A0A077ZBF3_TRITR Loading...

7 transmembrane receptor

AlphaFold DB , UniProt , Accession A0A077ZBF3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,378 aa.

						>A0A077ZBF3_TRITR|A0A077ZBF3
MRRPLSAWIVVLVPLAHSWVQGIIGGSKLPQCSPFRTLTIDPTNAKHRIIAAFPLYEDDCLQVRADSVHTLFAVQWALGIWNRNPQNVNHRIGLSVVGVCFEEHEFVTQSFKLLHSAGYFEQRTCHEPENQTMQYLLLSEISPNYMTYKHFLKSLKLPALTFSTATAQMKSDASLNSLFSTAPTLEDYAEVVTALLIKMNSNWISVIYCKSSVMADALERFRKKLVDSNILVESMTVADIQVPASIGISGRSKIIIILSNRRDLVTLLTWNIGRLRNTLIIGIPTNDQTLSDEQRFQLMQINGQFSLLLLEPMKSKMDDFRDYFVEILRRNSRTYALLASYAHAKFNCTLVNAPGFVDCKNRGDSYLAEAVTTGATVEAAVLATYAVAAMVRMTSTDDKIFACNGQNETADCGEQLTQALKLVRYTFGPDDPMSLRGKEISFDNRLVLENIQIEGRLMGTDSKGRVIDKLVMNYDKSTKALSLNDPLLLPDGRPVRSVCPNGSHSCRTCSLVDMADNQRTWLLYPGDVYLVGMFDLRRWDETLKRCIPSTANDHLSLAATVVYVLETVKQKYSRLNLLPNVRLGALLVDSCGSPIEAADAMLQLRRRCLAFHSQNVTVSFDDVLAFVTGQEDVSYSSTKTFFTENGGFFQPLISVSCQGESCSSREISILPSSQLLSKALLSLLTQFNWSLLSVLVSSQHSASLEAFKMFETSASTQGICIGEVFFIDLPDEKGESQSNVEMTPSNPVVVVFASAADFNRFLKQVNRRKVRDDTVFLLTGQSHDFVRQNSFERSASTNDKFPEEMPDYVARQWTFLSMQPSAPGNDGLARFLSKARPKHLPQPWLVAFWEELLNCAISDDSVERFNKRCEEDSPMAMQTSSELVYERFLMAALEGWVILTDEIYKKVCHELRGLCDEFFQRYPRAMNAWLHLLKSHDRFTLYNIQVNKEGPAVEPVGQWSPEDSLVLHASAEGKIANMNVERLPNSHCQHPLCRCYDVQRNFRLEREKGRRAEIEILMPTQNSEVSSLTPRSGQWRNFGWNYFFLVVNSTLVLITLSVFGIILFKMACHVVKGNQSLGICLLCGVLMLYSTAFLFVFDPTDAICRLRHFGHSFSYSVCFGVLIAKATQLRNSETLGINGYISQWNYWLLLFFIVSVQMALNLQWAIFRNSVVLHFITGDHSDFIVPKCGWTDHEFLTSHSYVVLLLLVAWFISFVNRNVKRNYKETRWLLYTCSLLLPVWITWTAGYLLIPYPYKDALVVIELFSSATIVLALMFGPKLYLLLCYEPVLIEYPTGNVEDNDSSKELYDLEAYFDQTPASASGCSPAGSPLSACRPAFSVSSGDTASNLTDSNSSKYQAVILKKSKSKKVVAATTAAAR
					

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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	28.9	Very low	33	Very low	146 Å²	146	147.8 Å²	147.8	72%	0.719	75%	0.752	S	S	*	*				0	-158.6	0	-62	-174.9	-172.6	0	0	111.3	D731	M1-D731 PolarHBondContact N-OD2 3.49Å
2	R	32.2	Very low	33.1	Very low	159 Å²	159	147.1 Å²	147.1	60%	0.6	75%	0.75	S	S	*	*			trans	68.2	93	163.3	-54.6	-167.4	-173.6	179	0.1	120.5	E735	R2-E735 IonicContact CZ-OE2 2.78Å; R2-E735 IonicContact NE-OE2 3.47Å; R2-E735 IonicContact NH2-OE2 2.86Å; R2-E735 PolarHBondContact NH2-OE2 3.32Å
3	R	34.3	Very low	33.4	Very low	234 Å²	234	143.1 Å²	143.1	88%	0.883	74%	0.736	S	S	*	*			trans	11.9	159.1	131.9	-69.7	-176.6	-179.2	-177	1.6	121.3
4	P	37.9	Very low	33.4	Very low	112 Å²	112	139.4 Å²	139.4	73%	0.727	73%	0.726	S	S	*	*			cis	-135	151.6	13.1	30.2	-8.1	0	0	0	119
5	L	29.8	Very low	33.6	Very low	153 Å²	153	139.1 Å²	139.1	80%	0.801	73%	0.725	S	S	*	*			trans	22	152.5	135.3	-68.6	146.5	0	0	0	123.8
6	S	29.7	Very low	33.7	Very low	122 Å²	122	134.3 Å²	134.3	85%	0.853	71%	0.711	S	S	*	*			trans	75.1	105.5	161.6	71.5	0	0	0	0	119.2
7	A	31.9	Very low	33.8	Very low	69 Å²	69	134.8 Å²	134.8	57%	0.57	71%	0.709	S	S	*	*			trans	-158.8	-42.1	159.3	0	0	0	0	0	112.2	I9	A7-I9 VanDerWaalsContact C-N 3.26Å; A7-I9 PolarHBondContact O-N 3.34Å
8	W	30.3	Very low	33.9	Very low	251 Å²	251	132.7 Å²	132.7	95%	0.951	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	9.9	-163.6	-73.6	88.1	0	0	0	118.2
9	I	34.5	Very low	33.8	Very low	149 Å²	149	134.1 Å²	134.1	76%	0.764	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-18.3	-178.2	-67.5	174.5	0	0	0	112.7	A7	A7-I9 VanDerWaalsContact C-N 3.26Å; A7-I9 PolarHBondContact O-N 3.34Å
10	V	36.4	Very low	33.9	Very low	111 Å²	111	132.2 Å²	132.2	67%	0.673	70%	0.695	S	S	*	*	S	Bend	trans	-81	-26.8	-168.8	-177.2	0	0	0	0	113.6	L12	V10-L12 PolarHBondContact O-N 2.59Å
11	V	37.6	Very low	34	Very low	120 Å²	120	134.2 Å²	134.2	73%	0.727	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-24.2	-168.2	-177.2	0	0	0	0	114.1
12	L	34.5	Very low	34.3	Very low	139 Å²	139	130.8 Å²	130.8	73%	0.728	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-8.9	-173.9	-72.7	166.3	0	0	0	114.7	V10	V10-L12 PolarHBondContact O-N 2.59Å
13	V	36.4	Very low	34.6	Very low	95 Å²	95	129 Å²	129	58%	0.576	70%	0.704	S	S	*	*	S	Bend	trans	-75.3	-39.3	-177.1	-176	0	0	0	0	114.3	L15 A16	V13-L15 VanDerWaalsContact C-N 3.3Å; V13-L15 PolarHBondContact O-N 3.31Å; V13-A16 PolarHBondContact O-N 2.9Å
14	P	33.9	Very low	34.8	Very low	91 Å²	91	125.4 Å²	125.4	59%	0.591	70%	0.701	S	S	*	*	H	α-helix	trans	-60.3	-35.4	-173.8	-26.2	35.3	0	0	0	114.5	A16 H17	P14-A16 VanDerWaalsContact C-N 3.29Å; P14-A16 PolarHBondContact O-N 3.03Å; P14-H17 PolarHBondContact O-N 3.38Å
15	L	36.4	Very low	34.3	Very low	136 Å²	136	124.1 Å²	124.1	71%	0.712	71%	0.708	S	S	*	*	H	α-helix	trans	-69.4	-24.5	-178	-72.2	166.5	0	0	0	113.2	V13	V13-L15 VanDerWaalsContact C-N 3.3Å; V13-L15 PolarHBondContact O-N 3.31Å
16	A	34.8	Very low	34.4	Very low	61 Å²	61	120.5 Å²	120.5	50%	0.504	71%	0.708	S	S	.	*	H	α-helix	trans	-73.4	-32	177	0	0	0	0	0	112.4	V13 P14 W19 V20	V13-A16 PolarHBondContact O-N 2.9Å; P14-A16 VanDerWaalsContact C-N 3.29Å; P14-A16 PolarHBondContact O-N 3.03Å; A16-W19 PolarHBondContact O-N 3.27Å; A16-V20 WeakPolarHBondContact O-CG2 3.02Å
17	H	34.8	Very low	34.6	Very low	144 Å²	144	120.8 Å²	120.8	67%	0.667	71%	0.71	S	S	*	*	H	α-helix	trans	-72.7	-36.1	-171.5	-135.4	0.2	0	0	0	112.5	P14 W19 V20	P14-H17 PolarHBondContact O-N 3.38Å; H17-W19 PolarHBondContact O-N 2.79Å; H17-V20 PolarHBondContact O-N 3.21Å
18	S	35.8	Very low	34.5	Very low	96 Å²	96	127.1 Å²	127.1	67%	0.671	72%	0.724	S	S	*	*	H	α-helix	trans	-60.8	-29.2	175.7	173.8	0	0	0	0	113.5
19	W	32.5	Very low	34.5	Very low	159 Å²	159	123.1 Å²	123.1	60%	0.602	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-10.2	-178.6	-92	70.9	0	0	0	114.9	A16 H17 V1215	A16-W19 PolarHBondContact O-N 3.27Å; H17-W19 PolarHBondContact O-N 2.79Å; W19-V1215 HydrophobicContact CH2-CG1 4.35Å; W19-V1215 HydrophobicContact CH2-CG2 4.16Å; W19-V1215 HydrophobicContact CZ3-CG2 4.13Å
20	V	34.8	Very low	34.4	Very low	97 Å²	97	121.1 Å²	121.1	59%	0.588	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-28.2	-175	172	0	0	0	0	112.9	A16 H17 G22	A16-V20 WeakPolarHBondContact O-CG2 3.02Å; H17-V20 PolarHBondContact O-N 3.21Å; V20-G22 PolarHBondContact O-N 3.43Å
21	Q	36.3	Very low	34.3	Very low	175 Å²	175	124.6 Å²	124.6	82%	0.818	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-14	-177.9	-72	-173.9	-29.9	0	0	114.5
22	G	36.2	Very low	34.2	Very low	74 Å²	74	123.2 Å²	123.2	76%	0.763	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	7	-175	0	0	0	0	0	117.1	V20	V20-G22 PolarHBondContact O-N 3.43Å
23	I	38.6	Very low	34.6	Very low	120 Å²	120	120.8 Å²	120.8	62%	0.615	72%	0.716	S	S	*	*	S	Bend	trans	-117.7	-12.1	-165.5	-65.6	-179.6	0	0	0	114.4
24	I	37.7	Very low	35	Very low	160 Å²	160	122.1 Å²	122.1	82%	0.821	73%	0.726	S	S	*	*	S	Bend	trans	-101.4	122.7	177.4	-56.1	-179.9	0	0	0	109.1
25	G	28.5	Very low	35.8	Very low	84 Å²	84	122.2 Å²	122.2	87%	0.866	72%	0.718	S	S	*	*			trans	-76.7	137.9	-167.2	0	0	0	0	0	115.3
26	G	31.3	Very low	36.5	Very low	78 Å²	78	127.8 Å²	127.8	80%	0.804	73%	0.729	S	S	*	*			trans	-127.2	151.5	164.4	0	0	0	0	0	110.4
27	S	33.6	Very low	37.8	Very low	128 Å²	128	126.5 Å²	126.5	90%	0.895	72%	0.715	S	S	*	*			trans	-78.3	151.9	-169.1	43.8	0	0	0	0	114.9
28	K	29.4	Very low	39.3	Very low	201 Å²	201	122.8 Å²	122.8	87%	0.874	70%	0.7	S	S	*	*			trans	-57.9	141.7	-179	-56.6	170.4	178.1	177.9	0	113.7
29	L	31.6	Very low	40.9	Very low	167 Å²	167	121.5 Å²	121.5	87%	0.874	69%	0.688	S	S	*	*			trans	-162.9	145.4	139.3	-98.9	152.2	0	0	0	108.2
30	P	32.1	Very low	42.7	Very low	108 Å²	108	116.7 Å²	116.7	70%	0.701	67%	0.674	S	S	*	*			trans	-89.3	127.9	-165.5	33.2	-32.5	0	0	0	113.6	C32	P30-C32 PolarHBondContact O-N 3.15Å
31	Q	32.8	Very low	44.3	Very low	184 Å²	184	115.7 Å²	115.7	86%	0.86	67%	0.665	S	S	*	*			trans	-96.9	51.1	177.6	-68.7	-170.7	-15.2	0	0	113.4	S33	Q31-S33 PolarHBondContact O-N 3.49Å
32	C	37.3	Very low	45.8	Very low	91 Å²	91	108.9 Å²	108.9	62%	0.615	64%	0.636	S	S	*	*			trans	-83	69.1	165.9	-74.6	0	0	0	0	109.4	P30 C125	P30-C32 PolarHBondContact O-N 3.15Å; C32-C125 HydrophobicContact CB-CB 4.18Å; C32-C125 WeakPolarHBondContact CB-SG 3.41Å; C32-C125 WeakPolarHBondContact SG-CB 3.19Å; C32-C125 CovalentContact SG-SG 2.05Å; C32-C125 PolarHBondContact SG-SG 3.16Å
33	S	42.9	Very low	47	Very low	88 Å²	88	110.3 Å²	110.3	62%	0.615	63%	0.63	S	S	*	*			trans	-87.4	142.4	-178	61.6	0	0	0	0	112.1	Q31 F35	Q31-S33 PolarHBondContact O-N 3.49Å; S33-F35 PolarHBondContact O-N 2.86Å; S33-F35 VanDerWaalsContact O-N 3.11Å
34	P	43.5	Very low	48.3	Very low	123 Å²	123	111.6 Å²	111.6	80%	0.799	64%	0.638	S	S	*	*			trans	-76.9	104.4	-173	29.6	-34.6	0	0	0	111.6	R36	P34-R36 PolarHBondContact O-N 2.93Å
35	F	50.7	Low	49.8	Very low	93 Å²	93	104.8 Å²	104.8	41%	0.408	61%	0.606	S	S	.	*			trans	-61.2	120.1	161.7	-113.8	-94.2	0	0	0	108.9	S33 T37 K112	S33-F35 PolarHBondContact O-N 2.86Å; S33-F35 VanDerWaalsContact O-N 3.11Å; F35-T37 VanDerWaalsContact C-N 3.26Å; F35-T37 PolarHBondContact O-N 2.95Å; F35-K112 HydrophobicContact CE1-CB 4.22Å; F35-K112 HydrophobicContact CE1-CD 3.83Å; F35-K112 HydrophobicContact CE1-CG 4.43Å; F35-K112 HydrophobicContact CE2-CD 4.34Å; F35-K112 HydrophobicContact CE2-CG 4.4Å; F35-K112 HydrophobicContact CZ-CB 4.22Å; F35-K112 HydrophobicContact CZ-CD 3.52Å; F35-K112 HydrophobicContact CZ-CG 4.02Å
36	R	52.4	Low	51.9	Low	252 Å²	252	107.2 Å²	107.2	95%	0.951	59%	0.592	S	S	*	*			trans	-70.2	83.6	176.7	-84.8	-171.8	172.1	-178.4	-1.5	110.4	P34	P34-R36 PolarHBondContact O-N 2.93Å
37	T	61	Low	54.2	Low	34 Å²	34	104.4 Å²	104.4	21%	0.209	56%	0.558	C	S	.	*			trans	-87.4	149.6	167.7	55.6	0	0	0	0	109.1	F35 T39 V97 L113	F35-T37 VanDerWaalsContact C-N 3.26Å; F35-T37 PolarHBondContact O-N 2.95Å; T37-T39 PolarHBondContact O-N 3.31Å; T37-T39 WeakPolarHBondContact OG1-CG2 3.24Å; T37-V97 HydrophobicContact CG2-CG2 3.79Å; T37-L113 HydrophobicContact CG2-CD1 3.61Å
38	L	67.3	Low	56.4	Low	67 Å²	67	100.3 Å²	100.3	35%	0.351	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	97.3	168.2	178.7	68.4	0	0	0	107.3	V96	L38-V96 HydrophobicContact CB-CB 4.22Å; L38-V96 PolarHBondContact N-O 2.71Å; L38-V96 PolarHBondContact O-N 3.25Å
39	T	68.8	Low	59.1	Low	69 Å²	69	90.8 Å²	90.8	42%	0.423	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	134.3	176.3	56.5	0	0	0	0	111.6	T37 L94	T37-T39 PolarHBondContact O-N 3.31Å; T37-T39 WeakPolarHBondContact OG1-CG2 3.24Å; T39-L94 CarbonylContact C-O 3.45Å; T39-L94 VanDerWaalsContact CA-O 3.32Å; T39-L94 WeakPolarHBondContact CA-O 3.08Å
40	I	70.5	Confident	61.6	Low	58 Å²	58	82.9 Å²	82.9	30%	0.297	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	89.8	169.2	-55.3	-179.7	0	0	0	106	P42 Q75 G93 L94	I40-P42 WeakPolarHBondContact O-CD 3.32Å; I40-Q75 HydrophobicContact CD1-CB 4.29Å; I40-Q75 VanDerWaalsContact CD1-CD 3.45Å; I40-Q75 HydrophobicContact CD1-CG 3.61Å; I40-G93 CarbonylContact O-C 3.44Å; I40-G93 WeakPolarHBondContact O-CA 3.39Å; I40-L94 HydrophobicContact CB-CB 4.29Å; I40-L94 HydrophobicContact CD1-CD2 4.37Å; I40-L94 PolarHBondContact N-O 3.18Å; I40-L94 PolarHBondContact O-N 3.49Å
41	D	68.6	Low	64.2	Low	75 Å²	75	77.8 Å²	77.8	40%	0.401	41%	0.407	S	S	.	.			trans	-105.5	100.5	-178.1	-71.4	-41.1	0	0	0	110	R48	D41-R48 VanDerWaalsContact CG-CZ 3.49Å; D41-R48 IonicContact OD1-CZ 2.93Å; D41-R48 IonicContact OD1-NE 3.21Å; D41-R48 IonicContact OD1-NH1 2.78Å; D41-R48 PolarHBondContact OD1-NH1 2.91Å; D41-R48 IonicContact OD1-NH2 2.82Å; D41-R48 PolarHBondContact OD1-NH2 3.44Å; D41-R48 IonicContact OD2-CZ 3.47Å; D41-R48 IonicContact OD2-NH1 3.87Å; D41-R48 PolarHBondContact OD2-NH1 3.24Å; D41-R48 IonicContact OD2-NH2 3.47Å; D41-R48 PolarHBondContact OD2-NH2 3.47Å
42	P	66.6	Low	66.6	Low	33 Å²	33	69.2 Å²	69.2	21%	0.214	37%	0.368	C	S	.	.			trans	-69.5	150.4	170.9	29.2	-30.7	0	0	0	109.6	I40 N44 A45 R91	I40-P42 WeakPolarHBondContact O-CD 3.32Å; P42-N44 PolarHBondContact O-N 3.45Å; P42-A45 HydrophobicContact CG-CB 4.08Å; P42-A45 WeakPolarHBondContact O-CB 3.19Å; P42-A45 PolarHBondContact O-N 3.07Å; P42-A45 VanDerWaalsContact O-N 3.15Å; P42-R91 HydrophobicContact CG-CB 4.4Å
43	T	62.7	Low	68.9	Low	104 Å²	104	64.9 Å²	64.9	64%	0.638	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	131.7	-178.2	49.1	0	0	0	0	111.4	R91	T43-R91 VanDerWaalsContact O-CD 3.22Å; T43-R91 WeakPolarHBondContact O-CD 3.32Å; T43-R91 PolarHBondContact O-NH1 3.05Å; T43-R91 PolarHBondContact OG1-NH1 3.07Å; T43-R91 VanDerWaalsContact OG1-NH1 3.07Å
44	N	64.8	Low	71	Confident	146 Å²	146	60.7 Å²	60.7	78%	0.781	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	29	-176.7	-54.3	-0.9	0	0	0	115.9	P42 K46	P42-N44 PolarHBondContact O-N 3.45Å; N44-K46 PolarHBondContact O-N 3.05Å
45	A	70.5	Confident	73	Confident	17 Å²	17	55.3 Å²	55.3	14%	0.14	27%	0.274	C	S	.	.			trans	-69.8	106.7	169.7	0	0	0	0	0	112.7	P42 H47	P42-A45 HydrophobicContact CG-CB 4.08Å; P42-A45 WeakPolarHBondContact O-CB 3.19Å; P42-A45 PolarHBondContact O-N 3.07Å; P42-A45 VanDerWaalsContact O-N 3.15Å; A45-H47 VanDerWaalsContact C-N 3.33Å
46	K	72.4	Confident	74.7	Confident	135 Å²	135	54.3 Å²	54.3	59%	0.587	27%	0.268	S	S	*	.			trans	-80	-14.2	171.8	-67.7	-175.2	176.6	-176.5	0	113.8	N44 T132 M133	N44-K46 PolarHBondContact O-N 3.05Å; K46-T132 VanDerWaalsContact O-CA 3.32Å; K46-T132 WeakPolarHBondContact O-CA 3.46Å; K46-M133 PolarHBondContact O-N 2.87Å; K46-M133 VanDerWaalsContact O-N 3.16Å
47	H	78.7	Confident	76.1	Confident	19 Å²	19	44 Å²	44	9%	0.088	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142	-169.9	-63.5	95.7	0	0	0	110.1	A45 I92 G93 Y135 V391	A45-H47 VanDerWaalsContact C-N 3.33Å; H47-I92 HydrophobicContact CB-CG1 4.05Å; H47-I92 CarbonylContact O-C 3.55Å; H47-I92 WeakPolarHBondContact O-CA 3.49Å; H47-G93 PolarHBondContact O-N 2.84Å; H47-Y135 HydrophobicContact CB-CE2 4.16Å; H47-Y135 AromaticContact CD2-CE2 3.9Å; H47-Y135 PolarHBondContact CD2-OH 3.12Å; H47-V391 HydrophobicContact CB-CG1 4.09Å; H47-V391 HydrophobicContact CB-CG2 4.1Å; H47-V391 WeakPolarHBondContact ND1-CG1 3.39Å
48	R	80.2	Confident	76.9	Confident	42 Å²	42	47.8 Å²	47.8	16%	0.158	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	129.4	-178.3	-59.4	-178.3	76.3	108.9	10	111.7	D41 G93 S95 M133 Q134 Y135	D41-R48 VanDerWaalsContact CG-CZ 3.49Å; D41-R48 IonicContact OD1-CZ 2.93Å; D41-R48 IonicContact OD1-NE 3.21Å; D41-R48 IonicContact OD1-NH1 2.78Å; D41-R48 PolarHBondContact OD1-NH1 2.91Å; D41-R48 IonicContact OD1-NH2 2.82Å; D41-R48 PolarHBondContact OD1-NH2 3.44Å; D41-R48 IonicContact OD2-CZ 3.47Å; D41-R48 IonicContact OD2-NH1 3.87Å; D41-R48 PolarHBondContact OD2-NH1 3.24Å; D41-R48 IonicContact OD2-NH2 3.47Å; D41-R48 PolarHBondContact OD2-NH2 3.47Å; R48-G93 WeakPolarHBondContact CA-O 3.08Å; R48-S95 PolarHBondContact NE-OG 3.16Å; R48-S95 PolarHBondContact NH2-OG 3.48Å; R48-M133 PolarHBondContact N-O 2.82Å; R48-Q134 WeakPolarHBondContact O-CA 3.26Å; R48-Y135 PolarHBondContact O-N 2.86Å
49	I	86.2	Confident	77.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	132.8	163.6	-65	-177.2	0	0	0	108.5	L78 I92 G93 L94 S95 L137 T384 V387	I49-L78 HydrophobicContact CD1-CD1 4.34Å; I49-L78 HydrophobicContact CD1-CD2 4.15Å; I49-I92 HydrophobicContact CD1-CG2 4.17Å; I49-I92 HydrophobicContact CG1-CG2 3.86Å; I49-G93 PolarHBondContact N-O 2.01Å; I49-L94 HydrophobicContact CB-CD1 3.99Å; I49-L94 HydrophobicContact CG2-CD1 3.88Å; I49-L94 CarbonylContact O-C 3.5Å; I49-L94 WeakPolarHBondContact O-CA 3.34Å; I49-S95 PolarHBondContact O-N 2.76Å; I49-L137 HydrophobicContact CG2-CB 3.75Å; I49-L137 HydrophobicContact CG2-CD2 4.44Å; I49-L137 HydrophobicContact CG2-CG 4.48Å; I49-T384 HydrophobicContact CD1-CG2 4.24Å; I49-V387 HydrophobicContact CD1-CB 4.06Å; I49-V387 HydrophobicContact CD1-CG1 3.92Å; I49-V387 HydrophobicContact CG1-CG1 3.95Å
50	I	84.4	Confident	78.1	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.5	178.1	-62.9	-173.2	0	0	0	108.1	S95 L113 L114 A117 Q134 Y135 L136 L137	I50-S95 WeakPolarHBondContact CA-O 2.93Å; I50-L113 HydrophobicContact CG2-CD1 4.29Å; I50-L113 HydrophobicContact CG2-CD2 3.45Å; I50-L113 VanDerWaalsContact CG2-CD2 3.45Å; I50-L113 HydrophobicContact CG2-CG 3.52Å; I50-L114 HydrophobicContact CD1-CD2 4.11Å; I50-L114 HydrophobicContact CG2-CD2 4.37Å; I50-A117 HydrophobicContact CD1-CB 3.64Å; I50-Q134 HydrophobicContact CD1-CB 3.88Å; I50-Q134 HydrophobicContact CD1-CG 3.79Å; I50-Y135 PolarHBondContact N-O 3.34Å; I50-L136 HydrophobicContact CG2-CD1 4.38Å; I50-L137 PolarHBondContact O-N 3.07Å
51	A	85	Confident	78.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	137.9	-177.8	0	0	0	0	0	113	F53 S95 V96 V97 L137	A51-F53 HydrophobicContact CB-CD2 3.91Å; A51-F53 HydrophobicContact CB-CE2 3.49Å; A51-F53 VanDerWaalsContact CB-CE2 3.49Å; A51-F53 HydrophobicContact CB-CZ 4.46Å; A51-S95 PolarHBondContact N-O 3.22Å; A51-V96 HydrophobicContact CB-CG2 4.19Å; A51-V96 WeakPolarHBondContact O-CA 3.27Å; A51-V97 PolarHBondContact O-N 2.77Å; A51-L137 HydrophobicContact CB-CB 4.12Å; A51-L137 HydrophobicContact CB-CD2 4.43Å
52	A	83.4	Confident	79.3	Confident	4 Å²	4	53.9 Å²	53.9	3%	0.033	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.1	165.3	0	0	0	0	0	108.7	V97 F106 S139	A52-V97 WeakPolarHBondContact CA-O 3.49Å; A52-F106 HydrophobicContact CB-CE1 3.79Å; A52-F106 HydrophobicContact CB-CZ 3.77Å; A52-F106 WeakPolarHBondContact O-CZ 3.17Å; A52-S139 WeakPolarHBondContact O-CB 3.27Å
53	F	86.7	Confident	80.1	Confident	1 Å²	1	53.3 Å²	53.3	0%	0.004	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.9	-179.7	-80.1	-89.4	0	0	0	110.4	A51 L55 T70 L71 V74 V96 V97 G98 V99 L137 S139 F162	A51-F53 HydrophobicContact CB-CD2 3.91Å; A51-F53 HydrophobicContact CB-CE2 3.49Å; A51-F53 VanDerWaalsContact CB-CE2 3.49Å; A51-F53 HydrophobicContact CB-CZ 4.46Å; F53-L55 VanDerWaalsContact C-N 3.29Å; F53-L55 HydrophobicContact CB-CD2 3.74Å; F53-L55 HydrophobicContact CB-CG 3.95Å; F53-L55 PolarHBondContact O-N 2.9Å; F53-T70 HydrophobicContact CE1-CG2 4.15Å; F53-L71 HydrophobicContact CD1-CB 4.27Å; F53-L71 HydrophobicContact CD2-CB 4.42Å; F53-L71 HydrophobicContact CD2-CD1 4.03Å; F53-L71 HydrophobicContact CE1-CB 4.26Å; F53-L71 HydrophobicContact CE2-CB 4.4Å; F53-L71 HydrophobicContact CE2-CD1 3.89Å; F53-L71 HydrophobicContact CG-CB 4.35Å; F53-L71 HydrophobicContact CZ-CB 4.33Å; F53-L71 HydrophobicContact CZ-CD1 4.48Å; F53-V74 HydrophobicContact CZ-CG2 4.16Å; F53-V96 HydrophobicContact CD2-CG1 4.15Å; F53-V96 HydrophobicContact CD2-CG2 4.28Å; F53-V96 HydrophobicContact CE2-CG2 4.21Å; F53-V97 PolarHBondContact N-O 2.94Å; F53-G98 WeakPolarHBondContact O-CA 3.3Å; F53-V99 WeakPolarHBondContact O-CG2 3.18Å; F53-V99 PolarHBondContact O-N 3.26Å; F53-L137 HydrophobicContact CZ-CD2 4.42Å; F53-S139 WeakPolarHBondContact CD1-OG 3.36Å; F53-F162 AromaticContact CE1-CZ 3.75Å; F53-F162 HydrophobicContact CE1-CZ 3.75Å; F53-F162 HydrophobicContact CZ-CZ 4.1Å
54	P	86	Confident	81.1	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	84.3	172.1	32.4	-28.2	0	0	0	108.4	Y56 S67 V99 F101 F106 S139 E140	P54-Y56 PolarHBondContact O-N 3.15Å; P54-S67 WeakPolarHBondContact O-CB 3.28Å; P54-S67 PolarHBondContact O-OG 3.36Å; P54-V99 CarbonylContact C-O 3.51Å; P54-V99 VanDerWaalsContact CA-O 3.31Å; P54-V99 WeakPolarHBondContact CA-O 3.28Å; P54-V99 HydrophobicContact CB-CG2 4.44Å; P54-F101 HydrophobicContact CB-CB 4.3Å; P54-F101 HydrophobicContact CB-CD2 3.71Å; P54-F101 HydrophobicContact CB-CG 4.5Å; P54-F101 HydrophobicContact CG-CD2 4.02Å; P54-F101 HydrophobicContact CG-CE2 4.45Å; P54-F106 HydrophobicContact CB-CE2 4.3Å; P54-F106 HydrophobicContact CG-CE2 4.28Å; P54-S139 WeakPolarHBondContact CD-OG 3.34Å; P54-E140 WeakPolarHBondContact CG-O 3.49Å
55	L	86.3	Confident	81.9	Confident	10 Å²	10	43.1 Å²	43.1	5%	0.052	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-14.3	-176.1	-62.5	179.1	0	0	0	112.2	F53 V63 R64 V68 L71 V99 L337	F53-L55 VanDerWaalsContact C-N 3.29Å; F53-L55 HydrophobicContact CB-CD2 3.74Å; F53-L55 HydrophobicContact CB-CG 3.95Å; F53-L55 PolarHBondContact O-N 2.9Å; L55-V63 WeakPolarHBondContact O-CA 3.48Å; L55-R64 PolarHBondContact O-N 3.07Å; L55-V68 HydrophobicContact CD2-CG2 4.3Å; L55-L71 HydrophobicContact CD1-CD2 4.04Å; L55-L71 HydrophobicContact CD2-CB 4.43Å; L55-L71 HydrophobicContact CD2-CD2 3.91Å; L55-V99 PolarHBondContact N-O 3.21Å; L55-L337 HydrophobicContact CB-CD1 4.11Å; L55-L337 HydrophobicContact CD1-CD1 3.94Å; L55-L337 HydrophobicContact CD1-CD2 3.75Å; L55-L337 HydrophobicContact CD1-CG 4.49Å; L55-L337 HydrophobicContact CD2-CD2 4.37Å; L55-L337 HydrophobicContact CG-CD1 4.48Å
56	Y	85.8	Confident	82.4	Confident	71 Å²	71	44.4 Å²	44.4	28%	0.278	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	152.8	175.5	-51.9	-84.8	0	0	0	110.7	P54 Q62 V63 V99 F101	P54-Y56 PolarHBondContact O-N 3.15Å; Y56-Q62 CarbonylContact C-O 3.58Å; Y56-Q62 WeakPolarHBondContact CA-O 3.5Å; Y56-V63 HydrophobicContact CD1-CG2 4.07Å; Y56-V63 HydrophobicContact CE1-CG2 3.88Å; Y56-V99 PolarHBondContact N-O 3.26Å; Y56-F101 PolarHBondContact O-N 3.31Å
57	E	82.7	Confident	83	Confident	37 Å²	37	38.1 Å²	38.1	17%	0.173	20%	0.198	C	C	.	.			trans	-64.8	176.2	167.6	-60	-63.4	138	0	0	111.2	D59 C60 Q62 R64	E57-D59 PolarHBondContact O-N 3.42Å; E57-C60 PolarHBondContact O-N 3.09Å; E57-Q62 HydrophobicContact CB-CB 4.2Å; E57-Q62 HydrophobicContact CG-CB 3.85Å; E57-Q62 PolarHBondContact N-O 3.01Å; E57-R64 VanDerWaalsContact CD-NE 3.32Å; E57-R64 WeakPolarHBondContact OE1-CB 3.3Å; E57-R64 VanDerWaalsContact OE1-CG 3.29Å; E57-R64 WeakPolarHBondContact OE1-CG 3.4Å; E57-R64 IonicContact OE1-CZ 3.47Å; E57-R64 IonicContact OE1-NE 3.39Å; E57-R64 PolarHBondContact OE1-NE 3.03Å; E57-R64 IonicContact OE1-NH2 3.43Å; E57-R64 IonicContact OE2-CZ 2.98Å; E57-R64 IonicContact OE2-NE 3.77Å; E57-R64 PolarHBondContact OE2-NE 2.87Å; E57-R64 IonicContact OE2-NH2 2.99Å; E57-R64 PolarHBondContact OE2-NH2 2.96Å
58	D	77.8	Confident	83.5	Confident	112 Å²	112	37.2 Å²	37.2	60%	0.599	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-20.7	179.3	-50.3	33.2	0	0	0	113.2	R64 F101	D58-R64 IonicContact OD1-NH2 3.44Å; D58-R64 PolarHBondContact OD1-NH2 2.67Å; D58-F101 WeakPolarHBondContact OD1-CD1 3.18Å
59	D	78.4	Confident	83.9	Confident	67 Å²	67	35.4 Å²	35.4	36%	0.358	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-4.4	177.9	71.7	2.8	0	0	0	114.6	E57 L61 Q62	E57-D59 PolarHBondContact O-N 3.42Å; D59-L61 WeakPolarHBondContact O-CG 3.34Å; D59-L61 PolarHBondContact O-N 3.16Å; D59-L61 PolarHBondContact OD1-N 3.22Å; D59-Q62 PolarHBondContact OD1-N 3.16Å; D59-Q62 PolarHBondContact OD2-NE2 3.46Å
60	C	82	Confident	84	Confident	64 Å²	64	35.3 Å²	35.3	43%	0.432	19%	0.186	S	C	.	.	S	Bend	trans	56.8	4.9	-170.9	-69.4	0	0	0	0	116.1	E57 C100	E57-C60 PolarHBondContact O-N 3.09Å; C60-C100 WeakPolarHBondContact CA-SG 3.41Å; C60-C100 HydrophobicContact CB-CB 4.2Å; C60-C100 WeakPolarHBondContact CB-SG 2.93Å; C60-C100 WeakPolarHBondContact SG-CB 3.08Å; C60-C100 CovalentContact SG-SG 2.03Å; C60-C100 PolarHBondContact SG-SG 3.14Å
61	L	82.5	Confident	84.3	Confident	147 Å²	147	35.3 Å²	35.3	77%	0.77	19%	0.186	S	C	*	.	S	Bend	trans	-107.2	-38.5	-174.3	-67	170.7	0	0	0	112	D59	D59-L61 WeakPolarHBondContact O-CG 3.34Å; D59-L61 PolarHBondContact O-N 3.16Å; D59-L61 PolarHBondContact OD1-N 3.22Å
62	Q	81.6	Confident	84.5	Confident	120 Å²	120	35.5 Å²	35.5	56%	0.561	19%	0.187	S	C	*	.	S	Bend	trans	-91.1	131.6	-177.9	-68.8	177.3	74.1	0	0	111.1	Y56 E57 D59	Y56-Q62 CarbonylContact C-O 3.58Å; Y56-Q62 WeakPolarHBondContact CA-O 3.5Å; E57-Q62 HydrophobicContact CB-CB 4.2Å; E57-Q62 HydrophobicContact CG-CB 3.85Å; E57-Q62 PolarHBondContact N-O 3.01Å; D59-Q62 PolarHBondContact OD1-N 3.16Å; D59-Q62 PolarHBondContact OD2-NE2 3.46Å
63	V	84.3	Confident	84.9	Confident	21 Å²	21	35.3 Å²	35.3	13%	0.127	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-83.2	121.6	-178.5	179.5	0	0	0	0	110.6	L55 Y56 A65 V68 L337	L55-V63 WeakPolarHBondContact O-CA 3.48Å; Y56-V63 HydrophobicContact CD1-CG2 4.07Å; Y56-V63 HydrophobicContact CE1-CG2 3.88Å; V63-A65 PolarHBondContact O-N 2.67Å; V63-V68 HydrophobicContact CG1-CG2 3.57Å; V63-L337 HydrophobicContact CG1-CD1 4.44Å
64	R	83.3	Confident	85.1	Confident	12 Å²	12	35.3 Å²	35.3	5%	0.045	19%	0.185	C	C	.	.			trans	-76.4	103.5	179.8	-173.1	168.5	-71	168.8	6.8	110.8	L55 E57 D58 D66 S67 V68	L55-R64 PolarHBondContact O-N 3.07Å; E57-R64 VanDerWaalsContact CD-NE 3.32Å; E57-R64 WeakPolarHBondContact OE1-CB 3.3Å; E57-R64 VanDerWaalsContact OE1-CG 3.29Å; E57-R64 WeakPolarHBondContact OE1-CG 3.4Å; E57-R64 IonicContact OE1-CZ 3.47Å; E57-R64 IonicContact OE1-NE 3.39Å; E57-R64 PolarHBondContact OE1-NE 3.03Å; E57-R64 IonicContact OE1-NH2 3.43Å; E57-R64 IonicContact OE2-CZ 2.98Å; E57-R64 IonicContact OE2-NE 3.77Å; E57-R64 PolarHBondContact OE2-NE 2.87Å; E57-R64 IonicContact OE2-NH2 2.99Å; E57-R64 PolarHBondContact OE2-NH2 2.96Å; D58-R64 IonicContact OD1-NH2 3.44Å; D58-R64 PolarHBondContact OD1-NH2 2.67Å; R64-D66 PolarHBondContact O-N 3.22Å; R64-S67 WeakPolarHBondContact CD-OG 3.28Å; R64-S67 WeakPolarHBondContact CG-OG 3.32Å; R64-S67 WeakPolarHBondContact O-CB 3.48Å; R64-S67 PolarHBondContact O-N 3.35Å; R64-V68 PolarHBondContact O-N 3.37Å
65	A	82.4	Confident	85.3	Confident	23 Å²	23	36.6 Å²	36.6	19%	0.19	19%	0.192	C	C	.	.	H	α-helix	trans	-56.2	-44.4	-172.6	0	0	0	0	0	114	V63 S67 V68 H69 Y341	V63-A65 PolarHBondContact O-N 2.67Å; A65-S67 PolarHBondContact O-N 3.05Å; A65-V68 PolarHBondContact O-N 2.59Å; A65-H69 PolarHBondContact O-N 2.96Å; A65-Y341 HydrophobicContact CB-CE2 3.97Å
66	D	80.3	Confident	85.5	Confident	44 Å²	44	36.9 Å²	36.9	24%	0.235	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-41.9	179.3	-69.7	-73.3	0	0	0	112.5	R64 V68 H69 T70 G374 A375	R64-D66 PolarHBondContact O-N 3.22Å; D66-V68 VanDerWaalsContact C-N 3.32Å; D66-V68 PolarHBondContact O-N 2.85Å; D66-H69 PolarHBondContact O-N 3.29Å; D66-T70 WeakPolarHBondContact O-CB 3.49Å; D66-T70 PolarHBondContact O-N 2.82Å; D66-T70 PolarHBondContact O-OG1 3.42Å; D66-G374 WeakPolarHBondContact OD1-CA 3.42Å; D66-A375 PolarHBondContact OD1-N 2.87Å; D66-A375 VanDerWaalsContact OD1-N 3.07Å
67	S	85.6	Confident	85.8	Confident	4 Å²	4	33.6 Å²	33.6	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-39.4	175	-56.2	0	0	0	0	112.2	P54 R64 A65 T70 L71	P54-S67 WeakPolarHBondContact O-CB 3.28Å; P54-S67 PolarHBondContact O-OG 3.36Å; R64-S67 WeakPolarHBondContact CD-OG 3.28Å; R64-S67 WeakPolarHBondContact CG-OG 3.32Å; R64-S67 WeakPolarHBondContact O-CB 3.48Å; R64-S67 PolarHBondContact O-N 3.35Å; A65-S67 PolarHBondContact O-N 3.05Å; S67-T70 PolarHBondContact O-N 2.8Å; S67-L71 WeakPolarHBondContact O-CB 3.32Å; S67-L71 PolarHBondContact O-N 2.7Å
68	V	87.8	Confident	86.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.5	-48.5	176.3	175.4	0	0	0	0	111	L55 V63 R64 A65 D66 T70 L71 F72 F324 L337 Y341	L55-V68 HydrophobicContact CD2-CG2 4.3Å; V63-V68 HydrophobicContact CG1-CG2 3.57Å; R64-V68 PolarHBondContact O-N 3.37Å; A65-V68 PolarHBondContact O-N 2.59Å; D66-V68 VanDerWaalsContact C-N 3.32Å; D66-V68 PolarHBondContact O-N 2.85Å; V68-T70 PolarHBondContact O-N 2.8Å; V68-L71 PolarHBondContact O-N 3.45Å; V68-F72 HydrophobicContact CG1-CD2 3.86Å; V68-F72 HydrophobicContact CG1-CE2 3.99Å; V68-F72 WeakPolarHBondContact O-CD2 3.45Å; V68-F72 PolarHBondContact O-N 3.2Å; V68-F324 HydrophobicContact CG1-CE2 4.5Å; V68-F324 HydrophobicContact CG1-CZ 4.32Å; V68-L337 HydrophobicContact CG2-CD1 4.08Å; V68-L337 HydrophobicContact CG2-CD2 4.43Å; V68-L337 HydrophobicContact CG2-CG 4.29Å; V68-Y341 HydrophobicContact CB-CD2 4.04Å; V68-Y341 HydrophobicContact CG1-CD2 3.88Å; V68-Y341 HydrophobicContact CG1-CE2 4.46Å; V68-Y341 HydrophobicContact CG1-CG 4.09Å; V68-Y341 HydrophobicContact CG2-CD2 4.32Å
69	H	88.8	Confident	86.7	Confident	3 Å²	3	28.2 Å²	28.2	1%	0.014	16%	0.159	C	C	.	.	H	α-helix	trans	-55.4	-42.9	175.2	-63.9	158.9	0	0	0	111.3	A65 D66 F72 A73 F320 F324 Y341 T372 G374 V377	A65-H69 PolarHBondContact O-N 2.96Å; D66-H69 PolarHBondContact O-N 3.29Å; H69-F72 PolarHBondContact O-N 2.83Å; H69-A73 WeakPolarHBondContact O-CB 3.48Å; H69-A73 PolarHBondContact O-N 2.91Å; H69-F320 VanDerWaalsContact O-CZ 3.25Å; H69-F320 WeakPolarHBondContact O-CZ 3.41Å; H69-F324 AromaticContact CD2-CE1 3.7Å; H69-F324 AromaticContact CD2-CZ 3.64Å; H69-F324 AromaticContact NE2-CE1 3.88Å; H69-Y341 AromaticContact NE2-CE2 3.64Å; H69-Y341 AromaticContact NE2-CZ 3.48Å; H69-Y341 PolarHBondContact NE2-OH 3.43Å; H69-T372 PolarHBondContact CE1-O 2.63Å; H69-T372 PolarHBondContact ND1-O 2.66Å; H69-G374 WeakPolarHBondContact ND1-CA 3.34Å; H69-G374 PolarHBondContact ND1-N 3.04Å; H69-V377 HydrophobicContact CB-CG2 3.9Å
70	T	89.3	Confident	87.3	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-73.5	-37.7	-174.8	-51.9	0	0	0	0	112.6	F53 D66 S67 V68 A73 V74 F162 T376 A380	F53-T70 HydrophobicContact CE1-CG2 4.15Å; D66-T70 WeakPolarHBondContact O-CB 3.49Å; D66-T70 PolarHBondContact O-N 2.82Å; D66-T70 PolarHBondContact O-OG1 3.42Å; S67-T70 PolarHBondContact O-N 2.8Å; V68-T70 PolarHBondContact O-N 2.8Å; T70-A73 PolarHBondContact O-N 2.93Å; T70-V74 WeakPolarHBondContact O-CG2 3.29Å; T70-V74 PolarHBondContact O-N 3.22Å; T70-F162 HydrophobicContact CG2-CD2 4.06Å; T70-F162 HydrophobicContact CG2-CE2 3.45Å; T70-F162 VanDerWaalsContact CG2-CE2 3.45Å; T70-F162 HydrophobicContact CG2-CZ 3.82Å; T70-T376 PolarHBondContact OG1-OG1 3.33Å; T70-A380 HydrophobicContact CG2-CB 3.33Å
71	L	89.7	Confident	87.7	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-59.4	-47.9	169.6	170.5	57.3	0	0	0	111.5	F53 L55 S67 V68 A73 V74 Q75 V96 L337	F53-L71 HydrophobicContact CD1-CB 4.27Å; F53-L71 HydrophobicContact CD2-CB 4.42Å; F53-L71 HydrophobicContact CD2-CD1 4.03Å; F53-L71 HydrophobicContact CE1-CB 4.26Å; F53-L71 HydrophobicContact CE2-CB 4.4Å; F53-L71 HydrophobicContact CE2-CD1 3.89Å; F53-L71 HydrophobicContact CG-CB 4.35Å; F53-L71 HydrophobicContact CZ-CB 4.33Å; F53-L71 HydrophobicContact CZ-CD1 4.48Å; L55-L71 HydrophobicContact CD1-CD2 4.04Å; L55-L71 HydrophobicContact CD2-CB 4.43Å; L55-L71 HydrophobicContact CD2-CD2 3.91Å; S67-L71 WeakPolarHBondContact O-CB 3.32Å; S67-L71 PolarHBondContact O-N 2.7Å; V68-L71 PolarHBondContact O-N 3.45Å; L71-A73 VanDerWaalsContact C-N 3.31Å; L71-A73 PolarHBondContact O-N 3.48Å; L71-V74 PolarHBondContact O-N 3.17Å; L71-Q75 PolarHBondContact O-N 3.24Å; L71-V96 HydrophobicContact CD1-CB 4.19Å; L71-V96 HydrophobicContact CD1-CG1 3.77Å; L71-V96 HydrophobicContact CD1-CG2 3.59Å; L71-V96 HydrophobicContact CD2-CG1 4.15Å; L71-L337 HydrophobicContact CD2-CD2 3.9Å
72	F	90.2	Very high	88	Confident	4 Å²	4	18 Å²	18	2%	0.018	10%	0.1	C	C	.	.	H	α-helix	trans	-69.1	-27.9	178.2	-81.7	-76.1	0	0	0	112.8	V68 H69 Q75 W76 F320 F324 I327 L337 L338	V68-F72 HydrophobicContact CG1-CD2 3.86Å; V68-F72 HydrophobicContact CG1-CE2 3.99Å; V68-F72 WeakPolarHBondContact O-CD2 3.45Å; V68-F72 PolarHBondContact O-N 3.2Å; H69-F72 PolarHBondContact O-N 2.83Å; F72-Q75 PolarHBondContact O-N 3.12Å; F72-W76 VanDerWaalsContact O-CB 3.24Å; F72-W76 WeakPolarHBondContact O-CB 3.23Å; F72-W76 PolarHBondContact O-N 3.44Å; F72-F320 HydrophobicContact CB-CE2 4.32Å; F72-F320 HydrophobicContact CB-CZ 4.21Å; F72-F324 HydrophobicContact CB-CD2 3.89Å; F72-F324 HydrophobicContact CB-CE2 3.89Å; F72-F324 HydrophobicContact CD2-CD2 4.49Å; F72-F324 AromaticContact CD2-CE2 3.72Å; F72-F324 HydrophobicContact CD2-CE2 3.72Å; F72-F324 HydrophobicContact CE2-CE2 4.48Å; F72-F324 HydrophobicContact CG-CD2 4.21Å; F72-F324 AromaticContact CG-CE2 3.89Å; F72-F324 HydrophobicContact CG-CE2 3.89Å; F72-I327 HydrophobicContact CD1-CD1 3.92Å; F72-I327 HydrophobicContact CE1-CD1 4.44Å; F72-I327 HydrophobicContact CE1-CG2 4.41Å; F72-L337 HydrophobicContact CE2-CD2 4.35Å; F72-L338 HydrophobicContact CE2-CD1 4Å; F72-L338 HydrophobicContact CZ-CD1 4.1Å
73	A	91.4	Very high	88.3	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-68.7	-39.5	172	0	0	0	0	0	112.5	H69 T70 L71 W76 A77 F320 V377 V381	H69-A73 WeakPolarHBondContact O-CB 3.48Å; H69-A73 PolarHBondContact O-N 2.91Å; T70-A73 PolarHBondContact O-N 2.93Å; L71-A73 VanDerWaalsContact C-N 3.31Å; L71-A73 PolarHBondContact O-N 3.48Å; A73-W76 PolarHBondContact O-N 3.37Å; A73-A77 WeakPolarHBondContact O-CB 3.46Å; A73-A77 PolarHBondContact O-N 3.44Å; A73-F320 VanDerWaalsContact CA-CE2 3.42Å; A73-F320 HydrophobicContact CB-CD2 4.18Å; A73-F320 HydrophobicContact CB-CE1 4.21Å; A73-F320 HydrophobicContact CB-CE2 3.83Å; A73-F320 HydrophobicContact CB-CZ 3.84Å; A73-V377 HydrophobicContact CB-CB 4.38Å; A73-V377 HydrophobicContact CB-CG1 3.86Å; A73-V377 HydrophobicContact CB-CG2 4.21Å; A73-V381 HydrophobicContact CB-CG2 4.02Å
74	V	90.9	Very high	88.4	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.2	-45	171.7	163	0	0	0	0	111.1	F53 T70 L71 L78 L94 L137 A380 T384	F53-V74 HydrophobicContact CZ-CG2 4.16Å; T70-V74 WeakPolarHBondContact O-CG2 3.29Å; T70-V74 PolarHBondContact O-N 3.22Å; L71-V74 PolarHBondContact O-N 3.17Å; V74-L78 HydrophobicContact CG1-CD1 4.48Å; V74-L78 WeakPolarHBondContact O-CG 3.14Å; V74-L78 PolarHBondContact O-N 3.21Å; V74-L94 HydrophobicContact CG1-CD1 3.82Å; V74-L94 HydrophobicContact CG1-CD2 3.86Å; V74-L137 HydrophobicContact CG1-CD2 4.21Å; V74-L137 HydrophobicContact CG2-CD2 3.72Å; V74-A380 HydrophobicContact CG2-CB 4.03Å; V74-T384 HydrophobicContact CB-CG2 4.05Å; V74-T384 HydrophobicContact CG1-CG2 3.75Å; V74-T384 HydrophobicContact CG2-CG2 3.75Å
75	Q	90.2	Very high	88.4	Confident	28 Å²	28	26.4 Å²	26.4	13%	0.131	14%	0.138	C	C	.	.	H	α-helix	trans	-62.2	-41	173.9	175.1	175	-3.6	0	0	112.3	I40 L71 F72 G79	I40-Q75 HydrophobicContact CD1-CB 4.29Å; I40-Q75 VanDerWaalsContact CD1-CD 3.45Å; I40-Q75 HydrophobicContact CD1-CG 3.61Å; L71-Q75 PolarHBondContact O-N 3.24Å; F72-Q75 PolarHBondContact O-N 3.12Å; Q75-G79 PolarHBondContact O-N 3.23Å
76	W	91.6	Very high	88.3	Confident	16 Å²	16	30.2 Å²	30.2	6%	0.061	15%	0.152	C	C	.	.	H	α-helix	trans	-65.3	-48.7	179.2	176.2	70.6	0	0	0	112.5	F72 A73 L78 G79 I80 M317 D319 F320 Y323 V381 P432	F72-W76 VanDerWaalsContact O-CB 3.24Å; F72-W76 WeakPolarHBondContact O-CB 3.23Å; F72-W76 PolarHBondContact O-N 3.44Å; A73-W76 PolarHBondContact O-N 3.37Å; W76-L78 PolarHBondContact O-N 3.14Å; W76-G79 CarbonylContact O-C 3.47Å; W76-G79 WeakPolarHBondContact O-CA 3.41Å; W76-G79 PolarHBondContact O-N 3.16Å; W76-I80 HydrophobicContact CD2-CD1 4.02Å; W76-I80 HydrophobicContact CH2-CD1 4.34Å; W76-I80 HydrophobicContact CZ2-CD1 3.74Å; W76-I80 PolarHBondContact O-N 2.92Å; W76-M317 HydrophobicContact CH2-CE 4.11Å; W76-M317 HydrophobicContact CZ3-CE 3.65Å; W76-D319 HydrophobicContact CH2-CB 3.94Å; W76-D319 HydrophobicContact CZ2-CB 3.63Å; W76-F320 HydrophobicContact CB-CD2 4.05Å; W76-F320 HydrophobicContact CB-CE2 4.23Å; W76-F320 HydrophobicContact CD2-CB 4.31Å; W76-F320 AromaticContact CD2-CD2 3.86Å; W76-F320 HydrophobicContact CD2-CD2 3.86Å; W76-F320 HydrophobicContact CE3-CB 4.13Å; W76-F320 AromaticContact CE3-CD2 3.97Å; W76-F320 HydrophobicContact CE3-CD2 3.97Å; W76-F320 HydrophobicContact CE3-CG 4.41Å; W76-F320 AromaticContact CG-CD2 3.94Å; W76-F320 HydrophobicContact CG-CD2 3.94Å; W76-F320 HydrophobicContact CH2-CB 3.93Å; W76-F320 HydrophobicContact CZ2-CB 4.15Å; W76-F320 HydrophobicContact CZ3-CB 3.95Å; W76-Y323 HydrophobicContact CB-CD1 3.92Å; W76-Y323 HydrophobicContact CB-CE1 3.52Å; W76-Y323 AromaticContact CD1-CD1 3.18Å; W76-Y323 AromaticContact CD1-CD2 3.7Å; W76-Y323 AromaticContact CD1-CE1 3.38Å; W76-Y323 AromaticContact CD1-CE2 3.89Å; W76-Y323 AromaticContact CD1-CG 3.33Å; W76-Y323 AromaticContact CD1-CZ 3.73Å; W76-Y323 AromaticContact CG-CD1 3.68Å; W76-Y323 HydrophobicContact CG-CD1 3.68Å; W76-Y323 AromaticContact CG-CE1 3.74Å; W76-Y323 HydrophobicContact CG-CE1 3.74Å; W76-Y323 HydrophobicContact CG-CG 4.25Å; W76-Y323 AromaticContact NE1-CD1 3.86Å; W76-Y323 AromaticContact NE1-CG 3.64Å; W76-V381 HydrophobicContact CE3-CG2 4.17Å; W76-V381 HydrophobicContact CZ3-CG1 4.47Å; W76-V381 HydrophobicContact CZ3-CG2 4.19Å; W76-P432 HydrophobicContact CH2-CB 3.72Å; W76-P432 HydrophobicContact CH2-CG 3.77Å; W76-P432 HydrophobicContact CZ2-CG 4.43Å; W76-P432 HydrophobicContact CZ3-CB 4.21Å; W76-P432 HydrophobicContact CZ3-CG 3.93Å
77	A	92.1	Very high	88.5	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-58.9	-48	178.6	0	0	0	0	0	111.8	A73 G79 I80 W81 V381 T384 Y385	A73-A77 WeakPolarHBondContact O-CB 3.46Å; A73-A77 PolarHBondContact O-N 3.44Å; A77-G79 VanDerWaalsContact C-N 3.26Å; A77-G79 PolarHBondContact O-N 3.14Å; A77-I80 PolarHBondContact O-N 2.96Å; A77-W81 WeakPolarHBondContact O-CB 3.48Å; A77-W81 PolarHBondContact O-N 2.76Å; A77-V381 HydrophobicContact CB-CB 4.47Å; A77-V381 HydrophobicContact CB-CG1 4Å; A77-V381 HydrophobicContact CB-CG2 4.23Å; A77-T384 VanDerWaalsContact CB-OG1 3.3Å; A77-T384 WeakPolarHBondContact CB-OG1 3.39Å; A77-Y385 HydrophobicContact CB-CD2 4.15Å; A77-Y385 HydrophobicContact CB-CE2 4.03Å
78	L	90.1	Very high	88.1	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-64.3	-32.5	173	-69.2	175.2	0	0	0	112.1	I49 V74 W76 N82 I92 L94	I49-L78 HydrophobicContact CD1-CD1 4.34Å; I49-L78 HydrophobicContact CD1-CD2 4.15Å; V74-L78 HydrophobicContact CG1-CD1 4.48Å; V74-L78 WeakPolarHBondContact O-CG 3.14Å; V74-L78 PolarHBondContact O-N 3.21Å; W76-L78 PolarHBondContact O-N 3.14Å; L78-N82 VanDerWaalsContact O-CB 3.22Å; L78-N82 WeakPolarHBondContact O-CB 3.39Å; L78-N82 VanDerWaalsContact O-CG 3.27Å; L78-N82 PolarHBondContact O-N 3.38Å; L78-N82 PolarHBondContact O-ND2 2.9Å; L78-I92 HydrophobicContact CD2-CB 4.06Å; L78-I92 HydrophobicContact CD2-CG2 3.78Å; L78-L94 HydrophobicContact CD1-CB 3.87Å; L78-L94 HydrophobicContact CD1-CD1 4.14Å; L78-L94 HydrophobicContact CD1-CD2 4.33Å; L78-L94 HydrophobicContact CD1-CG 4.33Å
79	G	88.7	Confident	87.5	Confident	29 Å²	29	37.7 Å²	37.7	30%	0.299	20%	0.195	S	C	.	.	H	α-helix	trans	-63.5	-37.1	174	0	0	0	0	0	113.6	Q75 W76 A77 R83	Q75-G79 PolarHBondContact O-N 3.23Å; W76-G79 CarbonylContact O-C 3.47Å; W76-G79 WeakPolarHBondContact O-CA 3.41Å; W76-G79 PolarHBondContact O-N 3.16Å; A77-G79 VanDerWaalsContact C-N 3.26Å; A77-G79 PolarHBondContact O-N 3.14Å; G79-R83 VanDerWaalsContact O-CD 3.23Å; G79-R83 WeakPolarHBondContact O-CD 3.43Å; G79-R83 WeakPolarHBondContact O-CG 3.37Å
80	I	90.8	Very high	87	Confident	39 Å²	39	38.5 Å²	38.5	20%	0.2	20%	0.198	C	C	.	.	H	α-helix	trans	-75.4	-50.7	173.3	-65.7	169.9	0	0	0	109.9	W76 A77 N82 R83 N84 P432	W76-I80 HydrophobicContact CD2-CD1 4.02Å; W76-I80 HydrophobicContact CH2-CD1 4.34Å; W76-I80 HydrophobicContact CZ2-CD1 3.74Å; W76-I80 PolarHBondContact O-N 2.92Å; A77-I80 PolarHBondContact O-N 2.96Å; I80-N82 VanDerWaalsContact C-N 3.33Å; I80-N82 PolarHBondContact O-N 3.46Å; I80-R83 WeakPolarHBondContact O-CB 3.05Å; I80-R83 PolarHBondContact O-N 2.89Å; I80-N84 PolarHBondContact O-N 2.87Å; I80-N84 VanDerWaalsContact O-N 3.08Å; I80-P432 HydrophobicContact CD1-CG 3.9Å
81	W	90	Very high	86.7	Confident	1 Å²	1	41.4 Å²	41.4	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-52.2	-48.1	-179.9	179.9	-89.9	0	0	0	113	A77 R83 N84 N87 H90 Y385 A388 R392 Y425	A77-W81 WeakPolarHBondContact O-CB 3.48Å; A77-W81 PolarHBondContact O-N 2.76Å; W81-R83 VanDerWaalsContact C-N 3.26Å; W81-R83 PolarHBondContact O-N 3.34Å; W81-N84 PolarHBondContact O-N 2.75Å; W81-N87 VanDerWaalsContact O-CB 3.3Å; W81-N87 WeakPolarHBondContact O-CB 3.17Å; W81-N87 PolarHBondContact O-ND2 3.07Å; W81-H90 PolarHBondContact NE1-O 3.29Å; W81-H90 VanDerWaalsContact NE1-O 3.09Å; W81-Y385 AromaticContact CE3-CD1 3.88Å; W81-Y385 HydrophobicContact CE3-CD1 3.88Å; W81-Y385 AromaticContact CE3-CE1 3.67Å; W81-Y385 HydrophobicContact CE3-CE1 3.67Å; W81-Y385 HydrophobicContact CZ3-CD1 4Å; W81-Y385 HydrophobicContact CZ3-CE1 4.05Å; W81-A388 HydrophobicContact CD2-CB 3.58Å; W81-A388 HydrophobicContact CE3-CB 3.84Å; W81-A388 HydrophobicContact CG-CB 4.1Å; W81-A388 HydrophobicContact CH2-CB 4.01Å; W81-A388 HydrophobicContact CZ2-CB 3.76Å; W81-A388 WeakPolarHBondContact CZ2-O 3.47Å; W81-A388 HydrophobicContact CZ3-CB 4.05Å; W81-R392 HydrophobicContact CH2-CB 4.29Å; W81-R392 HydrophobicContact CZ2-CB 4.07Å; W81-Y425 HydrophobicContact CH2-CE2 4.22Å; W81-Y425 AromaticContact CZ3-CE2 3.85Å; W81-Y425 HydrophobicContact CZ3-CE2 3.85Å; W81-Y425 AromaticContact CZ3-CZ 3.84Å
82	N	89.4	Confident	86.6	Confident	24 Å²	24	41.4 Å²	41.4	13%	0.128	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-12.3	-178.8	-71.3	-50	0	0	0	113.9	L78 I80 R91 I92	L78-N82 VanDerWaalsContact O-CB 3.22Å; L78-N82 WeakPolarHBondContact O-CB 3.39Å; L78-N82 VanDerWaalsContact O-CG 3.27Å; L78-N82 PolarHBondContact O-N 3.38Å; L78-N82 PolarHBondContact O-ND2 2.9Å; I80-N82 VanDerWaalsContact C-N 3.33Å; I80-N82 PolarHBondContact O-N 3.46Å; N82-R91 VanDerWaalsContact OD1-CA 3.22Å; N82-R91 WeakPolarHBondContact OD1-CA 3.31Å; N82-I92 PolarHBondContact ND2-O 2.04Å; N82-I92 PolarHBondContact OD1-N 3.48Å
83	R	88.1	Confident	86.4	Confident	216 Å²	216	41.2 Å²	41.2	82%	0.815	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-25.5	173.3	-76.8	174.5	-177.2	-168.4	0.7	113	G79 I80 W81	G79-R83 VanDerWaalsContact O-CD 3.23Å; G79-R83 WeakPolarHBondContact O-CD 3.43Å; G79-R83 WeakPolarHBondContact O-CG 3.37Å; I80-R83 WeakPolarHBondContact O-CB 3.05Å; I80-R83 PolarHBondContact O-N 2.89Å; W81-R83 VanDerWaalsContact C-N 3.26Å; W81-R83 PolarHBondContact O-N 3.34Å
84	N	86.5	Confident	86.2	Confident	9 Å²	9	41.3 Å²	41.3	5%	0.048	21%	0.209	C	C	.	.	S	Bend	trans	-60.4	124.1	178.4	-176.3	-39.1	0	0	0	110	I80 W81 Q86 N87	I80-N84 PolarHBondContact O-N 2.87Å; I80-N84 VanDerWaalsContact O-N 3.08Å; W81-N84 PolarHBondContact O-N 2.75Å; N84-Q86 PolarHBondContact O-N 2.94Å; N84-Q86 VanDerWaalsContact O-N 3.14Å; N84-Q86 WeakPolarHBondContact OD1-CB 3.31Å; N84-Q86 WeakPolarHBondContact OD1-CG 3.37Å; N84-Q86 PolarHBondContact OD1-N 3.26Å; N84-N87 PolarHBondContact O-N 3.02Å
85	P	82	Confident	85.9	Confident	103 Å²	103	41.6 Å²	41.6	67%	0.669	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-64.8	-18.5	-175	25.8	-34.7	0	0	0	114	N87 V88	P85-N87 PolarHBondContact O-N 3.42Å; P85-V88 WeakPolarHBondContact O-CG2 3.38Å
86	Q	81.5	Confident	85.5	Confident	104 Å²	104	40.4 Å²	40.4	49%	0.486	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-71.1	-20.1	172.4	-56.1	-175.9	19.3	0	0	113	N84 H90	N84-Q86 PolarHBondContact O-N 2.94Å; N84-Q86 VanDerWaalsContact O-N 3.14Å; N84-Q86 WeakPolarHBondContact OD1-CB 3.31Å; N84-Q86 WeakPolarHBondContact OD1-CG 3.37Å; N84-Q86 PolarHBondContact OD1-N 3.26Å; Q86-H90 PolarHBondContact O-ND1 3.05Å
87	N	83	Confident	85.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-104.1	14	-170.3	-63.9	-20.9	0	0	0	113.2	W81 N84 P85 N89 H90 R392	W81-N87 VanDerWaalsContact O-CB 3.3Å; W81-N87 WeakPolarHBondContact O-CB 3.17Å; W81-N87 PolarHBondContact O-ND2 3.07Å; N84-N87 PolarHBondContact O-N 3.02Å; P85-N87 PolarHBondContact O-N 3.42Å; N87-N89 VanDerWaalsContact C-N 3.3Å; N87-N89 PolarHBondContact O-N 3.35Å; N87-H90 HydrophobicContact CB-CB 4.39Å; N87-H90 CarbonylContact O-C 3.59Å; N87-H90 WeakPolarHBondContact O-CA 3.42Å; N87-H90 PolarHBondContact O-N 3.05Å; N87-R392 PolarHBondContact OD1-NH1 3.21Å
88	V	77.2	Confident	84.6	Confident	79 Å²	79	42 Å²	42	48%	0.479	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-38.7	-175.3	171.6	0	0	0	0	113.2	P85 H90	P85-V88 WeakPolarHBondContact O-CG2 3.38Å; V88-H90 VanDerWaalsContact C-N 3.33Å
89	N	75.8	Confident	84.4	Confident	126 Å²	126	41.8 Å²	41.8	67%	0.674	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-13.4	175.2	-64.4	-7.3	0	0	0	113.1	N87	N87-N89 VanDerWaalsContact C-N 3.3Å; N87-N89 PolarHBondContact O-N 3.35Å
90	H	79	Confident	84.2	Confident	20 Å²	20	40.9 Å²	40.9	9%	0.093	21%	0.212	C	C	.	.	S	Bend	trans	-110.8	34.9	-166.7	-47.9	114.7	0	0	0	111.1	W81 Q86 N87 V88	W81-H90 PolarHBondContact NE1-O 3.29Å; W81-H90 VanDerWaalsContact NE1-O 3.09Å; Q86-H90 PolarHBondContact O-ND1 3.05Å; N87-H90 HydrophobicContact CB-CB 4.39Å; N87-H90 CarbonylContact O-C 3.59Å; N87-H90 WeakPolarHBondContact O-CA 3.42Å; N87-H90 PolarHBondContact O-N 3.05Å; V88-H90 VanDerWaalsContact C-N 3.33Å
91	R	83.3	Confident	83.6	Confident	61 Å²	61	40.4 Å²	40.4	23%	0.23	21%	0.208	C	C	.	.			trans	-76.6	137.5	-175.2	-77	178.1	169.9	-174.2	0.5	112.4	P42 T43 N82	P42-R91 HydrophobicContact CG-CB 4.4Å; T43-R91 VanDerWaalsContact O-CD 3.22Å; T43-R91 WeakPolarHBondContact O-CD 3.32Å; T43-R91 PolarHBondContact O-NH1 3.05Å; T43-R91 PolarHBondContact OG1-NH1 3.07Å; T43-R91 VanDerWaalsContact OG1-NH1 3.07Å; N82-R91 VanDerWaalsContact OD1-CA 3.22Å; N82-R91 WeakPolarHBondContact OD1-CA 3.31Å
92	I	86.3	Confident	83	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.5	-172.8	-64	162.3	0	0	0	109.2	H47 I49 L78 N82 A388 V391	H47-I92 HydrophobicContact CB-CG1 4.05Å; H47-I92 CarbonylContact O-C 3.55Å; H47-I92 WeakPolarHBondContact O-CA 3.49Å; I49-I92 HydrophobicContact CD1-CG2 4.17Å; I49-I92 HydrophobicContact CG1-CG2 3.86Å; L78-I92 HydrophobicContact CD2-CB 4.06Å; L78-I92 HydrophobicContact CD2-CG2 3.78Å; N82-I92 PolarHBondContact ND2-O 2.04Å; N82-I92 PolarHBondContact OD1-N 3.48Å; I92-A388 VanDerWaalsContact CD1-CA 3.46Å; I92-A388 HydrophobicContact CD1-CB 3.51Å; I92-V391 HydrophobicContact CD1-CB 4.03Å; I92-V391 HydrophobicContact CD1-CG1 4.04Å; I92-V391 HydrophobicContact CD1-CG2 4.2Å; I92-V391 HydrophobicContact CG1-CB 4.47Å; I92-V391 HydrophobicContact CG1-CG1 4.04Å; I92-V391 HydrophobicContact CG1-CG2 4.48Å
93	G	86.2	Confident	82.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	165.9	170.3	0	0	0	0	0	112.5	I40 H47 R48 I49	I40-G93 CarbonylContact O-C 3.44Å; I40-G93 WeakPolarHBondContact O-CA 3.39Å; H47-G93 PolarHBondContact O-N 2.84Å; R48-G93 WeakPolarHBondContact CA-O 3.08Å; I49-G93 PolarHBondContact N-O 2.01Å
94	L	87.1	Confident	81.8	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.016	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	131	177.7	-178.5	66.2	0	0	0	109.8	T39 I40 I49 V74 L78 V96	T39-L94 CarbonylContact C-O 3.45Å; T39-L94 VanDerWaalsContact CA-O 3.32Å; T39-L94 WeakPolarHBondContact CA-O 3.08Å; I40-L94 HydrophobicContact CB-CB 4.29Å; I40-L94 HydrophobicContact CD1-CD2 4.37Å; I40-L94 PolarHBondContact N-O 3.18Å; I40-L94 PolarHBondContact O-N 3.49Å; I49-L94 HydrophobicContact CB-CD1 3.99Å; I49-L94 HydrophobicContact CG2-CD1 3.88Å; I49-L94 CarbonylContact O-C 3.5Å; I49-L94 WeakPolarHBondContact O-CA 3.34Å; V74-L94 HydrophobicContact CG1-CD1 3.82Å; V74-L94 HydrophobicContact CG1-CD2 3.86Å; L78-L94 HydrophobicContact CD1-CB 3.87Å; L78-L94 HydrophobicContact CD1-CD1 4.14Å; L78-L94 HydrophobicContact CD1-CD2 4.33Å; L78-L94 HydrophobicContact CD1-CG 4.33Å; L94-V96 HydrophobicContact CD1-CG2 3.95Å; L94-V96 HydrophobicContact CD2-CG2 3.92Å; L94-V96 HydrophobicContact CG-CG2 3.77Å
95	S	84.7	Confident	81.3	Confident	6 Å²	6	43.9 Å²	43.9	4%	0.042	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	110.7	171.2	-66.4	0	0	0	0	109.6	R48 I49 I50 A51	R48-S95 PolarHBondContact NE-OG 3.16Å; R48-S95 PolarHBondContact NH2-OG 3.48Å; I49-S95 PolarHBondContact O-N 2.76Å; I50-S95 WeakPolarHBondContact CA-O 2.93Å; A51-S95 PolarHBondContact N-O 3.22Å
96	V	83.1	Confident	81	Confident	3 Å²	3	39 Å²	39	2%	0.018	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.5	-177.9	163.6	0	0	0	0	111.8	L38 A51 F53 L71 L94	L38-V96 HydrophobicContact CB-CB 4.22Å; L38-V96 PolarHBondContact N-O 2.71Å; L38-V96 PolarHBondContact O-N 3.25Å; A51-V96 HydrophobicContact CB-CG2 4.19Å; A51-V96 WeakPolarHBondContact O-CA 3.27Å; F53-V96 HydrophobicContact CD2-CG1 4.15Å; F53-V96 HydrophobicContact CD2-CG2 4.28Å; F53-V96 HydrophobicContact CE2-CG2 4.21Å; L71-V96 HydrophobicContact CD1-CB 4.19Å; L71-V96 HydrophobicContact CD1-CG1 3.77Å; L71-V96 HydrophobicContact CD1-CG2 3.59Å; L71-V96 HydrophobicContact CD2-CG1 4.15Å; L94-V96 HydrophobicContact CD1-CG2 3.95Å; L94-V96 HydrophobicContact CD2-CG2 3.92Å; L94-V96 HydrophobicContact CG-CG2 3.77Å
97	V	83.3	Confident	81	Confident	17 Å²	17	35.1 Å²	35.1	10%	0.103	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.5	161.2	175.8	0	0	0	0	109.3	T37 A51 A52 F53 V99 Q109 L113	T37-V97 HydrophobicContact CG2-CG2 3.79Å; A51-V97 PolarHBondContact O-N 2.77Å; A52-V97 WeakPolarHBondContact CA-O 3.49Å; F53-V97 PolarHBondContact N-O 2.94Å; V97-V99 HydrophobicContact CG1-CG1 4Å; V97-Q109 HydrophobicContact CG1-CB 4.14Å; V97-L113 HydrophobicContact CB-CD2 4.18Å; V97-L113 HydrophobicContact CG2-CB 4.22Å; V97-L113 HydrophobicContact CG2-CD1 3.88Å; V97-L113 HydrophobicContact CG2-CD2 3.88Å; V97-L113 HydrophobicContact CG2-CG 4.21Å
98	G	81.4	Confident	81	Confident	34 Å²	34	38.2 Å²	38.2	35%	0.351	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	135.5	166.2	0	0	0	0	0	110.5	F53	F53-G98 WeakPolarHBondContact O-CA 3.3Å
99	V	84.4	Confident	81.2	Confident	2 Å²	2	36 Å²	36	1%	0.012	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	166.2	176.4	-57.5	0	0	0	0	110.3	F53 P54 L55 Y56 V97 E105 F106 Q109	F53-V99 WeakPolarHBondContact O-CG2 3.18Å; F53-V99 PolarHBondContact O-N 3.26Å; P54-V99 CarbonylContact C-O 3.51Å; P54-V99 VanDerWaalsContact CA-O 3.31Å; P54-V99 WeakPolarHBondContact CA-O 3.28Å; P54-V99 HydrophobicContact CB-CG2 4.44Å; L55-V99 PolarHBondContact N-O 3.21Å; Y56-V99 PolarHBondContact N-O 3.26Å; V97-V99 HydrophobicContact CG1-CG1 4Å; V99-E105 HydrophobicContact CB-CG 4.3Å; V99-E105 HydrophobicContact CG1-CG 4.39Å; V99-F106 HydrophobicContact CG2-CD2 3.43Å; V99-F106 VanDerWaalsContact CG2-CD2 3.43Å; V99-F106 HydrophobicContact CG2-CE2 3.75Å; V99-F106 HydrophobicContact CG2-CG 4.14Å; V99-Q109 HydrophobicContact CG1-CB 3.62Å; V99-Q109 HydrophobicContact CG1-CG 3.78Å
100	C	84.4	Confident	81.4	Confident	11 Å²	11	30.2 Å²	30.2	7%	0.074	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	167.2	162.8	-48.8	0	0	0	0	110.7	C60 E102 E105	C60-C100 WeakPolarHBondContact CA-SG 3.41Å; C60-C100 HydrophobicContact CB-CB 4.2Å; C60-C100 WeakPolarHBondContact CB-SG 2.93Å; C60-C100 WeakPolarHBondContact SG-CB 3.08Å; C60-C100 CovalentContact SG-SG 2.03Å; C60-C100 PolarHBondContact SG-SG 3.14Å; C100-E102 PolarHBondContact O-N 2.84Å; C100-E105 PolarHBondContact N-OE2 2.86Å
101	F	78.7	Confident	81.4	Confident	28 Å²	28	33.7 Å²	33.7	12%	0.123	17%	0.172	C	C	.	.	S	Bend	trans	-82	52.9	177.6	-161.2	-116	0	0	0	112.7	P54 Y56 D58 Y145	P54-F101 HydrophobicContact CB-CB 4.3Å; P54-F101 HydrophobicContact CB-CD2 3.71Å; P54-F101 HydrophobicContact CB-CG 4.5Å; P54-F101 HydrophobicContact CG-CD2 4.02Å; P54-F101 HydrophobicContact CG-CE2 4.45Å; Y56-F101 PolarHBondContact O-N 3.31Å; D58-F101 WeakPolarHBondContact OD1-CD1 3.18Å; F101-Y145 PolarHBondContact O-OH 2.98Å
102	E	77.8	Confident	81.2	Confident	107 Å²	107	34.2 Å²	34.2	50%	0.5	18%	0.176	S	C	.	.			trans	-116.9	133.1	176.2	-170.1	-173.4	-170.3	0	0	110.7	C100 H104 E105 F106	C100-E102 PolarHBondContact O-N 2.84Å; E102-H104 PolarHBondContact O-N 2.83Å; E102-E105 PolarHBondContact O-N 3.47Å; E102-F106 WeakPolarHBondContact O-CB 3.46Å; E102-F106 PolarHBondContact O-N 2.89Å
103	E	74.3	Confident	80.7	Confident	41 Å²	41	34.3 Å²	34.3	19%	0.192	18%	0.176	C	C	.	.	H	α-helix	trans	-55.4	-48.2	-175.1	-176.4	167.3	177.2	0	0	113.1	F106 V107 Y145 M146 T147	E103-F106 PolarHBondContact O-N 2.83Å; E103-V107 WeakPolarHBondContact O-CG2 3.22Å; E103-V107 PolarHBondContact O-N 2.98Å; E103-V107 VanDerWaalsContact O-N 3.09Å; E103-Y145 HydrophobicContact CB-CD1 3.63Å; E103-Y145 HydrophobicContact CB-CD2 3.98Å; E103-Y145 HydrophobicContact CB-CE1 3.72Å; E103-Y145 HydrophobicContact CB-CE2 4.09Å; E103-Y145 HydrophobicContact CB-CG 3.79Å; E103-Y145 VanDerWaalsContact CD-CA 3.5Å; E103-Y145 HydrophobicContact CG-CD1 3.81Å; E103-Y145 HydrophobicContact CG-CD2 4.01Å; E103-Y145 HydrophobicContact CG-CE1 4.42Å; E103-Y145 HydrophobicContact CG-CG 3.61Å; E103-Y145 VanDerWaalsContact OE1-C 3.28Å; E103-Y145 WeakPolarHBondContact OE1-CA 3.38Å; E103-Y145 VanDerWaalsContact OE2-CD1 3.26Å; E103-Y145 WeakPolarHBondContact OE2-CD1 3.39Å; E103-M146 PolarHBondContact OE1-N 2.76Å; E103-T147 WeakPolarHBondContact OE1-CA 3.38Å; E103-T147 WeakPolarHBondContact OE1-CB 3.12Å; E103-T147 PolarHBondContact OE1-N 3.23Å; E103-T147 PolarHBondContact OE1-OG1 3.32Å
104	H	77.2	Confident	80.3	Confident	123 Å²	123	34.4 Å²	34.4	57%	0.569	18%	0.177	S	C	*	.	H	α-helix	trans	-69.1	-39.1	-176.1	-71.5	-55.6	0	0	0	112.5	E102 T108	E102-H104 PolarHBondContact O-N 2.83Å; H104-T108 WeakPolarHBondContact O-CB 3.32Å; H104-T108 PolarHBondContact O-N 3.01Å; H104-T108 VanDerWaalsContact O-N 3.11Å; H104-T108 PolarHBondContact O-OG1 3.08Å
105	E	77.3	Confident	79.7	Confident	52 Å²	52	39.9 Å²	39.9	24%	0.243	20%	0.202	C	C	.	.	H	α-helix	trans	-65.5	-49	172.6	-174.9	173	-134.2	0	0	110.4	V99 C100 E102 V107 T108 Q109	V99-E105 HydrophobicContact CB-CG 4.3Å; V99-E105 HydrophobicContact CG1-CG 4.39Å; C100-E105 PolarHBondContact N-OE2 2.86Å; E102-E105 PolarHBondContact O-N 3.47Å; E105-V107 VanDerWaalsContact C-N 3.33Å; E105-V107 PolarHBondContact O-N 2.78Å; E105-T108 PolarHBondContact O-N 3.3Å; E105-Q109 HydrophobicContact CG-CG 3.37Å; E105-Q109 VanDerWaalsContact O-CG 3.31Å; E105-Q109 WeakPolarHBondContact O-CG 3.34Å; E105-Q109 PolarHBondContact O-N 3.2Å; E105-Q109 PolarHBondContact OE1-NE2 2.98Å
