	S	S	.	.	H	α-helix	trans	-58.6	-50.6	173.2	-113.3	-73.6	131.8	0	0	111	D1868 E1869 L1870 L1874 N1875 R1876	D1868-E1872 PolarHBondContact O-N 3.4Å; E1869-E1872 WeakPolarHBondContact O-CB 3.41Å; E1869-E1872 PolarHBondContact O-N 3.14Å; L1870-E1872 VanDerWaalsContact C-N 3.31Å; L1870-E1872 PolarHBondContact O-N 3.24Å; E1872-L1874 PolarHBondContact O-N 2.88Å; E1872-N1875 PolarHBondContact O-N 3.35Å; E1872-R1876 WeakPolarHBondContact O-CG 3.11Å; E1872-R1876 PolarHBondContact O-N 3.5Å; E1872-R1876 IonicContact OE2-CZ 3.66Å; E1872-R1876 IonicContact OE2-NE 3.12Å; E1872-R1876 PolarHBondContact OE2-NE 3.33Å; E1872-R1876 IonicContact OE2-NH2 3.58Å; E1872-R1876 PolarHBondContact OE2-NH2 3.01Å
1873	I	72.9	Confident	68	Low	93 Å²	93	100 Å²	100	48%	0.477	49%	0.488	S	S	.	.	H	α-helix	trans	-60.8	-43.8	177.9	-64.1	169.8	0	0	0	111.2	E1869 L1870 N1875 R1876 Q1877	E1869-I1873 PolarHBondContact O-N 3.35Å; L1870-I1873 PolarHBondContact O-N 3.21Å; I1873-N1875 VanDerWaalsContact C-N 3.34Å; I1873-N1875 PolarHBondContact O-N 3.38Å; I1873-R1876 PolarHBondContact O-N 2.85Å; I1873-Q1877 PolarHBondContact O-N 3.31Å
1874	L	66.5	Low	69.1	Low	70 Å²	70	97 Å²	97	37%	0.366	48%	0.483	S	S	.	.	H	α-helix	trans	-61.6	-41.6	178.9	-144.2	72.6	0	0	0	112	L1870 N1871 E1872 R1876 Q1877 K1878 M2094	L1870-L1874 PolarHBondContact O-N 2.93Å; N1871-L1874 PolarHBondContact O-N 3.38Å; E1872-L1874 PolarHBondContact O-N 2.88Å; L1874-R1876 VanDerWaalsContact C-N 3.34Å; L1874-R1876 PolarHBondContact O-N 2.93Å; L1874-Q1877 PolarHBondContact O-N 3.26Å; L1874-K1878 WeakPolarHBondContact O-CB 3.27Å; L1874-K1878 PolarHBondContact O-N 3.14Å; L1874-M2094 HydrophobicContact CD1-CE 3.96Å; L1874-M2094 HydrophobicContact CD1-SD 3.64Å; L1874-M2094 HydrophobicContact CD2-SD 4.25Å; L1874-M2094 HydrophobicContact CG-SD 4.09Å
1875	N	69.5	Low	70	Confident	64 Å²	64	95 Å²	95	34%	0.342	47%	0.47	S	S	.	.	H	α-helix	trans	-69.5	-29.4	177.2	-80.7	-68.2	0	0	0	112.8	N1871 E1872 I1873 R1879	N1871-N1875 WeakPolarHBondContact O-CB 3.42Å; N1871-N1875 PolarHBondContact O-N 3.22Å; N1871-N1875 PolarHBondContact O-ND2 2.95Å; E1872-N1875 PolarHBondContact O-N 3.35Å; I1873-N1875 VanDerWaalsContact C-N 3.34Å; I1873-N1875 PolarHBondContact O-N 3.38Å; N1875-R1879 WeakPolarHBondContact O-CG 3.25Å; N1875-R1879 PolarHBondContact O-N 3.29Å
1876	R	74.7	Confident	70.6	Confident	161 Å²	161	94 Å²	94	61%	0.608	47%	0.465	S	S	*	.	H	α-helix	trans	-66.9	-45.7	173.3	-67.6	171.8	-168.8	-165.8	5.7	111.8	E1872 I1873 L1874 K1878 R1879 A1880	E1872-R1876 WeakPolarHBondContact O-CG 3.11Å; E1872-R1876 PolarHBondContact O-N 3.5Å; E1872-R1876 IonicContact OE2-CZ 3.66Å; E1872-R1876 IonicContact OE2-NE 3.12Å; E1872-R1876 PolarHBondContact OE2-NE 3.33Å; E1872-R1876 IonicContact OE2-NH2 3.58Å; E1872-R1876 PolarHBondContact OE2-NH2 3.01Å; I1873-R1876 PolarHBondContact O-N 2.85Å; L1874-R1876 VanDerWaalsContact C-N 3.34Å; L1874-R1876 PolarHBondContact O-N 2.93Å; R1876-K1878 VanDerWaalsContact C-N 3.34Å; R1876-K1878 PolarHBondContact O-N 3.35Å; R1876-R1879 PolarHBondContact O-N 3.35Å; R1876-A1880 PolarHBondContact O-N 2.94Å
1877	Q	72.5	Confident	71.2	Confident	113 Å²	113	95.3 Å²	95.3	53%	0.528	47%	0.47	S	S	.	.	H	α-helix	trans	-62.3	-41.1	174.1	-74.6	-172.3	-23.5	0	0	112.2	I1873 L1874 R1879 A1880 L1881	I1873-Q1877 PolarHBondContact O-N 3.31Å; L1874-Q1877 PolarHBondContact O-N 3.26Å; Q1877-R1879 VanDerWaalsContact C-N 3.32Å; Q1877-R1879 PolarHBondContact O-N 3.37Å; Q1877-A1880 PolarHBondContact O-N 3.39Å; Q1877-L1881 PolarHBondContact O-N 3.22Å
1878	K	68.6	Low	72.1	Confident	130 Å²	130	94.3 Å²	94.3	57%	0.565	47%	0.465	S	S	*	.	H	α-helix	trans	-59	-39.2	174.8	-177.1	-176.8	173.5	-172.1	0	112.8	L1874 R1876 Q1882	L1874-K1878 WeakPolarHBondContact O-CB 3.27Å; L1874-K1878 PolarHBondContact O-N 3.14Å; R1876-K1878 VanDerWaalsContact C-N 3.34Å; R1876-K1878 PolarHBondContact O-N 3.35Å; K1878-Q1882 WeakPolarHBondContact O-CB 3.44Å; K1878-Q1882 PolarHBondContact O-N 3.26Å; K1878-Q1882 VanDerWaalsContact O-N 3.17Å
1879	R	72.4	Confident	72.7	Confident	176 Å²	176	94.4 Å²	94.4	66%	0.664	46%	0.462	S	S	*	.	H	α-helix	trans	-68.2	-33.7	176.2	-73.5	178.3	-166.3	168.9	8.8	113	N1875 R1876 Q1877 Q1882 S1883	N1875-R1879 WeakPolarHBondContact O-CG 3.25Å; N1875-R1879 PolarHBondContact O-N 3.29Å; R1876-R1879 PolarHBondContact O-N 3.35Å; Q1877-R1879 VanDerWaalsContact C-N 3.32Å; Q1877-R1879 PolarHBondContact O-N 3.37Å; R1879-Q1882 PolarHBondContact O-N 3.45Å; R1879-S1883 PolarHBondContact O-N 3.3Å
1880	A	75.2	Confident	73.4	Confident	53 Å²	53	94.6 Å²	94.6	44%	0.438	46%	0.463	S	S	.	.	H	α-helix	trans	-64.3	-54.5	175.9	0	0	0	0	0	111.3	R1876 Q1877 Q1882 S1883 D1884	R1876-A1880 PolarHBondContact O-N 2.94Å; Q1877-A1880 PolarHBondContact O-N 3.39Å; A1880-Q1882 PolarHBondContact O-N 3.44Å; A1880-Q1882 VanDerWaalsContact O-N 3.13Å; A1880-S1883 WeakPolarHBondContact O-CB 3.32Å; A1880-S1883 PolarHBondContact O-N 3.19Å; A1880-D1884 PolarHBondContact O-N 3.06Å
1881	L	72.2	Confident	73.9	Confident	80 Å²	80	94.9 Å²	94.9	42%	0.419	46%	0.462	S	S	.	.	H	α-helix	trans	-60.9	-24.1	177.2	-71.4	169.3	0	0	0	113.7	Q1877 L1885	Q1877-L1881 PolarHBondContact O-N 3.22Å; L1881-L1885 PolarHBondContact O-N 3.43Å
1882	Q	72.7	Confident	74.9	Confident	92 Å²	92	93.1 Å²	93.1	43%	0.43	45%	0.452	S	S	.	.	H	α-helix	trans	-71.4	-40.6	172.2	-164.3	76.2	59.5	0	0	111.3	K1878 R1879 A1880 L1885 D1886	K1878-Q1882 WeakPolarHBondContact O-CB 3.44Å; K1878-Q1882 PolarHBondContact O-N 3.26Å; K1878-Q1882 VanDerWaalsContact O-N 3.17Å; R1879-Q1882 PolarHBondContact O-N 3.45Å; A1880-Q1882 PolarHBondContact O-N 3.44Å; A1880-Q1882 VanDerWaalsContact O-N 3.13Å; Q1882-L1885 PolarHBondContact O-N 3.23Å; Q1882-D1886 VanDerWaalsContact O-CG 3.26Å; Q1882-D1886 PolarHBondContact O-N 3.2Å; Q1882-D1886 VanDerWaalsContact O-N 3.13Å
1883	S	77.1	Confident	75.3	Confident	74 Å²	74	91.5 Å²	91.5	52%	0.517	45%	0.453	S	S	.	.	H	α-helix	trans	-66	-44.4	179.3	-166.8	0	0	0	0	112.3	R1879 A1880 L1885 D1886 E1887	R1879-S1883 PolarHBondContact O-N 3.3Å; A1880-S1883 WeakPolarHBondContact O-CB 3.32Å; A1880-S1883 PolarHBondContact O-N 3.19Å; S1883-L1885 VanDerWaalsContact C-N 3.27Å; S1883-L1885 PolarHBondContact O-N 3.26Å; S1883-D1886 PolarHBondContact O-N 3.03Å; S1883-E1887 PolarHBondContact O-N 3Å
1884	D	74.7	Confident	75.7	Confident	88 Å²	88	90.3 Å²	90.3	47%	0.471	45%	0.453	S	S	.	.	H	α-helix	trans	-64.5	-35.1	-179.6	-55	-20.8	0	0	0	111.1	A1880 I1888	A1880-D1884 PolarHBondContact O-N 3.06Å; D1884-I1888 WeakPolarHBondContact O-CG1 3.43Å; D1884-I1888 PolarHBondContact O-N 3.25Å
1885	L	76.5	Confident	76.5	Confident	32 Å²	32	87.6 Å²	87.6	17%	0.168	44%	0.441	C	S	.	.	H	α-helix	trans	-66.6	-44.5	174.7	-173.4	71.9	0	0	0	111.9	L1881 Q1882 S1883 I1888 Q1889 M2084	L1881-L1885 PolarHBondContact O-N 3.43Å; Q1882-L1885 PolarHBondContact O-N 3.23Å; S1883-L1885 VanDerWaalsContact C-N 3.27Å; S1883-L1885 PolarHBondContact O-N 3.26Å; L1885-I1888 PolarHBondContact O-N 2.61Å; L1885-Q1889 WeakPolarHBondContact O-CG 3.43Å; L1885-Q1889 PolarHBondContact O-N 2.9Å; L1885-M2084 HydrophobicContact CD1-CB 3.94Å; L1885-M2084 HydrophobicContact CD1-CG 4.14Å
1886	D	77.4	Confident	77.1	Confident	79 Å²	79	87.7 Å²	87.7	42%	0.422	44%	0.441	S	S	.	.	H	α-helix	trans	-66.2	-36.2	-179.5	-68.1	-12.9	0	0	0	111.6	Q1882 S1883 Q1889 Q1890	Q1882-D1886 VanDerWaalsContact O-CG 3.26Å; Q1882-D1886 PolarHBondContact O-N 3.2Å; Q1882-D1886 VanDerWaalsContact O-N 3.13Å; S1883-D1886 PolarHBondContact O-N 3.03Å; D1886-Q1889 PolarHBondContact O-N 2.85Å; D1886-Q1890 PolarHBondContact O-N 2.74Å; D1886-Q1890 VanDerWaalsContact O-N 3.12Å
1887	E	78.2	Confident	77.5	Confident	125 Å²	125	88.7 Å²	88.7	58%	0.584	45%	0.445	S	S	*	.	H	α-helix	trans	-69	-42.5	177.2	-170.9	167.4	-129.7	0	0	112.3	S1883 Q1889 Q1890 Q1891	S1883-E1887 PolarHBondContact O-N 3Å; E1887-Q1889 VanDerWaalsContact C-N 3.32Å; E1887-Q1889 PolarHBondContact O-N 3.33Å; E1887-Q1890 WeakPolarHBondContact O-CB 3.38Å; E1887-Q1890 PolarHBondContact O-N 2.87Å; E1887-Q1890 VanDerWaalsContact O-N 3.15Å; E1887-Q1891 PolarHBondContact O-N 2.89Å
1888	I	77.6	Confident	77.9	Confident	50 Å²	50	86 Å²	86	26%	0.256	44%	0.436	S	S	.	.	H	α-helix	trans	-67.6	-33.8	175.6	-64.2	169.6	0	0	0	111.1	D1884 L1885 Q1890 Q1891 L1892 A2080 A2083	D1884-I1888 WeakPolarHBondContact O-CG1 3.43Å; D1884-I1888 PolarHBondContact O-N 3.25Å; L1885-I1888 PolarHBondContact O-N 2.61Å; I1888-Q1890 VanDerWaalsContact C-N 3.33Å; I1888-Q1890 PolarHBondContact O-N 2.96Å; I1888-Q1891 PolarHBondContact O-N 2.96Å; I1888-L1892 PolarHBondContact O-N 3.23Å; I1888-A2080 HydrophobicContact CG2-CB 3.83Å; I1888-A2083 HydrophobicContact CD1-CB 3.57Å
1889	Q	78	Confident	78.9	Confident	94 Å²	94	81.6 Å²	81.6	44%	0.439	42%	0.417	S	S	.	.	H	α-helix	trans	-64.3	-33.2	171.4	-75.5	-178.3	24.4	0	0	113	L1885 D1886 E1887 A1893	L1885-Q1889 WeakPolarHBondContact O-CG 3.43Å; L1885-Q1889 PolarHBondContact O-N 2.9Å; D1886-Q1889 PolarHBondContact O-N 2.85Å; E1887-Q1889 VanDerWaalsContact C-N 3.32Å; E1887-Q1889 PolarHBondContact O-N 3.33Å; Q1889-A1893 WeakPolarHBondContact O-CB 3.31Å; Q1889-A1893 PolarHBondContact O-N 3.31Å
1890	Q	81.3	Confident	79.2	Confident	149 Å²	149	79 Å²	79	70%	0.696	41%	0.411	S	S	*	.	H	α-helix	trans	-67.3	-39.2	171.9	-71.1	-170.8	20.8	0	0	112.3	D1886 E1887 I1888 A1893 S1894	D1886-Q1890 PolarHBondContact O-N 2.74Å; D1886-Q1890 VanDerWaalsContact O-N 3.12Å; E1887-Q1890 WeakPolarHBondContact O-CB 3.38Å; E1887-Q1890 PolarHBondContact O-N 2.87Å; E1887-Q1890 VanDerWaalsContact O-N 3.15Å; I1888-Q1890 VanDerWaalsContact C-N 3.33Å; I1888-Q1890 PolarHBondContact O-N 2.96Å; Q1890-A1893 PolarHBondContact O-N 3.38Å; Q1890-S1894 PolarHBondContact O-N 2.93Å
1891	Q	80.7	Confident	79.5	Confident	119 Å²	119	82.2 Å²	82.2	56%	0.556	42%	0.417	S	S	*	.	H	α-helix	trans	-63.2	-47.4	176.6	-65.1	-172.6	21.2	0	0	111	E1887 I1888 A1893 S1894 A1895	E1887-Q1891 PolarHBondContact O-N 2.89Å; I1888-Q1891 PolarHBondContact O-N 2.96Å; Q1891-A1893 VanDerWaalsContact C-N 3.33Å; Q1891-A1893 PolarHBondContact O-N 2.79Å; Q1891-S1894 PolarHBondContact O-N 3.33Å; Q1891-S1894 VanDerWaalsContact O-N 3.1Å; Q1891-S1894 PolarHBondContact O-OG 3.44Å; Q1891-A1895 PolarHBondContact O-N 3.34Å; Q1891-A1895 VanDerWaalsContact O-N 3.08Å
1892	L	83.5	Confident	80.1	Confident	31 Å²	31	81.8 Å²	81.8	16%	0.162	41%	0.412	C	S	.	.	H	α-helix	trans	-52	-49.5	171.8	-179.8	72.2	0	0	0	112.1	I1888 S1894 A1895 L1896 Q2077 A2080	I1888-L1892 PolarHBondContact O-N 3.23Å; L1892-S1894 VanDerWaalsContact C-N 3.25Å; L1892-S1894 PolarHBondContact O-N 2.75Å; L1892-A1895 PolarHBondContact O-N 2.92Å; L1892-L1896 HydrophobicContact CD1-CD1 4.17Å; L1892-L1896 HydrophobicContact CD1-CG 4.49Å; L1892-L1896 HydrophobicContact CD2-CD1 4.48Å; L1892-L1896 HydrophobicContact CG-CD1 3.91Å; L1892-L1896 WeakPolarHBondContact O-CG 3.36Å; L1892-L1896 PolarHBondContact O-N 3.12Å; L1892-Q2077 HydrophobicContact CD1-CB 3.57Å; L1892-Q2077 HydrophobicContact CD1-CG 3.88Å; L1892-A2080 HydrophobicContact CD1-CB 4.49Å; L1892-A2080 HydrophobicContact CD2-CB 4.36Å
1893	A	80.3	Confident	80.5	Confident	48 Å²	48	81.6 Å²	81.6	40%	0.397	41%	0.411	S	S	.	.	H	α-helix	trans	-64.4	-27.4	-179.2	0	0	0	0	0	113.3	Q1889 Q1890 Q1891 R1897	Q1889-A1893 WeakPolarHBondContact O-CB 3.31Å; Q1889-A1893 PolarHBondContact O-N 3.31Å; Q1890-A1893 PolarHBondContact O-N 3.38Å; Q1891-A1893 VanDerWaalsContact C-N 3.33Å; Q1891-A1893 PolarHBondContact O-N 2.79Å; A1893-R1897 WeakPolarHBondContact O-CG 3.44Å; A1893-R1897 PolarHBondContact O-N 3.32Å
1894	S	79.5	Confident	80.7	Confident	69 Å²	69	82.6 Å²	82.6	48%	0.483	41%	0.407	S	S	.	.	H	α-helix	trans	-76.6	-42.7	174.2	73.6	0	0	0	0	112.4	Q1890 Q1891 L1892 R1897 T1898	Q1890-S1894 PolarHBondContact O-N 2.93Å; Q1891-S1894 PolarHBondContact O-N 3.33Å; Q1891-S1894 VanDerWaalsContact O-N 3.1Å; Q1891-S1894 PolarHBondContact O-OG 3.44Å; L1892-S1894 VanDerWaalsContact C-N 3.25Å; L1892-S1894 PolarHBondContact O-N 2.75Å; S1894-R1897 PolarHBondContact O-N 3.29Å; S1894-T1898 PolarHBondContact O-N 3.43Å
1895	A	83.3	Confident	80.9	Confident	13 Å²	13	81.8 Å²	81.8	11%	0.107	40%	0.403	C	S	.	.	H	α-helix	trans	-60.9	-47.3	176.3	0	0	0	0	0	111.7	Q1891 L1892 R1897 T1898 Q1899 A2073 A2076	Q1891-A1895 PolarHBondContact O-N 3.34Å; Q1891-A1895 VanDerWaalsContact O-N 3.08Å; L1892-A1895 PolarHBondContact O-N 2.92Å; A1895-R1897 VanDerWaalsContact C-N 3.28Å; A1895-R1897 PolarHBondContact O-N 2.75Å; A1895-T1898 PolarHBondContact O-N 3.19Å; A1895-T1898 VanDerWaalsContact O-N 3.12Å; A1895-T1898 PolarHBondContact O-OG1 3.21Å; A1895-Q1899 PolarHBondContact O-N 3.06Å; A1895-A2073 HydrophobicContact CB-CB 4.38Å; A1895-A2076 HydrophobicContact CB-CB 4.13Å
1896	L	82.2	Confident	81.5	Confident	66 Å²	66	81.7 Å²	81.7	35%	0.346	40%	0.403	S	S	.	.	H	α-helix	trans	-61.7	-30.7	177.8	-72	170.5	0	0	0	113.4	L1892 K1900 A2073	L1892-L1896 HydrophobicContact CD1-CD1 4.17Å; L1892-L1896 HydrophobicContact CD1-CG 4.49Å; L1892-L1896 HydrophobicContact CD2-CD1 4.48Å; L1892-L1896 HydrophobicContact CG-CD1 3.91Å; L1892-L1896 WeakPolarHBondContact O-CG 3.36Å; L1892-L1896 PolarHBondContact O-N 3.12Å; L1896-K1900 PolarHBondContact O-N 2.87Å; L1896-A2073 HydrophobicContact CD2-CB 4.16Å
1897	R	83.1	Confident	81.5	Confident	182 Å²	182	85.2 Å²	85.2	69%	0.687	41%	0.414	S	S	*	.	H	α-helix	trans	-66.2	-49	171.5	-76.3	176.4	-173.7	-164.7	3.5	111.3	A1893 S1894 A1895 Q1899 K1900 E1901	A1893-R1897 WeakPolarHBondContact O-CG 3.44Å; A1893-R1897 PolarHBondContact O-N 3.32Å; S1894-R1897 PolarHBondContact O-N 3.29Å; A1895-R1897 VanDerWaalsContact C-N 3.28Å; A1895-R1897 PolarHBondContact O-N 2.75Å; R1897-Q1899 VanDerWaalsContact C-N 3.32Å; R1897-Q1899 PolarHBondContact O-N 3.38Å; R1897-K1900 PolarHBondContact O-N 2.81Å; R1897-E1901 PolarHBondContact O-N 2.85Å
1898	T	82.1	Confident	81.5	Confident	57 Å²	57	86.3 Å²	86.3	35%	0.35	41%	0.413	S	S	.	.	H	α-helix	trans	-65.4	-33.2	-179.9	59.8	0	0	0	0	113	S1894 A1895 F1902	S1894-T1898 PolarHBondContact O-N 3.43Å; A1895-T1898 PolarHBondContact O-N 3.19Å; A1895-T1898 VanDerWaalsContact O-N 3.12Å; A1895-T1898 PolarHBondContact O-OG1 3.21Å; T1898-F1902 WeakPolarHBondContact O-CD2 3.46Å; T1898-F1902 PolarHBondContact O-N 2.89Å
1899	Q	88.1	Confident	81.6	Confident	37 Å²	37	85.1 Å²	85.1	17%	0.173	41%	0.409	C	S	.	.	H	α-helix	trans	-58.3	-50.4	168.8	177.5	-173.8	-13.2	0	0	110.6	A1895 R1897 E1901 F1902 E1903 A2073	A1895-Q1899 PolarHBondContact O-N 3.06Å; R1897-Q1899 VanDerWaalsContact C-N 3.32Å; R1897-Q1899 PolarHBondContact O-N 3.38Å; Q1899-E1901 PolarHBondContact O-N 3.25Å; Q1899-F1902 PolarHBondContact O-N 3.25Å; Q1899-E1903 HydrophobicContact CG-CG 4.43Å; Q1899-E1903 PolarHBondContact NE2-OE1 2.85Å; Q1899-E1903 PolarHBondContact O-N 2.82Å; Q1899-A2073 HydrophobicContact CB-CB 4.4Å; Q1899-A2073 VanDerWaalsContact OE1-CB 3.28Å
1900	K	78.6	Confident	81.6	Confident	122 Å²	122	85.4 Å²	85.4	53%	0.53	41%	0.409	S	S	.	.	H	α-helix	trans	-64.3	-38.2	-175.7	-162.6	-173.5	178.9	-148.5	0	112.9	L1896 R1897 E1903 E1904	L1896-K1900 PolarHBondContact O-N 2.87Å; R1897-K1900 PolarHBondContact O-N 2.81Å; K1900-E1903 PolarHBondContact O-N 3.41Å; K1900-E1904 VanDerWaalsContact CE-OE1 3.23Å; K1900-E1904 WeakPolarHBondContact CE-OE1 3.22Å; K1900-E1904 IonicContact NZ-OE1 3.49Å; K1900-E1904 PolarHBondContact NZ-OE1 2.76Å; K1900-E1904 WeakPolarHBondContact O-CG 3.48Å; K1900-E1904 PolarHBondContact O-N 2.87Å
1901	E	82.2	Confident	81.6	Confident	120 Å²	120	82.8 Å²	82.8	56%	0.561	39%	0.393	S	S	*	.	H	α-helix	trans	-59.3	-46.4	174.6	-71.7	169.3	167.3	0	0	111.4	R1897 Q1899 E1904 D1905	R1897-E1901 PolarHBondContact O-N 2.85Å; Q1899-E1901 PolarHBondContact O-N 3.25Å; E1901-E1904 PolarHBondContact O-N 2.72Å; E1901-D1905 PolarHBondContact O-N 2.98Å
1902	F	85.6	Confident	81.6	Confident	70 Å²	70	82.7 Å²	82.7	31%	0.307	39%	0.392	S	S	.	.	H	α-helix	trans	-73.7	-24.8	176.9	-66.7	-57.4	0	0	0	114.3	T1898 Q1899 L1906 R2065 A2066 A2069	T1898-F1902 WeakPolarHBondContact O-CD2 3.46Å; T1898-F1902 PolarHBondContact O-N 2.89Å; Q1899-F1902 PolarHBondContact O-N 3.25Å; F1902-L1906 WeakPolarHBondContact O-CB 3.43Å; F1902-L1906 PolarHBondContact O-N 3.4Å; F1902-R2065 HydrophobicContact CB-CB 4.47Å; F1902-R2065 HydrophobicContact CD1-CB 3.73Å; F1902-R2065 HydrophobicContact CE1-CB 4.1Å; F1902-R2065 HydrophobicContact CG-CB 4.05Å; F1902-A2066 HydrophobicContact CB-CB 4.29Å; F1902-A2069 HydrophobicContact CD2-CB 3.64Å; F1902-A2069 HydrophobicContact CE2-CB 4.35Å
1903	E	79.9	Confident	81.7	Confident	89 Å²	89	82.1 Å²	82.1	42%	0.416	39%	0.389	S	S	.	.	H	α-helix	trans	-68.6	-39.3	168.2	-76.4	-178.3	-171	0	0	112	Q1899 K1900 L1906 F1907	Q1899-E1903 HydrophobicContact CG-CG 4.43Å; Q1899-E1903 PolarHBondContact NE2-OE1 2.85Å; Q1899-E1903 PolarHBondContact O-N 2.82Å; K1900-E1903 PolarHBondContact O-N 3.41Å; E1903-L1906 PolarHBondContact O-N 2.91Å; E1903-F1907 WeakPolarHBondContact O-CB 3.43Å; E1903-F1907 PolarHBondContact O-N 3.25Å
1904	E	81	Confident	81.7	Confident	94 Å²	94	84.1 Å²	84.1	44%	0.439	39%	0.393	S	S	.	.	H	α-helix	trans	-68.6	-36.9	175.5	-72.9	-175.6	-155.4	0	0	112	K1900 E1901 F1907 R1908	K1900-E1904 VanDerWaalsContact CE-OE1 3.23Å; K1900-E1904 WeakPolarHBondContact CE-OE1 3.22Å; K1900-E1904 IonicContact NZ-OE1 3.49Å; K1900-E1904 PolarHBondContact NZ-OE1 2.76Å; K1900-E1904 WeakPolarHBondContact O-CG 3.48Å; K1900-E1904 PolarHBondContact O-N 2.87Å; E1901-E1904 PolarHBondContact O-N 2.72Å; E1904-F1907 PolarHBondContact O-N 2.93Å; E1904-R1908 WeakPolarHBondContact O-CG 3.11Å; E1904-R1908 PolarHBondContact O-N 2.79Å; E1904-R1908 VanDerWaalsContact O-N 3.13Å
1905	D	80.9	Confident	81.8	Confident	72 Å²	72	82.4 Å²	82.4	39%	0.385	38%	0.378	S	S	.	.	H	α-helix	trans	-64	-46.6	170.6	-86.9	-7.9	0	0	0	112.2	E1901 F1907 R1908 S1909	E1901-D1905 PolarHBondContact O-N 2.98Å; D1905-F1907 VanDerWaalsContact C-N 3.25Å; D1905-F1907 PolarHBondContact O-N 3.21Å; D1905-R1908 WeakPolarHBondContact O-CB 3.08Å; D1905-R1908 PolarHBondContact O-N 3.34Å; D1905-R1908 VanDerWaalsContact O-N 3.08Å; D1905-S1909 PolarHBondContact O-N 3.1Å
1906	L	87.1	Confident	81.7	Confident	30 Å²	30	83 Å²	83	16%	0.157	38%	0.379	C	S	.	.	H	α-helix	trans	-59.1	-38	175.6	175.6	57.9	0	0	0	111.9	F1902 E1903 R1908 K1910 E2059 A2062 T2063 A2066	F1902-L1906 WeakPolarHBondContact O-CB 3.43Å; F1902-L1906 PolarHBondContact O-N 3.4Å; E1903-L1906 PolarHBondContact O-N 2.91Å; L1906-R1908 VanDerWaalsContact C-N 3.34Å; L1906-K1910 HydrophobicContact CD1-CD 4.16Å; L1906-K1910 HydrophobicContact CD1-CG 4.17Å; L1906-K1910 HydrophobicContact CG-CD 4.4Å; L1906-K1910 WeakPolarHBondContact O-CB 3.43Å; L1906-K1910 WeakPolarHBondContact O-CG 2.93Å; L1906-K1910 PolarHBondContact O-N 3.34Å; L1906-E2059 HydrophobicContact CD1-CG 4.36Å; L1906-A2062 HydrophobicContact CB-CB 4.23Å; L1906-A2062 HydrophobicContact CD1-CB 4.07Å; L1906-T2063 WeakPolarHBondContact CD1-OG1 3.2Å; L1906-A2066 HydrophobicContact CB-CB 4.48Å; L1906-A2066 HydrophobicContact CD2-CB 3.98Å
1907	F	77.7	Confident	81.8	Confident	152 Å²	152	83.6 Å²	83.6	67%	0.667	38%	0.381	S	S	*	.	H	α-helix	trans	-65.7	-35.6	175.9	-167.3	-93.8	0	0	0	112.5	E1903 E1904 D1905 R1911	E1903-F1907 WeakPolarHBondContact O-CB 3.43Å; E1903-F1907 PolarHBondContact O-N 3.25Å; E1904-F1907 PolarHBondContact O-N 2.93Å; D1905-F1907 VanDerWaalsContact C-N 3.25Å; D1905-F1907 PolarHBondContact O-N 3.21Å; F1907-R1911 PolarHBondContact O-N 3.05Å
1908	R	79.7	Confident	81.5	Confident	148 Å²	148	76.5 Å²	76.5	56%	0.558	36%	0.356	S	S	*	.	H	α-helix	trans	-65.9	-52.1	174.2	-69.2	169.1	-171.2	-111.6	5.8	111.6	E1904 D1905 L1906 K1910 R1911 Q1912	E1904-R1908 WeakPolarHBondContact O-CG 3.11Å; E1904-R1908 PolarHBondContact O-N 2.79Å; E1904-R1908 VanDerWaalsContact O-N 3.13Å; D1905-R1908 WeakPolarHBondContact O-CB 3.08Å; D1905-R1908 PolarHBondContact O-N 3.34Å; D1905-R1908 VanDerWaalsContact O-N 3.08Å; L1906-R1908 VanDerWaalsContact C-N 3.34Å; R1908-K1910 VanDerWaalsContact C-N 3.34Å; R1908-K1910 PolarHBondContact O-N 3.32Å; R1908-R1911 PolarHBondContact O-N 3Å; R1908-Q1912 PolarHBondContact O-N 3.08Å
1909	S	78.9	Confident	81.5	Confident	25 Å²	25	78.7 Å²	78.7	18%	0.175	36%	0.362	C	S	.	.	H	α-helix	trans	-61.1	-41.5	-179.9	-59.2	0	0	0	0	112	D1905 R1911 Q1912 L1913	D1905-S1909 PolarHBondContact O-N 3.1Å; S1909-R1911 VanDerWaalsContact C-N 3.34Å; S1909-R1911 PolarHBondContact O-N 3.35Å; S1909-Q1912 PolarHBondContact O-N 3.13Å; S1909-L1913 WeakPolarHBondContact O-CB 3.3Å; S1909-L1913 PolarHBondContact O-N 2.75Å
1910	K	78.8	Confident	81.4	Confident	101 Å²	101	78.6 Å²	78.6	44%	0.439	36%	0.361	S	S	.	.	H	α-helix	trans	-60.9	-39.7	175.7	-83.5	-172.4	167	-177.4	0	113.5	L1906 R1908 L1914 E2059	L1906-K1910 HydrophobicContact CD1-CD 4.16Å; L1906-K1910 HydrophobicContact CD1-CG 4.17Å; L1906-K1910 HydrophobicContact CG-CD 4.4Å; L1906-K1910 WeakPolarHBondContact O-CB 3.43Å; L1906-K1910 WeakPolarHBondContact O-CG 2.93Å; L1906-K1910 PolarHBondContact O-N 3.34Å; R1908-K1910 VanDerWaalsContact C-N 3.34Å; R1908-K1910 PolarHBondContact O-N 3.32Å; K1910-L1914 PolarHBondContact O-N 2.93Å; K1910-L1914 VanDerWaalsContact O-N 3.12Å; K1910-E2059 HydrophobicContact CD-CG 4.48Å; K1910-E2059 WeakPolarHBondContact CE-OE1 3.35Å; K1910-E2059 HydrophobicContact CG-CG 3.54Å; K1910-E2059 IonicContact NZ-OE1 3.09Å; K1910-E2059 PolarHBondContact NZ-OE1 3.28Å
1911	R	80.8	Confident	81.3	Confident	93 Å²	93	75.2 Å²	75.2	35%	0.351	35%	0.351	S	S	.	.	H	α-helix	trans	-65.5	-48.7	175.2	-176.7	177.2	-178.5	146.1	10	111.2	D1567 F1907 R1908 S1909 L1913 L1914 D1915	D1567-R1911 VanDerWaalsContact CB-NH2 3.32Å; D1567-R1911 VanDerWaalsContact N-NH2 3.19Å; D1567-R1911 PolarHBondContact O-NH2 3Å; F1907-R1911 PolarHBondContact O-N 3.05Å; R1908-R1911 PolarHBondContact O-N 3Å; S1909-R1911 VanDerWaalsContact C-N 3.34Å; S1909-R1911 PolarHBondContact O-N 3.35Å; R1911-L1913 PolarHBondContact O-N 2.84Å; R1911-L1914 WeakPolarHBondContact O-CB 3.21Å; R1911-L1914 PolarHBondContact O-N 3.4Å; R1911-D1915 IonicContact NE-OD2 2.7Å; R1911-D1915 PolarHBondContact O-N 3.4Å
1912	Q	80.6	Confident	81	Confident	118 Å²	118	73.7 Å²	73.7	55%	0.551	35%	0.347	S	S	*	.	H	α-helix	trans	-62.3	-33.4	-178.1	-170.6	170.8	-16.4	0	0	112.6	R1908 S1909 L1916	R1908-Q1912 PolarHBondContact O-N 3.08Å; S1909-Q1912 PolarHBondContact O-N 3.13Å; Q1912-L1916 WeakPolarHBondContact O-CD1 3.46Å; Q1912-L1916 WeakPolarHBondContact O-CG 3.42Å; Q1912-L1916 PolarHBondContact O-N 3.05Å
1913	L	85.6	Confident	80.9	Confident	19 Å²	19	72.9 Å²	72.9	10%	0.099	34%	0.344	C	S	.	.	H	α-helix	trans	-64.7	-46	169.9	177.3	147	0	0	0	112.4	S1909 R1911 L1916 Q1917 A2055 Q2056 E2059	S1909-L1913 WeakPolarHBondContact O-CB 3.3Å; S1909-L1913 PolarHBondContact O-N 2.75Å; R1911-L1913 PolarHBondContact O-N 2.84Å; L1913-L1916 PolarHBondContact O-N 3.42Å; L1913-Q1917 WeakPolarHBondContact O-CB 3.42Å; L1913-Q1917 PolarHBondContact O-N 2.77Å; L1913-A2055 HydrophobicContact CB-CB 4.14Å; L1913-Q2056 HydrophobicContact CD1-CB 4.25Å; L1913-Q2056 HydrophobicContact CD1-CG 3.51Å; L1913-E2059 HydrophobicContact CD1-CB 4.15Å
1914	L	80.2	Confident	80.9	Confident	90 Å²	90	73.4 Å²	73.4	47%	0.471	35%	0.347	S	S	.	.	H	α-helix	trans	-65	-45	-179.8	-169.6	72.6	0	0	0	111.9	K1910 R1911 L1916 Q1917 N1918	K1910-L1914 PolarHBondContact O-N 2.93Å; K1910-L1914 VanDerWaalsContact O-N 3.12Å; R1911-L1914 WeakPolarHBondContact O-CB 3.21Å; R1911-L1914 PolarHBondContact O-N 3.4Å; L1914-L1916 VanDerWaalsContact C-N 3.26Å; L1914-L1916 PolarHBondContact O-N 3.4Å; L1914-Q1917 PolarHBondContact O-N 2.71Å; L1914-Q1917 VanDerWaalsContact O-N 3.13Å; L1914-N1918 PolarHBondContact O-N 2.79Å; L1914-N1918 PolarHBondContact O-ND2 3.19Å
1915	D	80.5	Confident	80.6	Confident	32 Å²	32	74.5 Å²	74.5	17%	0.171	35%	0.352	C	S	.	.	H	α-helix	trans	-58.6	-38.3	178.1	-63.3	0.2	0	0	0	110.8	D1567 R1911 Q1919	D1567-D1915 WeakPolarHBondContact CB-OD1 3.45Å; R1911-D1915 IonicContact NE-OD2 2.7Å; R1911-D1915 PolarHBondContact O-N 3.4Å; D1915-Q1919 WeakPolarHBondContact O-CG 3.19Å