106	F	76.3	Confident	78.9	Confident	1 Å²	1	42.5 Å²	42.5	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-56.5	-46.4	-174.9	-157.4	-67.3	0	0	0	111.9	A52 P54 V99 E102 E103 S110 I141 Y148	A52-F106 HydrophobicContact CB-CE1 3.79Å; A52-F106 HydrophobicContact CB-CZ 3.77Å; A52-F106 WeakPolarHBondContact O-CZ 3.17Å; P54-F106 HydrophobicContact CB-CE2 4.3Å; P54-F106 HydrophobicContact CG-CE2 4.28Å; V99-F106 HydrophobicContact CG2-CD2 3.43Å; V99-F106 VanDerWaalsContact CG2-CD2 3.43Å; V99-F106 HydrophobicContact CG2-CE2 3.75Å; V99-F106 HydrophobicContact CG2-CG 4.14Å; E102-F106 WeakPolarHBondContact O-CB 3.46Å; E102-F106 PolarHBondContact O-N 2.89Å; E103-F106 PolarHBondContact O-N 2.83Å; F106-S110 VanDerWaalsContact O-CB 3.22Å; F106-S110 WeakPolarHBondContact O-CB 3.49Å; F106-S110 PolarHBondContact O-N 2.86Å; F106-S110 VanDerWaalsContact O-N 3.08Å; F106-S110 PolarHBondContact O-OG 3.37Å; F106-I141 HydrophobicContact CD1-CD1 4.1Å; F106-I141 HydrophobicContact CD2-CG1 4.48Å; F106-I141 HydrophobicContact CE1-CD1 3.39Å; F106-I141 HydrophobicContact CE1-CG1 3.93Å; F106-I141 HydrophobicContact CE2-CD1 4.26Å; F106-I141 HydrophobicContact CE2-CG1 3.86Å; F106-I141 HydrophobicContact CZ-CD1 3.49Å; F106-I141 VanDerWaalsContact CZ-CD1 3.49Å; F106-I141 HydrophobicContact CZ-CG1 3.56Å; F106-Y148 AromaticContact CD1-CD2 3.8Å; F106-Y148 HydrophobicContact CD1-CD2 3.8Å; F106-Y148 AromaticContact CD1-CE2 3.41Å; F106-Y148 HydrophobicContact CD1-CE2 3.41Å; F106-Y148 VanDerWaalsContact CD1-CE2 3.41Å; F106-Y148 HydrophobicContact CE1-CD2 4.37Å; F106-Y148 AromaticContact CE1-CE2 3.65Å; F106-Y148 HydrophobicContact CE1-CE2 3.65Å; F106-Y148 AromaticContact CE1-CZ 3.76Å
107	V	81.3	Confident	78	Confident	22 Å²	22	43.7 Å²	43.7	13%	0.133	23%	0.23	C	C	.	.	H	α-helix	trans	-61.5	-50.5	173.6	174.8	0	0	0	0	111.1	E103 E105 Q109 S110 F111 T147 Y148 F151	E103-V107 WeakPolarHBondContact O-CG2 3.22Å; E103-V107 PolarHBondContact O-N 2.98Å; E103-V107 VanDerWaalsContact O-N 3.09Å; E105-V107 VanDerWaalsContact C-N 3.33Å; E105-V107 PolarHBondContact O-N 2.78Å; V107-Q109 PolarHBondContact O-N 3.32Å; V107-S110 PolarHBondContact O-N 2.83Å; V107-F111 PolarHBondContact O-N 3.31Å; V107-T147 HydrophobicContact CG1-CG2 4.32Å; V107-T147 HydrophobicContact CG2-CG2 3.97Å; V107-Y148 HydrophobicContact CG2-CD2 3.73Å; V107-Y148 HydrophobicContact CG2-CG 4.44Å; V107-F151 HydrophobicContact CG1-CB 4.29Å; V107-F151 HydrophobicContact CG1-CD2 4.43Å; V107-F151 HydrophobicContact CG1-CG 4.37Å
108	T	82.6	Confident	77	Confident	65 Å²	65	44.4 Å²	44.4	40%	0.399	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-45.1	-173	-61.9	0	0	0	0	112	H104 E105 F111 K112	H104-T108 WeakPolarHBondContact O-CB 3.32Å; H104-T108 PolarHBondContact O-N 3.01Å; H104-T108 VanDerWaalsContact O-N 3.11Å; H104-T108 PolarHBondContact O-OG1 3.08Å; E105-T108 PolarHBondContact O-N 3.3Å; T108-F111 PolarHBondContact O-N 2.86Å; T108-K112 HydrophobicContact CG2-CD 4.01Å; T108-K112 WeakPolarHBondContact O-CD 3.49Å; T108-K112 VanDerWaalsContact O-CG 3.28Å; T108-K112 WeakPolarHBondContact O-CG 3.36Å; T108-K112 PolarHBondContact O-N 3.42Å
109	Q	81.2	Confident	76.4	Confident	33 Å²	33	45.1 Å²	45.1	15%	0.154	23%	0.234	C	C	.	.	H	α-helix	trans	-73.5	-33.8	179.6	-53.7	-72.5	29.2	0	0	111.2	V97 V99 E105 V107 K112 L113	V97-Q109 HydrophobicContact CG1-CB 4.14Å; V99-Q109 HydrophobicContact CG1-CB 3.62Å; V99-Q109 HydrophobicContact CG1-CG 3.78Å; E105-Q109 HydrophobicContact CG-CG 3.37Å; E105-Q109 VanDerWaalsContact O-CG 3.31Å; E105-Q109 WeakPolarHBondContact O-CG 3.34Å; E105-Q109 PolarHBondContact O-N 3.2Å; E105-Q109 PolarHBondContact OE1-NE2 2.98Å; V107-Q109 PolarHBondContact O-N 3.32Å; Q109-K112 PolarHBondContact O-N 2.64Å; Q109-L113 WeakPolarHBondContact O-CB 3.49Å; Q109-L113 PolarHBondContact O-N 3.48Å
110	S	79.1	Confident	75.6	Confident	5 Å²	5	48.8 Å²	48.8	4%	0.035	25%	0.25	C	C	.	.	H	α-helix	trans	-61.1	-43.8	171	-63.1	0	0	0	0	112	F106 V107 L113 L114	F106-S110 VanDerWaalsContact O-CB 3.22Å; F106-S110 WeakPolarHBondContact O-CB 3.49Å; F106-S110 PolarHBondContact O-N 2.86Å; F106-S110 VanDerWaalsContact O-N 3.08Å; F106-S110 PolarHBondContact O-OG 3.37Å; V107-S110 PolarHBondContact O-N 2.83Å; S110-L113 PolarHBondContact O-N 2.67Å; S110-L114 PolarHBondContact O-N 2.63Å; S110-L114 VanDerWaalsContact O-N 3.09Å
111	F	80.3	Confident	74.3	Confident	93 Å²	93	53.6 Å²	53.6	41%	0.408	27%	0.271	S	S	.	.	H	α-helix	trans	-64.9	-46.9	175.9	-177.7	-88.9	0	0	0	111.9	V107 T108 L113 L114 H115 F120 F151	V107-F111 PolarHBondContact O-N 3.31Å; T108-F111 PolarHBondContact O-N 2.86Å; F111-L113 VanDerWaalsContact C-N 3.28Å; F111-L113 PolarHBondContact O-N 3.49Å; F111-L114 PolarHBondContact O-N 3.43Å; F111-H115 WeakPolarHBondContact O-CB 3.49Å; F111-H115 PolarHBondContact O-N 2.99Å; F111-F120 HydrophobicContact CD2-CD2 4.43Å; F111-F120 AromaticContact CD2-CE2 3.58Å; F111-F120 HydrophobicContact CD2-CE2 3.58Å; F111-F120 AromaticContact CD2-CZ 3.77Å; F111-F120 HydrophobicContact CD2-CZ 3.77Å; F111-F120 AromaticContact CE2-CD2 3.92Å; F111-F120 HydrophobicContact CE2-CD2 3.92Å; F111-F120 HydrophobicContact CE2-CE1 4.14Å; F111-F120 AromaticContact CE2-CE2 3.41Å; F111-F120 HydrophobicContact CE2-CE2 3.41Å; F111-F120 VanDerWaalsContact CE2-CE2 3.41Å; F111-F120 HydrophobicContact CE2-CG 4.47Å; F111-F120 AromaticContact CE2-CZ 3.55Å; F111-F120 HydrophobicContact CE2-CZ 3.55Å; F111-F120 HydrophobicContact CG-CE2 4.33Å; F111-F120 HydrophobicContact CZ-CD2 4.12Å; F111-F120 HydrophobicContact CZ-CE2 4.05Å; F111-F120 HydrophobicContact CZ-CZ 4.5Å; F111-F151 HydrophobicContact CB-CE2 4.01Å; F111-F151 HydrophobicContact CD2-CE2 4.24Å
112	K	77.6	Confident	72.9	Confident	71 Å²	71	59.7 Å²	59.7	31%	0.309	30%	0.3	S	S	.	.	H	α-helix	trans	-57.6	-40.1	174.9	-75	158.8	166.5	175	0	112.2	F35 T108 Q109 H115 S116	F35-K112 HydrophobicContact CE1-CB 4.22Å; F35-K112 HydrophobicContact CE1-CD 3.83Å; F35-K112 HydrophobicContact CE1-CG 4.43Å; F35-K112 HydrophobicContact CE2-CD 4.34Å; F35-K112 HydrophobicContact CE2-CG 4.4Å; F35-K112 HydrophobicContact CZ-CB 4.22Å; F35-K112 HydrophobicContact CZ-CD 3.52Å; F35-K112 HydrophobicContact CZ-CG 4.02Å; T108-K112 HydrophobicContact CG2-CD 4.01Å; T108-K112 WeakPolarHBondContact O-CD 3.49Å; T108-K112 VanDerWaalsContact O-CG 3.28Å; T108-K112 WeakPolarHBondContact O-CG 3.36Å; T108-K112 PolarHBondContact O-N 3.42Å; Q109-K112 PolarHBondContact O-N 2.64Å; K112-H115 PolarHBondContact O-N 3.09Å; K112-S116 WeakPolarHBondContact O-CB 3.44Å; K112-S116 PolarHBondContact O-N 3.49Å; K112-S116 PolarHBondContact O-OG 3.29Å
113	L	77.4	Confident	71.6	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-64.1	-51.3	178.6	178.1	54.9	0	0	0	111.2	T37 I50 V97 Q109 S110 F111 H115 S116 A117	T37-L113 HydrophobicContact CG2-CD1 3.61Å; I50-L113 HydrophobicContact CG2-CD1 4.29Å; I50-L113 HydrophobicContact CG2-CD2 3.45Å; I50-L113 VanDerWaalsContact CG2-CD2 3.45Å; I50-L113 HydrophobicContact CG2-CG 3.52Å; V97-L113 HydrophobicContact CB-CD2 4.18Å; V97-L113 HydrophobicContact CG2-CB 4.22Å; V97-L113 HydrophobicContact CG2-CD1 3.88Å; V97-L113 HydrophobicContact CG2-CD2 3.88Å; V97-L113 HydrophobicContact CG2-CG 4.21Å; Q109-L113 WeakPolarHBondContact O-CB 3.49Å; Q109-L113 PolarHBondContact O-N 3.48Å; S110-L113 PolarHBondContact O-N 2.67Å; F111-L113 VanDerWaalsContact C-N 3.28Å; F111-L113 PolarHBondContact O-N 3.49Å; L113-H115 VanDerWaalsContact C-N 3.32Å; L113-H115 PolarHBondContact O-N 3.03Å; L113-S116 PolarHBondContact O-N 3.37Å; L113-S116 PolarHBondContact O-OG 3.37Å; L113-A117 PolarHBondContact O-N 3.48Å
114	L	76.5	Confident	70.5	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-39.2	174.2	-71.2	174.1	0	0	0	112.8	I50 S110 F111 A117 G118 Y119 F120 F151 L155 L157	I50-L114 HydrophobicContact CD1-CD2 4.11Å; I50-L114 HydrophobicContact CG2-CD2 4.37Å; S110-L114 PolarHBondContact O-N 2.63Å; S110-L114 VanDerWaalsContact O-N 3.09Å; F111-L114 PolarHBondContact O-N 3.43Å; L114-A117 PolarHBondContact O-N 3.21Å; L114-G118 PolarHBondContact O-N 3.37Å; L114-Y119 HydrophobicContact CB-CD1 4.44Å; L114-Y119 WeakPolarHBondContact O-CB 3.37Å; L114-Y119 PolarHBondContact O-N 3.45Å; L114-F120 HydrophobicContact CB-CD2 4.32Å; L114-F120 HydrophobicContact CB-CE2 3.78Å; L114-F120 HydrophobicContact CD1-CE2 4.38Å; L114-F151 HydrophobicContact CD1-CE2 4.45Å; L114-F151 HydrophobicContact CD1-CZ 3.88Å; L114-L155 HydrophobicContact CD1-CD1 3.76Å; L114-L155 HydrophobicContact CD1-CD2 3.65Å; L114-L155 HydrophobicContact CD1-CG 4.38Å; L114-L157 HydrophobicContact CD2-CD1 3.96Å
115	H	74.2	Confident	69.3	Low	119 Å²	119	64.7 Å²	64.7	55%	0.551	33%	0.33	S	S	*	.	H	α-helix	trans	-64.4	-44.1	174.6	-177.2	-83.8	0	0	0	112	F111 K112 L113 A117 G118 F120	F111-H115 WeakPolarHBondContact O-CB 3.49Å; F111-H115 PolarHBondContact O-N 2.99Å; K112-H115 PolarHBondContact O-N 3.09Å; L113-H115 VanDerWaalsContact C-N 3.32Å; L113-H115 PolarHBondContact O-N 3.03Å; H115-A117 PolarHBondContact O-N 3.23Å; H115-G118 PolarHBondContact O-N 3Å; H115-F120 HydrophobicContact CB-CD2 4.26Å
116	S	67.9	Low	68	Low	61 Å²	61	68.3 Å²	68.3	43%	0.427	35%	0.347	S	S	.	.	H	α-helix	trans	-66.4	-25.1	177	70.1	0	0	0	0	113.6	K112 L113 G118	K112-S116 WeakPolarHBondContact O-CB 3.44Å; K112-S116 PolarHBondContact O-N 3.49Å; K112-S116 PolarHBondContact O-OG 3.29Å; L113-S116 PolarHBondContact O-N 3.37Å; L113-S116 PolarHBondContact O-OG 3.37Å; S116-G118 VanDerWaalsContact C-N 3.33Å
117	A	65.2	Low	66.7	Low	27 Å²	27	76.5 Å²	76.5	22%	0.223	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-5.7	171	0	0	0	0	0	113.4	I50 L113 L114 H115 Q134	I50-A117 HydrophobicContact CD1-CB 3.64Å; L113-A117 PolarHBondContact O-N 3.48Å; L114-A117 PolarHBondContact O-N 3.21Å; H115-A117 PolarHBondContact O-N 3.23Å; A117-Q134 VanDerWaalsContact CB-OE1 3.25Å; A117-Q134 PolarHBondContact O-NE2 2.87Å
118	G	62.7	Low	65	Low	33 Å²	33	81.3 Å²	81.3	34%	0.34	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	1.7	174.9	0	0	0	0	0	116.4	L114 H115 S116 F120 E121	L114-G118 PolarHBondContact O-N 3.37Å; H115-G118 PolarHBondContact O-N 3Å; S116-G118 VanDerWaalsContact C-N 3.33Å; G118-F120 PolarHBondContact O-N 2.93Å; G118-F120 VanDerWaalsContact O-N 3.08Å; G118-E121 PolarHBondContact O-N 2.9Å; G118-E121 VanDerWaalsContact O-N 3.15Å
119	Y	68.2	Low	63.3	Low	49 Å²	49	86.3 Å²	86.3	19%	0.192	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-29.8	-173.9	174	-102.7	0	0	0	114.6	L114 L155 K156 L157	L114-Y119 HydrophobicContact CB-CD1 4.44Å; L114-Y119 WeakPolarHBondContact O-CB 3.37Å; L114-Y119 PolarHBondContact O-N 3.45Å; Y119-L155 HydrophobicContact CD1-CD2 4.39Å; Y119-L155 HydrophobicContact CE1-CD2 3.68Å; Y119-K156 PolarHBondContact OH-N 3.31Å; Y119-L157 HydrophobicContact CD2-CD1 3.86Å; Y119-L157 HydrophobicContact CD2-CD2 4.01Å; Y119-L157 HydrophobicContact CD2-CG 4.06Å; Y119-L157 HydrophobicContact CE2-CD1 3.76Å; Y119-L157 HydrophobicContact CE2-CD2 3.58Å; Y119-L157 HydrophobicContact CE2-CG 3.48Å; Y119-L157 VanDerWaalsContact CE2-CG 3.48Å; Y119-L157 HydrophobicContact CG-CD1 4.37Å
120	F	66.9	Low	61.8	Low	78 Å²	78	90 Å²	90	34%	0.342	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	10.2	-176.6	-67	-67.8	0	0	0	115.2	F111 L114 H115 G118 L155	F111-F120 HydrophobicContact CD2-CD2 4.43Å; F111-F120 AromaticContact CD2-CE2 3.58Å; F111-F120 HydrophobicContact CD2-CE2 3.58Å; F111-F120 AromaticContact CD2-CZ 3.77Å; F111-F120 HydrophobicContact CD2-CZ 3.77Å; F111-F120 AromaticContact CE2-CD2 3.92Å; F111-F120 HydrophobicContact CE2-CD2 3.92Å; F111-F120 HydrophobicContact CE2-CE1 4.14Å; F111-F120 AromaticContact CE2-CE2 3.41Å; F111-F120 HydrophobicContact CE2-CE2 3.41Å; F111-F120 VanDerWaalsContact CE2-CE2 3.41Å; F111-F120 HydrophobicContact CE2-CG 4.47Å; F111-F120 AromaticContact CE2-CZ 3.55Å; F111-F120 HydrophobicContact CE2-CZ 3.55Å; F111-F120 HydrophobicContact CG-CE2 4.33Å; F111-F120 HydrophobicContact CZ-CD2 4.12Å; F111-F120 HydrophobicContact CZ-CE2 4.05Å; F111-F120 HydrophobicContact CZ-CZ 4.5Å; L114-F120 HydrophobicContact CB-CD2 4.32Å; L114-F120 HydrophobicContact CB-CE2 3.78Å; L114-F120 HydrophobicContact CD1-CE2 4.38Å; H115-F120 HydrophobicContact CB-CD2 4.26Å; G118-F120 PolarHBondContact O-N 2.93Å; G118-F120 VanDerWaalsContact O-N 3.08Å; F120-L155 HydrophobicContact CE1-CD2 4.44Å; F120-L155 HydrophobicContact CZ-CD2 3.95Å
121	E	57.2	Low	60.5	Low	113 Å²	113	95.9 Å²	95.9	53%	0.528	48%	0.483	S	S	.	.			trans	47.8	113.5	175.6	-109.3	-155.5	128.5	0	0	118	G118 R123	G118-E121 PolarHBondContact O-N 2.9Å; G118-E121 VanDerWaalsContact O-N 3.15Å; E121-R123 WeakPolarHBondContact OE1-CG 3.38Å; E121-R123 IonicContact OE1-CZ 2.66Å; E121-R123 IonicContact OE1-NE 3.83Å; E121-R123 PolarHBondContact OE1-NE 2.87Å; E121-R123 IonicContact OE1-NH2 3.65Å
122	Q	49.1	Very low	59.5	Low	155 Å²	155	93.4 Å²	93.4	72%	0.724	48%	0.476	S	S	*	.			trans	-133.2	130.1	133.7	-71.4	-163.1	-2.2	0	0	109.6	T124	Q122-T124 WeakPolarHBondContact CB-OG1 3.36Å; Q122-T124 PolarHBondContact O-N 3.47Å
123	R	51.5	Low	58.8	Low	194 Å²	194	92.3 Å²	92.3	73%	0.732	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	16.6	-176.5	-62.4	-179.4	179.2	-177.6	-4.3	114.8	E121	E121-R123 WeakPolarHBondContact OE1-CG 3.38Å; E121-R123 IonicContact OE1-CZ 2.66Å; E121-R123 IonicContact OE1-NE 3.83Å; E121-R123 PolarHBondContact OE1-NE 2.87Å; E121-R123 IonicContact OE1-NH2 3.65Å
124	T	51.6	Low	58.5	Low	113 Å²	113	93.3 Å²	93.3	69%	0.693	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-7.3	-168.2	43.6	0	0	0	0	114.5	Q122	Q122-T124 WeakPolarHBondContact CB-OG1 3.36Å; Q122-T124 PolarHBondContact O-N 3.47Å
125	C	50.7	Low	58.6	Low	70 Å²	70	93.4 Å²	93.4	47%	0.473	48%	0.478	S	S	.	.	S	Bend	trans	-127.6	25.7	174.8	-74.6	0	0	0	0	113.6	C32	C32-C125 HydrophobicContact CB-CB 4.18Å; C32-C125 WeakPolarHBondContact CB-SG 3.41Å; C32-C125 WeakPolarHBondContact SG-CB 3.19Å; C32-C125 CovalentContact SG-SG 2.05Å; C32-C125 PolarHBondContact SG-SG 3.16Å
126	H	50.6	Low	58.9	Low	128 Å²	128	88.2 Å²	88.2	59%	0.593	45%	0.454	S	S	*	.			trans	-111.7	121.8	179	-102.2	-66	0	0	0	113.4
127	E	48.1	Very low	59.8	Low	172 Å²	172	85.4 Å²	85.4	80%	0.804	43%	0.434	S	S	*	.			trans	-73.5	146.5	149.3	-68.4	179.4	145.1	0	0	109	E129	E127-E129 PolarHBondContact O-N 3.28Å
128	P	47.3	Very low	60.7	Low	123 Å²	123	84.3 Å²	84.3	80%	0.799	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-3.8	-163.9	30.7	-36.6	0	0	0	116.1
129	E	45.7	Very low	61.7	Low	170 Å²	170	82.9 Å²	82.9	79%	0.794	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-10.6	-160.2	-66.3	-161.7	136.7	0	0	117.2	E127	E127-E129 PolarHBondContact O-N 3.28Å
130	N	50.6	Low	62.3	Low	111 Å²	111	81.3 Å²	81.3	59%	0.594	40%	0.403	S	S	*	.			trans	-144.1	88.7	177.5	-82	-75.1	0	0	0	113.4	T132	N130-T132 PolarHBondContact O-N 2.59Å
131	Q	51.9	Low	62.8	Low	128 Å²	128	77.6 Å²	77.6	60%	0.598	39%	0.387	S	S	*	.			trans	-71.9	112.3	159.6	-72.1	-175.6	-20.9	0	0	108.6	G405	Q131-G405 PolarHBondContact NE2-O 3.11Å; Q131-G405 VanDerWaalsContact OE1-N 3.16Å
132	T	59.4	Low	63.4	Low	42 Å²	42	73.3 Å²	73.3	26%	0.258	37%	0.37	S	S	.	.			trans	-100.5	125.5	176.7	57.4	0	0	0	0	111.3	K46 N130 Q134	K46-T132 VanDerWaalsContact O-CA 3.32Å; K46-T132 WeakPolarHBondContact O-CA 3.46Å; N130-T132 PolarHBondContact O-N 2.59Å; T132-Q134 PolarHBondContact O-NE2 2.86Å
133	M	61.5	Low	63.8	Low	48 Å²	48	66.4 Å²	66.4	24%	0.236	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	141.8	-177.6	-72.6	-77.7	-85.5	0	0	111	K46 R48 Y135 C403 L416	K46-M133 PolarHBondContact O-N 2.87Å; K46-M133 VanDerWaalsContact O-N 3.16Å; R48-M133 PolarHBondContact N-O 2.82Å; M133-Y135 HydrophobicContact CB-CE2 4.45Å; M133-C403 HydrophobicContact CE-CB 3.65Å; M133-C403 HydrophobicContact SD-CB 4.1Å; M133-L416 HydrophobicContact CE-CD1 3.79Å; M133-L416 HydrophobicContact CE-CD2 3.87Å; M133-L416 HydrophobicContact CE-CG 4.21Å
134	Q	71.4	Confident	64.2	Low	24 Å²	24	60.4 Å²	60.4	11%	0.112	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.1	-162.8	-67.3	169.2	41.1	0	0	112.3	R48 I50 A117 T132	R48-Q134 WeakPolarHBondContact O-CA 3.26Å; I50-Q134 HydrophobicContact CD1-CB 3.88Å; I50-Q134 HydrophobicContact CD1-CG 3.79Å; A117-Q134 VanDerWaalsContact CB-OE1 3.25Å; A117-Q134 PolarHBondContact O-NE2 2.87Å; T132-Q134 PolarHBondContact O-NE2 2.86Å
135	Y	78.1	Confident	65.2	Low	4 Å²	4	56.3 Å²	56.3	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130.4	-177.7	-53.1	-71.6	0	0	0	110.6	H47 R48 I50 M133 P158 V387 M390 V391 L416	H47-Y135 HydrophobicContact CB-CE2 4.16Å; H47-Y135 AromaticContact CD2-CE2 3.9Å; H47-Y135 PolarHBondContact CD2-OH 3.12Å; R48-Y135 PolarHBondContact O-N 2.86Å; I50-Y135 PolarHBondContact N-O 3.34Å; M133-Y135 HydrophobicContact CB-CE2 4.45Å; Y135-P158 HydrophobicContact CD1-CG 4.38Å; Y135-V387 HydrophobicContact CD1-CG1 4.33Å; Y135-V387 HydrophobicContact CD2-CG1 3.67Å; Y135-V387 HydrophobicContact CE2-CG1 4.37Å; Y135-V387 HydrophobicContact CG-CG1 3.64Å; Y135-M390 HydrophobicContact CD1-CE 3.6Å; Y135-M390 HydrophobicContact CE1-CE 3.34Å; Y135-M390 HydrophobicContact CE1-SD 3.91Å; Y135-M390 HydrophobicContact CG-CE 4.5Å; Y135-V391 HydrophobicContact CD2-CG2 4.33Å; Y135-V391 HydrophobicContact CE2-CG2 3.48Å; Y135-V391 VanDerWaalsContact CE2-CG2 3.48Å; Y135-L416 HydrophobicContact CE1-CD1 4.18Å; Y135-L416 HydrophobicContact CE1-CD2 4.2Å
136	L	82.1	Confident	66.3	Low	10 Å²	10	57.9 Å²	57.9	5%	0.052	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	123.3	-175	-173.3	61.6	0	0	0	111.3	I50 L138 L152 L155 A159 L160	I50-L136 HydrophobicContact CG2-CD1 4.38Å; L136-L138 HydrophobicContact CD1-CD2 4.36Å; L136-L138 HydrophobicContact CD2-CD2 3.84Å; L136-L138 HydrophobicContact CG-CD2 3.79Å; L136-L138 HydrophobicContact CG-CG 4.31Å; L136-L152 HydrophobicContact CD2-CD2 4.19Å; L136-L155 HydrophobicContact CD2-CD1 3.81Å; L136-A159 HydrophobicContact CB-CB 4.13Å; L136-A159 HydrophobicContact CD2-CB 4.25Å; L136-A159 HydrophobicContact CG-CB 4.38Å; L136-A159 VanDerWaalsContact O-CA 3.32Å; L136-A159 WeakPolarHBondContact O-CA 3.48Å; L136-L160 PolarHBondContact O-N 3.08Å
137	L	86.3	Confident	67.6	Low	2 Å²	2	54.5 Å²	54.5	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	119.4	177.2	-163.1	93.8	0	0	0	109.4	I49 I50 A51 F53 V74 L160 F162 A383 T384	I49-L137 HydrophobicContact CG2-CB 3.75Å; I49-L137 HydrophobicContact CG2-CD2 4.44Å; I49-L137 HydrophobicContact CG2-CG 4.48Å; I50-L137 PolarHBondContact O-N 3.07Å; A51-L137 HydrophobicContact CB-CB 4.12Å; A51-L137 HydrophobicContact CB-CD2 4.43Å; F53-L137 HydrophobicContact CZ-CD2 4.42Å; V74-L137 HydrophobicContact CG1-CD2 4.21Å; V74-L137 HydrophobicContact CG2-CD2 3.72Å; L137-L160 HydrophobicContact CD1-CB 4.45Å; L137-F162 HydrophobicContact CD1-CD1 4.45Å; L137-F162 HydrophobicContact CD2-CD1 4.23Å; L137-F162 HydrophobicContact CD2-CE1 3.63Å; L137-F162 HydrophobicContact CG-CD1 4.08Å; L137-F162 HydrophobicContact CG-CE1 3.76Å; L137-A383 HydrophobicContact CD1-CB 3.87Å; L137-T384 HydrophobicContact CD1-CG2 4.38Å; L137-T384 HydrophobicContact CD2-CG2 4.35Å
138	L	83.7	Confident	69	Low	3 Å²	3	46.4 Å²	46.4	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.4	-168.9	-62.1	177.6	0	0	0	111.6	L136 Y148 L152 A159 L160 T161 F162 L178	L136-L138 HydrophobicContact CD1-CD2 4.36Å; L136-L138 HydrophobicContact CD2-CD2 3.84Å; L136-L138 HydrophobicContact CG-CD2 3.79Å; L136-L138 HydrophobicContact CG-CG 4.31Å; L138-Y148 HydrophobicContact CD2-CE1 4.14Å; L138-Y148 WeakPolarHBondContact CD2-OH 3.37Å; L138-L152 HydrophobicContact CD1-CD1 4.09Å; L138-L152 HydrophobicContact CD1-CD2 4Å; L138-L152 HydrophobicContact CD2-CD2 4.06Å; L138-A159 HydrophobicContact CD1-CB 3.79Å; L138-A159 HydrophobicContact CG-CB 4.25Å; L138-L160 WeakPolarHBondContact CB-O 3.35Å; L138-L160 PolarHBondContact N-O 2.64Å; L138-T161 WeakPolarHBondContact O-CA 3.05Å; L138-T161 PolarHBondContact O-OG1 3.08Å; L138-F162 WeakPolarHBondContact O-CE1 3.31Å; L138-L178 HydrophobicContact CD1-CD1 3.63Å
139	S	84.6	Confident	70.4	Confident	4 Å²	4	41.3 Å²	41.3	3%	0.028	21%	0.21	C	C	.	.			trans	-71.7	-179.9	176.3	-164.6	0	0	0	0	113.6	A52 F53 P54 I141 F162 T166	A52-S139 WeakPolarHBondContact O-CB 3.27Å; F53-S139 WeakPolarHBondContact CD1-OG 3.36Å; P54-S139 WeakPolarHBondContact CD-OG 3.34Å; S139-I141 PolarHBondContact O-N 2.93Å; S139-F162 VanDerWaalsContact CA-CZ 3.41Å; S139-T166 VanDerWaalsContact O-CG2 3.23Å; S139-T166 WeakPolarHBondContact O-CG2 3.31Å; S139-T166 PolarHBondContact O-OG1 3.09Å
140	E	81.2	Confident	72.1	Confident	15 Å²	15	38.9 Å²	38.9	7%	0.07	20%	0.199	C	C	.	.			trans	-56.4	127.1	164.9	-175.7	178.1	-159	0	0	109.7	P54 A165 N286	P54-E140 WeakPolarHBondContact CG-O 3.49Å; E140-A165 HydrophobicContact CG-CB 4.24Å; E140-N286 WeakPolarHBondContact OE1-CB 3.37Å; E140-N286 PolarHBondContact OE1-ND2 2.7Å
141	I	77.2	Confident	73.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.174	C	C	.	.			trans	-141	145.9	179.5	-56.6	170.3	0	0	0	106.1	F106 S139 Y145 Y148 T166 M169	F106-I141 HydrophobicContact CD1-CD1 4.1Å; F106-I141 HydrophobicContact CD2-CG1 4.48Å; F106-I141 HydrophobicContact CE1-CD1 3.39Å; F106-I141 HydrophobicContact CE1-CG1 3.93Å; F106-I141 HydrophobicContact CE2-CD1 4.26Å; F106-I141 HydrophobicContact CE2-CG1 3.86Å; F106-I141 HydrophobicContact CZ-CD1 3.49Å; F106-I141 VanDerWaalsContact CZ-CD1 3.49Å; F106-I141 HydrophobicContact CZ-CG1 3.56Å; S139-I141 PolarHBondContact O-N 2.93Å; I141-Y145 HydrophobicContact CG2-CD2 3.27Å; I141-Y145 HydrophobicContact CG2-CE2 3.68Å; I141-Y145 HydrophobicContact CG2-CG 4.26Å; I141-Y148 HydrophobicContact CD1-CD1 3.77Å; I141-Y148 HydrophobicContact CD1-CE1 3.34Å; I141-Y148 HydrophobicContact CD1-CE2 4.39Å; I141-Y148 HydrophobicContact CD1-CG 4.43Å; I141-T166 HydrophobicContact CB-CG2 3.54Å; I141-T166 HydrophobicContact CD1-CG2 3.94Å; I141-T166 HydrophobicContact CG1-CG2 3.82Å; I141-M169 HydrophobicContact CG2-CE 4.41Å
142	S	69.1	Low	74.9	Confident	24 Å²	24	28.8 Å²	28.8	17%	0.168	15%	0.148	C	C	.	.			trans	-57.5	129.6	175.7	-178	0	0	0	0	110.9	N144 Y145 M169	S142-N144 PolarHBondContact O-N 2.88Å; S142-N144 VanDerWaalsContact O-N 3.14Å; S142-Y145 VanDerWaalsContact CB-CE1 3.42Å; S142-Y145 PolarHBondContact O-N 3.32Å; S142-M169 WeakPolarHBondContact O-CE 3.5Å
143	P	57	Low	75.9	Confident	10 Å²	10	32 Å²	32	7%	0.065	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.8	-179.1	21.3	-30.8	0	0	0	112.8	Y145 Q168 M214	P143-Y145 VanDerWaalsContact C-N 3.35Å; P143-Y145 PolarHBondContact O-N 3.43Å; P143-Q168 HydrophobicContact CB-CB 4.3Å; P143-Q168 HydrophobicContact CB-CG 4.5Å; P143-M214 HydrophobicContact CB-CG 3.61Å; P143-M214 HydrophobicContact CB-SD 4.37Å; P143-M214 VanDerWaalsContact O-CE 3.25Å; P143-M214 WeakPolarHBondContact O-CE 3.12Å; P143-M214 WeakPolarHBondContact O-CG 3.46Å; P143-M214 VanDerWaalsContact O-SD 3.34Å
144	N	60.3	Low	76.7	Confident	67 Å²	67	33.6 Å²	33.6	36%	0.358	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	0.5	-175.4	-81.1	-39.9	0	0	0	115.1	S142 M146 K210 S211	S142-N144 PolarHBondContact O-N 2.88Å; S142-N144 VanDerWaalsContact O-N 3.14Å; N144-M146 PolarHBondContact O-N 2.93Å; N144-K210 PolarHBondContact ND2-O 3.35Å; N144-S211 VanDerWaalsContact ND2-C 3.32Å; N144-S211 PolarHBondContact ND2-O 3.2Å
145	Y	72.5	Confident	76.8	Confident	27 Å²	27	33 Å²	33	11%	0.106	17%	0.172	C	C	.	.			trans	-72.4	85.6	179.2	-69.1	-9	0	0	0	112.6	F101 E103 I141 S142 P143 T147 Y148 K149	F101-Y145 PolarHBondContact O-OH 2.98Å; E103-Y145 HydrophobicContact CB-CD1 3.63Å; E103-Y145 HydrophobicContact CB-CD2 3.98Å; E103-Y145 HydrophobicContact CB-CE1 3.72Å; E103-Y145 HydrophobicContact CB-CE2 4.09Å; E103-Y145 HydrophobicContact CB-CG 3.79Å; E103-Y145 VanDerWaalsContact CD-CA 3.5Å; E103-Y145 HydrophobicContact CG-CD1 3.81Å; E103-Y145 HydrophobicContact CG-CD2 4.01Å; E103-Y145 HydrophobicContact CG-CE1 4.42Å; E103-Y145 HydrophobicContact CG-CG 3.61Å; E103-Y145 VanDerWaalsContact OE1-C 3.28Å; E103-Y145 WeakPolarHBondContact OE1-CA 3.38Å; E103-Y145 VanDerWaalsContact OE2-CD1 3.26Å; E103-Y145 WeakPolarHBondContact OE2-CD1 3.39Å; I141-Y145 HydrophobicContact CG2-CD2 3.27Å; I141-Y145 HydrophobicContact CG2-CE2 3.68Å; I141-Y145 HydrophobicContact CG2-CG 4.26Å; S142-Y145 VanDerWaalsContact CB-CE1 3.42Å; S142-Y145 PolarHBondContact O-N 3.32Å; P143-Y145 VanDerWaalsContact C-N 3.35Å; P143-Y145 PolarHBondContact O-N 3.43Å; Y145-T147 VanDerWaalsContact C-N 3.27Å; Y145-T147 PolarHBondContact O-N 3.03Å; Y145-Y148 PolarHBondContact O-N 3.21Å; Y145-Y148 VanDerWaalsContact O-N 3.1Å; Y145-K149 PolarHBondContact O-N 2.93Å
146	M	74	Confident	76.4	Confident	103 Å²	103	38.5 Å²	38.5	51%	0.507	20%	0.196	S	C	.	.	H	α-helix	trans	-59	-35.1	178.4	-75.6	-69.1	-70.3	0	0	112.9	E103 N144 Y148 K149 H150	E103-M146 PolarHBondContact OE1-N 2.76Å; N144-M146 PolarHBondContact O-N 2.93Å; M146-Y148 VanDerWaalsContact C-N 3.33Å; M146-Y148 PolarHBondContact O-N 2.84Å; M146-K149 WeakPolarHBondContact O-CB 3.39Å; M146-K149 PolarHBondContact O-N 3.09Å; M146-K149 HydrophobicContact SD-CD 4.13Å; M146-H150 PolarHBondContact O-CD2 2.68Å; M146-H150 PolarHBondContact O-N 2.84Å
147	T	77.9	Confident	76	Confident	57 Å²	57	38.9 Å²	38.9	35%	0.35	20%	0.198	S	C	.	.	H	α-helix	trans	-65.3	-39.4	176.5	-40.4	0	0	0	0	110.5	E103 V107 Y145 H150 F151	E103-T147 WeakPolarHBondContact OE1-CA 3.38Å; E103-T147 WeakPolarHBondContact OE1-CB 3.12Å; E103-T147 PolarHBondContact OE1-N 3.23Å; E103-T147 PolarHBondContact OE1-OG1 3.32Å; V107-T147 HydrophobicContact CG1-CG2 4.32Å; V107-T147 HydrophobicContact CG2-CG2 3.97Å; Y145-T147 VanDerWaalsContact C-N 3.27Å; Y145-T147 PolarHBondContact O-N 3.03Å; T147-H150 PolarHBondContact O-N 3.49Å; T147-F151 WeakPolarHBondContact O-CB 3.39Å; T147-F151 PolarHBondContact O-N 3.49Å
148	Y	77.2	Confident	75.6	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-70.1	-38.7	175.3	-157.3	-98.8	0	0	0	112	F106 V107 L138 I141 Y145 M146 H150 F151 L152 M169	F106-Y148 AromaticContact CD1-CD2 3.8Å; F106-Y148 HydrophobicContact CD1-CD2 3.8Å; F106-Y148 AromaticContact CD1-CE2 3.41Å; F106-Y148 HydrophobicContact CD1-CE2 3.41Å; F106-Y148 VanDerWaalsContact CD1-CE2 3.41Å; F106-Y148 HydrophobicContact CE1-CD2 4.37Å; F106-Y148 AromaticContact CE1-CE2 3.65Å; F106-Y148 HydrophobicContact CE1-CE2 3.65Å; F106-Y148 AromaticContact CE1-CZ 3.76Å; V107-Y148 HydrophobicContact CG2-CD2 3.73Å; V107-Y148 HydrophobicContact CG2-CG 4.44Å; L138-Y148 HydrophobicContact CD2-CE1 4.14Å; L138-Y148 WeakPolarHBondContact CD2-OH 3.37Å; I141-Y148 HydrophobicContact CD1-CD1 3.77Å; I141-Y148 HydrophobicContact CD1-CE1 3.34Å; I141-Y148 HydrophobicContact CD1-CE2 4.39Å; I141-Y148 HydrophobicContact CD1-CG 4.43Å; Y145-Y148 PolarHBondContact O-N 3.21Å; Y145-Y148 VanDerWaalsContact O-N 3.1Å; M146-Y148 VanDerWaalsContact C-N 3.33Å; M146-Y148 PolarHBondContact O-N 2.84Å; Y148-H150 VanDerWaalsContact C-N 3.33Å; Y148-H150 PolarHBondContact O-N 3.35Å; Y148-F151 AromaticContact CD2-CD1 3.93Å; Y148-F151 HydrophobicContact CD2-CD1 3.93Å; Y148-F151 AromaticContact CE2-CD1 3.52Å; Y148-F151 HydrophobicContact CE2-CD1 3.52Å; Y148-F151 AromaticContact CE2-CE1 3.76Å; Y148-F151 HydrophobicContact CE2-CE1 3.76Å; Y148-F151 AromaticContact CZ-CD1 3.94Å; Y148-F151 WeakPolarHBondContact O-CB 3.22Å; Y148-F151 PolarHBondContact O-N 3.01Å; Y148-L152 HydrophobicContact CD1-CD1 3.92Å; Y148-L152 HydrophobicContact CD1-CD2 4.47Å; Y148-L152 HydrophobicContact CD1-CG 3.89Å; Y148-L152 HydrophobicContact CE1-CD1 3.72Å; Y148-L152 HydrophobicContact CE1-CD2 3.7Å; Y148-L152 HydrophobicContact CE1-CG 3.61Å; Y148-L152 PolarHBondContact O-N 2.66Å; Y148-M169 HydrophobicContact CD1-CE 4.41Å; Y148-M169 HydrophobicContact CD1-SD 4.34Å
149	K	77.5	Confident	75.7	Confident	17 Å²	17	39 Å²	39	7%	0.074	20%	0.2	C	C	.	.	H	α-helix	trans	-56.7	-44.9	171.9	-164.3	-170.3	-171.3	-161	0	111.6	Y145 M146 K153 D172 M214 D216	Y145-K149 PolarHBondContact O-N 2.93Å; M146-K149 WeakPolarHBondContact O-CB 3.39Å; M146-K149 PolarHBondContact O-N 3.09Å; M146-K149 HydrophobicContact SD-CD 4.13Å; K149-K153 WeakPolarHBondContact O-CB 3.37Å; K149-K153 PolarHBondContact O-N 3.07Å; K149-K153 VanDerWaalsContact O-N 3.12Å; K149-D172 VanDerWaalsContact CE-CB 3.46Å; K149-D172 WeakPolarHBondContact CE-OD2 3.43Å; K149-D172 IonicContact NZ-OD2 2.72Å; K149-D172 PolarHBondContact NZ-OD2 2.91Å; K149-M214 HydrophobicContact CD-CE 4Å; K149-D216 IonicContact NZ-OD2 3.93Å; K149-D216 PolarHBondContact NZ-OD2 3.15Å
150	H	81.4	Confident	76	Confident	118 Å²	118	39 Å²	39	55%	0.546	20%	0.199	S	C	.	.	H	α-helix	trans	-68.9	-37.6	175.5	-77.8	-66.4	0	0	0	113.2	M146 T147 Y148 K153 S154	M146-H150 PolarHBondContact O-CD2 2.68Å; M146-H150 PolarHBondContact O-N 2.84Å; T147-H150 PolarHBondContact O-N 3.49Å; Y148-H150 VanDerWaalsContact C-N 3.33Å; Y148-H150 PolarHBondContact O-N 3.35Å; H150-K153 PolarHBondContact O-N 3.01Å; H150-S154 PolarHBondContact O-N 3.14Å
151	F	80.8	Confident	76.4	Confident	15 Å²	15	38.3 Å²	38.3	7%	0.066	20%	0.196	C	C	.	.	H	α-helix	trans	-60.6	-52.5	173.6	169.4	-107.1	0	0	0	111.5	V107 F111 L114 T147 Y148 K153 S154 L155	V107-F151 HydrophobicContact CG1-CB 4.29Å; V107-F151 HydrophobicContact CG1-CD2 4.43Å; V107-F151 HydrophobicContact CG1-CG 4.37Å; F111-F151 HydrophobicContact CB-CE2 4.01Å; F111-F151 HydrophobicContact CD2-CE2 4.24Å; L114-F151 HydrophobicContact CD1-CE2 4.45Å; L114-F151 HydrophobicContact CD1-CZ 3.88Å; T147-F151 WeakPolarHBondContact O-CB 3.39Å; T147-F151 PolarHBondContact O-N 3.49Å; Y148-F151 AromaticContact CD2-CD1 3.93Å; Y148-F151 HydrophobicContact CD2-CD1 3.93Å; Y148-F151 AromaticContact CE2-CD1 3.52Å; Y148-F151 HydrophobicContact CE2-CD1 3.52Å; Y148-F151 AromaticContact CE2-CE1 3.76Å; Y148-F151 HydrophobicContact CE2-CE1 3.76Å; Y148-F151 AromaticContact CZ-CD1 3.94Å; Y148-F151 WeakPolarHBondContact O-CB 3.22Å; Y148-F151 PolarHBondContact O-N 3.01Å; F151-K153 VanDerWaalsContact C-N 3.29Å; F151-K153 PolarHBondContact O-N 2.86Å; F151-S154 WeakPolarHBondContact O-CB 3.35Å; F151-S154 PolarHBondContact O-N 2.96Å; F151-S154 PolarHBondContact O-OG 3.31Å; F151-L155 HydrophobicContact CD1-CD1 4.31Å; F151-L155 HydrophobicContact CE1-CD1 3.79Å; F151-L155 HydrophobicContact CE2-CD1 4.29Å; F151-L155 HydrophobicContact CZ-CD1 3.79Å; F151-L155 PolarHBondContact O-N 3.43Å
152	L	79.4	Confident	77.1	Confident	13 Å²	13	38.3 Å²	38.3	7%	0.068	20%	0.196	C	C	.	.	H	α-helix	trans	-56.7	-42.2	175.9	-69.6	-177.3	0	0	0	112.1	L136 L138 Y148 S154 L155 M169 L175	L136-L152 HydrophobicContact CD2-CD2 4.19Å; L138-L152 HydrophobicContact CD1-CD1 4.09Å; L138-L152 HydrophobicContact CD1-CD2 4Å; L138-L152 HydrophobicContact CD2-CD2 4.06Å; Y148-L152 HydrophobicContact CD1-CD1 3.92Å; Y148-L152 HydrophobicContact CD1-CD2 4.47Å; Y148-L152 HydrophobicContact CD1-CG 3.89Å; Y148-L152 HydrophobicContact CE1-CD1 3.72Å; Y148-L152 HydrophobicContact CE1-CD2 3.7Å; Y148-L152 HydrophobicContact CE1-CG 3.61Å; Y148-L152 PolarHBondContact O-N 2.66Å; L152-S154 PolarHBondContact O-N 2.93Å; L152-S154 VanDerWaalsContact O-N 3.17Å; L152-L155 PolarHBondContact O-N 2.75Å; L152-M169 HydrophobicContact CD1-SD 4.11Å; L152-L175 HydrophobicContact CB-CD2 3.91Å
153	K	80.1	Confident	78	Confident	110 Å²	110	37.1 Å²	37.1	48%	0.478	19%	0.188	S	C	.	.	H	α-helix	trans	-63.6	-18.2	177.3	-173.8	168.8	-178.1	153.4	0	114.1	K149 H150 F151 S174 L175	K149-K153 WeakPolarHBondContact O-CB 3.37Å; K149-K153 PolarHBondContact O-N 3.07Å; K149-K153 VanDerWaalsContact O-N 3.12Å; H150-K153 PolarHBondContact O-N 3.01Å; F151-K153 VanDerWaalsContact C-N 3.29Å; F151-K153 PolarHBondContact O-N 2.86Å; K153-S174 WeakPolarHBondContact CD-OG 3.47Å; K153-S174 WeakPolarHBondContact CE-OG 3.32Å; K153-S174 PolarHBondContact NZ-OG 3.3Å; K153-L175 HydrophobicContact CB-CD2 4.02Å
154	S	78.1	Confident	79.5	Confident	80 Å²	80	37 Å²	37	56%	0.559	19%	0.187	S	C	*	.	H	α-helix	trans	-89.7	-15.1	173.7	75.6	0	0	0	0	113.9	H150 F151 L152	H150-S154 PolarHBondContact O-N 3.14Å; F151-S154 WeakPolarHBondContact O-CB 3.35Å; F151-S154 PolarHBondContact O-N 2.96Å; F151-S154 PolarHBondContact O-OG 3.31Å; L152-S154 PolarHBondContact O-N 2.93Å; L152-S154 VanDerWaalsContact O-N 3.17Å
155	L	74.8	Confident	80.7	Confident	12 Å²	12	34 Å²	34	6%	0.063	17%	0.171	C	C	.	.			trans	-89.6	131.8	179	-62.6	177.5	0	0	0	110.7	L114 Y119 F120 L136 F151 L152	L114-L155 HydrophobicContact CD1-CD1 3.76Å; L114-L155 HydrophobicContact CD1-CD2 3.65Å; L114-L155 HydrophobicContact CD1-CG 4.38Å; Y119-L155 HydrophobicContact CD1-CD2 4.39Å; Y119-L155 HydrophobicContact CE1-CD2 3.68Å; F120-L155 HydrophobicContact CE1-CD2 4.44Å; F120-L155 HydrophobicContact CZ-CD2 3.95Å; L136-L155 HydrophobicContact CD2-CD1 3.81Å; F151-L155 HydrophobicContact CD1-CD1 4.31Å; F151-L155 HydrophobicContact CE1-CD1 3.79Å; F151-L155 HydrophobicContact CE2-CD1 4.29Å; F151-L155 HydrophobicContact CZ-CD1 3.79Å; F151-L155 PolarHBondContact O-N 3.43Å; L152-L155 PolarHBondContact O-N 2.75Å
156	K	68.9	Low	81.4	Confident	120 Å²	120	32.9 Å²	32.9	52%	0.522	17%	0.167	S	C	.	.			trans	-95.6	8	173.7	-67.9	-166.5	172.6	-165	0	113.4	Y119 A410 G413	Y119-K156 PolarHBondContact OH-N 3.31Å; K156-A410 HydrophobicContact CD-CB 4.08Å; K156-G413 WeakPolarHBondContact O-CA 3.29Å
157	L	74.3	Confident	82	Confident	18 Å²	18	28 Å²	28	9%	0.094	14%	0.144	C	C	.	.	S	Bend	trans	-74.7	146.8	175.6	-67.5	173.3	0	0	0	110.9	L114 Y119 S177	L114-L157 HydrophobicContact CD2-CD1 3.96Å; Y119-L157 HydrophobicContact CD2-CD1 3.86Å; Y119-L157 HydrophobicContact CD2-CD2 4.01Å; Y119-L157 HydrophobicContact CD2-CG 4.06Å; Y119-L157 HydrophobicContact CE2-CD1 3.76Å; Y119-L157 HydrophobicContact CE2-CD2 3.58Å; Y119-L157 HydrophobicContact CE2-CG 3.48Å; Y119-L157 VanDerWaalsContact CE2-CG 3.48Å; Y119-L157 HydrophobicContact CG-CD1 4.37Å; L157-S177 PolarHBondContact O-OG 3.46Å
158	P	77.6	Confident	82.4	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.013	13%	0.129	C	C	.	.			trans	-64.4	133	160.1	30	-34.4	0	0	0	109.2	Y135 L416 L420	Y135-P158 HydrophobicContact CD1-CG 4.38Å; P158-L416 HydrophobicContact CG-CB 3.98Å; P158-L420 HydrophobicContact CB-CD2 3.98Å
159	A	85.8	Confident	82.8	Confident	6 Å²	6	25.7 Å²	25.7	5%	0.05	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	131.5	178.2	0	0	0	0	0	110.1	L136 L138 S177 L178 F179	L136-A159 HydrophobicContact CB-CB 4.13Å; L136-A159 HydrophobicContact CD2-CB 4.25Å; L136-A159 HydrophobicContact CG-CB 4.38Å; L136-A159 VanDerWaalsContact O-CA 3.32Å; L136-A159 WeakPolarHBondContact O-CA 3.48Å; L138-A159 HydrophobicContact CD1-CB 3.79Å; L138-A159 HydrophobicContact CG-CB 4.25Å; A159-S177 PolarHBondContact N-O 3.45Å; A159-L178 HydrophobicContact CB-CD1 4.4Å; A159-L178 WeakPolarHBondContact O-CA 3.31Å; A159-F179 PolarHBondContact O-N 3.26Å
160	L	90.5	Very high	83.2	Confident	3 Å²	3	26.2 Å²	26.2	2%	0.016	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.6	170.7	-79.3	77.7	0	0	0	109.8	L136 L137 L138 F179 A383 A386 V387 L420 F442	L136-L160 PolarHBondContact O-N 3.08Å; L137-L160 HydrophobicContact CD1-CB 4.45Å; L138-L160 WeakPolarHBondContact CB-O 3.35Å; L138-L160 PolarHBondContact N-O 2.64Å; L160-F179 WeakPolarHBondContact CA-O 3.38Å; L160-F179 HydrophobicContact CD1-CB 4.38Å; L160-F179 HydrophobicContact CG-CB 3.93Å; L160-A383 HydrophobicContact CB-CB 4.3Å; L160-A383 HydrophobicContact CD2-CB 3.92Å; L160-A383 WeakPolarHBondContact CD2-O 3.18Å; L160-A386 HydrophobicContact CD2-CB 3.73Å; L160-V387 HydrophobicContact CD1-CG2 3.66Å; L160-V387 HydrophobicContact CD2-CG2 4.08Å; L160-V387 HydrophobicContact CG-CG2 4.42Å; L160-L420 HydrophobicContact CD1-CD1 4.31Å; L160-L420 HydrophobicContact CD1-CD2 3.51Å; L160-F442 HydrophobicContact CD2-CZ 4.16Å
161	T	90.8	Very high	83.1	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	150.7	164.4	-161.3	0	0	0	0	112.4	L138 T166 A167 L178 F179 S180 T181	L138-T161 WeakPolarHBondContact O-CA 3.05Å; L138-T161 PolarHBondContact O-OG1 3.08Å; T161-T166 VanDerWaalsContact OG1-CB 3.29Å; T161-T166 WeakPolarHBondContact OG1-CB 3.48Å; T161-T166 PolarHBondContact OG1-OG1 3.02Å; T161-A167 HydrophobicContact CG2-CB 4.47Å; T161-L178 HydrophobicContact CG2-CD1 4.18Å; T161-F179 PolarHBondContact N-O 3.06Å; T161-S180 VanDerWaalsContact O-CA 3.3Å; T161-S180 WeakPolarHBondContact O-CA 3.41Å; T161-S180 PolarHBondContact O-OG 3.33Å; T161-T181 PolarHBondContact O-N 3.49Å; T161-T181 PolarHBondContact O-OG1 2.78Å
162	F	90.9	Very high	83.1	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.			trans	-125.5	12.7	-175.1	54.1	-104.8	0	0	0	113.1	F53 T70 L137 L138 S139 T181 T376 A379 A380 A383	F53-F162 AromaticContact CE1-CZ 3.75Å; F53-F162 HydrophobicContact CE1-CZ 3.75Å; F53-F162 HydrophobicContact CZ-CZ 4.1Å; T70-F162 HydrophobicContact CG2-CD2 4.06Å; T70-F162 HydrophobicContact CG2-CE2 3.45Å; T70-F162 VanDerWaalsContact CG2-CE2 3.45Å; T70-F162 HydrophobicContact CG2-CZ 3.82Å; L137-F162 HydrophobicContact CD1-CD1 4.45Å; L137-F162 HydrophobicContact CD2-CD1 4.23Å; L137-F162 HydrophobicContact CD2-CE1 3.63Å; L137-F162 HydrophobicContact CG-CD1 4.08Å; L137-F162 HydrophobicContact CG-CE1 3.76Å; L138-F162 WeakPolarHBondContact O-CE1 3.31Å; S139-F162 VanDerWaalsContact CA-CZ 3.41Å; F162-T181 WeakPolarHBondContact CA-OG1 3.46Å; F162-T181 WeakPolarHBondContact CB-OG1 3.49Å; F162-T376 HydrophobicContact CD2-CG2 4.31Å; F162-A379 VanDerWaalsContact CB-C 3.5Å; F162-A379 HydrophobicContact CB-CB 3.86Å; F162-A379 WeakPolarHBondContact CB-O 3.31Å; F162-A379 WeakPolarHBondContact O-CB 3.29Å; F162-A380 HydrophobicContact CB-CB 4.23Å; F162-A380 HydrophobicContact CD1-CB 3.94Å; F162-A380 HydrophobicContact CD2-CB 3.87Å; F162-A380 HydrophobicContact CE1-CB 4.23Å; F162-A380 HydrophobicContact CE2-CB 4.19Å; F162-A380 HydrophobicContact CG-CB 3.73Å; F162-A380 HydrophobicContact CZ-CB 4.33Å; F162-A383 HydrophobicContact CB-CB 4.32Å; F162-A383 HydrophobicContact CD1-CB 4.41Å
163	S	88.8	Confident	82.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.139	C	C	.	.			trans	-118.7	141.8	177.2	171.8	0	0	0	0	111.2	A165 T166 A167 D287	S163-A165 VanDerWaalsContact C-N 3.26Å; S163-A165 PolarHBondContact O-N 3.1Å; S163-A165 PolarHBondContact OG-N 2.82Å; S163-T166 WeakPolarHBondContact CB-OG1 3.45Å; S163-T166 PolarHBondContact O-OG1 3.39Å; S163-A167 WeakPolarHBondContact O-CB 3.25Å; S163-A167 PolarHBondContact O-N 3.12Å; S163-D287 WeakPolarHBondContact CA-OD2 3.49Å; S163-D287 WeakPolarHBondContact CB-OD2 3.38Å; S163-D287 PolarHBondContact OG-OD2 3.1Å
164	T	87.9	Confident	82.6	Confident	7 Å²	7	21.7 Å²	21.7	4%	0.043	13%	0.131	C	C	.	.	H	α-helix	trans	-61.5	-33	174.8	41.8	0	0	0	0	112.6	A167 Q168 A182 P183 Y188 N286 D287	T164-A167 PolarHBondContact O-N 2.77Å; T164-Q168 PolarHBondContact O-N 3.42Å; T164-A182 HydrophobicContact CG2-CB 4.28Å; T164-P183 HydrophobicContact CG2-CG 3.85Å; T164-Y188 HydrophobicContact CG2-CE2 4.27Å; T164-N286 VanDerWaalsContact OG1-C 3.24Å; T164-N286 WeakPolarHBondContact OG1-CA 3.48Å; T164-D287 WeakPolarHBondContact CB-OD1 3.41Å; T164-D287 VanDerWaalsContact CG2-OD1 3.24Å; T164-D287 WeakPolarHBondContact CG2-OD1 3.47Å; T164-D287 PolarHBondContact N-OD1 3.09Å; T164-D287 VanDerWaalsContact N-OD1 3.07Å; T164-D287 PolarHBondContact N-OD2 3.04Å; T164-D287 PolarHBondContact OG1-N 3.1Å; T164-D287 PolarHBondContact OG1-OD1 2.67Å; T164-D287 PolarHBondContact OG1-OD2 3.5Å
165	A	85.3	Confident	82.6	Confident	4 Å²	4	18.3 Å²	18.3	3%	0.033	11%	0.107	C	C	.	.	H	α-helix	trans	-65.2	-48.2	-179.1	0	0	0	0	0	112.2	E140 S163 Q168 T285 N286	E140-A165 HydrophobicContact CG-CB 4.24Å; S163-A165 VanDerWaalsContact C-N 3.26Å; S163-A165 PolarHBondContact O-N 3.1Å; S163-A165 PolarHBondContact OG-N 2.82Å; A165-Q168 WeakPolarHBondContact O-CB 3.32Å; A165-Q168 WeakPolarHBondContact O-CG 3.32Å; A165-Q168 PolarHBondContact O-N 2.64Å; A165-T285 WeakPolarHBondContact CA-O 3.29Å; A165-N286 HydrophobicContact CB-CB 4.24Å
166	T	86.6	Confident	82.7	Confident	3 Å²	3	23.1 Å²	23.1	2%	0.018	13%	0.133	C	C	.	.	H	α-helix	trans	-73.7	-30.1	174.8	32.5	0	0	0	0	113.3	S139 I141 T161 S163 Q168 M169	S139-T166 VanDerWaalsContact O-CG2 3.23Å; S139-T166 WeakPolarHBondContact O-CG2 3.31Å; S139-T166 PolarHBondContact O-OG1 3.09Å; I141-T166 HydrophobicContact CB-CG2 3.54Å; I141-T166 HydrophobicContact CD1-CG2 3.94Å; I141-T166 HydrophobicContact CG1-CG2 3.82Å; T161-T166 VanDerWaalsContact OG1-CB 3.29Å; T161-T166 WeakPolarHBondContact OG1-CB 3.48Å; T161-T166 PolarHBondContact OG1-OG1 3.02Å; S163-T166 WeakPolarHBondContact CB-OG1 3.45Å; S163-T166 PolarHBondContact O-OG1 3.39Å; T166-Q168 PolarHBondContact O-N 2.79Å; T166-Q168 VanDerWaalsContact O-N 3.09Å; T166-M169 WeakPolarHBondContact O-CB 3.26Å; T166-M169 PolarHBondContact O-N 3.08Å
167	A	88	Confident	83.1	Confident	2 Å²	2	18.6 Å²	18.6	2%	0.017	12%	0.116	C	C	.	.	H	α-helix	trans	-58.4	-20.9	173.8	0	0	0	0	0	112.5	T161 S163 T164 M169 K170 T184	T161-A167 HydrophobicContact CG2-CB 4.47Å; S163-A167 WeakPolarHBondContact O-CB 3.25Å; S163-A167 PolarHBondContact O-N 3.12Å; T164-A167 PolarHBondContact O-N 2.77Å; A167-M169 VanDerWaalsContact C-N 3.34Å; A167-M169 PolarHBondContact O-N 3.34Å; A167-K170 WeakPolarHBondContact O-CB 3.44Å; A167-T184 HydrophobicContact CB-CG2 4.28Å
168	Q	86.6	Confident	83.7	Confident	9 Å²	9	18 Å²	18	4%	0.042	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-62.7	-34.3	171.2	-57.6	-170.6	34.9	0	0	113.6	P143 T164 A165 T166 K170 S171 S212 M214 A217 T285	P143-Q168 HydrophobicContact CB-CB 4.3Å; P143-Q168 HydrophobicContact CB-CG 4.5Å; T164-Q168 PolarHBondContact O-N 3.42Å; A165-Q168 WeakPolarHBondContact O-CB 3.32Å; A165-Q168 WeakPolarHBondContact O-CG 3.32Å; A165-Q168 PolarHBondContact O-N 2.64Å; T166-Q168 PolarHBondContact O-N 2.79Å; T166-Q168 VanDerWaalsContact O-N 3.09Å; Q168-K170 PolarHBondContact O-N 2.81Å; Q168-K170 VanDerWaalsContact O-N 3.13Å; Q168-S171 VanDerWaalsContact O-CB 3.32Å; Q168-S171 WeakPolarHBondContact O-CB 3.39Å; Q168-S171 PolarHBondContact O-N 3.39Å; Q168-S171 PolarHBondContact O-OG 2.78Å; Q168-S212 PolarHBondContact NE2-O 2.95Å; Q168-M214 HydrophobicContact CB-CG 4.03Å; Q168-M214 HydrophobicContact CB-SD 4.13Å; Q168-A217 HydrophobicContact CB-CB 4.26Å; Q168-T285 PolarHBondContact NE2-O 2.91Å
169	M	84.6	Confident	84.3	Confident	1 Å²	1	17.9 Å²	17.9	1%	0.005	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-61.3	-26.7	-176.6	-64.7	-172.2	177.8	0	0	112.7	I141 S142 Y148 L152 T166 A167 S171 D172 L175 L178 M214	I141-M169 HydrophobicContact CG2-CE 4.41Å; S142-M169 WeakPolarHBondContact O-CE 3.5Å; Y148-M169 HydrophobicContact CD1-CE 4.41Å; Y148-M169 HydrophobicContact CD1-SD 4.34Å; L152-M169 HydrophobicContact CD1-SD 4.11Å; T166-M169 WeakPolarHBondContact O-CB 3.26Å; T166-M169 PolarHBondContact O-N 3.08Å; A167-M169 VanDerWaalsContact C-N 3.34Å; A167-M169 PolarHBondContact O-N 3.34Å; M169-S171 PolarHBondContact O-N 2.87Å; M169-D172 PolarHBondContact O-N 2.68Å; M169-L175 HydrophobicContact CB-CD1 4.11Å; M169-L178 HydrophobicContact CB-CD2 4.33Å; M169-M214 VanDerWaalsContact CA-SD 3.57Å; M169-M214 HydrophobicContact CB-SD 4.27Å; M169-M214 HydrophobicContact CG-SD 3.84Å
170	K	85.3	Confident	84.6	Confident	27 Å²	27	17.6 Å²	17.6	12%	0.117	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-58.4	-13.9	174.2	-158	-168.6	173.4	79.8	0	114.5	A167 Q168 D172 L178 T184 R445 L446 V447	A167-K170 WeakPolarHBondContact O-CB 3.44Å; Q168-K170 PolarHBondContact O-N 2.81Å; Q168-K170 VanDerWaalsContact O-N 3.13Å; K170-D172 PolarHBondContact O-N 3.4Å; K170-L178 HydrophobicContact CB-CD2 4.14Å; K170-L178 PolarHBondContact NZ-O 3.12Å; K170-T184 HydrophobicContact CD-CG2 3.79Å; K170-R445 WeakPolarHBondContact CE-O 3.38Å; K170-R445 PolarHBondContact NZ-O 2.93Å; K170-L446 VanDerWaalsContact NZ-C 3.29Å; K170-L446 PolarHBondContact NZ-O 3.19Å; K170-V447 HydrophobicContact CD-CG2 3.97Å; K170-V447 VanDerWaalsContact CE-CG2 3.4Å
171	S	80.2	Confident	84.7	Confident	14 Å²	14	17.8 Å²	17.8	10%	0.098	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-66.2	-17.9	170.8	58.5	0	0	0	0	113.6	Q168 M169 D216 A217 R220	Q168-S171 VanDerWaalsContact O-CB 3.32Å; Q168-S171 WeakPolarHBondContact O-CB 3.39Å; Q168-S171 PolarHBondContact O-N 3.39Å; Q168-S171 PolarHBondContact O-OG 2.78Å; M169-S171 PolarHBondContact O-N 2.87Å; S171-D216 WeakPolarHBondContact OG-CB 3.34Å; S171-A217 PolarHBondContact OG-N 2.81Å; S171-R220 PolarHBondContact O-NE 3.3Å; S171-R220 PolarHBondContact O-NH2 2.86Å
172	D	80	Confident	84.6	Confident	31 Å²	31	17.9 Å²	17.9	17%	0.166	11%	0.112	C	C	.	.	S	Bend	trans	-80.5	118.9	169.3	-168.5	-46.7	0	0	0	111	K149 M169 K170 S174 L175	K149-D172 VanDerWaalsContact CE-CB 3.46Å; K149-D172 WeakPolarHBondContact CE-OD2 3.43Å; K149-D172 IonicContact NZ-OD2 2.72Å; K149-D172 PolarHBondContact NZ-OD2 2.91Å; M169-D172 PolarHBondContact O-N 2.68Å; K170-D172 PolarHBondContact O-N 3.4Å; D172-S174 PolarHBondContact O-N 2.97Å; D172-S174 WeakPolarHBondContact OD1-CB 3.25Å; D172-S174 PolarHBondContact OD1-N 3.26Å; D172-S174 PolarHBondContact OD1-OG 2.84Å; D172-L175 PolarHBondContact O-N 2.84Å; D172-L175 VanDerWaalsContact O-N 3.11Å
173	A	74.3	Confident	84.6	Confident	70 Å²	70	18.1 Å²	18.1	58%	0.579	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	2.6	-178.4	0	0	0	0	0	115.2	N176	A173-N176 PolarHBondContact O-ND2 2.83Å; A173-N176 PolarHBondContact O-OD1 2.68Å
174	S	75.1	Confident	84.6	Confident	46 Å²	46	18.6 Å²	18.6	32%	0.322	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-6.7	171.8	63.3	0	0	0	0	114.7	K153 D172 N176	K153-S174 WeakPolarHBondContact CD-OG 3.47Å; K153-S174 WeakPolarHBondContact CE-OG 3.32Å; K153-S174 PolarHBondContact NZ-OG 3.3Å; D172-S174 PolarHBondContact O-N 2.97Å; D172-S174 WeakPolarHBondContact OD1-CB 3.25Å; D172-S174 PolarHBondContact OD1-N 3.26Å; D172-S174 PolarHBondContact OD1-OG 2.84Å; S174-N176 VanDerWaalsContact C-N 3.32Å; S174-N176 PolarHBondContact O-N 3.35Å
175	L	77.7	Confident	84.7	Confident	10 Å²	10	19.1 Å²	19.1	5%	0.052	12%	0.119	C	C	.	.			trans	-94.6	49.3	176.5	-64.7	-178.5	0	0	0	112.4	L152 K153 M169 D172 S177 L178	L152-L175 HydrophobicContact CB-CD2 3.91Å; K153-L175 HydrophobicContact CB-CD2 4.02Å; M169-L175 HydrophobicContact CB-CD1 4.11Å; D172-L175 PolarHBondContact O-N 2.84Å; D172-L175 VanDerWaalsContact O-N 3.11Å; L175-S177 PolarHBondContact O-N 2.91Å; L175-S177 VanDerWaalsContact O-N 3.13Å; L175-L178 HydrophobicContact CB-CB 4.27Å; L175-L178 HydrophobicContact CD1-CD2 4.41Å; L175-L178 WeakPolarHBondContact O-CB 3.36Å; L175-L178 PolarHBondContact O-N 3.19Å; L175-L178 VanDerWaalsContact O-N 3.1Å
176	N	77.1	Confident	84.9	Confident	112 Å²	112	20.7 Å²	20.7	60%	0.599	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-0.9	-173.9	-64	-33.8	0	0	0	115.1	A173 S174 L446	A173-N176 PolarHBondContact O-ND2 2.83Å; A173-N176 PolarHBondContact O-OD1 2.68Å; S174-N176 VanDerWaalsContact C-N 3.32Å; S174-N176 PolarHBondContact O-N 3.35Å; N176-L446 VanDerWaalsContact O-CD1 3.25Å; N176-L446 WeakPolarHBondContact O-CD1 3.49Å
177	S	78	Confident	85.1	Confident	25 Å²	25	20.6 Å²	20.6	18%	0.175	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	3	171.2	60.6	0	0	0	0	113.6	L157 A159 L175 F179	L157-S177 PolarHBondContact O-OG 3.46Å; A159-S177 PolarHBondContact N-O 3.45Å; L175-S177 PolarHBondContact O-N 2.91Å; L175-S177 VanDerWaalsContact O-N 3.13Å; S177-F179 WeakPolarHBondContact O-CD2 3.41Å
178	L	86.9	Confident	85.4	Confident	6 Å²	6	20.7 Å²	20.7	3%	0.031	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	109.2	-180	179.2	59.3	0	0	0	111.5	L138 A159 T161 M169 K170 L175	L138-L178 HydrophobicContact CD1-CD1 3.63Å; A159-L178 HydrophobicContact CB-CD1 4.4Å; A159-L178 WeakPolarHBondContact O-CA 3.31Å; T161-L178 HydrophobicContact CG2-CD1 4.18Å; M169-L178 HydrophobicContact CB-CD2 4.33Å; K170-L178 HydrophobicContact CB-CD2 4.14Å; K170-L178 PolarHBondContact NZ-O 3.12Å; L175-L178 HydrophobicContact CB-CB 4.27Å; L175-L178 HydrophobicContact CD1-CD2 4.41Å; L175-L178 WeakPolarHBondContact O-CB 3.36Å; L175-L178 PolarHBondContact O-N 3.19Å; L175-L178 VanDerWaalsContact O-N 3.1Å
179	F	90.8	Very high	85.6	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	151.2	173.9	-69.3	-108.6	0	0	0	110.4	A159 L160 T161 S177 T417 L420 K421 F442 L446	A159-F179 PolarHBondContact O-N 3.26Å; L160-F179 WeakPolarHBondContact CA-O 3.38Å; L160-F179 HydrophobicContact CD1-CB 4.38Å; L160-F179 HydrophobicContact CG-CB 3.93Å; T161-F179 PolarHBondContact N-O 3.06Å; S177-F179 WeakPolarHBondContact O-CD2 3.41Å; F179-T417 HydrophobicContact CE2-CG2 4.07Å; F179-T417 HydrophobicContact CZ-CG2 4.27Å; F179-L420 HydrophobicContact CB-CD2 4.49Å; F179-L420 HydrophobicContact CD1-CD2 3.94Å; F179-L420 HydrophobicContact CD1-CG 3.87Å; F179-L420 HydrophobicContact CD2-CD2 3.46Å; F179-L420 VanDerWaalsContact CD2-CD2 3.46Å; F179-L420 HydrophobicContact CD2-CG 4.24Å; F179-L420 HydrophobicContact CE1-CB 4.13Å; F179-L420 HydrophobicContact CE1-CD2 3.95Å; F179-L420 HydrophobicContact CE1-CG 3.62Å; F179-L420 HydrophobicContact CE2-CB 4.34Å; F179-L420 HydrophobicContact CE2-CD2 3.48Å; F179-L420 VanDerWaalsContact CE2-CD2 3.48Å; F179-L420 HydrophobicContact CE2-CG 4.02Å; F179-L420 HydrophobicContact CG-CD2 3.71Å; F179-L420 HydrophobicContact CG-CG 4.19Å; F179-L420 HydrophobicContact CZ-CB 3.86Å; F179-L420 HydrophobicContact CZ-CD2 3.72Å; F179-L420 HydrophobicContact CZ-CG 3.7Å; F179-K421 HydrophobicContact CE1-CG 3.98Å; F179-K421 HydrophobicContact CZ-CG 3.91Å; F179-F442 HydrophobicContact CB-CE1 4.33Å; F179-F442 HydrophobicContact CD1-CD1 4.06Å; F179-F442 HydrophobicContact CD1-CD2 4.06Å; F179-F442 HydrophobicContact CD1-CE1 4.27Å; F179-F442 HydrophobicContact CD1-CE2 4.26Å; F179-F442 AromaticContact CD1-CG 3.97Å; F179-F442 HydrophobicContact CD1-CG 3.97Å; F179-F442 HydrophobicContact CD1-CZ 4.37Å; F179-F442 HydrophobicContact CE1-CD2 4.42Å; F179-F442 HydrophobicContact CE1-CG 4.47Å; F179-L446 CarbonylContact C-O 3.6Å; F179-L446 VanDerWaalsContact CA-O 3.3Å; F179-L446 WeakPolarHBondContact CA-O 3.17Å; F179-L446 HydrophobicContact CD1-CB 3.75Å; F179-L446 HydrophobicContact CD2-CD1 4.36Å; F179-L446 HydrophobicContact CE1-CB 3.96Å; F179-L446 HydrophobicContact CE1-CD1 4.24Å; F179-L446 HydrophobicContact CE1-CD2 3.99Å; F179-L446 HydrophobicContact CE1-CG 4.29Å; F179-L446 HydrophobicContact CE2-CD1 3.96Å; F179-L446 HydrophobicContact CG-CB 4.06Å; F179-L446 HydrophobicContact CZ-CB 4.45Å; F179-L446 HydrophobicContact CZ-CD1 3.9Å; F179-L446 HydrophobicContact CZ-CD2 4.22Å; F179-L446 HydrophobicContact CZ-CG 4.43Å
180	S	91.5	Very high	85.9	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	134.8	176.4	-162.9	0	0	0	0	113.8	T161 A182 L446 V447 L448	T161-S180 VanDerWaalsContact O-CA 3.3Å; T161-S180 WeakPolarHBondContact O-CA 3.41Å; T161-S180 PolarHBondContact O-OG 3.33Å; S180-A182 PolarHBondContact OG-N 2.79Å; S180-A182 PolarHBondContact OG-O 2.93Å; S180-A182 VanDerWaalsContact OG-O 3.04Å; S180-L446 PolarHBondContact N-O 3.37Å; S180-V447 CarbonylContact O-C 3.59Å; S180-V447 WeakPolarHBondContact O-CA 3.49Å; S180-L448 PolarHBondContact O-N 2.94Å
181	T	91.6	Very high	86.3	Confident	6 Å²	6	20.3 Å²	20.3	4%	0.037	12%	0.124	C	C	.	.	S	Bend	trans	-98.2	-4.8	167.7	54	0	0	0	0	113.1	T161 F162 A379 L382 A383 F442	T161-T181 PolarHBondContact O-N 3.49Å; T161-T181 PolarHBondContact O-OG1 2.78Å; F162-T181 WeakPolarHBondContact CA-OG1 3.46Å; F162-T181 WeakPolarHBondContact CB-OG1 3.49Å; T181-A379 WeakPolarHBondContact CB-O 3.44Å; T181-A379 PolarHBondContact OG1-O 2.77Å; T181-L382 HydrophobicContact CG2-CB 4.19Å; T181-A383 HydrophobicContact CG2-CB 4.02Å; T181-F442 HydrophobicContact CG2-CE1 4.27Å; T181-F442 HydrophobicContact CG2-CZ 4.39Å
182	A	89.9	Confident	87	Confident	3 Å²	3	19.6 Å²	19.6	3%	0.025	12%	0.119	C	C	.	.	S	Bend	trans	-98.7	154.6	169.8	0	0	0	0	0	110.7	T164 S180	T164-A182 HydrophobicContact CG2-CB 4.28Å; S180-A182 PolarHBondContact OG-N 2.79Å; S180-A182 PolarHBondContact OG-O 2.93Å; S180-A182 VanDerWaalsContact OG-O 3.04Å
183	P	90.5	Very high	87.6	Confident	5 Å²	5	18.8 Å²	18.8	3%	0.032	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-65.9	144.9	174.4	24.7	-31.4	0	0	0	111.6	T164 D187 Y188 P312 I451 I453	T164-P183 HydrophobicContact CG2-CG 3.85Å; P183-D187 HydrophobicContact CB-CB 4.24Å; P183-Y188 HydrophobicContact CB-CD2 4.47Å; P183-Y188 HydrophobicContact CB-CE2 4.01Å; P183-Y188 HydrophobicContact CG-CE2 3.85Å; P183-P312 HydrophobicContact CG-CB 4.1Å; P183-P312 HydrophobicContact CG-CG 4.34Å; P183-I451 HydrophobicContact CB-CD1 4.44Å; P183-I451 HydrophobicContact CB-CG2 4.22Å; P183-I451 HydrophobicContact CG-CG2 4.47Å; P183-I453 HydrophobicContact CB-CD1 4.07Å
184	T	89.7	Confident	88.4	Confident	10 Å²	10	16.8 Å²	16.8	6%	0.061	10%	0.098	C	C	.	.	P	Polyproline II helix	trans	-88.8	165.8	170.4	70.5	0	0	0	0	110.7	A167 K170 E186 D187 Y188 V447	A167-T184 HydrophobicContact CB-CG2 4.28Å; K170-T184 HydrophobicContact CD-CG2 3.79Å; T184-E186 PolarHBondContact O-N 2.84Å; T184-E186 PolarHBondContact OG1-N 3.16Å; T184-D187 WeakPolarHBondContact CA-OD2 3.36Å; T184-D187 WeakPolarHBondContact CB-OD2 3.4Å; T184-D187 PolarHBondContact N-OD2 2.95Å; T184-D187 PolarHBondContact O-N 3.44Å; T184-D187 PolarHBondContact OG1-N 3.25Å; T184-D187 PolarHBondContact OG1-OD2 3.49Å; T184-Y188 WeakPolarHBondContact O-CD2 3.19Å; T184-Y188 PolarHBondContact O-N 3.18Å; T184-V447 HydrophobicContact CG2-CG1 4.46Å; T184-V447 HydrophobicContact CG2-CG2 3.67Å
185	L	89.9	Confident	89.2	Confident	18 Å²	18	14.6 Å²	14.6	9%	0.094	8%	0.083	C	C	.	.	H	α-helix	trans	-61.6	-24.9	171.5	-167.7	61.4	0	0	0	112.4	A189 V213 A217 F221 L258 I283	L185-A189 PolarHBondContact O-N 3.2Å; L185-V213 HydrophobicContact CD2-CG1 4.04Å; L185-A217 HydrophobicContact CD2-CB 4.08Å; L185-F221 HydrophobicContact CD1-CD2 3.8Å; L185-F221 HydrophobicContact CD1-CE2 4.16Å; L185-F221 HydrophobicContact CD1-CG 4.43Å; L185-F221 HydrophobicContact CD2-CB 3.93Å; L185-F221 HydrophobicContact CD2-CD2 4.38Å; L185-F221 HydrophobicContact CD2-CG 4.28Å; L185-F221 HydrophobicContact CG-CB 3.96Å; L185-F221 HydrophobicContact CG-CD2 3.69Å; L185-F221 HydrophobicContact CG-CG 4.07Å; L185-F221 WeakPolarHBondContact O-CD2 3.5Å; L185-L258 HydrophobicContact CD1-CD1 4.47Å; L185-L258 HydrophobicContact CD1-CD2 4.08Å; L185-L258 HydrophobicContact CD2-CD1 4.34Å; L185-I283 HydrophobicContact CD1-CG2 4.24Å
186	E	89	Confident	89.9	Confident	36 Å²	36	14.1 Å²	14.1	17%	0.168	8%	0.08	C	C	.	.	H	α-helix	trans	-69.1	-36.9	170.4	-67.2	-173.5	-159.1	0	0	112.9	T184 A189 E190 R220 R445	T184-E186 PolarHBondContact O-N 2.84Å; T184-E186 PolarHBondContact OG1-N 3.16Å; E186-A189 WeakPolarHBondContact O-CB 3.48Å; E186-A189 PolarHBondContact O-N 3.36Å; E186-E190 PolarHBondContact O-N 3.43Å; E186-E190 VanDerWaalsContact O-N 3.11Å; E186-R220 HydrophobicContact CG-CB 4.4Å; E186-R220 WeakPolarHBondContact OE1-CD 3.38Å; E186-R220 IonicContact OE1-CZ 3.64Å; E186-R220 IonicContact OE1-NE 2.75Å; E186-R220 IonicContact OE1-NH1 3.68Å; E186-R220 PolarHBondContact OE1-NH1 3.07Å; E186-R445 VanDerWaalsContact OE2-CD 3.26Å; E186-R445 WeakPolarHBondContact OE2-CD 3.35Å; E186-R445 IonicContact OE2-CZ 3.68Å; E186-R445 IonicContact OE2-NE 3.84Å; E186-R445 IonicContact OE2-NH1 2.69Å; E186-R445 PolarHBondContact OE2-NH1 2.94Å
187	D	90.8	Very high	90.4	Very high	2 Å²	2	14.3 Å²	14.3	1%	0.011	8%	0.08	C	C	.	.	H	α-helix	trans	-66.6	-41.6	176.9	-56.6	-78.6	0	0	0	109.6	P183 T184 A189 E190 V191 R445 K476	P183-D187 HydrophobicContact CB-CB 4.24Å; T184-D187 WeakPolarHBondContact CA-OD2 3.36Å; T184-D187 WeakPolarHBondContact CB-OD2 3.4Å; T184-D187 PolarHBondContact N-OD2 2.95Å; T184-D187 PolarHBondContact O-N 3.44Å; T184-D187 PolarHBondContact OG1-N 3.25Å; T184-D187 PolarHBondContact OG1-OD2 3.49Å; D187-A189 VanDerWaalsContact C-N 3.33Å; D187-A189 PolarHBondContact O-N 3.34Å; D187-E190 WeakPolarHBondContact O-CB 3.46Å; D187-E190 PolarHBondContact O-N 3.42Å; D187-E190 VanDerWaalsContact O-N 3.11Å; D187-V191 WeakPolarHBondContact O-CG2 3.43Å; D187-V191 PolarHBondContact O-N 2.97Å; D187-V191 VanDerWaalsContact O-N 3.09Å; D187-R445 IonicContact OD1-CZ 2.75Å; D187-R445 IonicContact OD1-NH2 3.75Å; D187-R445 PolarHBondContact OD1-NH2 2.84Å; D187-K476 WeakPolarHBondContact OD1-CD 3.39Å; D187-K476 WeakPolarHBondContact OD1-CE 3.4Å; D187-K476 IonicContact OD1-NZ 2.62Å; D187-K476 PolarHBondContact OD1-NZ 3.18Å
188	Y	93.1	Very high	90.9	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-63	-34.6	171.7	-71.5	-71.4	0	0	0	113.2	T164 P183 T184 E190 V191 V192 I283 L310 I453	T164-Y188 HydrophobicContact CG2-CE2 4.27Å; P183-Y188 HydrophobicContact CB-CD2 4.47Å; P183-Y188 HydrophobicContact CB-CE2 4.01Å; P183-Y188 HydrophobicContact CG-CE2 3.85Å; T184-Y188 WeakPolarHBondContact O-CD2 3.19Å; T184-Y188 PolarHBondContact O-N 3.18Å; Y188-E190 VanDerWaalsContact C-N 3.27Å; Y188-E190 PolarHBondContact O-N 3.06Å; Y188-V191 PolarHBondContact O-N 3.27Å; Y188-V192 WeakPolarHBondContact O-CB 3.17Å; Y188-V192 WeakPolarHBondContact O-CG2 3.15Å; Y188-V192 PolarHBondContact O-N 3.42Å; Y188-I283 HydrophobicContact CD1-CG2 3.88Å; Y188-I283 HydrophobicContact CD2-CG2 3.87Å; Y188-I283 HydrophobicContact CE1-CG2 4.31Å; Y188-I283 HydrophobicContact CE2-CG2 4.29Å; Y188-I283 HydrophobicContact CG-CG2 3.64Å; Y188-L310 HydrophobicContact CD1-CB 4.3Å; Y188-L310 HydrophobicContact CE1-CB 4.21Å; Y188-I453 HydrophobicContact CD1-CD1 4.1Å; Y188-I453 HydrophobicContact CD1-CG2 4.38Å; Y188-I453 HydrophobicContact CE1-CD1 4.11Å; Y188-I453 HydrophobicContact CE1-CG2 4.07Å
189	A	92.3	Very high	90.9	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.7	-34.4	172.6	0	0	0	0	0	112.2	L185 E186 D187 T193 F221 K224	L185-A189 PolarHBondContact O-N 3.2Å; E186-A189 WeakPolarHBondContact O-CB 3.48Å; E186-A189 PolarHBondContact O-N 3.36Å; D187-A189 VanDerWaalsContact C-N 3.33Å; D187-A189 PolarHBondContact O-N 3.34Å; A189-T193 VanDerWaalsContact O-CB 3.26Å; A189-T193 WeakPolarHBondContact O-CB 3.47Å; A189-T193 PolarHBondContact O-N 3.32Å; A189-T193 PolarHBondContact O-OG1 3.24Å; A189-F221 HydrophobicContact CB-CD2 3.63Å; A189-F221 HydrophobicContact CB-CE2 3.93Å; A189-F221 HydrophobicContact CB-CG 4.47Å; A189-K224 HydrophobicContact CB-CB 3.91Å; A189-K224 HydrophobicContact CB-CG 3.71Å
190	E	91.3	Very high	90.8	Very high	28 Å²	28	25.6 Å²	25.6	13%	0.131	13%	0.132	C	C	.	.	H	α-helix	trans	-68.9	-41.5	174.8	-69.9	169.4	172.4	0	0	111.5	E186 D187 Y188 T193 A194 K224 R445	E186-E190 PolarHBondContact O-N 3.43Å; E186-E190 VanDerWaalsContact O-N 3.11Å; D187-E190 WeakPolarHBondContact O-CB 3.46Å; D187-E190 PolarHBondContact O-N 3.42Å; D187-E190 VanDerWaalsContact O-N 3.11Å; Y188-E190 VanDerWaalsContact C-N 3.27Å; Y188-E190 PolarHBondContact O-N 3.06Å; E190-T193 PolarHBondContact O-N 3.09Å; E190-A194 WeakPolarHBondContact O-CB 3.1Å; E190-A194 PolarHBondContact O-N 2.82Å; E190-K224 WeakPolarHBondContact OE1-CE 3.36Å; E190-K224 IonicContact OE1-NZ 3.9Å; E190-K224 PolarHBondContact OE1-NZ 2.96Å; E190-R445 IonicContact OE1-CZ 2.77Å; E190-R445 IonicContact OE1-NH1 2.68Å; E190-R445 PolarHBondContact OE1-NH1 3.5Å; E190-R445 IonicContact OE1-NH2 3.18Å; E190-R445 PolarHBondContact OE1-NH2 3.5Å; E190-R445 IonicContact OE2-CZ 3.66Å; E190-R445 IonicContact OE2-NH1 2.69Å; E190-R445 IonicContact OE2-NH2 2.77Å; E190-R445 PolarHBondContact OE2-NH2 3Å
191	V	93.1	Very high	90.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.6	-51	172.2	-176.6	0	0	0	0	111.4	D187 Y188 T193 A194 L195 L310 I453 M472 Y474 L481	D187-V191 WeakPolarHBondContact O-CG2 3.43Å; D187-V191 PolarHBondContact O-N 2.97Å; D187-V191 VanDerWaalsContact O-N 3.09Å; Y188-V191 PolarHBondContact O-N 3.27Å; V191-T193 VanDerWaalsContact C-N 3.3Å; V191-T193 PolarHBondContact O-N 3.43Å; V191-A194 PolarHBondContact O-N 2.81Å; V191-L195 VanDerWaalsContact O-CB 3.3Å; V191-L195 WeakPolarHBondContact O-CB 3.4Å; V191-L195 PolarHBondContact O-N 3.19Å; V191-L310 HydrophobicContact CG1-CD1 4.01Å; V191-I453 HydrophobicContact CG2-CB 4.18Å; V191-I453 HydrophobicContact CG2-CD1 3.67Å; V191-I453 HydrophobicContact CG2-CG1 4.49Å; V191-I453 HydrophobicContact CG2-CG2 4.23Å; V191-M472 HydrophobicContact CG1-CE 3.45Å; V191-M472 VanDerWaalsContact CG1-CE 3.45Å; V191-M472 HydrophobicContact CG1-SD 4.23Å; V191-Y474 HydrophobicContact CG1-CG 4.48Å; V191-Y474 HydrophobicContact CG2-CD1 3.52Å; V191-Y474 HydrophobicContact CG2-CD2 4.42Å; V191-Y474 HydrophobicContact CG2-CE1 3.88Å; V191-Y474 HydrophobicContact CG2-CG 3.79Å; V191-L481 HydrophobicContact CG1-CD1 4.46Å
192	V	93.6	Very high	90.5	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.2	-43.2	177.8	165.4	0	0	0	0	111.1	Y188 L195 L196 L225 I256 I281 I283 L310	Y188-V192 WeakPolarHBondContact O-CB 3.17Å; Y188-V192 WeakPolarHBondContact O-CG2 3.15Å; Y188-V192 PolarHBondContact O-N 3.42Å; V192-L195 PolarHBondContact O-N 3.46Å; V192-L196 HydrophobicContact CG1-CD1 3.61Å; V192-L196 HydrophobicContact CG1-CG 4.32Å; V192-L196 WeakPolarHBondContact O-CB 3.36Å; V192-L196 VanDerWaalsContact O-CG 3.3Å; V192-L196 WeakPolarHBondContact O-CG 3.42Å; V192-L196 PolarHBondContact O-N 3.13Å; V192-L225 HydrophobicContact CB-CD2 4.33Å; V192-L225 HydrophobicContact CG1-CD2 3.61Å; V192-I256 HydrophobicContact CG1-CD1 3.56Å; V192-I256 HydrophobicContact CG2-CD1 4.29Å; V192-I281 HydrophobicContact CG2-CG2 4.38Å; V192-I283 HydrophobicContact CG2-CD1 3.73Å; V192-L310 HydrophobicContact CG2-CD1 4.28Å
193	T	92.6	Very high	90.3	Very high	14 Å²	14	29.1 Å²	29.1	9%	0.086	15%	0.149	C	C	.	.	H	α-helix	trans	-62.9	-50.5	178.6	-62.8	0	0	0	0	111.2	A189 E190 V191 L195 L196 I197 S228 I230	A189-T193 VanDerWaalsContact O-CB 3.26Å; A189-T193 WeakPolarHBondContact O-CB 3.47Å; A189-T193 PolarHBondContact O-N 3.32Å; A189-T193 PolarHBondContact O-OG1 3.24Å; E190-T193 PolarHBondContact O-N 3.09Å; V191-T193 VanDerWaalsContact C-N 3.3Å; V191-T193 PolarHBondContact O-N 3.43Å; T193-L195 VanDerWaalsContact C-N 3.26Å; T193-L195 PolarHBondContact O-N 2.84Å; T193-L196 PolarHBondContact O-N 3.25Å; T193-I197 HydrophobicContact CG2-CD1 3.81Å; T193-I197 WeakPolarHBondContact O-CB 3.46Å; T193-I197 VanDerWaalsContact O-CG1 3.27Å; T193-I197 WeakPolarHBondContact O-CG1 3.37Å; T193-I197 PolarHBondContact O-N 3.19Å; T193-S228 VanDerWaalsContact CG2-CB 3.47Å; T193-I230 HydrophobicContact CG2-CD1 4.03Å
194	A	91.8	Very high	90.3	Very high	27 Å²	27	28.9 Å²	28.9	22%	0.223	15%	0.147	C	C	.	.	H	α-helix	trans	-59.8	-38.4	177.2	0	0	0	0	0	111.8	E190 V191 K198 Y474 L481	E190-A194 WeakPolarHBondContact O-CB 3.1Å; E190-A194 PolarHBondContact O-N 2.82Å; V191-A194 PolarHBondContact O-N 2.81Å; A194-K198 WeakPolarHBondContact O-CB 3.26Å; A194-K198 PolarHBondContact O-N 2.84Å; A194-Y474 HydrophobicContact CB-CE2 4.35Å; A194-L481 HydrophobicContact CB-CB 4.09Å; A194-L481 HydrophobicContact CB-CD1 3.77Å
195	L	92	Very high	90.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-69.1	-45.7	178.8	-175.5	61.9	0	0	0	112.2	V191 V192 T193 K198 M199 I281 L308 M472 L481 L483 L487	V191-L195 VanDerWaalsContact O-CB 3.3Å; V191-L195 WeakPolarHBondContact O-CB 3.4Å; V191-L195 PolarHBondContact O-N 3.19Å; V192-L195 PolarHBondContact O-N 3.46Å; T193-L195 VanDerWaalsContact C-N 3.26Å; T193-L195 PolarHBondContact O-N 2.84Å; L195-K198 WeakPolarHBondContact O-CB 3.17Å; L195-K198 PolarHBondContact O-N 2.87Å; L195-M199 HydrophobicContact CD1-CG 4.49Å; L195-M199 HydrophobicContact CD2-CE 4.5Å; L195-M199 HydrophobicContact CG-CE 4.03Å; L195-M199 HydrophobicContact CG-SD 4.42Å; L195-M199 WeakPolarHBondContact O-CG 3.46Å; L195-M199 PolarHBondContact O-N 3.08Å; L195-I281 HydrophobicContact CD2-CD1 4.23Å; L195-L308 HydrophobicContact CD2-CD2 3.46Å; L195-L308 VanDerWaalsContact CD2-CD2 3.46Å; L195-M472 HydrophobicContact CD1-SD 3.89Å; L195-M472 HydrophobicContact CD2-SD 4.12Å; L195-M472 HydrophobicContact CG-SD 4.41Å; L195-L481 HydrophobicContact CB-CD1 3.9Å; L195-L481 HydrophobicContact CD1-CD1 4.43Å; L195-L481 HydrophobicContact CD1-CD2 4.22Å; L195-L483 HydrophobicContact CD1-CD1 4.2Å; L195-L487 HydrophobicContact CD1-CD1 3.86Å; L195-L487 HydrophobicContact CD2-CD1 4.33Å; L195-L487 HydrophobicContact CG-CD1 4.44Å
196	L	91.7	Very high	90.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.8	-41.9	177.9	-77.5	168.5	0	0	0	111.9	V192 T193 M199 N200 S201 I204 I230 I254	V192-L196 HydrophobicContact CG1-CD1 3.61Å; V192-L196 HydrophobicContact CG1-CG 4.32Å; V192-L196 WeakPolarHBondContact O-CB 3.36Å; V192-L196 VanDerWaalsContact O-CG 3.3Å; V192-L196 WeakPolarHBondContact O-CG 3.42Å; V192-L196 PolarHBondContact O-N 3.13Å; T193-L196 PolarHBondContact O-N 3.25Å; L196-M199 HydrophobicContact CD2-CE 3.94Å; L196-M199 CarbonylContact O-C 3.51Å; L196-M199 PolarHBondContact O-N 3.16Å; L196-N200 PolarHBondContact O-N 2.88Å; L196-N200 VanDerWaalsContact O-N 3.07Å; L196-S201 CarbonylContact C-O 3.59Å; L196-S201 PolarHBondContact O-N 3.24Å; L196-I204 HydrophobicContact CD1-CD1 4.33Å; L196-I204 HydrophobicContact CD1-CG2 3.85Å; L196-I204 HydrophobicContact CD2-CG2 3.77Å; L196-I230 HydrophobicContact CB-CD1 4.38Å; L196-I230 HydrophobicContact CD1-CD1 3.78Å; L196-I230 HydrophobicContact CD1-CG1 4.21Å; L196-I230 HydrophobicContact CD1-CG2 3.93Å; L196-I254 HydrophobicContact CD2-CD1 3.57Å; L196-I254 HydrophobicContact CD2-CG2 4.3Å
197	I	88.8	Confident	90	Very high	117 Å²	117	26.1 Å²	26.1	60%	0.6	13%	0.133	S	C	*	.	H	α-helix	trans	-60.5	-46.2	171.9	-68	168.1	0	0	0	110.3	T193 M199 N200	T193-I197 HydrophobicContact CG2-CD1 3.81Å; T193-I197 WeakPolarHBondContact O-CB 3.46Å; T193-I197 VanDerWaalsContact O-CG1 3.27Å; T193-I197 WeakPolarHBondContact O-CG1 3.37Å; T193-I197 PolarHBondContact O-N 3.19Å; I197-M199 VanDerWaalsContact C-N 3.27Å; I197-M199 PolarHBondContact O-N 3.25Å; I197-N200 PolarHBondContact O-N 2.99Å
198	K	88.2	Confident	89.9	Confident	138 Å²	138	28.3 Å²	28.3	60%	0.6	14%	0.142	S	C	*	.	H	α-helix	trans	-61.9	-33	177.2	-163.4	74.1	172.8	-166.5	0	112.8	A194 L195 L481	A194-K198 WeakPolarHBondContact O-CB 3.26Å; A194-K198 PolarHBondContact O-N 2.84Å; L195-K198 WeakPolarHBondContact O-CB 3.17Å; L195-K198 PolarHBondContact O-N 2.87Å; K198-L481 HydrophobicContact CB-CD2 4.43Å; K198-L481 HydrophobicContact CG-CD2 4.32Å
199	M	87.4	Confident	89.3	Confident	24 Å²	24	28.1 Å²	28.1	12%	0.118	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	2.5	175.4	-66.4	-171	-55.5	0	0	114.3	L195 L196 I197 S201 I254 L279 L487 V495	L195-M199 HydrophobicContact CD1-CG 4.49Å; L195-M199 HydrophobicContact CD2-CE 4.5Å; L195-M199 HydrophobicContact CG-CE 4.03Å; L195-M199 HydrophobicContact CG-SD 4.42Å; L195-M199 WeakPolarHBondContact O-CG 3.46Å; L195-M199 PolarHBondContact O-N 3.08Å; L196-M199 HydrophobicContact CD2-CE 3.94Å; L196-M199 CarbonylContact O-C 3.51Å; L196-M199 PolarHBondContact O-N 3.16Å; I197-M199 VanDerWaalsContact C-N 3.27Å; I197-M199 PolarHBondContact O-N 3.25Å; M199-S201 VanDerWaalsContact C-N 3.25Å; M199-S201 PolarHBondContact O-N 2.05Å; M199-S201 PolarHBondContact O-OG 2.72Å; M199-I254 HydrophobicContact CE-CD1 3.78Å; M199-L279 HydrophobicContact CE-CD2 4.11Å; M199-L279 HydrophobicContact SD-CD2 4.03Å; M199-L487 HydrophobicContact CG-CD1 4.46Å; M199-L487 HydrophobicContact SD-CB 4.21Å; M199-L487 HydrophobicContact SD-CD1 3.56Å; M199-L487 VanDerWaalsContact SD-CD1 3.56Å; M199-V495 HydrophobicContact SD-CB 4.27Å; M199-V495 HydrophobicContact SD-CG1 4.42Å
200	N	87.2	Confident	88.7	Confident	106 Å²	106	35.3 Å²	35.3	57%	0.567	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.3	49.8	-175.1	-168.9	-1.2	0	0	0	112.1	L196 I197 R496 V498	L196-N200 PolarHBondContact O-N 2.88Å; L196-N200 VanDerWaalsContact O-N 3.07Å; I197-N200 PolarHBondContact O-N 2.99Å; N200-R496 PolarHBondContact O-NE 3.14Å; N200-V498 WeakPolarHBondContact O-CG2 3.49Å
201	S	89.3	Confident	87.8	Confident	8 Å²	8	37 Å²	37	6%	0.056	19%	0.187	C	C	.	.			trans	-130.5	139.7	-177.7	-67.9	0	0	0	0	109.9	L196 M199 R496 S497	L196-S201 CarbonylContact C-O 3.59Å; L196-S201 PolarHBondContact O-N 3.24Å; M199-S201 VanDerWaalsContact C-N 3.25Å; M199-S201 PolarHBondContact O-N 2.05Å; M199-S201 PolarHBondContact O-OG 2.72Å; S201-R496 WeakPolarHBondContact OG-CA 3.44Å; S201-S497 CarbonylContact C-O 3.41Å; S201-S497 VanDerWaalsContact CA-O 3.26Å; S201-S497 WeakPolarHBondContact CA-O 3.22Å; S201-S497 VanDerWaalsContact CB-O 3.3Å; S201-S497 WeakPolarHBondContact CB-O 3.36Å; S201-S497 PolarHBondContact OG-N 2.88Å
202	N	87.7	Confident	87	Confident	48 Å²	48	37.4 Å²	37.4	26%	0.257	19%	0.19	S	C	.	.			trans	-136.9	6.6	-177.3	77.4	-18.3	0	0	0	114.3	L231 S497 V498 C499	N202-L231 WeakPolarHBondContact O-CB 3.22Å; N202-L231 PolarHBondContact O-N 2.87Å; N202-S497 PolarHBondContact N-O 3.35Å; N202-V498 VanDerWaalsContact OD1-CA 3.3Å; N202-V498 WeakPolarHBondContact OD1-CA 3.46Å; N202-C499 PolarHBondContact OD1-N 3.3Å; N202-C499 VanDerWaalsContact OD1-N 3.1Å
203	W	86.1	Confident	86.4	Confident	27 Å²	27	37.7 Å²	37.7	10%	0.102	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	119.8	-175.1	-174.7	32.4	0	0	0	110.8	L231 E233 R251 S497 C499	W203-L231 WeakPolarHBondContact CA-O 3.46Å; W203-E233 HydrophobicContact CZ2-CG 4.3Å; W203-R251 HydrophobicContact CH2-CB 3.6Å; W203-R251 HydrophobicContact CZ2-CB 3.93Å; W203-R251 HydrophobicContact CZ3-CB 4.5Å; W203-S497 PolarHBondContact N-O 2.81Å; W203-S497 VanDerWaalsContact N-O 3.08Å; W203-S497 WeakPolarHBondContact O-CB 3.37Å; W203-S497 PolarHBondContact O-OG 3.39Å; W203-C499 HydrophobicContact CB-CB 4.16Å; W203-C499 HydrophobicContact CD2-CB 4.28Å; W203-C499 HydrophobicContact CG-CB 4.12Å
204	I	89.9	Confident	85.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	157.6	-170	61.7	172.3	0	0	0	111.9	L196 V206 L225 I230 L231 V232 E233 I254 I256	L196-I204 HydrophobicContact CD1-CD1 4.33Å; L196-I204 HydrophobicContact CD1-CG2 3.85Å; L196-I204 HydrophobicContact CD2-CG2 3.77Å; I204-V206 HydrophobicContact CD1-CG2 4.34Å; I204-L225 HydrophobicContact CD1-CD1 4.06Å; I204-I230 HydrophobicContact CD1-CG2 3.58Å; I204-I230 HydrophobicContact CG1-CG2 3.8Å; I204-I230 HydrophobicContact CG2-CG2 4.44Å; I204-L231 PolarHBondContact N-O 2.86Å; I204-V232 HydrophobicContact CD1-CG2 4.1Å; I204-V232 HydrophobicContact CG1-CG2 4.14Å; I204-V232 CarbonylContact O-C 3.24Å; I204-V232 WeakPolarHBondContact O-CA 3.22Å; I204-E233 WeakPolarHBondContact O-CB 3.33Å; I204-E233 PolarHBondContact O-N 2.93Å; I204-I254 WeakPolarHBondContact CA-O 3.43Å; I204-I254 HydrophobicContact CG2-CB 4.02Å; I204-I254 HydrophobicContact CG2-CG2 3.96Å; I204-I256 HydrophobicContact CD1-CD1 3.66Å; I204-I256 HydrophobicContact CD1-CG1 4.42Å
205	S	87.2	Confident	85.4	Confident	4 Å²	4	39.8 Å²	39.8	3%	0.028	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	148.2	163.5	-53.8	0	0	0	0	109.4	E233 S252 I254 I255 I256	S205-E233 PolarHBondContact OG-OE2 2.59Å; S205-S252 PolarHBondContact N-OG 3.01Å; S205-S252 PolarHBondContact OG-OG 3.02Å; S205-I254 PolarHBondContact N-O 3.49Å; S205-I254 VanDerWaalsContact N-O 3.1Å; S205-I255 WeakPolarHBondContact O-CA 3.33Å; S205-I256 PolarHBondContact O-N 3.31Å
206	V	88.6	Confident	85.1	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.8	176	-175.7	0	0	0	0	109.5	I204 F221 V232 S234 M235 T236 I256 L258	I204-V206 HydrophobicContact CD1-CG2 4.34Å; V206-F221 HydrophobicContact CG1-CE1 4.3Å; V206-F221 HydrophobicContact CG2-CE1 4.33Å; V206-V232 HydrophobicContact CG2-CG1 3.98Å; V206-S234 PolarHBondContact N-O 2.99Å; V206-M235 HydrophobicContact CB-CE 3.95Å; V206-M235 HydrophobicContact CB-CG 4.29Å; V206-M235 HydrophobicContact CG1-CE 4.06Å; V206-M235 HydrophobicContact CG2-CE 3.95Å; V206-M235 CarbonylContact O-C 3.58Å; V206-M235 VanDerWaalsContact O-CA 3.29Å; V206-M235 WeakPolarHBondContact O-CA 3.44Å; V206-T236 PolarHBondContact O-N 2.91Å; V206-I256 CarbonylContact C-O 3.55Å; V206-I256 WeakPolarHBondContact CA-O 3.44Å; V206-I256 HydrophobicContact CG2-CB 4.29Å; V206-I256 HydrophobicContact CG2-CD1 4.49Å; V206-L258 HydrophobicContact CG1-CD1 4.05Å; V206-L258 HydrophobicContact CG1-CG 4.12Å
207	I	87.7	Confident	84.8	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.1	173.6	-44.6	-174.9	0	0	0	107.5	T236 A238 I248 I255 I256 I257 L258 L267	I207-T236 WeakPolarHBondContact CA-O 3.39Å; I207-A238 HydrophobicContact CG2-CB 3.94Å; I207-I248 HydrophobicContact CD1-CD1 3.61Å; I207-I248 HydrophobicContact CD1-CG1 3.92Å; I207-I248 HydrophobicContact CD1-CG2 4.3Å; I207-I255 HydrophobicContact CD1-CG2 3.53Å; I207-I255 HydrophobicContact CG1-CG2 3.73Å; I207-I256 PolarHBondContact N-O 3.36Å; I207-I257 HydrophobicContact CB-CG1 4.38Å; I207-I257 HydrophobicContact CD1-CG1 4.49Å; I207-I257 WeakPolarHBondContact O-CA 3.27Å; I207-L258 PolarHBondContact O-N 3.01Å; I207-L267 HydrophobicContact CG2-CD1 3.92Å
208	Y	87.8	Confident	84.7	Confident	48 Å²	48	38.3 Å²	38.3	19%	0.188	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	144.7	178.9	71.5	-78	0	0	0	113.1	L218 M235 T236 V237 A238 L258	Y208-L218 HydrophobicContact CD1-CD1 4.37Å; Y208-L218 HydrophobicContact CD1-CD2 3.91Å; Y208-L218 HydrophobicContact CD2-CD2 3.78Å; Y208-L218 HydrophobicContact CE1-CD2 3.59Å; Y208-L218 HydrophobicContact CE2-CD2 3.44Å; Y208-L218 VanDerWaalsContact CE2-CD2 3.44Å; Y208-L218 HydrophobicContact CG-CD1 4.29Å; Y208-L218 HydrophobicContact CG-CD2 3.98Å; Y208-M235 HydrophobicContact CE1-CB 4.28Å; Y208-T236 WeakPolarHBondContact CD1-O 3.49Å; Y208-T236 PolarHBondContact N-O 3.38Å; Y208-V237 HydrophobicContact CE1-CG2 3.91Å; Y208-V237 HydrophobicContact CE2-CG2 4.12Å; Y208-V237 WeakPolarHBondContact OH-CG2 3.33Å; Y208-A238 PolarHBondContact O-N 2.87Å; Y208-L258 WeakPolarHBondContact CA-O 3.46Å
209	C	82.2	Confident	84.7	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	118.6	175.5	-64.5	0	0	0	0	109.7	S211 S212 V213 L258 S259	C209-S211 PolarHBondContact O-N 3.05Å; C209-S211 VanDerWaalsContact O-N 3.12Å; C209-S212 PolarHBondContact O-N 3.47Å; C209-V213 PolarHBondContact O-N 2.95Å; C209-L258 PolarHBondContact N-O 3.37Å; C209-S259 PolarHBondContact SG-OG 3.48Å
210	K	78.9	Confident	84.7	Confident	152 Å²	152	39.1 Å²	39.1	66%	0.661	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.1	-178.6	-174.2	-178.5	175.4	-171.6	0	113.1	N144 S212 V237	N144-K210 PolarHBondContact ND2-O 3.35Å; K210-S212 PolarHBondContact O-N 2.62Å; K210-V237 HydrophobicContact CB-CG1 4.1Å
211	S	72.8	Confident	84.9	Confident	63 Å²	63	34 Å²	34	44%	0.441	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.9	171.4	54	0	0	0	0	113.9	N144 C209 D263	N144-S211 VanDerWaalsContact ND2-C 3.32Å; N144-S211 PolarHBondContact ND2-O 3.2Å; C209-S211 PolarHBondContact O-N 3.05Å; C209-S211 VanDerWaalsContact O-N 3.12Å; S211-D263 PolarHBondContact OG-OD2 3Å; S211-D263 VanDerWaalsContact OG-OD2 3.09Å
212	S	75.1	Confident	84.9	Confident	8 Å²	8	38.5 Å²	38.5	6%	0.056	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-8.3	-155.5	-59.4	0	0	0	0	114.8	Q168 C209 K210 N260 T285	Q168-S212 PolarHBondContact NE2-O 2.95Å; C209-S212 PolarHBondContact O-N 3.47Å; K210-S212 PolarHBondContact O-N 2.62Å; S212-N260 PolarHBondContact OG-ND2 3.14Å; S212-T285 WeakPolarHBondContact CB-OG1 3.33Å; S212-T285 WeakPolarHBondContact O-CB 3.1Å
213	V	81	Confident	85	Confident	6 Å²	6	42.1 Å²	42.1	4%	0.036	21%	0.207	C	C	.	.			trans	-132	127.6	-176.3	-170.3	0	0	0	0	111.3	L185 C209 L218 L258 T285	L185-V213 HydrophobicContact CD2-CG1 4.04Å; C209-V213 PolarHBondContact O-N 2.95Å; V213-L218 HydrophobicContact CG1-CB 4.01Å; V213-L258 HydrophobicContact CG2-CB 3.88Å; V213-T285 HydrophobicContact CG2-CG2 3.62Å
214	M	81.6	Confident	85.1	Confident	8 Å²	8	43.7 Å²	43.7	4%	0.039	22%	0.215	C	C	.	.			trans	-68.2	138.3	171.3	-56.2	-166.1	77.4	0	0	111.4	P143 K149 Q168 M169 D216 A217 L218	P143-M214 HydrophobicContact CB-CG 3.61Å; P143-M214 HydrophobicContact CB-SD 4.37Å; P143-M214 VanDerWaalsContact O-CE 3.25Å; P143-M214 WeakPolarHBondContact O-CE 3.12Å; P143-M214 WeakPolarHBondContact O-CG 3.46Å; P143-M214 VanDerWaalsContact O-SD 3.34Å; K149-M214 HydrophobicContact CD-CE 4Å; Q168-M214 HydrophobicContact CB-CG 4.03Å; Q168-M214 HydrophobicContact CB-SD 4.13Å; M169-M214 VanDerWaalsContact CA-SD 3.57Å; M169-M214 HydrophobicContact CB-SD 4.27Å; M169-M214 HydrophobicContact CG-SD 3.84Å; M214-D216 VanDerWaalsContact C-N 3.3Å; M214-D216 PolarHBondContact O-N 3.04Å; M214-A217 HydrophobicContact CB-CB 4.06Å; M214-A217 PolarHBondContact O-N 3.21Å; M214-A217 VanDerWaalsContact O-N 3.12Å; M214-L218 PolarHBondContact O-N 2.85Å
215	A	83.4	Confident	85.2	Confident	77 Å²	77	43.7 Å²	43.7	64%	0.636	22%	0.215	S	C	*	.	H	α-helix	trans	-58	-40.6	176	0	0	0	0	0	112.8	A217 L218 E219	A215-A217 VanDerWaalsContact C-N 3.34Å; A215-A217 PolarHBondContact O-N 3.41Å; A215-L218 PolarHBondContact O-N 2.78Å; A215-E219 PolarHBondContact O-N 3.28Å
216	D	84.6	Confident	85.2	Confident	69 Å²	69	47 Å²	47	37%	0.369	24%	0.235	S	C	.	.	H	α-helix	trans	-59	-43.8	175.5	-61.5	-33.1	0	0	0	111.6	K149 S171 M214 R220	K149-D216 IonicContact NZ-OD2 3.93Å; K149-D216 PolarHBondContact NZ-OD2 3.15Å; S171-D216 WeakPolarHBondContact OG-CB 3.34Å; M214-D216 VanDerWaalsContact C-N 3.3Å; M214-D216 PolarHBondContact O-N 3.04Å; D216-R220 WeakPolarHBondContact O-CG 3.18Å; D216-R220 PolarHBondContact O-N 3.08Å
217	A	85.1	Confident	85.1	Confident	5 Å²	5	52.2 Å²	52.2	4%	0.041	26%	0.262	C	S	.	.	H	α-helix	trans	-70.6	-39.6	179.4	0	0	0	0	0	111.9	Q168 S171 L185 M214 A215 R220 F221	Q168-A217 HydrophobicContact CB-CB 4.26Å; S171-A217 PolarHBondContact OG-N 2.81Å; L185-A217 HydrophobicContact CD2-CB 4.08Å; M214-A217 HydrophobicContact CB-CB 4.06Å; M214-A217 PolarHBondContact O-N 3.21Å; M214-A217 VanDerWaalsContact O-N 3.12Å; A215-A217 VanDerWaalsContact C-N 3.34Å; A215-A217 PolarHBondContact O-N 3.41Å; A217-R220 PolarHBondContact O-N 3.23Å; A217-F221 WeakPolarHBondContact O-CB 3.28Å; A217-F221 PolarHBondContact O-N 3.07Å
218	L	88.2	Confident	85.1	Confident	12 Å²	12	54 Å²	54	6%	0.063	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-43.4	176.7	-178.5	68.1	0	0	0	112.1	Y208 V213 M214 A215 F221 R222 M235 L258	Y208-L218 HydrophobicContact CD1-CD1 4.37Å; Y208-L218 HydrophobicContact CD1-CD2 3.91Å; Y208-L218 HydrophobicContact CD2-CD2 3.78Å; Y208-L218 HydrophobicContact CE1-CD2 3.59Å; Y208-L218 HydrophobicContact CE2-CD2 3.44Å; Y208-L218 VanDerWaalsContact CE2-CD2 3.44Å; Y208-L218 HydrophobicContact CG-CD1 4.29Å; Y208-L218 HydrophobicContact CG-CD2 3.98Å; V213-L218 HydrophobicContact CG1-CB 4.01Å; M214-L218 PolarHBondContact O-N 2.85Å; A215-L218 PolarHBondContact O-N 2.78Å; L218-F221 WeakPolarHBondContact O-CB 3.4Å; L218-F221 PolarHBondContact O-N 2.96Å; L218-R222 WeakPolarHBondContact O-CB 3.28Å; L218-R222 PolarHBondContact O-N 2.96Å; L218-M235 HydrophobicContact CD1-CE 4.04Å; L218-M235 HydrophobicContact CD1-SD 4.19Å; L218-M235 HydrophobicContact CD2-SD 4.38Å; L218-M235 HydrophobicContact CG-SD 4.2Å; L218-L258 HydrophobicContact CD1-CD1 3.62Å
219	E	87.2	Confident	84.9	Confident	91 Å²	91	58.4 Å²	58.4	43%	0.425	30%	0.302	S	S	.	.	H	α-helix	trans	-70.5	-33.8	179.1	-176.2	58.9	-168.1	0	0	111.6	A215 R222 K223	A215-E219 PolarHBondContact O-N 3.28Å; E219-R222 PolarHBondContact O-N 3.15Å; E219-R222 IonicContact OE1-CZ 2.72Å; E219-R222 IonicContact OE1-NE 2.84Å; E219-R222 PolarHBondContact OE1-NE 2.92Å; E219-R222 IonicContact OE1-NH2 3.61Å; E219-R222 PolarHBondContact OE1-NH2 2.64Å; E219-R222 IonicContact OE2-CZ 3.8Å; E219-R222 IonicContact OE2-NE 3.48Å; E219-R222 PolarHBondContact OE2-NE 2.92Å; E219-R222 IonicContact OE2-NH2 3.51Å; E219-R222 PolarHBondContact OE2-NH2 2.7Å; E219-K223 VanDerWaalsContact O-CB 3.25Å; E219-K223 WeakPolarHBondContact O-CB 3.26Å; E219-K223 PolarHBondContact O-N 3.25Å
220	R	86.9	Confident	85.1	Confident	88 Å²	88	58.7 Å²	58.7	33%	0.332	30%	0.303	S	S	.	.	H	α-helix	trans	-63.9	-42.4	169	-71.9	-158.3	-171.1	-156	4.9	112.5	S171 E186 D216 A217 K223 K224	S171-R220 PolarHBondContact O-NE 3.3Å; S171-R220 PolarHBondContact O-NH2 2.86Å; E186-R220 HydrophobicContact CG-CB 4.4Å; E186-R220 WeakPolarHBondContact OE1-CD 3.38Å; E186-R220 IonicContact OE1-CZ 3.64Å; E186-R220 IonicContact OE1-NE 2.75Å; E186-R220 IonicContact OE1-NH1 3.68Å; E186-R220 PolarHBondContact OE1-NH1 3.07Å; D216-R220 WeakPolarHBondContact O-CG 3.18Å; D216-R220 PolarHBondContact O-N 3.08Å; A217-R220 PolarHBondContact O-N 3.23Å; R220-K223 PolarHBondContact O-N 2.93Å; R220-K224 WeakPolarHBondContact O-CB 3.32Å; R220-K224 PolarHBondContact O-N 2.83Å
221	F	91	Very high	85.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-49	174.2	179.1	-96.1	0	0	0	111.2	L185 A189 V206 A217 L218 K223 K224 L225 I256 L258 I283	L185-F221 HydrophobicContact CD1-CD2 3.8Å; L185-F221 HydrophobicContact CD1-CE2 4.16Å; L185-F221 HydrophobicContact CD1-CG 4.43Å; L185-F221 HydrophobicContact CD2-CB 3.93Å; L185-F221 HydrophobicContact CD2-CD2 4.38Å; L185-F221 HydrophobicContact CD2-CG 4.28Å; L185-F221 HydrophobicContact CG-CB 3.96Å; L185-F221 HydrophobicContact CG-CD2 3.69Å; L185-F221 HydrophobicContact CG-CG 4.07Å; L185-F221 WeakPolarHBondContact O-CD2 3.5Å; A189-F221 HydrophobicContact CB-CD2 3.63Å; A189-F221 HydrophobicContact CB-CE2 3.93Å; A189-F221 HydrophobicContact CB-CG 4.47Å; V206-F221 HydrophobicContact CG1-CE1 4.3Å; V206-F221 HydrophobicContact CG2-CE1 4.33Å; A217-F221 WeakPolarHBondContact O-CB 3.28Å; A217-F221 PolarHBondContact O-N 3.07Å; L218-F221 WeakPolarHBondContact O-CB 3.4Å; L218-F221 PolarHBondContact O-N 2.96Å; F221-K223 PolarHBondContact O-N 2.86Å; F221-K224 PolarHBondContact O-N 3.33Å; F221-L225 HydrophobicContact CD1-CD1 3.81Å; F221-L225 HydrophobicContact CE1-CD1 3.45Å; F221-L225 VanDerWaalsContact CE1-CD1 3.45Å; F221-L225 HydrophobicContact CE2-CD1 4.47Å; F221-L225 HydrophobicContact CG-CD1 4.46Å; F221-L225 HydrophobicContact CZ-CD1 3.81Å; F221-L225 WeakPolarHBondContact O-CG 3.47Å; F221-L225 PolarHBondContact O-N 3.02Å; F221-I256 HydrophobicContact CE1-CD1 4.49Å; F221-I256 HydrophobicContact CZ-CD1 4.11Å; F221-I256 HydrophobicContact CZ-CG2 4.12Å; F221-L258 HydrophobicContact CD1-CD1 4.01Å; F221-L258 HydrophobicContact CE1-CD1 4.03Å; F221-L258 HydrophobicContact CE1-CD2 4.28Å; F221-L258 HydrophobicContact CE2-CD2 4.39Å; F221-L258 HydrophobicContact CG-CD1 4.49Å; F221-L258 HydrophobicContact CZ-CD2 4.03Å; F221-I283 HydrophobicContact CE2-CD1 3.98Å; F221-I283 HydrophobicContact CZ-CD1 3.99Å
222	R	90.5	Very high	85.7	Confident	102 Å²	102	53.4 Å²	53.4	39%	0.385	28%	0.278	S	S	.	.	H	α-helix	trans	-56.8	-51.1	175	-167.8	175.4	78.3	113.5	0.2	111.4	L218 E219 K224 L225 V226 M235	L218-R222 WeakPolarHBondContact O-CB 3.28Å; L218-R222 PolarHBondContact O-N 2.96Å; E219-R222 PolarHBondContact O-N 3.15Å; E219-R222 IonicContact OE1-CZ 2.72Å; E219-R222 IonicContact OE1-NE 2.84Å; E219-R222 PolarHBondContact OE1-NE 2.92Å; E219-R222 IonicContact OE1-NH2 3.61Å; E219-R222 PolarHBondContact OE1-NH2 2.64Å; E219-R222 IonicContact OE2-CZ 3.8Å; E219-R222 IonicContact OE2-NE 3.48Å; E219-R222 PolarHBondContact OE2-NE 2.92Å; E219-R222 IonicContact OE2-NH2 3.51Å; E219-R222 PolarHBondContact OE2-NH2 2.7Å; R222-K224 PolarHBondContact O-N 3.19Å; R222-L225 PolarHBondContact O-N 2.77Å; R222-V226 HydrophobicContact CG-CG2 4.49Å; R222-V226 WeakPolarHBondContact O-CG2 3.33Å; R222-V226 PolarHBondContact O-N 2.67Å; R222-M235 HydrophobicContact CB-CE 3.63Å; R222-M235 HydrophobicContact CB-SD 4.17Å; R222-M235 VanDerWaalsContact CD-SD 3.55Å; R222-M235 HydrophobicContact CG-CE 3.71Å; R222-M235 HydrophobicContact CG-SD 4.04Å
223	K	89.3	Confident	85.7	Confident	123 Å²	123	53.4 Å²	53.4	54%	0.535	28%	0.277	S	S	.	.	H	α-helix	trans	-59.5	-45.8	-179.4	-179.6	173.7	177.2	180	0	111.5	E219 R220 F221 L225 V226 D227	E219-K223 VanDerWaalsContact O-CB 3.25Å; E219-K223 WeakPolarHBondContact O-CB 3.26Å; E219-K223 PolarHBondContact O-N 3.25Å; R220-K223 PolarHBondContact O-N 2.93Å; F221-K223 PolarHBondContact O-N 2.86Å; K223-L225 VanDerWaalsContact C-N 3.26Å; K223-L225 PolarHBondContact O-N 3.39Å; K223-V226 PolarHBondContact O-N 2.88Å; K223-V226 VanDerWaalsContact O-N 3.16Å; K223-D227 WeakPolarHBondContact CE-OD2 3.23Å; K223-D227 WeakPolarHBondContact CG-OD2 3.28Å; K223-D227 VanDerWaalsContact O-CB 3.29Å; K223-D227 WeakPolarHBondContact O-CB 3.21Å; K223-D227 VanDerWaalsContact O-CG 3.22Å; K223-D227 PolarHBondContact O-N 2.93Å
224	K	88.7	Confident	85.4	Confident	61 Å²	61	54 Å²	54	27%	0.265	28%	0.281	S	S	.	.	H	α-helix	trans	-59.1	-36.7	-179.9	-172.2	63.2	167	-161.4	0	113	A189 E190 R220 F221 R222 S228	A189-K224 HydrophobicContact CB-CB 3.91Å; A189-K224 HydrophobicContact CB-CG 3.71Å; E190-K224 WeakPolarHBondContact OE1-CE 3.36Å; E190-K224 IonicContact OE1-NZ 3.9Å; E190-K224 PolarHBondContact OE1-NZ 2.96Å; R220-K224 WeakPolarHBondContact O-CB 3.32Å; R220-K224 PolarHBondContact O-N 2.83Å; F221-K224 PolarHBondContact O-N 3.33Å; R222-K224 PolarHBondContact O-N 3.19Å; K224-S228 WeakPolarHBondContact O-CB 3.47Å; K224-S228 PolarHBondContact O-N 2.86Å; K224-S228 PolarHBondContact O-OG 3.21Å
225	L	90.6	Very high	85.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-70.6	-47.3	174.6	-65.7	165.1	0	0	0	111.4	V192 I204 F221 R222 K223 S228 N229 I230	V192-L225 HydrophobicContact CB-CD2 4.33Å; V192-L225 HydrophobicContact CG1-CD2 3.61Å; I204-L225 HydrophobicContact CD1-CD1 4.06Å; F221-L225 HydrophobicContact CD1-CD1 3.81Å; F221-L225 HydrophobicContact CE1-CD1 3.45Å; F221-L225 VanDerWaalsContact CE1-CD1 3.45Å; F221-L225 HydrophobicContact CE2-CD1 4.47Å; F221-L225 HydrophobicContact CG-CD1 4.46Å; F221-L225 HydrophobicContact CZ-CD1 3.81Å; F221-L225 WeakPolarHBondContact O-CG 3.47Å; F221-L225 PolarHBondContact O-N 3.02Å; R222-L225 PolarHBondContact O-N 2.77Å; K223-L225 VanDerWaalsContact C-N 3.26Å; K223-L225 PolarHBondContact O-N 3.39Å; L225-S228 CarbonylContact O-C 3.56Å; L225-S228 WeakPolarHBondContact O-CA 3.26Å; L225-S228 WeakPolarHBondContact O-CB 3.42Å; L225-S228 PolarHBondContact O-N 2.94Å; L225-N229 PolarHBondContact O-N 3.45Å; L225-I230 HydrophobicContact CB-CB 4.19Å; L225-I230 HydrophobicContact CB-CD1 4.47Å; L225-I230 HydrophobicContact CB-CG2 4.39Å; L225-I230 HydrophobicContact CD2-CD1 3.76Å; L225-I230 WeakPolarHBondContact O-CB 3.43Å; L225-I230 PolarHBondContact O-N 3.04Å
226	V	87.2	Confident	85	Confident	74 Å²	74	53.5 Å²	53.5	45%	0.448	27%	0.269	S	S	.	.	H	α-helix	trans	-65.3	-43.6	-179.9	173.3	0	0	0	0	112.1	R222 K223 S228 N229	R222-V226 HydrophobicContact CG-CG2 4.49Å; R222-V226 WeakPolarHBondContact O-CG2 3.33Å; R222-V226 PolarHBondContact O-N 2.67Å; K223-V226 PolarHBondContact O-N 2.88Å; K223-V226 VanDerWaalsContact O-N 3.16Å; V226-S228 PolarHBondContact O-N 2.9Å; V226-S228 VanDerWaalsContact O-N 3.08Å; V226-N229 PolarHBondContact O-N 3.42Å
227	D	88	Confident	84.6	Confident	108 Å²	108	53.6 Å²	53.6	58%	0.578	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-19.7	172.5	-71	-6.7	0	0	0	111.8	K223	K223-D227 WeakPolarHBondContact CE-OD2 3.23Å; K223-D227 WeakPolarHBondContact CG-OD2 3.28Å; K223-D227 VanDerWaalsContact O-CB 3.29Å; K223-D227 WeakPolarHBondContact O-CB 3.21Å; K223-D227 VanDerWaalsContact O-CG 3.22Å; K223-D227 PolarHBondContact O-N 2.93Å
228	S	86.5	Confident	84	Confident	39 Å²	39	53.5 Å²	53.5	27%	0.273	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	17.6	176.9	-52.2	0	0	0	0	113.5	T193 K224 L225 V226 I230	T193-S228 VanDerWaalsContact CG2-CB 3.47Å; K224-S228 WeakPolarHBondContact O-CB 3.47Å; K224-S228 PolarHBondContact O-N 2.86Å; K224-S228 PolarHBondContact O-OG 3.21Å; L225-S228 CarbonylContact O-C 3.56Å; L225-S228 WeakPolarHBondContact O-CA 3.26Å; L225-S228 WeakPolarHBondContact O-CB 3.42Å; L225-S228 PolarHBondContact O-N 2.94Å; V226-S228 PolarHBondContact O-N 2.9Å; V226-S228 VanDerWaalsContact O-N 3.08Å; S228-I230 VanDerWaalsContact C-N 3.33Å; S228-I230 PolarHBondContact O-N 2.88Å
229	N	84	Confident	82.9	Confident	141 Å²	141	56.8 Å²	56.8	75%	0.754	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	29.1	-177.6	-63.6	-54.2	0	0	0	115.4	L225 V226	L225-N229 PolarHBondContact O-N 3.45Å; V226-N229 PolarHBondContact O-N 3.42Å
230	I	86.1	Confident	81.8	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.026	28%	0.279	C	S	.	.			trans	-97.2	125.1	173.7	-62.2	155.7	0	0	0	109.9	T193 L196 I204 L225 S228	T193-I230 HydrophobicContact CG2-CD1 4.03Å; L196-I230 HydrophobicContact CB-CD1 4.38Å; L196-I230 HydrophobicContact CD1-CD1 3.78Å; L196-I230 HydrophobicContact CD1-CG1 4.21Å; L196-I230 HydrophobicContact CD1-CG2 3.93Å; I204-I230 HydrophobicContact CD1-CG2 3.58Å; I204-I230 HydrophobicContact CG1-CG2 3.8Å; I204-I230 HydrophobicContact CG2-CG2 4.44Å; L225-I230 HydrophobicContact CB-CB 4.19Å; L225-I230 HydrophobicContact CB-CD1 4.47Å; L225-I230 HydrophobicContact CB-CG2 4.39Å; L225-I230 HydrophobicContact CD2-CD1 3.76Å; L225-I230 WeakPolarHBondContact O-CB 3.43Å; L225-I230 PolarHBondContact O-N 3.04Å; S228-I230 VanDerWaalsContact C-N 3.33Å; S228-I230 PolarHBondContact O-N 2.88Å
231	L	82.7	Confident	80.6	Confident	72 Å²	72	58.8 Å²	58.8	38%	0.377	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	111.9	-179.9	-63.6	165.8	0	0	0	110.2	N202 W203 I204 C499	N202-L231 WeakPolarHBondContact O-CB 3.22Å; N202-L231 PolarHBondContact O-N 2.87Å; W203-L231 WeakPolarHBondContact CA-O 3.46Å; I204-L231 PolarHBondContact N-O 2.86Å; L231-C499 HydrophobicContact CD1-CB 3.42Å; L231-C499 VanDerWaalsContact CD1-CB 3.42Å
232	V	82.5	Confident	79	Confident	33 Å²	33	62.2 Å²	62.2	20%	0.2	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	109.7	171.9	-178.4	0	0	0	0	108.9	I204 V206 S234 M235	I204-V232 HydrophobicContact CD1-CG2 4.1Å; I204-V232 HydrophobicContact CG1-CG2 4.14Å; I204-V232 CarbonylContact O-C 3.24Å; I204-V232 WeakPolarHBondContact O-CA 3.22Å; V206-V232 HydrophobicContact CG2-CG1 3.98Å; V232-S234 WeakPolarHBondContact CG1-O 3.38Å; V232-M235 HydrophobicContact CG1-CE 4.27Å; V232-M235 HydrophobicContact CG1-CG 3.84Å
233	E	74.1	Confident	77.3	Confident	7 Å²	7	61.8 Å²	61.8	3%	0.033	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	-43.1	-179.8	-168.1	-178.6	-168.4	0	0	112.2	W203 I204 S205 G250 R251 S252 T508	W203-E233 HydrophobicContact CZ2-CG 4.3Å; I204-E233 WeakPolarHBondContact O-CB 3.33Å; I204-E233 PolarHBondContact O-N 2.93Å; S205-E233 PolarHBondContact OG-OE2 2.59Å; E233-G250 VanDerWaalsContact OE2-CA 3.25Å; E233-G250 WeakPolarHBondContact OE2-CA 3.28Å; E233-R251 WeakPolarHBondContact OE1-CB 3.45Å; E233-R251 PolarHBondContact OE1-N 3.23Å; E233-R251 PolarHBondContact OE2-N 3.43Å; E233-S252 WeakPolarHBondContact OE2-CB 3.4Å; E233-S252 PolarHBondContact OE2-N 3.27Å; E233-T508 HydrophobicContact CG-CG2 3.97Å; E233-T508 WeakPolarHBondContact CG-OG1 3.28Å; E233-T508 WeakPolarHBondContact O-CB 3.39Å; E233-T508 PolarHBondContact O-OG1 2.75Å
234	S	74.4	Confident	75.4	Confident	18 Å²	18	60.4 Å²	60.4	13%	0.126	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	151.8	-177.1	59.5	0	0	0	0	110.6	V206 V232	V206-S234 PolarHBondContact N-O 2.99Å; V232-S234 WeakPolarHBondContact CG1-O 3.38Å
235	M	78.6	Confident	73.5	Confident	40 Å²	40	61.1 Å²	61.1	20%	0.197	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	89.5	167.7	-73.1	-151.5	145.8	0	0	108.6	V206 Y208 L218 R222 V232	V206-M235 HydrophobicContact CB-CE 3.95Å; V206-M235 HydrophobicContact CB-CG 4.29Å; V206-M235 HydrophobicContact CG1-CE 4.06Å; V206-M235 HydrophobicContact CG2-CE 3.95Å; V206-M235 CarbonylContact O-C 3.58Å; V206-M235 VanDerWaalsContact O-CA 3.29Å; V206-M235 WeakPolarHBondContact O-CA 3.44Å; Y208-M235 HydrophobicContact CE1-CB 4.28Å; L218-M235 HydrophobicContact CD1-CE 4.04Å; L218-M235 HydrophobicContact CD1-SD 4.19Å; L218-M235 HydrophobicContact CD2-SD 4.38Å; L218-M235 HydrophobicContact CG-SD 4.2Å; R222-M235 HydrophobicContact CB-CE 3.63Å; R222-M235 HydrophobicContact CB-SD 4.17Å; R222-M235 VanDerWaalsContact CD-SD 3.55Å; R222-M235 HydrophobicContact CG-CE 3.71Å; R222-M235 HydrophobicContact CG-SD 4.04Å; V232-M235 HydrophobicContact CG1-CE 4.27Å; V232-M235 HydrophobicContact CG1-CG 3.84Å
236	T	77.9	Confident	71.7	Confident	36 Å²	36	61.7 Å²	61.7	22%	0.221	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	127	-175.5	55.2	0	0	0	0	111.1	V206 I207 Y208 A238	V206-T236 PolarHBondContact O-N 2.91Å; I207-T236 WeakPolarHBondContact CA-O 3.39Å; Y208-T236 WeakPolarHBondContact CD1-O 3.49Å; Y208-T236 PolarHBondContact N-O 3.38Å; T236-A238 PolarHBondContact O-N 2.59Å
237	V	78.2	Confident	70.1	Confident	71 Å²	71	60.1 Å²	60.1	43%	0.43	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	125.2	168.5	179.4	0	0	0	0	108.4	Y208 K210	Y208-V237 HydrophobicContact CE1-CG2 3.91Å; Y208-V237 HydrophobicContact CE2-CG2 4.12Å; Y208-V237 WeakPolarHBondContact OH-CG2 3.33Å; K210-V237 HydrophobicContact CB-CG1 4.1Å
238	A	71.4	Confident	68.8	Low	3 Å²	3	56.2 Å²	56.2	3%	0.025	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	115.1	164.2	0	0	0	0	0	109.3	I207 Y208 T236 I246 L267	I207-A238 HydrophobicContact CG2-CB 3.94Å; Y208-A238 PolarHBondContact O-N 2.87Å; T236-A238 PolarHBondContact O-N 2.59Å; A238-I246 HydrophobicContact CB-CD1 4.09Å; A238-L267 HydrophobicContact CB-CD1 3.55Å; A238-L267 HydrophobicContact CB-CG 4.28Å
239	D	65.7	Low	67.3	Low	81 Å²	81	58.8 Å²	58.8	43%	0.433	36%	0.357	S	S	.	.			trans	-103.3	117.2	167.3	-163.8	-31.4	0	0	0	109.2	Q241	D239-Q241 VanDerWaalsContact C-N 3.3Å; D239-Q241 WeakPolarHBondContact OD1-CB 3.31Å; D239-Q241 PolarHBondContact OD1-N 3.35Å
240	I	63.1	Low	66.1	Low	44 Å²	44	53.3 Å²	53.3	23%	0.226	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-9.9	-171.8	-64.2	165	0	0	0	111	V242 D263 W270	I240-V242 PolarHBondContact O-N 3.42Å; I240-D263 HydrophobicContact CD1-CB 3.34Å; I240-D263 WeakPolarHBondContact CD1-OD2 3.42Å; I240-W270 HydrophobicContact CG2-CH2 3.88Å; I240-W270 HydrophobicContact CG2-CZ3 4.12Å; I240-W270 VanDerWaalsContact O-CH2 3.3Å; I240-W270 WeakPolarHBondContact O-CH2 3.43Å
241	Q	63.2	Low	65.3	Low	176 Å²	176	60.8 Å²	60.8	82%	0.822	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-12.2	174.3	-59.6	-168.5	-6.2	0	0	113	D239	D239-Q241 VanDerWaalsContact C-N 3.3Å; D239-Q241 WeakPolarHBondContact OD1-CB 3.31Å; D239-Q241 PolarHBondContact OD1-N 3.35Å
242	V	57.4	Low	64.9	Low	72 Å²	72	57.5 Å²	57.5	44%	0.436	35%	0.345	S	S	.	.			trans	-127.7	96.2	-177	-174.1	0	0	0	0	111.1	I240 A244 S245	I240-V242 PolarHBondContact O-N 3.42Å; V242-A244 PolarHBondContact O-N 3.03Å; V242-S245 PolarHBondContact O-OG 3.17Å
243	P	53	Low	65	Low	94 Å²	94	60.9 Å²	60.9	61%	0.61	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.2	-174.7	-25.9	35	0	0	0	116.3	W270	P243-W270 HydrophobicContact CB-CE3 4.38Å; P243-W270 HydrophobicContact CB-CH2 4.28Å; P243-W270 HydrophobicContact CB-CZ2 4.48Å; P243-W270 HydrophobicContact CB-CZ3 4.23Å; P243-W270 HydrophobicContact CG-CH2 4.02Å; P243-W270 HydrophobicContact CG-CZ2 4.33Å; P243-W270 HydrophobicContact CG-CZ3 4.35Å
244	A	49.4	Very low	65.8	Low	94 Å²	94	60.6 Å²	60.6	78%	0.777	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-13.3	-169.5	0	0	0	0	0	115.3	V242	V242-A244 PolarHBondContact O-N 3.03Å
245	S	48.9	Very low	66.5	Low	75 Å²	75	60 Å²	60	52%	0.524	35%	0.351	S	S	.	.			trans	-94.2	-12.6	-165.6	57	0	0	0	0	115.5	V242 G247	V242-S245 PolarHBondContact O-OG 3.17Å; S245-G247 VanDerWaalsContact C-N 3.34Å; S245-G247 PolarHBondContact O-N 3.23Å
246	I	54.3	Low	67.2	Low	13 Å²	13	58.1 Å²	58.1	7%	0.067	34%	0.341	C	S	.	.			trans	-78.2	81.4	-172	-50.6	-178.9	0	0	0	111	A238 I248 N271 R274	A238-I246 HydrophobicContact CB-CD1 4.09Å; I246-I248 HydrophobicContact CG2-CG1 4.04Å; I246-I248 PolarHBondContact O-N 3.22Å; I246-I248 VanDerWaalsContact O-N 3.09Å; I246-N271 PolarHBondContact O-OD1 2.55Å; I246-R274 PolarHBondContact O-NH1 2.78Å
247	G	52.8	Low	67.8	Low	41 Å²	41	56.4 Å²	56.4	42%	0.423	33%	0.331	S	S	.	.			trans	-75.7	82.1	171.7	0	0	0	0	0	112.3	S245 S249	S245-G247 VanDerWaalsContact C-N 3.34Å; S245-G247 PolarHBondContact O-N 3.23Å; G247-S249 VanDerWaalsContact C-N 3.33Å; G247-S249 PolarHBondContact O-N 2.96Å
248	I	60.5	Low	68.3	Low	25 Å²	25	53 Å²	53	13%	0.128	31%	0.31	C	S	.	.			trans	-67.7	93.9	166	-51.3	-176.9	0	0	0	108.1	I207 I246 I255 N271 L275	I207-I248 HydrophobicContact CD1-CD1 3.61Å; I207-I248 HydrophobicContact CD1-CG1 3.92Å; I207-I248 HydrophobicContact CD1-CG2 4.3Å; I246-I248 HydrophobicContact CG2-CG1 4.04Å; I246-I248 PolarHBondContact O-N 3.22Å; I246-I248 VanDerWaalsContact O-N 3.09Å; I248-I255 HydrophobicContact CG2-CD1 4.03Å; I248-N271 HydrophobicContact CD1-CB 3.68Å; I248-N271 VanDerWaalsContact CD1-CG 3.48Å; I248-L275 HydrophobicContact CD1-CD2 3.93Å
249	S	55.4	Low	69	Low	94 Å²	94	53 Å²	53	66%	0.657	31%	0.31	S	S	*	.			trans	-110.3	4	-174.6	57.9	0	0	0	0	114.3	G247	G247-S249 VanDerWaalsContact C-N 3.33Å; G247-S249 PolarHBondContact O-N 2.96Å
250	G	59	Low	69.7	Low	26 Å²	26	50.4 Å²	50.4	27%	0.268	30%	0.296	S	S	.	.			trans	-64	140.1	177.6	0	0	0	0	0	112.7	E233	E233-G250 VanDerWaalsContact OE2-CA 3.25Å; E233-G250 WeakPolarHBondContact OE2-CA 3.28Å
251	R	68.1	Low	70.2	Confident	161 Å²	161	51.2 Å²	51.2	61%	0.608	30%	0.296	S	S	*	.			trans	-88.1	-13.7	174	-60.4	175.8	176.7	173.2	2.5	112.1	W203 E233 S505	W203-R251 HydrophobicContact CH2-CB 3.6Å; W203-R251 HydrophobicContact CZ2-CB 3.93Å; W203-R251 HydrophobicContact CZ3-CB 4.5Å; E233-R251 WeakPolarHBondContact OE1-CB 3.45Å; E233-R251 PolarHBondContact OE1-N 3.23Å; E233-R251 PolarHBondContact OE2-N 3.43Å; R251-S505 PolarHBondContact NH1-OG 3.24Å
252	S	76	Confident	70.6	Confident	4 Å²	4	50.1 Å²	50.1	3%	0.028	29%	0.285	C	S	.	.			trans	-60.8	143.8	174.8	80.1	0	0	0	0	111.7	S205 E233 I254	S205-S252 PolarHBondContact N-OG 3.01Å; S205-S252 PolarHBondContact OG-OG 3.02Å; E233-S252 WeakPolarHBondContact OE2-CB 3.4Å; E233-S252 PolarHBondContact OE2-N 3.27Å; S252-I254 VanDerWaalsContact C-N 3.32Å; S252-I254 PolarHBondContact OG-O 3.06Å
253	K	84.6	Confident	71.6	Confident	104 Å²	104	48 Å²	48	45%	0.452	27%	0.271	S	S	.	.	S	Bend	trans	-88.9	-0.8	177.2	-63.8	-175.3	-178	176.9	0	113.6	T278 L279 S497	K253-T278 WeakPolarHBondContact O-CA 3.37Å; K253-L279 PolarHBondContact O-N 3.49Å; K253-S497 PolarHBondContact N-OG 3.38Å
254	I	89.3	Confident	73	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	110.9	-177.2	-59.1	171.4	0	0	0	107.7	L196 M199 I204 S205 S252 L279 I281 V495	L196-I254 HydrophobicContact CD2-CD1 3.57Å; L196-I254 HydrophobicContact CD2-CG2 4.3Å; M199-I254 HydrophobicContact CE-CD1 3.78Å; I204-I254 WeakPolarHBondContact CA-O 3.43Å; I204-I254 HydrophobicContact CG2-CB 4.02Å; I204-I254 HydrophobicContact CG2-CG2 3.96Å; S205-I254 PolarHBondContact N-O 3.49Å; S205-I254 VanDerWaalsContact N-O 3.1Å; S252-I254 VanDerWaalsContact C-N 3.32Å; S252-I254 PolarHBondContact OG-O 3.06Å; I254-L279 VanDerWaalsContact CA-O 3.32Å; I254-L279 WeakPolarHBondContact CA-O 3.34Å; I254-L279 HydrophobicContact CG1-CB 4.45Å; I254-I281 HydrophobicContact CG2-CD1 3.7Å; I254-I281 HydrophobicContact CG2-CG1 4.24Å; I254-V495 HydrophobicContact CD1-CG1 3.83Å; I254-V495 HydrophobicContact CG1-CG1 3.64Å
255	I	90.1	Very high	74.5	Confident	6 Å²	6	40 Å²	40	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.1	-178	-59.7	175.9	0	0	0	107.8	S205 I207 I248 I257 L275 T278 L279 I280 I281	S205-I255 WeakPolarHBondContact O-CA 3.33Å; I207-I255 HydrophobicContact CD1-CG2 3.53Å; I207-I255 HydrophobicContact CG1-CG2 3.73Å; I248-I255 HydrophobicContact CG2-CD1 4.03Å; I255-I257 HydrophobicContact CG2-CG1 4.15Å; I255-L275 HydrophobicContact CD1-CD2 3.77Å; I255-T278 HydrophobicContact CD1-CG2 4.09Å; I255-L279 PolarHBondContact N-O 2.97Å; I255-I280 CarbonylContact O-C 3.37Å; I255-I280 VanDerWaalsContact O-CA 3.28Å; I255-I280 WeakPolarHBondContact O-CA 3.31Å; I255-I281 PolarHBondContact O-N 3.08Å
256	I	92.4	Very high	76	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	131.6	172.2	-51.8	-173.9	0	0	0	108.2	V192 I204 S205 V206 I207 F221 L258 I281 I283	V192-I256 HydrophobicContact CG1-CD1 3.56Å; V192-I256 HydrophobicContact CG2-CD1 4.29Å; I204-I256 HydrophobicContact CD1-CD1 3.66Å; I204-I256 HydrophobicContact CD1-CG1 4.42Å; S205-I256 PolarHBondContact O-N 3.31Å; V206-I256 CarbonylContact C-O 3.55Å; V206-I256 WeakPolarHBondContact CA-O 3.44Å; V206-I256 HydrophobicContact CG2-CB 4.29Å; V206-I256 HydrophobicContact CG2-CD1 4.49Å; I207-I256 PolarHBondContact N-O 3.36Å; F221-I256 HydrophobicContact CE1-CD1 4.49Å; F221-I256 HydrophobicContact CZ-CD1 4.11Å; F221-I256 HydrophobicContact CZ-CG2 4.12Å; I256-L258 HydrophobicContact CG2-CD2 3.83Å; I256-L258 HydrophobicContact CG2-CG 4.48Å; I256-I281 WeakPolarHBondContact CA-O 3.39Å; I256-I281 HydrophobicContact CG1-CB 4.39Å; I256-I283 HydrophobicContact CG2-CD1 3.66Å; I256-I283 HydrophobicContact CG2-CG1 4.15Å
257	I	90.7	Very high	77.2	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	115.7	174.6	-54.3	-178.4	0	0	0	109.1	I207 I255 L264 L267 L268 I280 I281 I283	I207-I257 HydrophobicContact CB-CG1 4.38Å; I207-I257 HydrophobicContact CD1-CG1 4.49Å; I207-I257 WeakPolarHBondContact O-CA 3.27Å; I255-I257 HydrophobicContact CG2-CG1 4.15Å; I257-L264 HydrophobicContact CB-CD1 3.99Å; I257-L264 HydrophobicContact CD1-CD1 4.07Å; I257-L264 HydrophobicContact CG2-CD1 3.66Å; I257-L267 HydrophobicContact CD1-CD2 4.13Å; I257-L267 HydrophobicContact CG2-CD1 4.09Å; I257-L268 HydrophobicContact CD1-CD2 3.92Å; I257-I280 HydrophobicContact CD1-CG2 3.47Å; I257-I280 VanDerWaalsContact CD1-CG2 3.47Å; I257-I280 HydrophobicContact CG1-CG2 3.8Å; I257-I281 PolarHBondContact N-O 2.96Å; I257-I283 PolarHBondContact O-N 3.32Å
258	L	90.2	Very high	78.5	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	96.8	174.2	-51.6	-175.9	0	0	0	108.6	L185 V206 I207 Y208 C209 V213 L218 F221 I256 I283 T285	L185-L258 HydrophobicContact CD1-CD1 4.47Å; L185-L258 HydrophobicContact CD1-CD2 4.08Å; L185-L258 HydrophobicContact CD2-CD1 4.34Å; V206-L258 HydrophobicContact CG1-CD1 4.05Å; V206-L258 HydrophobicContact CG1-CG 4.12Å; I207-L258 PolarHBondContact O-N 3.01Å; Y208-L258 WeakPolarHBondContact CA-O 3.46Å; C209-L258 PolarHBondContact N-O 3.37Å; V213-L258 HydrophobicContact CG2-CB 3.88Å; L218-L258 HydrophobicContact CD1-CD1 3.62Å; F221-L258 HydrophobicContact CD1-CD1 4.01Å; F221-L258 HydrophobicContact CE1-CD1 4.03Å; F221-L258 HydrophobicContact CE1-CD2 4.28Å; F221-L258 HydrophobicContact CE2-CD2 4.39Å; F221-L258 HydrophobicContact CG-CD1 4.49Å; F221-L258 HydrophobicContact CZ-CD2 4.03Å; I256-L258 HydrophobicContact CG2-CD2 3.83Å; I256-L258 HydrophobicContact CG2-CG 4.48Å; L258-I283 HydrophobicContact CD2-CB 3.77Å; L258-I283 HydrophobicContact CD2-CD1 3.78Å; L258-I283 HydrophobicContact CD2-CG1 4.17Å; L258-I283 HydrophobicContact CD2-CG2 4.25Å; L258-T285 HydrophobicContact CB-CG2 4.43Å
259	S	85.7	Confident	79.4	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	162.9	-172.4	-163.6	0	0	0	0	112.7	C209 D263 L264 I283 T285	C209-S259 PolarHBondContact SG-OG 3.48Å; S259-D263 WeakPolarHBondContact OG-CB 3.21Å; S259-L264 PolarHBondContact OG-N 3.32Å; S259-I283 PolarHBondContact N-O 3.27Å; S259-T285 PolarHBondContact O-N 2.76Å; S259-T285 VanDerWaalsContact O-N 3.08Å; S259-T285 PolarHBondContact O-OG1 2.69Å
260	N	78.9	Confident	80.4	Confident	27 Å²	27	38 Å²	38	14%	0.144	17%	0.172	C	C	.	.			trans	-81.2	166.1	171	77.5	63.8	0	0	0	110.5	S212 R262 D263 L264 T285 N286	S212-N260 PolarHBondContact OG-ND2 3.14Å; N260-R262 VanDerWaalsContact C-N 3.31Å; N260-R262 PolarHBondContact O-N 3.03Å; N260-R262 WeakPolarHBondContact OD1-CB 3.47Å; N260-R262 PolarHBondContact OD1-N 3.35Å; N260-D263 PolarHBondContact ND2-OD1 3.03Å; N260-D263 PolarHBondContact ND2-OD2 3.17Å; N260-D263 PolarHBondContact O-N 3.19Å; N260-D263 PolarHBondContact OD1-N 3.36Å; N260-D263 VanDerWaalsContact OD1-N 3.1Å; N260-L264 WeakPolarHBondContact O-CB 3.36Å; N260-L264 PolarHBondContact O-N 3.36Å; N260-T285 WeakPolarHBondContact CA-OG1 3.47Å; N260-T285 PolarHBondContact N-OG1 3.37Å; N260-T285 VanDerWaalsContact N-OG1 3.15Å; N260-N286 WeakPolarHBondContact CB-OD1 3.41Å
261	R	74.2	Confident	81.2	Confident	61 Å²	61	37.1 Å²	37.1	23%	0.23	16%	0.162	C	C	.	.	H	α-helix	trans	-52.4	-40.2	-177.7	-179.6	-173.2	161.8	-178.8	-21.2	115	Q288 T289 L290 S291 Q294	R261-Q288 HydrophobicContact CB-CB 4.2Å; R261-T289 WeakPolarHBondContact CD-O 3.05Å; R261-T289 PolarHBondContact NE-O 3.07Å; R261-T289 PolarHBondContact NH1-O 3.11Å; R261-L290 HydrophobicContact CG-CD1 4.28Å; R261-L290 HydrophobicContact CG-CG 4.19Å; R261-S291 VanDerWaalsContact NH2-CB 3.31Å; R261-S291 PolarHBondContact NH2-OG 2.78Å; R261-Q294 VanDerWaalsContact CZ-OE1 3.24Å
262	R	72.3	Confident	81.5	Confident	153 Å²	153	31.3 Å²	31.3	58%	0.577	14%	0.142	S	C	*	.	H	α-helix	trans	-74.8	-48.6	-177.2	-57.1	178.4	-174.3	167.6	2.8	109.7	N260 L264 V265 T266	N260-R262 VanDerWaalsContact C-N 3.31Å; N260-R262 PolarHBondContact O-N 3.03Å; N260-R262 WeakPolarHBondContact OD1-CB 3.47Å; N260-R262 PolarHBondContact OD1-N 3.35Å; R262-L264 PolarHBondContact O-N 2.7Å; R262-V265 PolarHBondContact O-N 2.67Å; R262-T266 PolarHBondContact O-N 2.96Å
263	D	78.1	Confident	81.3	Confident	29 Å²	29	33.9 Å²	33.9	16%	0.155	17%	0.17	C	C	.	.	H	α-helix	trans	-66.1	-33.4	-176.8	-71.9	19	0	0	0	112.4	S211 I240 S259 N260 T266 L267	S211-D263 PolarHBondContact OG-OD2 3Å; S211-D263 VanDerWaalsContact OG-OD2 3.09Å; I240-D263 HydrophobicContact CD1-CB 3.34Å; I240-D263 WeakPolarHBondContact CD1-OD2 3.42Å; S259-D263 WeakPolarHBondContact OG-CB 3.21Å; N260-D263 PolarHBondContact ND2-OD1 3.03Å; N260-D263 PolarHBondContact ND2-OD2 3.17Å; N260-D263 PolarHBondContact O-N 3.19Å; N260-D263 PolarHBondContact OD1-N 3.36Å; N260-D263 VanDerWaalsContact OD1-N 3.1Å; D263-T266 PolarHBondContact O-OG1 3.17Å; D263-T266 VanDerWaalsContact O-OG1 3.05Å; D263-L267 WeakPolarHBondContact O-CB 3.35Å; D263-L267 PolarHBondContact O-N 2.87Å; D263-L267 VanDerWaalsContact O-N 3.08Å
264	L	82.8	Confident	80.7	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.031	18%	0.176	C	C	.	.	H	α-helix	trans	-63.4	-43.2	175	179.6	61.4	0	0	0	112.2	I257 S259 N260 R262 L268 L290 L309	I257-L264 HydrophobicContact CB-CD1 3.99Å; I257-L264 HydrophobicContact CD1-CD1 4.07Å; I257-L264 HydrophobicContact CG2-CD1 3.66Å; S259-L264 PolarHBondContact OG-N 3.32Å; N260-L264 WeakPolarHBondContact O-CB 3.36Å; N260-L264 PolarHBondContact O-N 3.36Å; R262-L264 PolarHBondContact O-N 2.7Å; L264-L268 HydrophobicContact CD1-CD1 3.94Å; L264-L268 HydrophobicContact CD1-CG 4.14Å; L264-L268 HydrophobicContact CG-CD1 4.01Å; L264-L268 WeakPolarHBondContact O-CB 3.47Å; L264-L268 VanDerWaalsContact O-CG 3.23Å; L264-L268 WeakPolarHBondContact O-CG 3.46Å; L264-L268 PolarHBondContact O-N 3.43Å; L264-L290 HydrophobicContact CD2-CD1 4.45Å; L264-L309 HydrophobicContact CD2-CD1 4.08Å