1916	L	83	Confident	80.6	Confident	25 Å²	25	72.7 Å²	72.7	13%	0.131	35%	0.346	C	S	.	.	H	α-helix	trans	-76.1	-32.7	175	-75.7	168.8	0	0	0	113.7	Q1912 L1913 L1914 Q1919 F1920 L2048 Q2051 A2055	Q1912-L1916 WeakPolarHBondContact O-CD1 3.46Å; Q1912-L1916 WeakPolarHBondContact O-CG 3.42Å; Q1912-L1916 PolarHBondContact O-N 3.05Å; L1913-L1916 PolarHBondContact O-N 3.42Å; L1914-L1916 VanDerWaalsContact C-N 3.26Å; L1914-L1916 PolarHBondContact O-N 3.4Å; L1916-Q1919 PolarHBondContact O-N 3.18Å; L1916-F1920 PolarHBondContact O-N 3.49Å; L1916-F1920 VanDerWaalsContact O-N 3.09Å; L1916-L2048 HydrophobicContact CD2-CD2 4.23Å; L1916-Q2051 HydrophobicContact CD1-CB 4.07Å; L1916-Q2051 HydrophobicContact CD2-CB 4Å; L1916-A2055 HydrophobicContact CD1-CB 3.92Å
1917	Q	82.5	Confident	80.5	Confident	80 Å²	80	72.7 Å²	72.7	37%	0.374	35%	0.346	S	S	.	.	H	α-helix	trans	-68.9	-41.4	179.2	-172	164.4	-19.7	0	0	111.6	L1913 L1914 Q1919 F1920 T1921 L2052	L1913-Q1917 WeakPolarHBondContact O-CB 3.42Å; L1913-Q1917 PolarHBondContact O-N 2.77Å; L1914-Q1917 PolarHBondContact O-N 2.71Å; L1914-Q1917 VanDerWaalsContact O-N 3.13Å; Q1917-Q1919 VanDerWaalsContact C-N 3.33Å; Q1917-Q1919 PolarHBondContact O-N 2.93Å; Q1917-F1920 PolarHBondContact O-N 2.91Å; Q1917-T1921 PolarHBondContact O-N 2.6Å; Q1917-T1921 VanDerWaalsContact O-N 3.08Å; Q1917-T1921 PolarHBondContact O-OG1 2.77Å; Q1917-L2052 HydrophobicContact CB-CD1 3.73Å; Q1917-L2052 HydrophobicContact CG-CD1 3.97Å
1918	N	78.2	Confident	80.7	Confident	32 Å²	32	71.2 Å²	71.2	17%	0.171	34%	0.339	C	S	.	.	H	α-helix	trans	-59.8	-41.8	172	-62.7	-26.7	0	0	0	111.8	L1914 F1920 T1921 D1922	L1914-N1918 PolarHBondContact O-N 2.79Å; L1914-N1918 PolarHBondContact O-ND2 3.19Å; N1918-F1920 VanDerWaalsContact C-N 3.28Å; N1918-F1920 PolarHBondContact O-N 3.28Å; N1918-T1921 PolarHBondContact O-N 2.69Å; N1918-T1921 PolarHBondContact O-OG1 3.2Å; N1918-D1922 WeakPolarHBondContact O-CB 3.47Å; N1918-D1922 VanDerWaalsContact O-CG 3.27Å; N1918-D1922 PolarHBondContact O-N 2.7Å
1919	Q	82.2	Confident	80.9	Confident	103 Å²	103	69.4 Å²	69.4	48%	0.481	34%	0.337	S	S	.	.	H	α-helix	trans	-67.9	-27.8	178	-71.4	175.7	33.1	0	0	113.1	D1915 L1916 Q1917 Q1923 L2048	D1915-Q1919 WeakPolarHBondContact O-CG 3.19Å; L1916-Q1919 PolarHBondContact O-N 3.18Å; Q1917-Q1919 VanDerWaalsContact C-N 3.33Å; Q1917-Q1919 PolarHBondContact O-N 2.93Å; Q1919-Q1923 WeakPolarHBondContact O-CG 3.22Å; Q1919-Q1923 PolarHBondContact O-N 3.37Å; Q1919-L2048 HydrophobicContact CB-CD1 4.45Å; Q1919-L2048 HydrophobicContact CB-CD2 3.65Å; Q1919-L2048 WeakPolarHBondContact O-CD1 3.44Å
1920	F	84.9	Confident	81.1	Confident	35 Å²	35	68.9 Å²	68.9	15%	0.154	33%	0.333	C	S	.	.	H	α-helix	trans	-74.4	-42.6	174.6	-175.3	-110.3	0	0	0	111.9	L1916 Q1917 N1918 Q1923 E1924 N2045 L2048 L2052	L1916-F1920 PolarHBondContact O-N 3.49Å; L1916-F1920 VanDerWaalsContact O-N 3.09Å; Q1917-F1920 PolarHBondContact O-N 2.91Å; N1918-F1920 VanDerWaalsContact C-N 3.28Å; N1918-F1920 PolarHBondContact O-N 3.28Å; F1920-Q1923 PolarHBondContact O-N 3.33Å; F1920-E1924 HydrophobicContact CD1-CG 4.38Å; F1920-E1924 HydrophobicContact CD2-CG 4.49Å; F1920-E1924 HydrophobicContact CE1-CG 3.83Å; F1920-E1924 VanDerWaalsContact CE1-OE2 3.26Å; F1920-E1924 WeakPolarHBondContact CE1-OE2 3.35Å; F1920-E1924 HydrophobicContact CE2-CG 3.96Å; F1920-E1924 HydrophobicContact CZ-CG 3.59Å; F1920-E1924 WeakPolarHBondContact CZ-OE1 3.27Å; F1920-E1924 PolarHBondContact O-N 2.75Å; F1920-N2045 HydrophobicContact CE2-CB 4.05Å; F1920-N2045 WeakPolarHBondContact CE2-O 3.34Å; F1920-L2048 HydrophobicContact CB-CB 4.28Å; F1920-L2048 HydrophobicContact CD2-CB 3.77Å; F1920-L2048 HydrophobicContact CG-CB 4.49Å; F1920-L2052 HydrophobicContact CB-CD1 4.33Å
1921	T	76.4	Confident	81.4	Confident	52 Å²	52	69.3 Å²	69.3	32%	0.319	33%	0.332	S	S	.	.	H	α-helix	trans	-63.2	-45	175.5	48.7	0	0	0	0	112.1	Q1917 N1918 Q1923 E1924 E1925	Q1917-T1921 PolarHBondContact O-N 2.6Å; Q1917-T1921 VanDerWaalsContact O-N 3.08Å; Q1917-T1921 PolarHBondContact O-OG1 2.77Å; N1918-T1921 PolarHBondContact O-N 2.69Å; N1918-T1921 PolarHBondContact O-OG1 3.2Å; T1921-Q1923 PolarHBondContact O-N 3.35Å; T1921-Q1923 VanDerWaalsContact O-N 3.15Å; T1921-E1924 PolarHBondContact O-N 2.83Å; T1921-E1925 PolarHBondContact O-N 2.94Å
1922	D	77.4	Confident	81.6	Confident	88 Å²	88	68.3 Å²	68.3	47%	0.471	33%	0.333	S	S	.	.	H	α-helix	trans	-58.5	-28.6	176.9	-71.5	10	0	0	0	112.2	N1918	N1918-D1922 WeakPolarHBondContact O-CB 3.47Å; N1918-D1922 VanDerWaalsContact O-CG 3.27Å; N1918-D1922 PolarHBondContact O-N 2.7Å
1923	Q	82.8	Confident	81.9	Confident	52 Å²	52	67 Å²	67	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-91.7	-30	177.7	-75.5	-71.7	-70	0	0	113.9	Q1919 F1920 T1921 H1927 N2045 L2048	Q1919-Q1923 WeakPolarHBondContact O-CG 3.22Å; Q1919-Q1923 PolarHBondContact O-N 3.37Å; F1920-Q1923 PolarHBondContact O-N 3.33Å; T1921-Q1923 PolarHBondContact O-N 3.35Å; T1921-Q1923 VanDerWaalsContact O-N 3.15Å; Q1923-H1927 WeakPolarHBondContact O-CB 3.14Å; Q1923-H1927 PolarHBondContact O-N 3.5Å; Q1923-N2045 VanDerWaalsContact C-ND2 3.35Å; Q1923-N2045 WeakPolarHBondContact CB-OD1 3.25Å; Q1923-N2045 PolarHBondContact O-ND2 3.41Å; Q1923-L2048 HydrophobicContact CB-CD1 4.14Å; Q1923-L2048 HydrophobicContact CG-CD1 3.75Å
1924	E	79.2	Confident	82	Confident	101 Å²	101	67.1 Å²	67.1	47%	0.472	33%	0.326	S	S	.	.	H	α-helix	trans	-68.9	-36.4	171.8	-78.9	-155.3	131.5	0	0	111.5	F1920 T1921 K1928 N2045	F1920-E1924 HydrophobicContact CD1-CG 4.38Å; F1920-E1924 HydrophobicContact CD2-CG 4.49Å; F1920-E1924 HydrophobicContact CE1-CG 3.83Å; F1920-E1924 VanDerWaalsContact CE1-OE2 3.26Å; F1920-E1924 WeakPolarHBondContact CE1-OE2 3.35Å; F1920-E1924 HydrophobicContact CE2-CG 3.96Å; F1920-E1924 HydrophobicContact CZ-CG 3.59Å; F1920-E1924 WeakPolarHBondContact CZ-OE1 3.27Å; F1920-E1924 PolarHBondContact O-N 2.75Å; T1921-E1924 PolarHBondContact O-N 2.83Å; E1924-K1928 WeakPolarHBondContact O-CB 3.05Å; E1924-K1928 PolarHBondContact O-N 3.48Å; E1924-N2045 PolarHBondContact N-OD1 2.74Å
1925	E	75.5	Confident	82.2	Confident	117 Å²	117	68.1 Å²	68.1	55%	0.547	33%	0.328	S	S	.	.	H	α-helix	trans	-69.4	-42.5	177.2	-156.2	-173.1	-145.9	0	0	112.3	T1921 H1927 K1928 E1929	T1921-E1925 PolarHBondContact O-N 2.94Å; E1925-H1927 PolarHBondContact O-N 3.19Å; E1925-K1928 WeakPolarHBondContact O-CB 3Å; E1925-K1928 PolarHBondContact O-N 3.34Å; E1925-K1928 VanDerWaalsContact O-N 3.13Å; E1925-E1929 PolarHBondContact O-N 3.46Å
1926	A	80.7	Confident	82.2	Confident	33 Å²	33	71.7 Å²	71.7	27%	0.273	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-49.1	173.5	0	0	0	0	0	112	K1928 E1929 T1930	A1926-K1928 VanDerWaalsContact C-N 3.26Å; A1926-K1928 PolarHBondContact O-N 2.79Å; A1926-E1929 PolarHBondContact O-N 2.79Å; A1926-E1929 VanDerWaalsContact O-N 3.15Å; A1926-T1930 PolarHBondContact O-N 2.66Å; A1926-T1930 PolarHBondContact O-OG1 3.07Å
1927	H	84.1	Confident	82.4	Confident	30 Å²	30	70.8 Å²	70.8	14%	0.139	34%	0.344	C	S	.	.	H	α-helix	trans	-62.5	-29.9	176.7	171	-90.7	0	0	0	113.3	Q1923 E1925 T1930 R1931 E2038 E2041 R2042 N2045	Q1923-H1927 WeakPolarHBondContact O-CB 3.14Å; Q1923-H1927 PolarHBondContact O-N 3.5Å; E1925-H1927 PolarHBondContact O-N 3.19Å; H1927-T1930 PolarHBondContact O-OG1 3.42Å; H1927-R1931 WeakPolarHBondContact O-CB 3.36Å; H1927-R1931 PolarHBondContact O-N 3.12Å; H1927-R1931 VanDerWaalsContact O-N 3.15Å; H1927-E2038 IonicContact NE2-OE1 2.6Å; H1927-E2041 HydrophobicContact CB-CB 4.05Å; H1927-R2042 WeakPolarHBondContact NE2-CD 3.05Å; H1927-N2045 WeakPolarHBondContact CB-ND2 3.11Å
1928	K	82.6	Confident	82.7	Confident	122 Å²	122	69.4 Å²	69.4	53%	0.53	34%	0.341	S	S	.	.	H	α-helix	trans	-71.2	-45.3	172.7	180	-173.8	174	-168.9	0	111	E1924 E1925 A1926 T1930 R1931 D1932	E1924-K1928 WeakPolarHBondContact O-CB 3.05Å; E1924-K1928 PolarHBondContact O-N 3.48Å; E1925-K1928 WeakPolarHBondContact O-CB 3Å; E1925-K1928 PolarHBondContact O-N 3.34Å; E1925-K1928 VanDerWaalsContact O-N 3.13Å; A1926-K1928 VanDerWaalsContact C-N 3.26Å; A1926-K1928 PolarHBondContact O-N 2.79Å; K1928-T1930 PolarHBondContact O-N 3.2Å; K1928-R1931 WeakPolarHBondContact O-CB 3.33Å; K1928-R1931 PolarHBondContact O-N 3.02Å; K1928-D1932 PolarHBondContact O-N 3.05Å
1929	E	83.2	Confident	82.9	Confident	109 Å²	109	70 Å²	70	51%	0.509	35%	0.351	S	S	.	.	H	α-helix	trans	-65	-37.4	-179.3	-149.2	-141.7	168.1	0	0	112.2	E1925 A1926 K1933	E1925-E1929 PolarHBondContact O-N 3.46Å; A1926-E1929 PolarHBondContact O-N 2.79Å; A1926-E1929 VanDerWaalsContact O-N 3.15Å; E1929-K1933 VanDerWaalsContact CD-CE 3.45Å; E1929-K1933 VanDerWaalsContact O-CD 3.32Å; E1929-K1933 WeakPolarHBondContact O-CD 3.43Å; E1929-K1933 VanDerWaalsContact O-CG 3.23Å; E1929-K1933 WeakPolarHBondContact O-CG 3.27Å; E1929-K1933 PolarHBondContact O-N 3.38Å; E1929-K1933 VanDerWaalsContact O-N 3.15Å; E1929-K1933 WeakPolarHBondContact OE1-CE 3.16Å; E1929-K1933 IonicContact OE1-NZ 2.65Å; E1929-K1933 PolarHBondContact OE1-NZ 3.47Å; E1929-K1933 IonicContact OE2-NZ 3.93Å; E1929-K1933 PolarHBondContact OE2-NZ 2.91Å
1930	T	84.4	Confident	83	Confident	14 Å²	14	67.7 Å²	67.7	9%	0.086	35%	0.345	C	S	.	.	H	α-helix	trans	-73.3	-37	175.3	59.1	0	0	0	0	112.5	A1926 H1927 K1928 K1933 L1934 I2037 E2041	A1926-T1930 PolarHBondContact O-N 2.66Å; A1926-T1930 PolarHBondContact O-OG1 3.07Å; H1927-T1930 PolarHBondContact O-OG1 3.42Å; K1928-T1930 PolarHBondContact O-N 3.2Å; T1930-K1933 PolarHBondContact O-N 3.08Å; T1930-L1934 WeakPolarHBondContact O-CB 3.49Å; T1930-L1934 PolarHBondContact O-N 2.73Å; T1930-I2037 HydrophobicContact CG2-CG2 3.76Å; T1930-E2041 WeakPolarHBondContact CB-OE2 2.88Å; T1930-E2041 WeakPolarHBondContact CG2-OE2 3.21Å; T1930-E2041 PolarHBondContact OG1-OE2 2.72Å
1931	R	85.2	Confident	83	Confident	111 Å²	111	66.2 Å²	66.2	42%	0.419	34%	0.339	S	S	.	.	H	α-helix	trans	-61.1	-43.4	171.2	174.4	179.5	174.3	72.3	11.7	112.6	H1927 K1928 L1934 Q1935	H1927-R1931 WeakPolarHBondContact O-CB 3.36Å; H1927-R1931 PolarHBondContact O-N 3.12Å; H1927-R1931 VanDerWaalsContact O-N 3.15Å; K1928-R1931 WeakPolarHBondContact O-CB 3.33Å; K1928-R1931 PolarHBondContact O-N 3.02Å; R1931-L1934 WeakPolarHBondContact O-CB 3.47Å; R1931-L1934 PolarHBondContact O-N 3.49Å; R1931-Q1935 WeakPolarHBondContact O-CB 2.96Å; R1931-Q1935 PolarHBondContact O-N 2.81Å
1932	D	84.1	Confident	83.4	Confident	72 Å²	72	67.9 Å²	67.9	39%	0.385	35%	0.35	S	S	.	.	H	α-helix	trans	-69.2	-37	179.1	-72.8	-15.7	0	0	0	111.2	K1928 Q1935 N1936	K1928-D1932 PolarHBondContact O-N 3.05Å; D1932-Q1935 PolarHBondContact O-N 2.63Å; D1932-N1936 PolarHBondContact O-N 3.17Å; D1932-N1936 PolarHBondContact O-ND2 3.3Å
1933	K	87.9	Confident	83.7	Confident	91 Å²	91	69.2 Å²	69.2	40%	0.396	36%	0.355	S	S	.	.	H	α-helix	trans	-60.5	-45.2	169.8	-70.9	162.5	-171	173.2	0	111.5	E1929 T1930 Q1935 N1936 A1937 L2034	E1929-K1933 VanDerWaalsContact CD-CE 3.45Å; E1929-K1933 VanDerWaalsContact O-CD 3.32Å; E1929-K1933 WeakPolarHBondContact O-CD 3.43Å; E1929-K1933 VanDerWaalsContact O-CG 3.23Å; E1929-K1933 WeakPolarHBondContact O-CG 3.27Å; E1929-K1933 PolarHBondContact O-N 3.38Å; E1929-K1933 VanDerWaalsContact O-N 3.15Å; E1929-K1933 WeakPolarHBondContact OE1-CE 3.16Å; E1929-K1933 IonicContact OE1-NZ 2.65Å; E1929-K1933 PolarHBondContact OE1-NZ 3.47Å; E1929-K1933 IonicContact OE2-NZ 3.93Å; E1929-K1933 PolarHBondContact OE2-NZ 2.91Å; T1930-K1933 PolarHBondContact O-N 3.08Å; K1933-Q1935 PolarHBondContact O-N 3.08Å; K1933-N1936 PolarHBondContact O-N 3.32Å; K1933-A1937 PolarHBondContact O-N 3.31Å; K1933-L2034 HydrophobicContact CB-CD1 4.14Å; K1933-L2034 HydrophobicContact CB-CD2 4.04Å
1934	L	86.5	Confident	83.8	Confident	20 Å²	20	70.9 Å²	70.9	11%	0.105	36%	0.362	C	S	.	.	H	α-helix	trans	-60.5	-44.7	176.1	176.6	58.7	0	0	0	112.1	T1930 R1931 N1936 A1937 T1938 R2031 L2034 I2035 E2038	T1930-L1934 WeakPolarHBondContact O-CB 3.49Å; T1930-L1934 PolarHBondContact O-N 2.73Å; R1931-L1934 WeakPolarHBondContact O-CB 3.47Å; R1931-L1934 PolarHBondContact O-N 3.49Å; L1934-N1936 PolarHBondContact O-N 3.25Å; L1934-A1937 PolarHBondContact O-N 2.94Å; L1934-T1938 HydrophobicContact CD1-CG2 4.39Å; L1934-T1938 PolarHBondContact O-N 2.88Å; L1934-T1938 PolarHBondContact O-OG1 3.16Å; L1934-R2031 HydrophobicContact CD1-CG 3.62Å; L1934-L2034 HydrophobicContact CB-CB 4.06Å; L1934-L2034 HydrophobicContact CD1-CB 4Å; L1934-I2035 HydrophobicContact CD1-CD1 4.44Å; L1934-I2035 HydrophobicContact CD1-CG1 3.65Å; L1934-I2035 HydrophobicContact CD2-CG1 3.97Å; L1934-I2035 HydrophobicContact CG-CG1 4.49Å; L1934-E2038 WeakPolarHBondContact CD2-OE2 3.43Å
1935	Q	85.1	Confident	84	Confident	111 Å²	111	70.7 Å²	70.7	52%	0.519	36%	0.361	S	S	.	.	H	α-helix	trans	-65.8	-36.5	-179.9	-173.9	167.6	-38.5	0	0	112.4	R1931 D1932 K1933 T1938 A1939	R1931-Q1935 WeakPolarHBondContact O-CB 2.96Å; R1931-Q1935 PolarHBondContact O-N 2.81Å; D1932-Q1935 PolarHBondContact O-N 2.63Å; K1933-Q1935 PolarHBondContact O-N 3.08Å; Q1935-T1938 WeakPolarHBondContact CA-OG1 3.44Å; Q1935-T1938 PolarHBondContact O-OG1 2.93Å; Q1935-A1939 WeakPolarHBondContact O-CB 2.95Å; Q1935-A1939 PolarHBondContact O-N 3.01Å
1936	N	81.4	Confident	84.2	Confident	107 Å²	107	67.8 Å²	67.8	57%	0.572	36%	0.357	S	S	*	.	H	α-helix	trans	-69.7	-36.4	174.3	-74.8	-57.5	0	0	0	112.6	D1932 K1933 L1934 S1940	D1932-N1936 PolarHBondContact O-N 3.17Å; D1932-N1936 PolarHBondContact O-ND2 3.3Å; K1933-N1936 PolarHBondContact O-N 3.32Å; L1934-N1936 PolarHBondContact O-N 3.25Å; N1936-S1940 WeakPolarHBondContact O-CB 3.35Å; N1936-S1940 PolarHBondContact O-N 3.22Å; N1936-S1940 VanDerWaalsContact O-N 3.07Å; N1936-S1940 PolarHBondContact O-OG 3.41Å
1937	A	86.5	Confident	84.4	Confident	7 Å²	7	69 Å²	69	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-65.5	-44.4	174.1	0	0	0	0	0	111.9	K1933 L1934 S1940 L1941 R2031 L2034	K1933-A1937 PolarHBondContact O-N 3.31Å; L1934-A1937 PolarHBondContact O-N 2.94Å; A1937-S1940 PolarHBondContact O-N 2.8Å; A1937-L1941 PolarHBondContact O-N 2.95Å; A1937-R2031 HydrophobicContact CB-CB 4.41Å; A1937-L2034 HydrophobicContact CB-CD1 4.3Å
1938	T	87.9	Confident	84.4	Confident	50 Å²	50	68.4 Å²	68.4	31%	0.307	36%	0.359	S	S	.	.	H	α-helix	trans	-65.3	-43	175.9	49.8	0	0	0	0	112.7	L1934 Q1935 S1940 L1941 T1942 R2031	L1934-T1938 HydrophobicContact CD1-CG2 4.39Å; L1934-T1938 PolarHBondContact O-N 2.88Å; L1934-T1938 PolarHBondContact O-OG1 3.16Å; Q1935-T1938 WeakPolarHBondContact CA-OG1 3.44Å; Q1935-T1938 PolarHBondContact O-OG1 2.93Å; T1938-S1940 VanDerWaalsContact C-N 3.31Å; T1938-S1940 PolarHBondContact O-N 3.49Å; T1938-L1941 WeakPolarHBondContact O-CB 3.36Å; T1938-L1941 PolarHBondContact O-N 2.85Å; T1938-T1942 PolarHBondContact O-N 3.36Å; T1938-T1942 PolarHBondContact O-OG1 3.46Å; T1938-R2031 HydrophobicContact CG2-CG 3.82Å
1939	A	82.5	Confident	84.4	Confident	46 Å²	46	69 Å²	69	38%	0.38	36%	0.364	S	S	.	.	H	α-helix	trans	-60.5	-41.1	176.3	0	0	0	0	0	112.2	Q1935 T1942 I1943	Q1935-A1939 WeakPolarHBondContact O-CB 2.95Å; Q1935-A1939 PolarHBondContact O-N 3.01Å; A1939-T1942 PolarHBondContact O-N 2.32Å; A1939-I1943 WeakPolarHBondContact O-CD1 2.86Å; A1939-I1943 WeakPolarHBondContact O-CG1 3.42Å; A1939-I1943 PolarHBondContact O-N 3.33Å
1940	S	84	Confident	84.5	Confident	53 Å²	53	66.5 Å²	66.5	37%	0.371	36%	0.361	S	S	.	.	H	α-helix	trans	-64.9	-38.7	176.1	-61.3	0	0	0	0	112.4	N1936 A1937 T1938 K1944	N1936-S1940 WeakPolarHBondContact O-CB 3.35Å; N1936-S1940 PolarHBondContact O-N 3.22Å; N1936-S1940 VanDerWaalsContact O-N 3.07Å; N1936-S1940 PolarHBondContact O-OG 3.41Å; A1937-S1940 PolarHBondContact O-N 2.8Å; T1938-S1940 VanDerWaalsContact C-N 3.31Å; T1938-S1940 PolarHBondContact O-N 3.49Å; S1940-K1944 VanDerWaalsContact O-CG 3.29Å; S1940-K1944 WeakPolarHBondContact O-CG 3.3Å; S1940-K1944 PolarHBondContact O-N 3.45Å
1941	L	86.6	Confident	84.5	Confident	5 Å²	5	67.5 Å²	67.5	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-60.9	-54.6	173.3	-81.9	163.9	0	0	0	111.8	A1937 T1938 I1943 K1944 E1945 I2024 L2027 T2028 R2031	A1937-L1941 PolarHBondContact O-N 2.95Å; T1938-L1941 WeakPolarHBondContact O-CB 3.36Å; T1938-L1941 PolarHBondContact O-N 2.85Å; L1941-I1943 VanDerWaalsContact C-N 3.27Å; L1941-I1943 PolarHBondContact O-N 3.39Å; L1941-K1944 CarbonylContact O-C 3.6Å; L1941-K1944 WeakPolarHBondContact O-CA 3.24Å; L1941-K1944 PolarHBondContact O-N 3.13Å; L1941-E1945 WeakPolarHBondContact O-CG 3.41Å; L1941-E1945 PolarHBondContact O-N 2.82Å; L1941-I2024 HydrophobicContact CD2-CB 4.34Å; L1941-I2024 HydrophobicContact CD2-CG1 4.48Å; L1941-I2024 HydrophobicContact CD2-CG2 3.82Å; L1941-L2027 HydrophobicContact CD1-CB 4.42Å; L1941-L2027 HydrophobicContact CD2-CB 3.68Å; L1941-L2027 HydrophobicContact CG-CB 3.79Å; L1941-T2028 WeakPolarHBondContact CD2-OG1 3.07Å; L1941-R2031 HydrophobicContact CD1-CB 3.98Å; L1941-R2031 HydrophobicContact CD1-CG 4.35Å
1942	T	84.3	Confident	84.5	Confident	87 Å²	87	65.6 Å²	65.6	53%	0.534	36%	0.362	S	S	.	.	H	α-helix	trans	-59	-38.1	-176	-54	0	0	0	0	112.4	T1938 A1939 A1946	T1938-T1942 PolarHBondContact O-N 3.36Å; T1938-T1942 PolarHBondContact O-OG1 3.46Å; A1939-T1942 PolarHBondContact O-N 2.32Å; T1942-A1946 WeakPolarHBondContact O-CB 3.39Å; T1942-A1946 PolarHBondContact O-N 3.11Å; T1942-A1946 VanDerWaalsContact O-N 3.08Å
1943	I	82.2	Confident	84.5	Confident	115 Å²	115	68.8 Å²	68.8	59%	0.59	38%	0.375	S	S	*	.	H	α-helix	trans	-65	-40.2	174.9	-66.6	167	0	0	0	111.2	A1939 L1941 T1947	A1939-I1943 WeakPolarHBondContact O-CD1 2.86Å; A1939-I1943 WeakPolarHBondContact O-CG1 3.42Å; A1939-I1943 PolarHBondContact O-N 3.33Å; L1941-I1943 VanDerWaalsContact C-N 3.27Å; L1941-I1943 PolarHBondContact O-N 3.39Å; I1943-T1947 PolarHBondContact O-N 3.41Å; I1943-T1947 VanDerWaalsContact O-N 3.09Å; I1943-T1947 PolarHBondContact O-OG1 3.12Å
1944	K	85.8	Confident	84.3	Confident	87 Å²	87	68.4 Å²	68.4	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-72.1	-40.1	177.9	-69.7	-67.5	-178.4	-176.8	0	112.6	S1940 L1941 T1947 I1948 I2024	S1940-K1944 VanDerWaalsContact O-CG 3.29Å; S1940-K1944 WeakPolarHBondContact O-CG 3.3Å; S1940-K1944 PolarHBondContact O-N 3.45Å; L1941-K1944 CarbonylContact O-C 3.6Å; L1941-K1944 WeakPolarHBondContact O-CA 3.24Å; L1941-K1944 PolarHBondContact O-N 3.13Å; K1944-T1947 WeakPolarHBondContact O-CB 3.43Å; K1944-T1947 PolarHBondContact O-N 2.94Å; K1944-I1948 WeakPolarHBondContact O-CG1 3.46Å; K1944-I1948 PolarHBondContact O-N 2.91Å; K1944-I2024 HydrophobicContact CB-CD1 3.82Å; K1944-I2024 HydrophobicContact CB-CG1 3.61Å
1945	E	82.9	Confident	84.2	Confident	97 Å²	97	68.1 Å²	68.1	45%	0.453	37%	0.373	S	S	.	.	H	α-helix	trans	-58.9	-47	174.6	-71.4	-180	127.1	0	0	111.1	L1941 T1947 I1948 Q1949 I2024	L1941-E1945 WeakPolarHBondContact O-CG 3.41Å; L1941-E1945 PolarHBondContact O-N 2.82Å; E1945-T1947 VanDerWaalsContact C-N 3.32Å; E1945-T1947 PolarHBondContact O-N 2.76Å; E1945-I1948 PolarHBondContact O-N 3.27Å; E1945-I1948 VanDerWaalsContact O-N 3.17Å; E1945-Q1949 PolarHBondContact O-N 2.87Å; E1945-I2024 HydrophobicContact CB-CD1 4.43Å; E1945-I2024 HydrophobicContact CG-CD1 3.79Å
1946	A	80.8	Confident	84.2	Confident	57 Å²	57	67 Å²	67	47%	0.471	37%	0.37	S	S	.	.	H	α-helix	trans	-60.8	-40.1	174.6	0	0	0	0	0	112.4	T1942 I1948 Q1949 A1950	T1942-A1946 WeakPolarHBondContact O-CB 3.39Å; T1942-A1946 PolarHBondContact O-N 3.11Å; T1942-A1946 VanDerWaalsContact O-N 3.08Å; A1946-I1948 VanDerWaalsContact C-N 3.32Å; A1946-I1948 PolarHBondContact O-N 3.1Å; A1946-Q1949 PolarHBondContact O-N 3.48Å; A1946-A1950 PolarHBondContact O-N 2.92Å; A1946-A1950 VanDerWaalsContact O-N 3.12Å
1947	T	83.4	Confident	84.4	Confident	57 Å²	57	68.2 Å²	68.2	35%	0.35	37%	0.373	S	S	.	.	H	α-helix	trans	-62.4	-38.9	175.4	-52.3	0	0	0	0	111.8	I1943 K1944 E1945 Q1951	I1943-T1947 PolarHBondContact O-N 3.41Å; I1943-T1947 VanDerWaalsContact O-N 3.09Å; I1943-T1947 PolarHBondContact O-OG1 3.12Å; K1944-T1947 WeakPolarHBondContact O-CB 3.43Å; K1944-T1947 PolarHBondContact O-N 2.94Å; E1945-T1947 VanDerWaalsContact C-N 3.32Å; E1945-T1947 PolarHBondContact O-N 2.76Å; T1947-Q1951 WeakPolarHBondContact O-CG 3.28Å; T1947-Q1951 PolarHBondContact O-N 3.45Å
1948	I	84.1	Confident	84.1	Confident	18 Å²	18	69.9 Å²	69.9	9%	0.092	38%	0.379	C	S	.	.	H	α-helix	trans	-69.4	-42.9	177	-74.9	-170.9	0	0	0	111.4	K1944 E1945 A1946 A1950 Q1951 I1952 L2017 A2020 K2021 I2024	K1944-I1948 WeakPolarHBondContact O-CG1 3.46Å; K1944-I1948 PolarHBondContact O-N 2.91Å; E1945-I1948 PolarHBondContact O-N 3.27Å; E1945-I1948 VanDerWaalsContact O-N 3.17Å; A1946-I1948 VanDerWaalsContact C-N 3.32Å; A1946-I1948 PolarHBondContact O-N 3.1Å; I1948-A1950 VanDerWaalsContact C-N 3.33Å; I1948-A1950 PolarHBondContact O-N 3.01Å; I1948-Q1951 PolarHBondContact O-N 2.88Å; I1948-I1952 HydrophobicContact CG2-CD1 3.82Å; I1948-I1952 HydrophobicContact CG2-CG1 4.45Å; I1948-I1952 WeakPolarHBondContact O-CG1 3.49Å; I1948-I1952 PolarHBondContact O-N 3.43Å; I1948-L2017 HydrophobicContact CB-CD1 4.31Å; I1948-L2017 HydrophobicContact CG1-CD1 4.38Å; I1948-L2017 HydrophobicContact CG2-CD1 3.89Å; I1948-A2020 HydrophobicContact CD1-CB 3.71Å; I1948-A2020 HydrophobicContact CG1-CB 3.61Å; I1948-K2021 HydrophobicContact CD1-CG 3.89Å; I1948-I2024 HydrophobicContact CD1-CD1 3.43Å; I1948-I2024 VanDerWaalsContact CD1-CD1 3.43Å; I1948-I2024 HydrophobicContact CD1-CG1 4.21Å; I1948-I2024 HydrophobicContact CG1-CD1 4.21Å
1949	Q	84.2	Confident	83.9	Confident	136 Å²	136	70 Å²	70	64%	0.636	38%	0.377	S	S	*	.	H	α-helix	trans	-60.6	-42.4	177.8	-72.3	-175.7	4.2	0	0	111.9	E1945 A1946 I1952 Q1953	E1945-Q1949 PolarHBondContact O-N 2.87Å; A1946-Q1949 PolarHBondContact O-N 3.48Å; Q1949-I1952 PolarHBondContact O-N 2.72Å; Q1949-Q1953 PolarHBondContact O-N 3.04Å; Q1949-Q1953 VanDerWaalsContact O-N 3.07Å
1950	A	84.1	Confident	84	Confident	55 Å²	55	73 Å²	73	46%	0.455	39%	0.386	S	S	.	.	H	α-helix	trans	-60.5	-45.3	174	0	0	0	0	0	112.4	A1946 I1948 I1952 Q1953 E1954	A1946-A1950 PolarHBondContact O-N 2.92Å; A1946-A1950 VanDerWaalsContact O-N 3.12Å; I1948-A1950 VanDerWaalsContact C-N 3.33Å; I1948-A1950 PolarHBondContact O-N 3.01Å; A1950-I1952 VanDerWaalsContact C-N 3.3Å; A1950-I1952 PolarHBondContact O-N 2.96Å; A1950-Q1953 PolarHBondContact O-N 3.08Å; A1950-E1954 PolarHBondContact O-N 3.42Å
1951	Q	85.2	Confident	83.9	Confident	36 Å²	36	74.1 Å²	74.1	17%	0.168	39%	0.385	C	S	.	.	H	α-helix	trans	-68	-26.5	178.1	-71.9	-177	7.8	0	0	113.3	T1947 I1948 I1955 I2013 S2016 L2017	T1947-Q1951 WeakPolarHBondContact O-CG 3.28Å; T1947-Q1951 PolarHBondContact O-N 3.45Å; I1948-Q1951 PolarHBondContact O-N 2.88Å; Q1951-I1955 WeakPolarHBondContact O-CD1 3.42Å; Q1951-I1955 VanDerWaalsContact O-CG1 3.29Å; Q1951-I1955 WeakPolarHBondContact O-CG1 2.97Å; Q1951-I1955 PolarHBondContact O-N 3.36Å; Q1951-I2013 HydrophobicContact CB-CG2 4.25Å; Q1951-I2013 HydrophobicContact CG-CG2 4.39Å; Q1951-S2016 PolarHBondContact NE2-OG 3.28Å; Q1951-S2016 PolarHBondContact OE1-OG 3.05Å; Q1951-L2017 HydrophobicContact CB-CD1 3.62Å
1952	I	85	Confident	83.8	Confident	71 Å²	71	78.9 Å²	78.9	36%	0.364	40%	0.403	S	S	.	.	H	α-helix	trans	-70.3	-45.6	171.7	-69.6	167.9	0	0	0	110.6	I1948 Q1949 A1950 E1954 I1955 D1956 L2017	I1948-I1952 HydrophobicContact CG2-CD1 3.82Å; I1948-I1952 HydrophobicContact CG2-CG1 4.45Å; I1948-I1952 WeakPolarHBondContact O-CG1 3.49Å; I1948-I1952 PolarHBondContact O-N 3.43Å; Q1949-I1952 PolarHBondContact O-N 2.72Å; A1950-I1952 VanDerWaalsContact C-N 3.3Å; A1950-I1952 PolarHBondContact O-N 2.96Å; I1952-E1954 VanDerWaalsContact C-N 3.33Å; I1952-E1954 PolarHBondContact O-N 3.27Å; I1952-I1955 PolarHBondContact O-N 3.25Å; I1952-D1956 PolarHBondContact O-N 3.06Å; I1952-L2017 HydrophobicContact CG1-CD1 3.84Å; I1952-L2017 HydrophobicContact CG1-CD2 4.05Å
1953	Q	84.3	Confident	83.7	Confident	139 Å²	139	81.7 Å²	81.7	65%	0.65	41%	0.407	S	S	*	.	H	α-helix	trans	-58.8	-44.5	175.5	-73.1	-176.3	-45.5	0	0	111.7	Q1949 A1950 I1955 D1956 E1957	Q1949-Q1953 PolarHBondContact O-N 3.04Å; Q1949-Q1953 VanDerWaalsContact O-N 3.07Å; A1950-Q1953 PolarHBondContact O-N 3.08Å; Q1953-I1955 VanDerWaalsContact C-N 3.33Å; Q1953-I1955 PolarHBondContact O-N 2.93Å; Q1953-D1956 PolarHBondContact O-N 3.26Å; Q1953-E1957 PolarHBondContact O-N 3.43Å
1954	E	83.8	Confident	83.9	Confident	83 Å²	83	81 Å²	81	39%	0.388	40%	0.4	S	S	.	.	H	α-helix	trans	-56	-46.2	175.3	-138.1	-169.1	159.5	0	0	111.3	A1950 I1952 D1956 E1957 F1958 I2013	A1950-E1954 PolarHBondContact O-N 3.42Å; I1952-E1954 VanDerWaalsContact C-N 3.33Å; I1952-E1954 PolarHBondContact O-N 3.27Å; E1954-D1956 PolarHBondContact O-N 3.25Å; E1954-E1957 PolarHBondContact O-N 3.17Å; E1954-F1958 HydrophobicContact CB-CE2 4.41Å; E1954-F1958 HydrophobicContact CG-CE2 3.82Å; E1954-F1958 HydrophobicContact CG-CZ 4.49Å; E1954-F1958 WeakPolarHBondContact O-CD2 3.37Å; E1954-F1958 PolarHBondContact O-N 2.91Å; E1954-F1958 VanDerWaalsContact O-N 3.09Å; E1954-I2013 HydrophobicContact CG-CD1 4.47Å; E1954-I2013 WeakPolarHBondContact OE1-CD1 3.47Å