265	V	80.2	Confident	80	Confident	13 Å²	13	36.4 Å²	36.4	8%	0.079	18%	0.176	C	C	.	.	H	α-helix	trans	-69.8	-40.4	-177.1	177.7	0	0	0	0	111.2	R262 T269 L290 Q294 L298	R262-V265 PolarHBondContact O-N 2.67Å; V265-T269 HydrophobicContact CG1-CG2 4.48Å; V265-T269 WeakPolarHBondContact O-CB 3.34Å; V265-T269 VanDerWaalsContact O-CG2 3.31Å; V265-T269 WeakPolarHBondContact O-CG2 3.41Å; V265-T269 PolarHBondContact O-N 3.17Å; V265-T269 PolarHBondContact O-OG1 2.74Å; V265-L290 HydrophobicContact CG2-CD2 3.99Å; V265-Q294 HydrophobicContact CG2-CB 4.48Å; V265-L298 HydrophobicContact CG1-CD2 4.41Å; V265-L298 HydrophobicContact CG2-CD1 4.37Å
266	T	80.2	Confident	79.4	Confident	45 Å²	45	43.4 Å²	43.4	28%	0.276	20%	0.203	S	C	.	.	H	α-helix	trans	-67.5	-44.5	176.4	53.3	0	0	0	0	111.7	R262 D263 L268 T269 W270	R262-T266 PolarHBondContact O-N 2.96Å; D263-T266 PolarHBondContact O-OG1 3.17Å; D263-T266 VanDerWaalsContact O-OG1 3.05Å; T266-L268 PolarHBondContact O-N 3.06Å; T266-T269 WeakPolarHBondContact CA-OG1 3.43Å; T266-T269 PolarHBondContact O-N 3.12Å; T266-T269 PolarHBondContact O-OG1 3.08Å; T266-T269 VanDerWaalsContact O-OG1 3.12Å; T266-W270 VanDerWaalsContact O-CG 3.3Å; T266-W270 PolarHBondContact O-N 3.1Å
267	L	79.2	Confident	78.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-44.9	179.2	-166.2	171.6	0	0	0	111.7	I207 A238 I257 D263 N271	I207-L267 HydrophobicContact CG2-CD1 3.92Å; A238-L267 HydrophobicContact CB-CD1 3.55Å; A238-L267 HydrophobicContact CB-CG 4.28Å; I257-L267 HydrophobicContact CD1-CD2 4.13Å; I257-L267 HydrophobicContact CG2-CD1 4.09Å; D263-L267 WeakPolarHBondContact O-CB 3.35Å; D263-L267 PolarHBondContact O-N 2.87Å; D263-L267 VanDerWaalsContact O-N 3.08Å; L267-N271 PolarHBondContact O-N 3.37Å; L267-N271 PolarHBondContact O-ND2 3.04Å
268	L	81.3	Confident	78.3	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-48.5	174.9	-73.4	174.1	0	0	0	111.9	I257 L264 T266 W270 N271 I272 L275 I280 L298 F305 L307	I257-L268 HydrophobicContact CD1-CD2 3.92Å; L264-L268 HydrophobicContact CD1-CD1 3.94Å; L264-L268 HydrophobicContact CD1-CG 4.14Å; L264-L268 HydrophobicContact CG-CD1 4.01Å; L264-L268 WeakPolarHBondContact O-CB 3.47Å; L264-L268 VanDerWaalsContact O-CG 3.23Å; L264-L268 WeakPolarHBondContact O-CG 3.46Å; L264-L268 PolarHBondContact O-N 3.43Å; T266-L268 PolarHBondContact O-N 3.06Å; L268-W270 VanDerWaalsContact C-N 3.32Å; L268-W270 PolarHBondContact O-N 3.03Å; L268-N271 PolarHBondContact O-N 3.5Å; L268-N271 VanDerWaalsContact O-N 3.15Å; L268-I272 VanDerWaalsContact O-CG1 3.24Å; L268-I272 WeakPolarHBondContact O-CG1 3.44Å; L268-I272 PolarHBondContact O-N 3.43Å; L268-L275 HydrophobicContact CD2-CD1 3.96Å; L268-I280 HydrophobicContact CD2-CD1 3.41Å; L268-I280 VanDerWaalsContact CD2-CD1 3.41Å; L268-I280 HydrophobicContact CD2-CG2 4.29Å; L268-L298 HydrophobicContact CB-CD2 4.03Å; L268-L298 HydrophobicContact CD1-CD1 4.2Å; L268-L298 HydrophobicContact CD1-CD2 3.86Å; L268-F305 HydrophobicContact CD2-CE2 4.28Å; L268-F305 HydrophobicContact CD2-CZ 4.46Å; L268-L307 HydrophobicContact CD1-CD1 4.45Å; L268-L307 HydrophobicContact CD1-CD2 3.99Å
269	T	78.8	Confident	78.3	Confident	50 Å²	50	47.2 Å²	47.2	31%	0.307	22%	0.223	S	C	.	.	H	α-helix	trans	-67.3	-29	-175.9	49.5	0	0	0	0	113.6	V265 T266 L298 I301	V265-T269 HydrophobicContact CG1-CG2 4.48Å; V265-T269 WeakPolarHBondContact O-CB 3.34Å; V265-T269 VanDerWaalsContact O-CG2 3.31Å; V265-T269 WeakPolarHBondContact O-CG2 3.41Å; V265-T269 PolarHBondContact O-N 3.17Å; V265-T269 PolarHBondContact O-OG1 2.74Å; T266-T269 WeakPolarHBondContact CA-OG1 3.43Å; T266-T269 PolarHBondContact O-N 3.12Å; T266-T269 PolarHBondContact O-OG1 3.08Å; T266-T269 VanDerWaalsContact O-OG1 3.12Å; T269-L298 HydrophobicContact CG2-CD2 4.46Å; T269-I301 HydrophobicContact CG2-CD1 3.88Å
270	W	76.7	Confident	78.5	Confident	109 Å²	109	47.1 Å²	47.1	41%	0.413	22%	0.223	S	C	.	.	H	α-helix	trans	-76.7	-22	173.9	-64.3	-8.7	0	0	0	113.9	I240 P243 T266 L268	I240-W270 HydrophobicContact CG2-CH2 3.88Å; I240-W270 HydrophobicContact CG2-CZ3 4.12Å; I240-W270 VanDerWaalsContact O-CH2 3.3Å; I240-W270 WeakPolarHBondContact O-CH2 3.43Å; P243-W270 HydrophobicContact CB-CE3 4.38Å; P243-W270 HydrophobicContact CB-CH2 4.28Å; P243-W270 HydrophobicContact CB-CZ2 4.48Å; P243-W270 HydrophobicContact CB-CZ3 4.23Å; P243-W270 HydrophobicContact CG-CH2 4.02Å; P243-W270 HydrophobicContact CG-CZ2 4.33Å; P243-W270 HydrophobicContact CG-CZ3 4.35Å; T266-W270 VanDerWaalsContact O-CG 3.3Å; T266-W270 PolarHBondContact O-N 3.1Å; L268-W270 VanDerWaalsContact C-N 3.32Å; L268-W270 PolarHBondContact O-N 3.03Å
271	N	75.7	Confident	79.1	Confident	8 Å²	8	45.9 Å²	45.9	4%	0.043	22%	0.216	C	C	.	.	H	α-helix	trans	-110.2	3.9	-171.6	-74.2	-80.2	0	0	0	115.5	I246 I248 L267 L268 G273 R274 L275	I246-N271 PolarHBondContact O-OD1 2.55Å; I248-N271 HydrophobicContact CD1-CB 3.68Å; I248-N271 VanDerWaalsContact CD1-CG 3.48Å; L267-N271 PolarHBondContact O-N 3.37Å; L267-N271 PolarHBondContact O-ND2 3.04Å; L268-N271 PolarHBondContact O-N 3.5Å; L268-N271 VanDerWaalsContact O-N 3.15Å; N271-G273 PolarHBondContact O-N 3.32Å; N271-R274 PolarHBondContact O-N 3.21Å; N271-L275 HydrophobicContact CB-CD1 3.82Å; N271-L275 HydrophobicContact CB-CG 4.08Å; N271-L275 WeakPolarHBondContact O-CG 3.33Å; N271-L275 PolarHBondContact O-N 2.91Å
272	I	74.8	Confident	79.9	Confident	39 Å²	39	43 Å²	43	20%	0.2	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.8	-41.9	-175.3	-55.9	180	0	0	0	113.2	L268 R274 L275 I301 F305	L268-I272 VanDerWaalsContact O-CG1 3.24Å; L268-I272 WeakPolarHBondContact O-CG1 3.44Å; L268-I272 PolarHBondContact O-N 3.43Å; I272-R274 VanDerWaalsContact C-N 3.28Å; I272-R274 PolarHBondContact O-N 3.43Å; I272-L275 PolarHBondContact O-N 3.19Å; I272-I301 HydrophobicContact CD1-CB 3.88Å; I272-I301 HydrophobicContact CD1-CD1 3.73Å; I272-I301 HydrophobicContact CD1-CG1 4.4Å; I272-I301 HydrophobicContact CD1-CG2 3.45Å; I272-I301 VanDerWaalsContact CD1-CG2 3.45Å; I272-F305 HydrophobicContact CG1-CE1 4.49Å; I272-F305 HydrophobicContact CG2-CE1 4.48Å
273	G	70.6	Confident	80.8	Confident	59 Å²	59	35.8 Å²	35.8	61%	0.608	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-27	179.9	0	0	0	0	0	115	N271	N271-G273 PolarHBondContact O-N 3.32Å
274	R	72.6	Confident	81.2	Confident	155 Å²	155	35.2 Å²	35.2	59%	0.585	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-28.1	-179.8	-68.5	179.6	175	149.1	-1.9	113.2	I246 N271 I272 R276	I246-R274 PolarHBondContact O-NH1 2.78Å; N271-R274 PolarHBondContact O-N 3.21Å; I272-R274 VanDerWaalsContact C-N 3.28Å; I272-R274 PolarHBondContact O-N 3.43Å; R274-R276 PolarHBondContact O-N 2.83Å; R274-R276 VanDerWaalsContact O-N 3.08Å
275	L	75.6	Confident	81.2	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.178	C	C	.	.			trans	-75	8.2	-174	-65.9	167.5	0	0	0	115	I248 I255 L268 N271 I272 N277 T278 I280 F305	I248-L275 HydrophobicContact CD1-CD2 3.93Å; I255-L275 HydrophobicContact CD1-CD2 3.77Å; L268-L275 HydrophobicContact CD2-CD1 3.96Å; N271-L275 HydrophobicContact CB-CD1 3.82Å; N271-L275 HydrophobicContact CB-CG 4.08Å; N271-L275 WeakPolarHBondContact O-CG 3.33Å; N271-L275 PolarHBondContact O-N 2.91Å; I272-L275 PolarHBondContact O-N 3.19Å; L275-N277 PolarHBondContact O-N 2.86Å; L275-T278 PolarHBondContact O-N 2.92Å; L275-T278 PolarHBondContact O-OG1 3.43Å; L275-I280 HydrophobicContact CB-CD1 4.33Å; L275-I280 HydrophobicContact CD1-CD1 3.82Å; L275-I280 HydrophobicContact CD2-CD1 3.87Å; L275-I280 HydrophobicContact CG-CD1 4.22Å; L275-F305 HydrophobicContact CB-CB 4.28Å; L275-F305 HydrophobicContact CB-CD1 4.1Å; L275-F305 HydrophobicContact CB-CG 4.39Å; L275-F305 WeakPolarHBondContact O-CB 3.46Å
276	R	76.2	Confident	81.2	Confident	154 Å²	154	35.7 Å²	35.7	58%	0.581	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	130.5	-173.2	-63.4	-176.5	168.5	-148.1	-4.4	112.9	R274 T278 Q304	R274-R276 PolarHBondContact O-N 2.83Å; R274-R276 VanDerWaalsContact O-N 3.08Å; R276-T278 VanDerWaalsContact C-N 3.28Å; R276-T278 PolarHBondContact O-N 2.89Å; R276-Q304 CarbonylContact C-O 3.59Å; R276-Q304 WeakPolarHBondContact CA-O 3.39Å; R276-Q304 HydrophobicContact CB-CB 4.4Å; R276-Q304 HydrophobicContact CG-CB 4.1Å; R276-Q304 VanDerWaalsContact CZ-OE1 3.24Å; R276-Q304 VanDerWaalsContact NE-OE1 3.13Å
277	N	77.4	Confident	81	Confident	67 Å²	67	34.2 Å²	34.2	36%	0.358	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	36.8	-177	-67.2	-8.5	0	0	0	114.4	L275 Q304	L275-N277 PolarHBondContact O-N 2.86Å; N277-Q304 PolarHBondContact N-O 3.37Å
278	T	83.8	Confident	80.6	Confident	13 Å²	13	35.8 Å²	35.8	8%	0.08	18%	0.176	C	C	.	.			trans	-106.9	149	169.9	66.3	0	0	0	0	112	K253 I255 L275 R276 S306	K253-T278 WeakPolarHBondContact O-CA 3.37Å; I255-T278 HydrophobicContact CD1-CG2 4.09Å; L275-T278 PolarHBondContact O-N 2.92Å; L275-T278 PolarHBondContact O-OG1 3.43Å; R276-T278 VanDerWaalsContact C-N 3.28Å; R276-T278 PolarHBondContact O-N 2.89Å; T278-S306 PolarHBondContact O-N 3.34Å; T278-S306 VanDerWaalsContact O-N 3.08Å
279	L	88.9	Confident	80.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	125.4	160.5	177.8	72.5	0	0	0	107.8	M199 K253 I254 I255 I281 L308 L457 L487 V495	M199-L279 HydrophobicContact CE-CD2 4.11Å; M199-L279 HydrophobicContact SD-CD2 4.03Å; K253-L279 PolarHBondContact O-N 3.49Å; I254-L279 VanDerWaalsContact CA-O 3.32Å; I254-L279 WeakPolarHBondContact CA-O 3.34Å; I254-L279 HydrophobicContact CG1-CB 4.45Å; I255-L279 PolarHBondContact N-O 2.97Å; L279-I281 HydrophobicContact CD2-CD1 4.45Å; L279-I281 HydrophobicContact CD2-CG1 4.26Å; L279-I281 HydrophobicContact CG-CG1 4.4Å; L279-L308 HydrophobicContact CD1-CB 4.26Å; L279-L457 HydrophobicContact CD1-CD1 4.38Å; L279-L487 HydrophobicContact CD2-CD1 4.43Å; L279-V495 HydrophobicContact CB-CG1 3.82Å; L279-V495 HydrophobicContact CB-CG2 3.97Å; L279-V495 HydrophobicContact CD2-CB 4.39Å; L279-V495 HydrophobicContact CD2-CG1 3.9Å; L279-V495 HydrophobicContact CD2-CG2 4.15Å; L279-V495 HydrophobicContact CG-CG1 4.48Å; L279-V495 HydrophobicContact CG-CG2 4.42Å
280	I	90.1	Very high	79.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.4	176	-54.1	-178.8	0	0	0	107.9	I255 I257 L268 L275 F305 S306 L307 L308	I255-I280 CarbonylContact O-C 3.37Å; I255-I280 VanDerWaalsContact O-CA 3.28Å; I255-I280 WeakPolarHBondContact O-CA 3.31Å; I257-I280 HydrophobicContact CD1-CG2 3.47Å; I257-I280 VanDerWaalsContact CD1-CG2 3.47Å; I257-I280 HydrophobicContact CG1-CG2 3.8Å; L268-I280 HydrophobicContact CD2-CD1 3.41Å; L268-I280 VanDerWaalsContact CD2-CD1 3.41Å; L268-I280 HydrophobicContact CD2-CG2 4.29Å; L275-I280 HydrophobicContact CB-CD1 4.33Å; L275-I280 HydrophobicContact CD1-CD1 3.82Å; L275-I280 HydrophobicContact CD2-CD1 3.87Å; L275-I280 HydrophobicContact CG-CD1 4.22Å; I280-F305 HydrophobicContact CD1-CB 4.11Å; I280-F305 HydrophobicContact CD1-CD2 3.57Å; I280-F305 HydrophobicContact CD1-CE2 4.13Å; I280-F305 HydrophobicContact CD1-CG 3.87Å; I280-F305 HydrophobicContact CG1-CB 4.49Å; I280-F305 HydrophobicContact CG1-CD2 4.32Å; I280-S306 PolarHBondContact N-O 3.1Å; I280-L307 HydrophobicContact CB-CD1 4.05Å; I280-L307 HydrophobicContact CG2-CD1 3.81Å; I280-L307 CarbonylContact O-C 3.52Å; I280-L307 WeakPolarHBondContact O-CA 3.48Å; I280-L308 PolarHBondContact O-N 3.25Å
281	I	92.6	Very high	79.7	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	102.1	174.2	-57.2	175.5	0	0	0	107.4	V192 L195 I254 I255 I256 I257 L279 I283 L308 L310	V192-I281 HydrophobicContact CG2-CG2 4.38Å; L195-I281 HydrophobicContact CD2-CD1 4.23Å; I254-I281 HydrophobicContact CG2-CD1 3.7Å; I254-I281 HydrophobicContact CG2-CG1 4.24Å; I255-I281 PolarHBondContact O-N 3.08Å; I256-I281 WeakPolarHBondContact CA-O 3.39Å; I256-I281 HydrophobicContact CG1-CB 4.39Å; I257-I281 PolarHBondContact N-O 2.96Å; L279-I281 HydrophobicContact CD2-CD1 4.45Å; L279-I281 HydrophobicContact CD2-CG1 4.26Å; L279-I281 HydrophobicContact CG-CG1 4.4Å; I281-I283 HydrophobicContact CG2-CG1 4.23Å; I281-L308 CarbonylContact C-O 3.57Å; I281-L308 WeakPolarHBondContact CA-O 3.49Å; I281-L310 HydrophobicContact CG2-CD1 3.87Å; I281-L310 HydrophobicContact CG2-CG 4.05Å
282	G	90.3	Very high	79.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	119.3	176.2	0	0	0	0	0	110.4	L308 L310	G282-L308 PolarHBondContact N-O 2.84Å; G282-L310 PolarHBondContact O-N 2.84Å
283	I	91.3	Very high	79.4	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	115.1	174.7	-55.8	179.1	0	0	0	107.7	L185 Y188 V192 F221 I256 I257 L258 S259 I281 T285 L310	L185-I283 HydrophobicContact CD1-CG2 4.24Å; Y188-I283 HydrophobicContact CD1-CG2 3.88Å; Y188-I283 HydrophobicContact CD2-CG2 3.87Å; Y188-I283 HydrophobicContact CE1-CG2 4.31Å; Y188-I283 HydrophobicContact CE2-CG2 4.29Å; Y188-I283 HydrophobicContact CG-CG2 3.64Å; V192-I283 HydrophobicContact CG2-CD1 3.73Å; F221-I283 HydrophobicContact CE2-CD1 3.98Å; F221-I283 HydrophobicContact CZ-CD1 3.99Å; I256-I283 HydrophobicContact CG2-CD1 3.66Å; I256-I283 HydrophobicContact CG2-CG1 4.15Å; I257-I283 PolarHBondContact O-N 3.32Å; L258-I283 HydrophobicContact CD2-CB 3.77Å; L258-I283 HydrophobicContact CD2-CD1 3.78Å; L258-I283 HydrophobicContact CD2-CG1 4.17Å; L258-I283 HydrophobicContact CD2-CG2 4.25Å; S259-I283 PolarHBondContact N-O 3.27Å; I281-I283 HydrophobicContact CG2-CG1 4.23Å; I283-T285 PolarHBondContact O-N 2.89Å; I283-L310 HydrophobicContact CG1-CD1 4.29Å
284	P	86.1	Confident	79.5	Confident	18 Å²	18	40.5 Å²	40.5	12%	0.117	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	127.6	-177.4	31.1	-34.5	0	0	0	110	N286 L310	P284-N286 VanDerWaalsContact C-N 3.3Å; P284-N286 WeakPolarHBondContact CB-O 3.3Å; P284-L310 WeakPolarHBondContact CD-O 3.28Å; P284-L310 VanDerWaalsContact CG-O 3.28Å; P284-L310 WeakPolarHBondContact CG-O 3.12Å
285	T	83.1	Confident	79.6	Confident	11 Å²	11	34.8 Å²	34.8	7%	0.067	17%	0.173	C	C	.	.	S	Bend	trans	-83.9	-9.2	177.9	57.3	0	0	0	0	113.4	A165 Q168 S212 V213 L258 S259 N260 I283	A165-T285 WeakPolarHBondContact CA-O 3.29Å; Q168-T285 PolarHBondContact NE2-O 2.91Å; S212-T285 WeakPolarHBondContact CB-OG1 3.33Å; S212-T285 WeakPolarHBondContact O-CB 3.1Å; V213-T285 HydrophobicContact CG2-CG2 3.62Å; L258-T285 HydrophobicContact CB-CG2 4.43Å; S259-T285 PolarHBondContact O-N 2.76Å; S259-T285 VanDerWaalsContact O-N 3.08Å; S259-T285 PolarHBondContact O-OG1 2.69Å; N260-T285 WeakPolarHBondContact CA-OG1 3.47Å; N260-T285 PolarHBondContact N-OG1 3.37Å; N260-T285 VanDerWaalsContact N-OG1 3.15Å; I283-T285 PolarHBondContact O-N 2.89Å
286	N	79.6	Confident	79.5	Confident	17 Å²	17	40.1 Å²	40.1	9%	0.091	20%	0.197	C	C	.	.	S	Bend	trans	-143.2	163.5	175.2	78.4	-45.3	0	0	0	109.8	E140 T164 A165 N260 P284 Q288	E140-N286 WeakPolarHBondContact OE1-CB 3.37Å; E140-N286 PolarHBondContact OE1-ND2 2.7Å; T164-N286 VanDerWaalsContact OG1-C 3.24Å; T164-N286 WeakPolarHBondContact OG1-CA 3.48Å; A165-N286 HydrophobicContact CB-CB 4.24Å; N260-N286 WeakPolarHBondContact CB-OD1 3.41Å; P284-N286 VanDerWaalsContact C-N 3.3Å; P284-N286 WeakPolarHBondContact CB-O 3.3Å; N286-Q288 VanDerWaalsContact ND2-CD 3.27Å; N286-Q288 WeakPolarHBondContact ND2-CG 3.01Å; N286-Q288 PolarHBondContact ND2-NE2 2.93Å; N286-Q288 PolarHBondContact O-N 3.04Å; N286-Q288 VanDerWaalsContact O-N 3.07Å
287	D	76.3	Confident	79.4	Confident	14 Å²	14	36.6 Å²	36.6	8%	0.075	19%	0.187	C	C	.	.	S	Bend	trans	-76.5	-2.4	-163.2	-55.2	-73	0	0	0	115.4	S163 T164 T289 A375 T376	S163-D287 WeakPolarHBondContact CA-OD2 3.49Å; S163-D287 WeakPolarHBondContact CB-OD2 3.38Å; S163-D287 PolarHBondContact OG-OD2 3.1Å; T164-D287 WeakPolarHBondContact CB-OD1 3.41Å; T164-D287 VanDerWaalsContact CG2-OD1 3.24Å; T164-D287 WeakPolarHBondContact CG2-OD1 3.47Å; T164-D287 PolarHBondContact N-OD1 3.09Å; T164-D287 VanDerWaalsContact N-OD1 3.07Å; T164-D287 PolarHBondContact N-OD2 3.04Å; T164-D287 PolarHBondContact OG1-N 3.1Å; T164-D287 PolarHBondContact OG1-OD1 2.67Å; T164-D287 PolarHBondContact OG1-OD2 3.5Å; D287-T289 PolarHBondContact O-N 3.32Å; D287-A375 HydrophobicContact CB-CB 4.15Å; D287-A375 WeakPolarHBondContact O-CB 3.39Å; D287-T376 HydrophobicContact CB-CG2 3.68Å; D287-T376 VanDerWaalsContact CG-CG2 3.49Å; D287-T376 WeakPolarHBondContact OD2-CG2 3.29Å
288	Q	72	Confident	79.2	Confident	33 Å²	33	34 Å²	34	15%	0.154	17%	0.173	C	C	.	.			trans	-73.9	110.6	-171.7	-65.3	177.3	10.8	0	0	112.7	R261 N286	R261-Q288 HydrophobicContact CB-CB 4.2Å; N286-Q288 VanDerWaalsContact ND2-CD 3.27Å; N286-Q288 WeakPolarHBondContact ND2-CG 3.01Å; N286-Q288 PolarHBondContact ND2-NE2 2.93Å; N286-Q288 PolarHBondContact O-N 3.04Å; N286-Q288 VanDerWaalsContact O-N 3.07Å
289	T	70.6	Confident	78.5	Confident	53 Å²	53	34.8 Å²	34.8	33%	0.325	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-71	148.7	175.2	61.3	0	0	0	0	111.8	R261 D287 E311	R261-T289 WeakPolarHBondContact CD-O 3.05Å; R261-T289 PolarHBondContact NE-O 3.07Å; R261-T289 PolarHBondContact NH1-O 3.11Å; D287-T289 PolarHBondContact O-N 3.32Å; T289-E311 WeakPolarHBondContact CA-OE1 3.2Å; T289-E311 VanDerWaalsContact CB-OE1 3.28Å; T289-E311 WeakPolarHBondContact CB-OE1 3.34Å; T289-E311 VanDerWaalsContact CG2-OE1 3.31Å; T289-E311 WeakPolarHBondContact CG2-OE1 3.09Å
290	L	73.9	Confident	77.3	Confident	5 Å²	5	40.7 Å²	40.7	3%	0.026	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-64.7	135.2	175.2	-82.6	80	0	0	0	110.9	R261 L264 V265 Q294 R295 L298 L309	R261-L290 HydrophobicContact CG-CD1 4.28Å; R261-L290 HydrophobicContact CG-CG 4.19Å; L264-L290 HydrophobicContact CD2-CD1 4.45Å; V265-L290 HydrophobicContact CG2-CD2 3.99Å; L290-Q294 HydrophobicContact CD2-CB 4.45Å; L290-R295 HydrophobicContact CB-CG 3.98Å; L290-R295 VanDerWaalsContact O-CZ 3.31Å; L290-R295 PolarHBondContact O-NE 3.31Å; L290-L298 HydrophobicContact CD2-CD1 3.62Å; L290-L309 HydrophobicContact CD1-CD1 4.31Å; L290-L309 HydrophobicContact CD1-CD2 3.89Å
291	S	71.4	Confident	75.8	Confident	44 Å²	44	44.4 Å²	44.4	31%	0.308	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-74.4	154.3	171.4	56.2	0	0	0	0	111.3	R261 E293 Q294 R295	R261-S291 VanDerWaalsContact NH2-CB 3.31Å; R261-S291 PolarHBondContact NH2-OG 2.78Å; S291-E293 PolarHBondContact O-N 3.35Å; S291-Q294 WeakPolarHBondContact O-CA 3.46Å; S291-Q294 PolarHBondContact O-N 2.04Å; S291-Q294 PolarHBondContact OG-OE1 3.21Å; S291-R295 PolarHBondContact O-N 3.38Å
292	D	71.7	Confident	74.2	Confident	110 Å²	110	51 Å²	51	59%	0.588	26%	0.258	S	S	*	.	H	α-helix	trans	-61.8	-30.7	-174.8	-53.9	-56.6	0	0	0	113.1	Q294 R295 F296	D292-Q294 PolarHBondContact O-N 2.87Å; D292-R295 PolarHBondContact O-N 2.63Å; D292-R295 IonicContact OD1-CZ 3.2Å; D292-R295 IonicContact OD1-NH1 3.03Å; D292-R295 PolarHBondContact OD1-NH1 2.66Å; D292-F296 VanDerWaalsContact O-CB 3.25Å; D292-F296 WeakPolarHBondContact O-CB 3.44Å; D292-F296 PolarHBondContact O-N 3.28Å
293	E	73.4	Confident	72.6	Confident	115 Å²	115	51.2 Å²	51.2	54%	0.537	26%	0.26	S	S	.	.	H	α-helix	trans	-57.7	-44.2	168.1	-180	57.9	-147.9	0	0	112.6	S291 F296 Q297	S291-E293 PolarHBondContact O-N 3.35Å; E293-F296 PolarHBondContact O-N 3.38Å; E293-Q297 WeakPolarHBondContact O-CB 3.26Å; E293-Q297 VanDerWaalsContact O-CG 3.25Å; E293-Q297 WeakPolarHBondContact O-CG 3.21Å; E293-Q297 PolarHBondContact O-N 2.96Å; E293-Q297 PolarHBondContact OE1-NE2 3.35Å
294	Q	72.8	Confident	71.6	Confident	38 Å²	38	54.9 Å²	54.9	18%	0.178	28%	0.277	C	S	.	.	H	α-helix	trans	-76.5	-32.8	179.2	-69.8	-178.5	-54.9	0	0	112.1	R261 V265 L290 S291 D292 L298	R261-Q294 VanDerWaalsContact CZ-OE1 3.24Å; V265-Q294 HydrophobicContact CG2-CB 4.48Å; L290-Q294 HydrophobicContact CD2-CB 4.45Å; S291-Q294 WeakPolarHBondContact O-CA 3.46Å; S291-Q294 PolarHBondContact O-N 2.04Å; S291-Q294 PolarHBondContact OG-OE1 3.21Å; D292-Q294 PolarHBondContact O-N 2.87Å; Q294-L298 WeakPolarHBondContact O-CG 3.48Å; Q294-L298 PolarHBondContact O-N 2.91Å
295	R	75	Confident	71.4	Confident	36 Å²	36	54.6 Å²	54.6	14%	0.136	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-50.3	168.4	-64	175.3	174.6	159.5	-9.8	109.3	L290 S291 D292 Q297 L298 M299 E311 M458	L290-R295 HydrophobicContact CB-CG 3.98Å; L290-R295 VanDerWaalsContact O-CZ 3.31Å; L290-R295 PolarHBondContact O-NE 3.31Å; S291-R295 PolarHBondContact O-N 3.38Å; D292-R295 PolarHBondContact O-N 2.63Å; D292-R295 IonicContact OD1-CZ 3.2Å; D292-R295 IonicContact OD1-NH1 3.03Å; D292-R295 PolarHBondContact OD1-NH1 2.66Å; R295-Q297 PolarHBondContact O-N 3.2Å; R295-L298 PolarHBondContact O-N 3.34Å; R295-M299 VanDerWaalsContact O-CG 3.28Å; R295-M299 WeakPolarHBondContact O-CG 3.37Å; R295-M299 PolarHBondContact O-N 3.46Å; R295-E311 IonicContact NH2-OE2 2.69Å; R295-M458 HydrophobicContact CB-SD 4.43Å; R295-M458 HydrophobicContact CG-CE 3.83Å; R295-M458 HydrophobicContact CG-SD 4.06Å
296	F	73.5	Confident	71.5	Confident	113 Å²	113	54.4 Å²	54.4	50%	0.496	27%	0.273	S	S	.	.	H	α-helix	trans	-60.3	-43.7	178.6	-168.8	-108.1	0	0	0	112.5	D292 E293 L298 M299 Q300	D292-F296 VanDerWaalsContact O-CB 3.25Å; D292-F296 WeakPolarHBondContact O-CB 3.44Å; D292-F296 PolarHBondContact O-N 3.28Å; E293-F296 PolarHBondContact O-N 3.38Å; F296-L298 PolarHBondContact O-N 3.48Å; F296-M299 PolarHBondContact O-N 3Å; F296-M299 VanDerWaalsContact O-N 3.11Å; F296-Q300 HydrophobicContact CD1-CG 4.11Å; F296-Q300 VanDerWaalsContact CE1-CD 3.47Å; F296-Q300 HydrophobicContact CE1-CG 3.84Å; F296-Q300 HydrophobicContact CZ-CG 4.06Å; F296-Q300 WeakPolarHBondContact O-CG 3.13Å; F296-Q300 PolarHBondContact O-N 2.85Å
297	Q	74.1	Confident	71.9	Confident	80 Å²	80	53.8 Å²	53.8	37%	0.374	27%	0.27	S	S	.	.	H	α-helix	trans	-58.4	-43.8	173.3	-74.4	170.2	13.2	0	0	112.6	E293 R295 M299 I301	E293-Q297 WeakPolarHBondContact O-CB 3.26Å; E293-Q297 VanDerWaalsContact O-CG 3.25Å; E293-Q297 WeakPolarHBondContact O-CG 3.21Å; E293-Q297 PolarHBondContact O-N 2.96Å; E293-Q297 PolarHBondContact OE1-NE2 3.35Å; R295-Q297 PolarHBondContact O-N 3.2Å; Q297-M299 VanDerWaalsContact C-N 3.31Å; Q297-M299 PolarHBondContact O-N 2.83Å; Q297-I301 WeakPolarHBondContact O-CD1 3.39Å; Q297-I301 WeakPolarHBondContact O-CG1 3.38Å
298	L	72.2	Confident	72.6	Confident	13 Å²	13	53.1 Å²	53.1	7%	0.068	27%	0.266	C	S	.	.	H	α-helix	trans	-65.2	-34.1	174.6	-72.3	174	0	0	0	112.6	V265 L268 T269 L290 Q294 R295 F296 L307	V265-L298 HydrophobicContact CG1-CD2 4.41Å; V265-L298 HydrophobicContact CG2-CD1 4.37Å; L268-L298 HydrophobicContact CB-CD2 4.03Å; L268-L298 HydrophobicContact CD1-CD1 4.2Å; L268-L298 HydrophobicContact CD1-CD2 3.86Å; T269-L298 HydrophobicContact CG2-CD2 4.46Å; L290-L298 HydrophobicContact CD2-CD1 3.62Å; Q294-L298 WeakPolarHBondContact O-CG 3.48Å; Q294-L298 PolarHBondContact O-N 2.91Å; R295-L298 PolarHBondContact O-N 3.34Å; F296-L298 PolarHBondContact O-N 3.48Å; L298-L307 HydrophobicContact CD1-CD2 4.03Å
299	M	69	Low	73.4	Confident	29 Å²	29	51.7 Å²	51.7	14%	0.143	26%	0.259	C	S	.	.	H	α-helix	trans	-83.4	-22.5	-176.6	-62.5	-155.8	-67.5	0	0	113.9	R295 F296 Q297 M458 V466 I467 D468	R295-M299 VanDerWaalsContact O-CG 3.28Å; R295-M299 WeakPolarHBondContact O-CG 3.37Å; R295-M299 PolarHBondContact O-N 3.46Å; F296-M299 PolarHBondContact O-N 3Å; F296-M299 VanDerWaalsContact O-N 3.11Å; Q297-M299 VanDerWaalsContact C-N 3.31Å; Q297-M299 PolarHBondContact O-N 2.83Å; M299-M458 HydrophobicContact SD-CB 4.13Å; M299-M458 HydrophobicContact SD-CG 4.44Å; M299-V466 HydrophobicContact CB-CG1 3.95Å; M299-V466 HydrophobicContact CE-CG1 3.45Å; M299-V466 VanDerWaalsContact CE-CG1 3.45Å; M299-V466 HydrophobicContact CG-CG1 4.18Å; M299-V466 HydrophobicContact SD-CG1 3.3Å; M299-V466 WeakPolarHBondContact SD-CG1 3.49Å; M299-I467 VanDerWaalsContact SD-O 3.41Å; M299-D468 HydrophobicContact CE-CB 4.09Å; M299-D468 HydrophobicContact SD-CB 4.42Å
300	Q	63.2	Low	74.4	Confident	124 Å²	124	49.1 Å²	49.1	58%	0.579	24%	0.244	S	C	*	.	H	α-helix	trans	-70.6	-26.7	177.4	-84.1	-161.6	-34.6	0	0	114.7	F296 N302	F296-Q300 HydrophobicContact CD1-CG 4.11Å; F296-Q300 VanDerWaalsContact CE1-CD 3.47Å; F296-Q300 HydrophobicContact CE1-CG 3.84Å; F296-Q300 HydrophobicContact CZ-CG 4.06Å; F296-Q300 WeakPolarHBondContact O-CG 3.13Å; F296-Q300 PolarHBondContact O-N 2.85Å; Q300-N302 PolarHBondContact O-N 2.9Å
301	I	60.4	Low	75	Confident	78 Å²	78	49.8 Å²	49.8	40%	0.4	25%	0.247	S	C	.	.	S	Bend	trans	-86.2	42.2	-165.6	-41.4	161.7	0	0	0	111.9	T269 I272 Q297 G303	T269-I301 HydrophobicContact CG2-CD1 3.88Å; I272-I301 HydrophobicContact CD1-CB 3.88Å; I272-I301 HydrophobicContact CD1-CD1 3.73Å; I272-I301 HydrophobicContact CD1-CG1 4.4Å; I272-I301 HydrophobicContact CD1-CG2 3.45Å; I272-I301 VanDerWaalsContact CD1-CG2 3.45Å; Q297-I301 WeakPolarHBondContact O-CD1 3.39Å; Q297-I301 WeakPolarHBondContact O-CG1 3.38Å; I301-G303 PolarHBondContact O-N 3.35Å; I301-G303 VanDerWaalsContact O-N 3.13Å
302	N	58	Low	75.6	Confident	138 Å²	138	48.6 Å²	48.6	74%	0.738	24%	0.238	S	C	*	.			trans	42.6	49.5	179.8	-73.3	-35	0	0	0	112.8	Q300 Q304	Q300-N302 PolarHBondContact O-N 2.9Å; N302-Q304 WeakPolarHBondContact O-CG 3.28Å; N302-Q304 PolarHBondContact O-N 3.17Å
303	G	57	Low	76.1	Confident	5 Å²	5	47.3 Å²	47.3	5%	0.052	23%	0.23	C	C	.	.			trans	-57.3	100.7	-163.9	0	0	0	0	0	113.7	I301 F305 T460	I301-G303 PolarHBondContact O-N 3.35Å; I301-G303 VanDerWaalsContact O-N 3.13Å; G303-F305 PolarHBondContact O-N 2.83Å; G303-F305 VanDerWaalsContact O-N 3.07Å; G303-T460 PolarHBondContact O-OG1 2.95Å
304	Q	70.5	Confident	76.1	Confident	79 Å²	79	45.3 Å²	45.3	37%	0.369	22%	0.219	S	C	.	.			trans	-77.6	23.6	173.9	-58.7	-165.3	-5.8	0	0	112.7	R276 N277 N302	R276-Q304 CarbonylContact C-O 3.59Å; R276-Q304 WeakPolarHBondContact CA-O 3.39Å; R276-Q304 HydrophobicContact CB-CB 4.4Å; R276-Q304 HydrophobicContact CG-CB 4.1Å; R276-Q304 VanDerWaalsContact CZ-OE1 3.24Å; R276-Q304 VanDerWaalsContact NE-OE1 3.13Å; N277-Q304 PolarHBondContact N-O 3.37Å; N302-Q304 WeakPolarHBondContact O-CG 3.28Å; N302-Q304 PolarHBondContact O-N 3.17Å
305	F	81.6	Confident	76.3	Confident	12 Å²	12	45 Å²	45	5%	0.053	22%	0.221	C	C	.	.	S	Bend	trans	-137	160.8	175.9	61.8	-95.2	0	0	0	109.2	L268 I272 L275 I280 G303 L307	L268-F305 HydrophobicContact CD2-CE2 4.28Å; L268-F305 HydrophobicContact CD2-CZ 4.46Å; I272-F305 HydrophobicContact CG1-CE1 4.49Å; I272-F305 HydrophobicContact CG2-CE1 4.48Å; L275-F305 HydrophobicContact CB-CB 4.28Å; L275-F305 HydrophobicContact CB-CD1 4.1Å; L275-F305 HydrophobicContact CB-CG 4.39Å; L275-F305 WeakPolarHBondContact O-CB 3.46Å; I280-F305 HydrophobicContact CD1-CB 4.11Å; I280-F305 HydrophobicContact CD1-CD2 3.57Å; I280-F305 HydrophobicContact CD1-CE2 4.13Å; I280-F305 HydrophobicContact CD1-CG 3.87Å; I280-F305 HydrophobicContact CG1-CB 4.49Å; I280-F305 HydrophobicContact CG1-CD2 4.32Å; G303-F305 PolarHBondContact O-N 2.83Å; G303-F305 VanDerWaalsContact O-N 3.07Å; F305-L307 HydrophobicContact CE2-CB 4.35Å
306	S	85.7	Confident	76.2	Confident	6 Å²	6	51.2 Å²	51.2	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.3	175	-57.2	0	0	0	0	108.9	T278 I280 L488 P490	T278-S306 PolarHBondContact O-N 3.34Å; T278-S306 VanDerWaalsContact O-N 3.08Å; I280-S306 PolarHBondContact N-O 3.1Å; S306-L488 PolarHBondContact OG-O 2.92Å; S306-P490 WeakPolarHBondContact OG-CD 3.4Å
307	L	88	Confident	76.8	Confident	4 Å²	4	46 Å²	46	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	110.7	178.4	176.3	64	0	0	0	109.7	L268 I280 L298 F305 L457 M458	L268-L307 HydrophobicContact CD1-CD1 4.45Å; L268-L307 HydrophobicContact CD1-CD2 3.99Å; I280-L307 HydrophobicContact CB-CD1 4.05Å; I280-L307 HydrophobicContact CG2-CD1 3.81Å; I280-L307 CarbonylContact O-C 3.52Å; I280-L307 WeakPolarHBondContact O-CA 3.48Å; L298-L307 HydrophobicContact CD1-CD2 4.03Å; F305-L307 HydrophobicContact CE2-CB 4.35Å; L307-L457 WeakPolarHBondContact O-CA 3.43Å; L307-M458 HydrophobicContact CB-CB 4.43Å; L307-M458 PolarHBondContact N-O 3.05Å; L307-M458 PolarHBondContact O-N 3.32Å
308	L	90.8	Very high	77.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	105.5	166.5	-178.6	66	0	0	0	108.6	L195 L279 I280 I281 G282 L310 L457 V471 L487	L195-L308 HydrophobicContact CD2-CD2 3.46Å; L195-L308 VanDerWaalsContact CD2-CD2 3.46Å; L279-L308 HydrophobicContact CD1-CB 4.26Å; I280-L308 PolarHBondContact O-N 3.25Å; I281-L308 CarbonylContact C-O 3.57Å; I281-L308 WeakPolarHBondContact CA-O 3.49Å; G282-L308 PolarHBondContact N-O 2.84Å; L308-L310 HydrophobicContact CD2-CD2 4.14Å; L308-L310 HydrophobicContact CG-CD2 3.99Å; L308-L457 HydrophobicContact CB-CD1 4.29Å; L308-L457 HydrophobicContact CD1-CB 4.43Å; L308-V471 HydrophobicContact CD1-CG2 3.58Å; L308-L487 HydrophobicContact CD1-CD2 4.49Å; L308-L487 HydrophobicContact CD2-CD1 4.02Å
309	L	89.2	Confident	78.1	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	128.3	174.4	-169.7	70.1	0	0	0	109.2	L264 L290 E311 G455 R456	L264-L309 HydrophobicContact CD2-CD1 4.08Å; L290-L309 HydrophobicContact CD1-CD1 4.31Å; L290-L309 HydrophobicContact CD1-CD2 3.89Å; L309-E311 HydrophobicContact CD2-CG 3.84Å; L309-E311 WeakPolarHBondContact CD2-OE1 3.32Å; L309-E311 HydrophobicContact CG-CG 3.92Å; L309-G455 WeakPolarHBondContact O-CA 3.31Å; L309-R456 PolarHBondContact N-O 2.9Å; L309-R456 PolarHBondContact O-N 3.27Å
310	L	90.8	Very high	79.1	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	110.2	176.4	-58.3	-170	0	0	0	109.9	Y188 V191 V192 I281 G282 I283 P284 L308 I453 E454 M472	Y188-L310 HydrophobicContact CD1-CB 4.3Å; Y188-L310 HydrophobicContact CE1-CB 4.21Å; V191-L310 HydrophobicContact CG1-CD1 4.01Å; V192-L310 HydrophobicContact CG2-CD1 4.28Å; I281-L310 HydrophobicContact CG2-CD1 3.87Å; I281-L310 HydrophobicContact CG2-CG 4.05Å; G282-L310 PolarHBondContact O-N 2.84Å; I283-L310 HydrophobicContact CG1-CD1 4.29Å; P284-L310 WeakPolarHBondContact CD-O 3.28Å; P284-L310 VanDerWaalsContact CG-O 3.28Å; P284-L310 WeakPolarHBondContact CG-O 3.12Å; L308-L310 HydrophobicContact CD2-CD2 4.14Å; L308-L310 HydrophobicContact CG-CD2 3.99Å; L310-I453 HydrophobicContact CB-CG2 4.32Å; L310-E454 WeakPolarHBondContact CA-O 3.41Å; L310-M472 HydrophobicContact CD2-CE 3.61Å
311	E	86.3	Confident	80.3	Confident	18 Å²	18	42 Å²	42	8%	0.084	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143.6	179.5	-61	-172.1	134	0	0	109.6	T289 R295 L309 M313 E454	T289-E311 WeakPolarHBondContact CA-OE1 3.2Å; T289-E311 VanDerWaalsContact CB-OE1 3.28Å; T289-E311 WeakPolarHBondContact CB-OE1 3.34Å; T289-E311 VanDerWaalsContact CG2-OE1 3.31Å; T289-E311 WeakPolarHBondContact CG2-OE1 3.09Å; R295-E311 IonicContact NH2-OE2 2.69Å; L309-E311 HydrophobicContact CD2-CG 3.84Å; L309-E311 WeakPolarHBondContact CD2-OE1 3.32Å; L309-E311 HydrophobicContact CG-CG 3.92Å; E311-M313 PolarHBondContact O-N 2.87Å; E311-E454 PolarHBondContact N-O 3.23Å; E311-E454 PolarHBondContact O-N 3.15Å
312	P	85	Confident	81.5	Confident	19 Å²	19	42.4 Å²	42.4	12%	0.123	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	131.3	172.5	22.2	-23.1	0	0	0	109.1	P183 K314	P183-P312 HydrophobicContact CG-CB 4.1Å; P183-P312 HydrophobicContact CG-CG 4.34Å; P312-K314 WeakPolarHBondContact O-CE 3.37Å; P312-K314 WeakPolarHBondContact O-CG 3.41Å; P312-K314 PolarHBondContact O-N 2.88Å
313	M	81.6	Confident	83	Confident	84 Å²	84	39 Å²	39	41%	0.414	19%	0.188	S	C	.	.			trans	-65.5	129.4	-178.8	-176.4	-177.1	170.8	0	0	109.6	E311 Q452	E311-M313 PolarHBondContact O-N 2.87Å; M313-Q452 HydrophobicContact CB-CB 3.94Å; M313-Q452 PolarHBondContact N-O 2.68Å; M313-Q452 HydrophobicContact SD-CB 4.17Å; M313-Q452 PolarHBondContact SD-OE1 2.9Å; M313-Q452 VanDerWaalsContact SD-OE1 3.36Å
314	K	74.3	Confident	84.5	Confident	73 Å²	73	38.8 Å²	38.8	32%	0.317	19%	0.185	S	C	.	.			trans	-122.2	133.3	-174.8	-69.8	163.5	-158.1	-169.1	0	110.3	P312 A375	P312-K314 WeakPolarHBondContact O-CE 3.37Å; P312-K314 WeakPolarHBondContact O-CG 3.41Å; P312-K314 PolarHBondContact O-N 2.88Å; K314-A375 WeakPolarHBondContact CE-O 3.46Å; K314-A375 PolarHBondContact NZ-O 2.85Å
315	S	77	Confident	85.2	Confident	32 Å²	32	35.7 Å²	35.7	22%	0.224	17%	0.172	C	C	.	.			trans	-66.7	145.6	167.3	54.2	0	0	0	0	110.5	M317 E378 K438	S315-M317 PolarHBondContact O-N 3.34Å; S315-E378 WeakPolarHBondContact CB-OE2 3.32Å; S315-E378 PolarHBondContact N-OE2 2.98Å; S315-E378 VanDerWaalsContact OG-CD 3.22Å; S315-E378 PolarHBondContact OG-OE2 2.85Å; S315-K438 PolarHBondContact OG-NZ 3.36Å
316	K	72.5	Confident	85.2	Confident	166 Å²	166	38.8 Å²	38.8	72%	0.722	19%	0.186	S	C	*	.			trans	-70.6	99.6	167.1	-64.9	-177.2	-179.8	-177.9	0	106.9	D318 S434	K316-D318 WeakPolarHBondContact CB-OD2 3.28Å; K316-D318 PolarHBondContact O-N 3.05Å; K316-S434 PolarHBondContact O-OG 3.24Å
317	M	85.8	Confident	85.1	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.02	19%	0.188	C	C	.	.			trans	-75.4	57.2	178.3	-67.3	-72.2	-73	0	0	110	W76 S315 D319 F320 R321 V377 E378 V381 L435	W76-M317 HydrophobicContact CH2-CE 4.11Å; W76-M317 HydrophobicContact CZ3-CE 3.65Å; S315-M317 PolarHBondContact O-N 3.34Å; M317-D319 VanDerWaalsContact C-N 3.28Å; M317-D319 PolarHBondContact O-N 3.39Å; M317-F320 HydrophobicContact CB-CB 4.21Å; M317-F320 PolarHBondContact O-N 2.04Å; M317-R321 PolarHBondContact O-N 2.97Å; M317-V377 HydrophobicContact CB-CG1 4.33Å; M317-V377 HydrophobicContact CE-CG1 4.46Å; M317-V377 HydrophobicContact CG-CG1 4.27Å; M317-E378 HydrophobicContact CG-CB 4.34Å; M317-V381 HydrophobicContact CE-CB 4.3Å; M317-V381 HydrophobicContact CE-CG1 4.36Å; M317-V381 HydrophobicContact CE-CG2 4.01Å; M317-L435 HydrophobicContact CE-CD1 4.26Å; M317-L435 HydrophobicContact CE-CG 4.38Å; M317-L435 HydrophobicContact SD-CD2 3.86Å; M317-L435 HydrophobicContact SD-CG 4.08Å
318	D	84.9	Confident	84.6	Confident	63 Å²	63	39.3 Å²	39.3	34%	0.337	19%	0.189	S	C	.	.	H	α-helix	trans	-58.9	-41.5	-174.6	-71.6	-49.9	0	0	0	110.5	K316 F320 R321 D322	K316-D318 WeakPolarHBondContact CB-OD2 3.28Å; K316-D318 PolarHBondContact O-N 3.05Å; D318-F320 PolarHBondContact O-N 3.26Å; D318-R321 PolarHBondContact O-N 2.79Å; D318-R321 IonicContact OD1-CZ 3.67Å; D318-R321 IonicContact OD1-NH1 2.73Å; D318-R321 PolarHBondContact OD1-NH1 3.26Å; D318-R321 IonicContact OD1-NH2 2.78Å; D318-R321 PolarHBondContact OD1-NH2 3.38Å; D318-D322 VanDerWaalsContact O-CG 3.3Å; D318-D322 PolarHBondContact O-N 3.11Å
319	D	88.9	Confident	83.9	Confident	37 Å²	37	45 Å²	45	20%	0.198	21%	0.21	C	C	.	.	H	α-helix	trans	-54.6	-37.1	174.8	-48.9	-49	0	0	0	112.8	W76 M317 Y323 M433 S434	W76-D319 HydrophobicContact CH2-CB 3.94Å; W76-D319 HydrophobicContact CZ2-CB 3.63Å; M317-D319 VanDerWaalsContact C-N 3.28Å; M317-D319 PolarHBondContact O-N 3.39Å; D319-Y323 WeakPolarHBondContact O-CB 3.01Å; D319-Y323 PolarHBondContact O-N 3.46Å; D319-M433 WeakPolarHBondContact OD1-CE 3.28Å; D319-M433 PolarHBondContact OD2-N 2.93Å; D319-S434 WeakPolarHBondContact OD2-CB 3.44Å; D319-S434 PolarHBondContact OD2-N 2.75Å; D319-S434 PolarHBondContact OD2-OG 3.19Å
320	F	90.2	Very high	83	Confident	1 Å²	1	53 Å²	53	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-80.8	-39.8	-179.9	172.4	-105.2	0	0	0	111.9	H69 F72 A73 W76 M317 D318 D322 Y323 F324 T373 V377	H69-F320 VanDerWaalsContact O-CZ 3.25Å; H69-F320 WeakPolarHBondContact O-CZ 3.41Å; F72-F320 HydrophobicContact CB-CE2 4.32Å; F72-F320 HydrophobicContact CB-CZ 4.21Å; A73-F320 VanDerWaalsContact CA-CE2 3.42Å; A73-F320 HydrophobicContact CB-CD2 4.18Å; A73-F320 HydrophobicContact CB-CE1 4.21Å; A73-F320 HydrophobicContact CB-CE2 3.83Å; A73-F320 HydrophobicContact CB-CZ 3.84Å; W76-F320 HydrophobicContact CB-CD2 4.05Å; W76-F320 HydrophobicContact CB-CE2 4.23Å; W76-F320 HydrophobicContact CD2-CB 4.31Å; W76-F320 AromaticContact CD2-CD2 3.86Å; W76-F320 HydrophobicContact CD2-CD2 3.86Å; W76-F320 HydrophobicContact CE3-CB 4.13Å; W76-F320 AromaticContact CE3-CD2 3.97Å; W76-F320 HydrophobicContact CE3-CD2 3.97Å; W76-F320 HydrophobicContact CE3-CG 4.41Å; W76-F320 AromaticContact CG-CD2 3.94Å; W76-F320 HydrophobicContact CG-CD2 3.94Å; W76-F320 HydrophobicContact CH2-CB 3.93Å; W76-F320 HydrophobicContact CZ2-CB 4.15Å; W76-F320 HydrophobicContact CZ3-CB 3.95Å; M317-F320 HydrophobicContact CB-CB 4.21Å; M317-F320 PolarHBondContact O-N 2.04Å; D318-F320 PolarHBondContact O-N 3.26Å; F320-D322 VanDerWaalsContact C-N 3.3Å; F320-D322 PolarHBondContact O-N 2.72Å; F320-Y323 HydrophobicContact CD2-CD1 4.08Å; F320-Y323 HydrophobicContact CE2-CD1 4.14Å; F320-Y323 PolarHBondContact O-N 3.36Å; F320-F324 HydrophobicContact CE1-CB 4.49Å; F320-F324 HydrophobicContact CE2-CB 4.48Å; F320-F324 HydrophobicContact CZ-CB 4.22Å; F320-F324 HydrophobicContact CZ-CD2 4.03Å; F320-F324 HydrophobicContact CZ-CG 4.37Å; F320-F324 WeakPolarHBondContact O-CB 3.34Å; F320-F324 PolarHBondContact O-N 2.95Å; F320-T373 HydrophobicContact CD1-CG2 4.36Å; F320-V377 HydrophobicContact CD1-CG1 3.64Å; F320-V377 HydrophobicContact CD1-CG2 4.34Å; F320-V377 HydrophobicContact CE1-CG1 4.04Å; F320-V377 HydrophobicContact CE1-CG2 3.95Å; F320-V377 HydrophobicContact CG-CG1 4.21Å
321	R	87.4	Confident	81.7	Confident	61 Å²	61	55.8 Å²	55.8	23%	0.23	26%	0.255	C	S	.	.	H	α-helix	trans	-56.3	-49.5	174.4	-179	-165.3	57.8	-121.6	-18.7	110	M317 D318 Y323 F324 V325 V371 T373	M317-R321 PolarHBondContact O-N 2.97Å; D318-R321 PolarHBondContact O-N 2.79Å; D318-R321 IonicContact OD1-CZ 3.67Å; D318-R321 IonicContact OD1-NH1 2.73Å; D318-R321 PolarHBondContact OD1-NH1 3.26Å; D318-R321 IonicContact OD1-NH2 2.78Å; D318-R321 PolarHBondContact OD1-NH2 3.38Å; R321-Y323 VanDerWaalsContact C-N 3.34Å; R321-Y323 PolarHBondContact O-N 3.12Å; R321-F324 PolarHBondContact O-N 3.46Å; R321-F324 VanDerWaalsContact O-N 3.11Å; R321-V325 WeakPolarHBondContact O-CG2 3.43Å; R321-V325 PolarHBondContact O-N 2.82Å; R321-V371 HydrophobicContact CG-CB 4.38Å; R321-V371 HydrophobicContact CG-CG1 4.04Å; R321-T373 HydrophobicContact CB-CG2 3.8Å; R321-T373 HydrophobicContact CG-CG2 4.39Å
322	D	87	Confident	80.2	Confident	85 Å²	85	56.8 Å²	56.8	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-68.5	-36.7	-174.1	-63	1.6	0	0	0	110.7	D318 F320 E326	D318-D322 VanDerWaalsContact O-CG 3.3Å; D318-D322 PolarHBondContact O-N 3.11Å; F320-D322 VanDerWaalsContact C-N 3.3Å; F320-D322 PolarHBondContact O-N 2.72Å; D322-E326 PolarHBondContact O-N 3.22Å
323	Y	88.6	Confident	78.7	Confident	67 Å²	67	66.9 Å²	66.9	26%	0.263	30%	0.3	S	S	.	.	H	α-helix	trans	-61.1	-43.8	168.1	169.9	-103.3	0	0	0	113.2	W76 D319 F320 R321 E326 I327	W76-Y323 HydrophobicContact CB-CD1 3.92Å; W76-Y323 HydrophobicContact CB-CE1 3.52Å; W76-Y323 AromaticContact CD1-CD1 3.18Å; W76-Y323 AromaticContact CD1-CD2 3.7Å; W76-Y323 AromaticContact CD1-CE1 3.38Å; W76-Y323 AromaticContact CD1-CE2 3.89Å; W76-Y323 AromaticContact CD1-CG 3.33Å; W76-Y323 AromaticContact CD1-CZ 3.73Å; W76-Y323 AromaticContact CG-CD1 3.68Å; W76-Y323 HydrophobicContact CG-CD1 3.68Å; W76-Y323 AromaticContact CG-CE1 3.74Å; W76-Y323 HydrophobicContact CG-CE1 3.74Å; W76-Y323 HydrophobicContact CG-CG 4.25Å; W76-Y323 AromaticContact NE1-CD1 3.86Å; W76-Y323 AromaticContact NE1-CG 3.64Å; D319-Y323 WeakPolarHBondContact O-CB 3.01Å; D319-Y323 PolarHBondContact O-N 3.46Å; F320-Y323 HydrophobicContact CD2-CD1 4.08Å; F320-Y323 HydrophobicContact CE2-CD1 4.14Å; F320-Y323 PolarHBondContact O-N 3.36Å; R321-Y323 VanDerWaalsContact C-N 3.34Å; R321-Y323 PolarHBondContact O-N 3.12Å; Y323-E326 PolarHBondContact O-N 2.92Å; Y323-I327 HydrophobicContact CD1-CD1 3.7Å; Y323-I327 HydrophobicContact CD1-CG1 4.48Å; Y323-I327 HydrophobicContact CE1-CD1 3.15Å; Y323-I327 HydrophobicContact CE1-CG1 4.1Å; Y323-I327 HydrophobicContact CE2-CD1 4.13Å; Y323-I327 HydrophobicContact CE2-CG1 4.22Å; Y323-I327 HydrophobicContact CG-CD1 4.39Å; Y323-I327 VanDerWaalsContact CZ-CD1 3.42Å; Y323-I327 WeakPolarHBondContact O-CG1 3.1Å; Y323-I327 PolarHBondContact O-N 3.4Å
324	F	88.2	Confident	77.6	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-66.7	-39.2	-179.8	-171	-101.1	0	0	0	111.9	V68 H69 F72 F320 R321 E326 I327 L328 L338 Y341 V371	V68-F324 HydrophobicContact CG1-CE2 4.5Å; V68-F324 HydrophobicContact CG1-CZ 4.32Å; H69-F324 AromaticContact CD2-CE1 3.7Å; H69-F324 AromaticContact CD2-CZ 3.64Å; H69-F324 AromaticContact NE2-CE1 3.88Å; F72-F324 HydrophobicContact CB-CD2 3.89Å; F72-F324 HydrophobicContact CB-CE2 3.89Å; F72-F324 HydrophobicContact CD2-CD2 4.49Å; F72-F324 AromaticContact CD2-CE2 3.72Å; F72-F324 HydrophobicContact CD2-CE2 3.72Å; F72-F324 HydrophobicContact CE2-CE2 4.48Å; F72-F324 HydrophobicContact CG-CD2 4.21Å; F72-F324 AromaticContact CG-CE2 3.89Å; F72-F324 HydrophobicContact CG-CE2 3.89Å; F320-F324 HydrophobicContact CE1-CB 4.49Å; F320-F324 HydrophobicContact CE2-CB 4.48Å; F320-F324 HydrophobicContact CZ-CB 4.22Å; F320-F324 HydrophobicContact CZ-CD2 4.03Å; F320-F324 HydrophobicContact CZ-CG 4.37Å; F320-F324 WeakPolarHBondContact O-CB 3.34Å; F320-F324 PolarHBondContact O-N 2.95Å; R321-F324 PolarHBondContact O-N 3.46Å; R321-F324 VanDerWaalsContact O-N 3.11Å; F324-E326 VanDerWaalsContact C-N 3.35Å; F324-I327 PolarHBondContact O-N 3.07Å; F324-L328 HydrophobicContact CD1-CD1 3.8Å; F324-L328 HydrophobicContact CD1-CG 4.43Å; F324-L328 HydrophobicContact CE1-CD1 3.7Å; F324-L328 HydrophobicContact CE1-CG 4.25Å; F324-L328 WeakPolarHBondContact O-CG 3.47Å; F324-L328 PolarHBondContact O-N 3.42Å; F324-L338 HydrophobicContact CE2-CD1 4.38Å; F324-L338 HydrophobicContact CZ-CD1 4.33Å; F324-Y341 AromaticContact CE1-CE1 3.77Å; F324-Y341 HydrophobicContact CE1-CE1 3.77Å; F324-Y341 AromaticContact CE1-CZ 3.87Å; F324-Y341 HydrophobicContact CZ-CD1 4.35Å; F324-Y341 AromaticContact CZ-CE1 3.89Å; F324-Y341 HydrophobicContact CZ-CE1 3.89Å; F324-V371 HydrophobicContact CD1-CG1 3.88Å; F324-V371 HydrophobicContact CD1-CG2 4.35Å; F324-V371 HydrophobicContact CE1-CG1 4.43Å
325	V	84.6	Confident	77.3	Confident	14 Å²	14	66.4 Å²	66.4	9%	0.085	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-40.3	170.6	174.8	0	0	0	0	111.1	R321 L328 R329 L367 A368 V371	R321-V325 WeakPolarHBondContact O-CG2 3.43Å; R321-V325 PolarHBondContact O-N 2.82Å; V325-L328 PolarHBondContact O-N 3.14Å; V325-R329 PolarHBondContact O-N 3.07Å; V325-R329 VanDerWaalsContact O-N 3.07Å; V325-L367 HydrophobicContact CG1-CB 4.28Å; V325-A368 HydrophobicContact CG2-CB 4.39Å; V325-V371 HydrophobicContact CG2-CB 4.46Å; V325-V371 HydrophobicContact CG2-CG2 4.21Å
326	E	83.2	Confident	77.3	Confident	77 Å²	77	69 Å²	69	36%	0.36	33%	0.325	S	S	.	.	H	α-helix	trans	-65.2	-38.8	174.8	-171.6	173.3	-114.9	0	0	112.7	D322 Y323 F324 R329 R330	D322-E326 PolarHBondContact O-N 3.22Å; Y323-E326 PolarHBondContact O-N 2.92Å; F324-E326 VanDerWaalsContact C-N 3.35Å; E326-R329 PolarHBondContact O-N 3.02Å; E326-R330 HydrophobicContact CG-CG 4.2Å; E326-R330 WeakPolarHBondContact O-CB 3.49Å; E326-R330 PolarHBondContact O-N 2.95Å; E326-R330 IonicContact OE1-CZ 3.33Å; E326-R330 IonicContact OE1-NE 3.57Å; E326-R330 IonicContact OE1-NH1 3.06Å; E326-R330 PolarHBondContact OE1-NH1 3.38Å; E326-R330 IonicContact OE1-NH2 2.72Å; E326-R330 PolarHBondContact OE1-NH2 3.15Å; E326-R330 IonicContact OE2-CZ 2.81Å; E326-R330 IonicContact OE2-NH1 2.7Å; E326-R330 PolarHBondContact OE2-NH1 3.27Å; E326-R330 IonicContact OE2-NH2 3.93Å
327	I	82.1	Confident	77.7	Confident	13 Å²	13	62.5 Å²	62.5	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-60.8	-50.6	173.6	-65	162.2	0	0	0	110.5	F72 Y323 F324 R329 R330 N331 L338	F72-I327 HydrophobicContact CD1-CD1 3.92Å; F72-I327 HydrophobicContact CE1-CD1 4.44Å; F72-I327 HydrophobicContact CE1-CG2 4.41Å; Y323-I327 HydrophobicContact CD1-CD1 3.7Å; Y323-I327 HydrophobicContact CD1-CG1 4.48Å; Y323-I327 HydrophobicContact CE1-CD1 3.15Å; Y323-I327 HydrophobicContact CE1-CG1 4.1Å; Y323-I327 HydrophobicContact CE2-CD1 4.13Å; Y323-I327 HydrophobicContact CE2-CG1 4.22Å; Y323-I327 HydrophobicContact CG-CD1 4.39Å; Y323-I327 VanDerWaalsContact CZ-CD1 3.42Å; Y323-I327 WeakPolarHBondContact O-CG1 3.1Å; Y323-I327 PolarHBondContact O-N 3.4Å; F324-I327 PolarHBondContact O-N 3.07Å; I327-R329 PolarHBondContact O-N 2.79Å; I327-R330 PolarHBondContact O-N 2.67Å; I327-N331 HydrophobicContact CG2-CB 4.16Å; I327-N331 PolarHBondContact O-N 3.47Å; I327-L338 HydrophobicContact CG2-CD1 4.44Å; I327-L338 HydrophobicContact CG2-CD2 3.69Å
328	L	79	Confident	77.6	Confident	9 Å²	9	62.3 Å²	62.3	5%	0.047	30%	0.297	C	S	.	.	H	α-helix	trans	-52.5	-39.4	177.6	-77.4	165.9	0	0	0	111.3	F324 V325 L338 Y341 A342 F346 L350 V371	F324-L328 HydrophobicContact CD1-CD1 3.8Å; F324-L328 HydrophobicContact CD1-CG 4.43Å; F324-L328 HydrophobicContact CE1-CD1 3.7Å; F324-L328 HydrophobicContact CE1-CG 4.25Å; F324-L328 WeakPolarHBondContact O-CG 3.47Å; F324-L328 PolarHBondContact O-N 3.42Å; V325-L328 PolarHBondContact O-N 3.14Å; L328-L338 HydrophobicContact CD2-CD1 3.74Å; L328-L338 HydrophobicContact CD2-CD2 4.36Å; L328-L338 HydrophobicContact CD2-CG 3.88Å; L328-L338 HydrophobicContact CG-CD1 4.3Å; L328-Y341 HydrophobicContact CD1-CE1 4.49Å; L328-Y341 HydrophobicContact CD2-CD1 4.2Å; L328-Y341 HydrophobicContact CD2-CE1 4.23Å; L328-A342 HydrophobicContact CD2-CB 4.32Å; L328-F346 HydrophobicContact CD1-CE2 4.21Å; L328-L350 VanDerWaalsContact O-CD2 3.3Å; L328-L350 WeakPolarHBondContact O-CD2 3.09Å; L328-V371 HydrophobicContact CD1-CG2 4.22Å
329	R	74.3	Confident	77.4	Confident	120 Å²	120	60.6 Å²	60.6	45%	0.453	29%	0.292	S	S	.	.	H	α-helix	trans	-80.6	-35.9	-179.5	-155.4	178.9	83.3	167.9	1	114.7	V325 E326 I327 D364	V325-R329 PolarHBondContact O-N 3.07Å; V325-R329 VanDerWaalsContact O-N 3.07Å; E326-R329 PolarHBondContact O-N 3.02Å; I327-R329 PolarHBondContact O-N 2.79Å; R329-D364 WeakPolarHBondContact CD-OD1 3.1Å; R329-D364 IonicContact CZ-OD1 2.88Å; R329-D364 IonicContact CZ-OD2 3.86Å; R329-D364 IonicContact NE-OD1 2.93Å; R329-D364 IonicContact NH1-OD1 2.66Å; R329-D364 PolarHBondContact NH1-OD1 2.77Å; R329-D364 IonicContact NH1-OD2 3.79Å; R329-D364 PolarHBondContact NH1-OD2 3.33Å
330	R	71.3	Confident	77	Confident	171 Å²	171	60.7 Å²	60.7	65%	0.645	30%	0.296	S	S	*	.	H	α-helix	trans	-92.4	-38.8	-173.6	-76	-169.8	178	150.9	8.5	114.6	E326 I327 S332	E326-R330 HydrophobicContact CG-CG 4.2Å; E326-R330 WeakPolarHBondContact O-CB 3.49Å; E326-R330 PolarHBondContact O-N 2.95Å; E326-R330 IonicContact OE1-CZ 3.33Å; E326-R330 IonicContact OE1-NE 3.57Å; E326-R330 IonicContact OE1-NH1 3.06Å; E326-R330 PolarHBondContact OE1-NH1 3.38Å; E326-R330 IonicContact OE1-NH2 2.72Å; E326-R330 PolarHBondContact OE1-NH2 3.15Å; E326-R330 IonicContact OE2-CZ 2.81Å; E326-R330 IonicContact OE2-NH1 2.7Å; E326-R330 PolarHBondContact OE2-NH1 3.27Å; E326-R330 IonicContact OE2-NH2 3.93Å; I327-R330 PolarHBondContact O-N 2.67Å; R330-S332 PolarHBondContact O-N 3.04Å
331	N	62.7	Low	76.8	Confident	58 Å²	58	60.8 Å²	60.8	31%	0.31	30%	0.296	S	S	.	.			trans	-101.9	32	-160.2	-123.8	-25.1	0	0	0	113.6	I327 R333 T334 Y335	I327-N331 HydrophobicContact CG2-CB 4.16Å; I327-N331 PolarHBondContact O-N 3.47Å; N331-R333 PolarHBondContact O-N 2.87Å; N331-T334 PolarHBondContact O-N 2.95Å; N331-T334 VanDerWaalsContact O-N 3.07Å; N331-T334 PolarHBondContact O-OG1 3.4Å; N331-T334 WeakPolarHBondContact OD1-CB 3.28Å; N331-T334 PolarHBondContact OD1-OG1 3.31Å; N331-Y335 HydrophobicContact CB-CD2 4.3Å; N331-Y335 HydrophobicContact CB-CE2 4.43Å
332	S	54.9	Low	76.5	Confident	39 Å²	39	57.9 Å²	57.9	27%	0.273	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.6	-161.6	99.7	0	0	0	0	115.5	R330 L350	R330-S332 PolarHBondContact O-N 3.04Å; S332-L350 WeakPolarHBondContact CB-O 3.22Å; S332-L350 PolarHBondContact OG-O 3.04Å
333	R	53.6	Low	76.3	Confident	231 Å²	231	57.7 Å²	57.7	87%	0.872	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-8.7	179.9	-65.2	-175.8	176.7	-171.7	-2.4	114.3	N331	N331-R333 PolarHBondContact O-N 2.87Å
334	T	59.4	Low	75.9	Confident	89 Å²	89	57.8 Å²	57.8	55%	0.546	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-22.6	-160	-32.6	0	0	0	0	113.4	N331	N331-T334 PolarHBondContact O-N 2.95Å; N331-T334 VanDerWaalsContact O-N 3.07Å; N331-T334 PolarHBondContact O-OG1 3.4Å; N331-T334 WeakPolarHBondContact OD1-CB 3.28Å; N331-T334 PolarHBondContact OD1-OG1 3.31Å
335	Y	68.3	Low	75.5	Confident	58 Å²	58	62.7 Å²	62.7	23%	0.227	32%	0.317	C	S	.	.			trans	-131.3	105.5	-175.1	-64.5	-78.6	0	0	0	111.8	N331 L337 L338 A339	N331-Y335 HydrophobicContact CB-CD2 4.3Å; N331-Y335 HydrophobicContact CB-CE2 4.43Å; Y335-L337 VanDerWaalsContact C-N 3.29Å; Y335-L337 PolarHBondContact O-N 3Å; Y335-L338 WeakPolarHBondContact O-CB 3Å; Y335-L338 PolarHBondContact O-N 2.98Å; Y335-L338 VanDerWaalsContact O-N 3.07Å; Y335-A339 PolarHBondContact O-N 3.25Å
336	A	76.7	Confident	75.3	Confident	87 Å²	87	62.5 Å²	62.5	72%	0.719	32%	0.315	S	S	*	.	H	α-helix	trans	-58.8	-39	177.3	0	0	0	0	0	112.8	L338 A339 S340	A336-L338 VanDerWaalsContact C-N 3.26Å; A336-L338 PolarHBondContact O-N 3.49Å; A336-A339 PolarHBondContact O-N 3.42Å; A336-A339 VanDerWaalsContact O-N 3.17Å; A336-S340 PolarHBondContact O-N 3.17Å; A336-S340 PolarHBondContact O-OG 2.9Å
337	L	81.5	Confident	75.2	Confident	28 Å²	28	64 Å²	64	15%	0.147	33%	0.326	C	S	.	.	H	α-helix	trans	-56.8	-37.2	174.2	178.9	69.8	0	0	0	113	L55 V63 V68 L71 F72 Y335 S340 Y341	L55-L337 HydrophobicContact CB-CD1 4.11Å; L55-L337 HydrophobicContact CD1-CD1 3.94Å; L55-L337 HydrophobicContact CD1-CD2 3.75Å; L55-L337 HydrophobicContact CD1-CG 4.49Å; L55-L337 HydrophobicContact CD2-CD2 4.37Å; L55-L337 HydrophobicContact CG-CD1 4.48Å; V63-L337 HydrophobicContact CG1-CD1 4.44Å; V68-L337 HydrophobicContact CG2-CD1 4.08Å; V68-L337 HydrophobicContact CG2-CD2 4.43Å; V68-L337 HydrophobicContact CG2-CG 4.29Å; L71-L337 HydrophobicContact CD2-CD2 3.9Å; F72-L337 HydrophobicContact CE2-CD2 4.35Å; Y335-L337 VanDerWaalsContact C-N 3.29Å; Y335-L337 PolarHBondContact O-N 3Å; L337-S340 PolarHBondContact O-OG 2.79Å; L337-S340 VanDerWaalsContact O-OG 3.05Å; L337-Y341 VanDerWaalsContact O-CB 3.27Å; L337-Y341 WeakPolarHBondContact O-CB 3.3Å; L337-Y341 PolarHBondContact O-N 3.49Å
338	L	83.1	Confident	75.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-73.9	-34.1	-179	-166.1	75.6	0	0	0	110.8	F72 F324 I327 L328 Y335 A336 A342 L350	F72-L338 HydrophobicContact CE2-CD1 4Å; F72-L338 HydrophobicContact CZ-CD1 4.1Å; F324-L338 HydrophobicContact CE2-CD1 4.38Å; F324-L338 HydrophobicContact CZ-CD1 4.33Å; I327-L338 HydrophobicContact CG2-CD1 4.44Å; I327-L338 HydrophobicContact CG2-CD2 3.69Å; L328-L338 HydrophobicContact CD2-CD1 3.74Å; L328-L338 HydrophobicContact CD2-CD2 4.36Å; L328-L338 HydrophobicContact CD2-CG 3.88Å; L328-L338 HydrophobicContact CG-CD1 4.3Å; Y335-L338 WeakPolarHBondContact O-CB 3Å; Y335-L338 PolarHBondContact O-N 2.98Å; Y335-L338 VanDerWaalsContact O-N 3.07Å; A336-L338 VanDerWaalsContact C-N 3.26Å; A336-L338 PolarHBondContact O-N 3.49Å; L338-A342 VanDerWaalsContact O-CB 3.3Å; L338-A342 WeakPolarHBondContact O-CB 3.46Å; L338-A342 PolarHBondContact O-N 3.23Å; L338-L350 HydrophobicContact CB-CD1 4.11Å; L338-L350 HydrophobicContact CD2-CD1 3.78Å; L338-L350 HydrophobicContact CG-CD1 3.73Å
339	A	79.6	Confident	75.1	Confident	28 Å²	28	63.9 Å²	63.9	23%	0.231	33%	0.326	C	S	.	.	H	α-helix	trans	-69.7	-41.2	174.7	0	0	0	0	0	112.1	Y335 A336 H343 L350	Y335-A339 PolarHBondContact O-N 3.25Å; A336-A339 PolarHBondContact O-N 3.42Å; A336-A339 VanDerWaalsContact O-N 3.17Å; A339-H343 WeakPolarHBondContact O-CB 3.4Å; A339-H343 PolarHBondContact O-N 3.09Å; A339-L350 HydrophobicContact CB-CB 4.24Å; A339-L350 HydrophobicContact CB-CD1 4.38Å
340	S	81	Confident	75.1	Confident	39 Å²	39	58.5 Å²	58.5	27%	0.273	31%	0.306	S	S	.	.	H	α-helix	trans	-68.7	-40	174.5	57.1	0	0	0	0	112.3	A336 L337 H343 A344	A336-S340 PolarHBondContact O-N 3.17Å; A336-S340 PolarHBondContact O-OG 2.9Å; L337-S340 PolarHBondContact O-OG 2.79Å; L337-S340 VanDerWaalsContact O-OG 3.05Å; S340-H343 PolarHBondContact O-N 3.28Å; S340-A344 VanDerWaalsContact O-CB 3.3Å; S340-A344 WeakPolarHBondContact O-CB 3.45Å; S340-A344 PolarHBondContact O-N 3.46Å
341	Y	85.7	Confident	75.1	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-57.2	-50.8	170.7	167.6	-89.1	0	0	0	112	A65 V68 H69 F324 L328 L337 H343 A344 K345 F346	A65-Y341 HydrophobicContact CB-CE2 3.97Å; V68-Y341 HydrophobicContact CB-CD2 4.04Å; V68-Y341 HydrophobicContact CG1-CD2 3.88Å; V68-Y341 HydrophobicContact CG1-CE2 4.46Å; V68-Y341 HydrophobicContact CG1-CG 4.09Å; V68-Y341 HydrophobicContact CG2-CD2 4.32Å; H69-Y341 AromaticContact NE2-CE2 3.64Å; H69-Y341 AromaticContact NE2-CZ 3.48Å; H69-Y341 PolarHBondContact NE2-OH 3.43Å; F324-Y341 AromaticContact CE1-CE1 3.77Å; F324-Y341 HydrophobicContact CE1-CE1 3.77Å; F324-Y341 AromaticContact CE1-CZ 3.87Å; F324-Y341 HydrophobicContact CZ-CD1 4.35Å; F324-Y341 AromaticContact CZ-CE1 3.89Å; F324-Y341 HydrophobicContact CZ-CE1 3.89Å; L328-Y341 HydrophobicContact CD1-CE1 4.49Å; L328-Y341 HydrophobicContact CD2-CD1 4.2Å; L328-Y341 HydrophobicContact CD2-CE1 4.23Å; L337-Y341 VanDerWaalsContact O-CB 3.27Å; L337-Y341 WeakPolarHBondContact O-CB 3.3Å; L337-Y341 PolarHBondContact O-N 3.49Å; Y341-H343 VanDerWaalsContact C-N 3.34Å; Y341-H343 PolarHBondContact O-N 2.88Å; Y341-A344 PolarHBondContact O-N 3.49Å; Y341-K345 HydrophobicContact CE2-CB 4.43Å; Y341-K345 VanDerWaalsContact O-CB 3.31Å; Y341-K345 WeakPolarHBondContact O-CB 3.27Å; Y341-K345 PolarHBondContact O-N 2.94Å; Y341-F346 AromaticContact CE1-CE2 3.73Å; Y341-F346 HydrophobicContact CE1-CE2 3.73Å; Y341-F346 HydrophobicContact CE1-CZ 4.22Å
342	A	83	Confident	75.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65	-38.1	-177.8	0	0	0	0	0	112.2	L328 L338 F346 N347 C348 L350	L328-A342 HydrophobicContact CD2-CB 4.32Å; L338-A342 VanDerWaalsContact O-CB 3.3Å; L338-A342 WeakPolarHBondContact O-CB 3.46Å; L338-A342 PolarHBondContact O-N 3.23Å; A342-F346 HydrophobicContact CB-CD2 4.44Å; A342-F346 WeakPolarHBondContact O-CA 3.47Å; A342-F346 WeakPolarHBondContact O-CB 3.47Å; A342-F346 PolarHBondContact O-N 3.47Å; A342-N347 PolarHBondContact O-N 3.11Å; A342-C348 CarbonylContact C-O 3.47Å; A342-L350 HydrophobicContact CB-CD1 4.27Å; A342-L350 HydrophobicContact CB-CD2 4.41Å; A342-L350 HydrophobicContact CB-CG 4.02Å
343	H	82.3	Confident	75.9	Confident	82 Å²	82	58 Å²	58	38%	0.38	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-49.6	173.1	-174.1	-84.4	0	0	0	111.5	A339 S340 Y341 N347 C348 F356	A339-H343 WeakPolarHBondContact O-CB 3.4Å; A339-H343 PolarHBondContact O-N 3.09Å; S340-H343 PolarHBondContact O-N 3.28Å; Y341-H343 VanDerWaalsContact C-N 3.34Å; Y341-H343 PolarHBondContact O-N 2.88Å; H343-N347 VanDerWaalsContact O-CA 3.27Å; H343-N347 WeakPolarHBondContact O-CA 3.35Å; H343-N347 PolarHBondContact O-N 2.91Å; H343-N347 VanDerWaalsContact O-N 3.08Å; H343-C348 VanDerWaalsContact CA-O 3.24Å; H343-C348 WeakPolarHBondContact CA-O 3.13Å; H343-C348 PolarHBondContact N-O 3.18Å; H343-F356 AromaticContact CD2-CE1 4Å; H343-F356 AromaticContact NE2-CD1 3.79Å; H343-F356 AromaticContact NE2-CE1 3.24Å; H343-F356 WeakPolarHBondContact NE2-CE1 3.45Å; H343-F356 AromaticContact NE2-CZ 3.97Å
344	A	80.5	Confident	76.8	Confident	69 Å²	69	53.3 Å²	53.3	57%	0.57	32%	0.32	S	S	*	.	H	α-helix	trans	-66.7	-38.9	-178.9	0	0	0	0	0	113.5	S340 Y341	S340-A344 VanDerWaalsContact O-CB 3.3Å; S340-A344 WeakPolarHBondContact O-CB 3.45Å; S340-A344 PolarHBondContact O-N 3.46Å; Y341-A344 PolarHBondContact O-N 3.49Å
345	K	79.5	Confident	77.5	Confident	103 Å²	103	53.2 Å²	53.2	45%	0.448	34%	0.337	S	S	.	.	H	α-helix	trans	-91.4	-33.5	-173	-171.6	63.4	177.8	-176.4	0	114.1	Y341	Y341-K345 HydrophobicContact CE2-CB 4.43Å; Y341-K345 VanDerWaalsContact O-CB 3.31Å; Y341-K345 WeakPolarHBondContact O-CB 3.27Å; Y341-K345 PolarHBondContact O-N 2.94Å
346	F	80	Confident	77.6	Confident	10 Å²	10	55.4 Å²	55.4	4%	0.044	35%	0.348	C	S	.	.	H	α-helix	trans	-122.1	-0.9	-172.9	-51.3	-53.7	0	0	0	114.2	L328 Y341 A342 C348 R362 L367 A370 V371	L328-F346 HydrophobicContact CD1-CE2 4.21Å; Y341-F346 AromaticContact CE1-CE2 3.73Å; Y341-F346 HydrophobicContact CE1-CE2 3.73Å; Y341-F346 HydrophobicContact CE1-CZ 4.22Å; A342-F346 HydrophobicContact CB-CD2 4.44Å; A342-F346 WeakPolarHBondContact O-CA 3.47Å; A342-F346 WeakPolarHBondContact O-CB 3.47Å; A342-F346 PolarHBondContact O-N 3.47Å; F346-C348 VanDerWaalsContact C-N 3.29Å; F346-C348 PolarHBondContact O-N 2.98Å; F346-R362 PolarHBondContact O-NH2 2.99Å; F346-L367 HydrophobicContact CD2-CD2 4.3Å; F346-L367 HydrophobicContact CE2-CD2 4.46Å; F346-A370 HydrophobicContact CD1-CB 4.14Å; F346-A370 HydrophobicContact CE1-CB 3.68Å; F346-V371 HydrophobicContact CE2-CG2 4.45Å; F346-V371 HydrophobicContact CZ-CG2 3.72Å
347	N	81.2	Confident	77.7	Confident	109 Å²	109	55 Å²	55	58%	0.583	34%	0.337	S	S	*	.	S	Bend	trans	49.1	50.2	-175.5	-163	8.3	0	0	0	112	A342 H343	A342-N347 PolarHBondContact O-N 3.11Å; H343-N347 VanDerWaalsContact O-CA 3.27Å; H343-N347 WeakPolarHBondContact O-CA 3.35Å; H343-N347 PolarHBondContact O-N 2.91Å; H343-N347 VanDerWaalsContact O-N 3.08Å
348	C	81	Confident	77.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	34%	0.339	C	S	.	.			trans	-142.5	156.1	178.2	69.5	0	0	0	0	110	A342 H343 F346 V357 C359	A342-C348 CarbonylContact C-O 3.47Å; H343-C348 VanDerWaalsContact CA-O 3.24Å; H343-C348 WeakPolarHBondContact CA-O 3.13Å; H343-C348 PolarHBondContact N-O 3.18Å; F346-C348 VanDerWaalsContact C-N 3.29Å; F346-C348 PolarHBondContact O-N 2.98Å; C348-V357 CarbonylContact C-O 3.17Å; C348-V357 WeakPolarHBondContact CA-O 3.29Å; C348-V357 WeakPolarHBondContact CB-O 3.36Å; C348-C359 HydrophobicContact CB-CB 3.93Å; C348-C359 WeakPolarHBondContact CB-SG 3.41Å; C348-C359 PolarHBondContact O-SG 3.19Å; C348-C359 WeakPolarHBondContact SG-CA 3.36Å; C348-C359 WeakPolarHBondContact SG-CB 3.47Å; C348-C359 CovalentContact SG-SG 2.04Å; C348-C359 PolarHBondContact SG-SG 3.4Å
349	T	77.7	Confident	77.1	Confident	18 Å²	18	55.9 Å²	55.9	11%	0.11	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-108.3	142.3	178.8	53.9	0	0	0	0	111.9	V351 A353 F356 V357 D358 C359	T349-V351 VanDerWaalsContact C-N 3.26Å; T349-V351 VanDerWaalsContact CB-O 3.22Å; T349-V351 WeakPolarHBondContact CB-O 3.32Å; T349-V351 PolarHBondContact OG1-O 3.47Å; T349-A353 HydrophobicContact CG2-CB 4.43Å; T349-F356 HydrophobicContact CG2-CB 3.59Å; T349-F356 HydrophobicContact CG2-CD1 4.09Å; T349-F356 HydrophobicContact CG2-CD2 4.4Å; T349-F356 HydrophobicContact CG2-CG 3.77Å; T349-V357 PolarHBondContact N-O 2.93Å; T349-D358 WeakPolarHBondContact O-CA 3.03Å; T349-C359 PolarHBondContact O-N 2.97Å
350	L	73.9	Confident	76.9	Confident	7 Å²	7	61.4 Å²	61.4	4%	0.037	36%	0.361	C	S	.	.	S	Bend	trans	-82.4	-5.1	170.5	-68	-174.9	0	0	0	113.2	L328 S332 L338 A339 A342 C359	L328-L350 VanDerWaalsContact O-CD2 3.3Å; L328-L350 WeakPolarHBondContact O-CD2 3.09Å; S332-L350 WeakPolarHBondContact CB-O 3.22Å; S332-L350 PolarHBondContact OG-O 3.04Å; L338-L350 HydrophobicContact CB-CD1 4.11Å; L338-L350 HydrophobicContact CD2-CD1 3.78Å; L338-L350 HydrophobicContact CG-CD1 3.73Å; A339-L350 HydrophobicContact CB-CB 4.24Å; A339-L350 HydrophobicContact CB-CD1 4.38Å; A342-L350 HydrophobicContact CB-CD1 4.27Å; A342-L350 HydrophobicContact CB-CD2 4.41Å; A342-L350 HydrophobicContact CB-CG 4.02Å; L350-C359 HydrophobicContact CD2-CB 3.86Å
351	V	71.3	Confident	76.7	Confident	84 Å²	84	65.4 Å²	65.4	51%	0.509	38%	0.379	S	S	.	.	S	Bend	trans	-122.9	143.1	176.5	-176.7	0	0	0	0	107.6	T349 A353	T349-V351 VanDerWaalsContact C-N 3.26Å; T349-V351 VanDerWaalsContact CB-O 3.22Å; T349-V351 WeakPolarHBondContact CB-O 3.32Å; T349-V351 PolarHBondContact OG1-O 3.47Å; V351-A353 PolarHBondContact O-N 2.9Å
352	N	67	Low	76.2	Confident	140 Å²	140	69.5 Å²	69.5	75%	0.749	39%	0.394	S	S	*	.			trans	-66.2	96.9	174.4	-71.5	9	0	0	0	109.9
353	A	68.2	Low	75.8	Confident	35 Å²	35	70.9 Å²	70.9	29%	0.289	41%	0.409	S	S	.	.			trans	-111.7	126	174.2	0	0	0	0	0	108.9	T349 V351 G355 F356	T349-A353 HydrophobicContact CG2-CB 4.43Å; V351-A353 PolarHBondContact O-N 2.9Å; A353-G355 PolarHBondContact O-N 3.21Å; A353-F356 HydrophobicContact CB-CB 4.49Å; A353-F356 HydrophobicContact CB-CD2 3.92Å; A353-F356 PolarHBondContact O-N 2.89Å
354	P	73	Confident	75.1	Confident	131 Å²	131	70.8 Å²	70.8	85%	0.851	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	129.5	-179.9	26.2	-33.5	0	0	0	110.3
355	G	72.4	Confident	74.8	Confident	88 Å²	88	72.1 Å²	72.1	91%	0.907	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.5	-11.1	-176	0	0	0	0	0	115.3	A353	A353-G355 PolarHBondContact O-N 3.21Å
356	F	71.3	Confident	74.7	Confident	104 Å²	104	71.8 Å²	71.8	46%	0.456	41%	0.413	S	S	.	.	S	Bend	trans	-112.4	152.9	178.9	-64.8	-88.4	0	0	0	112.6	H343 T349 A353	H343-F356 AromaticContact CD2-CE1 4Å; H343-F356 AromaticContact NE2-CD1 3.79Å; H343-F356 AromaticContact NE2-CE1 3.24Å; H343-F356 WeakPolarHBondContact NE2-CE1 3.45Å; H343-F356 AromaticContact NE2-CZ 3.97Å; T349-F356 HydrophobicContact CG2-CB 3.59Å; T349-F356 HydrophobicContact CG2-CD1 4.09Å; T349-F356 HydrophobicContact CG2-CD2 4.4Å; T349-F356 HydrophobicContact CG2-CG 3.77Å; A353-F356 HydrophobicContact CB-CB 4.49Å; A353-F356 HydrophobicContact CB-CD2 3.92Å; A353-F356 PolarHBondContact O-N 2.89Å
357	V	78.8	Confident	74.5	Confident	79 Å²	79	71.6 Å²	71.6	48%	0.479	41%	0.412	S	S	.	.			trans	-82	124.9	175.6	-178.9	0	0	0	0	109.2	C348 T349 C359	C348-V357 CarbonylContact C-O 3.17Å; C348-V357 WeakPolarHBondContact CA-O 3.29Å; C348-V357 WeakPolarHBondContact CB-O 3.36Å; T349-V357 PolarHBondContact N-O 2.93Å; V357-C359 PolarHBondContact O-N 3.3Å
358	D	77	Confident	74.2	Confident	38 Å²	38	68 Å²	68	20%	0.203	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-61.1	124.5	168.6	176.7	-2.9	0	0	0	109.4	T349 K360 N361	T349-D358 WeakPolarHBondContact O-CA 3.03Å; D358-K360 PolarHBondContact O-N 3.42Å; D358-K360 VanDerWaalsContact O-N 3.11Å; D358-K360 WeakPolarHBondContact OD1-CB 3.03Å; D358-K360 PolarHBondContact OD1-N 2.97Å; D358-N361 WeakPolarHBondContact O-CB 3.39Å; D358-N361 PolarHBondContact O-N 3.48Å
359	C	75.3	Confident	73.8	Confident	7 Å²	7	76 Å²	76	5%	0.047	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-55.2	-29.5	178.6	-61.9	0	0	0	0	113	C348 T349 L350 V357 N361 R362	C348-C359 HydrophobicContact CB-CB 3.93Å; C348-C359 WeakPolarHBondContact CB-SG 3.41Å; C348-C359 PolarHBondContact O-SG 3.19Å; C348-C359 WeakPolarHBondContact SG-CA 3.36Å; C348-C359 WeakPolarHBondContact SG-CB 3.47Å; C348-C359 CovalentContact SG-SG 2.04Å; C348-C359 PolarHBondContact SG-SG 3.4Å; T349-C359 PolarHBondContact O-N 2.97Å; L350-C359 HydrophobicContact CD2-CB 3.86Å; V357-C359 PolarHBondContact O-N 3.3Å; C359-N361 PolarHBondContact O-N 2.82Å; C359-R362 WeakPolarHBondContact O-CB 3.45Å; C359-R362 PolarHBondContact O-N 2.8Å; C359-R362 VanDerWaalsContact O-N 3.09Å
360	K	74.9	Confident	73.5	Confident	145 Å²	145	76.5 Å²	76.5	63%	0.63	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-59	-26.9	175.6	-171.3	-179.2	173.7	-172.4	0	112.9	D358	D358-K360 PolarHBondContact O-N 3.42Å; D358-K360 VanDerWaalsContact O-N 3.11Å; D358-K360 WeakPolarHBondContact OD1-CB 3.03Å; D358-K360 PolarHBondContact OD1-N 2.97Å
361	N	77.3	Confident	73.7	Confident	123 Å²	123	76.5 Å²	76.5	66%	0.658	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-85.3	-4.8	-179.9	-62.7	-20.1	0	0	0	113.5	D358 C359 G363	D358-N361 WeakPolarHBondContact O-CB 3.39Å; D358-N361 PolarHBondContact O-N 3.48Å; C359-N361 PolarHBondContact O-N 2.82Å; N361-G363 VanDerWaalsContact C-N 3.31Å
362	R	75.4	Confident	73.7	Confident	87 Å²	87	77 Å²	77	33%	0.328	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-71.2	-24.5	173.5	-75.5	-73	-160.7	160.7	2.7	113.2	F346 C359 Y366 L367	F346-R362 PolarHBondContact O-NH2 2.99Å; C359-R362 WeakPolarHBondContact O-CB 3.45Å; C359-R362 PolarHBondContact O-N 2.8Å; C359-R362 VanDerWaalsContact O-N 3.09Å; R362-Y366 HydrophobicContact CB-CD1 3.91Å; R362-Y366 HydrophobicContact CG-CD1 4.2Å; R362-Y366 HydrophobicContact CG-CE1 4.4Å; R362-Y366 PolarHBondContact NH1-OH 3.32Å; R362-Y366 VanDerWaalsContact NH1-OH 3.14Å; R362-Y366 WeakPolarHBondContact O-CB 3.49Å; R362-L367 HydrophobicContact CB-CD2 4.28Å; R362-L367 HydrophobicContact CB-CG 4.26Å
363	G	73.2	Confident	74.1	Confident	30 Å²	30	73 Å²	73	31%	0.309	43%	0.425	S	S	.	.			trans	86.4	144.2	-175	0	0	0	0	0	113.4	N361 S365 Y366 L367	N361-G363 VanDerWaalsContact C-N 3.31Å; G363-S365 VanDerWaalsContact C-N 3.31Å; G363-S365 PolarHBondContact O-N 3.06Å; G363-Y366 PolarHBondContact O-N 3.28Å; G363-L367 PolarHBondContact O-N 3.07Å
364	D	68.8	Low	74.3	Confident	79 Å²	79	71.5 Å²	71.5	42%	0.422	41%	0.413	S	S	.	.	H	α-helix	trans	-62.3	-36	-173.5	-60.8	-32.8	0	0	0	112.5	R329 L367 A368	R329-D364 WeakPolarHBondContact CD-OD1 3.1Å; R329-D364 IonicContact CZ-OD1 2.88Å; R329-D364 IonicContact CZ-OD2 3.86Å; R329-D364 IonicContact NE-OD1 2.93Å; R329-D364 IonicContact NH1-OD1 2.66Å; R329-D364 PolarHBondContact NH1-OD1 2.77Å; R329-D364 IonicContact NH1-OD2 3.79Å; R329-D364 PolarHBondContact NH1-OD2 3.33Å; D364-L367 PolarHBondContact O-N 3.06Å; D364-A368 WeakPolarHBondContact O-CB 3.23Å; D364-A368 PolarHBondContact O-N 3.39Å
365	S	73.4	Confident	74.5	Confident	97 Å²	97	66.2 Å²	66.2	68%	0.678	38%	0.38	S	S	*	.	H	α-helix	trans	-65.4	-46.9	178.5	50.4	0	0	0	0	112.7	G363 L367 A368 E369	G363-S365 VanDerWaalsContact C-N 3.31Å; G363-S365 PolarHBondContact O-N 3.06Å; S365-L367 VanDerWaalsContact C-N 3.28Å; S365-L367 PolarHBondContact O-N 2.77Å; S365-A368 PolarHBondContact O-N 3.36Å; S365-E369 WeakPolarHBondContact O-CB 3.37Å; S365-E369 PolarHBondContact O-N 2.72Å
366	Y	78.5	Confident	75.1	Confident	97 Å²	97	62.3 Å²	62.3	38%	0.38	34%	0.339	S	S	.	.	H	α-helix	trans	-59.7	-40.8	176.4	-179.3	-87.5	0	0	0	111.4	R362 G363 A370	R362-Y366 HydrophobicContact CB-CD1 3.91Å; R362-Y366 HydrophobicContact CG-CD1 4.2Å; R362-Y366 HydrophobicContact CG-CE1 4.4Å; R362-Y366 PolarHBondContact NH1-OH 3.32Å; R362-Y366 VanDerWaalsContact NH1-OH 3.14Å; R362-Y366 WeakPolarHBondContact O-CB 3.49Å; G363-Y366 PolarHBondContact O-N 3.28Å; Y366-A370 HydrophobicContact CE1-CB 4.42Å; Y366-A370 WeakPolarHBondContact O-CB 3.42Å; Y366-A370 PolarHBondContact O-N 2.64Å
367	L	75.3	Confident	76	Confident	6 Å²	6	57.5 Å²	57.5	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-43.1	177.4	-68	172.4	0	0	0	111.7	V325 F346 R362 G363 D364 S365 A370 V371	V325-L367 HydrophobicContact CG1-CB 4.28Å; F346-L367 HydrophobicContact CD2-CD2 4.3Å; F346-L367 HydrophobicContact CE2-CD2 4.46Å; R362-L367 HydrophobicContact CB-CD2 4.28Å; R362-L367 HydrophobicContact CB-CG 4.26Å; G363-L367 PolarHBondContact O-N 3.07Å; D364-L367 PolarHBondContact O-N 3.06Å; S365-L367 VanDerWaalsContact C-N 3.28Å; S365-L367 PolarHBondContact O-N 2.77Å; L367-A370 PolarHBondContact O-N 3.48Å; L367-V371 WeakPolarHBondContact O-CB 3.27Å; L367-V371 WeakPolarHBondContact O-CG2 3.38Å; L367-V371 PolarHBondContact O-N 3.32Å
368	A	73.9	Confident	76.5	Confident	32 Å²	32	55 Å²	55	26%	0.264	30%	0.302	S	S	.	.	H	α-helix	trans	-65.1	-39.2	177.2	0	0	0	0	0	112.9	V325 D364 S365	V325-A368 HydrophobicContact CG2-CB 4.39Å; D364-A368 WeakPolarHBondContact O-CB 3.23Å; D364-A368 PolarHBondContact O-N 3.39Å; S365-A368 PolarHBondContact O-N 3.36Å
369	E	73.1	Confident	77.1	Confident	170 Å²	170	54 Å²	54	79%	0.794	30%	0.299	S	S	*	.	H	α-helix	trans	-72.1	-33.9	178	-169.8	168.3	-150.2	0	0	112.4	S365	S365-E369 WeakPolarHBondContact O-CB 3.37Å; S365-E369 PolarHBondContact O-N 2.72Å
370	A	72.7	Confident	77.9	Confident	28 Å²	28	53.7 Å²	53.7	23%	0.231	30%	0.296	C	S	.	.	H	α-helix	trans	-82.8	-15.1	178	0	0	0	0	0	114.6	F346 Y366 L367 T372	F346-A370 HydrophobicContact CD1-CB 4.14Å; F346-A370 HydrophobicContact CE1-CB 3.68Å; Y366-A370 HydrophobicContact CE1-CB 4.42Å; Y366-A370 WeakPolarHBondContact O-CB 3.42Å; Y366-A370 PolarHBondContact O-N 2.64Å; L367-A370 PolarHBondContact O-N 3.48Å; A370-T372 PolarHBondContact O-N 2.84Å
371	V	76.7	Confident	78.7	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.042	27%	0.266	C	S	.	.			trans	-84.9	85.3	174.7	174.4	0	0	0	0	110.1	R321 F324 V325 L328 F346 L367 T373	R321-V371 HydrophobicContact CG-CB 4.38Å; R321-V371 HydrophobicContact CG-CG1 4.04Å; F324-V371 HydrophobicContact CD1-CG1 3.88Å; F324-V371 HydrophobicContact CD1-CG2 4.35Å; F324-V371 HydrophobicContact CE1-CG1 4.43Å; V325-V371 HydrophobicContact CG2-CB 4.46Å; V325-V371 HydrophobicContact CG2-CG2 4.21Å; L328-V371 HydrophobicContact CD1-CG2 4.22Å; F346-V371 HydrophobicContact CE2-CG2 4.45Å; F346-V371 HydrophobicContact CZ-CG2 3.72Å; L367-V371 WeakPolarHBondContact O-CB 3.27Å; L367-V371 WeakPolarHBondContact O-CG2 3.38Å; L367-V371 PolarHBondContact O-N 3.32Å; V371-T373 PolarHBondContact O-N 3.35Å
372	T	71.2	Confident	79.4	Confident	93 Å²	93	41.6 Å²	41.6	57%	0.571	24%	0.238	S	C	*	.			trans	-71.2	110.9	163.3	56	0	0	0	0	109.4	H69 A370 G374	H69-T372 PolarHBondContact CE1-O 2.63Å; H69-T372 PolarHBondContact ND1-O 2.66Å; A370-T372 PolarHBondContact O-N 2.84Å; T372-G374 PolarHBondContact O-N 3.02Å
373	T	75.7	Confident	80.2	Confident	56 Å²	56	37.5 Å²	37.5	34%	0.344	22%	0.223	S	C	.	.			trans	-58.8	132.4	-179.8	49.6	0	0	0	0	111.9	F320 R321 V371	F320-T373 HydrophobicContact CD1-CG2 4.36Å; R321-T373 HydrophobicContact CB-CG2 3.8Å; R321-T373 HydrophobicContact CG-CG2 4.39Å; V371-T373 PolarHBondContact O-N 3.35Å
374	G	73.4	Confident	81.1	Confident	5 Å²	5	36.1 Å²	36.1	5%	0.052	21%	0.208	C	C	.	.			trans	-61.7	146.5	-173.2	0	0	0	0	0	113.8	D66 H69 T372 T376 V377	D66-G374 WeakPolarHBondContact OD1-CA 3.42Å; H69-G374 WeakPolarHBondContact ND1-CA 3.34Å; H69-G374 PolarHBondContact ND1-N 3.04Å; T372-G374 PolarHBondContact O-N 3.02Å; G374-T376 PolarHBondContact O-N 3.05Å; G374-T376 VanDerWaalsContact O-N 3.09Å; G374-V377 VanDerWaalsContact O-CB 3.32Å; G374-V377 WeakPolarHBondContact O-CB 3.37Å; G374-V377 VanDerWaalsContact O-CG2 3.24Å; G374-V377 WeakPolarHBondContact O-CG2 3.17Å; G374-V377 PolarHBondContact O-N 2.85Å; G374-V377 VanDerWaalsContact O-N 3.11Å
375	A	77.3	Confident	82.3	Confident	19 Å²	19	32.4 Å²	32.4	16%	0.157	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.4	-164.3	0	0	0	0	0	115.2	D66 D287 K314	D66-A375 PolarHBondContact OD1-N 2.87Å; D66-A375 VanDerWaalsContact OD1-N 3.07Å; D287-A375 HydrophobicContact CB-CB 4.15Å; D287-A375 WeakPolarHBondContact O-CB 3.39Å; K314-A375 WeakPolarHBondContact CE-O 3.46Å; K314-A375 PolarHBondContact NZ-O 2.85Å
376	T	85.1	Confident	83.1	Confident	7 Å²	7	27.8 Å²	27.8	4%	0.043	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-1.1	179.9	37.7	0	0	0	0	113.9	T70 F162 D287 G374 E378 A379 A380	T70-T376 PolarHBondContact OG1-OG1 3.33Å; F162-T376 HydrophobicContact CD2-CG2 4.31Å; D287-T376 HydrophobicContact CB-CG2 3.68Å; D287-T376 VanDerWaalsContact CG-CG2 3.49Å; D287-T376 WeakPolarHBondContact OD2-CG2 3.29Å; G374-T376 PolarHBondContact O-N 3.05Å; G374-T376 VanDerWaalsContact O-N 3.09Å; T376-E378 PolarHBondContact O-N 3.3Å; T376-A379 PolarHBondContact O-N 2.82Å; T376-A380 WeakPolarHBondContact O-CB 3.26Å; T376-A380 PolarHBondContact O-N 3.46Å
377	V	89.3	Confident	83.7	Confident	3 Å²	3	23.2 Å²	23.2	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-54.1	-51.5	-175.5	162.6	0	0	0	0	112.7	H69 A73 M317 F320 G374 A380 V381	H69-V377 HydrophobicContact CB-CG2 3.9Å; A73-V377 HydrophobicContact CB-CB 4.38Å; A73-V377 HydrophobicContact CB-CG1 3.86Å; A73-V377 HydrophobicContact CB-CG2 4.21Å; M317-V377 HydrophobicContact CB-CG1 4.33Å; M317-V377 HydrophobicContact CE-CG1 4.46Å; M317-V377 HydrophobicContact CG-CG1 4.27Å; F320-V377 HydrophobicContact CD1-CG1 3.64Å; F320-V377 HydrophobicContact CD1-CG2 4.34Å; F320-V377 HydrophobicContact CE1-CG1 4.04Å; F320-V377 HydrophobicContact CE1-CG2 3.95Å; F320-V377 HydrophobicContact CG-CG1 4.21Å; G374-V377 VanDerWaalsContact O-CB 3.32Å; G374-V377 WeakPolarHBondContact O-CB 3.37Å; G374-V377 VanDerWaalsContact O-CG2 3.24Å; G374-V377 WeakPolarHBondContact O-CG2 3.17Å; G374-V377 PolarHBondContact O-N 2.85Å; G374-V377 VanDerWaalsContact O-N 3.11Å; V377-A380 PolarHBondContact O-N 2.95Å; V377-V381 WeakPolarHBondContact O-CG2 3.49Å; V377-V381 PolarHBondContact O-N 3.41Å
378	E	89.5	Confident	84.3	Confident	27 Å²	27	23 Å²	23	13%	0.126	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-49.2	180	174.8	169.2	175.1	0	0	111.7	S315 M317 T376 A380 V381 L382 L435 K438	S315-E378 WeakPolarHBondContact CB-OE2 3.32Å; S315-E378 PolarHBondContact N-OE2 2.98Å; S315-E378 VanDerWaalsContact OG-CD 3.22Å; S315-E378 PolarHBondContact OG-OE2 2.85Å; M317-E378 HydrophobicContact CG-CB 4.34Å; T376-E378 PolarHBondContact O-N 3.3Å; E378-A380 PolarHBondContact O-N 3.26Å; E378-V381 PolarHBondContact O-N 3.33Å; E378-V381 VanDerWaalsContact O-N 3.1Å; E378-L382 HydrophobicContact CG-CD1 3.91Å; E378-L382 HydrophobicContact CG-CG 4.23Å; E378-L382 WeakPolarHBondContact O-CG 3.48Å; E378-L382 PolarHBondContact O-N 3.16Å; E378-L435 HydrophobicContact CG-CD2 4.16Å; E378-K438 IonicContact OE1-NZ 3.29Å; E378-K438 PolarHBondContact OE1-NZ 3.01Å; E378-K438 IonicContact OE2-NZ 3.45Å
379	A	89.5	Confident	85	Confident	17 Å²	17	21.9 Å²	21.9	14%	0.14	13%	0.128	C	C	.	.	H	α-helix	trans	-60.4	-33.7	-178.9	0	0	0	0	0	112.2	F162 T181 T376 A383	F162-A379 VanDerWaalsContact CB-C 3.5Å; F162-A379 HydrophobicContact CB-CB 3.86Å; F162-A379 WeakPolarHBondContact CB-O 3.31Å; F162-A379 WeakPolarHBondContact O-CB 3.29Å; T181-A379 WeakPolarHBondContact CB-O 3.44Å; T181-A379 PolarHBondContact OG1-O 2.77Å; T376-A379 PolarHBondContact O-N 2.82Å; A379-A383 WeakPolarHBondContact O-CB 3.34Å; A379-A383 PolarHBondContact O-N 3.41Å
380	A	91.1	Very high	85.7	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-74.6	-35.3	175.8	0	0	0	0	0	113.2	T70 V74 F162 T376 V377 E378 A383 T384	T70-A380 HydrophobicContact CG2-CB 3.33Å; V74-A380 HydrophobicContact CG2-CB 4.03Å; F162-A380 HydrophobicContact CB-CB 4.23Å; F162-A380 HydrophobicContact CD1-CB 3.94Å; F162-A380 HydrophobicContact CD2-CB 3.87Å; F162-A380 HydrophobicContact CE1-CB 4.23Å; F162-A380 HydrophobicContact CE2-CB 4.19Å; F162-A380 HydrophobicContact CG-CB 3.73Å; F162-A380 HydrophobicContact CZ-CB 4.33Å; T376-A380 WeakPolarHBondContact O-CB 3.26Å; T376-A380 PolarHBondContact O-N 3.46Å; V377-A380 PolarHBondContact O-N 2.95Å; E378-A380 PolarHBondContact O-N 3.26Å; A380-A383 PolarHBondContact O-N 2.91Å; A380-T384 WeakPolarHBondContact O-CG2 3.16Å; A380-T384 PolarHBondContact O-N 3.5Å; A380-T384 PolarHBondContact O-OG1 3.28Å
381	V	92.6	Very high	86.2	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-66.6	-41.7	170.9	174.5	0	0	0	0	110.6	A73 W76 A77 M317 V377 E378 A383 T384 Y385 L435	A73-V381 HydrophobicContact CB-CG2 4.02Å; W76-V381 HydrophobicContact CE3-CG2 4.17Å; W76-V381 HydrophobicContact CZ3-CG1 4.47Å; W76-V381 HydrophobicContact CZ3-CG2 4.19Å; A77-V381 HydrophobicContact CB-CB 4.47Å; A77-V381 HydrophobicContact CB-CG1 4Å; A77-V381 HydrophobicContact CB-CG2 4.23Å; M317-V381 HydrophobicContact CE-CB 4.3Å; M317-V381 HydrophobicContact CE-CG1 4.36Å; M317-V381 HydrophobicContact CE-CG2 4.01Å; V377-V381 WeakPolarHBondContact O-CG2 3.49Å; V377-V381 PolarHBondContact O-N 3.41Å; E378-V381 PolarHBondContact O-N 3.33Å; E378-V381 VanDerWaalsContact O-N 3.1Å; V381-A383 VanDerWaalsContact C-N 3.31Å; V381-A383 PolarHBondContact O-N 3.12Å; V381-T384 PolarHBondContact O-N 3.45Å; V381-T384 PolarHBondContact O-OG1 3.25Å; V381-Y385 HydrophobicContact CG1-CD2 4.02Å; V381-Y385 HydrophobicContact CG1-CE2 4.32Å; V381-Y385 WeakPolarHBondContact O-CB 3.39Å; V381-Y385 WeakPolarHBondContact O-CD2 3.44Å; V381-Y385 PolarHBondContact O-N 3.31Å; V381-L435 HydrophobicContact CB-CD1 4.38Å; V381-L435 HydrophobicContact CG1-CD1 3.52Å
382	L	92.3	Very high	86.6	Confident	14 Å²	14	15.6 Å²	15.6	7%	0.073	9%	0.091	C	C	.	.	H	α-helix	trans	-61.7	-39	172.6	-65.9	173.3	0	0	0	111.4	T181 E378 A386 F427 L435 I440 L448	T181-L382 HydrophobicContact CG2-CB 4.19Å; E378-L382 HydrophobicContact CG-CD1 3.91Å; E378-L382 HydrophobicContact CG-CG 4.23Å; E378-L382 WeakPolarHBondContact O-CG 3.48Å; E378-L382 PolarHBondContact O-N 3.16Å; L382-A386 VanDerWaalsContact O-CB 3.3Å; L382-A386 WeakPolarHBondContact O-CB 3.29Å; L382-A386 PolarHBondContact O-N 3.23Å; L382-F427 HydrophobicContact CD2-CE2 3.6Å; L382-F427 HydrophobicContact CD2-CZ 3.81Å; L382-L435 HydrophobicContact CD2-CD1 4.42Å; L382-I440 HydrophobicContact CD2-CD1 4.35Å; L382-I440 HydrophobicContact CD2-CG1 4.15Å; L382-L448 HydrophobicContact CD1-CD2 3.96Å
383	A	92	Very high	87	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-68.8	-40.9	178.1	0	0	0	0	0	112.9	L137 L160 F162 T181 A379 A380 V381 A386 V387	L137-A383 HydrophobicContact CD1-CB 3.87Å; L160-A383 HydrophobicContact CB-CB 4.3Å; L160-A383 HydrophobicContact CD2-CB 3.92Å; L160-A383 WeakPolarHBondContact CD2-O 3.18Å; F162-A383 HydrophobicContact CB-CB 4.32Å; F162-A383 HydrophobicContact CD1-CB 4.41Å; T181-A383 HydrophobicContact CG2-CB 4.02Å; A379-A383 WeakPolarHBondContact O-CB 3.34Å; A379-A383 PolarHBondContact O-N 3.41Å; A380-A383 PolarHBondContact O-N 2.91Å; V381-A383 VanDerWaalsContact C-N 3.31Å; V381-A383 PolarHBondContact O-N 3.12Å; A383-A386 PolarHBondContact O-N 2.72Å; A383-V387 PolarHBondContact O-N 3.31Å; A383-V387 VanDerWaalsContact O-N 3.16Å
384	T	92.3	Very high	86.9	Confident	1 Å²	1	12.1 Å²	12.1	1%	0.006	7%	0.066	C	C	.	.	H	α-helix	trans	-67.6	-41.1	175.4	52.4	0	0	0	0	111.8	I49 V74 A77 L137 A380 V381 A386 V387 A388	I49-T384 HydrophobicContact CD1-CG2 4.24Å; V74-T384 HydrophobicContact CB-CG2 4.05Å; V74-T384 HydrophobicContact CG1-CG2 3.75Å; V74-T384 HydrophobicContact CG2-CG2 3.75Å; A77-T384 VanDerWaalsContact CB-OG1 3.3Å; A77-T384 WeakPolarHBondContact CB-OG1 3.39Å; L137-T384 HydrophobicContact CD1-CG2 4.38Å; L137-T384 HydrophobicContact CD2-CG2 4.35Å; A380-T384 WeakPolarHBondContact O-CG2 3.16Å; A380-T384 PolarHBondContact O-N 3.5Å; A380-T384 PolarHBondContact O-OG1 3.28Å; V381-T384 PolarHBondContact O-N 3.45Å; V381-T384 PolarHBondContact O-OG1 3.25Å; T384-A386 VanDerWaalsContact C-N 3.34Å; T384-A386 PolarHBondContact O-N 3.45Å; T384-V387 PolarHBondContact O-N 3.13Å; T384-A388 VanDerWaalsContact O-CB 3.27Å; T384-A388 WeakPolarHBondContact O-CB 3.46Å; T384-A388 PolarHBondContact O-N 2.84Å
385	Y	93.1	Very high	86.8	Confident	2 Å²	2	14.2 Å²	14.2	1%	0.008	8%	0.08	C	C	.	.	H	α-helix	trans	-64.7	-34.6	174.1	-95.3	-96.1	0	0	0	112.9	A77 W81 V381 A388 A389 Y425 F427 D431 P432	A77-Y385 HydrophobicContact CB-CD2 4.15Å; A77-Y385 HydrophobicContact CB-CE2 4.03Å; W81-Y385 AromaticContact CE3-CD1 3.88Å; W81-Y385 HydrophobicContact CE3-CD1 3.88Å; W81-Y385 AromaticContact CE3-CE1 3.67Å; W81-Y385 HydrophobicContact CE3-CE1 3.67Å; W81-Y385 HydrophobicContact CZ3-CD1 4Å; W81-Y385 HydrophobicContact CZ3-CE1 4.05Å; V381-Y385 HydrophobicContact CG1-CD2 4.02Å; V381-Y385 HydrophobicContact CG1-CE2 4.32Å; V381-Y385 WeakPolarHBondContact O-CB 3.39Å; V381-Y385 WeakPolarHBondContact O-CD2 3.44Å; V381-Y385 PolarHBondContact O-N 3.31Å; Y385-A388 PolarHBondContact O-N 3.33Å; Y385-A389 VanDerWaalsContact O-CB 3.3Å; Y385-A389 WeakPolarHBondContact O-CB 3.39Å; Y385-A389 PolarHBondContact O-N 2.65Å; Y385-Y425 HydrophobicContact CD1-CD1 4.05Å; Y385-Y425 AromaticContact CD1-CE1 3.42Å; Y385-Y425 HydrophobicContact CD1-CE1 3.42Å; Y385-Y425 VanDerWaalsContact CD1-CE1 3.42Å; Y385-Y425 AromaticContact CD1-CZ 3.95Å; Y385-Y425 AromaticContact CE1-CE1 3.74Å; Y385-Y425 HydrophobicContact CE1-CE1 3.74Å; Y385-Y425 AromaticContact CE1-CZ 3.99Å; Y385-F427 HydrophobicContact CD1-CD1 4.14Å; Y385-F427 AromaticContact CD1-CE1 3.44Å; Y385-F427 HydrophobicContact CD1-CE1 3.44Å; Y385-F427 VanDerWaalsContact CD1-CE1 3.44Å; Y385-F427 HydrophobicContact CD1-CZ 4.02Å; Y385-F427 AromaticContact CD2-CE1 3.8Å; Y385-F427 HydrophobicContact CD2-CE1 3.8Å; Y385-F427 HydrophobicContact CD2-CZ 4.28Å; Y385-F427 HydrophobicContact CE1-CD1 4.02Å; Y385-F427 AromaticContact CE1-CE1 3.64Å; Y385-F427 HydrophobicContact CE1-CE1 3.64Å; Y385-F427 HydrophobicContact CE2-CE1 4.01Å; Y385-F427 AromaticContact CG-CE1 3.5Å; Y385-F427 HydrophobicContact CG-CE1 3.5Å; Y385-F427 VanDerWaalsContact CG-CE1 3.5Å; Y385-F427 AromaticContact CG-CZ 3.8Å; Y385-F427 HydrophobicContact CG-CZ 3.8Å; Y385-F427 AromaticContact CZ-CE1 3.93Å; Y385-D431 WeakPolarHBondContact CE1-OD1 3.48Å; Y385-D431 PolarHBondContact OH-OD1 2.77Å; Y385-P432 HydrophobicContact CE2-CG 4.44Å; Y385-P432 VanDerWaalsContact OH-CD 3.23Å; Y385-P432 WeakPolarHBondContact OH-CD 3.28Å
386	A	91.5	Very high	86.3	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.2	-45.7	174	0	0	0	0	0	112.5	L160 L382 A383 T384 A388 M390 I440 F442	L160-A386 HydrophobicContact CD2-CB 3.73Å; L382-A386 VanDerWaalsContact O-CB 3.3Å; L382-A386 WeakPolarHBondContact O-CB 3.29Å; L382-A386 PolarHBondContact O-N 3.23Å; A383-A386 PolarHBondContact O-N 2.72Å; T384-A386 VanDerWaalsContact C-N 3.34Å; T384-A386 PolarHBondContact O-N 3.45Å; A386-A388 VanDerWaalsContact C-N 3.32Å; A386-M390 PolarHBondContact O-N 3.45Å; A386-M390 VanDerWaalsContact O-N 3.11Å; A386-I440 HydrophobicContact CB-CG2 3.93Å; A386-F442 HydrophobicContact CB-CE2 3.95Å; A386-F442 HydrophobicContact CB-CZ 3.87Å
387	V	89.5	Confident	85.1	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-63.5	-39.9	172.9	175.9	0	0	0	0	110.9	I49 Y135 L160 A383 T384 M390 V391	I49-V387 HydrophobicContact CD1-CB 4.06Å; I49-V387 HydrophobicContact CD1-CG1 3.92Å; I49-V387 HydrophobicContact CG1-CG1 3.95Å; Y135-V387 HydrophobicContact CD1-CG1 4.33Å; Y135-V387 HydrophobicContact CD2-CG1 3.67Å; Y135-V387 HydrophobicContact CE2-CG1 4.37Å; Y135-V387 HydrophobicContact CG-CG1 3.64Å; L160-V387 HydrophobicContact CD1-CG2 3.66Å; L160-V387 HydrophobicContact CD2-CG2 4.08Å; L160-V387 HydrophobicContact CG-CG2 4.42Å; A383-V387 PolarHBondContact O-N 3.31Å; A383-V387 VanDerWaalsContact O-N 3.16Å; T384-V387 PolarHBondContact O-N 3.13Å; V387-M390 WeakPolarHBondContact O-CB 3.27Å; V387-M390 PolarHBondContact O-N 2.93Å; V387-V391 WeakPolarHBondContact O-CG2 3.38Å; V387-V391 PolarHBondContact O-N 2.89Å
388	A	89.2	Confident	83.4	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-70.4	-38.9	-177.1	0	0	0	0	0	113.2	W81 I92 T384 Y385 A386 V391 R392	W81-A388 HydrophobicContact CD2-CB 3.58Å; W81-A388 HydrophobicContact CE3-CB 3.84Å; W81-A388 HydrophobicContact CG-CB 4.1Å; W81-A388 HydrophobicContact CH2-CB 4.01Å; W81-A388 HydrophobicContact CZ2-CB 3.76Å; W81-A388 WeakPolarHBondContact CZ2-O 3.47Å; W81-A388 HydrophobicContact CZ3-CB 4.05Å; I92-A388 VanDerWaalsContact CD1-CA 3.46Å; I92-A388 HydrophobicContact CD1-CB 3.51Å; T384-A388 VanDerWaalsContact O-CB 3.27Å; T384-A388 WeakPolarHBondContact O-CB 3.46Å; T384-A388 PolarHBondContact O-N 2.84Å; Y385-A388 PolarHBondContact O-N 3.33Å; A386-A388 VanDerWaalsContact C-N 3.32Å; A388-V391 PolarHBondContact O-N 2.8Å; A388-R392 PolarHBondContact O-N 2.7Å
389	A	88.9	Confident	81.5	Confident	9 Å²	9	35.8 Å²	35.8	7%	0.074	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-39.9	170.9	0	0	0	0	0	112	Y385 R392 M393 V423 Y425	Y385-A389 VanDerWaalsContact O-CB 3.3Å; Y385-A389 WeakPolarHBondContact O-CB 3.39Å; Y385-A389 PolarHBondContact O-N 2.65Å; A389-R392 PolarHBondContact O-N 2.8Å; A389-M393 PolarHBondContact O-N 3.23Å; A389-V423 HydrophobicContact CB-CG1 3.77Å; A389-Y425 HydrophobicContact CB-CD2 3.81Å; A389-Y425 HydrophobicContact CB-CG 3.91Å
390	M	87	Confident	79.7	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-60.2	-46.9	173.1	-172.5	-110.2	-61.3	0	0	111.9	Y135 A386 V387 R392 M393 T394 L416 A419 L420 V423	Y135-M390 HydrophobicContact CD1-CE 3.6Å; Y135-M390 HydrophobicContact CE1-CE 3.34Å; Y135-M390 HydrophobicContact CE1-SD 3.91Å; Y135-M390 HydrophobicContact CG-CE 4.5Å; A386-M390 PolarHBondContact O-N 3.45Å; A386-M390 VanDerWaalsContact O-N 3.11Å; V387-M390 WeakPolarHBondContact O-CB 3.27Å; V387-M390 PolarHBondContact O-N 2.93Å; M390-R392 VanDerWaalsContact C-N 3.3Å; M390-R392 PolarHBondContact O-N 3.08Å; M390-M393 PolarHBondContact O-N 2.82Å; M390-M393 VanDerWaalsContact O-N 3.13Å; M390-T394 HydrophobicContact CG-CG2 4.35Å; M390-T394 WeakPolarHBondContact O-CG2 3.43Å; M390-T394 PolarHBondContact O-N 3.32Å; M390-T394 PolarHBondContact O-OG1 2.63Å; M390-T394 HydrophobicContact SD-CG2 4.14Å; M390-L416 HydrophobicContact SD-CD2 4.09Å; M390-A419 HydrophobicContact CG-CB 4.07Å; M390-L420 HydrophobicContact CB-CD1 4.24Å; M390-L420 HydrophobicContact CE-CB 4.43Å; M390-L420 HydrophobicContact CE-CD1 4.38Å; M390-L420 HydrophobicContact CG-CB 4.28Å; M390-L420 HydrophobicContact CG-CD1 4.46Å; M390-V423 HydrophobicContact CB-CG2 3.65Å; M390-V423 HydrophobicContact CG-CG2 4.2Å
391	V	83.9	Confident	77.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.5	-36.7	176	164.4	0	0	0	0	112.4	H47 I92 Y135 V387 A388 T394 S395	H47-V391 HydrophobicContact CB-CG1 4.09Å; H47-V391 HydrophobicContact CB-CG2 4.1Å; H47-V391 WeakPolarHBondContact ND1-CG1 3.39Å; I92-V391 HydrophobicContact CD1-CB 4.03Å; I92-V391 HydrophobicContact CD1-CG1 4.04Å; I92-V391 HydrophobicContact CD1-CG2 4.2Å; I92-V391 HydrophobicContact CG1-CB 4.47Å; I92-V391 HydrophobicContact CG1-CG1 4.04Å; I92-V391 HydrophobicContact CG1-CG2 4.48Å; Y135-V391 HydrophobicContact CD2-CG2 4.33Å; Y135-V391 HydrophobicContact CE2-CG2 3.48Å; Y135-V391 VanDerWaalsContact CE2-CG2 3.48Å; V387-V391 WeakPolarHBondContact O-CG2 3.38Å; V387-V391 PolarHBondContact O-N 2.89Å; A388-V391 PolarHBondContact O-N 2.8Å; V391-T394 PolarHBondContact O-OG1 3.06Å; V391-S395 WeakPolarHBondContact O-CB 3.48Å; V391-S395 PolarHBondContact O-N 3.44Å
392	R	84.9	Confident	75.9	Confident	72 Å²	72	43.5 Å²	43.5	27%	0.272	23%	0.232	S	C	.	.	H	α-helix	trans	-67.6	-41.1	174	-177.8	168.3	167.7	164.6	-10.1	111.6	W81 N87 A388 A389 M390 T396	W81-R392 HydrophobicContact CH2-CB 4.29Å; W81-R392 HydrophobicContact CZ2-CB 4.07Å; N87-R392 PolarHBondContact OD1-NH1 3.21Å; A388-R392 PolarHBondContact O-N 2.7Å; A389-R392 PolarHBondContact O-N 2.8Å; M390-R392 VanDerWaalsContact C-N 3.3Å; M390-R392 PolarHBondContact O-N 3.08Å; R392-T396 PolarHBondContact O-N 3.45Å; R392-T396 PolarHBondContact O-OG1 3.36Å
393	M	80.1	Confident	74.2	Confident	57 Å²	57	44.3 Å²	44.3	28%	0.281	24%	0.238	S	C	.	.	H	α-helix	trans	-67.2	-48.6	178.7	-175.6	177.5	-179.1	0	0	112.6	A389 M390 S395 T396 D397 L422	A389-M393 PolarHBondContact O-N 3.23Å; M390-M393 PolarHBondContact O-N 2.82Å; M390-M393 VanDerWaalsContact O-N 3.13Å; M393-S395 VanDerWaalsContact C-N 3.25Å; M393-S395 PolarHBondContact O-N 3.3Å; M393-T396 PolarHBondContact O-N 3.49Å; M393-T396 VanDerWaalsContact O-N 3.17Å; M393-T396 PolarHBondContact O-OG1 3.09Å; M393-D397 PolarHBondContact O-N 3.35Å; M393-L422 HydrophobicContact CE-CB 3.88Å; M393-L422 HydrophobicContact CE-CD1 4.39Å; M393-L422 HydrophobicContact SD-CB 4.28Å
394	T	73.3	Confident	72.2	Confident	18 Å²	18	50.3 Å²	50.3	11%	0.11	27%	0.271	C	S	.	.	H	α-helix	trans	-66.4	-28.2	180	57.4	0	0	0	0	112.4	M390 V391 F401 A419	M390-T394 HydrophobicContact CG-CG2 4.35Å; M390-T394 WeakPolarHBondContact O-CG2 3.43Å; M390-T394 PolarHBondContact O-N 3.32Å; M390-T394 PolarHBondContact O-OG1 2.63Å; M390-T394 HydrophobicContact SD-CG2 4.14Å; V391-T394 PolarHBondContact O-OG1 3.06Å; T394-F401 HydrophobicContact CG2-CB 3.85Å; T394-F401 HydrophobicContact CG2-CD2 3.99Å; T394-F401 HydrophobicContact CG2-CG 3.94Å; T394-A419 HydrophobicContact CG2-CB 3.75Å
395	S	70.1	Confident	70.3	Confident	50 Å²	50	52.2 Å²	52.2	35%	0.35	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-7.3	176.4	-170.6	0	0	0	0	114.5	V391 M393	V391-S395 WeakPolarHBondContact O-CB 3.48Å; V391-S395 PolarHBondContact O-N 3.44Å; M393-S395 VanDerWaalsContact C-N 3.25Å; M393-S395 PolarHBondContact O-N 3.3Å
396	T	67.8	Low	68.1	Low	90 Å²	90	60.6 Å²	60.6	55%	0.552	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-25.8	172.7	44.5	0	0	0	0	113.4	R392 M393 D398	R392-T396 PolarHBondContact O-N 3.45Å; R392-T396 PolarHBondContact O-OG1 3.36Å; M393-T396 PolarHBondContact O-N 3.49Å; M393-T396 VanDerWaalsContact O-N 3.17Å; M393-T396 PolarHBondContact O-OG1 3.09Å; T396-D398 PolarHBondContact O-N 2.82Å
397	D	60.5	Low	65.7	Low	68 Å²	68	67.2 Å²	67.2	36%	0.364	37%	0.365	S	S	.	.			trans	-98.6	79.4	177.6	-91.5	-49.6	0	0	0	111.9	M393 K399 I400	M393-D397 PolarHBondContact O-N 3.35Å; D397-K399 PolarHBondContact O-N 3.1Å; D397-I400 HydrophobicContact CB-CB 4.12Å; D397-I400 HydrophobicContact CB-CD1 4.11Å; D397-I400 HydrophobicContact CB-CG1 4.02Å; D397-I400 PolarHBondContact O-N 2.97Å; D397-I400 VanDerWaalsContact O-N 3.13Å
398	D	52.8	Low	63.7	Low	153 Å²	153	73.6 Å²	73.6	82%	0.818	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-11.9	174.8	-87.5	-24.7	0	0	0	115.1	T396	T396-D398 PolarHBondContact O-N 2.82Å
399	K	49.9	Very low	62.1	Low	197 Å²	197	78.5 Å²	78.5	86%	0.857	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-6.9	-173.1	-66.8	-177.3	178.5	176.8	0	115.4	D397	D397-K399 PolarHBondContact O-N 3.1Å
400	I	51.2	Low	60.4	Low	94 Å²	94	79.7 Å²	79.7	48%	0.482	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-33.5	-165.1	-48.9	-174.3	0	0	0	113.8	D397	D397-I400 HydrophobicContact CB-CB 4.12Å; D397-I400 HydrophobicContact CB-CD1 4.11Å; D397-I400 HydrophobicContact CB-CG1 4.02Å; D397-I400 PolarHBondContact O-N 2.97Å; D397-I400 VanDerWaalsContact O-N 3.13Å
401	F	53.7	Low	59.3	Low	26 Å²	26	83.6 Å²	83.6	11%	0.114	46%	0.455	C	S	.	.			trans	-129.1	33.5	-172.9	-65.5	-67.4	0	0	0	114.6	T394 C403 Q415 A419	T394-F401 HydrophobicContact CG2-CB 3.85Å; T394-F401 HydrophobicContact CG2-CD2 3.99Å; T394-F401 HydrophobicContact CG2-CG 3.94Å; F401-C403 PolarHBondContact O-N 3.15Å; F401-Q415 HydrophobicContact CD1-CB 4.15Å; F401-Q415 HydrophobicContact CE1-CB 4.42Å; F401-Q415 VanDerWaalsContact CE1-O 3.31Å; F401-Q415 WeakPolarHBondContact CE1-O 3.19Å; F401-A419 HydrophobicContact CD1-CB 4.06Å; F401-A419 HydrophobicContact CD2-CB 4.3Å; F401-A419 HydrophobicContact CE1-CB 3.79Å; F401-A419 HydrophobicContact CE2-CB 4.02Å; F401-A419 HydrophobicContact CG-CB 4.32Å; F401-A419 HydrophobicContact CZ-CB 3.76Å
402	A	49.6	Very low	58.5	Low	60 Å²	60	84.7 Å²	84.7	50%	0.496	46%	0.463	S	S	.	.			trans	-76.7	79.5	-179.3	0	0	0	0	0	112.6	N404	A402-N404 PolarHBondContact O-N 3.39Å
403	C	57	Low	57.7	Low	30 Å²	30	81.6 Å²	81.6	20%	0.203	45%	0.453	C	S	.	.			trans	-67.9	57.9	166.8	-66.9	0	0	0	0	112.4	M133 F401 G405 C412	M133-C403 HydrophobicContact CE-CB 3.65Å; M133-C403 HydrophobicContact SD-CB 4.1Å; F401-C403 PolarHBondContact O-N 3.15Å; C403-G405 PolarHBondContact O-N 3.13Å; C403-G405 VanDerWaalsContact O-N 3.16Å; C403-C412 HydrophobicContact CB-CB 3.94Å; C403-C412 WeakPolarHBondContact CB-SG 3.26Å; C403-C412 VanDerWaalsContact SG-CA 3.57Å; C403-C412 WeakPolarHBondContact SG-CB 3.48Å; C403-C412 CovalentContact SG-SG 2.04Å; C403-C412 PolarHBondContact SG-SG 3.28Å
404	N	50.9	Low	57.4	Low	127 Å²	127	84.6 Å²	84.6	68%	0.679	47%	0.467	S	S	*	.			trans	-64.5	113.5	172.7	-72.1	-33.6	0	0	0	108.4	A402 Q406	A402-N404 PolarHBondContact O-N 3.39Å; N404-Q406 PolarHBondContact O-N 3.47Å
405	G	50.9	Low	57.4	Low	41 Å²	41	86.3 Å²	86.3	42%	0.423	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	59.2	-167.3	0	0	0	0	0	115.4	Q131 C403	Q131-G405 PolarHBondContact NE2-O 3.11Å; Q131-G405 VanDerWaalsContact OE1-N 3.16Å; C403-G405 PolarHBondContact O-N 3.13Å; C403-G405 VanDerWaalsContact O-N 3.16Å
406	Q	47.2	Very low	57.7	Low	177 Å²	177	84.2 Å²	84.2	83%	0.827	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-24.3	168	-67.2	-171.2	-8.9	0	0	112.4	N404	N404-Q406 PolarHBondContact O-N 3.47Å
407	N	40.6	Very low	58.2	Low	140 Å²	140	80.5 Å²	80.5	75%	0.749	44%	0.436	S	S	*	.	S	Bend	trans	-131	138.5	176.5	-81.3	-23.9	0	0	0	112.4
408	E	48.3	Very low	59.2	Low	135 Å²	135	81.9 Å²	81.9	63%	0.631	44%	0.44	S	S	*	.			trans	51.1	89.7	153.7	-56.5	-167.1	-163.3	0	0	119.3	A410 D411 C412	E408-A410 PolarHBondContact O-N 2.79Å; E408-D411 HydrophobicContact CB-CB 4.24Å; E408-D411 PolarHBondContact O-N 3.3Å; E408-C412 PolarHBondContact O-N 2.78Å
409	T	54.6	Low	60.5	Low	104 Å²	104	74.6 Å²	74.6	64%	0.638	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-7.3	162.1	52.4	0	0	0	0	114.5
410	A	54.1	Low	62.2	Low	34 Å²	34	65.2 Å²	65.2	28%	0.281	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-50.5	173.2	0	0	0	0	0	112.5	K156 E408 G413	K156-A410 HydrophobicContact CD-CB 4.08Å; E408-A410 PolarHBondContact O-N 2.79Å; A410-G413 PolarHBondContact O-N 2.99Å
411	D	63.3	Low	63.8	Low	82 Å²	82	65.4 Å²	65.4	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-74.2	-42.3	-172.6	-165.1	62.3	0	0	0	111.3	E408 G413 E414 Q415	E408-D411 HydrophobicContact CB-CB 4.24Å; E408-D411 PolarHBondContact O-N 3.3Å; D411-G413 PolarHBondContact O-N 2.97Å; D411-E414 PolarHBondContact O-N 2.81Å; D411-Q415 WeakPolarHBondContact O-CG 3.22Å; D411-Q415 PolarHBondContact O-N 3.15Å; D411-Q415 PolarHBondContact OD2-NE2 3.48Å
412	C	66.9	Low	65.4	Low	24 Å²	24	69.3 Å²	69.3	16%	0.162	38%	0.379	C	S	.	.	H	α-helix	trans	-55	-38.4	174	176.9	0	0	0	0	113	C403 E408 E414 Q415 L416	C403-C412 HydrophobicContact CB-CB 3.94Å; C403-C412 WeakPolarHBondContact CB-SG 3.26Å; C403-C412 VanDerWaalsContact SG-CA 3.57Å; C403-C412 WeakPolarHBondContact SG-CB 3.48Å; C403-C412 CovalentContact SG-SG 2.04Å; C403-C412 PolarHBondContact SG-SG 3.28Å; E408-C412 PolarHBondContact O-N 2.78Å; C412-E414 VanDerWaalsContact C-N 3.33Å; C412-E414 PolarHBondContact O-N 3.47Å; C412-Q415 PolarHBondContact O-N 2.79Å; C412-L416 WeakPolarHBondContact O-CB 3.42Å; C412-L416 VanDerWaalsContact O-CG 3.31Å; C412-L416 WeakPolarHBondContact O-CG 3.45Å; C412-L416 PolarHBondContact O-N 3.26Å
413	G	69.9	Low	67.2	Low	6 Å²	6	66.6 Å²	66.6	6%	0.062	36%	0.356	C	S	.	.	H	α-helix	trans	-64.7	-36.1	177.9	0	0	0	0	0	113.1	K156 A410 D411 T417	K156-G413 WeakPolarHBondContact O-CA 3.29Å; A410-G413 PolarHBondContact O-N 2.99Å; D411-G413 PolarHBondContact O-N 2.97Å; G413-T417 WeakPolarHBondContact O-CB 3.36Å; G413-T417 PolarHBondContact O-N 3Å; G413-T417 VanDerWaalsContact O-N 3.1Å; G413-T417 PolarHBondContact O-OG1 3.39Å
414	E	73	Confident	68.8	Low	121 Å²	121	73.8 Å²	73.8	57%	0.565	38%	0.379	S	S	*	.	H	α-helix	trans	-74.7	-42.1	174.5	-171.5	163.1	170.4	0	0	111.7	D411 C412 L416 T417 Q418	D411-E414 PolarHBondContact O-N 2.81Å; C412-E414 VanDerWaalsContact C-N 3.33Å; C412-E414 PolarHBondContact O-N 3.47Å; E414-L416 PolarHBondContact O-N 2.69Å; E414-T417 CarbonylContact O-C 3.48Å; E414-T417 WeakPolarHBondContact O-CA 3.28Å; E414-T417 WeakPolarHBondContact O-CB 3.45Å; E414-T417 PolarHBondContact O-N 3.21Å; E414-T417 VanDerWaalsContact O-N 3.08Å; E414-Q418 WeakPolarHBondContact O-CG 3.36Å; E414-Q418 PolarHBondContact O-N 3.04Å
415	Q	73	Confident	70.7	Confident	53 Å²	53	69.1 Å²	69.1	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-56.8	-47.7	173.4	-68.2	-177.7	22	0	0	112.1	F401 D411 C412 T417 Q418 A419	F401-Q415 HydrophobicContact CD1-CB 4.15Å; F401-Q415 HydrophobicContact CE1-CB 4.42Å; F401-Q415 VanDerWaalsContact CE1-O 3.31Å; F401-Q415 WeakPolarHBondContact CE1-O 3.19Å; D411-Q415 WeakPolarHBondContact O-CG 3.22Å; D411-Q415 PolarHBondContact O-N 3.15Å; D411-Q415 PolarHBondContact OD2-NE2 3.48Å; C412-Q415 PolarHBondContact O-N 2.79Å; Q415-T417 VanDerWaalsContact C-N 3.3Å; Q415-T417 PolarHBondContact O-N 3.32Å; Q415-Q418 WeakPolarHBondContact O-CB 3.43Å; Q415-Q418 PolarHBondContact O-N 2.81Å; Q415-Q418 VanDerWaalsContact O-N 3.08Å; Q415-A419 PolarHBondContact O-N 2.67Å
416	L	76.3	Confident	72.6	Confident	7 Å²	7	71.5 Å²	71.5	4%	0.037	36%	0.359	C	S	.	.	H	α-helix	trans	-62.8	-36	174.3	-69.7	174	0	0	0	112.4	M133 Y135 P158 M390 C412 E414 Q418 A419 L420	M133-L416 HydrophobicContact CE-CD1 3.79Å; M133-L416 HydrophobicContact CE-CD2 3.87Å; M133-L416 HydrophobicContact CE-CG 4.21Å; Y135-L416 HydrophobicContact CE1-CD1 4.18Å; Y135-L416 HydrophobicContact CE1-CD2 4.2Å; P158-L416 HydrophobicContact CG-CB 3.98Å; M390-L416 HydrophobicContact SD-CD2 4.09Å; C412-L416 WeakPolarHBondContact O-CB 3.42Å; C412-L416 VanDerWaalsContact O-CG 3.31Å; C412-L416 WeakPolarHBondContact O-CG 3.45Å; C412-L416 PolarHBondContact O-N 3.26Å; E414-L416 PolarHBondContact O-N 2.69Å; L416-Q418 VanDerWaalsContact C-N 3.27Å; L416-Q418 PolarHBondContact O-N 2.8Å; L416-A419 PolarHBondContact O-N 3.32Å; L416-L420 WeakPolarHBondContact O-CB 3.17Å; L416-L420 PolarHBondContact O-N 3.47Å
417	T	78.3	Confident	74.7	Confident	12 Å²	12	63.4 Å²	63.4	7%	0.074	32%	0.321	C	S	.	.	H	α-helix	trans	-67.4	-27.5	174.2	-63.8	0	0	0	0	111.9	F179 G413 E414 Q415 K421	F179-T417 HydrophobicContact CE2-CG2 4.07Å; F179-T417 HydrophobicContact CZ-CG2 4.27Å; G413-T417 WeakPolarHBondContact O-CB 3.36Å; G413-T417 PolarHBondContact O-N 3Å; G413-T417 VanDerWaalsContact O-N 3.1Å; G413-T417 PolarHBondContact O-OG1 3.39Å; E414-T417 CarbonylContact O-C 3.48Å; E414-T417 WeakPolarHBondContact O-CA 3.28Å; E414-T417 WeakPolarHBondContact O-CB 3.45Å; E414-T417 PolarHBondContact O-N 3.21Å; E414-T417 VanDerWaalsContact O-N 3.08Å; Q415-T417 VanDerWaalsContact C-N 3.3Å; Q415-T417 PolarHBondContact O-N 3.32Å; T417-K421 WeakPolarHBondContact O-CE 3.41Å; T417-K421 WeakPolarHBondContact O-CG 3.25Å
418	Q	80.8	Confident	76.9	Confident	96 Å²	96	57.7 Å²	57.7	45%	0.449	30%	0.295	S	S	.	.	H	α-helix	trans	-77.6	-44.8	171.2	-66.8	177.2	23.6	0	0	111.5	E414 Q415 L416 L420 K421 L422	E414-Q418 WeakPolarHBondContact O-CG 3.36Å; E414-Q418 PolarHBondContact O-N 3.04Å; Q415-Q418 WeakPolarHBondContact O-CB 3.43Å; Q415-Q418 PolarHBondContact O-N 2.81Å; Q415-Q418 VanDerWaalsContact O-N 3.08Å; L416-Q418 VanDerWaalsContact C-N 3.27Å; L416-Q418 PolarHBondContact O-N 2.8Å; Q418-L420 VanDerWaalsContact C-N 3.3Å; Q418-L420 PolarHBondContact O-N 3.14Å; Q418-K421 WeakPolarHBondContact O-CB 3.44Å; Q418-K421 PolarHBondContact O-N 2.86Å; Q418-K421 VanDerWaalsContact O-N 3.1Å; Q418-L422 PolarHBondContact O-N 3.46Å
419	A	81.4	Confident	78.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-55.3	-44.6	175.1	0	0	0	0	0	112	M390 T394 F401 Q415 L416 K421 L422 V423	M390-A419 HydrophobicContact CG-CB 4.07Å; T394-A419 HydrophobicContact CG2-CB 3.75Å; F401-A419 HydrophobicContact CD1-CB 4.06Å; F401-A419 HydrophobicContact CD2-CB 4.3Å; F401-A419 HydrophobicContact CE1-CB 3.79Å; F401-A419 HydrophobicContact CE2-CB 4.02Å; F401-A419 HydrophobicContact CG-CB 4.32Å; F401-A419 HydrophobicContact CZ-CB 3.76Å; Q415-A419 PolarHBondContact O-N 2.67Å; L416-A419 PolarHBondContact O-N 3.32Å; A419-K421 VanDerWaalsContact C-N 3.28Å; A419-K421 PolarHBondContact O-N 3.27Å; A419-L422 PolarHBondContact O-N 2.88Å; A419-V423 PolarHBondContact O-N 3.1Å
420	L	85.1	Confident	80.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.1	-24.1	179.6	-175.1	58.1	0	0	0	113.8	P158 L160 F179 M390 L416 Q418 L422 V423 F442	P158-L420 HydrophobicContact CB-CD2 3.98Å; L160-L420 HydrophobicContact CD1-CD1 4.31Å; L160-L420 HydrophobicContact CD1-CD2 3.51Å; F179-L420 HydrophobicContact CB-CD2 4.49Å; F179-L420 HydrophobicContact CD1-CD2 3.94Å; F179-L420 HydrophobicContact CD1-CG 3.87Å; F179-L420 HydrophobicContact CD2-CD2 3.46Å; F179-L420 VanDerWaalsContact CD2-CD2 3.46Å; F179-L420 HydrophobicContact CD2-CG 4.24Å; F179-L420 HydrophobicContact CE1-CB 4.13Å; F179-L420 HydrophobicContact CE1-CD2 3.95Å; F179-L420 HydrophobicContact CE1-CG 3.62Å; F179-L420 HydrophobicContact CE2-CB 4.34Å; F179-L420 HydrophobicContact CE2-CD2 3.48Å; F179-L420 VanDerWaalsContact CE2-CD2 3.48Å; F179-L420 HydrophobicContact CE2-CG 4.02Å; F179-L420 HydrophobicContact CG-CD2 3.71Å; F179-L420 HydrophobicContact CG-CG 4.19Å; F179-L420 HydrophobicContact CZ-CB 3.86Å; F179-L420 HydrophobicContact CZ-CD2 3.72Å; F179-L420 HydrophobicContact CZ-CG 3.7Å; M390-L420 HydrophobicContact CB-CD1 4.24Å; M390-L420 HydrophobicContact CE-CB 4.43Å; M390-L420 HydrophobicContact CE-CD1 4.38Å; M390-L420 HydrophobicContact CG-CB 4.28Å; M390-L420 HydrophobicContact CG-CD1 4.46Å; L416-L420 WeakPolarHBondContact O-CB 3.17Å; L416-L420 PolarHBondContact O-N 3.47Å; Q418-L420 VanDerWaalsContact C-N 3.3Å; Q418-L420 PolarHBondContact O-N 3.14Å; L420-L422 VanDerWaalsContact C-N 3.35Å; L420-V423 HydrophobicContact CD1-CG2 4.16Å; L420-F442 HydrophobicContact CD1-CE2 4.14Å
421	K	85.5	Confident	81.7	Confident	98 Å²	98	54.1 Å²	54.1	43%	0.426	28%	0.277	S	S	.	.	H	α-helix	trans	-73.7	-25.8	171.7	-70.1	170.8	-161.1	-174.2	0	113.1	F179 T417 Q418 A419 L446	F179-K421 HydrophobicContact CE1-CG 3.98Å; F179-K421 HydrophobicContact CZ-CG 3.91Å; T417-K421 WeakPolarHBondContact O-CE 3.41Å; T417-K421 WeakPolarHBondContact O-CG 3.25Å; Q418-K421 WeakPolarHBondContact O-CB 3.44Å; Q418-K421 PolarHBondContact O-N 2.86Å; Q418-K421 VanDerWaalsContact O-N 3.1Å; A419-K421 VanDerWaalsContact C-N 3.28Å; A419-K421 PolarHBondContact O-N 3.27Å; K421-L446 HydrophobicContact CD-CD2 3.9Å; K421-L446 HydrophobicContact CG-CD2 3.68Å
422	L	86.6	Confident	82.9	Confident	109 Å²	109	50.4 Å²	50.4	57%	0.571	26%	0.257	S	S	*	.	S	Bend	trans	-90.9	-2.4	-177.7	-61.6	173.5	0	0	0	112.8	M393 Q418 A419 L420 R424	M393-L422 HydrophobicContact CE-CB 3.88Å; M393-L422 HydrophobicContact CE-CD1 4.39Å; M393-L422 HydrophobicContact SD-CB 4.28Å; Q418-L422 PolarHBondContact O-N 3.46Å; A419-L422 PolarHBondContact O-N 2.88Å; L420-L422 VanDerWaalsContact C-N 3.35Å; L422-R424 PolarHBondContact O-N 2.93Å
423	V	87.7	Confident	83.9	Confident	3 Å²	3	55 Å²	55	2%	0.018	28%	0.278	C	S	.	.			trans	-62.3	118.9	178.2	172.8	0	0	0	0	110.6	A389 M390 A419 L420	A389-V423 HydrophobicContact CB-CG1 3.77Å; M390-V423 HydrophobicContact CB-CG2 3.65Å; M390-V423 HydrophobicContact CG-CG2 4.2Å; A419-V423 PolarHBondContact O-N 3.1Å; L420-V423 HydrophobicContact CD1-CG2 4.16Å
424	R	89.7	Confident	84.6	Confident	180 Å²	180	56 Å²	56	68%	0.679	28%	0.284	S	S	*	.			trans	-123.4	126	159.2	-71.2	-172.6	176.5	161.6	-0.7	109.7	L422 E439 I440	L422-R424 PolarHBondContact O-N 2.93Å; R424-E439 WeakPolarHBondContact CD-OE1 3.28Å; R424-I440 VanDerWaalsContact CA-O 3.3Å; R424-I440 WeakPolarHBondContact CA-O 3.42Å
425	Y	91.2	Very high	85.4	Confident	29 Å²	29	50.3 Å²	50.3	11%	0.114	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	118.5	-178.3	-173.8	-94.7	0	0	0	112	W81 Y385 A389 F427 D431 E439 I440	W81-Y425 HydrophobicContact CH2-CE2 4.22Å; W81-Y425 AromaticContact CZ3-CE2 3.85Å; W81-Y425 HydrophobicContact CZ3-CE2 3.85Å; W81-Y425 AromaticContact CZ3-CZ 3.84Å; Y385-Y425 HydrophobicContact CD1-CD1 4.05Å; Y385-Y425 AromaticContact CD1-CE1 3.42Å; Y385-Y425 HydrophobicContact CD1-CE1 3.42Å; Y385-Y425 VanDerWaalsContact CD1-CE1 3.42Å; Y385-Y425 AromaticContact CD1-CZ 3.95Å; Y385-Y425 AromaticContact CE1-CE1 3.74Å; Y385-Y425 HydrophobicContact CE1-CE1 3.74Å; Y385-Y425 AromaticContact CE1-CZ 3.99Å; A389-Y425 HydrophobicContact CB-CD2 3.81Å; A389-Y425 HydrophobicContact CB-CG 3.91Å; Y425-F427 HydrophobicContact CE1-CD1 4.02Å; Y425-F427 HydrophobicContact CE1-CE1 4.26Å; Y425-F427 HydrophobicContact CE1-CG 4.24Å; Y425-D431 PolarHBondContact OH-OD1 2.89Å; Y425-D431 PolarHBondContact OH-OD2 3.02Å; Y425-E439 CarbonylContact O-C 3.59Å; Y425-E439 WeakPolarHBondContact O-CA 3.22Å; Y425-I440 HydrophobicContact CD1-CD1 4.34Å; Y425-I440 PolarHBondContact N-O 3.38Å; Y425-I440 VanDerWaalsContact N-O 3.12Å; Y425-I440 PolarHBondContact O-N 2.03Å
426	T	91.6	Very high	86	Confident	92 Å²	92	53.9 Å²	53.9	56%	0.564	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	120.7	177.1	53.3	0	0	0	0	110.3	G428 K438 E439	T426-G428 PolarHBondContact O-N 2.71Å; T426-K438 WeakPolarHBondContact CA-O 3.5Å; T426-E439 HydrophobicContact CG2-CB 4.11Å; T426-E439 HydrophobicContact CG2-CG 4.11Å
427	F	90	Very high	86.4	Confident	6 Å²	6	56.7 Å²	56.7	3%	0.026	30%	0.299	C	S	.	.			trans	-65.7	124.3	-178.4	-74	-88	0	0	0	112.3	L382 Y385 Y425 D431 L435 G437 K438 I440	L382-F427 HydrophobicContact CD2-CE2 3.6Å; L382-F427 HydrophobicContact CD2-CZ 3.81Å; Y385-F427 HydrophobicContact CD1-CD1 4.14Å; Y385-F427 AromaticContact CD1-CE1 3.44Å; Y385-F427 HydrophobicContact CD1-CE1 3.44Å; Y385-F427 VanDerWaalsContact CD1-CE1 3.44Å; Y385-F427 HydrophobicContact CD1-CZ 4.02Å; Y385-F427 AromaticContact CD2-CE1 3.8Å; Y385-F427 HydrophobicContact CD2-CE1 3.8Å; Y385-F427 HydrophobicContact CD2-CZ 4.28Å; Y385-F427 HydrophobicContact CE1-CD1 4.02Å; Y385-F427 AromaticContact CE1-CE1 3.64Å; Y385-F427 HydrophobicContact CE1-CE1 3.64Å; Y385-F427 HydrophobicContact CE2-CE1 4.01Å; Y385-F427 AromaticContact CG-CE1 3.5Å; Y385-F427 HydrophobicContact CG-CE1 3.5Å; Y385-F427 VanDerWaalsContact CG-CE1 3.5Å; Y385-F427 AromaticContact CG-CZ 3.8Å; Y385-F427 HydrophobicContact CG-CZ 3.8Å; Y385-F427 AromaticContact CZ-CE1 3.93Å; Y425-F427 HydrophobicContact CE1-CD1 4.02Å; Y425-F427 HydrophobicContact CE1-CE1 4.26Å; Y425-F427 HydrophobicContact CE1-CG 4.24Å; F427-D431 HydrophobicContact CB-CB 4.38Å; F427-D431 HydrophobicContact CD1-CB 4.02Å; F427-L435 HydrophobicContact CB-CB 4.4Å; F427-L435 VanDerWaalsContact CB-O 3.29Å; F427-L435 WeakPolarHBondContact CB-O 3.36Å; F427-L435 HydrophobicContact CD1-CB 3.91Å; F427-L435 HydrophobicContact CD1-CD1 4.38Å; F427-L435 HydrophobicContact CD2-CB 4.05Å; F427-L435 HydrophobicContact CE1-CB 4.13Å; F427-L435 HydrophobicContact CE1-CD1 3.76Å; F427-L435 HydrophobicContact CE2-CB 4.27Å; F427-L435 HydrophobicContact CE2-CD1 4.32Å; F427-L435 HydrophobicContact CG-CB 3.87Å; F427-L435 HydrophobicContact CZ-CB 4.3Å; F427-L435 HydrophobicContact CZ-CD1 3.73Å; F427-G437 PolarHBondContact O-N 3.1Å; F427-K438 HydrophobicContact CD2-CB 4.02Å; F427-K438 WeakPolarHBondContact CD2-O 3.23Å; F427-K438 PolarHBondContact N-O 3.05Å; F427-I440 HydrophobicContact CE2-CD1 3.81Å; F427-I440 HydrophobicContact CE2-CG1 3.82Å; F427-I440 HydrophobicContact CZ-CD1 3.84Å; F427-I440 HydrophobicContact CZ-CG1 4.36Å
428	G	87.2	Confident	86.9	Confident	20 Å²	20	59.7 Å²	59.7	21%	0.206	31%	0.311	C	S	.	.			trans	-94.6	-161.9	-170.2	0	0	0	0	0	115.9	T426 D431 R436	T426-G428 PolarHBondContact O-N 2.71Å; G428-D431 PolarHBondContact N-OD2 2.88Å; G428-R436 WeakPolarHBondContact O-CG 3.28Å; G428-R436 PolarHBondContact O-NE 2.99Å
429	P	85.7	Confident	87.2	Confident	96 Å²	96	58.7 Å²	58.7	62%	0.623	31%	0.307	S	S	*	.	S	Bend	trans	-71.8	-35.7	176.2	29.1	-33.4	0	0	0	112.7	D431 R436	P429-D431 VanDerWaalsContact C-N 3.25Å; P429-D431 PolarHBondContact O-N 3.19Å; P429-R436 PolarHBondContact O-NH2 3.3Å