1955	I	84.1	Confident	83.8	Confident	13 Å²	13	78 Å²	78	7%	0.067	39%	0.388	C	S	.	.	H	α-helix	trans	-63.4	-40.9	177.5	-73	165.7	0	0	0	112.1	Q1951 I1952 Q1953 F1958 L1959 R2010 I2013 Q2014 L2017	Q1951-I1955 WeakPolarHBondContact O-CD1 3.42Å; Q1951-I1955 VanDerWaalsContact O-CG1 3.29Å; Q1951-I1955 WeakPolarHBondContact O-CG1 2.97Å; Q1951-I1955 PolarHBondContact O-N 3.36Å; I1952-I1955 PolarHBondContact O-N 3.25Å; Q1953-I1955 VanDerWaalsContact C-N 3.33Å; Q1953-I1955 PolarHBondContact O-N 2.93Å; I1955-F1958 PolarHBondContact O-N 2.86Å; I1955-L1959 HydrophobicContact CG2-CD1 4.18Å; I1955-L1959 WeakPolarHBondContact O-CG 3.44Å; I1955-L1959 PolarHBondContact O-N 3.44Å; I1955-R2010 HydrophobicContact CG1-CG 4.45Å; I1955-R2010 HydrophobicContact CG2-CG 4.12Å; I1955-I2013 HydrophobicContact CD1-CG2 4.04Å; I1955-I2013 HydrophobicContact CG1-CB 4.35Å; I1955-I2013 HydrophobicContact CG1-CG2 3.91Å; I1955-Q2014 HydrophobicContact CD1-CB 4.44Å; I1955-L2017 HydrophobicContact CD1-CB 4.47Å; I1955-L2017 HydrophobicContact CD1-CD2 3.95Å
1956	D	85.3	Confident	83.9	Confident	87 Å²	87	76.7 Å²	76.7	47%	0.465	38%	0.382	S	S	.	.	H	α-helix	trans	-68.7	-36.8	178.1	-84.6	-31	0	0	0	112.3	I1952 Q1953 E1954 L1959 I1960	I1952-D1956 PolarHBondContact O-N 3.06Å; Q1953-D1956 PolarHBondContact O-N 3.26Å; E1954-D1956 PolarHBondContact O-N 3.25Å; D1956-L1959 WeakPolarHBondContact O-CB 3.19Å; D1956-L1959 PolarHBondContact O-N 2.86Å; D1956-L1959 VanDerWaalsContact O-N 3.14Å; D1956-I1960 WeakPolarHBondContact O-CG1 3.48Å; D1956-I1960 PolarHBondContact O-N 2.89Å
1957	E	84.5	Confident	84.2	Confident	133 Å²	133	77.7 Å²	77.7	62%	0.621	38%	0.382	S	S	*	.	H	α-helix	trans	-60.6	-47.1	171.2	-72.6	-170.5	167.9	0	0	111.5	Q1953 E1954 L1959 I1960 E1961	Q1953-E1957 PolarHBondContact O-N 3.43Å; E1954-E1957 PolarHBondContact O-N 3.17Å; E1957-L1959 PolarHBondContact O-N 3.28Å; E1957-I1960 PolarHBondContact O-N 3.12Å; E1957-I1960 VanDerWaalsContact O-N 3.09Å; E1957-E1961 PolarHBondContact O-N 2.91Å
1958	F	81.6	Confident	84.2	Confident	42 Å²	42	78.2 Å²	78.2	18%	0.184	38%	0.381	C	S	.	.	H	α-helix	trans	-60.4	-31.7	173.5	-67.5	-58.8	0	0	0	112.7	E1954 I1955 R1962 E2006 R2010 I2013	E1954-F1958 HydrophobicContact CB-CE2 4.41Å; E1954-F1958 HydrophobicContact CG-CE2 3.82Å; E1954-F1958 HydrophobicContact CG-CZ 4.49Å; E1954-F1958 WeakPolarHBondContact O-CD2 3.37Å; E1954-F1958 PolarHBondContact O-N 2.91Å; E1954-F1958 VanDerWaalsContact O-N 3.09Å; I1955-F1958 PolarHBondContact O-N 2.86Å; F1958-R1962 WeakPolarHBondContact O-CB 3.4Å; F1958-R1962 PolarHBondContact O-N 3.24Å; F1958-E2006 HydrophobicContact CD1-CB 4.45Å; F1958-E2006 VanDerWaalsContact CD1-OE2 3.27Å; F1958-E2006 WeakPolarHBondContact CD1-OE2 3.49Å; F1958-E2006 WeakPolarHBondContact CE1-OE2 3.23Å; F1958-R2010 HydrophobicContact CB-CB 4.25Å; F1958-R2010 HydrophobicContact CB-CG 4.41Å; F1958-I2013 HydrophobicContact CD2-CD1 4.21Å; F1958-I2013 HydrophobicContact CE2-CD1 3.43Å; F1958-I2013 VanDerWaalsContact CE2-CD1 3.43Å; F1958-I2013 HydrophobicContact CZ-CD1 4.17Å
1959	L	82.8	Confident	84.2	Confident	53 Å²	53	77.4 Å²	77.4	28%	0.277	38%	0.377	S	S	.	.	H	α-helix	trans	-73.8	-31.9	175.1	-71.7	172.4	0	0	0	113	I1955 D1956 E1957 K1963	I1955-L1959 HydrophobicContact CG2-CD1 4.18Å; I1955-L1959 WeakPolarHBondContact O-CG 3.44Å; I1955-L1959 PolarHBondContact O-N 3.44Å; D1956-L1959 WeakPolarHBondContact O-CB 3.19Å; D1956-L1959 PolarHBondContact O-N 2.86Å; D1956-L1959 VanDerWaalsContact O-N 3.14Å; E1957-L1959 PolarHBondContact O-N 3.28Å; L1959-K1963 WeakPolarHBondContact O-CG 3.45Å; L1959-K1963 PolarHBondContact O-N 3.38Å
1960	I	85.5	Confident	84.2	Confident	110 Å²	110	74.6 Å²	74.6	56%	0.564	37%	0.366	S	S	*	.	H	α-helix	trans	-71.9	-49.7	173.8	-68.5	164.4	0	0	0	110.4	D1956 E1957 R1962 K1963 K1964	D1956-I1960 WeakPolarHBondContact O-CG1 3.48Å; D1956-I1960 PolarHBondContact O-N 2.89Å; E1957-I1960 PolarHBondContact O-N 3.12Å; E1957-I1960 VanDerWaalsContact O-N 3.09Å; I1960-R1962 VanDerWaalsContact C-N 3.32Å; I1960-R1962 PolarHBondContact O-N 3.45Å; I1960-K1963 PolarHBondContact O-N 3.5Å; I1960-K1963 VanDerWaalsContact O-N 3.15Å; I1960-K1964 WeakPolarHBondContact O-CB 2.95Å; I1960-K1964 PolarHBondContact O-N 3.06Å
1961	E	81.9	Confident	84.1	Confident	76 Å²	76	76.9 Å²	76.9	36%	0.355	37%	0.367	S	S	.	.	H	α-helix	trans	-54.5	-47.8	173	-82.4	-81.6	107.6	0	0	110.6	E1957 K1963 K1964 M1965	E1957-E1961 PolarHBondContact O-N 2.91Å; E1961-K1963 VanDerWaalsContact C-N 3.33Å; E1961-K1963 PolarHBondContact O-N 2.95Å; E1961-K1964 WeakPolarHBondContact O-CB 3.49Å; E1961-K1964 PolarHBondContact O-N 3.17Å; E1961-K1964 VanDerWaalsContact O-N 3.17Å; E1961-K1964 IonicContact OE1-NZ 2.69Å; E1961-K1964 PolarHBondContact OE1-NZ 2.92Å; E1961-M1965 WeakPolarHBondContact O-CB 3.31Å; E1961-M1965 WeakPolarHBondContact O-CG 3.18Å; E1961-M1965 PolarHBondContact O-N 3.43Å
1962	R	84	Confident	83.9	Confident	104 Å²	104	76.3 Å²	76.3	39%	0.392	37%	0.365	S	S	.	.	H	α-helix	trans	-58.5	-40.7	177.3	-163.6	-172.9	79.5	129.4	4.4	112.9	F1958 I1960 Q1966 L2003 T2007	F1958-R1962 WeakPolarHBondContact O-CB 3.4Å; F1958-R1962 PolarHBondContact O-N 3.24Å; I1960-R1962 VanDerWaalsContact C-N 3.32Å; I1960-R1962 PolarHBondContact O-N 3.45Å; R1962-Q1966 VanDerWaalsContact O-CB 3.29Å; R1962-Q1966 WeakPolarHBondContact O-CB 3.23Å; R1962-Q1966 PolarHBondContact O-N 3.35Å; R1962-L2003 HydrophobicContact CB-CD1 4.43Å; R1962-L2003 HydrophobicContact CG-CD1 3.56Å; R1962-L2003 HydrophobicContact CG-CG 4.18Å; R1962-T2007 VanDerWaalsContact CD-CG2 3.45Å; R1962-T2007 HydrophobicContact CG-CG2 4.29Å
1963	K	83.1	Confident	83.8	Confident	146 Å²	146	76.3 Å²	76.3	64%	0.635	36%	0.362	S	S	*	.	H	α-helix	trans	-64.5	-46.2	175.8	-77.4	172.7	-179.1	171.3	0	111.6	L1959 I1960 E1961 Q1966 T1967	L1959-K1963 WeakPolarHBondContact O-CG 3.45Å; L1959-K1963 PolarHBondContact O-N 3.38Å; I1960-K1963 PolarHBondContact O-N 3.5Å; I1960-K1963 VanDerWaalsContact O-N 3.15Å; E1961-K1963 VanDerWaalsContact C-N 3.33Å; E1961-K1963 PolarHBondContact O-N 2.95Å; K1963-Q1966 WeakPolarHBondContact O-CB 3.19Å; K1963-Q1966 PolarHBondContact O-N 3.07Å; K1963-T1967 PolarHBondContact O-N 2.72Å; K1963-T1967 PolarHBondContact O-OG1 2.84Å
1964	K	85.7	Confident	83.5	Confident	101 Å²	101	74.9 Å²	74.9	44%	0.439	36%	0.359	S	S	.	.	H	α-helix	trans	-62.4	-41.7	179.6	175.2	-176.2	166.2	-158.9	0	112.2	I1960 E1961 T1967 Q1968	I1960-K1964 WeakPolarHBondContact O-CB 2.95Å; I1960-K1964 PolarHBondContact O-N 3.06Å; E1961-K1964 WeakPolarHBondContact O-CB 3.49Å; E1961-K1964 PolarHBondContact O-N 3.17Å; E1961-K1964 VanDerWaalsContact O-N 3.17Å; E1961-K1964 IonicContact OE1-NZ 2.69Å; E1961-K1964 PolarHBondContact OE1-NZ 2.92Å; K1964-T1967 PolarHBondContact O-OG1 2.63Å; K1964-Q1968 WeakPolarHBondContact O-CG 3.2Å; K1964-Q1968 PolarHBondContact O-N 3.42Å; K1964-Q1968 VanDerWaalsContact O-N 3.1Å
1965	M	83.4	Confident	83.1	Confident	24 Å²	24	75.4 Å²	75.4	12%	0.118	36%	0.36	C	S	.	.	H	α-helix	trans	-67.5	-42.8	174.6	-64.6	-70.4	-101.4	0	0	111.2	E1961 T1967 Q1968 I1969 F1999 R2002 L2003	E1961-M1965 WeakPolarHBondContact O-CB 3.31Å; E1961-M1965 WeakPolarHBondContact O-CG 3.18Å; E1961-M1965 PolarHBondContact O-N 3.43Å; M1965-T1967 PolarHBondContact O-N 3.49Å; M1965-Q1968 PolarHBondContact O-N 3.04Å; M1965-I1969 VanDerWaalsContact O-CG1 3.31Å; M1965-I1969 WeakPolarHBondContact O-CG1 3.39Å; M1965-I1969 PolarHBondContact O-N 2.83Å; M1965-F1999 HydrophobicContact CE-CD1 3.74Å; M1965-F1999 HydrophobicContact CE-CE1 4.32Å; M1965-F1999 HydrophobicContact SD-CD1 3.68Å; M1965-F1999 HydrophobicContact SD-CE1 3.97Å; M1965-R2002 HydrophobicContact CE-CB 3.52Å; M1965-R2002 HydrophobicContact CE-CG 4.21Å; M1965-L2003 HydrophobicContact CB-CD1 3.73Å
1966	Q	86.1	Confident	82.4	Confident	69 Å²	69	77 Å²	77	32%	0.322	37%	0.368	S	S	.	.	H	α-helix	trans	-59.5	-46.4	174	-172.2	66.6	58.9	0	0	111.9	R1962 K1963 Q1968 I1969 D1970	R1962-Q1966 VanDerWaalsContact O-CB 3.29Å; R1962-Q1966 WeakPolarHBondContact O-CB 3.23Å; R1962-Q1966 PolarHBondContact O-N 3.35Å; K1963-Q1966 WeakPolarHBondContact O-CB 3.19Å; K1963-Q1966 PolarHBondContact O-N 3.07Å; Q1966-Q1968 VanDerWaalsContact C-N 3.3Å; Q1966-Q1968 PolarHBondContact O-N 3.36Å; Q1966-I1969 WeakPolarHBondContact O-CB 3.02Å; Q1966-I1969 PolarHBondContact O-N 3.47Å; Q1966-D1970 PolarHBondContact NE2-OD1 2.81Å; Q1966-D1970 PolarHBondContact NE2-OD2 3.47Å; Q1966-D1970 WeakPolarHBondContact O-CB 3.49Å; Q1966-D1970 PolarHBondContact O-N 2.94Å
1967	T	85.6	Confident	81.6	Confident	79 Å²	79	79.1 Å²	79.1	49%	0.485	38%	0.379	S	S	.	.	H	α-helix	trans	-65.3	-32	177.8	51.8	0	0	0	0	112.8	K1963 K1964 M1965 D1970 E1971	K1963-T1967 PolarHBondContact O-N 2.72Å; K1963-T1967 PolarHBondContact O-OG1 2.84Å; K1964-T1967 PolarHBondContact O-OG1 2.63Å; M1965-T1967 PolarHBondContact O-N 3.49Å; T1967-D1970 PolarHBondContact O-N 2.97Å; T1967-E1971 WeakPolarHBondContact O-CB 3.38Å; T1967-E1971 PolarHBondContact O-N 3.32Å
1968	Q	83.8	Confident	80.6	Confident	68 Å²	68	77 Å²	77	32%	0.318	38%	0.376	S	S	.	.	H	α-helix	trans	-69.8	-39.1	172.6	-72.7	-179.5	19.4	0	0	112.6	K1964 M1965 Q1966 L1972 F1999	K1964-Q1968 WeakPolarHBondContact O-CG 3.2Å; K1964-Q1968 PolarHBondContact O-N 3.42Å; K1964-Q1968 VanDerWaalsContact O-N 3.1Å; M1965-Q1968 PolarHBondContact O-N 3.04Å; Q1966-Q1968 VanDerWaalsContact C-N 3.3Å; Q1966-Q1968 PolarHBondContact O-N 3.36Å; Q1968-L1972 WeakPolarHBondContact O-CB 3.33Å; Q1968-L1972 WeakPolarHBondContact O-CD1 3.36Å; Q1968-L1972 VanDerWaalsContact O-CG 3.22Å; Q1968-L1972 WeakPolarHBondContact O-CG 3.3Å; Q1968-L1972 PolarHBondContact O-N 2.76Å; Q1968-F1999 VanDerWaalsContact OE1-CZ 3.25Å
1969	I	84.9	Confident	79.3	Confident	1 Å²	1	78.4 Å²	78.4	1%	0.005	39%	0.385	C	S	.	.	H	α-helix	trans	-60.6	-46.8	171.9	-71.2	161.8	0	0	0	110.1	M1965 Q1966 L1972 K1973 F1999 E2000 L2003	M1965-I1969 VanDerWaalsContact O-CG1 3.31Å; M1965-I1969 WeakPolarHBondContact O-CG1 3.39Å; M1965-I1969 PolarHBondContact O-N 2.83Å; Q1966-I1969 WeakPolarHBondContact O-CB 3.02Å; Q1966-I1969 PolarHBondContact O-N 3.47Å; I1969-L1972 PolarHBondContact O-N 3.2Å; I1969-K1973 HydrophobicContact CG2-CD 3.81Å; I1969-K1973 VanDerWaalsContact CG2-CE 3.47Å; I1969-K1973 WeakPolarHBondContact O-CB 3.49Å; I1969-K1973 VanDerWaalsContact O-CG 3.3Å; I1969-K1973 WeakPolarHBondContact O-CG 3.36Å; I1969-K1973 PolarHBondContact O-N 3.42Å; I1969-F1999 HydrophobicContact CD1-CB 3.99Å; I1969-F1999 HydrophobicContact CG1-CB 3.58Å; I1969-E2000 HydrophobicContact CD1-CG 3.85Å; I1969-E2000 HydrophobicContact CG1-CG 4.27Å; I1969-E2000 HydrophobicContact CG2-CG 4.34Å; I1969-L2003 HydrophobicContact CD1-CD2 4.23Å
1970	D	84.1	Confident	77.8	Confident	77 Å²	77	82.5 Å²	82.5	41%	0.412	41%	0.407	S	S	.	.	H	α-helix	trans	-70.2	-38	-177.5	-62.5	-19.8	0	0	0	111.7	Q1966 T1967 K1973 L1974	Q1966-D1970 PolarHBondContact NE2-OD1 2.81Å; Q1966-D1970 PolarHBondContact NE2-OD2 3.47Å; Q1966-D1970 WeakPolarHBondContact O-CB 3.49Å; Q1966-D1970 PolarHBondContact O-N 2.94Å; T1967-D1970 PolarHBondContact O-N 2.97Å; D1970-K1973 PolarHBondContact O-N 3.27Å; D1970-L1974 WeakPolarHBondContact O-CB 3.17Å; D1970-L1974 PolarHBondContact O-N 3.44Å
1971	E	82.7	Confident	76.5	Confident	103 Å²	103	84.9 Å²	84.9	48%	0.481	42%	0.42	S	S	.	.	H	α-helix	trans	-60.8	-43.8	169.6	-92.7	-164.9	-136.2	0	0	112.7	T1967 L1974 K1975	T1967-E1971 WeakPolarHBondContact O-CB 3.38Å; T1967-E1971 PolarHBondContact O-N 3.32Å; E1971-L1974 PolarHBondContact O-N 2.94Å; E1971-K1975 WeakPolarHBondContact O-CB 3.41Å; E1971-K1975 WeakPolarHBondContact O-CD 3.46Å; E1971-K1975 VanDerWaalsContact O-CG 3.27Å; E1971-K1975 WeakPolarHBondContact O-CG 3.49Å; E1971-K1975 PolarHBondContact O-N 3.43Å; E1971-K1975 IonicContact OE2-NZ 2.59Å; E1971-K1975 PolarHBondContact OE2-NZ 2.81Å
1972	L	81	Confident	75.2	Confident	23 Å²	23	88.6 Å²	88.6	12%	0.12	44%	0.442	C	S	.	.	H	α-helix	trans	-69.5	-37.2	179.9	-72.8	168.7	0	0	0	111.3	Q1968 I1969 K1975 L1976 L1992 K1995 I1996 F1999	Q1968-L1972 WeakPolarHBondContact O-CB 3.33Å; Q1968-L1972 WeakPolarHBondContact O-CD1 3.36Å; Q1968-L1972 VanDerWaalsContact O-CG 3.22Å; Q1968-L1972 WeakPolarHBondContact O-CG 3.3Å; Q1968-L1972 PolarHBondContact O-N 2.76Å; I1969-L1972 PolarHBondContact O-N 3.2Å; L1972-K1975 PolarHBondContact O-N 2.96Å; L1972-L1976 WeakPolarHBondContact O-CB 3.49Å; L1972-L1976 PolarHBondContact O-N 2.66Å; L1972-L1992 HydrophobicContact CD2-CD2 3.87Å; L1972-K1995 HydrophobicContact CD1-CG 4.37Å; L1972-I1996 HydrophobicContact CB-CD1 4.02Å; L1972-I1996 HydrophobicContact CB-CG1 3.6Å; L1972-I1996 HydrophobicContact CD1-CG1 4.32Å; L1972-F1999 HydrophobicContact CD1-CD2 3.72Å; L1972-F1999 HydrophobicContact CD1-CE2 3.73Å
1973	K	81.8	Confident	73.8	Confident	71 Å²	71	92.1 Å²	92.1	31%	0.309	46%	0.463	S	S	.	.	H	α-helix	trans	-66.5	-35.7	170.8	-73.2	170.5	-179.9	170	0	112.1	I1969 D1970 L1976 N1977 I1996 E2000	I1969-K1973 HydrophobicContact CG2-CD 3.81Å; I1969-K1973 VanDerWaalsContact CG2-CE 3.47Å; I1969-K1973 WeakPolarHBondContact O-CB 3.49Å; I1969-K1973 VanDerWaalsContact O-CG 3.3Å; I1969-K1973 WeakPolarHBondContact O-CG 3.36Å; I1969-K1973 PolarHBondContact O-N 3.42Å; D1970-K1973 PolarHBondContact O-N 3.27Å; K1973-L1976 WeakPolarHBondContact O-CB 3.39Å; K1973-L1976 PolarHBondContact O-N 3.04Å; K1973-N1977 VanDerWaalsContact O-CG 3.27Å; K1973-N1977 PolarHBondContact O-N 2.92Å; K1973-N1977 VanDerWaalsContact O-N 3.17Å; K1973-N1977 PolarHBondContact O-ND2 2.75Å; K1973-I1996 HydrophobicContact CG-CD1 3.99Å; K1973-I1996 HydrophobicContact CG-CG2 4.48Å; K1973-E2000 VanDerWaalsContact CE-OE1 3.31Å; K1973-E2000 WeakPolarHBondContact CE-OE1 3.43Å; K1973-E2000 IonicContact NZ-OE1 2.66Å; K1973-E2000 PolarHBondContact NZ-OE1 3.22Å
1974	L	77.9	Confident	72.5	Confident	110 Å²	110	87.7 Å²	87.7	58%	0.576	45%	0.448	S	S	*	.	H	α-helix	trans	-64.9	-47.5	172.2	-163.1	90.2	0	0	0	110.8	D1970 E1971 L1976 N1977 T1978	D1970-L1974 WeakPolarHBondContact O-CB 3.17Å; D1970-L1974 PolarHBondContact O-N 3.44Å; E1971-L1974 PolarHBondContact O-N 2.94Å; L1974-L1976 VanDerWaalsContact C-N 3.26Å; L1974-L1976 PolarHBondContact O-N 3.01Å; L1974-N1977 CarbonylContact O-C 3.55Å; L1974-N1977 WeakPolarHBondContact O-CA 3.21Å; L1974-N1977 PolarHBondContact O-N 3.4Å; L1974-T1978 HydrophobicContact CG-CG2 4.23Å; L1974-T1978 WeakPolarHBondContact O-CG2 3.24Å; L1974-T1978 PolarHBondContact O-N 2.72Å; L1974-T1978 PolarHBondContact O-OG1 3.28Å
1975	K	75.3	Confident	71.6	Confident	94 Å²	94	86.5 Å²	86.5	41%	0.409	45%	0.451	S	S	.	.	H	α-helix	trans	-61.4	-33	177.3	-73.1	159.9	-176.9	163.1	0	112.6	E1971 L1972 N1977 T1978 N1979	E1971-K1975 WeakPolarHBondContact O-CB 3.41Å; E1971-K1975 WeakPolarHBondContact O-CD 3.46Å; E1971-K1975 VanDerWaalsContact O-CG 3.27Å; E1971-K1975 WeakPolarHBondContact O-CG 3.49Å; E1971-K1975 PolarHBondContact O-N 3.43Å; E1971-K1975 IonicContact OE2-NZ 2.59Å; E1971-K1975 PolarHBondContact OE2-NZ 2.81Å; L1972-K1975 PolarHBondContact O-N 2.96Å; K1975-N1977 VanDerWaalsContact C-N 3.35Å; K1975-T1978 PolarHBondContact O-OG1 2.98Å; K1975-N1979 PolarHBondContact O-ND2 3.44Å
1976	L	70.3	Confident	71.1	Confident	45 Å²	45	94.5 Å²	94.5	24%	0.236	48%	0.479	C	S	.	.	H	α-helix	trans	-64.1	-38.3	170.9	-165.9	73.8	0	0	0	112	L1972 K1973 L1974 L1989 L1992 I1996	L1972-L1976 WeakPolarHBondContact O-CB 3.49Å; L1972-L1976 PolarHBondContact O-N 2.66Å; K1973-L1976 WeakPolarHBondContact O-CB 3.39Å; K1973-L1976 PolarHBondContact O-N 3.04Å; L1974-L1976 VanDerWaalsContact C-N 3.26Å; L1974-L1976 PolarHBondContact O-N 3.01Å; L1976-L1989 HydrophobicContact CD1-CD1 3.54Å; L1976-L1989 HydrophobicContact CD1-CG 3.94Å; L1976-L1992 HydrophobicContact CD1-CB 4.4Å; L1976-I1996 HydrophobicContact CD2-CD1 4.44Å
1977	N	67.5	Low	70.5	Confident	132 Å²	132	95.2 Å²	95.2	71%	0.706	49%	0.492	S	S	*	.	H	α-helix	trans	-86.4	-27.2	-176.8	-69.3	-25.7	0	0	0	114.5	K1973 L1974 K1975	K1973-N1977 VanDerWaalsContact O-CG 3.27Å; K1973-N1977 PolarHBondContact O-N 2.92Å; K1973-N1977 VanDerWaalsContact O-N 3.17Å; K1973-N1977 PolarHBondContact O-ND2 2.75Å; L1974-N1977 CarbonylContact O-C 3.55Å; L1974-N1977 WeakPolarHBondContact O-CA 3.21Å; L1974-N1977 PolarHBondContact O-N 3.4Å; K1975-N1977 VanDerWaalsContact C-N 3.35Å
1978	T	63.4	Low	69.7	Low	90 Å²	90	96.1 Å²	96.1	55%	0.552	49%	0.491	S	S	*	.	H	α-helix	trans	-80.6	-16.4	-178.9	51.1	0	0	0	0	113.9	L1974 K1975 N1980	L1974-T1978 HydrophobicContact CG-CG2 4.23Å; L1974-T1978 WeakPolarHBondContact O-CG2 3.24Å; L1974-T1978 PolarHBondContact O-N 2.72Å; L1974-T1978 PolarHBondContact O-OG1 3.28Å; K1975-T1978 PolarHBondContact O-OG1 2.98Å; T1978-N1980 PolarHBondContact O-N 3.36Å
1979	N	55	Low	69.4	Low	71 Å²	71	96.2 Å²	96.2	38%	0.38	49%	0.493	S	S	.	.	S	Bend	trans	-81	113.2	177.3	-76.1	-8.8	0	0	0	109.7	K1975 I1981 V1984	K1975-N1979 PolarHBondContact O-ND2 3.44Å; N1979-I1981 PolarHBondContact O-N 3.29Å; N1979-I1981 VanDerWaalsContact O-N 3.14Å; N1979-V1984 HydrophobicContact CB-CG2 3.96Å
1980	N	51.5	Low	69.1	Low	138 Å²	138	100.9 Å²	100.9	74%	0.738	52%	0.515	S	S	*	.			trans	-53	121.8	175.9	-80.7	-32.1	0	0	0	110.5	T1978 D1982 Q1983	T1978-N1980 PolarHBondContact O-N 3.36Å; N1980-D1982 PolarHBondContact O-N 3.43Å; N1980-Q1983 PolarHBondContact O-N 3.48Å
1981	I	57.1	Low	68.9	Low	161 Å²	161	106.4 Å²	106.4	83%	0.826	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.8	-165.9	-68.6	170.6	0	0	0	113.1	N1979	N1979-I1981 PolarHBondContact O-N 3.29Å; N1979-I1981 VanDerWaalsContact O-N 3.14Å
1982	D	55.5	Low	68.8	Low	153 Å²	153	103.2 Å²	103.2	82%	0.818	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-2.6	-175.5	-57.6	-49	0	0	0	115.7	N1980	N1980-D1982 PolarHBondContact O-N 3.43Å
1983	Q	55.2	Low	68.9	Low	179 Å²	179	105.5 Å²	105.5	84%	0.836	53%	0.526	S	S	*	.	S	Bend	trans	-135.4	0	-172.4	-66.3	-166.8	2.6	0	0	118.2	N1980	N1980-Q1983 PolarHBondContact O-N 3.48Å
1984	V	54.3	Low	69.1	Low	52 Å²	52	104.6 Å²	104.6	32%	0.315	53%	0.532	S	S	.	.	S	Bend	trans	-99.3	132.8	179.7	177.8	0	0	0	0	111.8	N1979 E1988	N1979-V1984 HydrophobicContact CB-CG2 3.96Å; V1984-E1988 HydrophobicContact CG1-CB 4.25Å
1985	P	67.9	Low	69.3	Low	77 Å²	77	104.3 Å²	104.3	50%	0.5	53%	0.526	S	S	.	.			trans	-67.1	134.1	177.4	27.5	-34.5	0	0	0	112.1	S1987 E1988	P1985-S1987 PolarHBondContact O-N 2.92Å; P1985-E1988 HydrophobicContact CG-CB 4.49Å; P1985-E1988 PolarHBondContact O-N 2.82Å
1986	R	71.6	Confident	69.8	Low	191 Å²	191	100.4 Å²	100.4	72%	0.721	51%	0.51	S	S	*	.	H	α-helix	trans	-53.2	-32.2	-171.5	-165.1	179.2	-175.1	149	7.4	115.2	E1988 L1989 E1990	R1986-E1988 VanDerWaalsContact C-N 3.29Å; R1986-E1988 PolarHBondContact O-N 3.4Å; R1986-L1989 WeakPolarHBondContact O-CB 3.15Å; R1986-L1989 PolarHBondContact O-N 3.43Å; R1986-E1990 IonicContact NE-OE1 3.52Å; R1986-E1990 WeakPolarHBondContact O-CG 3.32Å; R1986-E1990 PolarHBondContact O-N 2.78Å
1987	S	74.8	Confident	70.6	Confident	85 Å²	85	104.7 Å²	104.7	59%	0.594	52%	0.523	S	S	*	.	H	α-helix	trans	-66	-26.5	177.7	48.1	0	0	0	0	114	P1985 R1991	P1985-S1987 PolarHBondContact O-N 2.92Å; S1987-R1991 WeakPolarHBondContact O-CB 3.13Å; S1987-R1991 PolarHBondContact O-N 2.73Å
1988	E	69.1	Low	71.6	Confident	98 Å²	98	102.4 Å²	102.4	46%	0.458	51%	0.508	S	S	.	.	H	α-helix	trans	-79.4	-36.2	175.7	-171.4	159.2	-142.4	0	0	111.4	V1984 P1985 R1986 R1991 L1992	V1984-E1988 HydrophobicContact CG1-CB 4.25Å; P1985-E1988 HydrophobicContact CG-CB 4.49Å; P1985-E1988 PolarHBondContact O-N 2.82Å; R1986-E1988 VanDerWaalsContact C-N 3.29Å; R1986-E1988 PolarHBondContact O-N 3.4Å; E1988-R1991 PolarHBondContact O-N 2.62Å; E1988-L1992 WeakPolarHBondContact O-CG 3.21Å; E1988-L1992 PolarHBondContact O-N 2.77Å
1989	L	75.5	Confident	72.7	Confident	69 Å²	69	99.3 Å²	99.3	36%	0.361	49%	0.487	S	S	.	.	H	α-helix	trans	-59.9	-51.8	170.6	-162.8	95.7	0	0	0	110.9	L1976 R1986 R1991 L1992 E1993	L1976-L1989 HydrophobicContact CD1-CD1 3.54Å; L1976-L1989 HydrophobicContact CD1-CG 3.94Å; R1986-L1989 WeakPolarHBondContact O-CB 3.15Å; R1986-L1989 PolarHBondContact O-N 3.43Å; L1989-R1991 VanDerWaalsContact C-N 3.25Å; L1989-R1991 PolarHBondContact O-N 3.06Å; L1989-L1992 PolarHBondContact O-N 2.78Å; L1989-E1993 WeakPolarHBondContact O-CG 3.4Å; L1989-E1993 PolarHBondContact O-N 3.39Å
1990	E	79.3	Confident	74.2	Confident	99 Å²	99	99.1 Å²	99.1	46%	0.463	48%	0.483	S	S	.	.	H	α-helix	trans	-58.8	-36	178	-73.5	169.7	-169.7	0	0	111.9	R1986 A1994	R1986-E1990 IonicContact NE-OE1 3.52Å; R1986-E1990 WeakPolarHBondContact O-CG 3.32Å; R1986-E1990 PolarHBondContact O-N 2.78Å; E1990-A1994 VanDerWaalsContact O-CB 3.27Å; E1990-A1994 WeakPolarHBondContact O-CB 3.49Å; E1990-A1994 PolarHBondContact O-N 2.77Å
1991	R	81.1	Confident	75.9	Confident	193 Å²	193	99 Å²	99	73%	0.728	48%	0.479	S	S	*	.	H	α-helix	trans	-69.9	-35.9	175.5	-162.6	173.9	87.1	144.8	0.6	112.9	S1987 E1988 L1989 K1995	S1987-R1991 WeakPolarHBondContact O-CB 3.13Å; S1987-R1991 PolarHBondContact O-N 2.73Å; E1988-R1991 PolarHBondContact O-N 2.62Å; L1989-R1991 VanDerWaalsContact C-N 3.25Å; L1989-R1991 PolarHBondContact O-N 3.06Å; R1991-K1995 WeakPolarHBondContact O-CB 3.08Å; R1991-K1995 PolarHBondContact O-N 3.2Å; R1991-K1995 VanDerWaalsContact O-N 3.16Å
1992	L	79.9	Confident	77.3	Confident	37 Å²	37	97.5 Å²	97.5	19%	0.194	46%	0.462	C	S	.	.	H	α-helix	trans	-69.2	-45.8	174	-73.3	167.1	0	0	0	111.2	L1972 L1976 E1988 L1989 A1994 K1995 I1996	L1972-L1992 HydrophobicContact CD2-CD2 3.87Å; L1976-L1992 HydrophobicContact CD1-CB 4.4Å; E1988-L1992 WeakPolarHBondContact O-CG 3.21Å; E1988-L1992 PolarHBondContact O-N 2.77Å; L1989-L1992 PolarHBondContact O-N 2.78Å; L1992-A1994 VanDerWaalsContact C-N 3.34Å; L1992-A1994 PolarHBondContact O-N 2.65Å; L1992-K1995 PolarHBondContact O-N 2.66Å; L1992-I1996 WeakPolarHBondContact O-CG1 3.47Å; L1992-I1996 PolarHBondContact O-N 3.19Å
1993	E	82.9	Confident	78.8	Confident	70 Å²	70	91.3 Å²	91.3	33%	0.327	43%	0.429	S	S	.	.	H	α-helix	trans	-63.4	-36.7	175.6	-66.3	-177.7	179.7	0	0	113.2	L1989 K1995 R1997	L1989-E1993 WeakPolarHBondContact O-CG 3.4Å; L1989-E1993 PolarHBondContact O-N 3.39Å; E1993-K1995 VanDerWaalsContact C-N 3.34Å; E1993-R1997 WeakPolarHBondContact O-CG 3.34Å; E1993-R1997 PolarHBondContact O-N 3.22Å; E1993-R1997 VanDerWaalsContact O-N 3.11Å; E1993-R1997 PolarHBondContact O-NE 3.43Å; E1993-R1997 IonicContact OE2-CZ 3.96Å; E1993-R1997 IonicContact OE2-NH2 3.08Å; E1993-R1997 PolarHBondContact OE2-NH2 2.74Å; E1993-R1997 VanDerWaalsContact OE2-NH2 3.08Å
1994	A	85.3	Confident	80.2	Confident	53 Å²	53	88.2 Å²	88.2	44%	0.438	42%	0.418	S	S	.	.	H	α-helix	trans	-63	-42.2	173.9	0	0	0	0	0	111.1	E1990 L1992 R1997 E1998	E1990-A1994 VanDerWaalsContact O-CB 3.27Å; E1990-A1994 WeakPolarHBondContact O-CB 3.49Å; E1990-A1994 PolarHBondContact O-N 2.77Å; L1992-A1994 VanDerWaalsContact C-N 3.34Å; L1992-A1994 PolarHBondContact O-N 2.65Å; A1994-R1997 PolarHBondContact O-N 3.03Å; A1994-E1998 PolarHBondContact O-N 3.16Å
1995	K	83.3	Confident	81.8	Confident	103 Å²	103	90 Å²	90	45%	0.448	43%	0.426	S	S	.	.	H	α-helix	trans	-72.2	-33.1	179.1	-163.9	166.9	-170	176.7	0	113.2	L1972 R1991 L1992 E1993 E1998 F1999	L1972-K1995 HydrophobicContact CD1-CG 4.37Å; R1991-K1995 WeakPolarHBondContact O-CB 3.08Å; R1991-K1995 PolarHBondContact O-N 3.2Å; R1991-K1995 VanDerWaalsContact O-N 3.16Å; L1992-K1995 PolarHBondContact O-N 2.66Å; E1993-K1995 VanDerWaalsContact C-N 3.34Å; K1995-E1998 PolarHBondContact O-N 3.45Å; K1995-F1999 HydrophobicContact CD-CE2 4.19Å; K1995-F1999 HydrophobicContact CG-CD2 4.08Å; K1995-F1999 HydrophobicContact CG-CE2 3.78Å; K1995-F1999 WeakPolarHBondContact O-CD2 2.85Å; K1995-F1999 PolarHBondContact O-N 3.5Å; K1995-F1999 VanDerWaalsContact O-N 3.17Å
1996	I	86.1	Confident	82.5	Confident	12 Å²	12	89.1 Å²	89.1	6%	0.062	41%	0.414	C	S	.	.	H	α-helix	trans	-59.7	-49.8	169.6	-71.3	163.7	0	0	0	109.9	L1972 K1973 L1976 L1992 E1998 F1999 E2000	L1972-I1996 HydrophobicContact CB-CD1 4.02Å; L1972-I1996 HydrophobicContact CB-CG1 3.6Å; L1972-I1996 HydrophobicContact CD1-CG1 4.32Å; K1973-I1996 HydrophobicContact CG-CD1 3.99Å; K1973-I1996 HydrophobicContact CG-CG2 4.48Å; L1976-I1996 HydrophobicContact CD2-CD1 4.44Å; L1992-I1996 WeakPolarHBondContact O-CG1 3.47Å; L1992-I1996 PolarHBondContact O-N 3.19Å; I1996-E1998 VanDerWaalsContact C-N 3.33Å; I1996-E1998 PolarHBondContact O-N 3.41Å; I1996-F1999 PolarHBondContact O-N 3Å; I1996-E2000 HydrophobicContact CG2-CG 4.36Å; I1996-E2000 WeakPolarHBondContact O-CG 3.28Å; I1996-E2000 PolarHBondContact O-N 3.11Å