430	D	85.3	Confident	87.7	Confident	90 Å²	90	58.7 Å²	58.7	48%	0.481	31%	0.307	S	S	.	.	S	Bend	trans	-82	0.9	-176.7	-55.2	-58.6	0	0	0	114.1
431	D	87.1	Confident	88	Confident	12 Å²	12	59 Å²	59	6%	0.064	31%	0.309	C	S	.	.	S	Bend	trans	-100.5	170.1	-176.4	-73.8	-51	0	0	0	112.3	Y385 Y425 F427 G428 P429 M433	Y385-D431 WeakPolarHBondContact CE1-OD1 3.48Å; Y385-D431 PolarHBondContact OH-OD1 2.77Å; Y425-D431 PolarHBondContact OH-OD1 2.89Å; Y425-D431 PolarHBondContact OH-OD2 3.02Å; F427-D431 HydrophobicContact CB-CB 4.38Å; F427-D431 HydrophobicContact CD1-CB 4.02Å; G428-D431 PolarHBondContact N-OD2 2.88Å; P429-D431 VanDerWaalsContact C-N 3.25Å; P429-D431 PolarHBondContact O-N 3.19Å; D431-M433 PolarHBondContact O-N 3.15Å
432	P	88.8	Confident	88.2	Confident	4 Å²	4	55 Å²	55	3%	0.026	29%	0.291	C	S	.	.			trans	-44	122	172.8	-34.2	38.6	0	0	0	113.6	W76 I80 Y385 S434 L435 R436	W76-P432 HydrophobicContact CH2-CB 3.72Å; W76-P432 HydrophobicContact CH2-CG 3.77Å; W76-P432 HydrophobicContact CZ2-CG 4.43Å; W76-P432 HydrophobicContact CZ3-CB 4.21Å; W76-P432 HydrophobicContact CZ3-CG 3.93Å; I80-P432 HydrophobicContact CD1-CG 3.9Å; Y385-P432 HydrophobicContact CE2-CG 4.44Å; Y385-P432 VanDerWaalsContact OH-CD 3.23Å; Y385-P432 WeakPolarHBondContact OH-CD 3.28Å; P432-S434 PolarHBondContact O-N 2.83Å; P432-L435 HydrophobicContact CB-CB 4.38Å; P432-L435 HydrophobicContact CB-CD1 4.35Å; P432-L435 HydrophobicContact CB-CG 4.31Å; P432-L435 PolarHBondContact O-N 2.91Å; P432-R436 PolarHBondContact O-N 2.86Å; P432-R436 VanDerWaalsContact O-N 3.15Å
433	M	87.9	Confident	88.2	Confident	121 Å²	121	50.8 Å²	50.8	60%	0.596	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-62.4	-34.7	-176.1	-57.4	-168.1	-67	0	0	111.1	D319 D431 L435 R436	D319-M433 WeakPolarHBondContact OD1-CE 3.28Å; D319-M433 PolarHBondContact OD2-N 2.93Å; D431-M433 PolarHBondContact O-N 3.15Å; M433-L435 PolarHBondContact O-N 2.82Å; M433-R436 PolarHBondContact O-N 3.47Å
434	S	85.4	Confident	88.1	Confident	28 Å²	28	59 Å²	59	20%	0.196	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-58.8	-20.3	173.6	-53.5	0	0	0	0	114.5	K316 D319 P432	K316-S434 PolarHBondContact O-OG 3.24Å; D319-S434 WeakPolarHBondContact OD2-CB 3.44Å; D319-S434 PolarHBondContact OD2-N 2.75Å; D319-S434 PolarHBondContact OD2-OG 3.19Å; P432-S434 PolarHBondContact O-N 2.83Å
435	L	88.1	Confident	87.8	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-115.9	-8.9	-178	-58.8	-179.2	0	0	0	114	M317 E378 V381 L382 F427 P432 M433 G437 K438	M317-L435 HydrophobicContact CE-CD1 4.26Å; M317-L435 HydrophobicContact CE-CG 4.38Å; M317-L435 HydrophobicContact SD-CD2 3.86Å; M317-L435 HydrophobicContact SD-CG 4.08Å; E378-L435 HydrophobicContact CG-CD2 4.16Å; V381-L435 HydrophobicContact CB-CD1 4.38Å; V381-L435 HydrophobicContact CG1-CD1 3.52Å; L382-L435 HydrophobicContact CD2-CD1 4.42Å; F427-L435 HydrophobicContact CB-CB 4.4Å; F427-L435 VanDerWaalsContact CB-O 3.29Å; F427-L435 WeakPolarHBondContact CB-O 3.36Å; F427-L435 HydrophobicContact CD1-CB 3.91Å; F427-L435 HydrophobicContact CD1-CD1 4.38Å; F427-L435 HydrophobicContact CD2-CB 4.05Å; F427-L435 HydrophobicContact CE1-CB 4.13Å; F427-L435 HydrophobicContact CE1-CD1 3.76Å; F427-L435 HydrophobicContact CE2-CB 4.27Å; F427-L435 HydrophobicContact CE2-CD1 4.32Å; F427-L435 HydrophobicContact CG-CB 3.87Å; F427-L435 HydrophobicContact CZ-CB 4.3Å; F427-L435 HydrophobicContact CZ-CD1 3.73Å; P432-L435 HydrophobicContact CB-CB 4.38Å; P432-L435 HydrophobicContact CB-CD1 4.35Å; P432-L435 HydrophobicContact CB-CG 4.31Å; P432-L435 PolarHBondContact O-N 2.91Å; M433-L435 PolarHBondContact O-N 2.82Å; L435-G437 PolarHBondContact O-N 3.02Å; L435-K438 HydrophobicContact CD2-CD 3.91Å; L435-K438 VanDerWaalsContact O-CB 3.31Å; L435-K438 WeakPolarHBondContact O-CB 3.38Å; L435-K438 PolarHBondContact O-N 3.04Å
436	R	86.8	Confident	87.6	Confident	127 Å²	127	52.8 Å²	52.8	48%	0.479	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	126.1	-176.2	-177.6	177	-66.9	155	-2.3	112.1	G428 P429 P432 M433	G428-R436 WeakPolarHBondContact O-CG 3.28Å; G428-R436 PolarHBondContact O-NE 2.99Å; P429-R436 PolarHBondContact O-NH2 3.3Å; P432-R436 PolarHBondContact O-N 2.86Å; P432-R436 VanDerWaalsContact O-N 3.15Å; M433-R436 PolarHBondContact O-N 3.47Å
437	G	85.1	Confident	87.5	Confident	66 Å²	66	48.4 Å²	48.4	68%	0.68	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-6	-178.7	0	0	0	0	0	116.1	F427 L435	F427-G437 PolarHBondContact O-N 3.1Å; L435-G437 PolarHBondContact O-N 3.02Å
438	K	86.9	Confident	87.5	Confident	75 Å²	75	48.6 Å²	48.6	33%	0.326	27%	0.265	S	S	.	.			trans	-70.7	152.9	166.5	-70	177.4	174.6	171.6	0	110.5	S315 E378 T426 F427 L435	S315-K438 PolarHBondContact OG-NZ 3.36Å; E378-K438 IonicContact OE1-NZ 3.29Å; E378-K438 PolarHBondContact OE1-NZ 3.01Å; E378-K438 IonicContact OE2-NZ 3.45Å; T426-K438 WeakPolarHBondContact CA-O 3.5Å; F427-K438 HydrophobicContact CD2-CB 4.02Å; F427-K438 WeakPolarHBondContact CD2-O 3.23Å; F427-K438 PolarHBondContact N-O 3.05Å; L435-K438 HydrophobicContact CD2-CD 3.91Å; L435-K438 VanDerWaalsContact O-CB 3.31Å; L435-K438 WeakPolarHBondContact O-CB 3.38Å; L435-K438 PolarHBondContact O-N 3.04Å
439	E	88.8	Confident	87.6	Confident	76 Å²	76	50.8 Å²	50.8	36%	0.355	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	134.8	172.5	-178.3	174.7	-163.2	0	0	111.2	R424 Y425 T426 N450	R424-E439 WeakPolarHBondContact CD-OE1 3.28Å; Y425-E439 CarbonylContact O-C 3.59Å; Y425-E439 WeakPolarHBondContact O-CA 3.22Å; T426-E439 HydrophobicContact CG2-CB 4.11Å; T426-E439 HydrophobicContact CG2-CG 4.11Å; E439-N450 PolarHBondContact O-ND2 3.42Å
440	I	91	Very high	87.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	120.8	167.2	-57.6	175.9	0	0	0	108.3	L382 A386 R424 Y425 F427 F442 L448	L382-I440 HydrophobicContact CD2-CD1 4.35Å; L382-I440 HydrophobicContact CD2-CG1 4.15Å; A386-I440 HydrophobicContact CB-CG2 3.93Å; R424-I440 VanDerWaalsContact CA-O 3.3Å; R424-I440 WeakPolarHBondContact CA-O 3.42Å; Y425-I440 HydrophobicContact CD1-CD1 4.34Å; Y425-I440 PolarHBondContact N-O 3.38Å; Y425-I440 VanDerWaalsContact N-O 3.12Å; Y425-I440 PolarHBondContact O-N 2.03Å; F427-I440 HydrophobicContact CE2-CD1 3.81Å; F427-I440 HydrophobicContact CE2-CG1 3.82Å; F427-I440 HydrophobicContact CZ-CD1 3.84Å; F427-I440 HydrophobicContact CZ-CG1 4.36Å; I440-F442 HydrophobicContact CG2-CE2 4.32Å; I440-L448 HydrophobicContact CB-CD1 4.46Å; I440-L448 HydrophobicContact CG2-CD1 3.97Å
441	S	91.5	Very high	87.8	Confident	6 Å²	6	45.5 Å²	45.5	4%	0.042	24%	0.236	C	C	.	.			trans	-151.7	148.5	170.5	-176.8	0	0	0	0	108.6	L448 E449	S441-L448 WeakPolarHBondContact O-CA 3.29Å; S441-E449 WeakPolarHBondContact CB-OE2 3.27Å; S441-E449 PolarHBondContact O-N 2.89Å; S441-E449 PolarHBondContact OG-OE2 2.86Å
442	F	89.8	Confident	87.8	Confident	14 Å²	14	48.5 Å²	48.5	6%	0.061	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-113.4	136.2	-175.8	-67.8	-77.5	0	0	0	112.1	L160 F179 T181 A386 L420 I440	L160-F442 HydrophobicContact CD2-CZ 4.16Å; F179-F442 HydrophobicContact CB-CE1 4.33Å; F179-F442 HydrophobicContact CD1-CD1 4.06Å; F179-F442 HydrophobicContact CD1-CD2 4.06Å; F179-F442 HydrophobicContact CD1-CE1 4.27Å; F179-F442 HydrophobicContact CD1-CE2 4.26Å; F179-F442 AromaticContact CD1-CG 3.97Å; F179-F442 HydrophobicContact CD1-CG 3.97Å; F179-F442 HydrophobicContact CD1-CZ 4.37Å; F179-F442 HydrophobicContact CE1-CD2 4.42Å; F179-F442 HydrophobicContact CE1-CG 4.47Å; T181-F442 HydrophobicContact CG2-CE1 4.27Å; T181-F442 HydrophobicContact CG2-CZ 4.39Å; A386-F442 HydrophobicContact CB-CE2 3.95Å; A386-F442 HydrophobicContact CB-CZ 3.87Å; L420-F442 HydrophobicContact CD1-CE2 4.14Å; I440-F442 HydrophobicContact CG2-CE2 4.32Å
443	D	86.8	Confident	87.9	Confident	21 Å²	21	48.4 Å²	48.4	11%	0.112	25%	0.249	C	C	.	.			trans	-71.8	173.9	178.6	71.8	11.3	0	0	0	112.6	R445 L446 V447 E449 K476	D443-R445 PolarHBondContact O-N 2.87Å; D443-R445 VanDerWaalsContact O-N 3.09Å; D443-R445 VanDerWaalsContact OD1-C 3.28Å; D443-R445 WeakPolarHBondContact OD1-CA 3.27Å; D443-R445 WeakPolarHBondContact OD1-CB 3.44Å; D443-R445 PolarHBondContact OD1-N 3.07Å; D443-R445 IonicContact OD2-NE 3.95Å; D443-L446 WeakPolarHBondContact O-CA 3.21Å; D443-L446 PolarHBondContact O-N 3.35Å; D443-L446 PolarHBondContact OD1-N 3.33Å; D443-V447 PolarHBondContact N-O 3.17Å; D443-V447 PolarHBondContact OD1-N 2.76Å; D443-E449 HydrophobicContact CB-CG 3.89Å; D443-K476 VanDerWaalsContact OD2-CE 3.25Å; D443-K476 WeakPolarHBondContact OD2-CE 3.38Å; D443-K476 IonicContact OD2-NZ 3.67Å; D443-K476 PolarHBondContact OD2-NZ 3.45Å
444	N	85.2	Confident	88.1	Confident	175 Å²	175	44.1 Å²	44.1	94%	0.936	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-15.1	173.9	-74.6	-22.6	0	0	0	114.4
445	R	83.2	Confident	88.3	Confident	63 Å²	63	42.8 Å²	42.8	24%	0.238	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-11.3	170.7	-59.7	-170.4	-78.5	-140.2	-6.5	111.7	K170 E186 D187 E190 D443 V447	K170-R445 WeakPolarHBondContact CE-O 3.38Å; K170-R445 PolarHBondContact NZ-O 2.93Å; E186-R445 VanDerWaalsContact OE2-CD 3.26Å; E186-R445 WeakPolarHBondContact OE2-CD 3.35Å; E186-R445 IonicContact OE2-CZ 3.68Å; E186-R445 IonicContact OE2-NE 3.84Å; E186-R445 IonicContact OE2-NH1 2.69Å; E186-R445 PolarHBondContact OE2-NH1 2.94Å; D187-R445 IonicContact OD1-CZ 2.75Å; D187-R445 IonicContact OD1-NH2 3.75Å; D187-R445 PolarHBondContact OD1-NH2 2.84Å; E190-R445 IonicContact OE1-CZ 2.77Å; E190-R445 IonicContact OE1-NH1 2.68Å; E190-R445 PolarHBondContact OE1-NH1 3.5Å; E190-R445 IonicContact OE1-NH2 3.18Å; E190-R445 PolarHBondContact OE1-NH2 3.5Å; E190-R445 IonicContact OE2-CZ 3.66Å; E190-R445 IonicContact OE2-NH1 2.69Å; E190-R445 IonicContact OE2-NH2 2.77Å; E190-R445 PolarHBondContact OE2-NH2 3Å; D443-R445 PolarHBondContact O-N 2.87Å; D443-R445 VanDerWaalsContact O-N 3.09Å; D443-R445 VanDerWaalsContact OD1-C 3.28Å; D443-R445 WeakPolarHBondContact OD1-CA 3.27Å; D443-R445 WeakPolarHBondContact OD1-CB 3.44Å; D443-R445 PolarHBondContact OD1-N 3.07Å; D443-R445 IonicContact OD2-NE 3.95Å; R445-V447 HydrophobicContact CB-CG2 4.11Å
446	L	87.5	Confident	88.3	Confident	16 Å²	16	45.7 Å²	45.7	8%	0.084	23%	0.229	C	C	.	.	S	Bend	trans	70.3	42.2	-167.9	-34.8	179.9	0	0	0	112.6	K170 N176 F179 S180 K421 D443	K170-L446 VanDerWaalsContact NZ-C 3.29Å; K170-L446 PolarHBondContact NZ-O 3.19Å; N176-L446 VanDerWaalsContact O-CD1 3.25Å; N176-L446 WeakPolarHBondContact O-CD1 3.49Å; F179-L446 CarbonylContact C-O 3.6Å; F179-L446 VanDerWaalsContact CA-O 3.3Å; F179-L446 WeakPolarHBondContact CA-O 3.17Å; F179-L446 HydrophobicContact CD1-CB 3.75Å; F179-L446 HydrophobicContact CD2-CD1 4.36Å; F179-L446 HydrophobicContact CE1-CB 3.96Å; F179-L446 HydrophobicContact CE1-CD1 4.24Å; F179-L446 HydrophobicContact CE1-CD2 3.99Å; F179-L446 HydrophobicContact CE1-CG 4.29Å; F179-L446 HydrophobicContact CE2-CD1 3.96Å; F179-L446 HydrophobicContact CG-CB 4.06Å; F179-L446 HydrophobicContact CZ-CB 4.45Å; F179-L446 HydrophobicContact CZ-CD1 3.9Å; F179-L446 HydrophobicContact CZ-CD2 4.22Å; F179-L446 HydrophobicContact CZ-CG 4.43Å; S180-L446 PolarHBondContact N-O 3.37Å; K421-L446 HydrophobicContact CD-CD2 3.9Å; K421-L446 HydrophobicContact CG-CD2 3.68Å; D443-L446 WeakPolarHBondContact O-CA 3.21Å; D443-L446 PolarHBondContact O-N 3.35Å; D443-L446 PolarHBondContact OD1-N 3.33Å
447	V	89.1	Confident	88.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-120.4	143.6	171.4	-172.3	0	0	0	0	108.1	K170 S180 T184 D443 R445 E449 I451	K170-V447 HydrophobicContact CD-CG2 3.97Å; K170-V447 VanDerWaalsContact CE-CG2 3.4Å; S180-V447 CarbonylContact O-C 3.59Å; S180-V447 WeakPolarHBondContact O-CA 3.49Å; T184-V447 HydrophobicContact CG2-CG1 4.46Å; T184-V447 HydrophobicContact CG2-CG2 3.67Å; D443-V447 PolarHBondContact N-O 3.17Å; D443-V447 PolarHBondContact OD1-N 2.76Å; R445-V447 HydrophobicContact CB-CG2 4.11Å; V447-E449 PolarHBondContact O-N 3.34Å; V447-I451 HydrophobicContact CG1-CD1 3.66Å
448	L	91.1	Very high	88.3	Confident	9 Å²	9	37.4 Å²	37.4	5%	0.047	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-49.7	134.7	177	-172.8	78.3	0	0	0	111.2	S180 L382 I440 S441 I451 K476	S180-L448 PolarHBondContact O-N 2.94Å; L382-L448 HydrophobicContact CD1-CD2 3.96Å; I440-L448 HydrophobicContact CB-CD1 4.46Å; I440-L448 HydrophobicContact CG2-CD1 3.97Å; S441-L448 WeakPolarHBondContact O-CA 3.29Å; L448-I451 HydrophobicContact CB-CD1 4.05Å; L448-I451 HydrophobicContact CB-CG1 3.88Å; L448-I451 HydrophobicContact CD2-CG1 4.01Å; L448-I451 HydrophobicContact CG-CG1 4.25Å; L448-I451 WeakPolarHBondContact O-CD1 3.45Å; L448-I451 WeakPolarHBondContact O-CG1 3.17Å; L448-K476 PolarHBondContact O-NZ 3.35Å
449	E	88.1	Confident	87.9	Confident	66 Å²	66	34.3 Å²	34.3	31%	0.308	17%	0.168	S	C	.	.	S	Bend	trans	-75.3	-44.7	-177.4	-67.9	-172.4	122	0	0	111.6	S441 D443 V447 I451 K476 S477	S441-E449 WeakPolarHBondContact CB-OE2 3.27Å; S441-E449 PolarHBondContact O-N 2.89Å; S441-E449 PolarHBondContact OG-OE2 2.86Å; D443-E449 HydrophobicContact CB-CG 3.89Å; V447-E449 PolarHBondContact O-N 3.34Å; E449-I451 PolarHBondContact O-N 2.6Å; E449-K476 WeakPolarHBondContact O-CB 3.5Å; E449-S477 PolarHBondContact O-N 3.03Å
450	N	86.5	Confident	87.3	Confident	63 Å²	63	31.8 Å²	31.8	34%	0.337	16%	0.158	S	C	.	.	S	Bend	trans	-83.4	36.4	-173.4	-62.9	-30.6	0	0	0	113.5	E439 S477	E439-N450 PolarHBondContact O-ND2 3.42Å; N450-S477 WeakPolarHBondContact OD1-CB 3.47Å
451	I	88.2	Confident	86.3	Confident	12 Å²	12	33.2 Å²	33.2	6%	0.062	17%	0.165	C	C	.	.			trans	-78.7	127.9	173.8	-62.6	175.8	0	0	0	109.3	P183 V447 L448 E449 I453 K476	P183-I451 HydrophobicContact CB-CD1 4.44Å; P183-I451 HydrophobicContact CB-CG2 4.22Å; P183-I451 HydrophobicContact CG-CG2 4.47Å; V447-I451 HydrophobicContact CG1-CD1 3.66Å; L448-I451 HydrophobicContact CB-CD1 4.05Å; L448-I451 HydrophobicContact CB-CG1 3.88Å; L448-I451 HydrophobicContact CD2-CG1 4.01Å; L448-I451 HydrophobicContact CG-CG1 4.25Å; L448-I451 WeakPolarHBondContact O-CD1 3.45Å; L448-I451 WeakPolarHBondContact O-CG1 3.17Å; E449-I451 PolarHBondContact O-N 2.6Å; I451-I453 HydrophobicContact CG2-CD1 4.47Å; I451-I453 HydrophobicContact CG2-CG1 4.1Å; I451-K476 HydrophobicContact CB-CB 4.44Å; I451-K476 HydrophobicContact CB-CD 4.22Å; I451-K476 WeakPolarHBondContact O-CB 3.33Å; I451-K476 PolarHBondContact O-N 3.37Å
452	Q	89.1	Confident	85.3	Confident	76 Å²	76	37 Å²	37	36%	0.355	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	137.5	171.3	-68.6	178.3	-12.7	0	0	109.8	M313 Y474 D475	M313-Q452 HydrophobicContact CB-CB 3.94Å; M313-Q452 PolarHBondContact N-O 2.68Å; M313-Q452 HydrophobicContact SD-CB 4.17Å; M313-Q452 PolarHBondContact SD-OE1 2.9Å; M313-Q452 VanDerWaalsContact SD-OE1 3.36Å; Q452-Y474 CarbonylContact C-O 3.53Å; Q452-Y474 WeakPolarHBondContact CA-O 3.42Å; Q452-D475 HydrophobicContact CG-CB 4.25Å
453	I	90.3	Very high	84.5	Confident	1 Å²	1	44 Å²	44	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	119.3	-179.2	-64.1	171.3	0	0	0	108.2	P183 Y188 V191 L310 I451 Y474	P183-I453 HydrophobicContact CB-CD1 4.07Å; Y188-I453 HydrophobicContact CD1-CD1 4.1Å; Y188-I453 HydrophobicContact CD1-CG2 4.38Å; Y188-I453 HydrophobicContact CE1-CD1 4.11Å; Y188-I453 HydrophobicContact CE1-CG2 4.07Å; V191-I453 HydrophobicContact CG2-CB 4.18Å; V191-I453 HydrophobicContact CG2-CD1 3.67Å; V191-I453 HydrophobicContact CG2-CG1 4.49Å; V191-I453 HydrophobicContact CG2-CG2 4.23Å; L310-I453 HydrophobicContact CB-CG2 4.32Å; I451-I453 HydrophobicContact CG2-CD1 4.47Å; I451-I453 HydrophobicContact CG2-CG1 4.1Å; I453-Y474 PolarHBondContact N-O 3.46Å; I453-Y474 PolarHBondContact O-N 3.4Å
454	E	90.8	Very high	83.6	Confident	32 Å²	32	45.8 Å²	45.8	15%	0.15	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	149.5	176.6	65	173.3	-117.9	0	0	112.3	L310 E311 L470 M472	L310-E454 WeakPolarHBondContact CA-O 3.41Å; E311-E454 PolarHBondContact N-O 3.23Å; E311-E454 PolarHBondContact O-N 3.15Å; E454-L470 HydrophobicContact CB-CD1 3.64Å; E454-L470 VanDerWaalsContact CD-CD1 3.46Å; E454-L470 HydrophobicContact CG-CD1 4.02Å; E454-L470 WeakPolarHBondContact OE1-CD1 3.06Å; E454-M472 WeakPolarHBondContact CA-O 3.4Å
455	G	89.5	Confident	83.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.4	173.2	0	0	0	0	0	110.6	L309 V471 M472	L309-G455 WeakPolarHBondContact O-CA 3.31Å; G455-V471 WeakPolarHBondContact O-CG2 2.95Å; G455-V471 PolarHBondContact O-N 2.55Å; G455-M472 PolarHBondContact N-O 2.69Å; G455-M472 PolarHBondContact O-N 2.85Å
456	R	88.6	Confident	82.7	Confident	61 Å²	61	45.8 Å²	45.8	23%	0.23	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.2	177.6	-179	171.4	-72.8	-92	-0.5	110.1	L309 M458 D468 K469	L309-R456 PolarHBondContact N-O 2.9Å; L309-R456 PolarHBondContact O-N 3.27Å; R456-M458 VanDerWaalsContact CD-CE 3.49Å; R456-M458 HydrophobicContact CG-CE 3.9Å; R456-D468 WeakPolarHBondContact CD-OD1 3.41Å; R456-D468 WeakPolarHBondContact CG-OD1 3.13Å; R456-D468 IonicContact CZ-OD1 3.79Å; R456-D468 IonicContact NE-OD1 3.01Å; R456-D468 IonicContact NH1-OD1 3.71Å; R456-D468 PolarHBondContact NH1-OD1 2.65Å; R456-D468 IonicContact NH1-OD2 2.96Å; R456-K469 CarbonylContact C-O 3.58Å; R456-K469 VanDerWaalsContact CA-O 3.3Å; R456-K469 WeakPolarHBondContact CA-O 3.28Å
457	L	87.7	Confident	82.2	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.073	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	120.7	178.9	-172.5	68.1	0	0	0	110.2	L279 L307 L308 D468 K469 V471 L487	L279-L457 HydrophobicContact CD1-CD1 4.38Å; L307-L457 WeakPolarHBondContact O-CA 3.43Å; L308-L457 HydrophobicContact CB-CD1 4.29Å; L308-L457 HydrophobicContact CD1-CB 4.43Å; L457-D468 WeakPolarHBondContact O-CA 3.27Å; L457-K469 PolarHBondContact N-O 3.12Å; L457-K469 PolarHBondContact O-N 3.02Å; L457-V471 HydrophobicContact CB-CB 4.36Å; L457-V471 HydrophobicContact CB-CG1 3.6Å; L457-V471 HydrophobicContact CB-CG2 3.78Å; L457-V471 HydrophobicContact CD2-CG1 4.15Å; L457-L487 HydrophobicContact CD1-CD2 4.02Å; L457-L487 HydrophobicContact CD2-CD2 4.08Å
458	M	84.4	Confident	81.8	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.025	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	140.8	173	-63.2	177.1	-171.5	0	0	110.1	R295 M299 L307 R456 I467	R295-M458 HydrophobicContact CB-SD 4.43Å; R295-M458 HydrophobicContact CG-CE 3.83Å; R295-M458 HydrophobicContact CG-SD 4.06Å; M299-M458 HydrophobicContact SD-CB 4.13Å; M299-M458 HydrophobicContact SD-CG 4.44Å; L307-M458 HydrophobicContact CB-CB 4.43Å; L307-M458 PolarHBondContact N-O 3.05Å; L307-M458 PolarHBondContact O-N 3.32Å; R456-M458 VanDerWaalsContact CD-CE 3.49Å; R456-M458 HydrophobicContact CG-CE 3.9Å; M458-I467 CarbonylContact C-O 3.52Å; M458-I467 VanDerWaalsContact CA-O 3.25Å; M458-I467 WeakPolarHBondContact CA-O 3.41Å
459	G	79.1	Confident	81.6	Confident	10 Å²	10	54.5 Å²	54.5	10%	0.103	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.8	-160.1	176.4	0	0	0	0	0	113.8	I467	G459-I467 PolarHBondContact N-O 2.7Å; G459-I467 PolarHBondContact O-N 3.06Å
460	T	75.3	Confident	81.5	Confident	24 Å²	24	55 Å²	55	15%	0.147	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.8	174.4	61.6	0	0	0	0	111.2	G303 R465	G303-T460 PolarHBondContact O-OG1 2.95Å; T460-R465 WeakPolarHBondContact CA-O 3.5Å
461	D	71.3	Confident	81.7	Confident	29 Å²	29	52 Å²	52	16%	0.155	27%	0.272	C	S	.	.			trans	-80.2	170	171.5	91.7	-19.5	0	0	0	111.7	K463 G464 R465 I467	D461-K463 PolarHBondContact O-N 2.73Å; D461-K463 VanDerWaalsContact OD1-C 3.27Å; D461-K463 VanDerWaalsContact OD1-CA 3.25Å; D461-K463 WeakPolarHBondContact OD1-CA 3.22Å; D461-K463 WeakPolarHBondContact OD1-CB 3.31Å; D461-K463 PolarHBondContact OD1-N 2.77Å; D461-G464 PolarHBondContact O-N 3.18Å; D461-G464 PolarHBondContact OD1-N 3.36Å; D461-R465 PolarHBondContact N-O 3Å; D461-R465 WeakPolarHBondContact OD1-CB 3.43Å; D461-R465 PolarHBondContact OD1-N 2.71Å; D461-R465 IonicContact OD1-NE 2.91Å; D461-R465 IonicContact OD2-CZ 2.7Å; D461-R465 IonicContact OD2-NE 2.73Å; D461-R465 PolarHBondContact OD2-NE 3.11Å; D461-R465 IonicContact OD2-NH2 3.94Å; D461-R465 PolarHBondContact OD2-NH2 3.04Å; D461-I467 HydrophobicContact CB-CD1 3.91Å; D461-I467 HydrophobicContact CB-CG1 4.19Å
462	S	69.8	Low	81.8	Confident	87 Å²	87	51.5 Å²	51.5	61%	0.608	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	2.9	179.1	57.7	0	0	0	0	115	P490	S462-P490 WeakPolarHBondContact CA-O 3.27Å; S462-P490 WeakPolarHBondContact CB-O 3.4Å; S462-P490 PolarHBondContact N-O 3.15Å
463	K	72.1	Confident	82	Confident	161 Å²	161	50 Å²	50	70%	0.7	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	11.5	171.8	-54.1	-176.9	-180	-176.6	0	112	D461 R465	D461-K463 PolarHBondContact O-N 2.73Å; D461-K463 VanDerWaalsContact OD1-C 3.27Å; D461-K463 VanDerWaalsContact OD1-CA 3.25Å; D461-K463 WeakPolarHBondContact OD1-CA 3.22Å; D461-K463 WeakPolarHBondContact OD1-CB 3.31Å; D461-K463 PolarHBondContact OD1-N 2.77Å; K463-R465 VanDerWaalsContact C-N 3.26Å; K463-R465 HydrophobicContact CB-CG 4.32Å; K463-R465 PolarHBondContact O-N 3.06Å
464	G	69.2	Low	82.1	Confident	58 Å²	58	50.3 Å²	50.3	60%	0.598	27%	0.265	S	S	*	.	S	Bend	trans	72.7	12.3	-178.2	0	0	0	0	0	114.4	D461	D461-G464 PolarHBondContact O-N 3.18Å; D461-G464 PolarHBondContact OD1-N 3.36Å
465	R	74.1	Confident	82	Confident	151 Å²	151	50 Å²	50	57%	0.57	26%	0.264	S	S	*	.			trans	-84.2	132.7	179.9	-57.5	179.7	-63.6	165.8	5.3	109.7	T460 D461 K463 I467	T460-R465 WeakPolarHBondContact CA-O 3.5Å; D461-R465 PolarHBondContact N-O 3Å; D461-R465 WeakPolarHBondContact OD1-CB 3.43Å; D461-R465 PolarHBondContact OD1-N 2.71Å; D461-R465 IonicContact OD1-NE 2.91Å; D461-R465 IonicContact OD2-CZ 2.7Å; D461-R465 IonicContact OD2-NE 2.73Å; D461-R465 PolarHBondContact OD2-NE 3.11Å; D461-R465 IonicContact OD2-NH2 3.94Å; D461-R465 PolarHBondContact OD2-NH2 3.04Å; K463-R465 VanDerWaalsContact C-N 3.26Å; K463-R465 HydrophobicContact CB-CG 4.32Å; K463-R465 PolarHBondContact O-N 3.06Å; R465-I467 PolarHBondContact O-N 2.93Å
466	V	74.5	Confident	82	Confident	87 Å²	87	50.7 Å²	50.7	53%	0.527	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	128.1	178.2	-179.9	0	0	0	0	110	M299	M299-V466 HydrophobicContact CB-CG1 3.95Å; M299-V466 HydrophobicContact CE-CG1 3.45Å; M299-V466 VanDerWaalsContact CE-CG1 3.45Å; M299-V466 HydrophobicContact CG-CG1 4.18Å; M299-V466 HydrophobicContact SD-CG1 3.3Å; M299-V466 WeakPolarHBondContact SD-CG1 3.49Å
467	I	77.1	Confident	81.8	Confident	47 Å²	47	50.6 Å²	50.6	24%	0.241	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.8	171.8	-53.6	176.2	0	0	0	107.6	M299 M458 G459 D461 R465 K469	M299-I467 VanDerWaalsContact SD-O 3.41Å; M458-I467 CarbonylContact C-O 3.52Å; M458-I467 VanDerWaalsContact CA-O 3.25Å; M458-I467 WeakPolarHBondContact CA-O 3.41Å; G459-I467 PolarHBondContact N-O 2.7Å; G459-I467 PolarHBondContact O-N 3.06Å; D461-I467 HydrophobicContact CB-CD1 3.91Å; D461-I467 HydrophobicContact CB-CG1 4.19Å; R465-I467 PolarHBondContact O-N 2.93Å; I467-K469 HydrophobicContact CG2-CB 4.11Å; I467-K469 HydrophobicContact CG2-CD 4.08Å; I467-K469 HydrophobicContact CG2-CG 3.96Å
468	D	81.8	Confident	81.7	Confident	59 Å²	59	54.4 Å²	54.4	32%	0.316	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	113	153.9	-179.3	-7.9	0	0	0	106.8	M299 R456 L457	M299-D468 HydrophobicContact CE-CB 4.09Å; M299-D468 HydrophobicContact SD-CB 4.42Å; R456-D468 WeakPolarHBondContact CD-OD1 3.41Å; R456-D468 WeakPolarHBondContact CG-OD1 3.13Å; R456-D468 IonicContact CZ-OD1 3.79Å; R456-D468 IonicContact NE-OD1 3.01Å; R456-D468 IonicContact NH1-OD1 3.71Å; R456-D468 PolarHBondContact NH1-OD1 2.65Å; R456-D468 IonicContact NH1-OD2 2.96Å; L457-D468 WeakPolarHBondContact O-CA 3.27Å
469	K	85.7	Confident	81.8	Confident	101 Å²	101	61.1 Å²	61.1	44%	0.439	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	145	-172.3	-81.3	-172.6	162.9	-164.2	0	113.3	R456 L457 I467 V471 D485	R456-K469 CarbonylContact C-O 3.58Å; R456-K469 VanDerWaalsContact CA-O 3.3Å; R456-K469 WeakPolarHBondContact CA-O 3.28Å; L457-K469 PolarHBondContact N-O 3.12Å; L457-K469 PolarHBondContact O-N 3.02Å; I467-K469 HydrophobicContact CG2-CB 4.11Å; I467-K469 HydrophobicContact CG2-CD 4.08Å; I467-K469 HydrophobicContact CG2-CG 3.96Å; K469-V471 HydrophobicContact CB-CG1 3.95Å; K469-V471 PolarHBondContact O-N 2.84Å; K469-D485 VanDerWaalsContact CD-OD2 3.3Å; K469-D485 WeakPolarHBondContact CD-OD2 3.47Å; K469-D485 IonicContact NZ-OD1 3.7Å; K469-D485 IonicContact NZ-OD2 3.84Å; K469-D485 PolarHBondContact NZ-OD2 2.83Å
470	L	86.9	Confident	82.1	Confident	77 Å²	77	63.1 Å²	63.1	40%	0.403	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	100.1	166.4	-173.7	70.9	0	0	0	110.3	E454 N484	E454-L470 HydrophobicContact CB-CD1 3.64Å; E454-L470 VanDerWaalsContact CD-CD1 3.46Å; E454-L470 HydrophobicContact CG-CD1 4.02Å; E454-L470 WeakPolarHBondContact OE1-CD1 3.06Å; L470-N484 PolarHBondContact O-ND2 3.27Å
471	V	89.9	Confident	82.8	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.006	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	-17.9	-172.1	-59.8	0	0	0	0	114.1	L308 G455 L457 K469 L483 N484 D485 L487	L308-V471 HydrophobicContact CD1-CG2 3.58Å; G455-V471 WeakPolarHBondContact O-CG2 2.95Å; G455-V471 PolarHBondContact O-N 2.55Å; L457-V471 HydrophobicContact CB-CB 4.36Å; L457-V471 HydrophobicContact CB-CG1 3.6Å; L457-V471 HydrophobicContact CB-CG2 3.78Å; L457-V471 HydrophobicContact CD2-CG1 4.15Å; K469-V471 HydrophobicContact CB-CG1 3.95Å; K469-V471 PolarHBondContact O-N 2.84Å; V471-L483 CarbonylContact O-C 3.56Å; V471-L483 WeakPolarHBondContact O-CA 3.45Å; V471-L483 WeakPolarHBondContact O-CD1 3.47Å; V471-N484 PolarHBondContact O-N 3.37Å; V471-D485 HydrophobicContact CB-CB 4.42Å; V471-D485 HydrophobicContact CG1-CB 4.05Å; V471-L487 HydrophobicContact CG2-CD2 3.9Å
472	M	91	Very high	83.7	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	144	-173.8	-169.7	-167.8	79.2	0	0	111.1	V191 L195 L310 E454 G455 L481 S482 L483	V191-M472 HydrophobicContact CG1-CE 3.45Å; V191-M472 VanDerWaalsContact CG1-CE 3.45Å; V191-M472 HydrophobicContact CG1-SD 4.23Å; L195-M472 HydrophobicContact CD1-SD 3.89Å; L195-M472 HydrophobicContact CD2-SD 4.12Å; L195-M472 HydrophobicContact CG-SD 4.41Å; L310-M472 HydrophobicContact CD2-CE 3.61Å; E454-M472 WeakPolarHBondContact CA-O 3.4Å; G455-M472 PolarHBondContact N-O 2.69Å; G455-M472 PolarHBondContact O-N 2.85Å; M472-L481 HydrophobicContact CG-CD1 4.33Å; M472-L481 HydrophobicContact CG-CD2 4.12Å; M472-L481 HydrophobicContact CG-CG 4.08Å; M472-L481 HydrophobicContact SD-CD1 3.74Å; M472-L481 HydrophobicContact SD-CD2 4.37Å; M472-L481 HydrophobicContact SD-CG 4.16Å; M472-S482 WeakPolarHBondContact CA-O 3.35Å; M472-S482 WeakPolarHBondContact CG-O 3.18Å; M472-L483 HydrophobicContact CB-CD1 3.92Å; M472-L483 HydrophobicContact CG-CD1 4.04Å
473	N	91.9	Very high	84.5	Confident	45 Å²	45	62.8 Å²	62.8	24%	0.241	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	126.5	162.9	-175.8	6.7	0	0	0	109.3	S482	N473-S482 PolarHBondContact N-O 3.44Å; N473-S482 PolarHBondContact O-N 3.19Å; N473-S482 PolarHBondContact O-OG 2.91Å
474	Y	92.7	Very high	85.1	Confident	7 Å²	7	60 Å²	60	3%	0.027	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	123.1	174.7	174.7	-92.2	0	0	0	110	V191 A194 Q452 I453 K476 A480 L481	V191-Y474 HydrophobicContact CG1-CG 4.48Å; V191-Y474 HydrophobicContact CG2-CD1 3.52Å; V191-Y474 HydrophobicContact CG2-CD2 4.42Å; V191-Y474 HydrophobicContact CG2-CE1 3.88Å; V191-Y474 HydrophobicContact CG2-CG 3.79Å; A194-Y474 HydrophobicContact CB-CE2 4.35Å; Q452-Y474 CarbonylContact C-O 3.53Å; Q452-Y474 WeakPolarHBondContact CA-O 3.42Å; I453-Y474 PolarHBondContact N-O 3.46Å; I453-Y474 PolarHBondContact O-N 3.4Å; Y474-K476 HydrophobicContact CE1-CB 4.01Å; Y474-A480 WeakPolarHBondContact CA-O 3.47Å; Y474-L481 HydrophobicContact CD2-CB 4.04Å; Y474-L481 HydrophobicContact CD2-CD1 4.3Å
475	D	90.3	Very high	85.7	Confident	26 Å²	26	60.1 Å²	60.1	14%	0.139	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	119.2	170.5	164.8	32.4	0	0	0	109.9	Q452 S477 T478 K479 A480	Q452-D475 HydrophobicContact CG-CB 4.25Å; D475-S477 VanDerWaalsContact C-N 3.31Å; D475-S477 PolarHBondContact O-N 2.97Å; D475-S477 WeakPolarHBondContact OD1-CB 3.14Å; D475-S477 PolarHBondContact OD1-N 3.22Å; D475-S477 PolarHBondContact OD1-OG 3.24Å; D475-S477 PolarHBondContact OD2-OG 3.38Å; D475-T478 WeakPolarHBondContact OD2-CB 3.5Å; D475-T478 VanDerWaalsContact OD2-CG2 3.24Å; D475-T478 WeakPolarHBondContact OD2-CG2 3.22Å; D475-T478 PolarHBondContact OD2-N 2.74Å; D475-T478 PolarHBondContact OD2-OG1 3.32Å; D475-K479 CarbonylContact O-C 3.56Å; D475-K479 WeakPolarHBondContact O-CA 3.48Å; D475-K479 PolarHBondContact O-N 3.05Å; D475-A480 PolarHBondContact N-O 3.42Å; D475-A480 VanDerWaalsContact N-O 3.15Å; D475-A480 PolarHBondContact O-N 3.43Å
476	K	88.6	Confident	85.9	Confident	14 Å²	14	57 Å²	57	6%	0.061	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-30.9	179.8	177.7	-178.4	169.6	178.1	0	113	D187 D443 L448 E449 I451 Y474 K479	D187-K476 WeakPolarHBondContact OD1-CD 3.39Å; D187-K476 WeakPolarHBondContact OD1-CE 3.4Å; D187-K476 IonicContact OD1-NZ 2.62Å; D187-K476 PolarHBondContact OD1-NZ 3.18Å; D443-K476 VanDerWaalsContact OD2-CE 3.25Å; D443-K476 WeakPolarHBondContact OD2-CE 3.38Å; D443-K476 IonicContact OD2-NZ 3.67Å; D443-K476 PolarHBondContact OD2-NZ 3.45Å; L448-K476 PolarHBondContact O-NZ 3.35Å; E449-K476 WeakPolarHBondContact O-CB 3.5Å; I451-K476 HydrophobicContact CB-CB 4.44Å; I451-K476 HydrophobicContact CB-CD 4.22Å; I451-K476 WeakPolarHBondContact O-CB 3.33Å; I451-K476 PolarHBondContact O-N 3.37Å; Y474-K476 HydrophobicContact CE1-CB 4.01Å; K476-K479 WeakPolarHBondContact O-CG 3.45Å; K476-K479 PolarHBondContact O-N 3.46Å
477	S	84.4	Confident	86.3	Confident	60 Å²	60	53.3 Å²	53.3	42%	0.42	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-48.2	-175.3	71.4	0	0	0	0	111.5	E449 N450 D475	E449-S477 PolarHBondContact O-N 3.03Å; N450-S477 WeakPolarHBondContact OD1-CB 3.47Å; D475-S477 VanDerWaalsContact C-N 3.31Å; D475-S477 PolarHBondContact O-N 2.97Å; D475-S477 WeakPolarHBondContact OD1-CB 3.14Å; D475-S477 PolarHBondContact OD1-N 3.22Å; D475-S477 PolarHBondContact OD1-OG 3.24Å; D475-S477 PolarHBondContact OD2-OG 3.38Å
478	T	86.6	Confident	86.3	Confident	94 Å²	94	54.6 Å²	54.6	58%	0.577	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-12.6	173.1	60.7	0	0	0	0	113.9	D475 A480	D475-T478 WeakPolarHBondContact OD2-CB 3.5Å; D475-T478 VanDerWaalsContact OD2-CG2 3.24Å; D475-T478 WeakPolarHBondContact OD2-CG2 3.22Å; D475-T478 PolarHBondContact OD2-N 2.74Å; D475-T478 PolarHBondContact OD2-OG1 3.32Å; T478-A480 PolarHBondContact O-N 3.47Å; T478-A480 VanDerWaalsContact OG1-CB 3.29Å; T478-A480 WeakPolarHBondContact OG1-CB 3.46Å; T478-A480 PolarHBondContact OG1-N 3.19Å
479	K	85.3	Confident	86	Confident	145 Å²	145	52.3 Å²	52.3	63%	0.63	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	24.3	-169.6	-57.9	-178.4	-179	177.9	0	113.3	D475 K476	D475-K479 CarbonylContact O-C 3.56Å; D475-K479 WeakPolarHBondContact O-CA 3.48Å; D475-K479 PolarHBondContact O-N 3.05Å; K476-K479 WeakPolarHBondContact O-CG 3.45Å; K476-K479 PolarHBondContact O-N 3.46Å
480	A	86.7	Confident	85.2	Confident	52 Å²	52	48.2 Å²	48.2	43%	0.43	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.6	-177.7	0	0	0	0	0	111	Y474 D475 T478	Y474-A480 WeakPolarHBondContact CA-O 3.47Å; D475-A480 PolarHBondContact N-O 3.42Å; D475-A480 VanDerWaalsContact N-O 3.15Å; D475-A480 PolarHBondContact O-N 3.43Å; T478-A480 PolarHBondContact O-N 3.47Å; T478-A480 VanDerWaalsContact OG1-CB 3.29Å; T478-A480 WeakPolarHBondContact OG1-CB 3.46Å; T478-A480 PolarHBondContact OG1-N 3.19Å
481	L	89.5	Confident	84.6	Confident	24 Å²	24	47.1 Å²	47.1	13%	0.126	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	109.3	168	-167.5	141	0	0	0	110.2	V191 A194 L195 K198 M472 Y474 L483	V191-L481 HydrophobicContact CG1-CD1 4.46Å; A194-L481 HydrophobicContact CB-CB 4.09Å; A194-L481 HydrophobicContact CB-CD1 3.77Å; L195-L481 HydrophobicContact CB-CD1 3.9Å; L195-L481 HydrophobicContact CD1-CD1 4.43Å; L195-L481 HydrophobicContact CD1-CD2 4.22Å; K198-L481 HydrophobicContact CB-CD2 4.43Å; K198-L481 HydrophobicContact CG-CD2 4.32Å; M472-L481 HydrophobicContact CG-CD1 4.33Å; M472-L481 HydrophobicContact CG-CD2 4.12Å; M472-L481 HydrophobicContact CG-CG 4.08Å; M472-L481 HydrophobicContact SD-CD1 3.74Å; M472-L481 HydrophobicContact SD-CD2 4.37Å; M472-L481 HydrophobicContact SD-CG 4.16Å; Y474-L481 HydrophobicContact CD2-CB 4.04Å; Y474-L481 HydrophobicContact CD2-CD1 4.3Å; L481-L483 HydrophobicContact CD2-CB 4.44Å
482	S	89.4	Confident	83.8	Confident	54 Å²	54	48.8 Å²	48.8	38%	0.378	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	140.2	168.9	67.9	0	0	0	0	110.3	M472 N473	M472-S482 WeakPolarHBondContact CA-O 3.35Å; M472-S482 WeakPolarHBondContact CG-O 3.18Å; N473-S482 PolarHBondContact N-O 3.44Å; N473-S482 PolarHBondContact O-N 3.19Å; N473-S482 PolarHBondContact O-OG 2.91Å
483	L	87.1	Confident	83.2	Confident	55 Å²	55	56.7 Å²	56.7	29%	0.288	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	116.5	178.3	-164.6	81.4	0	0	0	107.9	L195 V471 M472 L481 D485 L487	L195-L483 HydrophobicContact CD1-CD1 4.2Å; V471-L483 CarbonylContact O-C 3.56Å; V471-L483 WeakPolarHBondContact O-CA 3.45Å; V471-L483 WeakPolarHBondContact O-CD1 3.47Å; M472-L483 HydrophobicContact CB-CD1 3.92Å; M472-L483 HydrophobicContact CG-CD1 4.04Å; L481-L483 HydrophobicContact CD2-CB 4.44Å; L483-D485 WeakPolarHBondContact CG-O 3.2Å; L483-L487 HydrophobicContact CD1-CD1 4.41Å; L483-L487 HydrophobicContact CD1-CG 4.36Å
484	N	84.5	Confident	82.5	Confident	104 Å²	104	59.1 Å²	59.1	56%	0.556	33%	0.333	S	S	*	.	S	Bend	trans	-84.2	-41.4	-171.9	-62	-25.6	0	0	0	112.2	L470 V471	L470-N484 PolarHBondContact O-ND2 3.27Å; V471-N484 PolarHBondContact O-N 3.37Å
485	D	81	Confident	82	Confident	59 Å²	59	59 Å²	59	32%	0.316	33%	0.334	S	S	.	.	S	Bend	trans	-124	142.4	178.6	-91.4	-39.5	0	0	0	108.7	K469 V471 L483	K469-D485 VanDerWaalsContact CD-OD2 3.3Å; K469-D485 WeakPolarHBondContact CD-OD2 3.47Å; K469-D485 IonicContact NZ-OD1 3.7Å; K469-D485 IonicContact NZ-OD2 3.84Å; K469-D485 PolarHBondContact NZ-OD2 2.83Å; V471-D485 HydrophobicContact CB-CB 4.42Å; V471-D485 HydrophobicContact CG1-CB 4.05Å; L483-D485 WeakPolarHBondContact CG-O 3.2Å
486	P	78.6	Confident	81.7	Confident	86 Å²	86	64.6 Å²	64.6	56%	0.558	35%	0.353	S	S	*	.			trans	-67	136.7	177	28.3	-34.3	0	0	0	111.6	L488	P486-L488 PolarHBondContact O-N 3.37Å; P486-L488 VanDerWaalsContact O-N 3.15Å
487	L	82.9	Confident	81.5	Confident	10 Å²	10	64.1 Å²	64.1	5%	0.052	35%	0.351	C	S	.	.			trans	-74.5	104.5	175.2	-68.3	176.7	0	0	0	110.6	L195 M199 L279 L308 L457 V471 L483 V495	L195-L487 HydrophobicContact CD1-CD1 3.86Å; L195-L487 HydrophobicContact CD2-CD1 4.33Å; L195-L487 HydrophobicContact CG-CD1 4.44Å; M199-L487 HydrophobicContact CG-CD1 4.46Å; M199-L487 HydrophobicContact SD-CB 4.21Å; M199-L487 HydrophobicContact SD-CD1 3.56Å; M199-L487 VanDerWaalsContact SD-CD1 3.56Å; L279-L487 HydrophobicContact CD2-CD1 4.43Å; L308-L487 HydrophobicContact CD1-CD2 4.49Å; L308-L487 HydrophobicContact CD2-CD1 4.02Å; L457-L487 HydrophobicContact CD1-CD2 4.02Å; L457-L487 HydrophobicContact CD2-CD2 4.08Å; V471-L487 HydrophobicContact CG2-CD2 3.9Å; L483-L487 HydrophobicContact CD1-CD1 4.41Å; L483-L487 HydrophobicContact CD1-CG 4.36Å; L487-V495 HydrophobicContact CB-CG2 4.41Å; L487-V495 PolarHBondContact O-N 3.35Å
488	L	77.4	Confident	81.3	Confident	73 Å²	73	63.9 Å²	63.9	38%	0.382	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-106.3	145.5	176.4	-56.8	179.4	0	0	0	110.6	S306 P486 R493 P494	S306-L488 PolarHBondContact OG-O 2.92Å; P486-L488 PolarHBondContact O-N 3.37Å; P486-L488 VanDerWaalsContact O-N 3.15Å; L488-R493 CarbonylContact C-O 3.58Å; L488-R493 WeakPolarHBondContact CA-O 3.49Å; L488-P494 HydrophobicContact CD2-CB 4.37Å
489	L	74.9	Confident	80.4	Confident	11 Å²	11	60 Å²	60	6%	0.058	32%	0.324	C	S	.	.			trans	-70.7	164.6	165	-68.3	172.3	0	0	0	110.5	D491 G492 R493 V495	L489-D491 PolarHBondContact O-N 3.26Å; L489-D491 VanDerWaalsContact O-N 3.1Å; L489-G492 WeakPolarHBondContact O-CA 3.5Å; L489-G492 PolarHBondContact O-N 2.96Å; L489-R493 PolarHBondContact N-O 2.87Å; L489-V495 HydrophobicContact CD2-CG2 3.88Å; L489-V495 HydrophobicContact CG-CG2 3.87Å
490	P	70.7	Confident	79.2	Confident	16 Å²	16	56.8 Å²	56.8	10%	0.104	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.9	178.1	-24.8	36.4	0	0	0	114.1	S306 S462 G492	S306-P490 WeakPolarHBondContact OG-CD 3.4Å; S462-P490 WeakPolarHBondContact CA-O 3.27Å; S462-P490 WeakPolarHBondContact CB-O 3.4Å; S462-P490 PolarHBondContact N-O 3.15Å; P490-G492 PolarHBondContact O-N 3.38Å
491	D	73.5	Confident	77.6	Confident	53 Å²	53	62.3 Å²	62.3	28%	0.283	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	4	173.4	83.8	-19.1	0	0	0	114.3	L489 R493	L489-D491 PolarHBondContact O-N 3.26Å; L489-D491 VanDerWaalsContact O-N 3.1Å; D491-R493 WeakPolarHBondContact OD1-CB 3.48Å; D491-R493 WeakPolarHBondContact OD1-CG 3.4Å; D491-R493 PolarHBondContact OD1-N 3.47Å; D491-R493 VanDerWaalsContact OD1-N 3.14Å; D491-R493 IonicContact OD1-NE 3.76Å; D491-R493 IonicContact OD2-CZ 2.67Å; D491-R493 VanDerWaalsContact OD2-CZ 3.29Å; D491-R493 IonicContact OD2-NE 3.96Å; D491-R493 PolarHBondContact OD2-NE 3.32Å; D491-R493 IonicContact OD2-NH2 3.15Å; D491-R493 PolarHBondContact OD2-NH2 2.98Å
492	G	73.6	Confident	75.5	Confident	36 Å²	36	63.4 Å²	63.4	37%	0.371	36%	0.357	S	S	.	.	S	Bend	trans	81.9	2.1	177.6	0	0	0	0	0	115.3	L489 P490	L489-G492 WeakPolarHBondContact O-CA 3.5Å; L489-G492 PolarHBondContact O-N 2.96Å; P490-G492 PolarHBondContact O-N 3.38Å
493	R	78.3	Confident	73.6	Confident	167 Å²	167	62.4 Å²	62.4	63%	0.63	35%	0.35	S	S	*	.			trans	-83.9	147.3	176.3	-63.3	-172.7	-124.9	-140.2	-4.2	111.8	L488 L489 D491	L488-R493 CarbonylContact C-O 3.58Å; L488-R493 WeakPolarHBondContact CA-O 3.49Å; L489-R493 PolarHBondContact N-O 2.87Å; D491-R493 WeakPolarHBondContact OD1-CB 3.48Å; D491-R493 WeakPolarHBondContact OD1-CG 3.4Å; D491-R493 PolarHBondContact OD1-N 3.47Å; D491-R493 VanDerWaalsContact OD1-N 3.14Å; D491-R493 IonicContact OD1-NE 3.76Å; D491-R493 IonicContact OD2-CZ 2.67Å; D491-R493 VanDerWaalsContact OD2-CZ 3.29Å; D491-R493 IonicContact OD2-NE 3.96Å; D491-R493 PolarHBondContact OD2-NE 3.32Å; D491-R493 IonicContact OD2-NH2 3.15Å; D491-R493 PolarHBondContact OD2-NH2 2.98Å
494	P	77.5	Confident	71.7	Confident	95 Å²	95	63 Å²	63	62%	0.617	35%	0.351	S	S	*	.	B	Isolated β-bridge	trans	-61.6	138.9	170.3	27.4	-34.7	0	0	0	110.7	L488 R496	L488-P494 HydrophobicContact CD2-CB 4.37Å; P494-R496 PolarHBondContact O-N 2.92Å
495	V	81.1	Confident	69.9	Low	5 Å²	5	60.7 Å²	60.7	3%	0.03	34%	0.343	C	S	.	.			trans	-65.4	116	177.4	-178.1	0	0	0	0	109.1	M199 I254 L279 L487 L489	M199-V495 HydrophobicContact SD-CB 4.27Å; M199-V495 HydrophobicContact SD-CG1 4.42Å; I254-V495 HydrophobicContact CD1-CG1 3.83Å; I254-V495 HydrophobicContact CG1-CG1 3.64Å; L279-V495 HydrophobicContact CB-CG1 3.82Å; L279-V495 HydrophobicContact CB-CG2 3.97Å; L279-V495 HydrophobicContact CD2-CB 4.39Å; L279-V495 HydrophobicContact CD2-CG1 3.9Å; L279-V495 HydrophobicContact CD2-CG2 4.15Å; L279-V495 HydrophobicContact CG-CG1 4.48Å; L279-V495 HydrophobicContact CG-CG2 4.42Å; L487-V495 HydrophobicContact CB-CG2 4.41Å; L487-V495 PolarHBondContact O-N 3.35Å; L489-V495 HydrophobicContact CD2-CG2 3.88Å; L489-V495 HydrophobicContact CG-CG2 3.87Å
496	R	83.4	Confident	68.5	Low	144 Å²	144	59 Å²	59	54%	0.543	34%	0.335	S	S	.	.			trans	-136.6	117.6	172.4	-164.5	175.4	-174.1	-156	-1.6	111.6	N200 S201 P494 V498	N200-R496 PolarHBondContact O-NE 3.14Å; S201-R496 WeakPolarHBondContact OG-CA 3.44Å; P494-R496 PolarHBondContact O-N 2.92Å; R496-V498 HydrophobicContact CG-CG2 4.01Å
497	S	84.5	Confident	67.3	Low	4 Å²	4	63.6 Å²	63.6	3%	0.028	34%	0.342	C	S	.	.			trans	-128.2	100	178.1	-164.1	0	0	0	0	109.2	S201 N202 W203 K253	S201-S497 CarbonylContact C-O 3.41Å; S201-S497 VanDerWaalsContact CA-O 3.26Å; S201-S497 WeakPolarHBondContact CA-O 3.22Å; S201-S497 VanDerWaalsContact CB-O 3.3Å; S201-S497 WeakPolarHBondContact CB-O 3.36Å; S201-S497 PolarHBondContact OG-N 2.88Å; N202-S497 PolarHBondContact N-O 3.35Å; W203-S497 PolarHBondContact N-O 2.81Å; W203-S497 VanDerWaalsContact N-O 3.08Å; W203-S497 WeakPolarHBondContact O-CB 3.37Å; W203-S497 PolarHBondContact O-OG 3.39Å; K253-S497 PolarHBondContact N-OG 3.38Å
498	V	80.2	Confident	65.8	Low	55 Å²	55	65.7 Å²	65.7	33%	0.333	36%	0.355	S	S	.	.			trans	-129.9	130.5	-175.5	174.3	0	0	0	0	108.8	N200 N202 R496	N200-V498 WeakPolarHBondContact O-CG2 3.49Å; N202-V498 VanDerWaalsContact OD1-CA 3.3Å; N202-V498 WeakPolarHBondContact OD1-CA 3.46Å; R496-V498 HydrophobicContact CG-CG2 4.01Å
499	C	68.1	Low	64.7	Low	12 Å²	12	63.9 Å²	63.9	8%	0.081	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-68.4	133.2	172.2	168.2	0	0	0	0	109.7	N202 W203 L231 C506	N202-C499 PolarHBondContact OD1-N 3.3Å; N202-C499 VanDerWaalsContact OD1-N 3.1Å; W203-C499 HydrophobicContact CB-CB 4.16Å; W203-C499 HydrophobicContact CD2-CB 4.28Å; W203-C499 HydrophobicContact CG-CB 4.12Å; L231-C499 HydrophobicContact CD1-CB 3.42Å; L231-C499 VanDerWaalsContact CD1-CB 3.42Å; C499-C506 HydrophobicContact CB-CB 4.15Å; C499-C506 WeakPolarHBondContact CB-SG 3.34Å; C499-C506 WeakPolarHBondContact SG-CB 3.22Å; C499-C506 CovalentContact SG-SG 2.03Å; C499-C506 PolarHBondContact SG-SG 3.48Å
500	P	61.2	Low	63.7	Low	77 Å²	77	67.7 Å²	67.7	50%	0.5	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-67	132.3	171.2	-14.5	28.3	0	0	0	111.2	G502 S503	P500-G502 PolarHBondContact O-N 3.1Å; P500-S503 WeakPolarHBondContact O-CB 3.02Å; P500-S503 PolarHBondContact O-N 3.16Å
501	N	51.8	Low	63.2	Low	168 Å²	168	71 Å²	71	90%	0.898	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	133.9	172.6	-67.9	-2.2	0	0	0	110.2	S503	N501-S503 VanDerWaalsContact C-N 3.27Å; N501-S503 PolarHBondContact O-N 3.34Å
502	G	46.2	Very low	62.9	Low	47 Å²	47	72.4 Å²	72.4	49%	0.485	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	4.2	-175.1	0	0	0	0	0	115	P500 H504 D916	P500-G502 PolarHBondContact O-N 3.1Å; G502-H504 PolarHBondContact O-N 3.24Å; G502-D916 WeakPolarHBondContact CA-OD2 3.49Å
503	S	48.8	Very low	62.7	Low	34 Å²	34	72.9 Å²	72.9	24%	0.238	40%	0.396	C	S	.	.			trans	-72.8	100.3	175.2	176.3	0	0	0	0	111	P500 N501 S505 C506	P500-S503 WeakPolarHBondContact O-CB 3.02Å; P500-S503 PolarHBondContact O-N 3.16Å; N501-S503 VanDerWaalsContact C-N 3.27Å; N501-S503 PolarHBondContact O-N 3.34Å; S503-S505 PolarHBondContact O-N 3Å; S503-S505 VanDerWaalsContact O-N 3.17Å; S503-S505 WeakPolarHBondContact OG-CB 3.31Å; S503-S505 PolarHBondContact OG-N 3.41Å; S503-C506 VanDerWaalsContact CB-SG 3.57Å; S503-C506 WeakPolarHBondContact O-CB 3.35Å; S503-C506 PolarHBondContact O-N 3.08Å; S503-C506 PolarHBondContact OG-N 3.25Å; S503-C506 PolarHBondContact OG-SG 3.07Å
504	H	48	Very low	62.4	Low	67 Å²	67	71.2 Å²	71.2	31%	0.31	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-50.8	-33	163.1	-91.8	-112	0	0	0	111.6	G502 C506 R507 D916 F919	G502-H504 PolarHBondContact O-N 3.24Å; H504-C506 PolarHBondContact O-N 3.33Å; H504-C506 VanDerWaalsContact O-N 3.07Å; H504-R507 PolarHBondContact O-N 2.69Å; H504-D916 IonicContact CD2-OD1 3.82Å; H504-D916 IonicContact NE2-OD1 3.71Å; H504-F919 AromaticContact CE1-CD2 3.27Å; H504-F919 WeakPolarHBondContact CE1-CD2 3.39Å; H504-F919 AromaticContact CE1-CE2 3.66Å; H504-F919 AromaticContact CE1-CG 3.69Å; H504-F919 AromaticContact NE2-CD2 3.61Å
505	S	46.6	Very low	61.9	Low	56 Å²	56	67.3 Å²	67.3	39%	0.392	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-64.9	-2.5	172.2	-80.9	0	0	0	0	115.5	R251 S503	R251-S505 PolarHBondContact NH1-OG 3.24Å; S503-S505 PolarHBondContact O-N 3Å; S503-S505 VanDerWaalsContact O-N 3.17Å; S503-S505 WeakPolarHBondContact OG-CB 3.31Å; S503-S505 PolarHBondContact OG-N 3.41Å
506	C	51.3	Low	61.2	Low	22 Å²	22	70.4 Å²	70.4	15%	0.149	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-95	-2.9	167.3	-61.6	0	0	0	0	113.4	C499 S503 H504 T508	C499-C506 HydrophobicContact CB-CB 4.15Å; C499-C506 WeakPolarHBondContact CB-SG 3.34Å; C499-C506 WeakPolarHBondContact SG-CB 3.22Å; C499-C506 CovalentContact SG-SG 2.03Å; C499-C506 PolarHBondContact SG-SG 3.48Å; S503-C506 VanDerWaalsContact CB-SG 3.57Å; S503-C506 WeakPolarHBondContact O-CB 3.35Å; S503-C506 PolarHBondContact O-N 3.08Å; S503-C506 PolarHBondContact OG-N 3.25Å; S503-C506 PolarHBondContact OG-SG 3.07Å; H504-C506 PolarHBondContact O-N 3.33Å; H504-C506 VanDerWaalsContact O-N 3.07Å; C506-T508 VanDerWaalsContact C-N 3.33Å
507	R	52.6	Low	60	Low	184 Å²	184	65.8 Å²	65.8	69%	0.694	38%	0.376	S	S	*	.	S	Bend	trans	-97.4	59.7	162.1	-70.8	-173.6	176.1	-178	2.1	109.5	H504	H504-R507 PolarHBondContact O-N 2.69Å
508	T	51.7	Low	58.6	Low	54 Å²	54	72.6 Å²	72.6	33%	0.331	41%	0.407	S	S	.	.			trans	-64	132.3	175.4	25.9	0	0	0	0	111	E233 C506 S510	E233-T508 HydrophobicContact CG-CG2 3.97Å; E233-T508 WeakPolarHBondContact CG-OG1 3.28Å; E233-T508 WeakPolarHBondContact O-CB 3.39Å; E233-T508 PolarHBondContact O-OG1 2.75Å; C506-T508 VanDerWaalsContact C-N 3.33Å; T508-S510 PolarHBondContact O-N 3.42Å
509	C	55.4	Low	57.6	Low	35 Å²	35	77.8 Å²	77.8	24%	0.236	42%	0.421	C	S	.	.			trans	-53.9	126.9	168.3	-77.5	0	0	0	0	110.3	L511 V512 C608	C509-L511 WeakPolarHBondContact CB-O 3.04Å; C509-L511 PolarHBondContact O-N 3.09Å; C509-V512 HydrophobicContact CB-CG2 4.29Å; C509-C608 HydrophobicContact CB-CB 3.54Å; C509-C608 WeakPolarHBondContact CB-SG 3.37Å; C509-C608 WeakPolarHBondContact SG-CB 3.32Å; C509-C608 PolarHBondContact SG-N 2.94Å; C509-C608 VanDerWaalsContact SG-N 3.45Å; C509-C608 CovalentContact SG-SG 2.03Å; C509-C608 PolarHBondContact SG-SG 3.45Å
510	S	52.9	Low	57.5	Low	91 Å²	91	78.5 Å²	78.5	64%	0.636	43%	0.425	S	S	*	.	S	Bend	trans	-67.7	-22.2	177.6	51.1	0	0	0	0	113.3	T508	T508-S510 PolarHBondContact O-N 3.42Å
511	L	59.9	Low	58.3	Low	86 Å²	86	75.1 Å²	75.1	45%	0.45	40%	0.402	S	S	.	.			trans	-127.5	131.8	167.6	-72.5	86.1	0	0	0	109.6	C509 R607 C608	C509-L511 WeakPolarHBondContact CB-O 3.04Å; C509-L511 PolarHBondContact O-N 3.09Å; L511-R607 HydrophobicContact CB-CG 4.12Å; L511-R607 WeakPolarHBondContact O-CA 3.21Å; L511-C608 PolarHBondContact O-N 2.93Å
512	V	67.4	Low	59.6	Low	81 Å²	81	68.1 Å²	68.1	49%	0.491	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	116.6	168.6	-174.2	0	0	0	0	106.9	C509 C608 A610	C509-V512 HydrophobicContact CB-CG2 4.29Å; V512-C608 WeakPolarHBondContact CA-O 3.46Å; V512-C608 HydrophobicContact CB-CB 4.43Å; V512-C608 HydrophobicContact CG1-CB 4.19Å; V512-C608 HydrophobicContact CG2-CB 4.09Å; V512-A610 HydrophobicContact CG1-CB 3.98Å
513	D	69.7	Low	61.3	Low	46 Å²	46	66.3 Å²	66.3	25%	0.246	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	146.1	177.7	-86.4	52	0	0	0	109.5	R607 C608 A610	D513-R607 HydrophobicContact CB-CB 4.36Å; D513-R607 HydrophobicContact CB-CG 4.41Å; D513-R607 IonicContact OD1-CZ 2.97Å; D513-R607 IonicContact OD1-NE 2.82Å; D513-R607 IonicContact OD1-NH2 3.84Å; D513-R607 IonicContact OD2-CZ 3.59Å; D513-R607 IonicContact OD2-NE 2.72Å; D513-R607 PolarHBondContact OD2-NE 3.23Å; D513-R607 IonicContact OD2-NH1 2.67Å; D513-R607 PolarHBondContact OD2-NH1 3.31Å; D513-R607 IonicContact OD2-NH2 3.9Å; D513-R607 PolarHBondContact OD2-NH2 2.88Å; D513-C608 PolarHBondContact N-O 2.74Å; D513-A610 PolarHBondContact O-N 3.16Å
514	M	71.8	Confident	63	Low	132 Å²	132	68 Å²	68	65%	0.65	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	125.6	171.7	-63.7	-73.8	-82.2	0	0	108.7	A610 H612	M514-A610 HydrophobicContact SD-CB 4Å; M514-H612 HydrophobicContact CE-CB 3.9Å
515	A	67.8	Low	64.7	Low	13 Å²	13	67.7 Å²	67.7	11%	0.107	35%	0.349	C	S	.	.			trans	-70.4	133.1	177.5	0	0	0	0	0	110.8	N517 W521 L609 A610 F611	A515-N517 PolarHBondContact O-N 3.34Å; A515-W521 HydrophobicContact CB-CG 4.49Å; A515-L609 HydrophobicContact CB-CB 4.43Å; A515-A610 PolarHBondContact N-O 3.17Å; A515-F611 HydrophobicContact CB-CD1 3.78Å; A515-F611 HydrophobicContact CB-CD2 4.35Å; A515-F611 HydrophobicContact CB-CE1 3.41Å; A515-F611 VanDerWaalsContact CB-CE1 3.41Å; A515-F611 HydrophobicContact CB-CE2 4.04Å; A515-F611 HydrophobicContact CB-CG 4.23Å; A515-F611 HydrophobicContact CB-CZ 3.55Å
516	D	66.3	Low	66.4	Low	70 Å²	70	65.4 Å²	65.4	37%	0.374	33%	0.334	S	S	.	.			trans	-75.3	93	172.9	-172.7	-9.1	0	0	0	110.3	Q518 R519	D516-Q518 PolarHBondContact O-N 3.11Å; D516-Q518 WeakPolarHBondContact OD1-CB 3.48Å; D516-Q518 PolarHBondContact OD1-N 3.46Å; D516-R519 HydrophobicContact CB-CB 4.41Å; D516-R519 PolarHBondContact O-N 2.93Å; D516-R519 WeakPolarHBondContact OD2-CD 3.34Å; D516-R519 WeakPolarHBondContact OD2-CG 3.48Å; D516-R519 IonicContact OD2-NE 2.69Å
517	N	58.3	Low	68	Low	48 Å²	48	67 Å²	67	26%	0.257	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-16.9	174.9	-80.3	-0.6	0	0	0	114.1	A515 S613	A515-N517 PolarHBondContact O-N 3.34Å; N517-S613 PolarHBondContact ND2-OG 3.01Å
518	Q	54.8	Low	69.7	Low	146 Å²	146	58.4 Å²	58.4	68%	0.682	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-16.5	179.8	-65	-162.1	-16.4	0	0	113.9	D516	D516-Q518 PolarHBondContact O-N 3.11Å; D516-Q518 WeakPolarHBondContact OD1-CB 3.48Å; D516-Q518 PolarHBondContact OD1-N 3.46Å
519	R	59.4	Low	71.5	Confident	165 Å²	165	56.3 Å²	56.3	62%	0.623	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	-35.5	-161.2	-67.1	-166	-176.1	-151	-2.6	118.3	D516 R537	D516-R519 HydrophobicContact CB-CB 4.41Å; D516-R519 PolarHBondContact O-N 2.93Å; D516-R519 WeakPolarHBondContact OD2-CD 3.34Å; D516-R519 WeakPolarHBondContact OD2-CG 3.48Å; D516-R519 IonicContact OD2-NE 2.69Å; R519-R537 PolarHBondContact O-NH2 2.83Å
520	T	66.4	Low	73.4	Confident	27 Å²	27	54.7 Å²	54.7	17%	0.166	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145.2	-16.8	-174	43.3	0	0	0	0	116.4	V588 D589	T520-V588 WeakPolarHBondContact O-CA 3.3Å; T520-D589 PolarHBondContact O-N 3.21Å
521	W	77.8	Confident	75.3	Confident	6 Å²	6	50.4 Å²	50.4	2%	0.023	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.1	-166.4	-49.9	103	0	0	0	113.7	A515 L586 V588 A600 Q603 L604 L609 F611	A515-W521 HydrophobicContact CB-CG 4.49Å; W521-L586 HydrophobicContact CB-CD1 4.19Å; W521-L586 HydrophobicContact CE3-CD1 3.89Å; W521-L586 HydrophobicContact CE3-CD2 3.86Å; W521-L586 HydrophobicContact CE3-CG 3.95Å; W521-L586 HydrophobicContact CZ3-CD2 3.94Å; W521-L586 HydrophobicContact CZ3-CG 4.37Å; W521-V588 HydrophobicContact CE3-CB 4.48Å; W521-V588 HydrophobicContact CE3-CG1 4.15Å; W521-V588 HydrophobicContact CE3-CG2 3.83Å; W521-V588 HydrophobicContact CH2-CG1 4.47Å; W521-V588 HydrophobicContact CZ3-CB 4.38Å; W521-V588 HydrophobicContact CZ3-CG1 3.87Å; W521-V588 HydrophobicContact CZ3-CG2 3.63Å; W521-A600 HydrophobicContact CH2-CB 3.98Å; W521-A600 HydrophobicContact CZ2-CB 4.47Å; W521-Q603 HydrophobicContact CZ2-CB 4.35Å; W521-L604 HydrophobicContact CH2-CB 4.47Å; W521-L609 HydrophobicContact CD2-CD1 4.15Å; W521-L609 HydrophobicContact CE3-CD1 4.07Å; W521-L609 HydrophobicContact CH2-CD1 3.7Å; W521-L609 HydrophobicContact CZ2-CD1 3.78Å; W521-L609 HydrophobicContact CZ2-CD2 4.36Å; W521-L609 HydrophobicContact CZ3-CD1 3.84Å; W521-F611 HydrophobicContact CB-CE1 3.72Å; W521-F611 HydrophobicContact CB-CZ 3.99Å; W521-F611 HydrophobicContact CG-CE1 4.35Å; W521-F611 HydrophobicContact CG-CZ 4.3Å
522	L	78.7	Confident	76.8	Confident	21 Å²	21	46.3 Å²	46.3	11%	0.11	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	108.2	170.4	158.6	55.6	0	0	0	109.6	L587 L840 Q842 W844	L522-L587 HydrophobicContact CB-CB 4.1Å; L522-L587 HydrophobicContact CD2-CB 4.33Å; L522-L587 HydrophobicContact CD2-CD1 3.89Å; L522-L587 HydrophobicContact CG-CB 4.14Å; L522-L587 HydrophobicContact CG-CD1 4.16Å; L522-L587 HydrophobicContact CG-CG 4.45Å; L522-L587 PolarHBondContact N-O 2.93Å; L522-L587 PolarHBondContact O-N 3.14Å; L522-L840 HydrophobicContact CD2-CD2 4.05Å; L522-Q842 HydrophobicContact CD1-CG 3.82Å; L522-W844 HydrophobicContact CD2-CZ2 4.31Å
523	L	81.9	Confident	78	Confident	9 Å²	9	42.5 Å²	42.5	5%	0.047	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	121.3	-178.8	-176.9	67.6	0	0	0	112.5	Y529 L586 F611 Q614 V616 V618	L523-Y529 HydrophobicContact CD1-CD1 4.17Å; L523-Y529 HydrophobicContact CD1-CE1 3.58Å; L523-L586 HydrophobicContact CD1-CD1 4.43Å; L523-F611 HydrophobicContact CB-CD1 4.13Å; L523-F611 HydrophobicContact CB-CE1 4.19Å; L523-F611 HydrophobicContact CB-CG 4.41Å; L523-F611 HydrophobicContact CD2-CB 3.8Å; L523-F611 HydrophobicContact CD2-CD1 4.19Å; L523-F611 HydrophobicContact CD2-CD2 3.73Å; L523-F611 HydrophobicContact CD2-CE2 4.36Å; L523-F611 HydrophobicContact CD2-CG 3.63Å; L523-Q614 VanDerWaalsContact CD2-OE1 3.29Å; L523-Q614 PolarHBondContact O-NE2 3.02Å; L523-Q614 VanDerWaalsContact O-NE2 3.09Å; L523-V616 HydrophobicContact CD2-CB 3.9Å; L523-V616 HydrophobicContact CD2-CG1 3.95Å; L523-V616 HydrophobicContact CD2-CG2 4.46Å; L523-V618 HydrophobicContact CD1-CG2 3.89Å