1997	R	87.2	Confident	83.1	Confident	136 Å²	136	81.7 Å²	81.7	51%	0.513	39%	0.39	S	S	.	.	H	α-helix	trans	-60.7	-37.2	177.5	-77.9	175.1	-79	-146.7	-5.9	113.3	E1993 A1994 E2000 Q2001	E1993-R1997 WeakPolarHBondContact O-CG 3.34Å; E1993-R1997 PolarHBondContact O-N 3.22Å; E1993-R1997 VanDerWaalsContact O-N 3.11Å; E1993-R1997 PolarHBondContact O-NE 3.43Å; E1993-R1997 IonicContact OE2-CZ 3.96Å; E1993-R1997 IonicContact OE2-NH2 3.08Å; E1993-R1997 PolarHBondContact OE2-NH2 2.74Å; E1993-R1997 VanDerWaalsContact OE2-NH2 3.08Å; A1994-R1997 PolarHBondContact O-N 3.03Å; R1997-E2000 PolarHBondContact O-N 3.4Å; R1997-Q2001 WeakPolarHBondContact O-CB 3.46Å; R1997-Q2001 PolarHBondContact O-N 2.75Å
1998	E	87.8	Confident	83.6	Confident	83 Å²	83	81.5 Å²	81.5	39%	0.388	39%	0.389	S	S	.	.	H	α-helix	trans	-62.1	-44.8	175	-166.4	-164.3	159.5	0	0	111.9	A1994 K1995 I1996 R2002	A1994-E1998 PolarHBondContact O-N 3.16Å; K1995-E1998 PolarHBondContact O-N 3.45Å; I1996-E1998 VanDerWaalsContact C-N 3.33Å; I1996-E1998 PolarHBondContact O-N 3.41Å; E1998-R2002 WeakPolarHBondContact O-CG 3.46Å; E1998-R2002 PolarHBondContact O-N 3.12Å; E1998-R2002 VanDerWaalsContact O-N 3.17Å; E1998-R2002 IonicContact OE1-CZ 3.41Å; E1998-R2002 IonicContact OE1-NE 3.32Å; E1998-R2002 PolarHBondContact OE1-NE 3.01Å; E1998-R2002 IonicContact OE1-NH2 2.69Å; E1998-R2002 PolarHBondContact OE1-NH2 3.26Å
1999	F	86.8	Confident	84.4	Confident	26 Å²	26	78.9 Å²	78.9	11%	0.114	38%	0.378	C	S	.	.	H	α-helix	trans	-69.4	-38.1	177.3	-74	-57.8	0	0	0	112.7	M1965 Q1968 I1969 L1972 K1995 I1996 R2002 L2003	M1965-F1999 HydrophobicContact CE-CD1 3.74Å; M1965-F1999 HydrophobicContact CE-CE1 4.32Å; M1965-F1999 HydrophobicContact SD-CD1 3.68Å; M1965-F1999 HydrophobicContact SD-CE1 3.97Å; Q1968-F1999 VanDerWaalsContact OE1-CZ 3.25Å; I1969-F1999 HydrophobicContact CD1-CB 3.99Å; I1969-F1999 HydrophobicContact CG1-CB 3.58Å; L1972-F1999 HydrophobicContact CD1-CD2 3.72Å; L1972-F1999 HydrophobicContact CD1-CE2 3.73Å; K1995-F1999 HydrophobicContact CD-CE2 4.19Å; K1995-F1999 HydrophobicContact CG-CD2 4.08Å; K1995-F1999 HydrophobicContact CG-CE2 3.78Å; K1995-F1999 WeakPolarHBondContact O-CD2 2.85Å; K1995-F1999 PolarHBondContact O-N 3.5Å; K1995-F1999 VanDerWaalsContact O-N 3.17Å; I1996-F1999 PolarHBondContact O-N 3Å; F1999-R2002 PolarHBondContact O-N 2.67Å; F1999-L2003 PolarHBondContact O-N 2.82Å
2000	E	86.3	Confident	85	Confident	66 Å²	66	78.3 Å²	78.3	31%	0.308	37%	0.371	S	S	.	.	H	α-helix	trans	-61.8	-44.7	174	-72	173.4	152.8	0	0	111.4	I1969 K1973 I1996 R1997 R2002 L2003 D2004	I1969-E2000 HydrophobicContact CD1-CG 3.85Å; I1969-E2000 HydrophobicContact CG1-CG 4.27Å; I1969-E2000 HydrophobicContact CG2-CG 4.34Å; K1973-E2000 VanDerWaalsContact CE-OE1 3.31Å; K1973-E2000 WeakPolarHBondContact CE-OE1 3.43Å; K1973-E2000 IonicContact NZ-OE1 2.66Å; K1973-E2000 PolarHBondContact NZ-OE1 3.22Å; I1996-E2000 HydrophobicContact CG2-CG 4.36Å; I1996-E2000 WeakPolarHBondContact O-CG 3.28Å; I1996-E2000 PolarHBondContact O-N 3.11Å; R1997-E2000 PolarHBondContact O-N 3.4Å; E2000-R2002 VanDerWaalsContact C-N 3.33Å; E2000-R2002 PolarHBondContact O-N 2.75Å; E2000-L2003 WeakPolarHBondContact O-CB 3.35Å; E2000-L2003 PolarHBondContact O-N 3.01Å; E2000-L2003 VanDerWaalsContact O-N 3.08Å; E2000-D2004 PolarHBondContact O-N 3.25Å; E2000-D2004 VanDerWaalsContact O-N 3.14Å
2001	Q	87.6	Confident	85.4	Confident	137 Å²	137	77.7 Å²	77.7	64%	0.64	37%	0.374	S	S	*	.	H	α-helix	trans	-65.6	-34	178.4	-168.4	174.4	21.7	0	0	112.9	R1997 I2005	R1997-Q2001 WeakPolarHBondContact O-CB 3.46Å; R1997-Q2001 PolarHBondContact O-N 2.75Å; Q2001-I2005 WeakPolarHBondContact O-CG1 3.45Å; Q2001-I2005 PolarHBondContact O-N 3.5Å
2002	R	86.9	Confident	85.7	Confident	128 Å²	128	76.5 Å²	76.5	48%	0.483	37%	0.37	S	S	.	.	H	α-helix	trans	-68.5	-35.2	171.8	-69.1	173	-174.8	-125.3	11.1	111.8	M1965 E1998 F1999 E2000 D2004 I2005 E2006	M1965-R2002 HydrophobicContact CE-CB 3.52Å; M1965-R2002 HydrophobicContact CE-CG 4.21Å; E1998-R2002 WeakPolarHBondContact O-CG 3.46Å; E1998-R2002 PolarHBondContact O-N 3.12Å; E1998-R2002 VanDerWaalsContact O-N 3.17Å; E1998-R2002 IonicContact OE1-CZ 3.41Å; E1998-R2002 IonicContact OE1-NE 3.32Å; E1998-R2002 PolarHBondContact OE1-NE 3.01Å; E1998-R2002 IonicContact OE1-NH2 2.69Å; E1998-R2002 PolarHBondContact OE1-NH2 3.26Å; F1999-R2002 PolarHBondContact O-N 2.67Å; E2000-R2002 VanDerWaalsContact C-N 3.33Å; E2000-R2002 PolarHBondContact O-N 2.75Å; R2002-D2004 VanDerWaalsContact C-N 3.33Å; R2002-D2004 PolarHBondContact O-N 3.46Å; R2002-I2005 PolarHBondContact O-N 2.71Å; R2002-E2006 PolarHBondContact O-N 3.34Å; R2002-E2006 VanDerWaalsContact O-N 3.09Å
2003	L	86.3	Confident	86	Confident	24 Å²	24	75.3 Å²	75.3	13%	0.126	36%	0.363	C	S	.	.	H	α-helix	trans	-61.9	-39.5	176.2	-157.2	79.3	0	0	0	112.1	R1962 M1965 I1969 F1999 E2000 T2007	R1962-L2003 HydrophobicContact CB-CD1 4.43Å; R1962-L2003 HydrophobicContact CG-CD1 3.56Å; R1962-L2003 HydrophobicContact CG-CG 4.18Å; M1965-L2003 HydrophobicContact CB-CD1 3.73Å; I1969-L2003 HydrophobicContact CD1-CD2 4.23Å; F1999-L2003 PolarHBondContact O-N 2.82Å; E2000-L2003 WeakPolarHBondContact O-CB 3.35Å; E2000-L2003 PolarHBondContact O-N 3.01Å; E2000-L2003 VanDerWaalsContact O-N 3.08Å; L2003-T2007 WeakPolarHBondContact O-CB 3.21Å; L2003-T2007 WeakPolarHBondContact O-CG2 3.17Å; L2003-T2007 PolarHBondContact O-N 2.58Å; L2003-T2007 PolarHBondContact O-OG1 2.88Å
2004	D	85.2	Confident	86.2	Confident	113 Å²	113	75.3 Å²	75.3	60%	0.604	36%	0.363	S	S	*	.	H	α-helix	trans	-67.1	-38.6	176.3	-73.4	-19.7	0	0	0	112.1	E2000 R2002 T2007 S2008	E2000-D2004 PolarHBondContact O-N 3.25Å; E2000-D2004 VanDerWaalsContact O-N 3.14Å; R2002-D2004 VanDerWaalsContact C-N 3.33Å; R2002-D2004 PolarHBondContact O-N 3.46Å; D2004-T2007 WeakPolarHBondContact CA-OG1 3.49Å; D2004-T2007 PolarHBondContact O-OG1 2.63Å; D2004-T2007 VanDerWaalsContact O-OG1 3.12Å; D2004-S2008 PolarHBondContact O-N 3.31Å
2005	I	86.6	Confident	86.2	Confident	91 Å²	91	79.5 Å²	79.5	47%	0.467	37%	0.369	S	S	.	.	H	α-helix	trans	-64.1	-49.8	176.1	-67.3	167.6	0	0	0	110.5	Q2001 R2002 T2007 S2008 N2009	Q2001-I2005 WeakPolarHBondContact O-CG1 3.45Å; Q2001-I2005 PolarHBondContact O-N 3.5Å; R2002-I2005 PolarHBondContact O-N 2.71Å; I2005-T2007 PolarHBondContact O-N 3.03Å; I2005-S2008 WeakPolarHBondContact O-CB 3.46Å; I2005-S2008 PolarHBondContact O-N 3.41Å; I2005-S2008 VanDerWaalsContact O-N 3.13Å; I2005-N2009 PolarHBondContact O-N 3.3Å
2006	E	82.1	Confident	86.3	Confident	57 Å²	57	77 Å²	77	27%	0.266	36%	0.364	S	S	.	.	H	α-helix	trans	-71.7	-29.6	-177.5	-61.3	-49.3	153.1	0	0	113.7	F1958 R2002 S2008 N2009 R2010	F1958-E2006 HydrophobicContact CD1-CB 4.45Å; F1958-E2006 VanDerWaalsContact CD1-OE2 3.27Å; F1958-E2006 WeakPolarHBondContact CD1-OE2 3.49Å; F1958-E2006 WeakPolarHBondContact CE1-OE2 3.23Å; R2002-E2006 PolarHBondContact O-N 3.34Å; R2002-E2006 VanDerWaalsContact O-N 3.09Å; E2006-S2008 VanDerWaalsContact C-N 3.28Å; E2006-S2008 PolarHBondContact O-N 2.94Å; E2006-N2009 PolarHBondContact O-N 3.26Å; E2006-N2009 PolarHBondContact OE2-ND2 2.93Å; E2006-R2010 WeakPolarHBondContact O-CB 3.49Å; E2006-R2010 PolarHBondContact O-N 3.3Å
2007	T	84.2	Confident	86.3	Confident	35 Å²	35	76.7 Å²	76.7	22%	0.215	36%	0.362	C	S	.	.	H	α-helix	trans	-67.3	-29.9	170.8	49.2	0	0	0	0	112.7	R1962 L2003 D2004 I2005 V2011	R1962-T2007 VanDerWaalsContact CD-CG2 3.45Å; R1962-T2007 HydrophobicContact CG-CG2 4.29Å; L2003-T2007 WeakPolarHBondContact O-CB 3.21Å; L2003-T2007 WeakPolarHBondContact O-CG2 3.17Å; L2003-T2007 PolarHBondContact O-N 2.58Å; L2003-T2007 PolarHBondContact O-OG1 2.88Å; D2004-T2007 WeakPolarHBondContact CA-OG1 3.49Å; D2004-T2007 PolarHBondContact O-OG1 2.63Å; D2004-T2007 VanDerWaalsContact O-OG1 3.12Å; I2005-T2007 PolarHBondContact O-N 3.03Å; T2007-V2011 VanDerWaalsContact O-CG2 3.31Å; T2007-V2011 WeakPolarHBondContact O-CG2 3.07Å; T2007-V2011 PolarHBondContact O-N 3.14Å
2008	S	86.3	Confident	86.3	Confident	81 Å²	81	73.2 Å²	73.2	57%	0.566	35%	0.354	S	S	*	.	H	α-helix	trans	-70.9	-47.3	171	-168.7	0	0	0	0	112.3	D2004 I2005 E2006 R2010 V2011 R2012	D2004-S2008 PolarHBondContact O-N 3.31Å; I2005-S2008 WeakPolarHBondContact O-CB 3.46Å; I2005-S2008 PolarHBondContact O-N 3.41Å; I2005-S2008 VanDerWaalsContact O-N 3.13Å; E2006-S2008 VanDerWaalsContact C-N 3.28Å; E2006-S2008 PolarHBondContact O-N 2.94Å; S2008-R2010 PolarHBondContact O-N 3.35Å; S2008-V2011 PolarHBondContact O-N 3.11Å; S2008-V2011 VanDerWaalsContact O-N 3.14Å; S2008-R2012 PolarHBondContact O-N 3.25Å; S2008-R2012 VanDerWaalsContact O-N 3.11Å
2009	N	85.7	Confident	86.1	Confident	44 Å²	44	76.1 Å²	76.1	24%	0.235	36%	0.362	C	S	.	.	H	α-helix	trans	-54.7	-49.6	176.8	-75.4	-23.8	0	0	0	111.9	I2005 E2006 V2011 R2012 I2013	I2005-N2009 PolarHBondContact O-N 3.3Å; E2006-N2009 PolarHBondContact O-N 3.26Å; E2006-N2009 PolarHBondContact OE2-ND2 2.93Å; N2009-V2011 VanDerWaalsContact C-N 3.32Å; N2009-V2011 PolarHBondContact O-N 2.89Å; N2009-R2012 WeakPolarHBondContact O-CB 3.11Å; N2009-R2012 PolarHBondContact O-N 3.23Å; N2009-R2012 VanDerWaalsContact O-N 3.15Å; N2009-I2013 PolarHBondContact O-N 2.92Å; N2009-I2013 VanDerWaalsContact O-N 3.11Å
2010	R	87.9	Confident	85.9	Confident	57 Å²	57	75.5 Å²	75.5	22%	0.215	36%	0.362	C	S	.	.	H	α-helix	trans	-58.5	-40.1	177.7	-171.7	-155.7	63.7	-154.1	-10.4	112.5	I1955 F1958 E2006 S2008 I2013 Q2014	I1955-R2010 HydrophobicContact CG1-CG 4.45Å; I1955-R2010 HydrophobicContact CG2-CG 4.12Å; F1958-R2010 HydrophobicContact CB-CB 4.25Å; F1958-R2010 HydrophobicContact CB-CG 4.41Å; E2006-R2010 WeakPolarHBondContact O-CB 3.49Å; E2006-R2010 PolarHBondContact O-N 3.3Å; S2008-R2010 PolarHBondContact O-N 3.35Å; R2010-I2013 PolarHBondContact O-N 2.89Å; R2010-Q2014 VanDerWaalsContact O-CB 3.31Å; R2010-Q2014 WeakPolarHBondContact O-CB 2.92Å; R2010-Q2014 PolarHBondContact O-N 3Å
2011	V	86.9	Confident	85.9	Confident	85 Å²	85	76.3 Å²	76.3	52%	0.515	36%	0.364	S	S	.	.	H	α-helix	trans	-67	-36.8	178.1	168.9	0	0	0	0	111.7	T2007 S2008 N2009 Y2015	T2007-V2011 VanDerWaalsContact O-CG2 3.31Å; T2007-V2011 WeakPolarHBondContact O-CG2 3.07Å; T2007-V2011 PolarHBondContact O-N 3.14Å; S2008-V2011 PolarHBondContact O-N 3.11Å; S2008-V2011 VanDerWaalsContact O-N 3.14Å; N2009-V2011 VanDerWaalsContact C-N 3.32Å; N2009-V2011 PolarHBondContact O-N 2.89Å; V2011-Y2015 PolarHBondContact O-N 3.14Å
2012	R	89.3	Confident	85.9	Confident	169 Å²	169	75.7 Å²	75.7	64%	0.638	36%	0.361	S	S	*	.	H	α-helix	trans	-63.2	-43.8	174.4	-174.4	-171.8	67.8	-179	-0.9	112	S2008 N2009 Y2015 S2016	S2008-R2012 PolarHBondContact O-N 3.25Å; S2008-R2012 VanDerWaalsContact O-N 3.11Å; N2009-R2012 WeakPolarHBondContact O-CB 3.11Å; N2009-R2012 PolarHBondContact O-N 3.23Å; N2009-R2012 VanDerWaalsContact O-N 3.15Å; R2012-Y2015 PolarHBondContact O-N 3.08Å; R2012-S2016 PolarHBondContact O-N 3.31Å
2013	I	85	Confident	85.7	Confident	11 Å²	11	72.3 Å²	72.3	6%	0.056	36%	0.355	C	S	.	.	H	α-helix	trans	-73.4	-38.1	-178.4	-62.5	161.8	0	0	0	110.7	Q1951 E1954 I1955 F1958 N2009 R2010 Y2015 S2016 L2017	Q1951-I2013 HydrophobicContact CB-CG2 4.25Å; Q1951-I2013 HydrophobicContact CG-CG2 4.39Å; E1954-I2013 HydrophobicContact CG-CD1 4.47Å; E1954-I2013 WeakPolarHBondContact OE1-CD1 3.47Å; I1955-I2013 HydrophobicContact CD1-CG2 4.04Å; I1955-I2013 HydrophobicContact CG1-CB 4.35Å; I1955-I2013 HydrophobicContact CG1-CG2 3.91Å; F1958-I2013 HydrophobicContact CD2-CD1 4.21Å; F1958-I2013 HydrophobicContact CE2-CD1 3.43Å; F1958-I2013 VanDerWaalsContact CE2-CD1 3.43Å; F1958-I2013 HydrophobicContact CZ-CD1 4.17Å; N2009-I2013 PolarHBondContact O-N 2.92Å; N2009-I2013 VanDerWaalsContact O-N 3.11Å; R2010-I2013 PolarHBondContact O-N 2.89Å; I2013-Y2015 VanDerWaalsContact C-N 3.29Å; I2013-Y2015 PolarHBondContact O-N 2.75Å; I2013-S2016 WeakPolarHBondContact O-CA 3.3Å; I2013-S2016 WeakPolarHBondContact O-CB 3.35Å; I2013-S2016 PolarHBondContact O-N 3.4Å; I2013-L2017 WeakPolarHBondContact O-CB 3.35Å; I2013-L2017 PolarHBondContact O-N 3.08Å
2014	Q	86.4	Confident	85.6	Confident	71 Å²	71	72.1 Å²	72.1	33%	0.332	35%	0.354	S	S	.	.	H	α-helix	trans	-53.3	-44.5	170.1	-176.5	67.4	58.4	0	0	112.1	I1955 R2010 S2016 L2017 D2018	I1955-Q2014 HydrophobicContact CD1-CB 4.44Å; R2010-Q2014 VanDerWaalsContact O-CB 3.31Å; R2010-Q2014 WeakPolarHBondContact O-CB 2.92Å; R2010-Q2014 PolarHBondContact O-N 3Å; Q2014-S2016 VanDerWaalsContact C-N 3.34Å; Q2014-S2016 PolarHBondContact O-N 3.27Å; Q2014-L2017 WeakPolarHBondContact O-CB 3.33Å; Q2014-L2017 PolarHBondContact O-N 3.06Å; Q2014-D2018 PolarHBondContact NE2-OD1 2.96Å; Q2014-D2018 VanDerWaalsContact NE2-OD1 3.13Å; Q2014-D2018 PolarHBondContact NE2-OD2 2.73Å; Q2014-D2018 VanDerWaalsContact O-CG 3.3Å; Q2014-D2018 PolarHBondContact O-N 3.41Å; Q2014-D2018 VanDerWaalsContact O-OD2 3.14Å
2015	Y	87.2	Confident	85.7	Confident	141 Å²	141	71.3 Å²	71.3	55%	0.553	35%	0.349	S	S	*	.	H	α-helix	trans	-68.3	-29.7	178	-173.3	-105.1	0	0	0	113.7	V2011 R2012 I2013 R2019	V2011-Y2015 PolarHBondContact O-N 3.14Å; R2012-Y2015 PolarHBondContact O-N 3.08Å; I2013-Y2015 VanDerWaalsContact C-N 3.29Å; I2013-Y2015 PolarHBondContact O-N 2.75Å; Y2015-R2019 VanDerWaalsContact CE1-NE 3.34Å; Y2015-R2019 PolarHBondContact OH-NE 2.74Å; Y2015-R2019 PolarHBondContact OH-NH2 3.47Å
2016	S	84.3	Confident	85.7	Confident	50 Å²	50	73.2 Å²	73.2	35%	0.35	36%	0.356	S	S	.	.	H	α-helix	trans	-67.1	-47.9	169.2	168.9	0	0	0	0	111.1	Q1951 R2012 I2013 Q2014 D2018 R2019 A2020	Q1951-S2016 PolarHBondContact NE2-OG 3.28Å; Q1951-S2016 PolarHBondContact OE1-OG 3.05Å; R2012-S2016 PolarHBondContact O-N 3.31Å; I2013-S2016 WeakPolarHBondContact O-CA 3.3Å; I2013-S2016 WeakPolarHBondContact O-CB 3.35Å; I2013-S2016 PolarHBondContact O-N 3.4Å; Q2014-S2016 VanDerWaalsContact C-N 3.34Å; Q2014-S2016 PolarHBondContact O-N 3.27Å; S2016-D2018 VanDerWaalsContact C-N 3.32Å; S2016-D2018 PolarHBondContact O-N 2.76Å; S2016-R2019 PolarHBondContact O-N 3.02Å; S2016-A2020 PolarHBondContact O-N 3.29Å
2017	L	86.5	Confident	85.9	Confident	5 Å²	5	72.3 Å²	72.3	3%	0.026	35%	0.353	C	S	.	.	H	α-helix	trans	-56.9	-45.3	-179.4	-173	80.5	0	0	0	111.6	I1948 Q1951 I1952 I1955 I2013 Q2014 R2019 A2020 K2021	I1948-L2017 HydrophobicContact CB-CD1 4.31Å; I1948-L2017 HydrophobicContact CG1-CD1 4.38Å; I1948-L2017 HydrophobicContact CG2-CD1 3.89Å; Q1951-L2017 HydrophobicContact CB-CD1 3.62Å; I1952-L2017 HydrophobicContact CG1-CD1 3.84Å; I1952-L2017 HydrophobicContact CG1-CD2 4.05Å; I1955-L2017 HydrophobicContact CD1-CB 4.47Å; I1955-L2017 HydrophobicContact CD1-CD2 3.95Å; I2013-L2017 WeakPolarHBondContact O-CB 3.35Å; I2013-L2017 PolarHBondContact O-N 3.08Å; Q2014-L2017 WeakPolarHBondContact O-CB 3.33Å; Q2014-L2017 PolarHBondContact O-N 3.06Å; L2017-R2019 PolarHBondContact O-N 2.88Å; L2017-A2020 WeakPolarHBondContact O-CB 3.36Å; L2017-A2020 PolarHBondContact O-N 2.95Å; L2017-A2020 VanDerWaalsContact O-N 3.13Å; L2017-K2021 WeakPolarHBondContact O-CG 3.12Å; L2017-K2021 PolarHBondContact O-N 2.69Å
2018	D	86.3	Confident	86	Confident	64 Å²	64	72.3 Å²	72.3	34%	0.342	35%	0.353	S	S	.	.	H	α-helix	trans	-70.9	-32.5	-175.5	-64.1	-32.5	0	0	0	112.4	Q2014 S2016 K2021 E2022	Q2014-D2018 PolarHBondContact NE2-OD1 2.96Å; Q2014-D2018 VanDerWaalsContact NE2-OD1 3.13Å; Q2014-D2018 PolarHBondContact NE2-OD2 2.73Å; Q2014-D2018 VanDerWaalsContact O-CG 3.3Å; Q2014-D2018 PolarHBondContact O-N 3.41Å; Q2014-D2018 VanDerWaalsContact O-OD2 3.14Å; S2016-D2018 VanDerWaalsContact C-N 3.32Å; S2016-D2018 PolarHBondContact O-N 2.76Å; D2018-K2021 PolarHBondContact O-N 2.68Å; D2018-K2021 IonicContact OD1-NZ 3.07Å; D2018-K2021 PolarHBondContact OD1-NZ 3.12Å; D2018-E2022 PolarHBondContact O-N 2.78Å
2019	R	84.4	Confident	86.1	Confident	143 Å²	143	73.2 Å²	73.2	54%	0.54	35%	0.351	S	S	.	.	H	α-helix	trans	-68.3	-32.9	167.9	-73.3	-177.7	173.9	-160.1	0.3	113.3	Y2015 S2016 L2017 K2021 T2023	Y2015-R2019 VanDerWaalsContact CE1-NE 3.34Å; Y2015-R2019 PolarHBondContact OH-NE 2.74Å; Y2015-R2019 PolarHBondContact OH-NH2 3.47Å; S2016-R2019 PolarHBondContact O-N 3.02Å; L2017-R2019 PolarHBondContact O-N 2.88Å; R2019-K2021 VanDerWaalsContact C-N 3.33Å; R2019-T2023 PolarHBondContact O-N 3.36Å; R2019-T2023 PolarHBondContact O-OG1 3.3Å
2020	A	82.4	Confident	86.1	Confident	14 Å²	14	76.4 Å²	76.4	12%	0.116	37%	0.365	C	S	.	.	H	α-helix	trans	-67.3	-36.4	176.1	0	0	0	0	0	111	I1948 S2016 L2017 T2023 I2024	I1948-A2020 HydrophobicContact CD1-CB 3.71Å; I1948-A2020 HydrophobicContact CG1-CB 3.61Å; S2016-A2020 PolarHBondContact O-N 3.29Å; L2017-A2020 WeakPolarHBondContact O-CB 3.36Å; L2017-A2020 PolarHBondContact O-N 2.95Å; L2017-A2020 VanDerWaalsContact O-N 3.13Å; A2020-T2023 PolarHBondContact O-N 3.04Å; A2020-T2023 PolarHBondContact O-OG1 2.85Å; A2020-T2023 VanDerWaalsContact O-OG1 3.11Å; A2020-I2024 PolarHBondContact O-N 2.61Å; A2020-I2024 VanDerWaalsContact O-N 3.09Å
2021	K	86.3	Confident	86.3	Confident	82 Å²	82	77.5 Å²	77.5	36%	0.357	37%	0.369	S	S	.	.	H	α-helix	trans	-61.2	-50.3	173.5	-66.3	169.6	-169.9	156.2	0	111.8	I1948 L2017 D2018 R2019 T2023 I2024 D2025	I1948-K2021 HydrophobicContact CD1-CG 3.89Å; L2017-K2021 WeakPolarHBondContact O-CG 3.12Å; L2017-K2021 PolarHBondContact O-N 2.69Å; D2018-K2021 PolarHBondContact O-N 2.68Å; D2018-K2021 IonicContact OD1-NZ 3.07Å; D2018-K2021 PolarHBondContact OD1-NZ 3.12Å; R2019-K2021 VanDerWaalsContact C-N 3.33Å; K2021-T2023 PolarHBondContact O-N 2.71Å; K2021-T2023 VanDerWaalsContact O-N 3.14Å; K2021-I2024 WeakPolarHBondContact O-CA 3.44Å; K2021-I2024 WeakPolarHBondContact O-CB 3.49Å; K2021-I2024 PolarHBondContact O-N 3.42Å; K2021-D2025 PolarHBondContact O-N 3.44Å
2022	E	87.3	Confident	86.3	Confident	124 Å²	124	76.7 Å²	76.7	58%	0.579	36%	0.362	S	S	*	.	H	α-helix	trans	-56	-34	177.9	-70.9	-174.1	131.2	0	0	113	D2018 Q2026	D2018-E2022 PolarHBondContact O-N 2.78Å; E2022-Q2026 WeakPolarHBondContact O-CG 3.14Å; E2022-Q2026 PolarHBondContact O-N 2.94Å
2023	T	83.2	Confident	86.3	Confident	57 Å²	57	75 Å²	75	35%	0.35	36%	0.359	S	S	.	.	H	α-helix	trans	-78.9	-27.1	176.7	32.4	0	0	0	0	113.4	R2019 A2020 K2021 L2027	R2019-T2023 PolarHBondContact O-N 3.36Å; R2019-T2023 PolarHBondContact O-OG1 3.3Å; A2020-T2023 PolarHBondContact O-N 3.04Å; A2020-T2023 PolarHBondContact O-OG1 2.85Å; A2020-T2023 VanDerWaalsContact O-OG1 3.11Å; K2021-T2023 PolarHBondContact O-N 2.71Å; K2021-T2023 VanDerWaalsContact O-N 3.14Å; T2023-L2027 WeakPolarHBondContact O-CG 3.41Å; T2023-L2027 PolarHBondContact O-N 3.35Å
2024	I	84.1	Confident	86.5	Confident	20 Å²	20	75.7 Å²	75.7	10%	0.103	36%	0.363	C	S	.	.	H	α-helix	trans	-69	-44.1	167.7	-72.2	-173.5	0	0	0	111.1	L1941 K1944 E1945 I1948 A2020 K2021 Q2026 L2027 T2028	L1941-I2024 HydrophobicContact CD2-CB 4.34Å; L1941-I2024 HydrophobicContact CD2-CG1 4.48Å; L1941-I2024 HydrophobicContact CD2-CG2 3.82Å; K1944-I2024 HydrophobicContact CB-CD1 3.82Å; K1944-I2024 HydrophobicContact CB-CG1 3.61Å; E1945-I2024 HydrophobicContact CB-CD1 4.43Å; E1945-I2024 HydrophobicContact CG-CD1 3.79Å; I1948-I2024 HydrophobicContact CD1-CD1 3.43Å; I1948-I2024 VanDerWaalsContact CD1-CD1 3.43Å; I1948-I2024 HydrophobicContact CD1-CG1 4.21Å; I1948-I2024 HydrophobicContact CG1-CD1 4.21Å; A2020-I2024 PolarHBondContact O-N 2.61Å; A2020-I2024 VanDerWaalsContact O-N 3.09Å; K2021-I2024 WeakPolarHBondContact O-CA 3.44Å; K2021-I2024 WeakPolarHBondContact O-CB 3.49Å; K2021-I2024 PolarHBondContact O-N 3.42Å; I2024-Q2026 VanDerWaalsContact C-N 3.26Å; I2024-Q2026 PolarHBondContact O-N 3.16Å; I2024-L2027 PolarHBondContact O-N 3.06Å; I2024-T2028 WeakPolarHBondContact O-CB 3.34Å; I2024-T2028 PolarHBondContact O-N 3.36Å; I2024-T2028 PolarHBondContact O-OG1 3.18Å
2025	D	86.6	Confident	86.5	Confident	97 Å²	97	75.9 Å²	75.9	52%	0.519	37%	0.366	S	S	.	.	H	α-helix	trans	-59.7	-39.6	179.7	-69.9	-33.5	0	0	0	111.2	K2021 N2029	K2021-D2025 PolarHBondContact O-N 3.44Å; D2025-N2029 PolarHBondContact O-N 3.2Å; D2025-N2029 VanDerWaalsContact O-N 3.1Å; D2025-N2029 PolarHBondContact O-ND2 3.46Å
2026	Q	87.6	Confident	86.5	Confident	131 Å²	131	74.3 Å²	74.3	61%	0.612	37%	0.366	S	S	*	.	H	α-helix	trans	-64.2	-50.9	174.5	-71.6	172.1	26	0	0	112.3	E2022 I2024 T2028 N2029 E2030	E2022-Q2026 WeakPolarHBondContact O-CG 3.14Å; E2022-Q2026 PolarHBondContact O-N 2.94Å; I2024-Q2026 VanDerWaalsContact C-N 3.26Å; I2024-Q2026 PolarHBondContact O-N 3.16Å; Q2026-T2028 VanDerWaalsContact C-N 3.3Å; Q2026-T2028 PolarHBondContact O-N 3.35Å; Q2026-N2029 PolarHBondContact O-N 3.46Å; Q2026-E2030 PolarHBondContact O-N 3.01Å
2027	L	85.3	Confident	86.7	Confident	37 Å²	37	75.3 Å²	75.3	19%	0.194	37%	0.366	C	S	.	.	H	α-helix	trans	-65.2	-32.1	179.3	-70.5	168.9	0	0	0	112.6	L1941 T2023 I2024 E2030 R2031	L1941-L2027 HydrophobicContact CD1-CB 4.42Å; L1941-L2027 HydrophobicContact CD2-CB 3.68Å; L1941-L2027 HydrophobicContact CG-CB 3.79Å; T2023-L2027 WeakPolarHBondContact O-CG 3.41Å; T2023-L2027 PolarHBondContact O-N 3.35Å; I2024-L2027 PolarHBondContact O-N 3.06Å; L2027-E2030 PolarHBondContact O-N 3.44Å; L2027-R2031 WeakPolarHBondContact O-CB 3.07Å; L2027-R2031 PolarHBondContact O-N 3.39Å
2028	T	86.1	Confident	86.7	Confident	36 Å²	36	76.3 Å²	76.3	22%	0.221	37%	0.371	C	S	.	.	H	α-helix	trans	-66.6	-46.2	175.3	-53.9	0	0	0	0	110.5	L1941 I2024 Q2026 E2030 R2031 D2032	L1941-T2028 WeakPolarHBondContact CD2-OG1 3.07Å; I2024-T2028 WeakPolarHBondContact O-CB 3.34Å; I2024-T2028 PolarHBondContact O-N 3.36Å; I2024-T2028 PolarHBondContact O-OG1 3.18Å; Q2026-T2028 VanDerWaalsContact C-N 3.3Å; Q2026-T2028 PolarHBondContact O-N 3.35Å; T2028-E2030 PolarHBondContact O-N 3.07Å; T2028-R2031 PolarHBondContact O-N 3.13Å; T2028-D2032 WeakPolarHBondContact O-CB 3.41Å; T2028-D2032 VanDerWaalsContact O-CG 3.25Å; T2028-D2032 PolarHBondContact O-N 2.65Å
2029	N	88.4	Confident	86.6	Confident	99 Å²	99	76 Å²	76	53%	0.529	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-26.8	174.4	-84.4	-85.7	0	0	0	113.4	D2025 Q2026 K2033	D2025-N2029 PolarHBondContact O-N 3.2Å; D2025-N2029 VanDerWaalsContact O-N 3.1Å; D2025-N2029 PolarHBondContact O-ND2 3.46Å; Q2026-N2029 PolarHBondContact O-N 3.46Å; N2029-K2033 VanDerWaalsContact O-CD 3.29Å; N2029-K2033 WeakPolarHBondContact O-CD 3.46Å; N2029-K2033 WeakPolarHBondContact O-CE 3.38Å; N2029-K2033 VanDerWaalsContact O-CG 3.28Å; N2029-K2033 WeakPolarHBondContact O-CG 3.39Å
2030	E	87.4	Confident	86.6	Confident	111 Å²	111	73.9 Å²	73.9	52%	0.519	38%	0.377	S	S	.	.	H	α-helix	trans	-80.4	-45.1	175.6	-166.2	164.2	-123.1	0	0	111.7	Q2026 L2027 T2028 D2032 K2033 L2034	Q2026-E2030 PolarHBondContact O-N 3.01Å; L2027-E2030 PolarHBondContact O-N 3.44Å; T2028-E2030 PolarHBondContact O-N 3.07Å; E2030-D2032 VanDerWaalsContact C-N 3.33Å; E2030-D2032 PolarHBondContact O-N 3.47Å; E2030-K2033 PolarHBondContact O-N 2.91Å; E2030-L2034 HydrophobicContact CG-CD1 4.3Å; E2030-L2034 WeakPolarHBondContact O-CG 3.45Å; E2030-L2034 PolarHBondContact O-N 3.24Å; E2030-L2034 VanDerWaalsContact O-N 3.1Å
2031	R	90.5	Very high	86.7	Confident	81 Å²	81	75.1 Å²	75.1	31%	0.306	38%	0.38	S	S	.	.	H	α-helix	trans	-51.8	-50.4	170.8	-176	-160.2	70.5	-179.2	-0.6	111.3	L1934 A1937 T1938 L1941 L2027 T2028 K2033 L2034 I2035	L1934-R2031 HydrophobicContact CD1-CG 3.62Å; A1937-R2031 HydrophobicContact CB-CB 4.41Å; T1938-R2031 HydrophobicContact CG2-CG 3.82Å; L1941-R2031 HydrophobicContact CD1-CB 3.98Å; L1941-R2031 HydrophobicContact CD1-CG 4.35Å; L2027-R2031 WeakPolarHBondContact O-CB 3.07Å; L2027-R2031 PolarHBondContact O-N 3.39Å; T2028-R2031 PolarHBondContact O-N 3.13Å; R2031-K2033 VanDerWaalsContact C-N 3.29Å; R2031-K2033 PolarHBondContact O-N 3.08Å; R2031-L2034 PolarHBondContact O-N 3.06Å; R2031-I2035 HydrophobicContact CG-CD1 4.09Å; R2031-I2035 WeakPolarHBondContact O-CG1 3.37Å; R2031-I2035 PolarHBondContact O-N 3.02Å
2032	D	87.9	Confident	86.5	Confident	68 Å²	68	76.6 Å²	76.6	36%	0.364	38%	0.383	S	S	.	.	H	α-helix	trans	-69	-29	-172.1	-69	-5.7	0	0	0	112.5	T2028 E2030 I2036	T2028-D2032 WeakPolarHBondContact O-CB 3.41Å; T2028-D2032 VanDerWaalsContact O-CG 3.25Å; T2028-D2032 PolarHBondContact O-N 2.65Å; E2030-D2032 VanDerWaalsContact C-N 3.33Å; E2030-D2032 PolarHBondContact O-N 3.47Å; D2032-I2036 WeakPolarHBondContact O-CG1 3.22Å
2033	K	88.7	Confident	86.3	Confident	133 Å²	133	75.4 Å²	75.4	58%	0.578	38%	0.378	S	S	*	.	H	α-helix	trans	-67.8	-43.9	168.3	-70.1	166.5	-170.2	168.2	0	111.7	N2029 E2030 R2031 I2035 I2036 I2037	N2029-K2033 VanDerWaalsContact O-CD 3.29Å; N2029-K2033 WeakPolarHBondContact O-CD 3.46Å; N2029-K2033 WeakPolarHBondContact O-CE 3.38Å; N2029-K2033 VanDerWaalsContact O-CG 3.28Å; N2029-K2033 WeakPolarHBondContact O-CG 3.39Å; E2030-K2033 PolarHBondContact O-N 2.91Å; R2031-K2033 VanDerWaalsContact C-N 3.29Å; R2031-K2033 PolarHBondContact O-N 3.08Å; K2033-I2035 VanDerWaalsContact C-N 3.34Å; K2033-I2035 PolarHBondContact O-N 3.14Å; K2033-I2036 PolarHBondContact O-N 3.47Å; K2033-I2037 WeakPolarHBondContact O-CG1 3.05Å; K2033-I2037 PolarHBondContact O-N 3.17Å; K2033-I2037 VanDerWaalsContact O-N 3.14Å
2034	L	89.2	Confident	86.2	Confident	25 Å²	25	77.7 Å²	77.7	13%	0.131	38%	0.384	C	S	.	.	H	α-helix	trans	-65.7	-34.9	-179.5	-70.7	164.7	0	0	0	112.3	K1933 L1934 A1937 E2030 R2031 I2036 I2037 E2038	K1933-L2034 HydrophobicContact CB-CD1 4.14Å; K1933-L2034 HydrophobicContact CB-CD2 4.04Å; L1934-L2034 HydrophobicContact CB-CB 4.06Å; L1934-L2034 HydrophobicContact CD1-CB 4Å; A1937-L2034 HydrophobicContact CB-CD1 4.3Å; E2030-L2034 HydrophobicContact CG-CD1 4.3Å; E2030-L2034 WeakPolarHBondContact O-CG 3.45Å; E2030-L2034 PolarHBondContact O-N 3.24Å; E2030-L2034 VanDerWaalsContact O-N 3.1Å; R2031-L2034 PolarHBondContact O-N 3.06Å; L2034-I2036 VanDerWaalsContact C-N 3.32Å; L2034-I2036 PolarHBondContact O-N 3.13Å; L2034-I2037 PolarHBondContact O-N 3.07Å; L2034-E2038 PolarHBondContact O-N 2.73Å
2035	I	86.5	Confident	86.1	Confident	76 Å²	76	77.3 Å²	77.3	39%	0.39	38%	0.383	S	S	.	.	H	α-helix	trans	-58.9	-42.7	172.1	-67.8	170.3	0	0	0	111.4	L1934 R2031 K2033 I2037 A2039	L1934-I2035 HydrophobicContact CD1-CD1 4.44Å; L1934-I2035 HydrophobicContact CD1-CG1 3.65Å; L1934-I2035 HydrophobicContact CD2-CG1 3.97Å; L1934-I2035 HydrophobicContact CG-CG1 4.49Å; R2031-I2035 HydrophobicContact CG-CD1 4.09Å; R2031-I2035 WeakPolarHBondContact O-CG1 3.37Å; R2031-I2035 PolarHBondContact O-N 3.02Å; K2033-I2035 VanDerWaalsContact C-N 3.34Å; K2033-I2035 PolarHBondContact O-N 3.14Å; I2035-I2037 VanDerWaalsContact C-N 3.32Å; I2035-A2039 WeakPolarHBondContact O-CB 3.21Å; I2035-A2039 PolarHBondContact O-N 3.02Å; I2035-A2039 VanDerWaalsContact O-N 3.11Å
2036	I	88	Confident	85.8	Confident	108 Å²	108	80.6 Å²	80.6	55%	0.554	39%	0.388	S	S	*	.	H	α-helix	trans	-67.6	-35.5	178.9	-64.5	166.4	0	0	0	110.8	D2032 K2033 L2034 N2040	D2032-I2036 WeakPolarHBondContact O-CG1 3.22Å; K2033-I2036 PolarHBondContact O-N 3.47Å; L2034-I2036 VanDerWaalsContact C-N 3.32Å; L2034-I2036 PolarHBondContact O-N 3.13Å; I2036-N2040 PolarHBondContact O-N 2.72Å; I2036-N2040 PolarHBondContact O-ND2 3.32Å
2037	I	87.7	Confident	85.7	Confident	70 Å²	70	79.7 Å²	79.7	36%	0.359	38%	0.382	S	S	.	.	H	α-helix	trans	-70.2	-49.2	177.7	-64.1	166.8	0	0	0	110.7	T1930 K2033 L2034 I2035 A2039 N2040 E2041	T1930-I2037 HydrophobicContact CG2-CG2 3.76Å; K2033-I2037 WeakPolarHBondContact O-CG1 3.05Å; K2033-I2037 PolarHBondContact O-N 3.17Å; K2033-I2037 VanDerWaalsContact O-N 3.14Å; L2034-I2037 PolarHBondContact O-N 3.07Å; I2035-I2037 VanDerWaalsContact C-N 3.32Å; I2037-A2039 VanDerWaalsContact C-N 3.28Å; I2037-A2039 PolarHBondContact O-N 3.35Å; I2037-N2040 PolarHBondContact O-N 2.79Å; I2037-N2040 VanDerWaalsContact O-N 3.11Å; I2037-E2041 HydrophobicContact CG2-CG 4.43Å; I2037-E2041 WeakPolarHBondContact CG2-OE1 3.05Å; I2037-E2041 PolarHBondContact O-N 2.7Å; I2037-E2041 VanDerWaalsContact O-N 3.11Å
2038	E	86.5	Confident	85.6	Confident	26 Å²	26	78.6 Å²	78.6	12%	0.121	38%	0.376	C	S	.	.	H	α-helix	trans	-52.8	-47.7	175.7	-168.6	-145.5	140.2	0	0	110.5	H1927 L1934 L2034 N2040 E2041 R2042	H1927-E2038 IonicContact NE2-OE1 2.6Å; L1934-E2038 WeakPolarHBondContact CD2-OE2 3.43Å; L2034-E2038 PolarHBondContact O-N 2.73Å; E2038-N2040 VanDerWaalsContact C-N 3.3Å; E2038-N2040 PolarHBondContact O-N 3.38Å; E2038-E2041 PolarHBondContact O-N 2.74Å; E2038-R2042 WeakPolarHBondContact O-CB 3.36Å; E2038-R2042 PolarHBondContact O-N 3.4Å; E2038-R2042 WeakPolarHBondContact OE1-CD 3.43Å; E2038-R2042 IonicContact OE1-CZ 3.88Å; E2038-R2042 IonicContact OE1-NE 2.66Å; E2038-R2042 IonicContact OE1-NH1 3.62Å; E2038-R2042 PolarHBondContact OE1-NH1 2.79Å
2039	A	85.1	Confident	85.2	Confident	59 Å²	59	78.7 Å²	78.7	49%	0.488	38%	0.378	S	S	.	.	H	α-helix	trans	-58.4	-39	-178.5	0	0	0	0	0	113.4	I2035 I2037 E2043	I2035-A2039 WeakPolarHBondContact O-CB 3.21Å; I2035-A2039 PolarHBondContact O-N 3.02Å; I2035-A2039 VanDerWaalsContact O-N 3.11Å; I2037-A2039 VanDerWaalsContact C-N 3.28Å; I2037-A2039 PolarHBondContact O-N 3.35Å; A2039-E2043 PolarHBondContact O-N 2.87Å
2040	N	84.8	Confident	85	Confident	98 Å²	98	79.5 Å²	79.5	52%	0.524	37%	0.374	S	S	.	.	H	α-helix	trans	-72.3	-47.2	179.5	-73.4	-46.2	0	0	0	112	I2036 I2037 E2038 R2042 E2043 Q2044	I2036-N2040 PolarHBondContact O-N 2.72Å; I2036-N2040 PolarHBondContact O-ND2 3.32Å; I2037-N2040 PolarHBondContact O-N 2.79Å; I2037-N2040 VanDerWaalsContact O-N 3.11Å; E2038-N2040 VanDerWaalsContact C-N 3.3Å; E2038-N2040 PolarHBondContact O-N 3.38Å; N2040-R2042 VanDerWaalsContact C-N 3.28Å; N2040-R2042 PolarHBondContact O-N 3.35Å; N2040-E2043 PolarHBondContact O-N 3.18Å; N2040-E2043 VanDerWaalsContact O-N 3.08Å; N2040-Q2044 WeakPolarHBondContact O-CG 3.15Å; N2040-Q2044 PolarHBondContact O-N 3.36Å
2041	E	83.6	Confident	84.9	Confident	39 Å²	39	78.5 Å²	78.5	18%	0.182	37%	0.369	C	S	.	.	H	α-helix	trans	-65.7	-33.9	178.7	-66.2	169.5	167.3	0	0	111.1	H1927 T1930 I2037 E2038 E2043 Q2044 N2045	H1927-E2041 HydrophobicContact CB-CB 4.05Å; T1930-E2041 WeakPolarHBondContact CB-OE2 2.88Å; T1930-E2041 WeakPolarHBondContact CG2-OE2 3.21Å; T1930-E2041 PolarHBondContact OG1-OE2 2.72Å; I2037-E2041 HydrophobicContact CG2-CG 4.43Å; I2037-E2041 WeakPolarHBondContact CG2-OE1 3.05Å; I2037-E2041 PolarHBondContact O-N 2.7Å; I2037-E2041 VanDerWaalsContact O-N 3.11Å; E2038-E2041 PolarHBondContact O-N 2.74Å; E2041-E2043 VanDerWaalsContact C-N 3.26Å; E2041-E2043 PolarHBondContact O-N 2.65Å; E2041-Q2044 WeakPolarHBondContact O-CB 3.42Å; E2041-Q2044 PolarHBondContact O-N 2.89Å; E2041-N2045 PolarHBondContact O-N 3.49Å; E2041-N2045 PolarHBondContact O-ND2 3.49Å
2042	R	82.2	Confident	84.6	Confident	114 Å²	114	75.7 Å²	75.7	43%	0.43	36%	0.36	S	S	.	.	H	α-helix	trans	-68.1	-23.8	173.4	-158.6	164.9	-170.2	172.4	0.3	113.2	H1927 E2038 N2040 R2046	H1927-R2042 WeakPolarHBondContact NE2-CD 3.05Å; E2038-R2042 WeakPolarHBondContact O-CB 3.36Å; E2038-R2042 PolarHBondContact O-N 3.4Å; E2038-R2042 WeakPolarHBondContact OE1-CD 3.43Å; E2038-R2042 IonicContact OE1-CZ 3.88Å; E2038-R2042 IonicContact OE1-NE 2.66Å; E2038-R2042 IonicContact OE1-NH1 3.62Å; E2038-R2042 PolarHBondContact OE1-NH1 2.79Å; N2040-R2042 VanDerWaalsContact C-N 3.28Å; N2040-R2042 PolarHBondContact O-N 3.35Å; R2042-R2046 WeakPolarHBondContact O-CD 3.45Å; R2042-R2046 VanDerWaalsContact O-CG 3.27Å; R2042-R2046 WeakPolarHBondContact O-CG 3.1Å; R2042-R2046 PolarHBondContact O-N 2.62Å
2043	E	83	Confident	84.2	Confident	99 Å²	99	79.3 Å²	79.3	46%	0.463	37%	0.369	S	S	.	.	H	α-helix	trans	-81.5	-36.5	170.2	-155.6	-169.4	116.4	0	0	112.3	A2039 N2040 E2041 R2046 K2047	A2039-E2043 PolarHBondContact O-N 2.87Å; N2040-E2043 PolarHBondContact O-N 3.18Å; N2040-E2043 VanDerWaalsContact O-N 3.08Å; E2041-E2043 VanDerWaalsContact C-N 3.26Å; E2041-E2043 PolarHBondContact O-N 2.65Å; E2043-R2046 PolarHBondContact O-N 3.15Å; E2043-K2047 PolarHBondContact O-N 2.9Å; E2043-K2047 WeakPolarHBondContact OE1-CE 3.16Å; E2043-K2047 IonicContact OE1-NZ 2.76Å; E2043-K2047 PolarHBondContact OE1-NZ 2.81Å
2044	Q	81.2	Confident	83.9	Confident	104 Å²	104	78 Å²	78	49%	0.486	37%	0.365	S	S	.	.	H	α-helix	trans	-56.7	-52.5	171.6	-64	-92	16.5	0	0	110.6	N2040 E2041 R2046 K2047 L2048	N2040-Q2044 WeakPolarHBondContact O-CG 3.15Å; N2040-Q2044 PolarHBondContact O-N 3.36Å; E2041-Q2044 WeakPolarHBondContact O-CB 3.42Å; E2041-Q2044 PolarHBondContact O-N 2.89Å; Q2044-R2046 VanDerWaalsContact C-N 3.28Å; Q2044-R2046 PolarHBondContact O-N 3.43Å; Q2044-K2047 WeakPolarHBondContact O-CB 3.44Å; Q2044-K2047 PolarHBondContact O-N 2.78Å; Q2044-L2048 PolarHBondContact O-N 3.5Å; Q2044-L2048 VanDerWaalsContact O-N 3.08Å
2045	N	81.3	Confident	83.6	Confident	12 Å²	12	77.2 Å²	77.2	6%	0.064	36%	0.362	C	S	.	.	H	α-helix	trans	-58.1	-37.3	177.1	-82.2	-42.3	0	0	0	112.8	F1920 Q1923 E1924 H1927 E2041 K2047 S2049	F1920-N2045 HydrophobicContact CE2-CB 4.05Å; F1920-N2045 WeakPolarHBondContact CE2-O 3.34Å; Q1923-N2045 VanDerWaalsContact C-ND2 3.35Å; Q1923-N2045 WeakPolarHBondContact CB-OD1 3.25Å; Q1923-N2045 PolarHBondContact O-ND2 3.41Å; E1924-N2045 PolarHBondContact N-OD1 2.74Å; H1927-N2045 WeakPolarHBondContact CB-ND2 3.11Å; E2041-N2045 PolarHBondContact O-N 3.49Å; E2041-N2045 PolarHBondContact O-ND2 3.49Å; N2045-K2047 VanDerWaalsContact C-N 3.26Å; N2045-K2047 PolarHBondContact O-N 2.76Å; N2045-S2049 WeakPolarHBondContact O-CB 3.35Å; N2045-S2049 PolarHBondContact O-N 2.93Å
2046	R	80.3	Confident	83.4	Confident	167 Å²	167	77.2 Å²	77.2	63%	0.63	36%	0.36	S	S	*	.	H	α-helix	trans	-65.8	-24	174.4	-78.7	170.8	173.1	173.6	-0.3	114.1	R2042 E2043 Q2044	R2042-R2046 WeakPolarHBondContact O-CD 3.45Å; R2042-R2046 VanDerWaalsContact O-CG 3.27Å; R2042-R2046 WeakPolarHBondContact O-CG 3.1Å; R2042-R2046 PolarHBondContact O-N 2.62Å; E2043-R2046 PolarHBondContact O-N 3.15Å; Q2044-R2046 VanDerWaalsContact C-N 3.28Å; Q2044-R2046 PolarHBondContact O-N 3.43Å
2047	K	85.6	Confident	83.3	Confident	112 Å²	112	79 Å²	79	49%	0.487	37%	0.366	S	S	.	.	H	α-helix	trans	-83	-49.6	176.4	-69.4	168.1	-174.2	166.1	0	111	E2043 Q2044 N2045 S2049 R2050 Q2051	E2043-K2047 PolarHBondContact O-N 2.9Å; E2043-K2047 WeakPolarHBondContact OE1-CE 3.16Å; E2043-K2047 IonicContact OE1-NZ 2.76Å; E2043-K2047 PolarHBondContact OE1-NZ 2.81Å; Q2044-K2047 WeakPolarHBondContact O-CB 3.44Å; Q2044-K2047 PolarHBondContact O-N 2.78Å; N2045-K2047 VanDerWaalsContact C-N 3.26Å; N2045-K2047 PolarHBondContact O-N 2.76Å; K2047-S2049 VanDerWaalsContact C-N 3.34Å; K2047-S2049 PolarHBondContact O-N 3.19Å; K2047-R2050 WeakPolarHBondContact O-CB 3.02Å; K2047-R2050 PolarHBondContact O-N 2.77Å; K2047-Q2051 PolarHBondContact O-N 3.16Å
2048	L	84.4	Confident	83	Confident	13 Å²	13	80.2 Å²	80.2	7%	0.068	37%	0.373	C	S	.	.	H	α-helix	trans	-59.5	-42.7	175.1	-81.7	154.6	0	0	0	112.1	L1916 Q1919 F1920 Q1923 Q2044 R2050 Q2051 L2052	L1916-L2048 HydrophobicContact CD2-CD2 4.23Å; Q1919-L2048 HydrophobicContact CB-CD1 4.45Å; Q1919-L2048 HydrophobicContact CB-CD2 3.65Å; Q1919-L2048 WeakPolarHBondContact O-CD1 3.44Å; F1920-L2048 HydrophobicContact CB-CB 4.28Å; F1920-L2048 HydrophobicContact CD2-CB 3.77Å; F1920-L2048 HydrophobicContact CG-CB 4.49Å; Q1923-L2048 HydrophobicContact CB-CD1 4.14Å; Q1923-L2048 HydrophobicContact CG-CD1 3.75Å; Q2044-L2048 PolarHBondContact O-N 3.5Å; Q2044-L2048 VanDerWaalsContact O-N 3.08Å; L2048-R2050 PolarHBondContact O-N 3.44Å; L2048-Q2051 PolarHBondContact O-N 3.36Å; L2048-Q2051 VanDerWaalsContact O-N 3.14Å; L2048-L2052 WeakPolarHBondContact O-CB 3.43Å; L2048-L2052 PolarHBondContact O-N 3.1Å
2049	S	77	Confident	83.1	Confident	38 Å²	38	80.7 Å²	80.7	27%	0.266	38%	0.375	S	S	.	.	H	α-helix	trans	-63.4	-10.2	174.6	-173.4	0	0	0	0	114.7	N2045 K2047 R2053	N2045-S2049 WeakPolarHBondContact O-CB 3.35Å; N2045-S2049 PolarHBondContact O-N 2.93Å; K2047-S2049 VanDerWaalsContact C-N 3.34Å; K2047-S2049 PolarHBondContact O-N 3.19Å; S2049-R2053 VanDerWaalsContact O-CZ 3.29Å; S2049-R2053 PolarHBondContact O-NE 3.07Å; S2049-R2053 PolarHBondContact O-NH2 3.48Å; S2049-R2053 PolarHBondContact OG-NH2 3.35Å
2050	R	84.2	Confident	82.9	Confident	117 Å²	117	82.8 Å²	82.8	44%	0.442	38%	0.378	S	S	.	.	H	α-helix	trans	-90.4	-50.9	167	-72.4	178.3	175.6	-167.3	-2.8	111.3	T1464 K2047 L2048 L2052 R2053 E2054	T1464-R2050 PolarHBondContact OG1-NH1 3.38Å; K2047-R2050 WeakPolarHBondContact O-CB 3.02Å; K2047-R2050 PolarHBondContact O-N 2.77Å; L2048-R2050 PolarHBondContact O-N 3.44Å; R2050-L2052 PolarHBondContact O-N 3.29Å; R2050-R2053 WeakPolarHBondContact O-CB 3.35Å; R2050-R2053 PolarHBondContact O-N 3.4Å; R2050-E2054 PolarHBondContact O-N 3Å; R2050-E2054 VanDerWaalsContact O-N 3.09Å
2051	Q	84.8	Confident	82.8	Confident	89 Å²	89	83.1 Å²	83.1	42%	0.416	38%	0.377	S	S	.	.	H	α-helix	trans	-56.2	-38.9	179.7	-67.2	173.4	-40.7	0	0	112	L1916 K2047 L2048 R2053 E2054 A2055	L1916-Q2051 HydrophobicContact CD1-CB 4.07Å; L1916-Q2051 HydrophobicContact CD2-CB 4Å; K2047-Q2051 PolarHBondContact O-N 3.16Å; L2048-Q2051 PolarHBondContact O-N 3.36Å; L2048-Q2051 VanDerWaalsContact O-N 3.14Å; Q2051-R2053 VanDerWaalsContact C-N 3.32Å; Q2051-R2053 PolarHBondContact O-N 2.94Å; Q2051-E2054 PolarHBondContact O-N 2.96Å; Q2051-A2055 WeakPolarHBondContact O-CB 3.46Å; Q2051-A2055 PolarHBondContact O-N 2.93Å
2052	L	85.1	Confident	82.8	Confident	23 Å²	23	81.6 Å²	81.6	12%	0.12	37%	0.371	C	S	.	.	H	α-helix	trans	-63.9	-33.2	176.2	-169.8	136.7	0	0	0	113.3	Q1917 F1920 L2048 R2050 Q2056	Q1917-L2052 HydrophobicContact CB-CD1 3.73Å; Q1917-L2052 HydrophobicContact CG-CD1 3.97Å; F1920-L2052 HydrophobicContact CB-CD1 4.33Å; L2048-L2052 WeakPolarHBondContact O-CB 3.43Å; L2048-L2052 PolarHBondContact O-N 3.1Å; R2050-L2052 PolarHBondContact O-N 3.29Å; L2052-Q2056 WeakPolarHBondContact O-CB 3.38Å; L2052-Q2056 VanDerWaalsContact O-CG 3.25Å; L2052-Q2056 WeakPolarHBondContact O-CG 3.48Å; L2052-Q2056 PolarHBondContact O-N 3.12Å
2053	R	79.4	Confident	82.9	Confident	144 Å²	144	78.2 Å²	78.2	54%	0.543	36%	0.363	S	S	.	.	H	α-helix	trans	-75.8	-35.4	175.3	-90.6	177.9	-77.1	-168.1	-13.4	112.9	S2049 R2050 Q2051 Q2056 Q2057	S2049-R2053 VanDerWaalsContact O-CZ 3.29Å; S2049-R2053 PolarHBondContact O-NE 3.07Å; S2049-R2053 PolarHBondContact O-NH2 3.48Å; S2049-R2053 PolarHBondContact OG-NH2 3.35Å; R2050-R2053 WeakPolarHBondContact O-CB 3.35Å; R2050-R2053 PolarHBondContact O-N 3.4Å; Q2051-R2053 VanDerWaalsContact C-N 3.32Å; Q2051-R2053 PolarHBondContact O-N 2.94Å; R2053-Q2056 PolarHBondContact O-N 3.44Å; R2053-Q2057 PolarHBondContact O-N 2.96Å; R2053-Q2057 VanDerWaalsContact O-N 3.14Å
2054	E	81.9	Confident	82.9	Confident	106 Å²	106	82.4 Å²	82.4	50%	0.495	38%	0.375	S	S	.	.	H	α-helix	trans	-65.9	-47.7	174.4	-68.8	169.4	168.7	0	0	109.7	R2050 Q2051 Q2056 Q2057 D2058	R2050-E2054 PolarHBondContact O-N 3Å; R2050-E2054 VanDerWaalsContact O-N 3.09Å; Q2051-E2054 PolarHBondContact O-N 2.96Å; E2054-Q2056 VanDerWaalsContact C-N 3.32Å; E2054-Q2056 PolarHBondContact O-N 3.26Å; E2054-Q2057 PolarHBondContact O-N 3.31Å; E2054-D2058 PolarHBondContact O-N 2.74Å; E2054-D2058 VanDerWaalsContact O-N 3.14Å
2055	A	83	Confident	83.1	Confident	8 Å²	8	82.7 Å²	82.7	7%	0.066	37%	0.371	C	S	.	.	H	α-helix	trans	-61.3	-35	173.7	0	0	0	0	0	113.5	L1913 L1916 Q2051 Q2057 D2058 E2059	L1913-A2055 HydrophobicContact CB-CB 4.14Å; L1916-A2055 HydrophobicContact CD1-CB 3.92Å; Q2051-A2055 WeakPolarHBondContact O-CB 3.46Å; Q2051-A2055 PolarHBondContact O-N 2.93Å; A2055-Q2057 VanDerWaalsContact C-N 3.34Å; A2055-Q2057 PolarHBondContact O-N 3.38Å; A2055-D2058 PolarHBondContact O-N 3.2Å; A2055-E2059 WeakPolarHBondContact O-CB 3.39Å; A2055-E2059 PolarHBondContact O-N 3.4Å
2056	Q	82.8	Confident	83.2	Confident	76 Å²	76	82.5 Å²	82.5	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-63.6	-34.4	172.1	-83.6	174.7	-10.1	0	0	112.9	L1913 L2052 R2053 E2054 N2060	L1913-Q2056 HydrophobicContact CD1-CB 4.25Å; L1913-Q2056 HydrophobicContact CD1-CG 3.51Å; L2052-Q2056 WeakPolarHBondContact O-CB 3.38Å; L2052-Q2056 VanDerWaalsContact O-CG 3.25Å; L2052-Q2056 WeakPolarHBondContact O-CG 3.48Å; L2052-Q2056 PolarHBondContact O-N 3.12Å; R2053-Q2056 PolarHBondContact O-N 3.44Å; E2054-Q2056 VanDerWaalsContact C-N 3.32Å; E2054-Q2056 PolarHBondContact O-N 3.26Å; Q2056-N2060 WeakPolarHBondContact O-CB 3.49Å; Q2056-N2060 PolarHBondContact O-N 3.13Å; Q2056-N2060 PolarHBondContact O-ND2 3.4Å
2057	Q	85	Confident	83.1	Confident	145 Å²	145	77.8 Å²	77.8	68%	0.678	36%	0.361	S	S	*	.	H	α-helix	trans	-69.3	-44.4	173.5	-84	-173.9	-69.9	0	0	111.6	R2053 E2054 A2055 E2059 N2060 E2061	R2053-Q2057 PolarHBondContact O-N 2.96Å; R2053-Q2057 VanDerWaalsContact O-N 3.14Å; E2054-Q2057 PolarHBondContact O-N 3.31Å; A2055-Q2057 VanDerWaalsContact C-N 3.34Å; A2055-Q2057 PolarHBondContact O-N 3.38Å; Q2057-E2059 VanDerWaalsContact C-N 3.34Å; Q2057-E2059 PolarHBondContact O-N 2.88Å; Q2057-N2060 PolarHBondContact O-N 3.31Å; Q2057-E2061 PolarHBondContact O-N 3.33Å
2058	D	82.1	Confident	82.9	Confident	95 Å²	95	76.4 Å²	76.4	51%	0.508	36%	0.362	S	S	.	.	H	α-helix	trans	-63.1	-37.6	178.9	-71.5	-27.8	0	0	0	112.5	E2054 A2055 A2062	E2054-D2058 PolarHBondContact O-N 2.74Å; E2054-D2058 VanDerWaalsContact O-N 3.14Å; A2055-D2058 PolarHBondContact O-N 3.2Å; D2058-A2062 VanDerWaalsContact O-CB 3.29Å; D2058-A2062 WeakPolarHBondContact O-CB 3.46Å; D2058-A2062 PolarHBondContact O-N 3.27Å
2059	E	88.7	Confident	82.8	Confident	37 Å²	37	76 Å²	76	17%	0.173	36%	0.361	C	S	.	.	H	α-helix	trans	-65.5	-42.9	174.4	-164.2	-126.3	141	0	0	112.4	L1906 K1910 L1913 A2055 Q2057 T2063	L1906-E2059 HydrophobicContact CD1-CG 4.36Å; K1910-E2059 HydrophobicContact CD-CG 4.48Å; K1910-E2059 WeakPolarHBondContact CE-OE1 3.35Å; K1910-E2059 HydrophobicContact CG-CG 3.54Å; K1910-E2059 IonicContact NZ-OE1 3.09Å; K1910-E2059 PolarHBondContact NZ-OE1 3.28Å; L1913-E2059 HydrophobicContact CD1-CB 4.15Å; A2055-E2059 WeakPolarHBondContact O-CB 3.39Å; A2055-E2059 PolarHBondContact O-N 3.4Å; Q2057-E2059 VanDerWaalsContact C-N 3.34Å; Q2057-E2059 PolarHBondContact O-N 2.88Å; E2059-T2063 WeakPolarHBondContact O-CB 3.41Å; E2059-T2063 PolarHBondContact O-N 3.48Å; E2059-T2063 PolarHBondContact O-OG1 2.83Å
2060	N	80.6	Confident	83.1	Confident	103 Å²	103	77.9 Å²	77.9	55%	0.551	37%	0.366	S	S	*	.	H	α-helix	trans	-66.6	-37.8	178.4	-87.5	-81.2	0	0	0	112.1	Q2056 Q2057 R2064	Q2056-N2060 WeakPolarHBondContact O-CB 3.49Å; Q2056-N2060 PolarHBondContact O-N 3.13Å; Q2056-N2060 PolarHBondContact O-ND2 3.4Å; Q2057-N2060 PolarHBondContact O-N 3.31Å; N2060-R2064 PolarHBondContact O-N 2.95Å
2061	E	83.6	Confident	82.8	Confident	104 Å²	104	80.4 Å²	80.4	49%	0.486	38%	0.375	S	S	.	.	H	α-helix	trans	-74.3	-41	177	-159	177.6	136.1	0	0	112.1	Q2057 T2063 R2064 R2065	Q2057-E2061 PolarHBondContact O-N 3.33Å; E2061-T2063 VanDerWaalsContact C-N 3.27Å; E2061-T2063 PolarHBondContact O-N 3.26Å; E2061-R2064 WeakPolarHBondContact O-CB 3.2Å; E2061-R2064 PolarHBondContact O-N 3.14Å; E2061-R2064 VanDerWaalsContact O-N 3.12Å; E2061-R2065 WeakPolarHBondContact O-CG 3.09Å; E2061-R2065 PolarHBondContact O-N 3.03Å; E2061-R2065 VanDerWaalsContact O-N 3.07Å; E2061-R2065 IonicContact OE1-CZ 2.75Å; E2061-R2065 IonicContact OE1-NE 2.72Å; E2061-R2065 PolarHBondContact OE1-NE 2.95Å; E2061-R2065 IonicContact OE1-NH2 3.77Å; E2061-R2065 PolarHBondContact OE1-NH2 3.35Å
2062	A	82.9	Confident	82.7	Confident	8 Å²	8	84.7 Å²	84.7	7%	0.066	39%	0.387	C	S	.	.	H	α-helix	trans	-58.2	-40.3	171.8	0	0	0	0	0	111.6	L1906 D2058 R2064 R2065 A2066	L1906-A2062 HydrophobicContact CB-CB 4.23Å; L1906-A2062 HydrophobicContact CD1-CB 4.07Å; D2058-A2062 VanDerWaalsContact O-CB 3.29Å; D2058-A2062 WeakPolarHBondContact O-CB 3.46Å; D2058-A2062 PolarHBondContact O-N 3.27Å; A2062-R2064 VanDerWaalsContact C-N 3.33Å; A2062-R2064 PolarHBondContact O-N 3.44Å; A2062-R2065 PolarHBondContact O-N 3.21Å; A2062-R2065 VanDerWaalsContact O-N 3.15Å; A2062-A2066 PolarHBondContact O-N 2.99Å
2063	T	84.1	Confident	82.5	Confident	42 Å²	42	83.7 Å²	83.7	26%	0.258	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-39	175.7	-61.4	0	0	0	0	112.2	L1906 E2059 E2061 T2067	L1906-T2063 WeakPolarHBondContact CD1-OG1 3.2Å; E2059-T2063 WeakPolarHBondContact O-CB 3.41Å; E2059-T2063 PolarHBondContact O-N 3.48Å; E2059-T2063 PolarHBondContact O-OG1 2.83Å; E2061-T2063 VanDerWaalsContact C-N 3.27Å; E2061-T2063 PolarHBondContact O-N 3.26Å; T2063-T2067 WeakPolarHBondContact O-CB 3.39Å; T2063-T2067 WeakPolarHBondContact O-CG2 3.47Å; T2063-T2067 PolarHBondContact O-N 3.09Å; T2063-T2067 PolarHBondContact O-OG1 2.72Å
2064	R	82.8	Confident	82.3	Confident	188 Å²	188	81.7 Å²	81.7	71%	0.709	38%	0.379	S	S	*	.	H	α-helix	trans	-66.8	-36.6	174.3	-75.6	179.3	170.6	-174.8	-1.9	112.8	N2060 E2061 A2062 T2067 T2068	N2060-R2064 PolarHBondContact O-N 2.95Å; E2061-R2064 WeakPolarHBondContact O-CB 3.2Å; E2061-R2064 PolarHBondContact O-N 3.14Å; E2061-R2064 VanDerWaalsContact O-N 3.12Å; A2062-R2064 VanDerWaalsContact C-N 3.33Å; A2062-R2064 PolarHBondContact O-N 3.44Å; R2064-T2067 PolarHBondContact O-OG1 2.76Å; R2064-T2068 WeakPolarHBondContact O-CB 3.31Å; R2064-T2068 WeakPolarHBondContact O-CG2 3.33Å; R2064-T2068 PolarHBondContact O-N 2.9Å; R2064-T2068 PolarHBondContact O-OG1 2.69Å
2065	R	85.9	Confident	82.1	Confident	110 Å²	110	82.5 Å²	82.5	42%	0.415	38%	0.383	S	S	.	.	H	α-helix	trans	-69.5	-47.3	176.7	-62.8	175.7	-167.6	173.9	4.5	111.1	F1902 E2061 A2062 T2067 T2068 A2069	F1902-R2065 HydrophobicContact CB-CB 4.47Å; F1902-R2065 HydrophobicContact CD1-CB 3.73Å; F1902-R2065 HydrophobicContact CE1-CB 4.1Å; F1902-R2065 HydrophobicContact CG-CB 4.05Å; E2061-R2065 WeakPolarHBondContact O-CG 3.09Å; E2061-R2065 PolarHBondContact O-N 3.03Å; E2061-R2065 VanDerWaalsContact O-N 3.07Å; E2061-R2065 IonicContact OE1-CZ 2.75Å; E2061-R2065 IonicContact OE1-NE 2.72Å; E2061-R2065 PolarHBondContact OE1-NE 2.95Å; E2061-R2065 IonicContact OE1-NH2 3.77Å; E2061-R2065 PolarHBondContact OE1-NH2 3.35Å; A2062-R2065 PolarHBondContact O-N 3.21Å; A2062-R2065 VanDerWaalsContact O-N 3.15Å; R2065-T2067 PolarHBondContact O-N 2.98Å; R2065-T2068 PolarHBondContact O-N 2.74Å; R2065-T2068 PolarHBondContact O-OG1 3.27Å; R2065-T2068 VanDerWaalsContact O-OG1 3.1Å; R2065-A2069 WeakPolarHBondContact O-CB 3.23Å; R2065-A2069 PolarHBondContact O-N 3.36Å
2066	A	83.1	Confident	81.8	Confident	8 Å²	8	83.3 Å²	83.3	7%	0.066	39%	0.39	C	S	.	.	H	α-helix	trans	-59.1	-48.6	176.4	0	0	0	0	0	112.4	F1902 L1906 A2062 T2068 A2069 Q2070	F1902-A2066 HydrophobicContact CB-CB 4.29Å; L1906-A2066 HydrophobicContact CB-CB 4.48Å; L1906-A2066 HydrophobicContact CD2-CB 3.98Å; A2062-A2066 PolarHBondContact O-N 2.99Å; A2066-T2068 VanDerWaalsContact C-N 3.34Å; A2066-T2068 PolarHBondContact O-N 3.08Å; A2066-A2069 PolarHBondContact O-N 3.28Å; A2066-Q2070 WeakPolarHBondContact O-CB 3.32Å; A2066-Q2070 PolarHBondContact O-N 2.86Å
2067	T	78.3	Confident	81.5	Confident	67 Å²	67	83.6 Å²	83.6	41%	0.411	39%	0.391	S	S	.	.	H	α-helix	trans	-68.2	-27.2	-179.5	50	0	0	0	0	114.3	T2063 R2064 R2065 R2071	T2063-T2067 WeakPolarHBondContact O-CB 3.39Å; T2063-T2067 WeakPolarHBondContact O-CG2 3.47Å; T2063-T2067 PolarHBondContact O-N 3.09Å; T2063-T2067 PolarHBondContact O-OG1 2.72Å; R2064-T2067 PolarHBondContact O-OG1 2.76Å; R2065-T2067 PolarHBondContact O-N 2.98Å; T2067-R2071 PolarHBondContact O-N 3.38Å
2068	T	80.5	Confident	81.1	Confident	83 Å²	83	83.8 Å²	83.8	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-81.3	-30	173.6	48	0	0	0	0	112.9	R2064 R2065 A2066	R2064-T2068 WeakPolarHBondContact O-CB 3.31Å; R2064-T2068 WeakPolarHBondContact O-CG2 3.33Å; R2064-T2068 PolarHBondContact O-N 2.9Å; R2064-T2068 PolarHBondContact O-OG1 2.69Å; R2065-T2068 PolarHBondContact O-N 2.74Å; R2065-T2068 PolarHBondContact O-OG1 3.27Å; R2065-T2068 VanDerWaalsContact O-OG1 3.1Å; A2066-T2068 VanDerWaalsContact C-N 3.34Å; A2066-T2068 PolarHBondContact O-N 3.08Å
2069	A	82.3	Confident	80.8	Confident	6 Å²	6	84.1 Å²	84.1	5%	0.05	40%	0.396	C	S	.	.	H	α-helix	trans	-70.8	-41	170	0	0	0	0	0	112.2	F1902 R2065 A2066 R2071 R2072 A2073	F1902-A2069 HydrophobicContact CD2-CB 3.64Å; F1902-A2069 HydrophobicContact CE2-CB 4.35Å; R2065-A2069 WeakPolarHBondContact O-CB 3.23Å; R2065-A2069 PolarHBondContact O-N 3.36Å; A2066-A2069 PolarHBondContact O-N 3.28Å; A2069-R2071 PolarHBondContact O-N 2.59Å; A2069-R2072 PolarHBondContact O-N 2.78Å; A2069-R2072 VanDerWaalsContact O-N 3.15Å; A2069-A2073 PolarHBondContact O-N 2.93Å