524	Y	84.6	Confident	78.9	Confident	69 Å²	69	40.3 Å²	40.3	27%	0.271	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	113.2	160.9	-171.9	-84.8	0	0	0	108.1	V562 L565 E566 G584 A585	Y524-V562 HydrophobicContact CD2-CG1 4.14Å; Y524-V562 HydrophobicContact CE2-CG1 4.05Å; Y524-L565 HydrophobicContact CD1-CD1 4.47Å; Y524-E566 HydrophobicContact CE2-CG 4.31Å; Y524-E566 VanDerWaalsContact OH-CG 3.31Å; Y524-E566 WeakPolarHBondContact OH-CG 3.32Å; Y524-G584 CarbonylContact O-C 3.53Å; Y524-G584 WeakPolarHBondContact O-CA 3.37Å; Y524-A585 PolarHBondContact N-O 3.4Å; Y524-A585 PolarHBondContact O-N 3.47Å
525	P	83	Confident	79.6	Confident	60 Å²	60	34.3 Å²	34.3	39%	0.39	17%	0.168	S	C	.	.			trans	-73.9	142.7	-165.8	26.8	-33.8	0	0	0	113.7
526	G	83.9	Confident	80.1	Confident	8 Å²	8	34 Å²	34	8%	0.082	17%	0.165	C	C	.	.			trans	-160.9	-164.7	175.1	0	0	0	0	0	113.1	Y529	G526-Y529 PolarHBondContact N-OH 3.34Å; G526-Y529 PolarHBondContact O-OH 3.42Å
527	D	83.5	Confident	80.7	Confident	57 Å²	57	32 Å²	32	31%	0.305	15%	0.152	S	C	.	.	S	Bend	trans	-103	-17.4	178.1	-52.5	-50.2	0	0	0	112.1	V581 R582	D527-V581 HydrophobicContact CB-CG1 4.38Å; D527-R582 PolarHBondContact N-O 3.4Å; D527-R582 IonicContact OD1-CZ 3.64Å; D527-R582 VanDerWaalsContact OD1-CZ 3.32Å; D527-R582 IonicContact OD1-NE 2.97Å; D527-R582 PolarHBondContact OD1-NE 2.86Å; D527-R582 VanDerWaalsContact OD1-NE 3.15Å; D527-R582 IonicContact OD1-NH2 3.47Å; D527-R582 PolarHBondContact OD1-NH2 2.9Å; D527-R582 WeakPolarHBondContact OD2-CA 3.43Å; D527-R582 WeakPolarHBondContact OD2-CB 3.36Å; D527-R582 VanDerWaalsContact OD2-CG 3.26Å; D527-R582 WeakPolarHBondContact OD2-CG 3.49Å; D527-R582 IonicContact OD2-CZ 2.8Å; D527-R582 PolarHBondContact OD2-N 3.3Å; D527-R582 IonicContact OD2-NE 3.69Å; D527-R582 PolarHBondContact OD2-NE 3.36Å
528	V	88.4	Confident	81.7	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.012	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	150	173	-89.7	0	0	0	0	109.3	V581 R582 L583 G584 L624 L914 F919	V528-V581 HydrophobicContact CG2-CG1 3.69Å; V528-R582 PolarHBondContact N-O 2.9Å; V528-L583 HydrophobicContact CG2-CD2 4.06Å; V528-G584 WeakPolarHBondContact O-CA 3.29Å; V528-G584 PolarHBondContact O-N 3.34Å; V528-L624 HydrophobicContact CB-CD1 3.66Å; V528-L624 HydrophobicContact CB-CG 3.93Å; V528-L624 HydrophobicContact CG1-CD1 3.83Å; V528-L624 HydrophobicContact CG1-CD2 4.24Å; V528-L624 HydrophobicContact CG1-CG 3.95Å; V528-L624 HydrophobicContact CG2-CD1 3.84Å; V528-L914 HydrophobicContact CB-CD1 4.47Å; V528-L914 HydrophobicContact CG1-CD1 3.43Å; V528-L914 VanDerWaalsContact CG1-CD1 3.43Å; V528-L914 HydrophobicContact CG1-CD2 4.42Å; V528-L914 HydrophobicContact CG2-CD1 4.39Å; V528-F919 HydrophobicContact CG1-CE1 4.12Å; V528-F919 HydrophobicContact CG1-CZ 4.2Å
529	Y	90.7	Very high	82.9	Confident	10 Å²	10	34 Å²	34	4%	0.039	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137.3	-165.9	-68.2	-84.4	0	0	0	114.5	L523 G526 V616 V618 D622 V623 L624	L523-Y529 HydrophobicContact CD1-CD1 4.17Å; L523-Y529 HydrophobicContact CD1-CE1 3.58Å; G526-Y529 PolarHBondContact N-OH 3.34Å; G526-Y529 PolarHBondContact O-OH 3.42Å; Y529-V616 WeakPolarHBondContact OH-CG1 3.43Å; Y529-V618 HydrophobicContact CD1-CG2 4.43Å; Y529-V618 HydrophobicContact CD2-CG1 3.91Å; Y529-V618 HydrophobicContact CD2-CG2 4.43Å; Y529-V618 HydrophobicContact CE1-CG2 4.13Å; Y529-V618 HydrophobicContact CE2-CG1 4.35Å; Y529-V618 HydrophobicContact CE2-CG2 4.13Å; Y529-V618 HydrophobicContact CG-CG1 4.05Å; Y529-D622 HydrophobicContact CD2-CB 3.96Å; Y529-D622 PolarHBondContact N-O 3.17Å; Y529-V623 WeakPolarHBondContact O-CA 3.25Å; Y529-L624 PolarHBondContact O-N 3.17Å
530	L	93.8	Very high	83.8	Confident	2 Å²	2	28 Å²	28	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.1	163.7	-178.7	70.1	0	0	0	108.6	V561 G584 A585 L586 A625 V627 L893 W896	L530-V561 HydrophobicContact CD2-CG1 3.64Å; L530-G584 PolarHBondContact N-O 2.94Å; L530-A585 HydrophobicContact CB-CB 4.4Å; L530-A585 CarbonylContact O-C 3.55Å; L530-A585 WeakPolarHBondContact O-CA 3.48Å; L530-A585 WeakPolarHBondContact O-CB 3.29Å; L530-L586 PolarHBondContact O-N 3.34Å; L530-A625 HydrophobicContact CD1-CB 3.63Å; L530-V627 HydrophobicContact CD1-CG2 3.69Å; L530-V627 HydrophobicContact CD2-CG2 4.08Å; L530-V627 HydrophobicContact CG-CG2 3.93Å; L530-L893 HydrophobicContact CD2-CD2 3.82Å; L530-W896 HydrophobicContact CB-CH2 4.08Å; L530-W896 HydrophobicContact CB-CZ3 4.35Å; L530-W896 HydrophobicContact CD1-CD2 4.48Å; L530-W896 HydrophobicContact CD1-CE3 4.28Å; L530-W896 HydrophobicContact CD1-CH2 4.01Å; L530-W896 HydrophobicContact CD1-CZ2 4.21Å; L530-W896 HydrophobicContact CD1-CZ3 4.04Å; L530-W896 HydrophobicContact CD2-CE3 4.45Å; L530-W896 HydrophobicContact CD2-CZ3 4Å; L530-W896 HydrophobicContact CG-CH2 4.45Å; L530-W896 HydrophobicContact CG-CZ3 4.38Å
531	V	93.3	Very high	84.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	117.9	-179.6	175.2	0	0	0	0	109.7	L586 V588 M601 L604 V623 A625 F626 V627	V531-L586 CarbonylContact C-O 3.53Å; V531-L586 WeakPolarHBondContact CA-O 3.22Å; V531-L586 HydrophobicContact CG2-CB 4.25Å; V531-V588 HydrophobicContact CG1-CG2 3.91Å; V531-M601 HydrophobicContact CG1-CE 4.21Å; V531-L604 HydrophobicContact CG1-CD2 4.05Å; V531-L604 HydrophobicContact CG2-CD2 3.98Å; V531-V623 HydrophobicContact CB-CG1 4.21Å; V531-V623 HydrophobicContact CG2-CB 4.29Å; V531-V623 HydrophobicContact CG2-CG1 3.53Å; V531-V623 HydrophobicContact CG2-CG2 3.69Å; V531-A625 PolarHBondContact N-O 2.97Å; V531-F626 HydrophobicContact CB-CD1 3.61Å; V531-F626 HydrophobicContact CB-CE1 3.65Å; V531-F626 HydrophobicContact CB-CG 4.28Å; V531-F626 HydrophobicContact CB-CZ 4.34Å; V531-F626 HydrophobicContact CG1-CD1 3.64Å; V531-F626 HydrophobicContact CG1-CE1 3.59Å; V531-F626 HydrophobicContact CG2-CE1 4.11Å; V531-F626 HydrophobicContact CG2-CZ 4.42Å; V531-F626 CarbonylContact O-C 3.6Å; V531-F626 VanDerWaalsContact O-CA 3.22Å; V531-F626 WeakPolarHBondContact O-CA 3.4Å; V531-V627 PolarHBondContact O-N 3.07Å
532	G	92.2	Very high	84.5	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121.9	-179	0	0	0	0	0	112.2	L586 L587 V588 V627	G532-L586 PolarHBondContact N-O 3.3Å; G532-L587 CarbonylContact O-C 3.57Å; G532-L587 WeakPolarHBondContact O-CA 3.19Å; G532-V588 PolarHBondContact O-N 3.07Å; G532-V627 CarbonylContact C-O 3.52Å; G532-V627 WeakPolarHBondContact CA-O 3.18Å
533	M	91.9	Very high	84.4	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126	175.9	-61.1	-173.6	76.9	0	0	110.7	V588 A597 M601 V627 T628 G629 Q630 T638	M533-V588 HydrophobicContact CG-CB 4.36Å; M533-A597 HydrophobicContact CE-CB 4Å; M533-M601 HydrophobicContact CE-CE 3.96Å; M533-M601 HydrophobicContact CE-CG 3.92Å; M533-M601 HydrophobicContact CE-SD 4.36Å; M533-M601 HydrophobicContact CG-CE 4.08Å; M533-M601 HydrophobicContact SD-CE 3.45Å; M533-M601 WeakPolarHBondContact SD-CE 3.33Å; M533-M601 HydrophobicContact SD-CG 3.88Å; M533-M601 HydrophobicContact SD-SD 3.62Å; M533-M601 VanDerWaalsContact SD-SD 3.62Å; M533-V627 PolarHBondContact N-O 3.36Å; M533-T628 WeakPolarHBondContact O-CA 3.34Å; M533-G629 PolarHBondContact O-N 3.46Å; M533-Q630 HydrophobicContact CB-CG 4.07Å; M533-T638 HydrophobicContact CE-CG2 4.41Å; M533-T638 WeakPolarHBondContact CE-OG1 3.31Å; M533-T638 HydrophobicContact SD-CG2 3.47Å; M533-T638 WeakPolarHBondContact SD-CG2 3.29Å
534	F	89.5	Confident	84.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.1	-176.7	-59.5	-75.4	0	0	0	110.2	L536 L557 A558 V561 L587 V588 D589 S590 V627	F534-L536 HydrophobicContact CB-CD2 3.76Å; F534-L536 HydrophobicContact CB-CG 3.94Å; F534-L536 PolarHBondContact O-N 3.26Å; F534-L557 HydrophobicContact CD1-CB 3.97Å; F534-L557 HydrophobicContact CE1-CB 3.66Å; F534-A558 HydrophobicContact CD2-CB 3.79Å; F534-A558 HydrophobicContact CE2-CB 4.1Å; F534-A558 HydrophobicContact CG-CB 4.08Å; F534-V561 HydrophobicContact CE2-CG2 4.03Å; F534-V561 HydrophobicContact CZ-CG2 3.76Å; F534-L587 HydrophobicContact CE2-CD2 4.12Å; F534-V588 PolarHBondContact N-O 3.34Å; F534-D589 WeakPolarHBondContact O-CA 3.06Å; F534-S590 PolarHBondContact O-N 3.48Å; F534-S590 PolarHBondContact O-OG 2.55Å; F534-V627 HydrophobicContact CZ-CG1 3.96Å
535	D	84.9	Confident	83.9	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.027	25%	0.253	C	S	.	.			trans	-98.4	76.7	175.6	-64.5	-49.1	0	0	0	109.5	R537 H554 S590 C591 G592 Q630 E631 S634	D535-R537 VanDerWaalsContact C-N 3.26Å; D535-R537 PolarHBondContact O-N 3.46Å; D535-H554 VanDerWaalsContact O-CB 3.22Å; D535-H554 WeakPolarHBondContact O-CB 3.43Å; D535-H554 PolarHBondContact O-CD2 3.44Å; D535-S590 VanDerWaalsContact OD1-CB 3.32Å; D535-S590 WeakPolarHBondContact OD1-CB 3.01Å; D535-S590 PolarHBondContact OD1-OG 2.86Å; D535-C591 PolarHBondContact OD1-N 3.01Å; D535-G592 VanDerWaalsContact CG-N 3.26Å; D535-G592 WeakPolarHBondContact OD1-CA 3.46Å; D535-G592 PolarHBondContact OD1-N 3.41Å; D535-Q630 WeakPolarHBondContact OD2-CA 3.45Å; D535-Q630 WeakPolarHBondContact OD2-CB 3.24Å; D535-E631 PolarHBondContact OD2-N 3.37Å; D535-S634 PolarHBondContact OD2-OG 2.88Å
536	L	79.3	Confident	83.6	Confident	8 Å²	8	52 Å²	52	4%	0.042	24%	0.243	C	C	.	.			trans	-77	-17.9	-173.5	-56.4	175.7	0	0	0	112.2	F534 H554 L555 A558 D589 W844	F534-L536 HydrophobicContact CB-CD2 3.76Å; F534-L536 HydrophobicContact CB-CG 3.94Å; F534-L536 PolarHBondContact O-N 3.26Å; L536-H554 HydrophobicContact CD2-CB 4.43Å; L536-H554 WeakPolarHBondContact CD2-O 3.35Å; L536-L555 HydrophobicContact CD2-CB 4.33Å; L536-L555 HydrophobicContact CD2-CD1 4.23Å; L536-A558 HydrophobicContact CD2-CB 3.83Å; L536-D589 HydrophobicContact CB-CB 4.31Å; L536-D589 HydrophobicContact CD1-CB 4.25Å; L536-D589 HydrophobicContact CG-CB 4.45Å; L536-D589 PolarHBondContact N-OD1 3.01Å; L536-W844 HydrophobicContact CB-CH2 4.24Å; L536-W844 HydrophobicContact CB-CZ3 4.43Å; L536-W844 HydrophobicContact CD1-CH2 3.82Å; L536-W844 HydrophobicContact CD1-CZ2 4.04Å
537	R	79.1	Confident	83	Confident	27 Å²	27	53.4 Å²	53.4	10%	0.102	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	169.3	174	-76.1	177.2	-64.7	177.2	4.9	109.8	R519 D535 C546 I547 D589 C591	R519-R537 PolarHBondContact O-NH2 2.83Å; D535-R537 VanDerWaalsContact C-N 3.26Å; D535-R537 PolarHBondContact O-N 3.46Å; R537-C546 HydrophobicContact CB-CB 3.83Å; R537-I547 WeakPolarHBondContact CA-O 3.14Å; R537-I547 VanDerWaalsContact CB-O 3.23Å; R537-I547 WeakPolarHBondContact CB-O 3.3Å; R537-D589 IonicContact CZ-OD2 2.75Å; R537-D589 PolarHBondContact N-OD1 2.77Å; R537-D589 IonicContact NE-OD2 3.65Å; R537-D589 PolarHBondContact NE-OD2 3.28Å; R537-D589 IonicContact NH2-OD2 2.76Å; R537-D589 PolarHBondContact NH2-OD2 3.45Å; R537-C591 CarbonylContact O-C 3.51Å; R537-C591 WeakPolarHBondContact O-CA 3.39Å
538	R	78.5	Confident	82.3	Confident	170 Å²	170	52.4 Å²	52.4	64%	0.642	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	139.5	171.7	177.7	178.4	168.6	90.2	2.3	110.1	C546 I547 C591	R538-C546 WeakPolarHBondContact O-CA 3.25Å; R538-I547 PolarHBondContact N-O 3.49Å; R538-I547 PolarHBondContact O-N 2.81Å; R538-C591 CarbonylContact C-O 3.54Å
539	W	80.2	Confident	81.1	Confident	66 Å²	66	53.5 Å²	53.5	25%	0.25	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	128.6	171.9	-177.5	-100.3	0	0	0	111	K544 C591 E596	W539-K544 HydrophobicContact CH2-CB 4.47Å; W539-K544 HydrophobicContact CZ2-CB 4.18Å; W539-C591 VanDerWaalsContact CB-O 3.3Å; W539-C591 WeakPolarHBondContact CB-O 3.35Å; W539-C591 PolarHBondContact N-O 2.74Å; W539-E596 HydrophobicContact CE3-CG 4.04Å; W539-E596 HydrophobicContact CZ3-CG 3.85Å
540	D	79.6	Confident	79.5	Confident	39 Å²	39	57.5 Å²	57.5	21%	0.209	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	112.3	169.5	-179.8	-12.9	0	0	0	109.3	T542 L543 K544 R545 I547	D540-T542 PolarHBondContact O-N 2.82Å; D540-T542 WeakPolarHBondContact OD1-CA 3.46Å; D540-T542 WeakPolarHBondContact OD1-CB 3.37Å; D540-T542 PolarHBondContact OD1-N 2.99Å; D540-T542 PolarHBondContact OD1-OG1 2.91Å; D540-T542 PolarHBondContact OD2-OG1 3.01Å; D540-L543 HydrophobicContact CB-CB 4.36Å; D540-L543 PolarHBondContact OD1-N 3.32Å; D540-L543 WeakPolarHBondContact OD2-CB 3.34Å; D540-L543 WeakPolarHBondContact OD2-CD1 3.3Å; D540-L543 WeakPolarHBondContact OD2-CG 3.44Å; D540-K544 VanDerWaalsContact O-CA 3.3Å; D540-K544 WeakPolarHBondContact O-CA 3.49Å; D540-K544 PolarHBondContact O-N 3.03Å; D540-R545 PolarHBondContact N-O 3.39Å; D540-I547 HydrophobicContact CB-CD1 3.55Å; D540-I547 HydrophobicContact CB-CG1 4.05Å; D540-I547 VanDerWaalsContact OD2-CD1 3.24Å; D540-I547 WeakPolarHBondContact OD2-CD1 3.5Å
541	E	77.5	Confident	77.8	Confident	165 Å²	165	59.4 Å²	59.4	77%	0.771	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.8	177.7	-64.3	-162	158.2	0	0	113.3
542	T	79.8	Confident	76.3	Confident	121 Å²	121	60.2 Å²	60.2	74%	0.742	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-40.8	-177.1	75.8	0	0	0	0	111.5	D540	D540-T542 PolarHBondContact O-N 2.82Å; D540-T542 WeakPolarHBondContact OD1-CA 3.46Å; D540-T542 WeakPolarHBondContact OD1-CB 3.37Å; D540-T542 PolarHBondContact OD1-N 2.99Å; D540-T542 PolarHBondContact OD1-OG1 2.91Å; D540-T542 PolarHBondContact OD2-OG1 3.01Å
543	L	77.4	Confident	75	Confident	94 Å²	94	64.2 Å²	64.2	49%	0.492	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-4.6	179.4	-66.4	177.8	0	0	0	113.7	D540 R545 I547	D540-L543 HydrophobicContact CB-CB 4.36Å; D540-L543 PolarHBondContact OD1-N 3.32Å; D540-L543 WeakPolarHBondContact OD2-CB 3.34Å; D540-L543 WeakPolarHBondContact OD2-CD1 3.3Å; D540-L543 WeakPolarHBondContact OD2-CG 3.44Å; L543-R545 VanDerWaalsContact C-N 3.28Å; L543-R545 HydrophobicContact CB-CG 3.91Å; L543-R545 PolarHBondContact O-N 3.39Å; L543-I547 HydrophobicContact CD1-CD1 3.99Å
544	K	80.1	Confident	74.2	Confident	162 Å²	162	65.4 Å²	65.4	70%	0.704	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	48.1	179.8	-62.4	-171	177.5	-173.7	0	113.1	W539 D540	W539-K544 HydrophobicContact CH2-CB 4.47Å; W539-K544 HydrophobicContact CZ2-CB 4.18Å; D540-K544 VanDerWaalsContact O-CA 3.3Å; D540-K544 WeakPolarHBondContact O-CA 3.49Å; D540-K544 PolarHBondContact O-N 3.03Å
545	R	75.1	Confident	73.6	Confident	127 Å²	127	66.5 Å²	66.5	48%	0.479	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	159.4	-177.5	70.7	-173.9	-171.4	172.8	3.8	110.7	D540 L543 I547	D540-R545 PolarHBondContact N-O 3.39Å; L543-R545 VanDerWaalsContact C-N 3.28Å; L543-R545 HydrophobicContact CB-CG 3.91Å; L543-R545 PolarHBondContact O-N 3.39Å; R545-I547 HydrophobicContact CG-CD1 4.36Å; R545-I547 HydrophobicContact CG-CG1 3.97Å
546	C	76.5	Confident	73.3	Confident	26 Å²	26	66.3 Å²	66.3	18%	0.176	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	133.4	168.4	-44.3	0	0	0	0	110.5	R537 R538 C591	R537-C546 HydrophobicContact CB-CB 3.83Å; R538-C546 WeakPolarHBondContact O-CA 3.25Å; C546-C591 HydrophobicContact CB-CB 3.69Å; C546-C591 WeakPolarHBondContact CB-SG 3.16Å; C546-C591 WeakPolarHBondContact SG-CB 3.42Å; C546-C591 CovalentContact SG-SG 2.02Å; C546-C591 PolarHBondContact SG-SG 2.75Å
547	I	72.7	Confident	73.6	Confident	38 Å²	38	66.5 Å²	66.5	20%	0.195	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143.2	178.4	-57.5	-171.4	0	0	0	108.1	R537 R538 D540 L543 R545 S549	R537-I547 WeakPolarHBondContact CA-O 3.14Å; R537-I547 VanDerWaalsContact CB-O 3.23Å; R537-I547 WeakPolarHBondContact CB-O 3.3Å; R538-I547 PolarHBondContact N-O 3.49Å; R538-I547 PolarHBondContact O-N 2.81Å; D540-I547 HydrophobicContact CB-CD1 3.55Å; D540-I547 HydrophobicContact CB-CG1 4.05Å; D540-I547 VanDerWaalsContact OD2-CD1 3.24Å; D540-I547 WeakPolarHBondContact OD2-CD1 3.5Å; L543-I547 HydrophobicContact CD1-CD1 3.99Å; R545-I547 HydrophobicContact CG-CD1 4.36Å; R545-I547 HydrophobicContact CG-CG1 3.97Å; I547-S549 PolarHBondContact O-N 3.37Å
548	P	67.4	Low	73.9	Confident	37 Å²	37	65.4 Å²	65.4	24%	0.24	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-42.6	129.1	174.5	-36.3	43.4	0	0	0	113.9	F848 E851	P548-F848 HydrophobicContact CB-CD2 4.11Å; P548-E851 HydrophobicContact CB-CB 4.49Å; P548-E851 HydrophobicContact CB-CG 4.5Å; P548-E851 WeakPolarHBondContact CD-OE2 3.45Å; P548-E851 VanDerWaalsContact CG-OE2 3.23Å; P548-E851 WeakPolarHBondContact CG-OE2 3.24Å
549	S	64.8	Low	74.1	Confident	25 Å²	25	57.9 Å²	57.9	18%	0.175	30%	0.302	C	S	.	.			trans	-81.5	148.7	175.2	-170.2	0	0	0	0	109.8	I547 A551	I547-S549 PolarHBondContact O-N 3.37Å; S549-A551 VanDerWaalsContact C-N 3.27Å; S549-A551 PolarHBondContact OG-N 2.87Å
550	T	56	Low	74.4	Confident	94 Å²	94	54.8 Å²	54.8	58%	0.577	29%	0.29	S	S	*	.	S	Bend	trans	-78.3	-13.1	171.5	50.3	0	0	0	0	112.9	F791	T550-F791 VanDerWaalsContact CB-CZ 3.47Å; T550-F791 HydrophobicContact CG2-CD1 4.46Å; T550-F791 HydrophobicContact CG2-CE1 3.46Å; T550-F791 VanDerWaalsContact CG2-CE1 3.46Å; T550-F791 HydrophobicContact CG2-CZ 3.62Å; T550-F791 VanDerWaalsContact O-CE2 3.29Å; T550-F791 WeakPolarHBondContact O-CE2 3.3Å
551	A	58.5	Low	74.9	Confident	41 Å²	41	53 Å²	53	34%	0.339	28%	0.28	S	S	.	.			trans	-93	130.3	177.2	0	0	0	0	0	111.6	S549	S549-A551 VanDerWaalsContact C-N 3.27Å; S549-A551 PolarHBondContact OG-N 2.87Å
552	N	62	Low	75.3	Confident	18 Å²	18	45.7 Å²	45.7	10%	0.096	25%	0.247	C	C	.	.			trans	-86.4	-15.7	-177.6	-69.4	-38.7	0	0	0	114	H554 L555 S556 M877 Q878	N552-H554 PolarHBondContact O-N 3.24Å; N552-L555 WeakPolarHBondContact O-CB 3.47Å; N552-L555 PolarHBondContact O-N 2.97Å; N552-S556 PolarHBondContact O-N 3.32Å; N552-M877 HydrophobicContact CB-CE 4.02Å; N552-M877 VanDerWaalsContact O-CE 3.28Å; N552-M877 WeakPolarHBondContact O-CE 3.15Å; N552-Q878 PolarHBondContact ND2-O 3.02Å
553	D	64.7	Low	75.6	Confident	83 Å²	83	41 Å²	41	44%	0.444	22%	0.216	S	C	.	.	H	α-helix	trans	-67.5	-33.1	-158.7	-53.8	-28.8	0	0	0	113.6	L555 S556 L557	D553-L555 VanDerWaalsContact C-N 3.31Å; D553-L555 PolarHBondContact O-N 2.88Å; D553-S556 PolarHBondContact O-N 2.9Å; D553-S556 PolarHBondContact O-OG 3.46Å; D553-L557 WeakPolarHBondContact O-CG 3.45Å; D553-L557 PolarHBondContact O-N 3.46Å
554	H	75.4	Confident	76.2	Confident	28 Å²	28	36.6 Å²	36.6	13%	0.13	19%	0.193	C	C	.	.	H	α-helix	trans	-71	-28.4	174.7	-56.4	-72.2	0	0	0	112.5	D535 L536 N552 A558 G629	D535-H554 VanDerWaalsContact O-CB 3.22Å; D535-H554 WeakPolarHBondContact O-CB 3.43Å; D535-H554 PolarHBondContact O-CD2 3.44Å; L536-H554 HydrophobicContact CD2-CB 4.43Å; L536-H554 WeakPolarHBondContact CD2-O 3.35Å; N552-H554 PolarHBondContact O-N 3.24Å; H554-A558 PolarHBondContact O-N 2.9Å; H554-A558 VanDerWaalsContact O-N 3.09Å; H554-G629 PolarHBondContact ND1-O 3.31Å
555	L	77.1	Confident	76.6	Confident	23 Å²	23	29.7 Å²	29.7	12%	0.12	16%	0.164	C	C	.	.	H	α-helix	trans	-76.2	-32.4	176.8	-177.8	65.7	0	0	0	111.6	L536 N552 D553 A558 A559 W844 L845 F848 M877	L536-L555 HydrophobicContact CD2-CB 4.33Å; L536-L555 HydrophobicContact CD2-CD1 4.23Å; N552-L555 WeakPolarHBondContact O-CB 3.47Å; N552-L555 PolarHBondContact O-N 2.97Å; D553-L555 VanDerWaalsContact C-N 3.31Å; D553-L555 PolarHBondContact O-N 2.88Å; L555-A558 PolarHBondContact O-N 3.28Å; L555-A559 VanDerWaalsContact O-CB 3.29Å; L555-A559 WeakPolarHBondContact O-CB 3.38Å; L555-A559 PolarHBondContact O-N 2.93Å; L555-W844 HydrophobicContact CD1-CH2 4.26Å; L555-L845 HydrophobicContact CD1-CD1 3.98Å; L555-L845 HydrophobicContact CD2-CD1 3.98Å; L555-F848 HydrophobicContact CD2-CD1 3.94Å; L555-F848 HydrophobicContact CD2-CE1 3.4Å; L555-F848 HydrophobicContact CD2-CZ 3.78Å; L555-M877 HydrophobicContact CB-CE 3.63Å; L555-M877 HydrophobicContact CD2-CE 3.88Å; L555-M877 HydrophobicContact CG-CE 3.7Å
556	S	78.3	Confident	77.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-70.5	-36.4	175.2	60.9	0	0	0	0	111.1	N552 D553 A559 T560 M877 E886	N552-S556 PolarHBondContact O-N 3.32Å; D553-S556 PolarHBondContact O-N 2.9Å; D553-S556 PolarHBondContact O-OG 3.46Å; S556-A559 PolarHBondContact O-N 3.5Å; S556-T560 WeakPolarHBondContact O-CB 3.32Å; S556-T560 PolarHBondContact O-N 3.25Å; S556-T560 PolarHBondContact O-OG1 3.48Å; S556-M877 VanDerWaalsContact N-CE 3.25Å; S556-E886 WeakPolarHBondContact CB-OE1 3.26Å; S556-E886 PolarHBondContact OG-OE1 3.13Å
557	L	85.3	Confident	77.6	Confident	12 Å²	12	27.9 Å²	27.9	6%	0.063	16%	0.16	C	C	.	.	H	α-helix	trans	-61.4	-48.2	170.2	-67	170.7	0	0	0	111.9	F534 D553 A559 T560 V561 V655 E886 L889	F534-L557 HydrophobicContact CD1-CB 3.97Å; F534-L557 HydrophobicContact CE1-CB 3.66Å; D553-L557 WeakPolarHBondContact O-CG 3.45Å; D553-L557 PolarHBondContact O-N 3.46Å; L557-A559 PolarHBondContact O-N 3.05Å; L557-T560 WeakPolarHBondContact O-CB 3.49Å; L557-T560 PolarHBondContact O-N 3.47Å; L557-T560 VanDerWaalsContact O-N 3.17Å; L557-V561 PolarHBondContact O-N 2.82Å; L557-V655 HydrophobicContact CD1-CG1 4.42Å; L557-V655 HydrophobicContact CD2-CG1 4.43Å; L557-V655 HydrophobicContact CD2-CG2 4.31Å; L557-E886 HydrophobicContact CD2-CG 4.04Å; L557-E886 HydrophobicContact CG-CG 4.49Å; L557-L889 HydrophobicContact CB-CD2 4.11Å; L557-L889 HydrophobicContact CD2-CB 4.37Å; L557-L889 HydrophobicContact CD2-CD2 3.78Å
558	A	84.5	Confident	78.5	Confident	4 Å²	4	26.1 Å²	26.1	3%	0.033	15%	0.151	C	C	.	.	H	α-helix	trans	-62.9	-41.9	176.7	0	0	0	0	0	112.9	F534 L536 H554 L555 T560 V561 V562 L587	F534-A558 HydrophobicContact CD2-CB 3.79Å; F534-A558 HydrophobicContact CE2-CB 4.1Å; F534-A558 HydrophobicContact CG-CB 4.08Å; L536-A558 HydrophobicContact CD2-CB 3.83Å; H554-A558 PolarHBondContact O-N 2.9Å; H554-A558 VanDerWaalsContact O-N 3.09Å; L555-A558 PolarHBondContact O-N 3.28Å; A558-T560 VanDerWaalsContact C-N 3.28Å; A558-T560 PolarHBondContact O-N 2.88Å; A558-V561 WeakPolarHBondContact O-CB 3.43Å; A558-V561 PolarHBondContact O-N 3.42Å; A558-V562 PolarHBondContact O-N 3.48Å; A558-L587 HydrophobicContact CB-CD1 4.44Å
559	A	82.8	Confident	79.5	Confident	13 Å²	13	27.8 Å²	27.8	11%	0.107	16%	0.155	C	C	.	.	H	α-helix	trans	-65.1	-31	174.5	0	0	0	0	0	112.6	L555 S556 L557 V561 V562 Y563 L832	L555-A559 VanDerWaalsContact O-CB 3.29Å; L555-A559 WeakPolarHBondContact O-CB 3.38Å; L555-A559 PolarHBondContact O-N 2.93Å; S556-A559 PolarHBondContact O-N 3.5Å; L557-A559 PolarHBondContact O-N 3.05Å; A559-V561 VanDerWaalsContact C-N 3.34Å; A559-V562 PolarHBondContact O-N 2.77Å; A559-Y563 PolarHBondContact O-N 2.89Å; A559-L832 HydrophobicContact CB-CD2 3.67Å
560	T	87.2	Confident	80.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.7	-36	174.2	-61.3	0	0	0	0	111.9	S556 L557 A558 Y563 V564 L828 E886 L889 M890	S556-T560 WeakPolarHBondContact O-CB 3.32Å; S556-T560 PolarHBondContact O-N 3.25Å; S556-T560 PolarHBondContact O-OG1 3.48Å; L557-T560 WeakPolarHBondContact O-CB 3.49Å; L557-T560 PolarHBondContact O-N 3.47Å; L557-T560 VanDerWaalsContact O-N 3.17Å; A558-T560 VanDerWaalsContact C-N 3.28Å; A558-T560 PolarHBondContact O-N 2.88Å; T560-Y563 PolarHBondContact O-N 2.85Å; T560-V564 WeakPolarHBondContact O-CG2 3.24Å; T560-V564 PolarHBondContact O-N 3.39Å; T560-L828 HydrophobicContact CG2-CD1 4.2Å; T560-L828 HydrophobicContact CG2-CD2 4.13Å; T560-E886 WeakPolarHBondContact CG2-O 3.43Å; T560-L889 HydrophobicContact CG2-CD2 4.49Å; T560-L889 HydrophobicContact CG2-CG 4.43Å; T560-M890 HydrophobicContact CG2-CB 3.85Å
561	V	89.2	Confident	82.1	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-48.7	173.4	-175.2	0	0	0	0	110.6	L530 F534 L557 A558 A559 V564 L565 A585 L587 L889 L893	L530-V561 HydrophobicContact CD2-CG1 3.64Å; F534-V561 HydrophobicContact CE2-CG2 4.03Å; F534-V561 HydrophobicContact CZ-CG2 3.76Å; L557-V561 PolarHBondContact O-N 2.82Å; A558-V561 WeakPolarHBondContact O-CB 3.43Å; A558-V561 PolarHBondContact O-N 3.42Å; A559-V561 VanDerWaalsContact C-N 3.34Å; V561-V564 PolarHBondContact O-N 2.85Å; V561-L565 HydrophobicContact CG1-CD1 4.25Å; V561-L565 WeakPolarHBondContact O-CG 3.48Å; V561-L565 PolarHBondContact O-N 2.93Å; V561-L565 VanDerWaalsContact O-N 3.14Å; V561-A585 HydrophobicContact CG1-CB 4.44Å; V561-L587 HydrophobicContact CB-CD2 4.25Å; V561-L587 HydrophobicContact CG1-CD2 4.12Å; V561-L587 HydrophobicContact CG2-CD2 4.45Å; V561-L889 HydrophobicContact CG2-CD2 4.41Å; V561-L893 HydrophobicContact CB-CD1 4.34Å; V561-L893 HydrophobicContact CG1-CD1 4.39Å; V561-L893 HydrophobicContact CG2-CD1 4.04Å
562	V	86.4	Confident	83.5	Confident	12 Å²	12	35.1 Å²	35.1	7%	0.073	17%	0.169	C	C	.	.	H	α-helix	trans	-62.2	-45.9	178.7	-176.3	0	0	0	0	111.1	Y524 A558 A559 V564 L565 E566 L587	Y524-V562 HydrophobicContact CD2-CG1 4.14Å; Y524-V562 HydrophobicContact CE2-CG1 4.05Å; A558-V562 PolarHBondContact O-N 3.48Å; A559-V562 PolarHBondContact O-N 2.77Å; V562-V564 VanDerWaalsContact C-N 3.34Å; V562-V564 PolarHBondContact O-N 3.16Å; V562-L565 PolarHBondContact O-N 2.71Å; V562-E566 PolarHBondContact O-N 3.39Å; V562-L587 HydrophobicContact CG2-CD1 4.01Å
563	Y	86.7	Confident	84.7	Confident	23 Å²	23	38.1 Å²	38.1	9%	0.09	19%	0.191	C	C	.	.	H	α-helix	trans	-54.8	-45.4	176.8	173.5	-100.7	0	0	0	112.7	A559 T560 T567 L828 F831 M890	A559-Y563 PolarHBondContact O-N 2.89Å; T560-Y563 PolarHBondContact O-N 2.85Å; Y563-T567 HydrophobicContact CD2-CG2 3.95Å; Y563-T567 HydrophobicContact CE2-CG2 3.69Å; Y563-T567 WeakPolarHBondContact O-CB 3.46Å; Y563-T567 WeakPolarHBondContact O-CG2 3.38Å; Y563-T567 PolarHBondContact O-N 2.87Å; Y563-T567 PolarHBondContact O-OG1 3.42Å; Y563-L828 HydrophobicContact CD1-CD1 3.72Å; Y563-L828 HydrophobicContact CE1-CB 4.16Å; Y563-L828 HydrophobicContact CE1-CD1 4.22Å; Y563-L828 HydrophobicContact CG-CD1 3.92Å; Y563-F831 HydrophobicContact CD2-CB 3.64Å; Y563-F831 AromaticContact CD2-CD1 3.82Å; Y563-F831 HydrophobicContact CD2-CD1 3.82Å; Y563-F831 AromaticContact CD2-CD2 3.68Å; Y563-F831 HydrophobicContact CD2-CD2 3.68Å; Y563-F831 HydrophobicContact CD2-CE1 4.35Å; Y563-F831 HydrophobicContact CD2-CE2 4.21Å; Y563-F831 AromaticContact CD2-CG 3.44Å; Y563-F831 HydrophobicContact CD2-CG 3.44Å; Y563-F831 VanDerWaalsContact CD2-CG 3.44Å; Y563-F831 HydrophobicContact CE2-CB 3.82Å; Y563-F831 HydrophobicContact CE2-CD2 4.35Å; Y563-F831 HydrophobicContact CE2-CG 4.12Å; Y563-F831 HydrophobicContact CG-CD1 4.19Å; Y563-F831 HydrophobicContact CG-CG 4.26Å; Y563-M890 HydrophobicContact CE1-CG 4.42Å; Y563-M890 HydrophobicContact CE1-SD 4.12Å
564	V	89.6	Confident	85.8	Confident	1 Å²	1	46 Å²	46	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-66	-44.6	178.5	175.2	0	0	0	0	110.8	T560 V561 V562 E566 T567 V568 M890 L893 E894	T560-V564 WeakPolarHBondContact O-CG2 3.24Å; T560-V564 PolarHBondContact O-N 3.39Å; V561-V564 PolarHBondContact O-N 2.85Å; V562-V564 VanDerWaalsContact C-N 3.34Å; V562-V564 PolarHBondContact O-N 3.16Å; V564-E566 VanDerWaalsContact C-N 3.32Å; V564-E566 PolarHBondContact O-N 3.28Å; V564-T567 PolarHBondContact O-N 3.43Å; V564-V568 HydrophobicContact CG1-CB 4.12Å; V564-V568 WeakPolarHBondContact O-CB 3.48Å; V564-V568 WeakPolarHBondContact O-CG1 3.35Å; V564-V568 PolarHBondContact O-N 3.39Å; V564-M890 HydrophobicContact CG2-CB 4.18Å; V564-M890 HydrophobicContact CG2-CG 3.77Å; V564-L893 HydrophobicContact CB-CB 4.24Å; V564-L893 HydrophobicContact CG1-CB 3.81Å; V564-L893 HydrophobicContact CG2-CB 4.18Å; V564-L893 HydrophobicContact CG2-CD1 4.45Å; V564-E894 HydrophobicContact CG1-CG 3.9Å; V564-E894 HydrophobicContact CG2-CG 4.46Å
565	L	88.7	Confident	86.4	Confident	17 Å²	17	48.6 Å²	48.6	9%	0.089	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-36.9	-179	-66.9	178.9	0	0	0	112.9	Y524 V561 V562 L583 A585 W896	Y524-L565 HydrophobicContact CD1-CD1 4.47Å; V561-L565 HydrophobicContact CG1-CD1 4.25Å; V561-L565 WeakPolarHBondContact O-CG 3.48Å; V561-L565 PolarHBondContact O-N 2.93Å; V561-L565 VanDerWaalsContact O-N 3.14Å; V562-L565 PolarHBondContact O-N 2.71Å; L565-L583 HydrophobicContact CD2-CB 3.77Å; L565-L583 HydrophobicContact CD2-CD1 3.9Å; L565-L583 HydrophobicContact CD2-CG 4.48Å; L565-A585 HydrophobicContact CD1-CB 3.62Å; L565-W896 HydrophobicContact CD2-CZ3 4.48Å
566	E	84.9	Confident	86.9	Confident	86 Å²	86	52.5 Å²	52.5	40%	0.402	25%	0.25	S	C	.	.	H	α-helix	trans	-72.2	-41.2	174.5	-71.4	-173.7	166.3	0	0	113.1	Y524 V562 V564 Q570	Y524-E566 HydrophobicContact CE2-CG 4.31Å; Y524-E566 VanDerWaalsContact OH-CG 3.31Å; Y524-E566 WeakPolarHBondContact OH-CG 3.32Å; V562-E566 PolarHBondContact O-N 3.39Å; V564-E566 VanDerWaalsContact C-N 3.32Å; V564-E566 PolarHBondContact O-N 3.28Å; E566-Q570 PolarHBondContact O-NE2 2.94Å
567	T	88.3	Confident	87.4	Confident	30 Å²	30	52.8 Å²	52.8	18%	0.184	25%	0.251	C	S	.	.	H	α-helix	trans	-95.9	-27	-168.4	62.7	0	0	0	0	115	Y563 V564 K569 Q570 K571	Y563-T567 HydrophobicContact CD2-CG2 3.95Å; Y563-T567 HydrophobicContact CE2-CG2 3.69Å; Y563-T567 WeakPolarHBondContact O-CB 3.46Å; Y563-T567 WeakPolarHBondContact O-CG2 3.38Å; Y563-T567 PolarHBondContact O-N 2.87Å; Y563-T567 PolarHBondContact O-OG1 3.42Å; V564-T567 PolarHBondContact O-N 3.43Å; T567-K569 PolarHBondContact O-N 3.22Å; T567-Q570 WeakPolarHBondContact O-CA 3.47Å; T567-Q570 WeakPolarHBondContact O-CB 3.17Å; T567-Q570 PolarHBondContact O-N 3.09Å; T567-K571 WeakPolarHBondContact O-CB 3.42Å; T567-K571 PolarHBondContact O-N 2.84Å
568	V	90.4	Very high	87.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.7	-43.2	-171	67.9	0	0	0	0	112.9	V564 Q570 Y572 L577 E894 V897	V564-V568 HydrophobicContact CG1-CB 4.12Å; V564-V568 WeakPolarHBondContact O-CB 3.48Å; V564-V568 WeakPolarHBondContact O-CG1 3.35Å; V564-V568 PolarHBondContact O-N 3.39Å; V568-Q570 VanDerWaalsContact C-N 3.3Å; V568-Q570 PolarHBondContact O-N 2.68Å; V568-Y572 HydrophobicContact CG2-CD2 3.88Å; V568-Y572 HydrophobicContact CG2-CE2 4.34Å; V568-Y572 WeakPolarHBondContact O-CD2 3.31Å; V568-Y572 PolarHBondContact O-N 3.43Å; V568-L577 HydrophobicContact CG2-CD1 4.04Å; V568-E894 HydrophobicContact CG2-CG 4.22Å; V568-V897 HydrophobicContact CG1-CG1 4.16Å; V568-V897 HydrophobicContact CG1-CG2 4.29Å; V568-V897 HydrophobicContact CG2-CB 4.16Å; V568-V897 HydrophobicContact CG2-CG1 4.16Å
569	K	88.8	Confident	87.6	Confident	72 Å²	72	53.1 Å²	53.1	31%	0.313	25%	0.254	S	S	.	.	H	α-helix	trans	-69.8	-25.6	178.4	-64.6	-156.4	-179.4	-158.2	0	113.2	T567 S573 L577 L578 V581	T567-K569 PolarHBondContact O-N 3.22Å; K569-S573 WeakPolarHBondContact O-CA 3.33Å; K569-S573 PolarHBondContact O-N 3.36Å; K569-L577 WeakPolarHBondContact CD-O 3.44Å; K569-L577 WeakPolarHBondContact CE-O 3.23Å; K569-L577 PolarHBondContact NZ-O 3.1Å; K569-L578 PolarHBondContact NZ-O 3Å; K569-V581 PolarHBondContact NZ-O 2.7Å
570	Q	87.6	Confident	87.7	Confident	145 Å²	145	58.2 Å²	58.2	68%	0.678	28%	0.279	S	S	*	.	H	α-helix	trans	-80.1	-50	175.7	-53.2	-175.6	18.9	0	0	110.4	E566 T567 V568 Y572 S573	E566-Q570 PolarHBondContact O-NE2 2.94Å; T567-Q570 WeakPolarHBondContact O-CA 3.47Å; T567-Q570 WeakPolarHBondContact O-CB 3.17Å; T567-Q570 PolarHBondContact O-N 3.09Å; V568-Q570 VanDerWaalsContact C-N 3.3Å; V568-Q570 PolarHBondContact O-N 2.68Å; Q570-Y572 VanDerWaalsContact C-N 3.32Å; Q570-Y572 PolarHBondContact O-N 3.43Å; Q570-S573 VanDerWaalsContact O-CB 3.32Å; Q570-S573 WeakPolarHBondContact O-CB 3.45Å; Q570-S573 PolarHBondContact O-N 2.93Å; Q570-S573 PolarHBondContact O-OG 3Å; Q570-S573 VanDerWaalsContact O-OG 3.08Å
571	K	87	Confident	87.6	Confident	98 Å²	98	58.5 Å²	58.5	43%	0.426	28%	0.281	S	S	.	.	H	α-helix	trans	-55.3	-44.3	178.3	-171.2	-177.8	-176	-168.6	0	112	T567 E894	T567-K571 WeakPolarHBondContact O-CB 3.42Å; T567-K571 PolarHBondContact O-N 2.84Å; K571-E894 WeakPolarHBondContact CD-OE1 3.2Å; K571-E894 IonicContact NZ-OE1 2.78Å; K571-E894 PolarHBondContact NZ-OE1 3.33Å; K571-E894 IonicContact NZ-OE2 3.92Å; K571-E894 PolarHBondContact NZ-OE2 3.12Å
572	Y	89.2	Confident	87.6	Confident	72 Å²	72	65.7 Å²	65.7	28%	0.282	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	32.9	179.3	-60	-71.4	0	0	0	113.2	V568 Q570 R574 L575 L577 E894 I898	V568-Y572 HydrophobicContact CG2-CD2 3.88Å; V568-Y572 HydrophobicContact CG2-CE2 4.34Å; V568-Y572 WeakPolarHBondContact O-CD2 3.31Å; V568-Y572 PolarHBondContact O-N 3.43Å; Q570-Y572 VanDerWaalsContact C-N 3.32Å; Q570-Y572 PolarHBondContact O-N 3.43Å; Y572-R574 PolarHBondContact O-N 3.32Å; Y572-L575 HydrophobicContact CD1-CD1 4.38Å; Y572-L575 HydrophobicContact CG-CD1 4.47Å; Y572-L575 WeakPolarHBondContact O-CB 3.39Å; Y572-L575 PolarHBondContact O-N 3.09Å; Y572-L577 HydrophobicContact CD2-CD1 4.42Å; Y572-L577 HydrophobicContact CG-CD1 4.45Å; Y572-E894 HydrophobicContact CE2-CB 4.28Å; Y572-E894 HydrophobicContact CE2-CG 4.26Å; Y572-E894 WeakPolarHBondContact CE2-OE2 3.45Å; Y572-E894 PolarHBondContact OH-OE2 3.02Å; Y572-I898 HydrophobicContact CD2-CD1 4.44Å; Y572-I898 HydrophobicContact CE2-CD1 4.36Å
573	S	86.9	Confident	87.7	Confident	81 Å²	81	65.9 Å²	65.9	57%	0.566	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-47.1	-34.5	179.4	45.6	0	0	0	0	114.7	K569 Q570 L575 N576	K569-S573 WeakPolarHBondContact O-CA 3.33Å; K569-S573 PolarHBondContact O-N 3.36Å; Q570-S573 VanDerWaalsContact O-CB 3.32Å; Q570-S573 WeakPolarHBondContact O-CB 3.45Å; Q570-S573 PolarHBondContact O-N 2.93Å; Q570-S573 PolarHBondContact O-OG 3Å; Q570-S573 VanDerWaalsContact O-OG 3.08Å; S573-L575 VanDerWaalsContact C-N 3.28Å; S573-L575 PolarHBondContact O-N 2.85Å; S573-N576 PolarHBondContact O-N 2.83Å
574	R	88.2	Confident	87.9	Confident	249 Å²	249	64.8 Å²	64.8	94%	0.94	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-62.6	-25.7	175.7	-65.9	-175.9	-178.2	175.6	1.3	114.9	Y572	Y572-R574 PolarHBondContact O-N 3.32Å
575	L	87.8	Confident	87.9	Confident	82 Å²	82	64.7 Å²	64.7	43%	0.429	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-83.4	-15.2	179.5	-61.5	-177.3	0	0	0	112.7	Y572 S573 L577 I898 K905	Y572-L575 HydrophobicContact CD1-CD1 4.38Å; Y572-L575 HydrophobicContact CG-CD1 4.47Å; Y572-L575 WeakPolarHBondContact O-CB 3.39Å; Y572-L575 PolarHBondContact O-N 3.09Å; S573-L575 VanDerWaalsContact C-N 3.28Å; S573-L575 PolarHBondContact O-N 2.85Å; L575-L577 HydrophobicContact CB-CD2 3.68Å; L575-L577 HydrophobicContact CB-CG 3.99Å; L575-L577 HydrophobicContact CD1-CD2 4.02Å; L575-I898 HydrophobicContact CD1-CG1 4.4Å; L575-K905 PolarHBondContact O-NZ 2.67Å
576	N	87.6	Confident	88	Confident	105 Å²	105	63.9 Å²	63.9	56%	0.561	30%	0.299	S	S	*	.			trans	46.8	65.4	-172.5	-170.5	21.4	0	0	0	111.4	S573 L578 P579 K905	S573-N576 PolarHBondContact O-N 2.83Å; N576-L578 PolarHBondContact O-N 3.45Å; N576-P579 WeakPolarHBondContact O-CD 3.16Å; N576-K905 PolarHBondContact O-NZ 2.78Å
577	L	89.1	Confident	88.2	Confident	6 Å²	6	59.9 Å²	59.9	3%	0.031	28%	0.281	C	S	.	.			trans	-72.2	123.2	-172.5	-62.1	175.8	0	0	0	111.7	V568 K569 Y572 L575 V897 I898 D901	V568-L577 HydrophobicContact CG2-CD1 4.04Å; K569-L577 WeakPolarHBondContact CD-O 3.44Å; K569-L577 WeakPolarHBondContact CE-O 3.23Å; K569-L577 PolarHBondContact NZ-O 3.1Å; Y572-L577 HydrophobicContact CD2-CD1 4.42Å; Y572-L577 HydrophobicContact CG-CD1 4.45Å; L575-L577 HydrophobicContact CB-CD2 3.68Å; L575-L577 HydrophobicContact CB-CG 3.99Å; L575-L577 HydrophobicContact CD1-CD2 4.02Å; L577-V897 HydrophobicContact CB-CG1 4.48Å; L577-V897 HydrophobicContact CD1-CG1 4.1Å; L577-I898 HydrophobicContact CD1-CG1 4.28Å; L577-I898 HydrophobicContact CD2-CG1 4.22Å; L577-D901 HydrophobicContact CD2-CB 3.87Å; L577-D901 WeakPolarHBondContact CD2-OD2 3.2Å
578	L	88.1	Confident	88.2	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.016	27%	0.272	C	S	.	.	S	Bend	trans	51.3	66.4	176.8	-63	173.7	0	0	0	112.5	K569 N576 N580 V581 L583 V897 T900 D901 Y904	K569-L578 PolarHBondContact NZ-O 3Å; N576-L578 PolarHBondContact O-N 3.45Å; L578-N580 PolarHBondContact O-N 2.9Å; L578-V581 HydrophobicContact CB-CB 4.32Å; L578-V581 PolarHBondContact O-N 2.97Å; L578-L583 HydrophobicContact CD1-CD1 4.2Å; L578-L583 HydrophobicContact CD1-CD2 3.64Å; L578-L583 HydrophobicContact CD1-CG 4.07Å; L578-V897 HydrophobicContact CD1-CG1 4.48Å; L578-T900 HydrophobicContact CD1-CG2 4.17Å; L578-T900 HydrophobicContact CD2-CG2 4.34Å; L578-D901 HydrophobicContact CD2-CB 4.15Å; L578-D901 HydrophobicContact CG-CB 4.12Å; L578-D901 PolarHBondContact N-OD1 2.03Å; L578-Y904 HydrophobicContact CD2-CD1 3.64Å; L578-Y904 HydrophobicContact CD2-CE1 4.41Å; L578-Y904 HydrophobicContact CD2-CG 3.77Å
579	P	85.2	Confident	88	Confident	20 Å²	20	58.7 Å²	58.7	13%	0.13	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	138	175.7	25.9	-34.9	0	0	0	110.7	N576 V581 Y904 L911	N576-P579 WeakPolarHBondContact O-CD 3.16Å; P579-V581 PolarHBondContact O-N 3.03Å; P579-Y904 HydrophobicContact CG-CE1 4.05Å; P579-Y904 PolarHBondContact O-OH 2.72Å; P579-Y904 VanDerWaalsContact O-OH 3.06Å; P579-L911 HydrophobicContact CG-CB 4.35Å; P579-L911 HydrophobicContact CG-CD2 4.45Å
580	N	84	Confident	87.9	Confident	120 Å²	120	55.2 Å²	55.2	64%	0.642	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	15.2	-178.4	-50.9	-50.1	0	0	0	116	L578 L911	L578-N580 PolarHBondContact O-N 2.9Å; N580-L911 PolarHBondContact ND2-O 3.42Å
581	V	86.7	Confident	87.7	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.036	23%	0.226	C	C	.	.			trans	-129.9	125.4	178	-178	0	0	0	0	110.8	D527 V528 K569 L578 P579 Y904 L914	D527-V581 HydrophobicContact CB-CG1 4.38Å; V528-V581 HydrophobicContact CG2-CG1 3.69Å; K569-V581 PolarHBondContact NZ-O 2.7Å; L578-V581 HydrophobicContact CB-CB 4.32Å; L578-V581 PolarHBondContact O-N 2.97Å; P579-V581 PolarHBondContact O-N 3.03Å; V581-Y904 HydrophobicContact CG2-CE2 4.29Å; V581-L914 HydrophobicContact CG1-CD1 4.06Å; V581-L914 HydrophobicContact CG1-CD2 4.12Å; V581-L914 HydrophobicContact CG1-CG 4.09Å; V581-L914 HydrophobicContact CG2-CD2 4.09Å; V581-L914 HydrophobicContact CG2-CG 3.86Å
582	R	87.8	Confident	87.5	Confident	152 Å²	152	44.6 Å²	44.6	57%	0.574	22%	0.215	S	C	*	.	P	Polyproline II helix	trans	-92.4	133.4	174.7	-56.6	172.6	-66.4	164.8	2.9	110.2	D527 V528	D527-R582 PolarHBondContact N-O 3.4Å; D527-R582 IonicContact OD1-CZ 3.64Å; D527-R582 VanDerWaalsContact OD1-CZ 3.32Å; D527-R582 IonicContact OD1-NE 2.97Å; D527-R582 PolarHBondContact OD1-NE 2.86Å; D527-R582 VanDerWaalsContact OD1-NE 3.15Å; D527-R582 IonicContact OD1-NH2 3.47Å; D527-R582 PolarHBondContact OD1-NH2 2.9Å; D527-R582 WeakPolarHBondContact OD2-CA 3.43Å; D527-R582 WeakPolarHBondContact OD2-CB 3.36Å; D527-R582 VanDerWaalsContact OD2-CG 3.26Å; D527-R582 WeakPolarHBondContact OD2-CG 3.49Å; D527-R582 IonicContact OD2-CZ 2.8Å; D527-R582 PolarHBondContact OD2-N 3.3Å; D527-R582 IonicContact OD2-NE 3.69Å; D527-R582 PolarHBondContact OD2-NE 3.36Å; V528-R582 PolarHBondContact N-O 2.9Å
583	L	89.7	Confident	87.3	Confident	15 Å²	15	41.5 Å²	41.5	8%	0.079	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	124.2	172.1	-64.2	175.1	0	0	0	109.3	V528 L565 L578 W896 V897	V528-L583 HydrophobicContact CG2-CD2 4.06Å; L565-L583 HydrophobicContact CD2-CB 3.77Å; L565-L583 HydrophobicContact CD2-CD1 3.9Å; L565-L583 HydrophobicContact CD2-CG 4.48Å; L578-L583 HydrophobicContact CD1-CD1 4.2Å; L578-L583 HydrophobicContact CD1-CD2 3.64Å; L578-L583 HydrophobicContact CD1-CG 4.07Å; L583-W896 HydrophobicContact CD2-CH2 4.2Å; L583-V897 HydrophobicContact CD1-CB 4.45Å; L583-V897 HydrophobicContact CD1-CG1 3.91Å; L583-V897 HydrophobicContact CD1-CG2 3.63Å
584	G	89.9	Confident	87.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	168.4	170.3	0	0	0	0	0	111.4	Y524 V528 L530	Y524-G584 CarbonylContact O-C 3.53Å; Y524-G584 WeakPolarHBondContact O-CA 3.37Å; V528-G584 WeakPolarHBondContact O-CA 3.29Å; V528-G584 PolarHBondContact O-N 3.34Å; L530-G584 PolarHBondContact N-O 2.94Å
585	A	90.7	Very high	87.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	148.6	167.6	0	0	0	0	0	111.8	Y524 L530 V561 L565 L587	Y524-A585 PolarHBondContact N-O 3.4Å; Y524-A585 PolarHBondContact O-N 3.47Å; L530-A585 HydrophobicContact CB-CB 4.4Å; L530-A585 CarbonylContact O-C 3.55Å; L530-A585 WeakPolarHBondContact O-CA 3.48Å; L530-A585 WeakPolarHBondContact O-CB 3.29Å; V561-A585 HydrophobicContact CG1-CB 4.44Å; L565-A585 HydrophobicContact CD1-CB 3.62Å; A585-L587 HydrophobicContact CB-CD2 4.26Å
586	L	89.8	Confident	87.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	101.4	168.7	178.6	61.9	0	0	0	107.3	W521 L523 L530 V531 G532 V588 L604 L609 F611	W521-L586 HydrophobicContact CB-CD1 4.19Å; W521-L586 HydrophobicContact CE3-CD1 3.89Å; W521-L586 HydrophobicContact CE3-CD2 3.86Å; W521-L586 HydrophobicContact CE3-CG 3.95Å; W521-L586 HydrophobicContact CZ3-CD2 3.94Å; W521-L586 HydrophobicContact CZ3-CG 4.37Å; L523-L586 HydrophobicContact CD1-CD1 4.43Å; L530-L586 PolarHBondContact O-N 3.34Å; V531-L586 CarbonylContact C-O 3.53Å; V531-L586 WeakPolarHBondContact CA-O 3.22Å; V531-L586 HydrophobicContact CG2-CB 4.25Å; G532-L586 PolarHBondContact N-O 3.3Å; L586-V588 HydrophobicContact CG-CG2 4.35Å; L586-L604 HydrophobicContact CD2-CD1 3.78Å; L586-L609 HydrophobicContact CD2-CD1 4.05Å; L586-F611 HydrophobicContact CD1-CE1 4.35Å; L586-F611 HydrophobicContact CD1-CE2 4.32Å; L586-F611 HydrophobicContact CD1-CZ 3.63Å
587	L	88.9	Confident	87.3	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	134	177.3	-52.2	-179.1	0	0	0	108.4	L522 G532 F534 A558 V561 V562 A585	L522-L587 HydrophobicContact CB-CB 4.1Å; L522-L587 HydrophobicContact CD2-CB 4.33Å; L522-L587 HydrophobicContact CD2-CD1 3.89Å; L522-L587 HydrophobicContact CG-CB 4.14Å; L522-L587 HydrophobicContact CG-CD1 4.16Å; L522-L587 HydrophobicContact CG-CG 4.45Å; L522-L587 PolarHBondContact N-O 2.93Å; L522-L587 PolarHBondContact O-N 3.14Å; G532-L587 CarbonylContact O-C 3.57Å; G532-L587 WeakPolarHBondContact O-CA 3.19Å; F534-L587 HydrophobicContact CE2-CD2 4.12Å; A558-L587 HydrophobicContact CB-CD1 4.44Å; V561-L587 HydrophobicContact CB-CD2 4.25Å; V561-L587 HydrophobicContact CG1-CD2 4.12Å; V561-L587 HydrophobicContact CG2-CD2 4.45Å; V562-L587 HydrophobicContact CG2-CD1 4.01Å; A585-L587 HydrophobicContact CB-CD2 4.26Å
588	V	88.9	Confident	87.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122.1	-168.4	-169.6	0	0	0	0	108.2	T520 W521 V531 G532 M533 F534 L586 A600	T520-V588 WeakPolarHBondContact O-CA 3.3Å; W521-V588 HydrophobicContact CE3-CB 4.48Å; W521-V588 HydrophobicContact CE3-CG1 4.15Å; W521-V588 HydrophobicContact CE3-CG2 3.83Å; W521-V588 HydrophobicContact CH2-CG1 4.47Å; W521-V588 HydrophobicContact CZ3-CB 4.38Å; W521-V588 HydrophobicContact CZ3-CG1 3.87Å; W521-V588 HydrophobicContact CZ3-CG2 3.63Å; V531-V588 HydrophobicContact CG1-CG2 3.91Å; G532-V588 PolarHBondContact O-N 3.07Å; M533-V588 HydrophobicContact CG-CB 4.36Å; F534-V588 PolarHBondContact N-O 3.34Å; L586-V588 HydrophobicContact CG-CG2 4.35Å; V588-A600 HydrophobicContact CG1-CB 3.7Å
589	D	86.2	Confident	87.3	Confident	4 Å²	4	31.7 Å²	31.7	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	116.8	173	-173.4	15.7	0	0	0	110.3	T520 F534 L536 R537 C591	T520-D589 PolarHBondContact O-N 3.21Å; F534-D589 WeakPolarHBondContact O-CA 3.06Å; L536-D589 HydrophobicContact CB-CB 4.31Å; L536-D589 HydrophobicContact CD1-CB 4.25Å; L536-D589 HydrophobicContact CG-CB 4.45Å; L536-D589 PolarHBondContact N-OD1 3.01Å; R537-D589 IonicContact CZ-OD2 2.75Å; R537-D589 PolarHBondContact N-OD1 2.77Å; R537-D589 IonicContact NE-OD2 3.65Å; R537-D589 PolarHBondContact NE-OD2 3.28Å; R537-D589 IonicContact NH2-OD2 2.76Å; R537-D589 PolarHBondContact NH2-OD2 3.45Å; D589-C591 PolarHBondContact OD1-N 2.65Å; D589-C591 PolarHBondContact OD2-SG 3.02Å
590	S	86.9	Confident	87.4	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.162	C	C	.	.			trans	-92.5	-2.7	172.8	39.4	0	0	0	0	113.9	F534 D535 G592 S593 Q630	F534-S590 PolarHBondContact O-N 3.48Å; F534-S590 PolarHBondContact O-OG 2.55Å; D535-S590 VanDerWaalsContact OD1-CB 3.32Å; D535-S590 WeakPolarHBondContact OD1-CB 3.01Å; D535-S590 PolarHBondContact OD1-OG 2.86Å; S590-G592 PolarHBondContact O-N 3.36Å; S590-G592 VanDerWaalsContact O-N 3.08Å; S590-S593 PolarHBondContact O-N 2.85Å; S590-Q630 PolarHBondContact OG-NE2 3.08Å
591	C	83.3	Confident	87.7	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	20.8	173.9	-47.3	0	0	0	0	116	D535 R537 R538 W539 C546 D589 S593	D535-C591 PolarHBondContact OD1-N 3.01Å; R537-C591 CarbonylContact O-C 3.51Å; R537-C591 WeakPolarHBondContact O-CA 3.39Å; R538-C591 CarbonylContact C-O 3.54Å; W539-C591 VanDerWaalsContact CB-O 3.3Å; W539-C591 WeakPolarHBondContact CB-O 3.35Å; W539-C591 PolarHBondContact N-O 2.74Å; C546-C591 HydrophobicContact CB-CB 3.69Å; C546-C591 WeakPolarHBondContact CB-SG 3.16Å; C546-C591 WeakPolarHBondContact SG-CB 3.42Å; C546-C591 CovalentContact SG-SG 2.02Å; C546-C591 PolarHBondContact SG-SG 2.75Å; D589-C591 PolarHBondContact OD1-N 2.65Å; D589-C591 PolarHBondContact OD2-SG 3.02Å; C591-S593 PolarHBondContact O-N 3.31Å
592	G	81.8	Confident	87.6	Confident	20 Å²	20	27.6 Å²	27.6	21%	0.206	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	5.5	-170.1	0	0	0	0	0	114.1	D535 S590	D535-G592 VanDerWaalsContact CG-N 3.26Å; D535-G592 WeakPolarHBondContact OD1-CA 3.46Å; D535-G592 PolarHBondContact OD1-N 3.41Å; S590-G592 PolarHBondContact O-N 3.36Å; S590-G592 VanDerWaalsContact O-N 3.08Å
593	S	85.1	Confident	87.5	Confident	7 Å²	7	22.7 Å²	22.7	5%	0.049	13%	0.128	C	C	.	.			trans	-99	126.5	-174.8	177.9	0	0	0	0	111.8	S590 C591 I595 E596 A597	S590-S593 PolarHBondContact O-N 2.85Å; C591-S593 PolarHBondContact O-N 3.31Å; S593-I595 PolarHBondContact O-N 3.43Å; S593-I595 PolarHBondContact OG-N 3.01Å; S593-E596 PolarHBondContact OG-N 3.14Å; S593-A597 WeakPolarHBondContact O-CB 3.45Å; S593-A597 PolarHBondContact O-N 3.02Å; S593-A597 VanDerWaalsContact O-N 3.09Å
594	P	87.5	Confident	87.1	Confident	41 Å²	41	22 Å²	22	27%	0.266	12%	0.124	S	C	.	.	H	α-helix	trans	-65.4	-27.7	173.7	25.4	-31	0	0	0	112.2	A598 V633 S637	P594-A598 VanDerWaalsContact O-CB 3.3Å; P594-A598 WeakPolarHBondContact O-CB 3.43Å; P594-A598 PolarHBondContact O-N 3.47Å; P594-A598 VanDerWaalsContact O-N 3.08Å; P594-V633 HydrophobicContact CG-CG1 4.16Å; P594-S637 VanDerWaalsContact CB-OG 3.25Å; P594-S637 WeakPolarHBondContact CB-OG 3.45Å; P594-S637 WeakPolarHBondContact O-CB 3.48Å; P594-S637 PolarHBondContact O-OG 3.37Å
595	I	87.9	Confident	86.7	Confident	124 Å²	124	27.3 Å²	27.3	64%	0.636	14%	0.144	S	C	*	.	H	α-helix	trans	-73.8	-48.2	-179.1	-61.3	173.7	0	0	0	110.2	S593 A598 D599	S593-I595 PolarHBondContact O-N 3.43Å; S593-I595 PolarHBondContact OG-N 3.01Å; I595-A598 PolarHBondContact O-N 3.29Å; I595-D599 PolarHBondContact O-N 3.46Å
596	E	87.1	Confident	86	Confident	55 Å²	55	35.5 Å²	35.5	26%	0.257	18%	0.175	S	C	.	.	H	α-helix	trans	-66.9	-38.9	178.9	-55.4	-59.6	130.8	0	0	110.9	W539 S593 A598 D599 A600	W539-E596 HydrophobicContact CE3-CG 4.04Å; W539-E596 HydrophobicContact CZ3-CG 3.85Å; S593-E596 PolarHBondContact OG-N 3.14Å; E596-A598 PolarHBondContact O-N 3.33Å; E596-D599 PolarHBondContact O-N 3.25Å; E596-A600 WeakPolarHBondContact O-CB 3.36Å; E596-A600 PolarHBondContact O-N 3.05Å
597	A	88.7	Confident	85	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57	-46.3	171.5	0	0	0	0	0	112.5	M533 S593 M601	M533-A597 HydrophobicContact CE-CB 4Å; S593-A597 WeakPolarHBondContact O-CB 3.45Å; S593-A597 PolarHBondContact O-N 3.02Å; S593-A597 VanDerWaalsContact O-N 3.09Å; A597-M601 WeakPolarHBondContact O-CG 3.32Å; A597-M601 PolarHBondContact O-N 3.08Å
598	A	89.3	Confident	84.5	Confident	27 Å²	27	40 Å²	40	22%	0.223	19%	0.194	C	C	.	.	H	α-helix	trans	-68.9	-41.3	179.7	0	0	0	0	0	112.6	P594 I595 E596 M601 L602	P594-A598 VanDerWaalsContact O-CB 3.3Å; P594-A598 WeakPolarHBondContact O-CB 3.43Å; P594-A598 PolarHBondContact O-N 3.47Å; P594-A598 VanDerWaalsContact O-N 3.08Å; I595-A598 PolarHBondContact O-N 3.29Å; E596-A598 PolarHBondContact O-N 3.33Å; A598-M601 PolarHBondContact O-N 2.95Å; A598-L602 VanDerWaalsContact O-CG 3.32Å; A598-L602 WeakPolarHBondContact O-CG 3.32Å; A598-L602 PolarHBondContact O-N 3.09Å
599	D	88.7	Confident	83.9	Confident	72 Å²	72	40 Å²	40	39%	0.385	19%	0.194	S	C	.	.	H	α-helix	trans	-68.6	-41.8	179.2	-167.2	61.7	0	0	0	111.6	I595 E596 M601 L602 Q603	I595-D599 PolarHBondContact O-N 3.46Å; E596-D599 PolarHBondContact O-N 3.25Å; D599-M601 VanDerWaalsContact C-N 3.32Å; D599-M601 PolarHBondContact O-N 3.42Å; D599-L602 CarbonylContact O-C 3.58Å; D599-L602 PolarHBondContact O-N 3.34Å; D599-Q603 WeakPolarHBondContact O-CG 3.47Å; D599-Q603 PolarHBondContact O-N 3.46Å; D599-Q603 PolarHBondContact OD2-NE2 3.45Å
600	A	87.4	Confident	83.5	Confident	3 Å²	3	40.5 Å²	40.5	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-58.3	-42.1	175.4	0	0	0	0	0	112.4	W521 V588 E596 Q603 L604	W521-A600 HydrophobicContact CH2-CB 3.98Å; W521-A600 HydrophobicContact CZ2-CB 4.47Å; V588-A600 HydrophobicContact CG1-CB 3.7Å; E596-A600 WeakPolarHBondContact O-CB 3.36Å; E596-A600 PolarHBondContact O-N 3.05Å; A600-Q603 PolarHBondContact O-N 3.26Å; A600-L604 WeakPolarHBondContact O-CB 3.45Å; A600-L604 PolarHBondContact O-N 3.08Å
601	M	88.8	Confident	83	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.5	-37.1	173.4	-71.4	-63.4	95.8	0	0	113.1	V531 M533 A597 A598 D599 L604 R605 F626 F641 F648	V531-M601 HydrophobicContact CG1-CE 4.21Å; M533-M601 HydrophobicContact CE-CE 3.96Å; M533-M601 HydrophobicContact CE-CG 3.92Å; M533-M601 HydrophobicContact CE-SD 4.36Å; M533-M601 HydrophobicContact CG-CE 4.08Å; M533-M601 HydrophobicContact SD-CE 3.45Å; M533-M601 WeakPolarHBondContact SD-CE 3.33Å; M533-M601 HydrophobicContact SD-CG 3.88Å; M533-M601 HydrophobicContact SD-SD 3.62Å; M533-M601 VanDerWaalsContact SD-SD 3.62Å; A597-M601 WeakPolarHBondContact O-CG 3.32Å; A597-M601 PolarHBondContact O-N 3.08Å; A598-M601 PolarHBondContact O-N 2.95Å; D599-M601 VanDerWaalsContact C-N 3.32Å; D599-M601 PolarHBondContact O-N 3.42Å; M601-L604 HydrophobicContact CE-CD2 3.99Å; M601-R605 WeakPolarHBondContact O-CB 3.2Å; M601-R605 PolarHBondContact O-N 2.78Å; M601-F626 HydrophobicContact CE-CD1 4.4Å; M601-F626 HydrophobicContact CE-CE1 3.95Å; M601-F626 HydrophobicContact SD-CD1 4.19Å; M601-F626 HydrophobicContact SD-CE1 3.81Å; M601-F641 HydrophobicContact CB-CD2 3.83Å; M601-F641 HydrophobicContact CB-CE1 4.32Å; M601-F641 HydrophobicContact CB-CE2 3.56Å; M601-F641 HydrophobicContact CB-CG 4.33Å; M601-F641 HydrophobicContact CB-CZ 3.82Å; M601-F641 HydrophobicContact CG-CD2 3.97Å; M601-F641 HydrophobicContact CG-CE2 4.04Å; M601-F648 HydrophobicContact CB-CZ 4.11Å; M601-F648 HydrophobicContact SD-CE1 3.72Å; M601-F648 HydrophobicContact SD-CZ 4.09Å
602	L	86.2	Confident	82.3	Confident	58 Å²	58	47.4 Å²	47.4	30%	0.304	23%	0.231	S	C	.	.	H	α-helix	trans	-71.8	-37.6	176	-73.2	171.2	0	0	0	112.9	A598 D599 R606 F641	A598-L602 VanDerWaalsContact O-CG 3.32Å; A598-L602 WeakPolarHBondContact O-CG 3.32Å; A598-L602 PolarHBondContact O-N 3.09Å; D599-L602 CarbonylContact O-C 3.58Å; D599-L602 PolarHBondContact O-N 3.34Å; L602-R606 VanDerWaalsContact O-CB 3.25Å; L602-R606 WeakPolarHBondContact O-CB 3.3Å; L602-R606 WeakPolarHBondContact O-CD 3.27Å; L602-R606 WeakPolarHBondContact O-CG 3.16Å; L602-R606 PolarHBondContact O-N 3.32Å; L602-R606 VanDerWaalsContact O-N 3.14Å; L602-F641 HydrophobicContact CD2-CE1 4.03Å; L602-F641 HydrophobicContact CD2-CZ 4.31Å; L602-F641 HydrophobicContact CG-CE1 4.3Å; L602-F641 HydrophobicContact CG-CZ 4.09Å
603	Q	83.7	Confident	81.4	Confident	48 Å²	48	50.2 Å²	50.2	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-55.9	173.9	-72.3	-169.4	34.9	0	0	110.1	W521 D599 A600 R605 R606 R607	W521-Q603 HydrophobicContact CZ2-CB 4.35Å; D599-Q603 WeakPolarHBondContact O-CG 3.47Å; D599-Q603 PolarHBondContact O-N 3.46Å; D599-Q603 PolarHBondContact OD2-NE2 3.45Å; A600-Q603 PolarHBondContact O-N 3.26Å; Q603-R605 PolarHBondContact O-N 2.96Å; Q603-R606 PolarHBondContact O-N 3.03Å; Q603-R607 WeakPolarHBondContact O-CB 3.25Å; Q603-R607 PolarHBondContact O-N 2.93Å
604	L	82.8	Confident	80.5	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-54.7	-37.2	-178.1	-177.2	70.9	0	0	0	112.8	W521 V531 L586 A600 M601 L609 F620 F626	W521-L604 HydrophobicContact CH2-CB 4.47Å; V531-L604 HydrophobicContact CG1-CD2 4.05Å; V531-L604 HydrophobicContact CG2-CD2 3.98Å; L586-L604 HydrophobicContact CD2-CD1 3.78Å; A600-L604 WeakPolarHBondContact O-CB 3.45Å; A600-L604 PolarHBondContact O-N 3.08Å; M601-L604 HydrophobicContact CE-CD2 3.99Å; L604-L609 HydrophobicContact CD1-CD1 3.91Å; L604-F620 HydrophobicContact CG-CD2 4.28Å; L604-F626 HydrophobicContact CD2-CE1 3.71Å; L604-F626 HydrophobicContact CD2-CZ 3.9Å
605	R	81.6	Confident	79.8	Confident	111 Å²	111	58.1 Å²	58.1	42%	0.419	29%	0.285	S	S	.	.	H	α-helix	trans	-82.4	-24.1	179.3	-177.1	168.4	175	-169.9	3.6	114.4	M601 Q603 F620 G646 G647 F648	M601-R605 WeakPolarHBondContact O-CB 3.2Å; M601-R605 PolarHBondContact O-N 2.78Å; Q603-R605 PolarHBondContact O-N 2.96Å; R605-F620 HydrophobicContact CB-CD2 4.08Å; R605-F620 HydrophobicContact CB-CE2 4.19Å; R605-F620 HydrophobicContact CG-CD2 4.4Å; R605-F620 HydrophobicContact CG-CE2 4.38Å; R605-G646 PolarHBondContact NH1-O 3.41Å; R605-G647 PolarHBondContact NH2-O 3.12Å; R605-F648 HydrophobicContact CB-CE2 4.28Å; R605-F648 HydrophobicContact CB-CZ 4.14Å; R605-F648 HydrophobicContact CG-CE2 4.43Å