2070	Q	84.7	Confident	80.1	Confident	77 Å²	77	82.9 Å²	82.9	36%	0.36	39%	0.392	S	S	.	.	H	α-helix	trans	-55.4	-48.4	174.7	-176.8	-174	-18.6	0	0	111.6	A2066 R2072 A2073 E2074	A2066-Q2070 WeakPolarHBondContact O-CB 3.32Å; A2066-Q2070 PolarHBondContact O-N 2.86Å; Q2070-R2072 VanDerWaalsContact C-N 3.29Å; Q2070-R2072 PolarHBondContact O-N 2.89Å; Q2070-A2073 WeakPolarHBondContact O-CB 3.26Å; Q2070-A2073 PolarHBondContact O-N 3.27Å; Q2070-A2073 VanDerWaalsContact O-N 3.1Å; Q2070-E2074 HydrophobicContact CG-CG 4.41Å; Q2070-E2074 WeakPolarHBondContact CG-OE1 3.49Å; Q2070-E2074 PolarHBondContact NE2-OE1 2.84Å; Q2070-E2074 WeakPolarHBondContact O-CG 3.34Å; Q2070-E2074 PolarHBondContact O-N 2.99Å
2071	R	77.7	Confident	79.7	Confident	169 Å²	169	82.1 Å²	82.1	64%	0.638	39%	0.388	S	S	*	.	H	α-helix	trans	-57.9	-39.8	177.2	-74.8	-173.4	-170.5	165	4.6	113.1	T2067 A2069 A2073 E2074 E2075	T2067-R2071 PolarHBondContact O-N 3.38Å; A2069-R2071 PolarHBondContact O-N 2.59Å; R2071-A2073 VanDerWaalsContact C-N 3.35Å; R2071-E2074 PolarHBondContact O-N 2.89Å; R2071-E2075 WeakPolarHBondContact O-CB 3.01Å; R2071-E2075 WeakPolarHBondContact O-CG 3.34Å; R2071-E2075 PolarHBondContact O-N 3.34Å
2072	R	81.9	Confident	79.2	Confident	179 Å²	179	83 Å²	83	68%	0.675	39%	0.39	S	S	*	.	H	α-helix	trans	-68.3	-33.9	177.4	-74.5	178.6	170	168.5	-2.8	112.7	A2069 Q2070 A2076	A2069-R2072 PolarHBondContact O-N 2.78Å; A2069-R2072 VanDerWaalsContact O-N 3.15Å; Q2070-R2072 VanDerWaalsContact C-N 3.29Å; Q2070-R2072 PolarHBondContact O-N 2.89Å; R2072-A2076 VanDerWaalsContact O-CB 3.27Å; R2072-A2076 WeakPolarHBondContact O-CB 3.42Å; R2072-A2076 PolarHBondContact O-N 3.21Å
2073	A	81.8	Confident	78.7	Confident	2 Å²	2	83.9 Å²	83.9	2%	0.017	40%	0.397	C	S	.	.	H	α-helix	trans	-68.4	-41.3	171.2	0	0	0	0	0	111.5	A1895 L1896 Q1899 A2069 Q2070 R2071 Q2077	A1895-A2073 HydrophobicContact CB-CB 4.38Å; L1896-A2073 HydrophobicContact CD2-CB 4.16Å; Q1899-A2073 HydrophobicContact CB-CB 4.4Å; Q1899-A2073 VanDerWaalsContact OE1-CB 3.28Å; A2069-A2073 PolarHBondContact O-N 2.93Å; Q2070-A2073 WeakPolarHBondContact O-CB 3.26Å; Q2070-A2073 PolarHBondContact O-N 3.27Å; Q2070-A2073 VanDerWaalsContact O-N 3.1Å; R2071-A2073 VanDerWaalsContact C-N 3.35Å; A2073-Q2077 WeakPolarHBondContact O-CB 3.37Å; A2073-Q2077 PolarHBondContact O-N 2.71Å
2074	E	75.1	Confident	78.1	Confident	103 Å²	103	85.7 Å²	85.7	48%	0.481	40%	0.403	S	S	.	.	H	α-helix	trans	-63.7	-43.5	175.4	-71.2	170.5	174.1	0	0	112.4	Q2070 R2071 Q2077 M2078	Q2070-E2074 HydrophobicContact CG-CG 4.41Å; Q2070-E2074 WeakPolarHBondContact CG-OE1 3.49Å; Q2070-E2074 PolarHBondContact NE2-OE1 2.84Å; Q2070-E2074 WeakPolarHBondContact O-CG 3.34Å; Q2070-E2074 PolarHBondContact O-N 2.99Å; R2071-E2074 PolarHBondContact O-N 2.89Å; E2074-Q2077 PolarHBondContact O-N 2.93Å; E2074-M2078 PolarHBondContact O-N 2.83Å
2075	E	77.3	Confident	77.5	Confident	122 Å²	122	82.5 Å²	82.5	57%	0.57	40%	0.396	S	S	*	.	H	α-helix	trans	-61.2	-53	173.8	-74.6	171	157	0	0	111.2	R2071 Q2077 M2078 D2079	R2071-E2075 WeakPolarHBondContact O-CB 3.01Å; R2071-E2075 WeakPolarHBondContact O-CG 3.34Å; R2071-E2075 PolarHBondContact O-N 3.34Å; E2075-Q2077 PolarHBondContact O-N 3.48Å; E2075-M2078 WeakPolarHBondContact O-CB 3.48Å; E2075-M2078 PolarHBondContact O-N 2.97Å; E2075-D2079 PolarHBondContact O-N 3.03Å; E2075-D2079 VanDerWaalsContact O-N 3.09Å
2076	A	77	Confident	76.9	Confident	26 Å²	26	82.6 Å²	82.6	22%	0.215	40%	0.402	C	S	.	.	H	α-helix	trans	-60.4	-32.4	177.3	0	0	0	0	0	112.7	A1895 R2072 A2080	A1895-A2076 HydrophobicContact CB-CB 4.13Å; R2072-A2076 VanDerWaalsContact O-CB 3.27Å; R2072-A2076 WeakPolarHBondContact O-CB 3.42Å; R2072-A2076 PolarHBondContact O-N 3.21Å; A2076-A2080 VanDerWaalsContact O-CB 3.3Å; A2076-A2080 WeakPolarHBondContact O-CB 3.46Å; A2076-A2080 PolarHBondContact O-N 3.26Å
2077	Q	76.9	Confident	76.3	Confident	81 Å²	81	83.4 Å²	83.4	38%	0.379	41%	0.408	S	S	.	.	H	α-helix	trans	-77.7	-26.5	175.6	-165	148.9	10.8	0	0	113	L1892 A2073 E2074 E2075 N2081	L1892-Q2077 HydrophobicContact CD1-CB 3.57Å; L1892-Q2077 HydrophobicContact CD1-CG 3.88Å; A2073-Q2077 WeakPolarHBondContact O-CB 3.37Å; A2073-Q2077 PolarHBondContact O-N 2.71Å; E2074-Q2077 PolarHBondContact O-N 2.93Å; E2075-Q2077 PolarHBondContact O-N 3.48Å; Q2077-N2081 VanDerWaalsContact O-CB 3.31Å; Q2077-N2081 WeakPolarHBondContact O-CB 3.47Å; Q2077-N2081 VanDerWaalsContact O-CG 3.27Å; Q2077-N2081 PolarHBondContact O-N 2.86Å; Q2077-N2081 PolarHBondContact O-ND2 3.33Å
2078	M	75.4	Confident	75.6	Confident	150 Å²	150	84.4 Å²	84.4	74%	0.739	41%	0.41	S	S	*	.	H	α-helix	trans	-65.3	-47.6	169	-120.7	-175.9	-173.5	0	0	111.1	E2074 E2075 N2081 K2082	E2074-M2078 PolarHBondContact O-N 2.83Å; E2075-M2078 WeakPolarHBondContact O-CB 3.48Å; E2075-M2078 PolarHBondContact O-N 2.97Å; M2078-N2081 PolarHBondContact O-N 2.76Å; M2078-K2082 WeakPolarHBondContact O-CB 3.5Å; M2078-K2082 PolarHBondContact O-N 2.71Å
2079	D	75.7	Confident	74.8	Confident	102 Å²	102	83.4 Å²	83.4	55%	0.545	41%	0.406	S	S	.	.	H	α-helix	trans	-67.1	-40.3	178.2	-77.6	-35.1	0	0	0	112.3	E2075 N2081 K2082 A2083	E2075-D2079 PolarHBondContact O-N 3.03Å; E2075-D2079 VanDerWaalsContact O-N 3.09Å; D2079-N2081 PolarHBondContact O-N 2.65Å; D2079-K2082 PolarHBondContact O-N 2.8Å; D2079-A2083 WeakPolarHBondContact O-CB 3.14Å; D2079-A2083 PolarHBondContact O-N 3.14Å
2080	A	75.2	Confident	74.1	Confident	11 Å²	11	85.3 Å²	85.3	9%	0.091	42%	0.419	C	S	.	.	H	α-helix	trans	-61.1	-43.7	173.7	0	0	0	0	0	112.9	I1888 L1892 A2076 K2082 M2084	I1888-A2080 HydrophobicContact CG2-CB 3.83Å; L1892-A2080 HydrophobicContact CD1-CB 4.49Å; L1892-A2080 HydrophobicContact CD2-CB 4.36Å; A2076-A2080 VanDerWaalsContact O-CB 3.3Å; A2076-A2080 WeakPolarHBondContact O-CB 3.46Å; A2076-A2080 PolarHBondContact O-N 3.26Å; A2080-K2082 VanDerWaalsContact C-N 3.34Å; A2080-K2082 PolarHBondContact O-N 2.73Å; A2080-M2084 VanDerWaalsContact O-CB 3.32Å; A2080-M2084 WeakPolarHBondContact O-CB 3.19Å; A2080-M2084 PolarHBondContact O-N 3.26Å
2081	N	71.3	Confident	73.4	Confident	87 Å²	87	89.4 Å²	89.4	47%	0.465	43%	0.431	S	S	.	.	H	α-helix	trans	-64.7	-38.2	175.8	-80	-48	0	0	0	112.1	Q2077 M2078 D2079 H2085	Q2077-N2081 VanDerWaalsContact O-CB 3.31Å; Q2077-N2081 WeakPolarHBondContact O-CB 3.47Å; Q2077-N2081 VanDerWaalsContact O-CG 3.27Å; Q2077-N2081 PolarHBondContact O-N 2.86Å; Q2077-N2081 PolarHBondContact O-ND2 3.33Å; M2078-N2081 PolarHBondContact O-N 2.76Å; D2079-N2081 PolarHBondContact O-N 2.65Å; N2081-H2085 WeakPolarHBondContact O-CB 3.49Å; N2081-H2085 PolarHBondContact O-N 2.85Å
2082	K	73.8	Confident	72.4	Confident	123 Å²	123	84.3 Å²	84.3	54%	0.535	43%	0.425	S	S	.	.	H	α-helix	trans	-65.9	-49.5	177.7	-177.1	-172.4	168.4	-157.3	0	111.8	M2078 D2079 A2080 M2084 H2085 E2086	M2078-K2082 WeakPolarHBondContact O-CB 3.5Å; M2078-K2082 PolarHBondContact O-N 2.71Å; D2079-K2082 PolarHBondContact O-N 2.8Å; A2080-K2082 VanDerWaalsContact C-N 3.34Å; A2080-K2082 PolarHBondContact O-N 2.73Å; K2082-M2084 VanDerWaalsContact C-N 3.33Å; K2082-M2084 PolarHBondContact O-N 3.49Å; K2082-H2085 WeakPolarHBondContact O-CB 3.08Å; K2082-H2085 PolarHBondContact O-N 3.37Å; K2082-H2085 VanDerWaalsContact O-N 3.13Å; K2082-E2086 VanDerWaalsContact CE-OE1 3.32Å; K2082-E2086 WeakPolarHBondContact CE-OE1 3.47Å; K2082-E2086 PolarHBondContact O-N 2.92Å
2083	A	72.4	Confident	71.6	Confident	25 Å²	25	82.3 Å²	82.3	21%	0.207	42%	0.423	C	S	.	.	H	α-helix	trans	-61.5	-41	176.4	0	0	0	0	0	112	I1888 D2079 H2085 E2086 A2087	I1888-A2083 HydrophobicContact CD1-CB 3.57Å; D2079-A2083 WeakPolarHBondContact O-CB 3.14Å; D2079-A2083 PolarHBondContact O-N 3.14Å; A2083-H2085 VanDerWaalsContact C-N 3.32Å; A2083-H2085 PolarHBondContact O-N 3.22Å; A2083-E2086 PolarHBondContact O-N 3.24Å; A2083-A2087 WeakPolarHBondContact O-CB 3.45Å; A2083-A2087 PolarHBondContact O-N 2.81Å
2084	M	71.2	Confident	70.7	Confident	80 Å²	80	85.5 Å²	85.5	39%	0.394	44%	0.439	S	S	.	.	H	α-helix	trans	-64.7	-34.9	174.6	-168.8	178.2	71.1	0	0	112.4	L1885 A2080 K2082 L2088	L1885-M2084 HydrophobicContact CD1-CB 3.94Å; L1885-M2084 HydrophobicContact CD1-CG 4.14Å; A2080-M2084 VanDerWaalsContact O-CB 3.32Å; A2080-M2084 WeakPolarHBondContact O-CB 3.19Å; A2080-M2084 PolarHBondContact O-N 3.26Å; K2082-M2084 VanDerWaalsContact C-N 3.33Å; K2082-M2084 PolarHBondContact O-N 3.49Å; M2084-L2088 HydrophobicContact CG-CD1 4.16Å; M2084-L2088 WeakPolarHBondContact O-CB 3.46Å; M2084-L2088 VanDerWaalsContact O-CG 3.23Å; M2084-L2088 WeakPolarHBondContact O-CG 3.24Å; M2084-L2088 PolarHBondContact O-N 3.02Å
2085	H	70.9	Confident	70	Confident	122 Å²	122	84.5 Å²	84.5	57%	0.565	44%	0.437	S	S	*	.	H	α-helix	trans	-67.2	-46.3	175.3	-172	59.9	0	0	0	111.9	N2081 K2082 A2083 A2087 L2088 C2089	N2081-H2085 WeakPolarHBondContact O-CB 3.49Å; N2081-H2085 PolarHBondContact O-N 2.85Å; K2082-H2085 WeakPolarHBondContact O-CB 3.08Å; K2082-H2085 PolarHBondContact O-N 3.37Å; K2082-H2085 VanDerWaalsContact O-N 3.13Å; A2083-H2085 VanDerWaalsContact C-N 3.32Å; A2083-H2085 PolarHBondContact O-N 3.22Å; H2085-A2087 PolarHBondContact O-N 2.84Å; H2085-L2088 PolarHBondContact O-N 3.29Å; H2085-C2089 PolarHBondContact O-N 2.78Å; H2085-C2089 PolarHBondContact O-SG 3.3Å
2086	E	72.7	Confident	69.2	Low	112 Å²	112	81.5 Å²	81.5	52%	0.523	43%	0.433	S	S	.	.	H	α-helix	trans	-59.8	-45.2	176.3	-70	173.8	-167.8	0	0	110.9	K2082 A2083 L2088 C2089 S2090	K2082-E2086 VanDerWaalsContact CE-OE1 3.32Å; K2082-E2086 WeakPolarHBondContact CE-OE1 3.47Å; K2082-E2086 PolarHBondContact O-N 2.92Å; A2083-E2086 PolarHBondContact O-N 3.24Å; E2086-L2088 PolarHBondContact O-N 3.05Å; E2086-C2089 PolarHBondContact O-N 3.47Å; E2086-S2090 PolarHBondContact O-N 3.23Å; E2086-S2090 VanDerWaalsContact O-N 3.08Å; E2086-S2090 PolarHBondContact O-OG 3.41Å
2087	A	69.6	Low	68.7	Low	24 Å²	24	85 Å²	85	20%	0.198	45%	0.448	C	S	.	.	H	α-helix	trans	-63.4	-36.3	174.5	0	0	0	0	0	113.8	A2083 H2085 R2091	A2083-A2087 WeakPolarHBondContact O-CB 3.45Å; A2083-A2087 PolarHBondContact O-N 2.81Å; H2085-A2087 PolarHBondContact O-N 2.84Å; A2087-R2091 VanDerWaalsContact O-CB 3.25Å; A2087-R2091 WeakPolarHBondContact O-CB 3.5Å; A2087-R2091 PolarHBondContact O-N 3.22Å
2088	L	63.4	Low	68.1	Low	88 Å²	88	84.8 Å²	84.8	46%	0.461	45%	0.448	S	S	.	.	H	α-helix	trans	-69.3	-38.6	175.4	-79.2	169	0	0	0	112.3	M2084 H2085 E2086 R2091 A2092	M2084-L2088 HydrophobicContact CG-CD1 4.16Å; M2084-L2088 WeakPolarHBondContact O-CB 3.46Å; M2084-L2088 VanDerWaalsContact O-CG 3.23Å; M2084-L2088 WeakPolarHBondContact O-CG 3.24Å; M2084-L2088 PolarHBondContact O-N 3.02Å; H2085-L2088 PolarHBondContact O-N 3.29Å; E2086-L2088 PolarHBondContact O-N 3.05Å; L2088-R2091 PolarHBondContact O-N 3.31Å; L2088-A2092 PolarHBondContact O-N 3.41Å
2089	C	65.1	Low	67.2	Low	62 Å²	62	86 Å²	86	42%	0.419	45%	0.445	S	S	.	.	H	α-helix	trans	-62.8	-50.9	174.6	-74.3	0	0	0	0	111.5	H2085 E2086 R2091 A2092 E2093	H2085-C2089 PolarHBondContact O-N 2.78Å; H2085-C2089 PolarHBondContact O-SG 3.3Å; E2086-C2089 PolarHBondContact O-N 3.47Å; C2089-R2091 VanDerWaalsContact C-N 3.26Å; C2089-R2091 PolarHBondContact O-N 2.98Å; C2089-A2092 WeakPolarHBondContact O-CB 3.29Å; C2089-A2092 PolarHBondContact O-N 3.18Å; C2089-E2093 PolarHBondContact O-N 3.32Å; C2089-E2093 VanDerWaalsContact O-N 3.12Å
2090	S	67.4	Low	66.2	Low	46 Å²	46	89.9 Å²	89.9	32%	0.322	45%	0.452	S	S	.	.	H	α-helix	trans	-59.7	-37.2	175.5	-57.1	0	0	0	0	112.2	E2086 A2092 M2094	E2086-S2090 PolarHBondContact O-N 3.23Å; E2086-S2090 VanDerWaalsContact O-N 3.08Å; E2086-S2090 PolarHBondContact O-OG 3.41Å; S2090-A2092 PolarHBondContact O-N 3.14Å; S2090-M2094 VanDerWaalsContact O-CG 3.3Å; S2090-M2094 WeakPolarHBondContact O-CG 3.33Å; S2090-M2094 PolarHBondContact O-N 3.1Å; S2090-M2094 VanDerWaalsContact O-N 3.16Å
2091	R	68.9	Low	65.8	Low	164 Å²	164	92.7 Å²	92.7	62%	0.619	47%	0.468	S	S	*	.	H	α-helix	trans	-65.9	-33.9	173.7	177.4	173	167.6	165.7	-5.3	112.5	A2087 L2088 C2089 N2095	A2087-R2091 VanDerWaalsContact O-CB 3.25Å; A2087-R2091 WeakPolarHBondContact O-CB 3.5Å; A2087-R2091 PolarHBondContact O-N 3.22Å; L2088-R2091 PolarHBondContact O-N 3.31Å; C2089-R2091 VanDerWaalsContact C-N 3.26Å; C2089-R2091 PolarHBondContact O-N 2.98Å; R2091-N2095 PolarHBondContact O-N 3.44Å; R2091-N2095 PolarHBondContact O-ND2 2.89Å
2092	A	57.1	Low	65.3	Low	61 Å²	61	94 Å²	94	50%	0.504	47%	0.472	S	S	.	.	H	α-helix	trans	-67.9	-45.2	176.8	0	0	0	0	0	111.7	L2088 C2089 S2090 M2094 N2095 A2096	L2088-A2092 PolarHBondContact O-N 3.41Å; C2089-A2092 WeakPolarHBondContact O-CB 3.29Å; C2089-A2092 PolarHBondContact O-N 3.18Å; S2090-A2092 PolarHBondContact O-N 3.14Å; A2092-M2094 PolarHBondContact O-N 3.03Å; A2092-N2095 PolarHBondContact O-N 3.19Å; A2092-A2096 PolarHBondContact O-N 3.39Å
2093	E	64.9	Low	64.6	Low	137 Å²	137	93 Å²	93	64%	0.64	47%	0.472	S	S	*	.	H	α-helix	trans	-60	-44.1	176.7	-66	-177.7	148.6	0	0	112	C2089 N2095 A2096 L2097	C2089-E2093 PolarHBondContact O-N 3.32Å; C2089-E2093 VanDerWaalsContact O-N 3.12Å; E2093-N2095 VanDerWaalsContact C-N 3.34Å; E2093-N2095 PolarHBondContact O-N 3.31Å; E2093-A2096 WeakPolarHBondContact O-CB 3.37Å; E2093-A2096 PolarHBondContact O-N 3.24Å; E2093-A2096 VanDerWaalsContact O-N 3.14Å; E2093-L2097 PolarHBondContact O-N 3.43Å
2094	M	62.8	Low	63.7	Low	70 Å²	70	96.8 Å²	96.8	35%	0.345	49%	0.488	S	S	.	.	H	α-helix	trans	-62.7	-37.8	176.6	-68.8	-62.6	178.7	0	0	112.9	L1874 S2090 A2092 A2096 L2097 L2098	L1874-M2094 HydrophobicContact CD1-CE 3.96Å; L1874-M2094 HydrophobicContact CD1-SD 3.64Å; L1874-M2094 HydrophobicContact CD2-SD 4.25Å; L1874-M2094 HydrophobicContact CG-SD 4.09Å; S2090-M2094 VanDerWaalsContact O-CG 3.3Å; S2090-M2094 WeakPolarHBondContact O-CG 3.33Å; S2090-M2094 PolarHBondContact O-N 3.1Å; S2090-M2094 VanDerWaalsContact O-N 3.16Å; A2092-M2094 PolarHBondContact O-N 3.03Å; M2094-A2096 VanDerWaalsContact C-N 3.35Å; M2094-L2097 PolarHBondContact O-N 3.24Å; M2094-L2097 HydrophobicContact SD-CD1 4.27Å; M2094-L2098 PolarHBondContact O-N 2.95Å
2095	N	61.3	Low	62.8	Low	81 Å²	81	97.6 Å²	97.6	43%	0.433	49%	0.491	S	S	.	.	H	α-helix	trans	-70.2	-30.4	174.8	-77.2	-66.6	0	0	0	112.6	R2091 A2092 E2093 R2099	R2091-N2095 PolarHBondContact O-N 3.44Å; R2091-N2095 PolarHBondContact O-ND2 2.89Å; A2092-N2095 PolarHBondContact O-N 3.19Å; E2093-N2095 VanDerWaalsContact C-N 3.34Å; E2093-N2095 PolarHBondContact O-N 3.31Å; N2095-R2099 PolarHBondContact O-N 3.21Å; N2095-R2099 VanDerWaalsContact O-N 3.13Å
2096	A	60.5	Low	62.2	Low	60 Å²	60	94.4 Å²	94.4	50%	0.496	49%	0.486	S	S	.	.	H	α-helix	trans	-68.9	-39.9	173.5	0	0	0	0	0	111.9	A2092 E2093 M2094 R2099 R2100	A2092-A2096 PolarHBondContact O-N 3.39Å; E2093-A2096 WeakPolarHBondContact O-CB 3.37Å; E2093-A2096 PolarHBondContact O-N 3.24Å; E2093-A2096 VanDerWaalsContact O-N 3.14Å; M2094-A2096 VanDerWaalsContact C-N 3.35Å; A2096-R2099 PolarHBondContact O-N 3.04Å; A2096-R2100 PolarHBondContact O-N 3.04Å; A2096-R2100 VanDerWaalsContact O-N 3.07Å
2097	L	65.6	Low	61	Low	100 Å²	100	93.9 Å²	93.9	52%	0.524	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-40.1	172.9	-69.8	171.3	0	0	0	112.3	E2093 M2094 R2100 T2101	E2093-L2097 PolarHBondContact O-N 3.43Å; M2094-L2097 PolarHBondContact O-N 3.24Å; M2094-L2097 HydrophobicContact SD-CD1 4.27Å; L2097-R2100 WeakPolarHBondContact O-CB 3.35Å; L2097-R2100 PolarHBondContact O-N 3.46Å; L2097-T2101 PolarHBondContact O-N 2.95Å; L2097-T2101 PolarHBondContact O-OG1 3.41Å; L2097-T2101 VanDerWaalsContact O-OG1 3.08Å
2098	L	64.3	Low	60.2	Low	75 Å²	75	98 Å²	98	39%	0.393	51%	0.508	S	S	.	.	H	α-helix	trans	-64.5	-39	177.5	-166.7	70.8	0	0	0	112.5	M2094 T2101 Q2102	M2094-L2098 PolarHBondContact O-N 2.95Å; L2098-T2101 WeakPolarHBondContact CA-OG1 3.36Å; L2098-T2101 PolarHBondContact O-OG1 3.01Å; L2098-Q2102 WeakPolarHBondContact O-CG 3.32Å; L2098-Q2102 PolarHBondContact O-N 3.29Å; L2098-Q2102 VanDerWaalsContact O-N 3.17Å
2099	R	57	Low	59.3	Low	177 Å²	177	100.8 Å²	100.8	67%	0.668	52%	0.517	S	S	*	.	H	α-helix	trans	-64.9	-44.3	171.5	-72.7	-177.5	-178.3	-131.3	1.9	111.7	N2095 A2096 T2101 Q2102 D2103	N2095-R2099 PolarHBondContact O-N 3.21Å; N2095-R2099 VanDerWaalsContact O-N 3.13Å; A2096-R2099 PolarHBondContact O-N 3.04Å; R2099-T2101 PolarHBondContact O-N 2.93Å; R2099-Q2102 CarbonylContact O-C 3.6Å; R2099-Q2102 WeakPolarHBondContact O-CA 3.46Å; R2099-Q2102 WeakPolarHBondContact O-CB 3.21Å; R2099-Q2102 PolarHBondContact O-N 3.13Å; R2099-D2103 VanDerWaalsContact O-CG 3.3Å; R2099-D2103 PolarHBondContact O-N 3.21Å
2100	R	55.6	Low	58.3	Low	182 Å²	182	101.8 Å²	101.8	69%	0.687	52%	0.524	S	S	*	.	H	α-helix	trans	-58.3	-34.3	179.1	-128.5	173.8	-171.9	147.1	2.6	113.2	A2096 L2097 L2104	A2096-R2100 PolarHBondContact O-N 3.04Å; A2096-R2100 VanDerWaalsContact O-N 3.07Å; L2097-R2100 WeakPolarHBondContact O-CB 3.35Å; L2097-R2100 PolarHBondContact O-N 3.46Å; R2100-L2104 WeakPolarHBondContact O-CD1 3.42Å; R2100-L2104 VanDerWaalsContact O-CG 3.24Å; R2100-L2104 WeakPolarHBondContact O-CG 3.16Å; R2100-L2104 PolarHBondContact O-N 3.2Å
2101	T	65.9	Low	56.9	Low	71 Å²	71	107.7 Å²	107.7	44%	0.436	54%	0.544	S	S	.	.	H	α-helix	trans	-74.6	-39.1	174	38.1	0	0	0	0	112.3	L2097 L2098 R2099 L2104 E2105	L2097-T2101 PolarHBondContact O-N 2.95Å; L2097-T2101 PolarHBondContact O-OG1 3.41Å; L2097-T2101 VanDerWaalsContact O-OG1 3.08Å; L2098-T2101 WeakPolarHBondContact CA-OG1 3.36Å; L2098-T2101 PolarHBondContact O-OG1 3.01Å; R2099-T2101 PolarHBondContact O-N 2.93Å; T2101-L2104 PolarHBondContact O-N 3.32Å; T2101-E2105 PolarHBondContact O-N 2.93Å
2102	Q	60.9	Low	55.4	Low	115 Å²	115	107.6 Å²	107.6	54%	0.537	55%	0.551	S	S	.	*	H	α-helix	trans	-64.3	-41	173.7	-70.5	172.6	-12.7	0	0	112.9	L2098 R2099 L2104 E2105 A2106	L2098-Q2102 WeakPolarHBondContact O-CG 3.32Å; L2098-Q2102 PolarHBondContact O-N 3.29Å; L2098-Q2102 VanDerWaalsContact O-N 3.17Å; R2099-Q2102 CarbonylContact O-C 3.6Å; R2099-Q2102 WeakPolarHBondContact O-CA 3.46Å; R2099-Q2102 WeakPolarHBondContact O-CB 3.21Å; R2099-Q2102 PolarHBondContact O-N 3.13Å; Q2102-L2104 VanDerWaalsContact C-N 3.33Å; Q2102-L2104 PolarHBondContact O-N 3.18Å; Q2102-E2105 PolarHBondContact O-N 3.4Å; Q2102-A2106 PolarHBondContact O-N 3.14Å
2103	D	58.5	Low	54.1	Low	100 Å²	100	111.9 Å²	111.9	54%	0.535	57%	0.565	S	S	.	*	H	α-helix	trans	-64.4	-37.5	175.8	-65.4	-34.9	0	0	0	111.5	R2099 A2106 L2107	R2099-D2103 VanDerWaalsContact O-CG 3.3Å; R2099-D2103 PolarHBondContact O-N 3.21Å; D2103-A2106 PolarHBondContact O-N 3.36Å; D2103-L2107 WeakPolarHBondContact O-CB 3.3Å; D2103-L2107 PolarHBondContact O-N 3.19Å
2104	L	53.3	Low	52.6	Low	106 Å²	106	113.2 Å²	113.2	56%	0.555	58%	0.577	S	S	*	*	H	α-helix	trans	-67.8	-40.6	173.8	-75.6	168.8	0	0	0	112.2	R2100 T2101 Q2102 A2106 L2107 V2108	R2100-L2104 WeakPolarHBondContact O-CD1 3.42Å; R2100-L2104 VanDerWaalsContact O-CG 3.24Å; R2100-L2104 WeakPolarHBondContact O-CG 3.16Å; R2100-L2104 PolarHBondContact O-N 3.2Å; T2101-L2104 PolarHBondContact O-N 3.32Å; Q2102-L2104 VanDerWaalsContact C-N 3.33Å; Q2102-L2104 PolarHBondContact O-N 3.18Å; L2104-A2106 VanDerWaalsContact C-N 3.34Å; L2104-L2107 PolarHBondContact O-N 2.98Å; L2104-V2108 WeakPolarHBondContact O-CG2 3.32Å; L2104-V2108 PolarHBondContact O-N 3.37Å
2105	E	53	Low	50.9	Low	97 Å²	97	114.7 Å²	114.7	45%	0.453	59%	0.594	S	S	.	*	H	α-helix	trans	-63	-39.4	172.4	-80.4	-161.9	-164	0	0	112.7	T2101 Q2102 V2108 K2109	T2101-E2105 PolarHBondContact O-N 2.93Å; Q2102-E2105 PolarHBondContact O-N 3.4Å; E2105-V2108 PolarHBondContact O-N 3.37Å; E2105-K2109 WeakPolarHBondContact O-CB 3.35Å; E2105-K2109 WeakPolarHBondContact O-CG 3.11Å; E2105-K2109 PolarHBondContact O-N 3.39Å; E2105-K2109 IonicContact OE2-NZ 2.77Å; E2105-K2109 PolarHBondContact OE2-NZ 3.42Å
2106	A	58.1	Low	49.4	Very low	55 Å²	55	117.5 Å²	117.5	46%	0.455	61%	0.609	S	S	.	*	H	α-helix	trans	-63.2	-45.6	175.8	0	0	0	0	0	111.2	Q2102 D2103 L2104 V2108 K2109 S2110	Q2102-A2106 PolarHBondContact O-N 3.14Å; D2103-A2106 PolarHBondContact O-N 3.36Å; L2104-A2106 VanDerWaalsContact C-N 3.34Å; A2106-V2108 VanDerWaalsContact C-N 3.29Å; A2106-V2108 PolarHBondContact O-N 3.02Å; A2106-K2109 PolarHBondContact O-N 2.98Å; A2106-S2110 WeakPolarHBondContact O-CB 3.3Å; A2106-S2110 PolarHBondContact O-N 2.67Å; A2106-S2110 PolarHBondContact O-OG 3.29Å
2107	L	48.4	Very low	47.8	Very low	100 Å²	100	125.7 Å²	125.7	52%	0.524	63%	0.629	S	S	.	*	H	α-helix	trans	-63.4	-29.1	175.9	-85.3	164	0	0	0	114.1	D2103 L2104	D2103-L2107 WeakPolarHBondContact O-CB 3.3Å; D2103-L2107 PolarHBondContact O-N 3.19Å; L2104-L2107 PolarHBondContact O-N 2.98Å
2108	V	52.4	Low	45.9	Very low	110 Å²	110	130.3 Å²	130.3	67%	0.667	65%	0.648	S	S	*	*	H	α-helix	trans	-76.5	-39.8	173	169.6	0	0	0	0	111	L2104 E2105 A2106	L2104-V2108 WeakPolarHBondContact O-CG2 3.32Å; L2104-V2108 PolarHBondContact O-N 3.37Å; E2105-V2108 PolarHBondContact O-N 3.37Å; A2106-V2108 VanDerWaalsContact C-N 3.29Å; A2106-V2108 PolarHBondContact O-N 3.02Å
2109	K	45	Very low	44.2	Very low	147 Å²	147	134 Å²	134	64%	0.639	67%	0.668	S	S	*	*	H	α-helix	trans	-70.4	-28.6	177.1	-71.3	164.3	-170.6	159.1	0	112.6	E2105 A2106 K2111	E2105-K2109 WeakPolarHBondContact O-CB 3.35Å; E2105-K2109 WeakPolarHBondContact O-CG 3.11Å; E2105-K2109 PolarHBondContact O-N 3.39Å; E2105-K2109 IonicContact OE2-NZ 2.77Å; E2105-K2109 PolarHBondContact OE2-NZ 3.42Å; A2106-K2109 PolarHBondContact O-N 2.98Å; K2109-K2111 VanDerWaalsContact C-N 3.32Å; K2109-K2111 PolarHBondContact O-N 2.88Å
2110	S	44.4	Very low	42.8	Very low	83 Å²	83	133.5 Å²	133.5	58%	0.58	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	15.4	179.3	79.6	0	0	0	0	115	A2106	A2106-S2110 WeakPolarHBondContact O-CB 3.3Å; A2106-S2110 PolarHBondContact O-N 2.67Å; A2106-S2110 PolarHBondContact O-OG 3.29Å
2111	K	38	Very low	41.4	Very low	171 Å²	171	133 Å²	133	74%	0.743	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	28	-178.8	-80.8	-163.8	171	-166.8	0	114.4	K2109	K2109-K2111 VanDerWaalsContact C-N 3.32Å; K2109-K2111 PolarHBondContact O-N 2.88Å
2112	Q	36.4	Very low	39.6	Very low	161 Å²	161	136.6 Å²	136.6	75%	0.752	70%	0.704	S	S	*	*	S	Bend	trans	-120.3	128.1	164.7	-66.2	-176.3	-10.3	0	0	108.3
2113	N	29.6	Very low	38	Very low	151 Å²	151	137.2 Å²	137.2	81%	0.807	72%	0.72	S	S	*	*	S	Bend	trans	69.2	105.6	-163.6	-37.9	-33	0	0	0	110.8
2114	D	33.5	Very low	36.3	Very low	165 Å²	165	140.1 Å²	140.1	88%	0.882	74%	0.735	S	S	*	*			cis	-144	163.8	43.8	-73.2	-35.9	0	0	0	112.9
2115	S	27.8	Very low	35.1	Very low	101 Å²	101	140.2 Å²	140.2	71%	0.706	75%	0.745	S	S	*	*			trans	-93.5	173.3	173.7	60.2	0	0	0	0	112.6
2116	D	29	Very low	33.8	Very low	141 Å²	141	141.5 Å²	141.5	75%	0.754	76%	0.764	S	S	*	*			trans	74.4	61.1	166	-49.4	-13.5	0	0	0	116.8
2117	Y	26.3	Very low	32.3	Very low	232 Å²	232	142.5 Å²	142.5	91%	0.91	78%	0.78	S	S	*	*			trans	-148.9	49.7	143.2	-105.4	-65	0	0	0	112.9	D2119	Y2117-D2119 VanDerWaalsContact C-N 3.34Å; Y2117-D2119 PolarHBondContact O-N 3.42Å; Y2117-D2119 VanDerWaalsContact O-N 3.12Å
2118	E	27.5	Very low	31.2	Very low	196 Å²	196	147.1 Å²	147.1	92%	0.916	80%	0.799	S	S	*	*			trans	-73.6	89.4	156.5	-83.3	-155.4	160	0	0	109.4
2119	D	28.7	Very low	29.9	Very low	153 Å²	153	149.3 Å²	149.3	82%	0.818	81%	0.807	S	S	*	*			trans	-163	57.2	156.6	-124.1	-15	0	0	0	113.2	Y2117	Y2117-D2119 VanDerWaalsContact C-N 3.34Å; Y2117-D2119 PolarHBondContact O-N 3.42Å; Y2117-D2119 VanDerWaalsContact O-N 3.12Å
2120	L	27.5	Very low	29.1	Very low	166 Å²	166	149.8 Å²	149.8	87%	0.869	82%	0.816	S	S	*	*	S	Bend	trans	-155.4	20.9	165.4	-117	173.8	0	0	0	115.5
2121	L	25.2	Very low	28.2	Very low	172 Å²	172	154 Å²	154	90%	0.901	83%	0.83	S	S	*	*			trans	-137.5	77	175.9	-79.8	178.8	0	0	0	112.6
2122	N	28.9	Very low	27.6	Very low	146 Å²	146	152.6 Å²	152.6	78%	0.781	83%	0.83	S	S	*	*			trans	-157.9	99.6	151.3	-127.3	-33	0	0	0	114.7
2123	C	25.6	Very low	26.9	Very low	129 Å²	129	151.3 Å²	151.3	87%	0.872	83%	0.828	S	S	*	*			trans	-142.6	50.6	164.2	-90.2	0	0	0	0	110.2	S2125	C2123-S2125 PolarHBondContact O-N 3.32Å
2124	N	24.1	Very low	26.7	Very low	160 Å²	160	153.2 Å²	153.2	86%	0.856	83%	0.829	S	S	*	*			trans	-85.4	82.8	179.8	-92.9	-19.2	0	0	0	112.7
2125	S	27.5	Very low	26.4	Very low	108 Å²	108	155.6 Å²	155.6	76%	0.755	83%	0.832	S	S	*	*			trans	-170.6	139.3	157.7	58.2	0	0	0	0	110	C2123	C2123-S2125 PolarHBondContact O-N 3.32Å
2126	S	25.7	Very low	26.2	Very low	124 Å²	124	156.4 Å²	156.4	87%	0.867	83%	0.833	S	S	*	*			cis	-162.4	144.9	-10	47	0	0	0	0	108.4
2127	G	26.9	Very low	26.1	Very low	76 Å²	76	159.9 Å²	159.9	78%	0.784	84%	0.842	S	S	*	*			trans	151	97.9	177.5	0	0	0	0	0	113.5	D2129	G2127-D2129 PolarHBondContact O-N 3.1Å
2128	E	25.2	Very low	26.1	Very low	198 Å²	198	152.3 Å²	152.3	93%	0.925	83%	0.834	S	S	*	*			trans	-78.7	94.4	172.3	-62.8	170.2	122.3	0	0	109.7
2129	D	25.1	Very low	25.8	Very low	156 Å²	156	147.7 Å²	147.7	83%	0.834	82%	0.824	S	S	*	*			trans	-170.7	56.3	161.1	-112.2	-19.1	0	0	0	114	G2127	G2127-D2129 PolarHBondContact O-N 3.1Å
2130	L	27.5	Very low	25.5	Very low	156 Å²	156	149 Å²	149	82%	0.817	82%	0.824	S	S	*	*	S	Bend	trans	-151.6	26.2	166.3	-144	73.3	0	0	0	116.6
2131	I	26.9	Very low	25.3	Very low	172 Å²	172	148.3 Å²	148.3	88%	0.882	82%	0.822	S	S	*	*	S	Bend	trans	-116.4	38.1	165.7	-43.3	-175.5	0	0	0	110.3
2132	L	24.4	Very low	25.3	Very low	141 Å²	141	148.3 Å²	148.3	74%	0.738	82%	0.815	S	S	*	*	S	Bend	trans	-158	155.8	159.7	-134.8	65.9	0	0	0	107.9
2133	N	22.7	Very low	25	Very low	134 Å²	134	147 Å²	147	72%	0.717	81%	0.807	S	S	*	*	S	Bend	trans	64.7	51.7	174.8	-62.3	-46.9	0	0	0	118.8
2134	K	24.7	Very low	24.9	Very low	191 Å²	191	147.4 Å²	147.4	83%	0.83	80%	0.8	S	S	*	*	S	Bend	trans	-160	59.6	142.6	-121.6	177.2	-172.7	-177.4	0	116.7
2135	F	26.8	Very low	24.9	Very low	215 Å²	215	151.6 Å²	151.6	94%	0.943	80%	0.804	S	S	*	*	S	Bend	trans	-160.7	33.3	144.8	-104.9	-62.5	0	0	0	113.7
2136	T	24	Very low	24.6	Very low	119 Å²	119	151.1 Å²	151.1	73%	0.73	80%	0.801	S	S	*	*			trans	-130.7	61.9	177.4	52.1	0	0	0	0	110.9
2137	K	27.1	Very low	24.5	Very low	214 Å²	214	153.2 Å²	153.2	93%	0.93	80%	0.802	S	S	*	*			trans	-169.2	109.4	168.7	-112	178.1	-178.3	179.9	0	109.1
2138	G	25.6	Very low	24.2	Very low	73 Å²	73	154.1 Å²	154.1	75%	0.753	80%	0.796	S	S	*	*			cis	176.7	116.7	-10	0	0	0	0	0	112.6
2139	S	22.4	Very low	24.1	Very low	99 Å²	99	152.8 Å²	152.8	69%	0.692	79%	0.787	S	S	*	*	S	Bend	trans	-105.6	70.6	171.8	-60.9	0	0	0	0	110
2140	Q	21.5	Very low	24.1	Very low	179 Å²	179	156.7 Å²	156.7	84%	0.836	79%	0.792	S	S	*	*			trans	-159.2	77	165.1	-123.9	-179.4	34.6	0	0	110.8
2141	D	23.9	Very low	23.8	Very low	152 Å²	152	157.8 Å²	157.8	81%	0.813	79%	0.785	S	S	*	*			trans	-151.3	143	154.4	-133.7	-25.6	0	0	0	111.9
2142	F	25.2	Very low	23.6	Very low	173 Å²	173	156.5 Å²	156.5	76%	0.759	78%	0.78	S	S	*	*			trans	47.9	96.9	169.1	-102.2	-94.8	0	0	0	121.5	L2144	F2142-L2144 WeakPolarHBondContact CE1-O 3.29Å
2143	L	21.5	Very low	23.5	Very low	117 Å²	117	159.4 Å²	159.4	61%	0.613	78%	0.782	S	S	*	*			trans	-82.7	156.4	137.7	-130.5	171.7	0	0	0	109.1	V1286	V1286-L2143 HydrophobicContact CB-CD1 4.23Å; V1286-L2143 HydrophobicContact CG1-CD1 3.7Å; V1286-L2143 HydrophobicContact CG2-CD1 4.48Å
2144	L	23.6	Very low	23.5	Very low	138 Å²	138	161.5 Å²	161.5	72%	0.723	79%	0.792	S	S	*	*			trans	71	95	174.3	-54.8	173.2	0	0	0	118.1	F2142	F2142-L2144 WeakPolarHBondContact CE1-O 3.29Å
2145	R	24.4	Very low	23.5	Very low	249 Å²	249	157 Å²	157	94%	0.94	78%	0.776	S	S	*	*				-155.8	152.3	113.3	-118.9	-179.4	-176.7	-161.3	0.1	115.6
2146	S	22	Very low	23.3	Very low	98 Å²	98	158 Å²	158	69%	0.685	77%	0.774	S	S	*	*			trans	-77.5	171.3	-165.9	-33.2	0	0	0	0	116.1
2147	N	22.8	Very low	23.2	Very low	168 Å²	168	155.7 Å²	155.7	90%	0.898	77%	0.773	S	S	*	*			trans	90.2	149.1	152	-63.5	-20.7	0	0	0	119.7
2148	S	21.8	Very low	23	Very low	95 Å²	95	150.3 Å²	150.3	66%	0.664	76%	0.762	S	S	*	*			trans	-105.3	161.9	-167.7	74.4	0	0	0	0	113.7
2149	K	22.2	Very low	23	Very low	170 Å²	170	155 Å²	155	74%	0.739	77%	0.765	S	S	*	*			trans	71.9	90	158.1	-63.3	162.5	-178.1	162.2	0	118.4
2150	Y	24.9	Very low	23	Very low	237 Å²	237	156.9 Å²	156.9	93%	0.929	76%	0.762	S	S	*	*				-115.3	122.9	105.2	-78.5	-98.6	0	0	0	105.4
2151	R	21.6	Very low	23.1	Very low	179 Å²	179	154.2 Å²	154.2	68%	0.675	75%	0.753	S	S	*	*			cis	59.4	79.6	27.8	-153.3	170.6	-162.6	164.6	8.2	114.9
2152	N	21.8	Very low	23.1	Very low	145 Å²	145	155 Å²	155	78%	0.775	75%	0.745	S	S	*	*			trans	33.6	120.3	141.3	-73.3	-40.8	0	0	0	118.7
2153	R	22.5	Very low	22.9	Very low	203 Å²	203	151 Å²	151	77%	0.766	73%	0.731	S	S	*	*				-177.7	114.5	115.9	-98.4	174.8	-164.2	-171.6	6.3	114.4	L2155	R2153-L2155 HydrophobicContact CB-CD1 4.48Å; R2153-L2155 HydrophobicContact CG-CD1 3.79Å; R2153-L2155 HydrophobicContact CG-CG 4.48Å
2154	L	24.2	Very low	22.8	Very low	177 Å²	177	152.2 Å²	152.2	93%	0.927	74%	0.737	S	S	*	*			trans	-172.4	93.9	149.7	-104.4	157	0	0	0	104.2
2155	L	22.9	Very low	22.7	Very low	97 Å²	97	152.2 Å²	152.2	51%	0.508	74%	0.738	S	S	.	*			cis	76.5	102.8	26	-106.6	-172	0	0	0	115.6	R2153	R2153-L2155 HydrophobicContact CB-CD1 4.48Å; R2153-L2155 HydrophobicContact CG-CD1 3.79Å; R2153-L2155 HydrophobicContact CG-CG 4.48Å
2156	R	22.9	Very low	22.6	Very low	237 Å²	237	151.6 Å²	151.6	89%	0.894	74%	0.735	S	S	*	*			trans	72.6	144	167.1	-49.2	-176.7	178.2	-171.3	-1.6	115.4
2157	G	22.3	Very low	22.5	Very low	70 Å²	70	150.4 Å²	150.4	72%	0.722	73%	0.732	S	S	*	*			cis	166.7	175.7	-5.8	0	0	0	0	0	110.5
2158	S	23.4	Very low	22.5	Very low	100 Å²	100	151.4 Å²	151.4	70%	0.699	73%	0.728	S	S	*	*			cis	155.6	97.7	-12.9	50	0	0	0	0	108.2
2159	H	24.4	Very low	22.6	Very low	173 Å²	173	151.7 Å²	151.7	80%	0.801	73%	0.73	S	S	*	*			trans	-165.9	150.8	171.9	-87.1	-12.4	0	0	0	108.3
2160	Q	23.7	Very low	22.6	Very low	138 Å²	138	149.1 Å²	149.1	65%	0.645	73%	0.725	S	S	*	*			cis	-162	157.4	-3.6	-118.4	175.1	39.8	0	0	112.5
2161	L	24.3	Very low	22.6	Very low	122 Å²	122	144.6 Å²	144.6	64%	0.639	72%	0.717	S	S	*	*			trans	68.7	112.3	149.2	-65.2	166.3	0	0	0	123.7
2162	R	22	Very low	22.8	Very low	168 Å²	168	143 Å²	143	63%	0.634	72%	0.721	S	S	*	*				48.3	142	113.7	-67.9	-175	-178.4	161.7	-3.1	120.1
2163	L	21.4	Very low	22.8	Very low	91 Å²	91	142 Å²	142	48%	0.476	72%	0.716	S	S	.	*			cis	-167.6	158.4	16.9	-120.4	167	0	0	0	113.8	K2197	L2163-K2197 HydrophobicContact CD1-CG 3.95Å
2164	L	20.6	Very low	23.2	Very low	141 Å²	141	137.6 Å²	137.6	74%	0.738	71%	0.713	S	S	*	*			trans	-19.3	148.7	165.7	-84.2	157.7	0	0	0	123.3
2165	N	21.5	Very low	23.2	Very low	138 Å²	138	138 Å²	138	74%	0.738	70%	0.704	S	S	*	*				107.9	142	125.7	-110.7	-17.5	0	0	0	122
2166	R	21.3	Very low	23.2	Very low	236 Å²	236	143 Å²	143	89%	0.891	72%	0.722	S	S	*	*			trans	66.7	153.9	168.7	-73.8	-168.9	171.5	165.5	-1.6	116.8
2167	A	21	Very low	23.3	Very low	74 Å²	74	136.6 Å²	136.6	61%	0.612	71%	0.711	S	S	*	*			cis	-167.7	158.5	-18	0	0	0	0	0	111
2168	F	21.7	Very low	23.3	Very low	188 Å²	188	141.6 Å²	141.6	83%	0.825	72%	0.721	S	S	*	*			trans	11.5	126.9	146.5	-66	-95.4	0	0	0	119.5
2169	S	23.4	Very low	23.4	Very low	101 Å²	101	147.7 Å²	147.7	71%	0.706	73%	0.729	S	S	*	*				-159.6	133.3	92	-98.7	0	0	0	0	111.7
2170	D	22.9	Very low	23.2	Very low	116 Å²	116	147.9 Å²	147.9	62%	0.62	74%	0.735	S	S	*	*				42	137.8	113.5	-33.7	-43.6	0	0	0	117.9
2171	D	24.3	Very low	23.2	Very low	143 Å²	143	146.3 Å²	146.3	77%	0.765	74%	0.739	S	S	*	*			cis	-155.8	172.8	39.3	-132.6	-31.9	0	0	0	115.3
2172	N	25.7	Very low	23.1	Very low	144 Å²	144	146.4 Å²	146.4	77%	0.77	74%	0.741	S	S	*	*			trans	76.1	70.2	164.4	-60.6	-47.7	0	0	0	120.9
2173	L	22.9	Very low	23.3	Very low	126 Å²	126	147.5 Å²	147.5	66%	0.66	75%	0.752	S	S	*	*				-59.9	-169.4	128.1	-98.2	160.6	0	0	0	110.5	Y2175	L2173-Y2175 HydrophobicContact CD1-CE2 4.04Å; L2173-Y2175 HydrophobicContact CD2-CD2 4.39Å; L2173-Y2175 HydrophobicContact CD2-CE2 4.26Å
2174	P	30.2	Very low	23.4	Very low	110 Å²	110	150.7 Å²	150.7	71%	0.714	77%	0.769	S	S	*	*			cis	-148.9	148.4	22	35.5	-10.1	0	0	0	121.5
2175	Y	24.3	Very low	23.5	Very low	184 Å²	184	148.6 Å²	148.6	72%	0.722	77%	0.766	S	S	*	*			trans	51.5	123	130.6	-69.8	-65.7	0	0	0	125.5	L2173	L2173-Y2175 HydrophobicContact CD1-CE2 4.04Å; L2173-Y2175 HydrophobicContact CD2-CD2 4.39Å; L2173-Y2175 HydrophobicContact CD2-CE2 4.26Å
2176	F	23.1	Very low	23.8	Very low	202 Å²	202	147.7 Å²	147.7	89%	0.886	77%	0.766	S	S	*	*				-56.8	131.6	123.2	-98.6	-93.6	0	0	0	111.3
2177	P	25.7	Very low	24	Very low	104 Å²	104	141.7 Å²	141.7	68%	0.675	76%	0.755	S	S	*	*			trans	-107.9	109.5	170.3	34.8	-25.8	0	0	0	112.8
2178	N	22.5	Very low	24.1	Very low	174 Å²	174	144.8 Å²	144.8	93%	0.93	76%	0.76	S	S	*	*			trans	-88.8	123.1	150.1	-100.9	-25.1	0	0	0	107.9
2179	R	24.6	Very low	24.2	Very low	228 Å²	228	144.4 Å²	144.4	86%	0.86	76%	0.758	S	S	*	*			trans	-142.8	127.5	172.4	-84.1	-167.7	177.3	-170.1	1.4	111.6
2180	L	21.2	Very low	24.2	Very low	178 Å²	178	147 Å²	147	93%	0.932	76%	0.764	S	S	*	*			trans	-131.6	144.7	139	-75.6	173.2	0	0	0	106.1
2181	S	22.8	Very low	24.3	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	77%	0.774	S	S	*	*			cis	-140.4	164.1	2.7	55.8	0	0	0	0	111.3
2182	D	22.5	Very low	24.3	Very low	124 Å²	124	147.9 Å²	147.9	66%	0.663	78%	0.781	S	S	*	*			trans	-64.3	146.1	166.2	-63.9	-73.3	0	0	0	111.7
2183	H	26.5	Very low	24.1	Very low	191 Å²	191	146.2 Å²	146.2	88%	0.884	78%	0.781	S	S	*	*				-159.2	138.9	100	-98.6	-70.6	0	0	0	111.9
2184	L	22.8	Very low	24	Very low	158 Å²	158	144.8 Å²	144.8	83%	0.827	78%	0.782	S	S	*	*			trans	-74.1	156.3	-179.4	-68.2	153.8	0	0	0	110.7
2185	S	23	Very low	23.7	Very low	97 Å²	97	149.4 Å²	149.4	68%	0.678	79%	0.786	S	S	*	*			cis	-148	-152.2	16.2	50.5	0	0	0	0	109.7
2186	T	26.8	Very low	23.7	Very low	119 Å²	119	149.7 Å²	149.7	73%	0.73	79%	0.788	S	S	*	*			cis	-157.7	-177.1	16.3	-17.7	0	0	0	0	113.2
2187	T	26.2	Very low	23.6	Very low	109 Å²	109	147.4 Å²	147.4	67%	0.669	78%	0.777	S	S	*	*			trans	-36.3	132.2	169.1	43.2	0	0	0	0	117.5
2188	I	22.9	Very low	23.4	Very low	140 Å²	140	145.6 Å²	145.6	72%	0.718	77%	0.767	S	S	*	*				73.4	122.9	65.4	-64.9	165.8	0	0	0	111.1
2189	K	25	Very low	23.3	Very low	179 Å²	179	140.9 Å²	140.9	78%	0.778	75%	0.748	S	S	*	*				-168.8	144.3	63.1	-142.5	152	-164.9	172.7	0	115.4
2190	N	22.9	Very low	23.2	Very low	155 Å²	155	136.2 Å²	136.2	83%	0.829	74%	0.739	S	S	*	*			trans	37.1	133.4	148.2	-57.6	12.4	0	0	0	124.2
2191	G	25.3	Very low	23.4	Very low	80 Å²	80	133.9 Å²	133.9	83%	0.825	73%	0.727	S	S	*	*			trans	-171.1	152.7	160.8	0	0	0	0	0	112
2192	Q	23	Very low	23.4	Very low	198 Å²	198	134.6 Å²	134.6	93%	0.925	72%	0.723	S	S	*	*			trans	-114.9	137.8	-165.6	-78	-176.4	-30.1	0	0	117
2193	S	21.5	Very low	23.3	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	72%	0.72	S	S	*	*			trans	63.8	125.9	136.1	-153.5	0	0	0	0	123.9
2194	S	21.5	Very low	23.1	Very low	96 Å²	96	131.3 Å²	131.3	67%	0.671	71%	0.705	S	S	*	*			trans	100.1	144	137.2	78	0	0	0	0	122.8
2195	Y	22.9	Very low	23	Very low	206 Å²	206	132.1 Å²	132.1	81%	0.808	70%	0.702	S	S	*	*			trans	92	135	152.9	-78.9	-63.3	0	0	0	124.8
2196	Y	24.3	Very low	23.1	Very low	191 Å²	191	134.9 Å²	134.9	75%	0.749	71%	0.705	S	S	*	*			trans	71.3	116.4	155.6	-87.9	-88.9	0	0	0	124.9
2197	K	21.2	Very low	22.8	Very low	153 Å²	153	136 Å²	136	67%	0.665	71%	0.706	S	S	*	*				-11.1	158.3	127.5	-71.9	170.8	177.6	171	0	117.1	L2163	L2163-K2197 HydrophobicContact CD1-CG 3.95Å
2198	S	21.5	Very low	22.7	Very low	67 Å²	67	134.8 Å²	134.8	47%	0.469	70%	0.702	S	S	.	*			cis	175.8	163.6	-11	59.8	0	0	0	0	111.5
2199	S	21.7	Very low	22.6	Very low	75 Å²	75	134 Å²	134	52%	0.524	69%	0.693	S	S	.	*			trans	70.4	172.3	160.4	-36.5	0	0	0	0	114.3
2200	I	21.8	Very low	22.5	Very low	129 Å²	129	129.6 Å²	129.6	66%	0.662	68%	0.676	S	S	*	*			cis	-155.9	169.4	7.2	-151.3	155.5	0	0	0	111
2201	D	25.4	Very low	22.7	Very low	129 Å²	129	133.4 Å²	133.4	69%	0.69	68%	0.68	S	S	*	*			trans	60.5	-177.5	162.3	-75.9	-31.5	0	0	0	119.8
2202	N	21.9	Very low	22.6	Very low	120 Å²	120	133.8 Å²	133.8	64%	0.642	67%	0.67	S	S	*	*				-172.3	148.6	-66.9	-119.4	-48.9	0	0	0	108.9
2203	K	21.3	Very low	22.6	Very low	138 Å²	138	129.8 Å²	129.8	60%	0.6	66%	0.659	S	S	*	*			trans	60.7	129.1	153.3	-70.7	-175.7	178.7	-179.6	0	122.1
2204	N	21.5	Very low	22.7	Very low	108 Å²	108	132.5 Å²	132.5	58%	0.578	66%	0.657	S	S	*	*				80	128.7	128.5	-70.8	28.2	0	0	0	122.3
2205	F	21.4	Very low	22.9	Very low	175 Å²	175	135.5 Å²	135.5	77%	0.768	67%	0.666	S	S	*	*			trans	70.3	149.7	154.2	-72.2	-137.2	0	0	0	113.6
2206	E	24.6	Very low	23	Very low	156 Å²	156	135.1 Å²	135.1	73%	0.729	67%	0.668	S	S	*	*			cis	-150.5	171.9	19.9	-144.2	156.7	-131	0	0	113.3
2207	N	21.6	Very low	23.4	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	66%	0.664	S	S	*	*			trans	-15.7	161	153.8	-66.4	-31.7	0	0	0	119.7
2208	S	22.7	Very low	23.4	Very low	84 Å²	84	130.2 Å²	130.2	59%	0.587	67%	0.668	S	S	*	*			cis	176.7	168.2	-10.4	57.5	0	0	0	0	111.3
2209	K	22.7	Very low	23.5	Very low	123 Å²	123	133.6 Å²	133.6	54%	0.535	68%	0.681	S	S	.	*			trans	72.3	124.9	152.5	-72.9	166.7	175.2	170.7	0	117.1	N2292	K2209-N2292 WeakPolarHBondContact CE-OD1 3.24Å; K2209-N2292 PolarHBondContact NZ-OD1 3.34Å
2210	E	21.4	Very low	23.5	Very low	87 Å²	87	134.6 Å²	134.6	41%	0.407	69%	0.687	S	S	.	*				75.7	124.7	62.9	-75.1	-179.2	146.9	0	0	114.2	S2290 N2291	E2210-S2290 PolarHBondContact OE1-N 2.62Å; E2210-S2290 PolarHBondContact OE1-OG 2.63Å; E2210-N2291 VanDerWaalsContact CD-ND2 3.33Å; E2210-N2291 PolarHBondContact OE1-ND2 2.85Å; E2210-N2291 WeakPolarHBondContact OE2-CB 3.4Å; E2210-N2291 PolarHBondContact OE2-ND2 2.95Å
2211	Y	28.4	Very low	23.5	Very low	235 Å²	235	135.4 Å²	135.4	92%	0.922	69%	0.692	S	S	*	*				-167.3	150.8	129.6	-104	-67.2	0	0	0	111.3
2212	S	21.8	Very low	23.4	Very low	88 Å²	88	136.6 Å²	136.6	62%	0.615	70%	0.697	S	S	*	*			trans	-87.5	-171.5	171.5	63	0	0	0	0	110.9
2213	T	23.3	Very low	23.4	Very low	113 Å²	113	138 Å²	138	69%	0.693	70%	0.704	S	S	*	*			cis	-160.5	173.6	15.5	-14.5	0	0	0	0	109.2
2214	K	23.1	Very low	23.8	Very low	167 Å²	167	136.2 Å²	136.2	73%	0.726	71%	0.706	S	S	*	*			trans	16.1	130.1	153.1	-62.9	-175.7	177.7	-169.4	0	118.8
2215	D	26.5	Very low	23.9	Very low	160 Å²	160	140.5 Å²	140.5	86%	0.856	72%	0.723	S	S	*	*				-160.2	178.3	69.6	-93.7	-39.8	0	0	0	115.1
2216	K	24.3	Very low	23.9	Very low	198 Å²	198	136.4 Å²	136.4	86%	0.861	72%	0.722	S	S	*	*			trans	-116.4	175.2	175.2	-104.2	-175.7	179.8	177.2	0	110
2217	P	33.6	Very low	23.7	Very low	101 Å²	101	140.2 Å²	140.2	66%	0.656	73%	0.729	S	S	*	*			cis	-135.6	-166.1	12.5	42.9	-24.2	0	0	0	116.3
2218	D	21	Very low	23.7	Very low	139 Å²	139	138.8 Å²	138.8	74%	0.743	73%	0.73	S	S	*	*			trans	89.9	138	150.3	-73	-3.6	0	0	0	124.5
2219	N	22.8	Very low	23.8	Very low	139 Å²	139	140.8 Å²	140.8	74%	0.743	74%	0.739	S	S	*	*			trans	69.6	89.5	157.5	-70.2	-47	0	0	0	122.2
2220	S	21.4	Very low	23.8	Very low	95 Å²	95	139.9 Å²	139.9	66%	0.664	75%	0.748	S	S	*	*				95.2	158	108.9	82.4	0	0	0	0	121.8
2221	I	22.8	Very low	24.1	Very low	146 Å²	146	141 Å²	141	75%	0.749	76%	0.763	S	S	*	*			trans	85.3	117.8	151.9	-72.3	167.4	0	0	0	120.4
2222	L	24.2	Very low	23.8	Very low	155 Å²	155	139.1 Å²	139.1	81%	0.812	76%	0.76	S	S	*	*			trans	70.3	110	149.7	-74.6	171	0	0	0	124.1
2223	L	20.2	Very low	23.8	Very low	149 Å²	149	141.4 Å²	141.4	78%	0.78	77%	0.77	S	S	*	*				-21.8	166.9	126.9	-65.8	160.2	0	0	0	117
2224	P	31.6	Very low	23.7	Very low	100 Å²	100	140.4 Å²	140.4	65%	0.649	77%	0.767	S	S	*	*			cis	-142.5	173.7	-42.9	40.6	-24.7	0	0	0	113.1
2225	Q	22.4	Very low	23.7	Very low	199 Å²	199	140.3 Å²	140.3	93%	0.93	77%	0.774	S	S	*	*			trans	-179.5	169.1	130	-102	173	43.4	0	0	111.7
2226	A	20.8	Very low	23.8	Very low	89 Å²	89	137.6 Å²	137.6	74%	0.736	77%	0.768	S	S	*	*			trans	-127	149.1	-172.8	0	0	0	0	0	112.4
2227	R	21.6	Very low	23.8	Very low	235 Å²	235	136.5 Å²	136.5	89%	0.887	76%	0.763	S	S	*	*				168.8	143.5	128.6	-96.7	170.6	175.2	-169.6	-1.7	113.3
2228	S	21.9	Very low	23.5	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	76%	0.763	S	S	*	*			trans	63.4	167.7	156.3	65.2	0	0	0	0	115.4
2229	V	23.7	Very low	23.7	Very low	126 Å²	126	134.6 Å²	134.6	76%	0.764	75%	0.747	S	S	*	*			cis	-140	148.5	19.1	177.2	0	0	0	0	110.9
2230	S	22.6	Very low	23.8	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	74%	0.736	S	S	*	*			trans	-124.1	157.7	142.4	87.4	0	0	0	0	107.6
2231	P	28.3	Very low	24.1	Very low	111 Å²	111	134.8 Å²	134.8	72%	0.721	74%	0.737	S	S	*	*			cis	-133	-164.5	16.8	42.6	-25	0	0	0	114.9
2232	F	21.6	Very low	24.2	Very low	194 Å²	194	135.5 Å²	135.5	85%	0.851	74%	0.735	S	S	*	*			trans	-36.8	144.6	169.6	-77.4	-103.9	0	0	0	116.7
2233	V	22.1	Very low	24.1	Very low	136 Å²	136	134.5 Å²	134.5	82%	0.824	74%	0.736	S	S	*	*				-152.6	148.5	98.9	144	0	0	0	0	110.4
2234	S	22.2	Very low	24.3	Very low	92 Å²	92	130.7 Å²	130.7	64%	0.643	73%	0.732	S	S	*	*			trans	-71.7	158.5	-173.4	57.2	0	0	0	0	115.7
2235	L	22.2	Very low	24.1	Very low	165 Å²	165	131.6 Å²	131.6	86%	0.864	73%	0.731	S	S	*	*			trans	-138.9	111.1	147.9	-116.6	173.1	0	0	0	111.8
2236	S	28.5	Very low	24.2	Very low	104 Å²	104	128.4 Å²	128.4	73%	0.727	72%	0.721	S	S	*	*			trans	-118	131.4	176.2	54.8	0	0	0	0	111.6
2237	K	24.6	Very low	24.3	Very low	175 Å²	175	129 Å²	129	76%	0.761	72%	0.718	S	S	*	*			trans	-162.3	155.8	172.6	-73.1	-163.9	179.9	170.1	0	107.2
2238	N	26	Very low	24.3	Very low	122 Å²	122	124.6 Å²	124.6	65%	0.652	71%	0.712	S	S	*	*			cis	-170.3	170.4	-7	-98.5	6.5	0	0	0	104.8
2239	N	26	Very low	24.3	Very low	78 Å²	78	129 Å²	129	42%	0.417	71%	0.712	S	S	.	*			cis	-173.1	156.9	-20.8	-93.7	-5.3	0	0	0	105.3
2240	H	26.2	Very low	24.2	Very low	108 Å²	108	128.7 Å²	128.7	50%	0.5	71%	0.711	S	S	.	*			cis	-160.8	169.5	5.3	-109.1	-15.4	0	0	0	107.6	F2242	H2240-F2242 AromaticContact CD2-CE2 3.77Å; H2240-F2242 AromaticContact CE1-CE2 3.99Å; H2240-F2242 AromaticContact NE2-CE2 3.55Å
2241	N	27	Very low	24.2	Very low	130 Å²	130	131.2 Å²	131.2	70%	0.695	72%	0.716	S	S	*	*				-169.8	118.6	90.8	-79.2	-36.2	0	0	0	113.6
2242	F	24.3	Very low	24	Very low	161 Å²	161	133.2 Å²	133.2	71%	0.706	71%	0.714	S	S	*	*				1.3	149.1	129.1	-75.9	-76.5	0	0	0	119.8	H2240	H2240-F2242 AromaticContact CD2-CE2 3.77Å; H2240-F2242 AromaticContact CE1-CE2 3.99Å; H2240-F2242 AromaticContact NE2-CE2 3.55Å
2243	T	22.8	Very low	24	Very low	134 Å²	134	128.2 Å²	128.2	82%	0.822	70%	0.695	S	S	*	*			cis	-144.3	167.2	20.7	52.1	0	0	0	0	112
2244	G	24.9	Very low	24	Very low	69 Å²	69	128.9 Å²	128.9	71%	0.711	69%	0.693	S	S	*	*			trans	-165.4	-41.1	177.2	0	0	0	0	0	120.6
2245	N	26.3	Very low	24	Very low	118 Å²	118	129.7 Å²	129.7	63%	0.631	70%	0.699	S	S	*	*			trans	66.5	103.7	178	-65.6	8.5	0	0	0	120.1
2246	N	24.7	Very low	24.1	Very low	133 Å²	133	126 Å²	126	71%	0.711	69%	0.687	S	S	*	*				49	118.7	122	-70.4	22.5	0	0	0	122.6
2247	C	23.7	Very low	23.8	Very low	100 Å²	100	127.1 Å²	127.1	68%	0.676	68%	0.68	S	S	*	*				91.5	128.1	115.5	-72.4	0	0	0	0	123.6
2248	L	21.7	Very low	23.7	Very low	143 Å²	143	122.9 Å²	122.9	75%	0.749	67%	0.666	S	S	*	*			trans	89.4	109	139.7	-64.2	160.5	0	0	0	122
2249	Y	21.6	Very low	23.5	Very low	204 Å²	204	127 Å²	127	80%	0.8	67%	0.672	S	S	*	*				89.7	143.7	129.8	-91	-56	0	0	0	125.4
2250	T	21.1	Very low	23.3	Very low	121 Å²	121	131.8 Å²	131.8	74%	0.742	69%	0.69	S	S	*	*			trans	73.1	127	155.1	45.7	0	0	0	0	121.8
2251	N	23.2	Very low	23.2	Very low	157 Å²	157	135.4 Å²	135.4	84%	0.84	71%	0.705	S	S	*	*			trans	-86.4	156.1	163.3	-66.5	-32.5	0	0	0	110.6
2252	K	23.4	Very low	23.1	Very low	153 Å²	153	137 Å²	137	67%	0.665	71%	0.713	S	S	*	*			trans	-164.2	115.7	131.2	-115.4	163.1	-176.4	152.4	0	114.3	D488	D488-K2252 WeakPolarHBondContact OD1-CE 3.04Å; D488-K2252 IonicContact OD1-NZ 2.71Å; D488-K2252 PolarHBondContact OD1-NZ 3.18Å
2253	L	22.2	Very low	23.1	Very low	89 Å²	89	133 Å²	133	47%	0.466	71%	0.709	S	S	.	*			trans	49.2	123.9	136.6	-62.1	175.9	0	0	0	123.3
2254	I	22	Very low	23.2	Very low	151 Å²	151	131.4 Å²	131.4	77%	0.774	70%	0.704	S	S	*	*			trans	91.9	147.5	131.3	-67.8	169.7	0	0	0	120
2255	S	21.7	Very low	23.2	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	70%	0.704	S	S	*	*			trans	-73.3	179.1	-170.4	53	0	0	0	0	115.5
2256	S	23.6	Very low	23.1	Very low	88 Å²	88	138.7 Å²	138.7	62%	0.615	71%	0.713	S	S	*	*			cis	-135.4	-167.9	11.2	53.6	0	0	0	0	110.8
2257	E	23.1	Very low	23	Very low	126 Å²	126	138.2 Å²	138.2	59%	0.589	72%	0.715	S	S	*	*			cis	-152.3	-152.7	16.1	-149.3	138	-82.6	0	0	112.9
2258	D	22.3	Very low	23.1	Very low	86 Å²	86	137.6 Å²	137.6	46%	0.46	71%	0.712	S	S	.	*			trans	-85.2	151	-153.7	-100.1	-66.8	0	0	0	119.5	S1440	S1440-D2258 VanDerWaalsContact CB-O 3.27Å; S1440-D2258 WeakPolarHBondContact CB-O 3.34Å; S1440-D2258 PolarHBondContact OG-N 3.36Å; S1440-D2258 VanDerWaalsContact OG-N 3.09Å; S1440-D2258 PolarHBondContact OG-O 3.08Å
2259	R	22.4	Very low	23.1	Very low	209 Å²	209	137.9 Å²	137.9	79%	0.789	71%	0.711	S	S	*	*			trans	7.3	141.6	151.4	-58.4	164.7	-144	-147.8	-0.1	120.5
2260	F	22.1	Very low	23.2	Very low	179 Å²	179	133.7 Å²	133.7	79%	0.785	70%	0.702	S	S	*	*				-148.8	124.1	123.7	-125.6	-92.8	0	0	0	112.2
2261	F	23	Very low	23.3	Very low	184 Å²	184	132.7 Å²	132.7	81%	0.807	70%	0.7	S	S	*	*			trans	61	144	162.1	-89.4	-119.3	0	0	0	122.3
2262	N	25.5	Very low	23.2	Very low	163 Å²	163	132.6 Å²	132.6	87%	0.872	69%	0.692	S	S	*	*			trans	-144.7	125.4	170.1	-165.1	19.2	0	0	0	108.5
2263	A	24.2	Very low	23.1	Very low	76 Å²	76	132.6 Å²	132.6	63%	0.628	70%	0.695	S	S	*	*			trans	-156.9	108.9	177.6	0	0	0	0	0	106.7
2264	S	24.1	Very low	23.1	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	70%	0.702	S	S	*	*				70.4	138.3	93.9	80.7	0	0	0	0	113.6
2265	N	24.9	Very low	23.1	Very low	135 Å²	135	131.7 Å²	131.7	72%	0.722	70%	0.701	S	S	*	*			cis	-173.1	-165.8	-20.3	-127.7	-10.9	0	0	0	105.9
2266	Y	24.4	Very low	23.2	Very low	206 Å²	206	132.4 Å²	132.4	81%	0.808	70%	0.696	S	S	*	*			trans	70.5	153.2	168	-55.9	-81.3	0	0	0	115.4
2267	T	24.1	Very low	23.3	Very low	123 Å²	123	131.4 Å²	131.4	76%	0.755	69%	0.686	S	S	*	*			cis	-110.3	134.9	4.1	22.8	0	0	0	0	110.9
2268	S	24	Very low	23.3	Very low	87 Å²	87	129.1 Å²	129.1	61%	0.608	68%	0.683	S	S	*	*				74.5	144.6	76.4	98.3	0	0	0	0	113
2269	M	22.9	Very low	23.3	Very low	149 Å²	149	131.7 Å²	131.7	73%	0.734	70%	0.697	S	S	*	*			cis	-165.6	163.1	6.1	-136.5	170.1	174.8	0	0	111.2
2270	N	22.8	Very low	23.4	Very low	115 Å²	115	129.1 Å²	129.1	62%	0.615	69%	0.694	S	S	*	*			trans	67.1	150.7	146.1	-71.6	-6.5	0	0	0	119.7
2271	S	23	Very low	23.4	Very low	101 Å²	101	127 Å²	127	71%	0.706	69%	0.691	S	S	*	*			cis	-173.3	164.8	-8.8	45.3	0	0	0	0	109.9
2272	F	22	Very low	23.5	Very low	154 Å²	154	125.4 Å²	125.4	68%	0.675	69%	0.689	S	S	*	*			cis	-163.9	168.2	-14.7	-119.9	-138.4	0	0	0	106.6
2273	E	20.9	Very low	23.4	Very low	153 Å²	153	124.3 Å²	124.3	72%	0.715	68%	0.683	S	S	*	*			trans	28.5	161.3	139.8	-61.9	-176.9	166.2	0	0	123.9
2274	T	22.5	Very low	23.3	Very low	102 Å²	102	125 Å²	125	63%	0.626	68%	0.683	S	S	*	*			cis	-171.5	173	-17.5	39.9	0	0	0	0	109.1
2275	T	22.4	Very low	23.3	Very low	120 Å²	120	125.6 Å²	125.6	74%	0.736	68%	0.682	S	S	*	*			trans	69.8	158.3	162	70.7	0	0	0	0	117.7
2276	N	23.8	Very low	23.2	Very low	124 Å²	124	125.6 Å²	125.6	66%	0.663	68%	0.682	S	S	*	*			cis	-151.5	176.6	-5.2	-115.5	-18.2	0	0	0	109.9	H2364	N2276-H2364 PolarHBondContact ND2-CE1 2.92Å
2277	T	24.1	Very low	23.3	Very low	66 Å²	66	122.7 Å²	122.7	41%	0.405	68%	0.681	S	S	.	*			trans	-107.7	139.5	176.3	51.8	0	0	0	0	113.8	N2363 H2364	T2277-N2363 WeakPolarHBondContact OG1-CB 3.48Å; T2277-N2363 PolarHBondContact OG1-ND2 3.27Å; T2277-H2364 PolarHBondContact O-CD2 3.15Å; T2277-H2364 PolarHBondContact O-NE2 2.71Å
2278	C	23.6	Very low	23.4	Very low	78 Å²	78	122.5 Å²	122.5	53%	0.527	68%	0.676	S	S	.	*			trans	154.9	140.7	133.3	-84.6	0	0	0	0	113.3
2279	D	22.4	Very low	23.5	Very low	141 Å²	141	124.4 Å²	124.4	75%	0.754	68%	0.679	S	S	*	*			trans	16.7	133.9	161.7	-50.1	-30.1	0	0	0	120.6
2280	H	24.7	Very low	23.7	Very low	155 Å²	155	121.1 Å²	121.1	72%	0.718	67%	0.67	S	S	*	*			cis	-149.4	153.2	35.8	-101.3	-57.7	0	0	0	113.2
2281	N	22	Very low	23.9	Very low	135 Å²	135	119.4 Å²	119.4	72%	0.722	66%	0.661	S	S	*	*			trans	47.2	129.6	142.7	-47	-10.3	0	0	0	118.5
2282	I	25.8	Very low	24	Very low	149 Å²	149	119.7 Å²	119.7	76%	0.764	66%	0.655	S	S	*	*			cis	-150.9	141.4	38	-70.4	175	0	0	0	111.5
2283	D	22.7	Very low	24.2	Very low	140 Å²	140	116.5 Å²	116.5	75%	0.749	65%	0.652	S	S	*	*			trans	23.2	116.4	154.4	-55.2	-33.8	0	0	0	123.4
2284	S	23.5	Very low	24.3	Very low	92 Å²	92	116.6 Å²	116.6	64%	0.643	66%	0.657	S	S	*	*				84.9	119.5	121	77	0	0	0	0	122.9
2285	T	23.1	Very low	24.6	Very low	112 Å²	112	117.6 Å²	117.6	69%	0.687	66%	0.659	S	S	*	*			trans	67.8	119.6	140.1	57.3	0	0	0	0	122.3
2286	N	23.5	Very low	24.8	Very low	135 Å²	135	119 Å²	119	72%	0.722	66%	0.657	S	S	*	*			trans	65	117.9	144.7	-57.5	-10.4	0	0	0	118.2
2287	N	24.9	Very low	24.9	Very low	145 Å²	145	118.8 Å²	118.8	78%	0.775	66%	0.66	S	S	*	*				63.5	127	71.4	-65.9	16.4	0	0	0	112.7
2288	N	26.3	Very low	24.9	Very low	120 Å²	120	120.9 Å²	120.9	64%	0.642	68%	0.676	S	S	*	*			cis	-154.3	178.2	-6.2	-95.3	54.4	0	0	0	105.3
2289	D	27	Very low	25.1	Very low	126 Å²	126	124.4 Å²	124.4	67%	0.674	69%	0.69	S	S	*	*			cis	-164.3	174.6	-1.6	-119	-40.3	0	0	0	106.7
2290	S	27.9	Very low	25.5	Very low	80 Å²	80	126.9 Å²	126.9	56%	0.559	69%	0.694	S	S	*	*			cis	-125.7	-105.1	-13.2	48.4	0	0	0	0	112.3	E2210	E2210-S2290 PolarHBondContact OE1-N 2.62Å; E2210-S2290 PolarHBondContact OE1-OG 2.63Å
2291	N	26.5	Very low	26.2	Very low	80 Å²	80	124.3 Å²	124.3	43%	0.428	69%	0.691	S	S	.	*			cis	-166.3	142.2	-5.1	-161	-16.4	0	0	0	111.7	E2210	E2210-N2291 VanDerWaalsContact CD-ND2 3.33Å; E2210-N2291 PolarHBondContact OE1-ND2 2.85Å; E2210-N2291 WeakPolarHBondContact OE2-CB 3.4Å; E2210-N2291 PolarHBondContact OE2-ND2 2.95Å
2292	N	25	Very low	26.2	Very low	106 Å²	106	124.8 Å²	124.8	57%	0.567	69%	0.694	S	S	*	*				162	108.7	126.5	-86.6	-56.8	0	0	0	115.6	K2209	K2209-N2292 WeakPolarHBondContact CE-OD1 3.24Å; K2209-N2292 PolarHBondContact NZ-OD1 3.34Å
2293	S	25.3	Very low	26.1	Very low	88 Å²	88	121 Å²	121	62%	0.615	69%	0.691	S	S	*	*			trans	59.5	131.3	130.4	70.6	0	0	0	0	124
2294	N	24	Very low	26.1	Very low	154 Å²	154	119.4 Å²	119.4	82%	0.824	69%	0.691	S	S	*	*			trans	76.4	145.8	152.3	-53.6	-9.6	0	0	0	117
2295	D	28.3	Very low	26.1	Very low	124 Å²	124	122.5 Å²	122.5	66%	0.663	70%	0.699	S	S	*	*			cis	-139.7	168.5	5.6	-156.4	4.2	0	0	0	113.1
2296	Q	27.2	Very low	25.9	Very low	150 Å²	150	123.5 Å²	123.5	70%	0.701	70%	0.699	S	S	*	*			trans	48.3	94.3	160.5	-78.3	169.4	60.5	0	0	120.1
2297	T	25.5	Very low	25.7	Very low	119 Å²	119	126 Å²	126	73%	0.73	70%	0.704	S	S	*	*			trans	63.8	110.4	134.7	52.6	0	0	0	0	120.5
2298	C	24.8	Very low	25.5	Very low	109 Å²	109	123.1 Å²	123.1	74%	0.736	70%	0.695	S	S	*	*			trans	71.9	61	134.8	-59.9	0	0	0	0	115.1
2299	N	27.6	Very low	25.3	Very low	152 Å²	152	121.2 Å²	121.2	81%	0.813	69%	0.691	S	S	*	*				88.9	94.3	77.6	-70.4	8.6	0	0	0	113.6
2300	K	31.1	Very low	25	Very low	194 Å²	194	120 Å²	120	84%	0.843	69%	0.685	S	S	*	*				-61.6	175.9	124.4	-47.9	175.9	175	177.7	0	109
2301	P	37.8	Very low	24.8	Very low	100 Å²	100	123.9 Å²	123.9	65%	0.649	70%	0.698	S	S	*	*			cis	-133.2	-148.2	-5.2	32.1	-7.5	0	0	0	110.9
2302	N	23.2	Very low	24.5	Very low	146 Å²	146	128.3 Å²	128.3	78%	0.781	71%	0.708	S	S	*	*			trans	65.8	92.9	151.4	-63.3	0.4	0	0	0	119.6
2303	G	22.8	Very low	24.3	Very low	69 Å²	69	129.6 Å²	129.6	71%	0.711	72%	0.719	S	S	*	*				-129.7	144	129.7	0	0	0	0	0	107.2
2304	S	23.5	Very low	24.1	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	73%	0.732	S	S	*	*			cis	50.5	98	5.9	73.1	0	0	0	0	116.2
2305	L	22.3	Very low	24	Very low	157 Å²	157	132.9 Å²	132.9	82%	0.822	74%	0.735	S	S	*	*	S	Bend	trans	68.1	140.1	164.9	-88.1	166.1	0	0	0	117.9
2306	I	19.8	Very low	23.7	Very low	134 Å²	134	132 Å²	132	69%	0.687	74%	0.738	S	S	*	*			trans	73.4	139.2	161.6	-54.8	149.1	0	0	0	113.3
2307	F	19.5	Very low	23.5	Very low	187 Å²	187	130.9 Å²	130.9	82%	0.82	74%	0.744	S	S	*	*			cis	-122.2	155	13.8	-104.7	-61.7	0	0	0	115.5
2308	S	19.9	Very low	23.2	Very low	84 Å²	84	133.6 Å²	133.6	59%	0.587	75%	0.746	S	S	*	*			trans	-29.7	176	162.6	61.8	0	0	0	0	122.7
2309	S	21.6	Very low	23.2	Very low	80 Å²	80	135.4 Å²	135.4	56%	0.559	74%	0.741	S	S	*	*				100.6	98.5	129.1	51.4	0	0	0	0	120.5
2310	N	21.6	Very low	23	Very low	102 Å²	102	133.5 Å²	133.5	55%	0.545	73%	0.726	S	S	.	*				68.9	102.6	119.1	-54.9	-10.8	0	0	0	119.3	N491	N491-N2310 WeakPolarHBondContact OD1-CB 3.33Å; N491-N2310 PolarHBondContact OD1-ND2 3.41Å
2311	I	23.2	Very low	22.5	Very low	161 Å²	161	129.4 Å²	129.4	83%	0.826	71%	0.71	S	S	*	*				-122.3	123.3	120.5	-63.4	-176.9	0	0	0	107.9	V2313	I2311-V2313 HydrophobicContact CG2-CG2 3.97Å
2312	R	20.4	Very low	21.7	Very low	173 Å²	173	129.3 Å²	129.3	65%	0.653	71%	0.708	S	S	*	*			trans	-93.2	131	162	-89.1	177.7	157.2	-165.7	-13.9	107.5	S492	S492-R2312 PolarHBondContact OG-NH1 3.17Å
2313	V	21.8	Very low	21.7	Very low	132 Å²	132	128.5 Å²	128.5	80%	0.8	71%	0.707	S	S	*	*			trans	-113	139.6	162	-179.1	0	0	0	0	109.1	I2311	I2311-V2313 HydrophobicContact CG2-CG2 3.97Å
2314	L	20.7	Very low	21.5	Very low	167 Å²	167	129.5 Å²	129.5	87%	0.874	70%	0.7	S	S	*	*			trans	-75.3	131.7	-169.6	-62.9	145.8	0	0	0	112.1
2315	T	22.1	Very low	21.7	Very low	144 Å²	144	128 Å²	128	88%	0.883	68%	0.683	S	S	*	*			trans	-148.5	152.6	149.8	26	0	0	0	0	109.6
2316	S	20.8	Very low	21.7	Very low	106 Å²	106	123.6 Å²	123.6	74%	0.741	66%	0.658	S	S	*	*			trans	-89.5	136.1	-162.6	55.3	0	0	0	0	115.1	K2318	S2316-K2318 PolarHBondContact O-N 3.13Å
2317	P	22.8	Very low	21.8	Very low	126 Å²	126	121.8 Å²	121.8	82%	0.818	64%	0.643	S	S	*	*			trans	-83.2	113.2	167.4	32.6	-30.9	0	0	0	111.2
2318	K	20.7	Very low	22	Very low	176 Å²	176	118.8 Å²	118.8	77%	0.765	64%	0.639	S	S	*	*			trans	-150.7	106.1	159.6	-78.9	-172	179.7	173.8	0	109	S2316	S2316-K2318 PolarHBondContact O-N 3.13Å
2319	F	24.9	Very low	22	Very low	148 Å²	148	117.9 Å²	117.9	65%	0.649	63%	0.626	S	S	*	*			trans	-160.4	140.7	139.2	-115	-69.9	0	0	0	111.6	E1607	E1607-F2319 VanDerWaalsContact CD-CZ 3.43Å; E1607-F2319 HydrophobicContact CG-CE1 4.28Å; E1607-F2319 HydrophobicContact CG-CE2 4.25Å; E1607-F2319 HydrophobicContact CG-CZ 3.6Å; E1607-F2319 WeakPolarHBondContact OE1-CE1 3.48Å; E1607-F2319 WeakPolarHBondContact OE1-CZ 3.47Å
2320	K	23.5	Very low	22.1	Very low	111 Å²	111	119.2 Å²	119.2	48%	0.483	64%	0.635	S	S	.	*			trans	-97.5	155.3	-178	-77.5	-178.8	142	-150.8	0	111.7	Y383	Y383-K2320 PolarHBondContact O-NZ 2.9Å
2321	Q	20.5	Very low	22	Very low	109 Å²	109	118.5 Å²	118.5	51%	0.509	63%	0.631	S	S	.	*			trans	-69.4	127	166.7	-79	166.5	-72.8	0	0	112.1	R504	R504-Q2321 VanDerWaalsContact CZ-OE1 3.29Å
2322	T	20.8	Very low	22	Very low	98 Å²	98	119.1 Å²	119.1	60%	0.601	63%	0.63	S	S	*	*			trans	-158.5	167.9	144	-29.8	0	0	0	0	108	P379	P379-T2322 HydrophobicContact CB-CG2 4.09Å; P379-T2322 HydrophobicContact CG-CG2 3.85Å
2323	V	22.1	Very low	22.2	Very low	128 Å²	128	118 Å²	118	78%	0.776	64%	0.636	S	S	*	*			trans	73.8	109.4	-177.9	-171	0	0	0	0	111.7
2324	T	19.5	Very low	22.3	Very low	91 Å²	91	117.2 Å²	117.2	56%	0.558	64%	0.635	S	S	*	*			cis	78	98.5	34.7	-43.5	0	0	0	0	112.5	N1086	N1086-T2324 WeakPolarHBondContact OD1-CG2 3.36Å
2325	I	27.8	Very low	22.2	Very low	74 Å²	74	115.3 Å²	115.3	38%	0.379	62%	0.619	S	S	.	*			trans	-88.8	135	-163.9	-63.1	171.6	0	0	0	112.7	S620 F624 N1086	S620-I2325 WeakPolarHBondContact OG-CD1 3.47Å; F624-I2325 HydrophobicContact CD2-CD1 4.32Å; F624-I2325 HydrophobicContact CE1-CD1 4.48Å; F624-I2325 HydrophobicContact CE2-CD1 3.48Å; F624-I2325 VanDerWaalsContact CE2-CD1 3.48Å; F624-I2325 HydrophobicContact CZ-CD1 3.58Å; N1086-I2325 PolarHBondContact ND2-O 3.09Å
2326	Q	21.5	Very low	22.6	Very low	64 Å²	64	114 Å²	114	30%	0.299	61%	0.614	S	S	.	*			trans	-160.7	138	141.8	-114.8	170.5	-24.6	0	0	113.6	N1086	N1086-Q2326 WeakPolarHBondContact ND2-CB 3.44Å; N1086-Q2326 PolarHBondContact ND2-OE1 3.49Å
2327	R	22.5	Very low	22.7	Very low	97 Å²	97	116.5 Å²	116.5	37%	0.366	62%	0.619	S	S	.	*			trans	60.8	170.6	159.4	-78.2	-175.1	179.5	121.9	4	116.6	E616	E616-R2327 HydrophobicContact CG-CG 4.1Å; E616-R2327 IonicContact OE1-CZ 2.88Å; E616-R2327 IonicContact OE1-NE 3.78Å; E616-R2327 IonicContact OE1-NH2 3.69Å; E616-R2327 PolarHBondContact OE1-NH2 3.09Å
2328	V	22.6	Very low	22.8	Very low	124 Å²	124	119.1 Å²	119.1	75%	0.752	62%	0.622	S	S	*	*			cis	-100.7	174.7	0.7	177.6	0	0	0	0	112.1
2329	Q	21	Very low	22.9	Very low	64 Å²	64	117 Å²	117	30%	0.299	62%	0.619	S	S	.	*			trans	-120.6	141.9	-173.6	-56.8	146.7	-110.7	0	0	112.8	P615 E616 I619	P615-Q2329 HydrophobicContact CB-CG 4.16Å; E616-Q2329 VanDerWaalsContact CD-OE1 3.27Å; E616-Q2329 HydrophobicContact CG-CG 4Å; E616-Q2329 PolarHBondContact OE1-OE1 3.24Å; I619-Q2329 HydrophobicContact CD1-CB 3.95Å; I619-Q2329 HydrophobicContact CD1-CG 3.75Å
2330	S	23.3	Very low	22.7	Very low	108 Å²	108	115.9 Å²	115.9	76%	0.755	62%	0.624	S	S	*	*			trans	-168.2	112.9	147.4	52.1	0	0	0	0	105.6
2331	D	20.4	Very low	22.7	Very low	88 Å²	88	116.8 Å²	116.8	47%	0.471	64%	0.638	S	S	.	*			cis	65.5	137.1	41.7	-68.7	-44.9	0	0	0	114.2	P615	P615-D2331 WeakPolarHBondContact CB-OD2 3.43Å; P615-D2331 VanDerWaalsContact CG-OD2 3.28Å; P615-D2331 WeakPolarHBondContact CG-OD2 3.38Å
2332	H	23.2	Very low	22.8	Very low	174 Å²	174	115.2 Å²	115.2	81%	0.806	64%	0.64	S	S	*	*			trans	71.4	137.4	-167.1	-49.1	-72.6	0	0	0	114.3
2333	I	24.6	Very low	22.9	Very low	150 Å²	150	118.2 Å²	118.2	77%	0.769	65%	0.65	S	S	*	*			cis	-160.3	152.9	1.1	-123.7	162.3	0	0	0	106.7
2334	C	22.4	Very low	22.9	Very low	115 Å²	115	115.7 Å²	115.7	78%	0.777	64%	0.643	S	S	*	*			cis	-163.4	-179.2	-22	-119.7	0	0	0	0	109.5
2335	K	19.6	Very low	23.2	Very low	127 Å²	127	118.3 Å²	118.3	55%	0.552	65%	0.654	S	S	*	*			trans	-69.2	152	164	-92.8	-178.7	171.6	178.7	0	111	D601 D603	D601-K2335 IonicContact OD1-NZ 2.72Å; D601-K2335 PolarHBondContact OD1-NZ 3.29Å; D603-K2335 IonicContact OD2-NZ 2.71Å; D603-K2335 PolarHBondContact OD2-NZ 2.89Å
2336	P	30.3	Very low	23.1	Very low	117 Å²	117	119.7 Å²	119.7	76%	0.76	67%	0.67	S	S	*	*			trans	-85.2	162	170.5	36.5	-35.5	0	0	0	112.4
2337	N	22	Very low	23.3	Very low	158 Å²	158	123.2 Å²	123.2	85%	0.845	69%	0.689	S	S	*	*			trans	-168.8	122.2	157	-120.3	17	0	0	0	111.2
2338	M	24.6	Very low	23.5	Very low	181 Å²	181	125.2 Å²	125.2	89%	0.892	71%	0.707	S	S	*	*			trans	-174.8	151.7	135.5	-109.1	-60.9	178.3	0	0	111.5
2339	D	23.4	Very low	23.6	Very low	131 Å²	131	123.1 Å²	123.1	70%	0.701	70%	0.698	S	S	*	*			trans	-91.1	157.3	-161.4	-63.9	-82	0	0	0	115.9
2340	V	20.9	Very low	23.8	Very low	124 Å²	124	127 Å²	127	75%	0.752	72%	0.72	S	S	*	*			trans	-5.1	117.1	141.5	-173.6	0	0	0	0	116.7
2341	V	23.8	Very low	24	Very low	130 Å²	130	127.9 Å²	127.9	79%	0.788	72%	0.716	S	S	*	*				-171.7	109.9	119.1	152.4	0	0	0	0	104.8
2342	S	21.6	Very low	24.4	Very low	77 Å²	77	129.2 Å²	129.2	54%	0.538	72%	0.723	S	S	.	*			cis	82.7	82.1	48.1	86.4	0	0	0	0	115.7
2343	I	22.8	Very low	24.6	Very low	160 Å²	160	127.4 Å²	127.4	82%	0.821	72%	0.719	S	S	*	*				80.3	136.9	121.4	-71.1	162.1	0	0	0	119.7
2344	A	23.7	Very low	24.7	Very low	75 Å²	75	125.2 Å²	125.2	62%	0.62	71%	0.709	S	S	*	*			trans	74.1	154.2	151.8	0	0	0	0	0	121.3
2345	D	24.5	Very low	24.9	Very low	147 Å²	147	127.2 Å²	127.2	79%	0.786	70%	0.704	S	S	*	*			cis	-167.8	151.9	-31.6	-99.3	-31.9	0	0	0	108.9
2346	S	26.8	Very low	25.1	Very low	103 Å²	103	128.8 Å²	128.8	72%	0.72	72%	0.718	S	S	*	*			trans	-160.8	110.4	152.9	-84.9	0	0	0	0	109.6
2347	I	25.5	Very low	25.1	Very low	138 Å²	138	129.2 Å²	129.2	71%	0.708	72%	0.721	S	S	*	*				75.8	123	82.8	-75	168.4	0	0	0	110.4
2348	N	26.3	Very low	25.1	Very low	139 Å²	139	125.5 Å²	125.5	74%	0.743	71%	0.712	S	S	*	*			cis	-169.2	173.8	0.9	-112.1	-9.6	0	0	0	108
2349	S	24.2	Very low	25	Very low	80 Å²	80	124.8 Å²	124.8	56%	0.559	71%	0.71	S	S	*	*			cis	-171.2	-177.8	-8.6	45.1	0	0	0	0	108
2350	I	26.8	Very low	25.5	Very low	146 Å²	146	123.5 Å²	123.5	75%	0.749	71%	0.709	S	S	*	*			trans	75	116.5	167.7	-55.1	167.5	0	0	0	112.1
2351	N	27.3	Very low	25.5	Very low	126 Å²	126	129 Å²	129	67%	0.674	72%	0.718	S	S	*	*			cis	-149.5	150.2	14.8	-124.6	-1.9	0	0	0	113.9
2352	N	27.9	Very low	25.5	Very low	115 Å²	115	128.7 Å²	128.7	62%	0.615	71%	0.712	S	S	*	*			trans	61.7	109.5	149.9	-59.5	-15.3	0	0	0	121.6
2353	N	27.1	Very low	25.6	Very low	136 Å²	136	129.3 Å²	129.3	73%	0.727	71%	0.709	S	S	*	*				75.3	142.6	122	-58.6	-0.1	0	0	0	121
2354	D	26.3	Very low	25.6	Very low	104 Å²	104	127 Å²	127	56%	0.556	70%	0.695	S	S	*	*			cis	-171.9	138.9	-27.6	-137.7	-18.7	0	0	0	111.1
2355	K	27.7	Very low	25.6	Very low	158 Å²	158	127.3 Å²	127.3	69%	0.687	69%	0.692	S	S	*	*			trans	59.9	153.6	156.3	-67.3	144.9	-169.3	153.2	0	118.9
2356	L	24.2	Very low	25.7	Very low	159 Å²	159	126.4 Å²	126.4	83%	0.832	70%	0.697	S	S	*	*			cis	75.2	151.9	29.4	-63.7	162.6	0	0	0	114.3
2357	P	29.6	Very low	25.8	Very low	126 Å²	126	127.5 Å²	127.5	82%	0.818	69%	0.694	S	S	*	*			cis	-131.6	-138	-12.6	41.2	-20.9	0	0	0	112.6
2358	A	23	Very low	26.3	Very low	81 Å²	81	127.6 Å²	127.6	67%	0.669	70%	0.696	S	S	*	*			trans	-93.9	173.6	-168.3	0	0	0	0	0	116.6
2359	I	21.1	Very low	26.3	Very low	165 Å²	165	125.6 Å²	125.6	85%	0.846	69%	0.693	S	S	*	*			trans	72.4	139.7	159.7	-70.9	170	0	0	0	115.1
2360	P	34.3	Very low	26.3	Very low	105 Å²	105	129.8 Å²	129.8	68%	0.682	70%	0.703	S	S	*	*			trans	-95.3	163.3	-154.5	37.6	-36.9	0	0	0	114.8
2361	Y	20.5	Very low	26.2	Very low	238 Å²	238	129.8 Å²	129.8	93%	0.933	71%	0.705	S	S	*	*				-145.4	164.6	124.1	-106.5	-75.8	0	0	0	109.7
2362	N	23.7	Very low	26.1	Very low	124 Å²	124	129 Å²	129	66%	0.663	70%	0.701	S	S	*	*			trans	-76.3	149.1	-160.1	-106	-25.1	0	0	0	115.8
2363	N	25.2	Very low	25.9	Very low	90 Å²	90	129.2 Å²	129.2	48%	0.481	70%	0.702	S	S	.	*			trans	27.6	111.4	147	-60.2	-10.9	0	0	0	119.1	T2277	T2277-N2363 WeakPolarHBondContact OG1-CB 3.48Å; T2277-N2363 PolarHBondContact OG1-ND2 3.27Å
2364	H	22.4	Very low	25.9	Very low	113 Å²	113	125.1 Å²	125.1	52%	0.523	68%	0.68	S	S	.	*				-155.5	138.4	114.2	-123.7	-83.9	0	0	0	112.7	N2276 T2277	N2276-H2364 PolarHBondContact ND2-CE1 2.92Å; T2277-H2364 PolarHBondContact O-CD2 3.15Å; T2277-H2364 PolarHBondContact O-NE2 2.71Å
2365	S	22.9	Very low	25.7	Very low	81 Å²	81	123.2 Å²	123.2	57%	0.566	67%	0.669	S	S	*	*			trans	43.1	84.5	156.1	54.7	0	0	0	0	119	I2367	S2365-I2367 PolarHBondContact O-N 3.29Å
2366	S	26.9	Very low	25.5	Very low	127 Å²	127	116.2 Å²	116.2	89%	0.888	64%	0.64	S	S	*	*			trans	-79.7	73.7	143.4	44.2	0	0	0	0	109.6
2367	I	29.6	Very low	25.5	Very low	127 Å²	127	112.9 Å²	112.9	65%	0.651	62%	0.622	S	S	*	*			trans	-64.9	143.9	158.8	-65	154	0	0	0	107	S2365	S2365-I2367 PolarHBondContact O-N 3.29Å
2368	D	34.8	Very low	25.2	Very low	140 Å²	140	111.5 Å²	111.5	75%	0.749	61%	0.607	S	S	*	*	S	Bend	trans	60.9	133.4	-175.4	-59.9	-47.1	0	0	0	115.6
2369	S	26.2	Very low	25.4	Very low	97 Å²	97	112 Å²	112	68%	0.678	60%	0.604	S	S	*	*			cis	-158.4	137.4	-34.1	24.5	0	0	0	0	107.4
2370	Q	25.5	Very low	25.6	Very low	167 Å²	167	110.5 Å²	110.5	78%	0.78	60%	0.602	S	S	*	*			trans	57.1	82.5	162.8	-65.6	176.7	-46.2	0	0	118.7
2371	N	24.5	Very low	25	Very low	147 Å²	147	110.8 Å²	110.8	79%	0.786	60%	0.602	S	S	*	*				-62.6	150.7	121.6	-77.6	-21	0	0	0	108.6
2372	N	24.3	Very low	25.3	Very low	108 Å²	108	104.3 Å²	104.3	58%	0.578	59%	0.588	S	S	*	*			cis	-134.7	150.4	25.1	-62.6	-90.8	0	0	0	112.1
2373	D	24.1	Very low	25.2	Very low	120 Å²	120	104.2 Å²	104.2	64%	0.642	59%	0.592	S	S	*	*			trans	-127.6	-171.4	174.1	-140.4	79.6	0	0	0	114.6	K1731	K1731-D2373 VanDerWaalsContact CG-O 3.3Å; K1731-D2373 WeakPolarHBondContact CG-O 3.38Å; K1731-D2373 IonicContact NZ-OD1 2.7Å; K1731-D2373 PolarHBondContact NZ-OD1 3Å; K1731-D2373 IonicContact NZ-OD2 2.66Å; K1731-D2373 PolarHBondContact NZ-OD2 3.25Å
2374	I	27.2	Very low	25.1	Very low	51 Å²	51	106.2 Å²	106.2	26%	0.262	60%	0.601	S	S	.	*			trans	-88.3	137.6	-146.8	-159.4	52.8	0	0	0	117.4	L1640 K1731 D2376	L1640-I2374 HydrophobicContact CD1-CD1 3.55Å; L1640-I2374 HydrophobicContact CD1-CG1 3.78Å; L1640-I2374 HydrophobicContact CD2-CD1 3.73Å; L1640-I2374 HydrophobicContact CD2-CG1 3.84Å; L1640-I2374 HydrophobicContact CG-CD1 4.21Å; L1640-I2374 HydrophobicContact CG-CG1 4.46Å; K1731-I2374 HydrophobicContact CD-CD1 4.18Å; K1731-I2374 VanDerWaalsContact CE-CA 3.5Å; K1731-I2374 VanDerWaalsContact CE-CB 3.41Å; K1731-I2374 HydrophobicContact CG-CD1 3.9Å; I2374-D2376 HydrophobicContact CG1-CB 4.38Å; I2374-D2376 WeakPolarHBondContact CG1-O 3.35Å; I2374-D2376 VanDerWaalsContact CG2-O 3.29Å; I2374-D2376 WeakPolarHBondContact CG2-O 3.49Å
2375	N	23	Very low	25.1	Very low	63 Å²	63	106.2 Å²	106.2	34%	0.337	61%	0.609	S	S	.	*	S	Bend	trans	-93.9	76.1	153.2	174.7	64.4	0	0	0	110.1	L1734 E1735	L1734-N2375 WeakPolarHBondContact CD2-ND2 3.42Å; L1734-N2375 WeakPolarHBondContact CD2-O 3.46Å; E1735-N2375 HydrophobicContact CG-CB 3.65Å
2376	D	22.1	Very low	25.2	Very low	12 Å²	12	109.1 Å²	109.1	6%	0.064	62%	0.617	C	S	.	*			trans	160.9	115.8	164.1	-99	-11.3	0	0	0	107.8	R1637 L1640 L1734 I2374	R1637-D2376 IonicContact CZ-OD1 2.79Å; R1637-D2376 IonicContact CZ-OD2 2.7Å; R1637-D2376 IonicContact NE-OD1 2.69Å; R1637-D2376 IonicContact NE-OD2 3.55Å; R1637-D2376 PolarHBondContact NE-OD2 2.83Å; R1637-D2376 IonicContact NH2-OD1 3.54Å; R1637-D2376 PolarHBondContact NH2-OD1 2.88Å; R1637-D2376 IonicContact NH2-OD2 2.71Å; R1637-D2376 PolarHBondContact NH2-OD2 2.9Å; L1640-D2376 HydrophobicContact CD2-CB 3.31Å; L1734-D2376 WeakPolarHBondContact CD1-OD2 3.43Å; L1734-D2376 HydrophobicContact CD2-CB 4.32Å; L1734-D2376 WeakPolarHBondContact CD2-OD2 3.12Å; I2374-D2376 HydrophobicContact CG1-CB 4.38Å; I2374-D2376 WeakPolarHBondContact CG1-O 3.35Å; I2374-D2376 VanDerWaalsContact CG2-O 3.29Å; I2374-D2376 WeakPolarHBondContact CG2-O 3.49Å
2377	N	24.3	Very low	24.9	Very low	88 Å²	88	110 Å²	110	47%	0.471	62%	0.617	S	S	.	*				-141.2	118.2	65.3	-136.4	-26.1	0	0	0	113.7	R1637 E1641	R1637-N2377 PolarHBondContact NH1-OD1 2.94Å; R1637-N2377 PolarHBondContact NH2-OD1 2.89Å; E1641-N2377 PolarHBondContact OE1-ND2 3.22Å
2378	I	24.5	Very low	24.6	Very low	97 Å²	97	108.3 Å²	108.3	50%	0.497	62%	0.616	S	S	.	*			trans	-56.4	133.3	150.3	-70.1	169.6	0	0	0	107.5
2379	P	26.5	Very low	24.1	Very low	93 Å²	93	106.3 Å²	106.3	60%	0.604	61%	0.614	S	S	*	*			cis	-136.9	132.1	37.4	22.2	2.2	0	0	0	117.7	T2381	P2379-T2381 WeakPolarHBondContact CB-OG1 3.34Å; P2379-T2381 PolarHBondContact O-N 3.12Å
2380	T	25.6	Very low	23.9	Very low	133 Å²	133	110.2 Å²	110.2	82%	0.816	62%	0.621	S	S	*	*				-77.1	87.7	128.7	32.4	0	0	0	0	110.6	T2382	T2380-T2382 PolarHBondContact O-OG1 3.21Å; T2380-T2382 VanDerWaalsContact O-OG1 3.13Å
2381	T	21.9	Very low	23.7	Very low	110 Å²	110	108.3 Å²	108.3	68%	0.675	62%	0.621	S	S	*	*			trans	-120	106.6	149.3	28.8	0	0	0	0	106.8	P2379 T2383	P2379-T2381 WeakPolarHBondContact CB-OG1 3.34Å; P2379-T2381 PolarHBondContact O-N 3.12Å; T2381-T2383 VanDerWaalsContact C-N 3.29Å
2382	T	25.5	Very low	23.6	Very low	103 Å²	103	107.4 Å²	107.4	63%	0.632	62%	0.62	S	S	*	*			cis	62.3	33.3	41.7	-28.4	0	0	0	0	112.5	T2380	T2380-T2382 PolarHBondContact O-OG1 3.21Å; T2380-T2382 VanDerWaalsContact O-OG1 3.13Å
2383	T	22.5	Very low	23.5	Very low	121 Å²	121	106.1 Å²	106.1	74%	0.742	63%	0.625	S	S	*	*			trans	-112.5	115.3	132.7	34.5	0	0	0	0	106.8	T2381	T2381-T2383 VanDerWaalsContact C-N 3.29Å
2384	I	22.3	Very low	23.5	Very low	132 Å²	132	111.3 Å²	111.3	68%	0.677	64%	0.636	S	S	*	*				53.2	87.4	60.2	-46.3	163.3	0	0	0	109.4
2385	T	23.7	Very low	23.3	Very low	114 Å²	114	114.8 Å²	114.8	70%	0.699	66%	0.655	S	S	*	*				-167.5	129.5	108.3	27.2	0	0	0	0	111.5
2386	I	25	Very low	23.4	Very low	142 Å²	142	119.3 Å²	119.3	73%	0.728	67%	0.674	S	S	*	*				36.1	99.9	122.7	-48.3	169	0	0	0	115.2
2387	T	20.8	Very low	23.4	Very low	144 Å²	144	123.7 Å²	123.7	88%	0.883	71%	0.705	S	S	*	*			trans	-97.7	108	132.1	46.3	0	0	0	0	108.3
2388	S	22.7	Very low	23.6	Very low	92 Å²	92	125.7 Å²	125.7	64%	0.643	72%	0.723	S	S	*	*			trans	-58.7	157.5	153	52.2	0	0	0	0	109.2
2389	S	23.7	Very low	23.4	Very low	99 Å²	99	126.1 Å²	126.1	69%	0.692	74%	0.735	S	S	*	*			cis	-152.3	170.4	19.5	-21	0	0	0	0	111.9
2390	E	22.2	Very low	23.4	Very low	179 Å²	179	127.7 Å²	127.7	84%	0.836	74%	0.743	S	S	*	*			trans	-17	140.3	142	-47.9	169.3	125.8	0	0	113.7
2391	V	22.4	Very low	23.2	Very low	127 Å²	127	128.4 Å²	128.4	77%	0.77	74%	0.741	S	S	*	*				-160.2	150.4	62.2	159	0	0	0	0	111
2392	T	22	Very low	23.3	Very low	127 Å²	127	130.3 Å²	130.3	78%	0.779	75%	0.746	S	S	*	*			trans	-22.7	140.8	172	64	0	0	0	0	119.2
2393	A	22.5	Very low	23.1	Very low	82 Å²	82	129.6 Å²	129.6	68%	0.678	75%	0.745	S	S	*	*				-176	122.4	112.3	0	0	0	0	0	114
2394	R	22.6	Very low	23.1	Very low	229 Å²	229	128.9 Å²	128.9	86%	0.864	75%	0.745	S	S	*	*			trans	65.3	157.6	158.5	-59.6	172.7	-175.1	154.1	2.6	114.8
2395	N	23.7	Very low	23.3	Very low	123 Å²	123	127.4 Å²	127.4	66%	0.658	74%	0.742	S	S	*	*			cis	-151.1	157.7	-19.4	-99	12.3	0	0	0	103.1
2396	E	24.5	Very low	23.3	Very low	158 Å²	158	129.8 Å²	129.8	74%	0.738	75%	0.745	S	S	*	*			cis	-158.8	173.5	18.2	-117.6	147.1	-127.4	0	0	108.8
2397	S	22.6	Very low	23.2	Very low	104 Å²	104	127 Å²	127	73%	0.727	74%	0.739	S	S	*	*			trans	-17.5	144.4	164.5	48.5	0	0	0	0	119.2
2398	P	27.9	Very low	23.3	Very low	130 Å²	130	128.2 Å²	128.2	84%	0.844	73%	0.732	S	S	*	*				-142.5	157.6	76.8	39.7	-24.4	0	0	0	118.6
2399	S	21.1	Very low	23.3	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	74%	0.737	S	S	*	*			trans	-129.9	176.5	154.2	60.5	0	0	0	0	107.7
2400	V	26.3	Very low	23.3	Very low	126 Å²	126	135.3 Å²	135.3	76%	0.764	74%	0.74	S	S	*	*			trans	78.7	109.4	-173.2	-172.7	0	0	0	0	111.2
2401	L	21.7	Very low	23.3	Very low	148 Å²	148	133.4 Å²	133.4	78%	0.775	74%	0.735	S	S	*	*			cis	78	142	33.9	-139.2	-173.4	0	0	0	112.7
2402	L	22.7	Very low	23.3	Very low	150 Å²	150	133.1 Å²	133.1	79%	0.785	73%	0.729	S	S	*	*			trans	79.3	142.7	-176.5	-53.8	170.6	0	0	0	115
2403	S	22.2	Very low	23.5	Very low	87 Å²	87	135.1 Å²	135.1	61%	0.608	73%	0.729	S	S	*	*			cis	-172.4	150.9	-13.7	47.7	0	0	0	0	113.1
2404	S	22.8	Very low	23.5	Very low	106 Å²	106	137 Å²	137	74%	0.741	73%	0.727	S	S	*	*			trans	66.9	167.2	148	73.7	0	0	0	0	117.4
2405	T	26.1	Very low	23.5	Very low	101 Å²	101	133.5 Å²	133.5	62%	0.62	72%	0.72	S	S	*	*			cis	-145.8	146.4	10.3	27.5	0	0	0	0	111
2406	E	24.4	Very low	23.5	Very low	165 Å²	165	135.8 Å²	135.8	77%	0.771	72%	0.724	S	S	*	*			trans	62.8	137.6	138.2	-63.3	166.8	-172.4	0	0	119.1
2407	S	21.9	Very low	23.4	Very low	84 Å²	84	133 Å²	133	59%	0.587	72%	0.718	S	S	*	*			cis	71.7	145.8	45.8	98.8	0	0	0	0	113.4
2408	F	22.7	Very low	23.6	Very low	168 Å²	168	134.4 Å²	134.4	74%	0.737	72%	0.718	S	S	*	*			cis	-150.3	174.5	17.5	-118.1	-60.5	0	0	0	112.6
2409	R	22.3	Very low	23.4	Very low	200 Å²	200	134 Å²	134	76%	0.755	71%	0.707	S	S	*	*			trans	-27.4	143.1	168.2	-63.4	153.4	179.3	166.7	-1.8	117.9
2410	N	25.2	Very low	23.4	Very low	140 Å²	140	135.9 Å²	135.9	75%	0.749	71%	0.705	S	S	*	*				173.5	122.4	118.8	-83.5	-19.7	0	0	0	108.7
2411	L	21	Very low	23.3	Very low	140 Å²	140	136 Å²	136	73%	0.733	70%	0.7	S	S	*	*				80.3	126.9	76.5	-92.5	168.1	0	0	0	114.8
2412	D	22	Very low	23.3	Very low	121 Å²	121	135.7 Å²	135.7	65%	0.647	69%	0.694	S	S	*	*			trans	59.4	131.1	165.3	-52.9	-41.6	0	0	0	118.4
2413	H	26.2	Very low	23.3	Very low	168 Å²	168	137.1 Å²	137.1	78%	0.778	69%	0.69	S	S	*	*			cis	-136.3	148.7	16.5	-77.3	-75.7	0	0	0	110.7
2414	L	22.4	Very low	23.2	Very low	123 Å²	123	140.9 Å²	140.9	64%	0.644	70%	0.698	S	S	*	*			cis	93.4	121.9	38.2	-160.5	83.1	0	0	0	113.5
2415	H	23.2	Very low	23.3	Very low	154 Å²	154	139.4 Å²	139.4	71%	0.713	70%	0.699	S	S	*	*			trans	71.2	151.6	172.1	-70.5	-43.8	0	0	0	117.6
2416	K	25.1	Very low	23.2	Very low	171 Å²	171	147.9 Å²	147.9	74%	0.743	73%	0.732	S	S	*	*			cis	-150.8	125.8	12.8	-136.4	166.3	179	-179.5	0	112.9
2417	T	22.4	Very low	23.1	Very low	99 Å²	99	147.1 Å²	147.1	61%	0.607	73%	0.73	S	S	*	*			trans	50.4	154.3	132.8	63.4	0	0	0	0	123.1
2418	N	26	Very low	23.2	Very low	135 Å²	135	150.4 Å²	150.4	72%	0.722	74%	0.737	S	S	*	*			trans	85.5	144.1	158.5	-59.6	-5.9	0	0	0	117.2
2419	L	23.9	Very low	23.2	Very low	120 Å²	120	149.4 Å²	149.4	63%	0.628	74%	0.737	S	S	*	*			cis	-160.2	156.7	-18.9	-107.1	170.1	0	0	0	107.9
2420	E	21.6	Very low	23.3	Very low	147 Å²	147	146.4 Å²	146.4	69%	0.687	74%	0.736	S	S	*	*			trans	61.1	130.6	140	-76.9	165.9	162.4	0	0	124.5
2421	I	23.7	Very low	23.1	Very low	130 Å²	130	146.8 Å²	146.8	67%	0.667	74%	0.735	S	S	*	*				101.5	107.4	122.5	-78.8	171.3	0	0	0	121.7
2422	H	21.8	Very low	23.3	Very low	141 Å²	141	147.3 Å²	147.3	65%	0.653	74%	0.736	S	S	*	*			trans	67.1	109.3	137	-69.2	-42	0	0	0	125.3
2423	Y	21.8	Very low	23.4	Very low	180 Å²	180	149.1 Å²	149.1	71%	0.706	74%	0.742	S	S	*	*				93.6	127.8	114.3	-84.6	-46.9	0	0	0	123.9
2424	H	21.3	Very low	23.2	Very low	166 Å²	166	147.7 Å²	147.7	77%	0.769	74%	0.739	S	S	*	*			trans	57.4	113.7	139.1	-79	-53.3	0	0	0	123
2425	G	24	Very low	23.2	Very low	74 Å²	74	149.8 Å²	149.8	76%	0.763	75%	0.747	S	S	*	*				81.3	151	121.8	0	0	0	0	0	118.6
2426	E	24	Very low	23.2	Very low	280 Å²	280	149.4 Å²	149.4	100%	1.308	75%	0.75	S	S	*	*			cis	-94.7	0	-3.9	-67.5	-172.8	115	0	0	113.2

Retrieved 2,426 of 2,426 residues in 2890.3 ms (Link to these results)

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