606	R	75.1	Confident	79.1	Confident	172 Å²	172	53.7 Å²	53.7	65%	0.649	26%	0.263	S	S	*	.	H	α-helix	trans	-98.5	-19.1	-175.7	-71.2	175.1	173	177.6	-0.5	113.9	L602 Q603	L602-R606 VanDerWaalsContact O-CB 3.25Å; L602-R606 WeakPolarHBondContact O-CB 3.3Å; L602-R606 WeakPolarHBondContact O-CD 3.27Å; L602-R606 WeakPolarHBondContact O-CG 3.16Å; L602-R606 PolarHBondContact O-N 3.32Å; L602-R606 VanDerWaalsContact O-N 3.14Å; Q603-R606 PolarHBondContact O-N 3.03Å
607	R	69.7	Low	78.7	Confident	82 Å²	82	55.3 Å²	55.3	31%	0.309	28%	0.277	S	S	.	.	S	Bend	trans	-138.4	140.3	-168.8	-64.3	155.6	171.3	-150.4	-19.2	109.7	L511 D513 Q603	L511-R607 HydrophobicContact CB-CG 4.12Å; L511-R607 WeakPolarHBondContact O-CA 3.21Å; D513-R607 HydrophobicContact CB-CB 4.36Å; D513-R607 HydrophobicContact CB-CG 4.41Å; D513-R607 IonicContact OD1-CZ 2.97Å; D513-R607 IonicContact OD1-NE 2.82Å; D513-R607 IonicContact OD1-NH2 3.84Å; D513-R607 IonicContact OD2-CZ 3.59Å; D513-R607 IonicContact OD2-NE 2.72Å; D513-R607 PolarHBondContact OD2-NE 3.23Å; D513-R607 IonicContact OD2-NH1 2.67Å; D513-R607 PolarHBondContact OD2-NH1 3.31Å; D513-R607 IonicContact OD2-NH2 3.9Å; D513-R607 PolarHBondContact OD2-NH2 2.88Å; Q603-R607 WeakPolarHBondContact O-CB 3.25Å; Q603-R607 PolarHBondContact O-N 2.93Å
608	C	77.4	Confident	78.2	Confident	14 Å²	14	55.3 Å²	55.3	10%	0.095	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	137.6	158.3	-86.7	0	0	0	0	108.7	C509 L511 V512 D513 V618	C509-C608 HydrophobicContact CB-CB 3.54Å; C509-C608 WeakPolarHBondContact CB-SG 3.37Å; C509-C608 WeakPolarHBondContact SG-CB 3.32Å; C509-C608 PolarHBondContact SG-N 2.94Å; C509-C608 VanDerWaalsContact SG-N 3.45Å; C509-C608 CovalentContact SG-SG 2.03Å; C509-C608 PolarHBondContact SG-SG 3.45Å; L511-C608 PolarHBondContact O-N 2.93Å; V512-C608 WeakPolarHBondContact CA-O 3.46Å; V512-C608 HydrophobicContact CB-CB 4.43Å; V512-C608 HydrophobicContact CG1-CB 4.19Å; V512-C608 HydrophobicContact CG2-CB 4.09Å; D513-C608 PolarHBondContact N-O 2.74Å; C608-V618 WeakPolarHBondContact CA-O 3.39Å
609	L	77.3	Confident	77.7	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.1	179.6	-66.8	174.5	0	0	0	110.3	A515 W521 L586 L604 F611 T617 V618	A515-L609 HydrophobicContact CB-CB 4.43Å; W521-L609 HydrophobicContact CD2-CD1 4.15Å; W521-L609 HydrophobicContact CE3-CD1 4.07Å; W521-L609 HydrophobicContact CH2-CD1 3.7Å; W521-L609 HydrophobicContact CZ2-CD1 3.78Å; W521-L609 HydrophobicContact CZ2-CD2 4.36Å; W521-L609 HydrophobicContact CZ3-CD1 3.84Å; L586-L609 HydrophobicContact CD2-CD1 4.05Å; L604-L609 HydrophobicContact CD1-CD1 3.91Å; L609-F611 HydrophobicContact CB-CE2 3.7Å; L609-F611 HydrophobicContact CB-CZ 4.23Å; L609-F611 WeakPolarHBondContact O-CD2 3.41Å; L609-T617 CarbonylContact O-C 3.56Å; L609-T617 WeakPolarHBondContact O-CA 3.45Å; L609-V618 PolarHBondContact N-O 3.42Å; L609-V618 PolarHBondContact O-N 3.15Å
610	A	77.9	Confident	77.4	Confident	14 Å²	14	52.9 Å²	52.9	12%	0.116	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	123.1	-179.6	0	0	0	0	0	112.2	V512 D513 M514 A515 T617	V512-A610 HydrophobicContact CG1-CB 3.98Å; D513-A610 PolarHBondContact O-N 3.16Å; M514-A610 HydrophobicContact SD-CB 4Å; A515-A610 PolarHBondContact N-O 3.17Å; A610-T617 HydrophobicContact CB-CG2 4Å
611	F	75.1	Confident	76.8	Confident	5 Å²	5	56.1 Å²	56.1	2%	0.022	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	97	-176.7	-67.8	-91.4	0	0	0	110.9	A515 W521 L523 L586 L609 S613 Q614 N615 V616 V618	A515-F611 HydrophobicContact CB-CD1 3.78Å; A515-F611 HydrophobicContact CB-CD2 4.35Å; A515-F611 HydrophobicContact CB-CE1 3.41Å; A515-F611 VanDerWaalsContact CB-CE1 3.41Å; A515-F611 HydrophobicContact CB-CE2 4.04Å; A515-F611 HydrophobicContact CB-CG 4.23Å; A515-F611 HydrophobicContact CB-CZ 3.55Å; W521-F611 HydrophobicContact CB-CE1 3.72Å; W521-F611 HydrophobicContact CB-CZ 3.99Å; W521-F611 HydrophobicContact CG-CE1 4.35Å; W521-F611 HydrophobicContact CG-CZ 4.3Å; L523-F611 HydrophobicContact CB-CD1 4.13Å; L523-F611 HydrophobicContact CB-CE1 4.19Å; L523-F611 HydrophobicContact CB-CG 4.41Å; L523-F611 HydrophobicContact CD2-CB 3.8Å; L523-F611 HydrophobicContact CD2-CD1 4.19Å; L523-F611 HydrophobicContact CD2-CD2 3.73Å; L523-F611 HydrophobicContact CD2-CE2 4.36Å; L523-F611 HydrophobicContact CD2-CG 3.63Å; L586-F611 HydrophobicContact CD1-CE1 4.35Å; L586-F611 HydrophobicContact CD1-CE2 4.32Å; L586-F611 HydrophobicContact CD1-CZ 3.63Å; L609-F611 HydrophobicContact CB-CE2 3.7Å; L609-F611 HydrophobicContact CB-CZ 4.23Å; L609-F611 WeakPolarHBondContact O-CD2 3.41Å; F611-S613 VanDerWaalsContact C-N 3.28Å; F611-S613 PolarHBondContact O-N 2.75Å; F611-Q614 PolarHBondContact O-N 3.23Å; F611-N615 PolarHBondContact O-N 2.73Å; F611-V616 PolarHBondContact N-O 2.74Å; F611-V616 PolarHBondContact O-N 3.38Å; F611-V618 HydrophobicContact CD2-CG2 4.28Å; F611-V618 HydrophobicContact CE2-CG2 4.02Å
612	H	68.6	Low	76.5	Confident	141 Å²	141	58 Å²	58	65%	0.653	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-32.6	-173.3	-168	38.2	0	0	0	113.8	M514 Q614	M514-H612 HydrophobicContact CE-CB 3.9Å; H612-Q614 PolarHBondContact O-N 3.5Å
613	S	64.2	Low	76.6	Confident	79 Å²	79	55.4 Å²	55.4	55%	0.552	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-18.2	-180	47.3	0	0	0	0	114.6	N517 F611	N517-S613 PolarHBondContact ND2-OG 3.01Å; F611-S613 VanDerWaalsContact C-N 3.28Å; F611-S613 PolarHBondContact O-N 2.75Å
614	Q	66.4	Low	77	Confident	70 Å²	70	53.4 Å²	53.4	33%	0.327	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-5.5	178.9	-62.4	-176.8	11.5	0	0	113.1	L523 F611 H612 V616	L523-Q614 VanDerWaalsContact CD2-OE1 3.29Å; L523-Q614 PolarHBondContact O-NE2 3.02Å; L523-Q614 VanDerWaalsContact O-NE2 3.09Å; F611-Q614 PolarHBondContact O-N 3.23Å; H612-Q614 PolarHBondContact O-N 3.5Å; Q614-V616 VanDerWaalsContact C-N 3.28Å; Q614-V616 HydrophobicContact CB-CB 4.48Å; Q614-V616 HydrophobicContact CB-CG2 4Å; Q614-V616 PolarHBondContact O-N 3.46Å
615	N	71.8	Confident	77.4	Confident	144 Å²	144	53.3 Å²	53.3	77%	0.77	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	41.8	-169.8	-72.6	-37	0	0	0	113.4	F611	F611-N615 PolarHBondContact O-N 2.73Å
616	V	74.3	Confident	78	Confident	30 Å²	30	48 Å²	48	18%	0.182	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.4	178.5	175.4	0	0	0	0	110	L523 Y529 F611 Q614 V618	L523-V616 HydrophobicContact CD2-CB 3.9Å; L523-V616 HydrophobicContact CD2-CG1 3.95Å; L523-V616 HydrophobicContact CD2-CG2 4.46Å; Y529-V616 WeakPolarHBondContact OH-CG1 3.43Å; F611-V616 PolarHBondContact N-O 2.74Å; F611-V616 PolarHBondContact O-N 3.38Å; Q614-V616 VanDerWaalsContact C-N 3.28Å; Q614-V616 HydrophobicContact CB-CB 4.48Å; Q614-V616 HydrophobicContact CB-CG2 4Å; Q614-V616 PolarHBondContact O-N 3.46Å; V616-V618 HydrophobicContact CG1-CG2 4.19Å
617	T	78.2	Confident	78.9	Confident	89 Å²	89	39.9 Å²	39.9	55%	0.546	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.5	168.6	54.5	0	0	0	0	109	L609 A610	L609-T617 CarbonylContact O-C 3.56Å; L609-T617 WeakPolarHBondContact O-CA 3.45Å; A610-T617 HydrophobicContact CB-CG2 4Å
618	V	77.7	Confident	79.9	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	125	178.3	-177	0	0	0	0	109.4	L523 Y529 C608 L609 F611 V616	L523-V618 HydrophobicContact CD1-CG2 3.89Å; Y529-V618 HydrophobicContact CD1-CG2 4.43Å; Y529-V618 HydrophobicContact CD2-CG1 3.91Å; Y529-V618 HydrophobicContact CD2-CG2 4.43Å; Y529-V618 HydrophobicContact CE1-CG2 4.13Å; Y529-V618 HydrophobicContact CE2-CG1 4.35Å; Y529-V618 HydrophobicContact CE2-CG2 4.13Å; Y529-V618 HydrophobicContact CG-CG1 4.05Å; C608-V618 WeakPolarHBondContact CA-O 3.39Å; L609-V618 PolarHBondContact N-O 3.42Å; L609-V618 PolarHBondContact O-N 3.15Å; F611-V618 HydrophobicContact CD2-CG2 4.28Å; F611-V618 HydrophobicContact CE2-CG2 4.02Å; V616-V618 HydrophobicContact CG1-CG2 4.19Å
619	S	78.3	Confident	80.4	Confident	18 Å²	18	35.4 Å²	35.4	13%	0.126	20%	0.195	C	C	.	.			trans	-94.7	154.5	168.8	-171.8	0	0	0	0	111.4	D621 D622	S619-D621 PolarHBondContact O-N 2.98Å; S619-D621 PolarHBondContact OG-N 3.45Å; S619-D622 WeakPolarHBondContact CA-OD2 3.39Å; S619-D622 WeakPolarHBondContact CB-OD2 3.3Å; S619-D622 PolarHBondContact N-OD2 2.68Å; S619-D622 PolarHBondContact O-N 3Å
620	F	82.3	Confident	80.8	Confident	30 Å²	30	35.7 Å²	35.7	13%	0.132	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-59.9	-33	167.7	-173.2	-97.7	0	0	0	112.3	L604 R605 D622 V623 F626 F648 Q650	L604-F620 HydrophobicContact CG-CD2 4.28Å; R605-F620 HydrophobicContact CB-CD2 4.08Å; R605-F620 HydrophobicContact CB-CE2 4.19Å; R605-F620 HydrophobicContact CG-CD2 4.4Å; R605-F620 HydrophobicContact CG-CE2 4.38Å; F620-D622 PolarHBondContact O-N 3.29Å; F620-V623 WeakPolarHBondContact O-CB 3.43Å; F620-V623 PolarHBondContact O-N 3.48Å; F620-F626 HydrophobicContact CE2-CZ 4.02Å; F620-F648 AromaticContact CE2-CD1 3.73Å; F620-F648 HydrophobicContact CE2-CD1 3.73Å; F620-F648 AromaticContact CE2-CE1 3.57Å; F620-F648 HydrophobicContact CE2-CE1 3.57Å; F620-F648 HydrophobicContact CE2-CE2 4.5Å; F620-F648 HydrophobicContact CE2-CG 4.28Å; F620-F648 AromaticContact CE2-CZ 3.98Å; F620-F648 HydrophobicContact CE2-CZ 3.98Å; F620-F648 HydrophobicContact CZ-CB 4.5Å; F620-F648 AromaticContact CZ-CD1 3.81Å; F620-F648 HydrophobicContact CZ-CD1 3.81Å; F620-F648 HydrophobicContact CZ-CD2 4.37Å; F620-F648 HydrophobicContact CZ-CE1 4.1Å; F620-F648 AromaticContact CZ-CG 3.95Å; F620-F648 HydrophobicContact CZ-CG 3.95Å; F620-F648 HydrophobicContact CZ-CZ 4.49Å; F620-Q650 PolarHBondContact O-NE2 3.42Å
621	D	76.2	Confident	80.9	Confident	72 Å²	72	39.6 Å²	39.6	39%	0.385	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-68.2	-20.5	178.8	-78.1	4.2	0	0	0	112.5	S619 V623 F919	S619-D621 PolarHBondContact O-N 2.98Å; S619-D621 PolarHBondContact OG-N 3.45Å; D621-V623 VanDerWaalsContact C-N 3.34Å; D621-F919 WeakPolarHBondContact O-CD1 3.29Å
622	D	82.4	Confident	80.9	Confident	40 Å²	40	41 Å²	41	21%	0.214	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-85.4	-7.9	177.5	-49.6	-40.8	0	0	0	112.6	Y529 S619 F620	Y529-D622 HydrophobicContact CD2-CB 3.96Å; Y529-D622 PolarHBondContact N-O 3.17Å; S619-D622 WeakPolarHBondContact CA-OD2 3.39Å; S619-D622 WeakPolarHBondContact CB-OD2 3.3Å; S619-D622 PolarHBondContact N-OD2 2.68Å; S619-D622 PolarHBondContact O-N 3Å; F620-D622 PolarHBondContact O-N 3.29Å
623	V	88.4	Confident	81.3	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.018	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	120	-177.9	-179.5	0	0	0	0	110.5	Y529 V531 F620 D621 F626 Q650	Y529-V623 WeakPolarHBondContact O-CA 3.25Å; V531-V623 HydrophobicContact CB-CG1 4.21Å; V531-V623 HydrophobicContact CG2-CB 4.29Å; V531-V623 HydrophobicContact CG2-CG1 3.53Å; V531-V623 HydrophobicContact CG2-CG2 3.69Å; F620-V623 WeakPolarHBondContact O-CB 3.43Å; F620-V623 PolarHBondContact O-N 3.48Å; D621-V623 VanDerWaalsContact C-N 3.34Å; V623-F626 HydrophobicContact CG1-CD2 4.13Å; V623-F626 HydrophobicContact CG1-CE1 4.49Å; V623-F626 HydrophobicContact CG1-CE2 3.52Å; V623-F626 HydrophobicContact CG1-CZ 3.73Å; V623-Q650 WeakPolarHBondContact O-CG 3.26Å; V623-Q650 PolarHBondContact O-NE2 3.23Å
624	L	91	Very high	82.3	Confident	5 Å²	5	34.6 Å²	34.6	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-28.7	-178	-64	-174	0	0	0	113.9	V528 Y529 P651 W896 T900 F918 Y922	V528-L624 HydrophobicContact CB-CD1 3.66Å; V528-L624 HydrophobicContact CB-CG 3.93Å; V528-L624 HydrophobicContact CG1-CD1 3.83Å; V528-L624 HydrophobicContact CG1-CD2 4.24Å; V528-L624 HydrophobicContact CG1-CG 3.95Å; V528-L624 HydrophobicContact CG2-CD1 3.84Å; Y529-L624 PolarHBondContact O-N 3.17Å; L624-P651 WeakPolarHBondContact O-CD 3.1Å; L624-W896 HydrophobicContact CB-CZ2 4.14Å; L624-T900 HydrophobicContact CD1-CG2 4.23Å; L624-F918 HydrophobicContact CD1-CE1 3.97Å; L624-F918 HydrophobicContact CD1-CZ 4.12Å; L624-F918 HydrophobicContact CD2-CE1 3.82Å; L624-F918 HydrophobicContact CD2-CZ 4.46Å; L624-Y922 HydrophobicContact CB-CE1 3.92Å; L624-Y922 HydrophobicContact CD2-CD1 4Å; L624-Y922 HydrophobicContact CD2-CE1 4.04Å; L624-Y922 HydrophobicContact CD2-CG 4.46Å; L624-Y922 WeakPolarHBondContact O-CE1 3.4Å; L624-Y922 PolarHBondContact O-OH 3.27Å
625	A	92.5	Very high	83.3	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	157.8	-179.6	0	0	0	0	0	110.7	L530 V531 P651 W896	L530-A625 HydrophobicContact CD1-CB 3.63Å; V531-A625 PolarHBondContact N-O 2.97Å; A625-P651 HydrophobicContact CB-CG 3.9Å; A625-W896 HydrophobicContact CB-CZ2 4.04Å
626	F	93.6	Very high	83.8	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	151	171.9	-70.1	-102.9	0	0	0	110.3	V531 M601 L604 F620 V623 F642 F648 Q650 P651 L652 I653	V531-F626 HydrophobicContact CB-CD1 3.61Å; V531-F626 HydrophobicContact CB-CE1 3.65Å; V531-F626 HydrophobicContact CB-CG 4.28Å; V531-F626 HydrophobicContact CB-CZ 4.34Å; V531-F626 HydrophobicContact CG1-CD1 3.64Å; V531-F626 HydrophobicContact CG1-CE1 3.59Å; V531-F626 HydrophobicContact CG2-CE1 4.11Å; V531-F626 HydrophobicContact CG2-CZ 4.42Å; V531-F626 CarbonylContact O-C 3.6Å; V531-F626 VanDerWaalsContact O-CA 3.22Å; V531-F626 WeakPolarHBondContact O-CA 3.4Å; M601-F626 HydrophobicContact CE-CD1 4.4Å; M601-F626 HydrophobicContact CE-CE1 3.95Å; M601-F626 HydrophobicContact SD-CD1 4.19Å; M601-F626 HydrophobicContact SD-CE1 3.81Å; L604-F626 HydrophobicContact CD2-CE1 3.71Å; L604-F626 HydrophobicContact CD2-CZ 3.9Å; F620-F626 HydrophobicContact CE2-CZ 4.02Å; V623-F626 HydrophobicContact CG1-CD2 4.13Å; V623-F626 HydrophobicContact CG1-CE1 4.49Å; V623-F626 HydrophobicContact CG1-CE2 3.52Å; V623-F626 HydrophobicContact CG1-CZ 3.73Å; F626-F642 HydrophobicContact CB-CE1 3.95Å; F626-F642 HydrophobicContact CB-CZ 3.68Å; F626-F642 AromaticContact CD1-CZ 3.74Å; F626-F642 HydrophobicContact CD1-CZ 3.74Å; F626-F642 AromaticContact CD2-CE1 3.62Å; F626-F642 HydrophobicContact CD2-CE1 3.62Å; F626-F642 AromaticContact CD2-CZ 3.67Å; F626-F642 HydrophobicContact CD2-CZ 3.67Å; F626-F642 HydrophobicContact CE1-CZ 4.29Å; F626-F642 HydrophobicContact CE2-CE1 4.26Å; F626-F642 HydrophobicContact CE2-CZ 4.24Å; F626-F642 AromaticContact CG-CE1 3.79Å; F626-F642 HydrophobicContact CG-CE1 3.79Å; F626-F642 AromaticContact CG-CZ 3.41Å; F626-F642 HydrophobicContact CG-CZ 3.41Å; F626-F642 VanDerWaalsContact CG-CZ 3.41Å; F626-F648 HydrophobicContact CD2-CD1 4.48Å; F626-F648 HydrophobicContact CE1-CD1 4.13Å; F626-F648 AromaticContact CE1-CE1 3.85Å; F626-F648 HydrophobicContact CE1-CE1 3.85Å; F626-F648 AromaticContact CE2-CD1 3.77Å; F626-F648 HydrophobicContact CE2-CD1 3.77Å; F626-F648 HydrophobicContact CE2-CE1 4.24Å; F626-F648 AromaticContact CZ-CD1 3.58Å; F626-F648 HydrophobicContact CZ-CD1 3.58Å; F626-F648 AromaticContact CZ-CE1 3.56Å; F626-F648 HydrophobicContact CZ-CE1 3.56Å; F626-Q650 HydrophobicContact CD2-CB 3.75Å; F626-Q650 HydrophobicContact CD2-CG 4.35Å; F626-Q650 HydrophobicContact CE2-CB 3.83Å; F626-Q650 HydrophobicContact CE2-CG 4Å; F626-P651 PolarHBondContact N-O 3.36Å; F626-L652 HydrophobicContact CB-CD1 3.66Å; F626-L652 WeakPolarHBondContact O-CA 3.32Å; F626-I653 PolarHBondContact O-N 2.93Å
627	V	93.7	Very high	84.4	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.5	173.4	-176	0	0	0	0	107.4	L530 V531 G532 M533 F534 I653 L889 L893	L530-V627 HydrophobicContact CD1-CG2 3.69Å; L530-V627 HydrophobicContact CD2-CG2 4.08Å; L530-V627 HydrophobicContact CG-CG2 3.93Å; V531-V627 PolarHBondContact O-N 3.07Å; G532-V627 CarbonylContact C-O 3.52Å; G532-V627 WeakPolarHBondContact CA-O 3.18Å; M533-V627 PolarHBondContact N-O 3.36Å; F534-V627 HydrophobicContact CZ-CG1 3.96Å; V627-I653 CarbonylContact C-O 3.54Å; V627-I653 VanDerWaalsContact CA-O 3.26Å; V627-I653 WeakPolarHBondContact CA-O 3.44Å; V627-I653 HydrophobicContact CG2-CB 4.49Å; V627-L889 HydrophobicContact CG1-CD1 3.71Å; V627-L893 HydrophobicContact CG2-CD2 3.86Å
628	T	91.5	Very high	84.8	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.5	167.4	-174.2	0	0	0	0	112.1	M533 Q630 Y635 L652 I653 S654 V655	M533-T628 WeakPolarHBondContact O-CA 3.34Å; T628-Q630 WeakPolarHBondContact OG1-CB 3.41Å; T628-Q630 VanDerWaalsContact OG1-CG 3.26Å; T628-Q630 WeakPolarHBondContact OG1-CG 3.48Å; T628-Q630 PolarHBondContact OG1-N 2.91Å; T628-Q630 PolarHBondContact OG1-OE1 3.45Å; T628-Y635 HydrophobicContact CG2-CD2 4.09Å; T628-Y635 HydrophobicContact CG2-CE2 4.38Å; T628-L652 HydrophobicContact CG2-CD1 3.92Å; T628-L652 HydrophobicContact CG2-CD2 4.1Å; T628-L652 HydrophobicContact CG2-CG 4.23Å; T628-I653 PolarHBondContact N-O 3.3Å; T628-S654 WeakPolarHBondContact CG2-OG 3.42Å; T628-V655 WeakPolarHBondContact O-CG2 3.44Å; T628-V655 PolarHBondContact O-N 3.23Å
629	G	86.3	Confident	85.3	Confident	3 Å²	3	26.9 Å²	26.9	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	42.7	165.8	0	0	0	0	0	110.5	M533 H554	M533-G629 PolarHBondContact O-N 3.46Å; H554-G629 PolarHBondContact ND1-O 3.31Å
630	Q	86.8	Confident	85.7	Confident	6 Å²	6	29.6 Å²	29.6	3%	0.028	16%	0.163	C	C	.	.			trans	-82.3	159.7	-180	-70	173	-70	0	0	112.4	M533 D535 S590 T628 T638 S656	M533-Q630 HydrophobicContact CB-CG 4.07Å; D535-Q630 WeakPolarHBondContact OD2-CA 3.45Å; D535-Q630 WeakPolarHBondContact OD2-CB 3.24Å; S590-Q630 PolarHBondContact OG-NE2 3.08Å; T628-Q630 WeakPolarHBondContact OG1-CB 3.41Å; T628-Q630 VanDerWaalsContact OG1-CG 3.26Å; T628-Q630 WeakPolarHBondContact OG1-CG 3.48Å; T628-Q630 PolarHBondContact OG1-N 2.91Å; T628-Q630 PolarHBondContact OG1-OE1 3.45Å; Q630-T638 PolarHBondContact NE2-OG1 2.98Å; Q630-T638 VanDerWaalsContact NE2-OG1 3.15Å; Q630-T638 VanDerWaalsContact OE1-CB 3.32Å; Q630-T638 PolarHBondContact OE1-OG1 2.83Å; Q630-S656 PolarHBondContact N-OG 3.1Å; Q630-S656 WeakPolarHBondContact O-CB 3.5Å; Q630-S656 PolarHBondContact O-OG 2.77Å
631	E	79.3	Confident	85.9	Confident	97 Å²	97	29.2 Å²	29.2	45%	0.453	16%	0.161	S	C	.	.			trans	-68.6	160.5	165.8	-64.6	-169.8	155.3	0	0	111.7	D535 V633 S634 Y635	D535-E631 PolarHBondContact OD2-N 3.37Å; E631-V633 PolarHBondContact O-N 3.38Å; E631-S634 PolarHBondContact N-OG 2.87Å; E631-S634 PolarHBondContact O-N 2.85Å; E631-S634 PolarHBondContact O-OG 3.12Å; E631-Y635 WeakPolarHBondContact O-CB 2.84Å; E631-Y635 PolarHBondContact O-N 3.04Å
632	D	74.6	Confident	86.5	Confident	34 Å²	34	25.8 Å²	25.8	18%	0.182	14%	0.143	C	C	.	.	H	α-helix	trans	-48.2	-39.2	-178.5	-68.6	8.3	0	0	0	113.7	S636 H700 S701	D632-S636 WeakPolarHBondContact O-CB 3.49Å; D632-S636 PolarHBondContact O-N 3.28Å; D632-H700 IonicContact OD1-CE1 3.7Å; D632-H700 IonicContact OD1-ND1 3.54Å; D632-H700 PolarHBondContact OD1-ND1 2.82Å; D632-H700 IonicContact OD2-CE1 3.74Å; D632-H700 IonicContact OD2-CG 2.68Å; D632-H700 IonicContact OD2-ND1 3.6Å; D632-H700 PolarHBondContact OD2-ND1 2.84Å; D632-S701 WeakPolarHBondContact OD2-CB 3.45Å; D632-S701 PolarHBondContact OD2-N 3.07Å; D632-S701 PolarHBondContact OD2-OG 3.18Å
633	V	78.7	Confident	86.5	Confident	86 Å²	86	26.4 Å²	26.4	52%	0.521	15%	0.148	S	C	.	.	H	α-helix	trans	-71.3	-50.6	-173.3	-170	0	0	0	0	111.4	P594 E631 S636	P594-V633 HydrophobicContact CG-CG1 4.16Å; E631-V633 PolarHBondContact O-N 3.38Å; V633-S636 WeakPolarHBondContact O-CB 3.24Å; V633-S636 PolarHBondContact O-OG 3.09Å
634	S	83.7	Confident	85.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-69.5	-44.2	176.9	40.1	0	0	0	0	111.6	D535 E631 S636 S637	D535-S634 PolarHBondContact OD2-OG 2.88Å; E631-S634 PolarHBondContact N-OG 2.87Å; E631-S634 PolarHBondContact O-N 2.85Å; E631-S634 PolarHBondContact O-OG 3.12Å; S634-S636 VanDerWaalsContact C-N 3.26Å; S634-S636 PolarHBondContact O-N 3.5Å; S634-S637 PolarHBondContact O-N 3.35Å
635	Y	87.4	Confident	84.6	Confident	15 Å²	15	40.2 Å²	40.2	6%	0.059	22%	0.218	C	C	.	.	H	α-helix	trans	-54.9	-38.8	174.6	166	-123.1	0	0	0	112.5	T628 E631 S637 T638 K639 C657 E666	T628-Y635 HydrophobicContact CG2-CD2 4.09Å; T628-Y635 HydrophobicContact CG2-CE2 4.38Å; E631-Y635 WeakPolarHBondContact O-CB 2.84Å; E631-Y635 PolarHBondContact O-N 3.04Å; Y635-S637 PolarHBondContact O-N 2.99Å; Y635-T638 PolarHBondContact O-N 3.45Å; Y635-T638 VanDerWaalsContact O-N 3.11Å; Y635-K639 HydrophobicContact CD2-CB 4.36Å; Y635-K639 HydrophobicContact CE1-CD 4.38Å; Y635-K639 HydrophobicContact CE2-CB 3.81Å; Y635-K639 HydrophobicContact CE2-CG 4.36Å; Y635-K639 WeakPolarHBondContact O-CB 3.41Å; Y635-K639 PolarHBondContact O-N 2.65Å; Y635-C657 HydrophobicContact CE1-CB 4.32Å; Y635-C657 WeakPolarHBondContact OH-CB 3.48Å; Y635-C657 PolarHBondContact OH-SG 3.41Å; Y635-C657 VanDerWaalsContact OH-SG 3.34Å; Y635-E666 VanDerWaalsContact CE2-OE1 3.28Å; Y635-E666 WeakPolarHBondContact CE2-OE1 3.48Å; Y635-E666 PolarHBondContact OH-OE1 2.9Å; Y635-E666 VanDerWaalsContact OH-OE1 3.1Å; Y635-E666 PolarHBondContact OH-OE2 2.98Å
636	S	83.4	Confident	83.2	Confident	63 Å²	63	41 Å²	41	44%	0.441	23%	0.225	S	C	.	.	H	α-helix	trans	-53	-32.2	-178.9	77	0	0	0	0	113.7	D632 V633 S634	D632-S636 WeakPolarHBondContact O-CB 3.49Å; D632-S636 PolarHBondContact O-N 3.28Å; V633-S636 WeakPolarHBondContact O-CB 3.24Å; V633-S636 PolarHBondContact O-OG 3.09Å; S634-S636 VanDerWaalsContact C-N 3.26Å; S634-S636 PolarHBondContact O-N 3.5Å
637	S	86.1	Confident	82.1	Confident	27 Å²	27	41.5 Å²	41.5	19%	0.189	23%	0.231	C	C	.	.	H	α-helix	trans	-84.7	-44.1	178.6	-65.7	0	0	0	0	112	P594 S634 Y635 K639 T640	P594-S637 VanDerWaalsContact CB-OG 3.25Å; P594-S637 WeakPolarHBondContact CB-OG 3.45Å; P594-S637 WeakPolarHBondContact O-CB 3.48Å; P594-S637 PolarHBondContact O-OG 3.37Å; S634-S637 PolarHBondContact O-N 3.35Å; Y635-S637 PolarHBondContact O-N 2.99Å; S637-K639 VanDerWaalsContact C-N 3.32Å; S637-K639 PolarHBondContact O-N 2.65Å; S637-T640 WeakPolarHBondContact O-CB 3.3Å; S637-T640 PolarHBondContact O-N 3.45Å; S637-T640 PolarHBondContact O-OG1 3.26Å
638	T	87.7	Confident	81.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-52.9	-47.5	173.8	-57.1	0	0	0	0	112.1	M533 Q630 Y635 T640 F641 F642	M533-T638 HydrophobicContact CE-CG2 4.41Å; M533-T638 WeakPolarHBondContact CE-OG1 3.31Å; M533-T638 HydrophobicContact SD-CG2 3.47Å; M533-T638 WeakPolarHBondContact SD-CG2 3.29Å; Q630-T638 PolarHBondContact NE2-OG1 2.98Å; Q630-T638 VanDerWaalsContact NE2-OG1 3.15Å; Q630-T638 VanDerWaalsContact OE1-CB 3.32Å; Q630-T638 PolarHBondContact OE1-OG1 2.83Å; Y635-T638 PolarHBondContact O-N 3.45Å; Y635-T638 VanDerWaalsContact O-N 3.11Å; T638-T640 PolarHBondContact O-N 2.98Å; T638-F641 WeakPolarHBondContact O-CD2 3.38Å; T638-F641 PolarHBondContact O-N 3.04Å; T638-F641 VanDerWaalsContact O-N 3.15Å; T638-F642 HydrophobicContact CG2-CE2 4.04Å; T638-F642 WeakPolarHBondContact O-CD2 3.47Å
639	K	86.8	Confident	81.1	Confident	66 Å²	66	47.4 Å²	47.4	29%	0.287	26%	0.257	S	S	.	.	H	α-helix	trans	-50	-34.7	179.3	179.1	-177.6	170.2	173.6	0	113.7	Y635 S637 F641 F642 S661	Y635-K639 HydrophobicContact CD2-CB 4.36Å; Y635-K639 HydrophobicContact CE1-CD 4.38Å; Y635-K639 HydrophobicContact CE2-CB 3.81Å; Y635-K639 HydrophobicContact CE2-CG 4.36Å; Y635-K639 WeakPolarHBondContact O-CB 3.41Å; Y635-K639 PolarHBondContact O-N 2.65Å; S637-K639 VanDerWaalsContact C-N 3.32Å; S637-K639 PolarHBondContact O-N 2.65Å; K639-F641 PolarHBondContact O-N 2.76Å; K639-F642 PolarHBondContact O-N 3.05Å; K639-S661 WeakPolarHBondContact CE-O 3.48Å; K639-S661 PolarHBondContact NZ-O 2.91Å
640	T	86.3	Confident	81.2	Confident	74 Å²	74	48 Å²	48	45%	0.454	26%	0.259	S	S	.	.	H	α-helix	trans	-60.8	-33.8	-176	67.9	0	0	0	0	112.8	S637 T638 F642 T643	S637-T640 WeakPolarHBondContact O-CB 3.3Å; S637-T640 PolarHBondContact O-N 3.45Å; S637-T640 PolarHBondContact O-OG1 3.26Å; T638-T640 PolarHBondContact O-N 2.98Å; T640-F642 PolarHBondContact O-N 3.31Å; T640-T643 PolarHBondContact O-N 3.47Å; T640-T643 PolarHBondContact O-OG1 3.41Å
641	F	88	Confident	81.4	Confident	23 Å²	23	47.7 Å²	47.7	10%	0.101	26%	0.257	C	S	.	.	H	α-helix	trans	-72.5	-24.4	-176.8	-65.7	-75.7	0	0	0	114	M601 L602 T638 K639 G646 F648	M601-F641 HydrophobicContact CB-CD2 3.83Å; M601-F641 HydrophobicContact CB-CE1 4.32Å; M601-F641 HydrophobicContact CB-CE2 3.56Å; M601-F641 HydrophobicContact CB-CG 4.33Å; M601-F641 HydrophobicContact CB-CZ 3.82Å; M601-F641 HydrophobicContact CG-CD2 3.97Å; M601-F641 HydrophobicContact CG-CE2 4.04Å; L602-F641 HydrophobicContact CD2-CE1 4.03Å; L602-F641 HydrophobicContact CD2-CZ 4.31Å; L602-F641 HydrophobicContact CG-CE1 4.3Å; L602-F641 HydrophobicContact CG-CZ 4.09Å; T638-F641 WeakPolarHBondContact O-CD2 3.38Å; T638-F641 PolarHBondContact O-N 3.04Å; T638-F641 VanDerWaalsContact O-N 3.15Å; K639-F641 PolarHBondContact O-N 2.76Å; F641-G646 CarbonylContact O-C 3.57Å; F641-G646 VanDerWaalsContact O-CA 3.28Å; F641-G646 WeakPolarHBondContact O-CA 3.43Å; F641-F648 HydrophobicContact CB-CD2 3.69Å; F641-F648 HydrophobicContact CB-CE2 3.77Å; F641-F648 HydrophobicContact CB-CG 4.09Å; F641-F648 HydrophobicContact CB-CZ 4.24Å; F641-F648 HydrophobicContact CD1-CD2 4.04Å; F641-F648 AromaticContact CD1-CE2 3.44Å; F641-F648 HydrophobicContact CD1-CE2 3.44Å; F641-F648 VanDerWaalsContact CD1-CE2 3.44Å; F641-F648 HydrophobicContact CD1-CZ 4.1Å; F641-F648 HydrophobicContact CE1-CE2 4.28Å; F641-F648 HydrophobicContact CG-CD2 4.25Å; F641-F648 AromaticContact CG-CE2 3.83Å; F641-F648 HydrophobicContact CG-CE2 3.83Å; F641-F648 HydrophobicContact CG-CZ 4.22Å; F641-F648 PolarHBondContact O-N 3.31Å
642	F	88	Confident	81.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-96.6	-3.5	-178.4	-61.5	-83.3	0	0	0	113.7	F626 T638 K639 T640 F648 L652 S663	F626-F642 HydrophobicContact CB-CE1 3.95Å; F626-F642 HydrophobicContact CB-CZ 3.68Å; F626-F642 AromaticContact CD1-CZ 3.74Å; F626-F642 HydrophobicContact CD1-CZ 3.74Å; F626-F642 AromaticContact CD2-CE1 3.62Å; F626-F642 HydrophobicContact CD2-CE1 3.62Å; F626-F642 AromaticContact CD2-CZ 3.67Å; F626-F642 HydrophobicContact CD2-CZ 3.67Å; F626-F642 HydrophobicContact CE1-CZ 4.29Å; F626-F642 HydrophobicContact CE2-CE1 4.26Å; F626-F642 HydrophobicContact CE2-CZ 4.24Å; F626-F642 AromaticContact CG-CE1 3.79Å; F626-F642 HydrophobicContact CG-CE1 3.79Å; F626-F642 AromaticContact CG-CZ 3.41Å; F626-F642 HydrophobicContact CG-CZ 3.41Å; F626-F642 VanDerWaalsContact CG-CZ 3.41Å; T638-F642 HydrophobicContact CG2-CE2 4.04Å; T638-F642 WeakPolarHBondContact O-CD2 3.47Å; K639-F642 PolarHBondContact O-N 3.05Å; T640-F642 PolarHBondContact O-N 3.31Å; F642-F648 HydrophobicContact CD1-CB 4.09Å; F642-F648 HydrophobicContact CE1-CB 3.87Å; F642-F648 AromaticContact CE1-CD1 3.97Å; F642-F648 HydrophobicContact CE1-CD1 3.97Å; F642-F648 HydrophobicContact CE1-CG 4.33Å; F642-F648 HydrophobicContact CE2-CD1 4.44Å; F642-F648 HydrophobicContact CZ-CB 4.37Å; F642-F648 AromaticContact CZ-CD1 3.7Å; F642-F648 HydrophobicContact CZ-CD1 3.7Å; F642-F648 HydrophobicContact CZ-CE1 4.35Å; F642-F648 HydrophobicContact CZ-CG 4.34Å; F642-L652 HydrophobicContact CB-CD2 4.49Å; F642-L652 HydrophobicContact CD1-CB 3.8Å; F642-L652 HydrophobicContact CD2-CB 4.28Å; F642-L652 HydrophobicContact CD2-CD2 3.7Å; F642-L652 HydrophobicContact CD2-CG 4.45Å; F642-L652 HydrophobicContact CE1-CB 4.1Å; F642-L652 HydrophobicContact CE2-CD1 4.38Å; F642-L652 HydrophobicContact CE2-CD2 4.15Å; F642-L652 HydrophobicContact CG-CB 3.91Å; F642-L652 HydrophobicContact CG-CD2 4.03Å; F642-L652 HydrophobicContact CZ-CB 4.48Å; F642-L652 HydrophobicContact CZ-CD1 4.47Å; F642-S663 WeakPolarHBondContact CB-OG 3.32Å
643	T	82.4	Confident	82.7	Confident	53 Å²	53	41.6 Å²	41.6	33%	0.325	23%	0.228	S	C	.	.	S	Bend	trans	-60.1	159.8	163.2	69.1	0	0	0	0	111	T640 N645 G646 R665	T640-T643 PolarHBondContact O-N 3.47Å; T640-T643 PolarHBondContact O-OG1 3.41Å; T643-N645 PolarHBondContact O-N 3.31Å; T643-N645 VanDerWaalsContact O-N 3.12Å; T643-G646 PolarHBondContact O-N 2.92Å; T643-G646 PolarHBondContact OG1-N 3.4Å; T643-R665 PolarHBondContact O-NH1 3.04Å
644	E	71.7	Confident	83.2	Confident	135 Å²	135	37.5 Å²	37.5	63%	0.631	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-39.7	-176	-59.2	-167.3	154.7	0	0	113.1	S664 R665	E644-S664 WeakPolarHBondContact CG-OG 3.15Å; E644-S664 PolarHBondContact OE1-OG 3.41Å; E644-R665 PolarHBondContact O-NH1 2.8Å; E644-R665 PolarHBondContact O-NH2 2.9Å
645	N	68.5	Low	83.2	Confident	162 Å²	162	38 Å²	38	87%	0.866	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.6	177.9	-65.5	-24.5	0	0	0	114	T643 G647	T643-N645 PolarHBondContact O-N 3.31Å; T643-N645 VanDerWaalsContact O-N 3.12Å; N645-G647 PolarHBondContact O-N 3.13Å
646	G	61.8	Low	82.8	Confident	16 Å²	16	38 Å²	38	17%	0.165	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.5	-177	0	0	0	0	0	113.3	R605 F641 T643 F648	R605-G646 PolarHBondContact NH1-O 3.41Å; F641-G646 CarbonylContact O-C 3.57Å; F641-G646 VanDerWaalsContact O-CA 3.28Å; F641-G646 WeakPolarHBondContact O-CA 3.43Å; T643-G646 PolarHBondContact O-N 2.92Å; T643-G646 PolarHBondContact OG1-N 3.4Å; G646-F648 VanDerWaalsContact C-N 3.34Å; G646-F648 PolarHBondContact O-N 3.3Å
647	G	70.6	Confident	82.6	Confident	11 Å²	11	35 Å²	35	11%	0.113	19%	0.188	C	C	.	.			trans	77.4	11.4	166.1	0	0	0	0	0	115.9	R605 N645	R605-G647 PolarHBondContact NH2-O 3.12Å; N645-G647 PolarHBondContact O-N 3.13Å
648	F	83	Confident	81.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.188	C	C	.	.			trans	-83.9	126.1	157.5	-73.6	-133.8	0	0	0	106.8	M601 R605 F620 F626 F641 F642 G646 R665	M601-F648 HydrophobicContact CB-CZ 4.11Å; M601-F648 HydrophobicContact SD-CE1 3.72Å; M601-F648 HydrophobicContact SD-CZ 4.09Å; R605-F648 HydrophobicContact CB-CE2 4.28Å; R605-F648 HydrophobicContact CB-CZ 4.14Å; R605-F648 HydrophobicContact CG-CE2 4.43Å; F620-F648 AromaticContact CE2-CD1 3.73Å; F620-F648 HydrophobicContact CE2-CD1 3.73Å; F620-F648 AromaticContact CE2-CE1 3.57Å; F620-F648 HydrophobicContact CE2-CE1 3.57Å; F620-F648 HydrophobicContact CE2-CE2 4.5Å; F620-F648 HydrophobicContact CE2-CG 4.28Å; F620-F648 AromaticContact CE2-CZ 3.98Å; F620-F648 HydrophobicContact CE2-CZ 3.98Å; F620-F648 HydrophobicContact CZ-CB 4.5Å; F620-F648 AromaticContact CZ-CD1 3.81Å; F620-F648 HydrophobicContact CZ-CD1 3.81Å; F620-F648 HydrophobicContact CZ-CD2 4.37Å; F620-F648 HydrophobicContact CZ-CE1 4.1Å; F620-F648 AromaticContact CZ-CG 3.95Å; F620-F648 HydrophobicContact CZ-CG 3.95Å; F620-F648 HydrophobicContact CZ-CZ 4.49Å; F626-F648 HydrophobicContact CD2-CD1 4.48Å; F626-F648 HydrophobicContact CE1-CD1 4.13Å; F626-F648 AromaticContact CE1-CE1 3.85Å; F626-F648 HydrophobicContact CE1-CE1 3.85Å; F626-F648 AromaticContact CE2-CD1 3.77Å; F626-F648 HydrophobicContact CE2-CD1 3.77Å; F626-F648 HydrophobicContact CE2-CE1 4.24Å; F626-F648 AromaticContact CZ-CD1 3.58Å; F626-F648 HydrophobicContact CZ-CD1 3.58Å; F626-F648 AromaticContact CZ-CE1 3.56Å; F626-F648 HydrophobicContact CZ-CE1 3.56Å; F641-F648 HydrophobicContact CB-CD2 3.69Å; F641-F648 HydrophobicContact CB-CE2 3.77Å; F641-F648 HydrophobicContact CB-CG 4.09Å; F641-F648 HydrophobicContact CB-CZ 4.24Å; F641-F648 HydrophobicContact CD1-CD2 4.04Å; F641-F648 AromaticContact CD1-CE2 3.44Å; F641-F648 HydrophobicContact CD1-CE2 3.44Å; F641-F648 VanDerWaalsContact CD1-CE2 3.44Å; F641-F648 HydrophobicContact CD1-CZ 4.1Å; F641-F648 HydrophobicContact CE1-CE2 4.28Å; F641-F648 HydrophobicContact CG-CD2 4.25Å; F641-F648 AromaticContact CG-CE2 3.83Å; F641-F648 HydrophobicContact CG-CE2 3.83Å; F641-F648 HydrophobicContact CG-CZ 4.22Å; F641-F648 PolarHBondContact O-N 3.31Å; F642-F648 HydrophobicContact CD1-CB 4.09Å; F642-F648 HydrophobicContact CE1-CB 3.87Å; F642-F648 AromaticContact CE1-CD1 3.97Å; F642-F648 HydrophobicContact CE1-CD1 3.97Å; F642-F648 HydrophobicContact CE1-CG 4.33Å; F642-F648 HydrophobicContact CE2-CD1 4.44Å; F642-F648 HydrophobicContact CZ-CB 4.37Å; F642-F648 AromaticContact CZ-CD1 3.7Å; F642-F648 HydrophobicContact CZ-CD1 3.7Å; F642-F648 HydrophobicContact CZ-CE1 4.35Å; F642-F648 HydrophobicContact CZ-CG 4.34Å; G646-F648 VanDerWaalsContact C-N 3.34Å; G646-F648 PolarHBondContact O-N 3.3Å; F648-R665 WeakPolarHBondContact O-CD 3.42Å; F648-R665 PolarHBondContact O-NH1 3.21Å
649	F	82.9	Confident	80.7	Confident	125 Å²	125	37 Å²	37	55%	0.548	20%	0.201	S	C	.	.			trans	-98.7	-17.4	-176.2	-67.5	-75.7	0	0	0	112.9	P923 N927	F649-P923 HydrophobicContact CB-CB 4.21Å; F649-N927 PolarHBondContact O-ND2 3.13Å
650	Q	87.7	Confident	79.6	Confident	15 Å²	15	41 Å²	41	7%	0.07	22%	0.221	C	C	.	.	S	Bend	trans	-61	151.3	170.7	-65.2	85.9	-17.7	0	0	111.5	F620 V623 F626	F620-Q650 PolarHBondContact O-NE2 3.42Å; V623-Q650 WeakPolarHBondContact O-CG 3.26Å; V623-Q650 PolarHBondContact O-NE2 3.23Å; F626-Q650 HydrophobicContact CD2-CB 3.75Å; F626-Q650 HydrophobicContact CD2-CG 4.35Å; F626-Q650 HydrophobicContact CE2-CB 3.83Å; F626-Q650 HydrophobicContact CE2-CG 4Å
651	P	89.9	Confident	78.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.212	C	C	.	.			trans	-70.6	155.8	170.7	32.4	-38.7	0	0	0	112.5	L624 A625 F626 R665 M926 L930	L624-P651 WeakPolarHBondContact O-CD 3.1Å; A625-P651 HydrophobicContact CB-CG 3.9Å; F626-P651 PolarHBondContact N-O 3.36Å; P651-R665 CarbonylContact C-O 3.44Å; P651-R665 WeakPolarHBondContact CA-O 3.38Å; P651-M926 HydrophobicContact CB-CG 4.45Å; P651-M926 HydrophobicContact CG-CG 3.8Å; P651-L930 HydrophobicContact CB-CD1 3.92Å; P651-L930 HydrophobicContact CB-CD2 3.64Å; P651-L930 HydrophobicContact CB-CG 4.12Å
652	L	90.7	Very high	78	Confident	1 Å²	1	40 Å²	40	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.2	166.5	178.1	63.9	0	0	0	110.6	F626 T628 F642 R665 E666 I667	F626-L652 HydrophobicContact CB-CD1 3.66Å; F626-L652 WeakPolarHBondContact O-CA 3.32Å; T628-L652 HydrophobicContact CG2-CD1 3.92Å; T628-L652 HydrophobicContact CG2-CD2 4.1Å; T628-L652 HydrophobicContact CG2-CG 4.23Å; F642-L652 HydrophobicContact CB-CD2 4.49Å; F642-L652 HydrophobicContact CD1-CB 3.8Å; F642-L652 HydrophobicContact CD2-CB 4.28Å; F642-L652 HydrophobicContact CD2-CD2 3.7Å; F642-L652 HydrophobicContact CD2-CG 4.45Å; F642-L652 HydrophobicContact CE1-CB 4.1Å; F642-L652 HydrophobicContact CE2-CD1 4.38Å; F642-L652 HydrophobicContact CE2-CD2 4.15Å; F642-L652 HydrophobicContact CG-CB 3.91Å; F642-L652 HydrophobicContact CG-CD2 4.03Å; F642-L652 HydrophobicContact CZ-CB 4.48Å; F642-L652 HydrophobicContact CZ-CD1 4.47Å; L652-R665 PolarHBondContact N-O 3.13Å; L652-E666 HydrophobicContact CB-CB 4.11Å; L652-E666 HydrophobicContact CB-CG 4.22Å; L652-E666 HydrophobicContact CD2-CB 4.34Å; L652-E666 HydrophobicContact CD2-CG 3.93Å; L652-E666 HydrophobicContact CG-CB 4.49Å; L652-E666 HydrophobicContact CG-CG 4.09Å; L652-E666 CarbonylContact O-C 3.51Å; L652-E666 VanDerWaalsContact O-CA 3.28Å; L652-E666 WeakPolarHBondContact O-CA 3.41Å; L652-I667 PolarHBondContact O-N 2.98Å
653	I	91.5	Very high	77.5	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	115.9	171.9	-58.7	174	0	0	0	107.5	F626 V627 T628 I667 I669 L889 A892 L893 W896 L933	F626-I653 PolarHBondContact O-N 2.93Å; V627-I653 CarbonylContact C-O 3.54Å; V627-I653 VanDerWaalsContact CA-O 3.26Å; V627-I653 WeakPolarHBondContact CA-O 3.44Å; V627-I653 HydrophobicContact CG2-CB 4.49Å; T628-I653 PolarHBondContact N-O 3.3Å; I653-I667 HydrophobicContact CG1-CG2 4.45Å; I653-I669 HydrophobicContact CG2-CG2 3.56Å; I653-L889 HydrophobicContact CG2-CD1 4.49Å; I653-A892 HydrophobicContact CG2-CB 4.03Å; I653-L893 HydrophobicContact CD1-CD2 4.11Å; I653-W896 HydrophobicContact CD1-CB 3.92Å; I653-W896 HydrophobicContact CD1-CG 4.07Å; I653-L933 HydrophobicContact CD1-CD1 4.34Å
654	S	88.9	Confident	77.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121	-164.4	-162.3	0	0	0	0	111.8	T628 C657 E666 I667 S668 I669	T628-S654 WeakPolarHBondContact CG2-OG 3.42Å; S654-C657 WeakPolarHBondContact OG-CB 3.3Å; S654-C657 PolarHBondContact OG-N 2.69Å; S654-C657 VanDerWaalsContact OG-N 3.09Å; S654-E666 WeakPolarHBondContact CB-OE1 3.45Å; S654-E666 PolarHBondContact OG-OE1 3.31Å; S654-I667 WeakPolarHBondContact CB-O 3.37Å; S654-I667 PolarHBondContact N-O 3.47Å; S654-S668 WeakPolarHBondContact O-CA 3.49Å; S654-I669 PolarHBondContact O-N 2.91Å; S654-I669 VanDerWaalsContact O-N 3.08Å
655	V	84.6	Confident	77.6	Confident	10 Å²	10	37.1 Å²	37.1	6%	0.061	21%	0.21	C	C	.	.	S	Bend	trans	-82.9	-34.9	165.5	-165.2	0	0	0	0	110.1	L557 T628 I669 L670 Y885 L889	L557-V655 HydrophobicContact CD1-CG1 4.42Å; L557-V655 HydrophobicContact CD2-CG1 4.43Å; L557-V655 HydrophobicContact CD2-CG2 4.31Å; T628-V655 WeakPolarHBondContact O-CG2 3.44Å; T628-V655 PolarHBondContact O-N 3.23Å; V655-I669 HydrophobicContact CB-CD1 4.23Å; V655-I669 HydrophobicContact CG1-CD1 4.25Å; V655-I669 HydrophobicContact CG2-CD1 3.71Å; V655-L670 WeakPolarHBondContact O-CD1 3.46Å; V655-Y885 HydrophobicContact CG1-CD1 3.67Å; V655-Y885 HydrophobicContact CG1-CG 4.19Å; V655-L889 HydrophobicContact CG2-CB 4.5Å; V655-L889 HydrophobicContact CG2-CD1 4.27Å; V655-L889 HydrophobicContact CG2-CD2 4.39Å
656	S	78.2	Confident	78.4	Confident	17 Å²	17	30.2 Å²	30.2	12%	0.119	17%	0.173	C	C	.	.	S	Bend	trans	-73.2	-37.2	-174	-46.3	0	0	0	0	113.2	Q630	Q630-S656 PolarHBondContact N-OG 3.1Å; Q630-S656 WeakPolarHBondContact O-CB 3.5Å; Q630-S656 PolarHBondContact O-OG 2.77Å
657	C	78.3	Confident	79.5	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.			trans	-76.3	144.2	-176.7	-168.2	0	0	0	0	113.3	Y635 S654 S661 C662 E666 S668	Y635-C657 HydrophobicContact CE1-CB 4.32Å; Y635-C657 WeakPolarHBondContact OH-CB 3.48Å; Y635-C657 PolarHBondContact OH-SG 3.41Å; Y635-C657 VanDerWaalsContact OH-SG 3.34Å; S654-C657 WeakPolarHBondContact OG-CB 3.3Å; S654-C657 PolarHBondContact OG-N 2.69Å; S654-C657 VanDerWaalsContact OG-N 3.09Å; C657-S661 VanDerWaalsContact SG-C 3.55Å; C657-S661 PolarHBondContact SG-OG 3.33Å; C657-C662 HydrophobicContact CB-CB 4.19Å; C657-C662 WeakPolarHBondContact CB-SG 3.4Å; C657-C662 WeakPolarHBondContact SG-CA 3.42Å; C657-C662 WeakPolarHBondContact SG-CB 3.25Å; C657-C662 PolarHBondContact SG-N 2.89Å; C657-C662 CovalentContact SG-SG 2.04Å; C657-C662 PolarHBondContact SG-SG 3.19Å; C657-E666 VanDerWaalsContact CB-OE1 3.32Å; C657-E666 WeakPolarHBondContact CB-OE1 3.4Å; C657-S668 VanDerWaalsContact O-CB 3.23Å; C657-S668 WeakPolarHBondContact O-CB 3.25Å; C657-S668 PolarHBondContact O-OG 2.91Å
658	Q	70.2	Confident	80.2	Confident	41 Å²	41	30.6 Å²	30.6	19%	0.192	17%	0.17	C	C	.	.			trans	-134.6	148	172.2	-59.1	-177.3	23.8	0	0	111.2	S661	Q658-S661 WeakPolarHBondContact O-CB 3.25Å; Q658-S661 PolarHBondContact O-N 3.16Å; Q658-S661 PolarHBondContact O-OG 3.36Å
659	G	65.5	Low	80.3	Confident	27 Å²	27	30.7 Å²	30.7	28%	0.278	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	58.5	-135.5	168	0	0	0	0	0	115.7	S661 E705	G659-S661 PolarHBondContact O-N 3.5Å; G659-E705 WeakPolarHBondContact CA-OE1 3.26Å
660	E	62.8	Low	80.1	Confident	151 Å²	151	25.2 Å²	25.2	71%	0.706	15%	0.147	S	C	*	.	G	3₁₀ helix	trans	-79.4	-1.9	-178	-69.4	177.4	-171.3	0	0	112.8	C662 Q674 M709	E660-C662 VanDerWaalsContact C-N 3.28Å; E660-C662 PolarHBondContact O-N 2.9Å; E660-Q674 PolarHBondContact OE1-NE2 2.04Å; E660-Q674 VanDerWaalsContact OE1-NE2 3.08Å; E660-M709 HydrophobicContact CG-CE 4.39Å
661	S	65.9	Low	79.8	Confident	38 Å²	38	24.9 Å²	24.9	27%	0.266	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-78.1	-4.2	-179.3	77.5	0	0	0	0	114.5	K639 C657 Q658 G659 E705	K639-S661 WeakPolarHBondContact CE-O 3.48Å; K639-S661 PolarHBondContact NZ-O 2.91Å; C657-S661 VanDerWaalsContact SG-C 3.55Å; C657-S661 PolarHBondContact SG-OG 3.33Å; Q658-S661 WeakPolarHBondContact O-CB 3.25Å; Q658-S661 PolarHBondContact O-N 3.16Å; Q658-S661 PolarHBondContact O-OG 3.36Å; G659-S661 PolarHBondContact O-N 3.5Å; S661-E705 WeakPolarHBondContact CB-OE2 3.47Å
662	C	75.5	Confident	79.3	Confident	37 Å²	37	26.1 Å²	26.1	25%	0.25	15%	0.154	C	C	.	.	S	Bend	trans	-83	152.2	-174.5	-50.4	0	0	0	0	113.6	C657 E660 E666	C657-C662 HydrophobicContact CB-CB 4.19Å; C657-C662 WeakPolarHBondContact CB-SG 3.4Å; C657-C662 WeakPolarHBondContact SG-CA 3.42Å; C657-C662 WeakPolarHBondContact SG-CB 3.25Å; C657-C662 PolarHBondContact SG-N 2.89Å; C657-C662 CovalentContact SG-SG 2.04Å; C657-C662 PolarHBondContact SG-SG 3.19Å; E660-C662 VanDerWaalsContact C-N 3.28Å; E660-C662 PolarHBondContact O-N 2.9Å; C662-E666 HydrophobicContact CB-CB 4.45Å; C662-E666 HydrophobicContact CB-CG 4.14Å
663	S	76.4	Confident	79	Confident	12 Å²	12	26.2 Å²	26.2	8%	0.084	16%	0.155	C	C	.	.			trans	-77.1	159.7	174.5	61.1	0	0	0	0	112.4	F642 R665 E666	F642-S663 WeakPolarHBondContact CB-OG 3.32Å; S663-R665 PolarHBondContact O-N 3.47Å; S663-R665 VanDerWaalsContact O-N 3.11Å; S663-E666 PolarHBondContact N-OE2 3.11Å; S663-E666 WeakPolarHBondContact O-CB 3.38Å; S663-E666 PolarHBondContact O-N 3.28Å; S663-E666 WeakPolarHBondContact OG-CB 3.31Å; S663-E666 PolarHBondContact OG-OE2 3.17Å
664	S	76	Confident	78.6	Confident	79 Å²	79	29.7 Å²	29.7	55%	0.552	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-2.6	-173	59.3	0	0	0	0	115.6	E644	E644-S664 WeakPolarHBondContact CG-OG 3.15Å; E644-S664 PolarHBondContact OE1-OG 3.41Å
665	R	80.4	Confident	78.5	Confident	36 Å²	36	30.6 Å²	30.6	14%	0.136	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	13.9	171	-59.2	-176.9	-177	131.5	16.2	112.4	T643 E644 F648 P651 L652 S663	T643-R665 PolarHBondContact O-NH1 3.04Å; E644-R665 PolarHBondContact O-NH1 2.8Å; E644-R665 PolarHBondContact O-NH2 2.9Å; F648-R665 WeakPolarHBondContact O-CD 3.42Å; F648-R665 PolarHBondContact O-NH1 3.21Å; P651-R665 CarbonylContact C-O 3.44Å; P651-R665 WeakPolarHBondContact CA-O 3.38Å; L652-R665 PolarHBondContact N-O 3.13Å; S663-R665 PolarHBondContact O-N 3.47Å; S663-R665 VanDerWaalsContact O-N 3.11Å
666	E	85.6	Confident	78.8	Confident	17 Å²	17	31 Å²	31	8%	0.079	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	144.2	-173	175.3	176.7	-158.8	0	0	111.1	Y635 L652 S654 C657 C662 S663	Y635-E666 VanDerWaalsContact CE2-OE1 3.28Å; Y635-E666 WeakPolarHBondContact CE2-OE1 3.48Å; Y635-E666 PolarHBondContact OH-OE1 2.9Å; Y635-E666 VanDerWaalsContact OH-OE1 3.1Å; Y635-E666 PolarHBondContact OH-OE2 2.98Å; L652-E666 HydrophobicContact CB-CB 4.11Å; L652-E666 HydrophobicContact CB-CG 4.22Å; L652-E666 HydrophobicContact CD2-CB 4.34Å; L652-E666 HydrophobicContact CD2-CG 3.93Å; L652-E666 HydrophobicContact CG-CB 4.49Å; L652-E666 HydrophobicContact CG-CG 4.09Å; L652-E666 CarbonylContact O-C 3.51Å; L652-E666 VanDerWaalsContact O-CA 3.28Å; L652-E666 WeakPolarHBondContact O-CA 3.41Å; S654-E666 WeakPolarHBondContact CB-OE1 3.45Å; S654-E666 PolarHBondContact OG-OE1 3.31Å; C657-E666 VanDerWaalsContact CB-OE1 3.32Å; C657-E666 WeakPolarHBondContact CB-OE1 3.4Å; C662-E666 HydrophobicContact CB-CB 4.45Å; C662-E666 HydrophobicContact CB-CG 4.14Å; S663-E666 PolarHBondContact N-OE2 3.11Å; S663-E666 WeakPolarHBondContact O-CB 3.38Å; S663-E666 PolarHBondContact O-N 3.28Å; S663-E666 WeakPolarHBondContact OG-CB 3.31Å; S663-E666 PolarHBondContact OG-OE2 3.17Å
667	I	85.6	Confident	79.3	Confident	19 Å²	19	30.3 Å²	30.3	10%	0.097	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.3	171.9	-172.3	161.5	0	0	0	110.5	L652 I653 S654 L930 L933 K934	L652-I667 PolarHBondContact O-N 2.98Å; I653-I667 HydrophobicContact CG1-CG2 4.45Å; S654-I667 WeakPolarHBondContact CB-O 3.37Å; S654-I667 PolarHBondContact N-O 3.47Å; I667-L930 HydrophobicContact CB-CD2 4.49Å; I667-L930 WeakPolarHBondContact CD1-O 3.43Å; I667-L930 HydrophobicContact CG2-CD2 3.82Å; I667-L933 HydrophobicContact CD1-CB 4.27Å; I667-K934 HydrophobicContact CD1-CB 4.1Å
668	S	85	Confident	79.9	Confident	16 Å²	16	35.7 Å²	35.7	11%	0.112	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	130.2	163.7	-177.7	0	0	0	0	109.3	S654 C657 L670	S654-S668 WeakPolarHBondContact O-CA 3.49Å; C657-S668 VanDerWaalsContact O-CB 3.23Å; C657-S668 WeakPolarHBondContact O-CB 3.25Å; C657-S668 PolarHBondContact O-OG 2.91Å; S668-L670 VanDerWaalsContact C-N 3.26Å; S668-L670 PolarHBondContact OG-N 3.31Å
669	I	84	Confident	80.9	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.015	19%	0.187	C	C	.	.	S	Bend	trans	-81	-8.8	174.5	67.4	177.9	0	0	0	112.8	I653 S654 V655 F888 L889 A892	I653-I669 HydrophobicContact CG2-CG2 3.56Å; S654-I669 PolarHBondContact O-N 2.91Å; S654-I669 VanDerWaalsContact O-N 3.08Å; V655-I669 HydrophobicContact CB-CD1 4.23Å; V655-I669 HydrophobicContact CG1-CD1 4.25Å; V655-I669 HydrophobicContact CG2-CD1 3.71Å; I669-F888 HydrophobicContact CB-CB 4.47Å; I669-F888 HydrophobicContact CD1-CB 3.85Å; I669-F888 HydrophobicContact CG1-CB 4.08Å; I669-F888 WeakPolarHBondContact O-CD1 3.34Å; I669-L889 HydrophobicContact CD1-CB 3.92Å; I669-L889 HydrophobicContact CD1-CD1 4.48Å; I669-A892 HydrophobicContact CB-CB 4.33Å; I669-A892 HydrophobicContact CG2-CB 3.54Å
670	L	80.5	Confident	82.2	Confident	10 Å²	10	32.5 Å²	32.5	5%	0.052	17%	0.174	C	C	.	.	S	Bend	trans	-97.6	153.1	-176.1	-63.4	171	0	0	0	111.1	V655 S668 Y885 F888	V655-L670 WeakPolarHBondContact O-CD1 3.46Å; S668-L670 VanDerWaalsContact C-N 3.26Å; S668-L670 PolarHBondContact OG-N 3.31Å; L670-Y885 HydrophobicContact CD1-CD1 4.03Å; L670-Y885 HydrophobicContact CD1-CE1 3.78Å; L670-Y885 HydrophobicContact CD2-CD1 4.04Å; L670-Y885 HydrophobicContact CD2-CE1 4.26Å; L670-F888 HydrophobicContact CD2-CD2 4.17Å; L670-F888 HydrophobicContact CD2-CG 4.34Å
671	P	80.3	Confident	83.6	Confident	8 Å²	8	25.4 Å²	25.4	5%	0.052	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-64.5	148.1	169.9	29.3	-35.7	0	0	0	110.7	L675 P820 F939	P671-L675 HydrophobicContact CB-CD1 4.38Å; P671-P820 HydrophobicContact CG-CB 3.81Å; P671-P820 HydrophobicContact CG-CG 3.82Å; P671-F939 HydrophobicContact CB-CE2 3.72Å; P671-F939 HydrophobicContact CB-CZ 3.66Å; P671-F939 HydrophobicContact CG-CE1 4.03Å; P671-F939 HydrophobicContact CG-CE2 3.85Å; P671-F939 HydrophobicContact CG-CZ 3.43Å; P671-F939 VanDerWaalsContact CG-CZ 3.43Å
672	S	80.2	Confident	84.7	Confident	25 Å²	25	24.7 Å²	24.7	18%	0.175	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-73	156	-173.1	64.8	0	0	0	0	113.9	Q674 L675 L676	S672-Q674 PolarHBondContact O-N 2.85Å; S672-Q674 VanDerWaalsContact O-N 3.14Å; S672-L675 WeakPolarHBondContact O-CA 3.39Å; S672-L675 WeakPolarHBondContact O-CB 3.36Å; S672-L675 PolarHBondContact O-N 3.26Å; S672-L676 PolarHBondContact O-N 3Å
673	S	83.5	Confident	85.4	Confident	3 Å²	3	22.9 Å²	22.9	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-48.2	-34.3	169	46.5	0	0	0	0	113.3	S677 E705	S673-S677 PolarHBondContact O-N 2.92Å; S673-E705 PolarHBondContact OG-OE1 3.01Å
674	Q	83.8	Confident	86	Confident	74 Å²	74	22.3 Å²	22.3	35%	0.346	12%	0.12	S	C	.	.	H	α-helix	trans	-72.8	-21.1	174.7	-64.5	177.1	1.5	0	0	115.1	E660 S672 S677 K678 M709	E660-Q674 PolarHBondContact OE1-NE2 2.04Å; E660-Q674 VanDerWaalsContact OE1-NE2 3.08Å; S672-Q674 PolarHBondContact O-N 2.85Å; S672-Q674 VanDerWaalsContact O-N 3.14Å; Q674-S677 PolarHBondContact O-OG 3.03Å; Q674-K678 WeakPolarHBondContact O-CD 3.44Å; Q674-K678 VanDerWaalsContact O-CG 3.31Å; Q674-K678 WeakPolarHBondContact O-CG 3.38Å; Q674-M709 HydrophobicContact CG-CE 3.99Å; Q674-M709 HydrophobicContact CG-CG 4.25Å; Q674-M709 HydrophobicContact CG-SD 3.59Å; Q674-M709 VanDerWaalsContact CG-SD 3.59Å
675	L	87.3	Confident	86.5	Confident	19 Å²	19	21.8 Å²	21.8	10%	0.099	11%	0.113	C	C	.	.	H	α-helix	trans	-88.2	-39.7	173.8	-70	163.5	0	0	0	110.3	P671 S672 S677 K678 A679 D937 F939 W959	P671-L675 HydrophobicContact CB-CD1 4.38Å; S672-L675 WeakPolarHBondContact O-CA 3.39Å; S672-L675 WeakPolarHBondContact O-CB 3.36Å; S672-L675 PolarHBondContact O-N 3.26Å; L675-S677 VanDerWaalsContact C-N 3.32Å; L675-S677 PolarHBondContact O-N 3.42Å; L675-K678 PolarHBondContact O-N 3.07Å; L675-A679 PolarHBondContact O-N 2.69Å; L675-D937 HydrophobicContact CD1-CB 3.83Å; L675-D937 WeakPolarHBondContact CD1-OD1 3.22Å; L675-F939 HydrophobicContact CB-CE2 3.91Å; L675-F939 HydrophobicContact CB-CZ 4.41Å; L675-W959 HydrophobicContact CB-CH2 4.46Å; L675-W959 HydrophobicContact CB-CZ3 4.44Å; L675-W959 HydrophobicContact CD2-CH2 3.94Å; L675-W959 HydrophobicContact CD2-CZ3 4.37Å
676	L	89.6	Confident	86.7	Confident	19 Å²	19	25.3 Å²	25.3	10%	0.099	13%	0.131	C	C	.	.	H	α-helix	trans	-56.2	-46.2	168.8	175.4	61.6	0	0	0	110.9	S672 K678 A679 L680 A706 F752 T779 M818 F939	S672-L676 PolarHBondContact O-N 3Å; L676-K678 VanDerWaalsContact C-N 3.33Å; L676-K678 PolarHBondContact O-N 3.26Å; L676-A679 PolarHBondContact O-N 3.35Å; L676-L680 HydrophobicContact CD1-CD1 3.97Å; L676-L680 HydrophobicContact CD1-CD2 4.44Å; L676-L680 HydrophobicContact CD1-CG 4.01Å; L676-L680 HydrophobicContact CG-CD1 3.89Å; L676-L680 HydrophobicContact CG-CG 4.38Å; L676-L680 VanDerWaalsContact O-CG 3.25Å; L676-L680 WeakPolarHBondContact O-CG 3.4Å; L676-L680 PolarHBondContact O-N 3.08Å; L676-A706 HydrophobicContact CD2-CB 4.41Å; L676-F752 HydrophobicContact CD2-CE1 4.36Å; L676-T779 HydrophobicContact CD1-CG2 4.31Å; L676-M818 HydrophobicContact CD1-CB 4.42Å; L676-M818 HydrophobicContact CD1-CG 4.11Å; L676-F939 HydrophobicContact CB-CE1 3.96Å; L676-F939 HydrophobicContact CB-CZ 3.87Å; L676-F939 HydrophobicContact CD1-CD1 4.27Å; L676-F939 HydrophobicContact CD1-CE1 3.82Å; L676-F939 HydrophobicContact CG-CE1 4.46Å
677	S	90.1	Very high	86.6	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.014	14%	0.136	C	C	.	.	H	α-helix	trans	-60.2	-41.2	177.2	71.2	0	0	0	0	112.4	S673 Q674 L675 L680 L681 S713	S673-S677 PolarHBondContact O-N 2.92Å; Q674-S677 PolarHBondContact O-OG 3.03Å; L675-S677 VanDerWaalsContact C-N 3.32Å; L675-S677 PolarHBondContact O-N 3.42Å; S677-L680 PolarHBondContact O-N 3.28Å; S677-L681 WeakPolarHBondContact O-CB 3.31Å; S677-L681 WeakPolarHBondContact O-CG 3.15Å; S677-L681 PolarHBondContact O-N 3.29Å; S677-S713 PolarHBondContact OG-OG 3.21Å
678	K	90	Very high	86.6	Confident	114 Å²	114	31 Å²	31	50%	0.496	16%	0.161	S	C	.	.	H	α-helix	trans	-65.1	-40	175.1	-71.1	170.6	-175.4	176.4	0	112.9	Q674 L675 L676 L681 S682 W959	Q674-K678 WeakPolarHBondContact O-CD 3.44Å; Q674-K678 VanDerWaalsContact O-CG 3.31Å; Q674-K678 WeakPolarHBondContact O-CG 3.38Å; L675-K678 PolarHBondContact O-N 3.07Å; L676-K678 VanDerWaalsContact C-N 3.33Å; L676-K678 PolarHBondContact O-N 3.26Å; K678-L681 PolarHBondContact O-N 3.02Å; K678-S682 WeakPolarHBondContact O-CB 3.38Å; K678-S682 PolarHBondContact O-N 3.23Å; K678-W959 HydrophobicContact CB-CH2 4.09Å; K678-W959 HydrophobicContact CB-CZ2 3.67Å
679	A	91	Very high	86.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-46	176.4	0	0	0	0	0	111.5	L675 L676 S682 L683 M818 F939 W959	L675-A679 PolarHBondContact O-N 2.69Å; L676-A679 PolarHBondContact O-N 3.35Å; A679-S682 PolarHBondContact O-N 3.06Å; A679-L683 PolarHBondContact O-N 3.49Å; A679-M818 HydrophobicContact CB-CE 4.15Å; A679-M818 HydrophobicContact CB-CG 4.15Å; A679-M818 HydrophobicContact CB-SD 4.11Å; A679-F939 HydrophobicContact CB-CB 4.43Å; A679-F939 HydrophobicContact CB-CD2 4.31Å; A679-F939 HydrophobicContact CB-CG 4.28Å; A679-W959 HydrophobicContact CB-CB 4.26Å; A679-W959 HydrophobicContact CB-CD2 3.58Å; A679-W959 HydrophobicContact CB-CE3 3.8Å; A679-W959 HydrophobicContact CB-CG 3.79Å; A679-W959 HydrophobicContact CB-CZ3 4.38Å
680	L	92.7	Very high	86.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.7	-45.4	175.1	-65.2	167.7	0	0	0	111.4	L676 S677 S682 L683 L684 F710 F752 L777 T779 M818	L676-L680 HydrophobicContact CD1-CD1 3.97Å; L676-L680 HydrophobicContact CD1-CD2 4.44Å; L676-L680 HydrophobicContact CD1-CG 4.01Å; L676-L680 HydrophobicContact CG-CD1 3.89Å; L676-L680 HydrophobicContact CG-CG 4.38Å; L676-L680 VanDerWaalsContact O-CG 3.25Å; L676-L680 WeakPolarHBondContact O-CG 3.4Å; L676-L680 PolarHBondContact O-N 3.08Å; S677-L680 PolarHBondContact O-N 3.28Å; L680-S682 PolarHBondContact O-N 3.36Å; L680-L683 VanDerWaalsContact O-CB 3.31Å; L680-L683 WeakPolarHBondContact O-CB 3.17Å; L680-L683 PolarHBondContact O-N 2.94Å; L680-L683 VanDerWaalsContact O-N 3.12Å; L680-L684 WeakPolarHBondContact O-CG 3.08Å; L680-L684 PolarHBondContact O-N 3.13Å; L680-F710 HydrophobicContact CB-CD2 4.17Å; L680-F710 HydrophobicContact CB-CE2 3.99Å; L680-F710 HydrophobicContact CD1-CD2 4Å; L680-F710 HydrophobicContact CD1-CE2 4.39Å; L680-F752 HydrophobicContact CD1-CE1 3.9Å; L680-F752 HydrophobicContact CD1-CZ 3.73Å; L680-L777 HydrophobicContact CD2-CD1 4.1Å; L680-L777 HydrophobicContact CD2-CD2 3.64Å; L680-L777 HydrophobicContact CD2-CG 3.77Å; L680-T779 HydrophobicContact CD1-CG2 3.96Å; L680-T779 HydrophobicContact CD2-CG2 3.89Å; L680-M818 HydrophobicContact CD2-CB 3.99Å; L680-M818 HydrophobicContact CD2-CG 4.39Å
681	L	91.5	Very high	87.2	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-62.5	-42.1	177.6	-72.3	172.4	0	0	0	112.3	S677 K678 L683 L684 T685 F710 A714 Q717 I719	S677-L681 WeakPolarHBondContact O-CB 3.31Å; S677-L681 WeakPolarHBondContact O-CG 3.15Å; S677-L681 PolarHBondContact O-N 3.29Å; K678-L681 PolarHBondContact O-N 3.02Å; L681-L683 PolarHBondContact O-N 3.34Å; L681-L684 HydrophobicContact CD2-CD1 4.41Å; L681-L684 PolarHBondContact O-N 2.92Å; L681-L684 VanDerWaalsContact O-N 3.14Å; L681-T685 WeakPolarHBondContact O-CG2 3.46Å; L681-T685 PolarHBondContact O-N 3.35Å; L681-T685 PolarHBondContact O-OG1 2.88Å; L681-F710 HydrophobicContact CD2-CE2 4.22Å; L681-F710 HydrophobicContact CG-CE2 4.48Å; L681-A714 HydrophobicContact CD2-CB 3.96Å; L681-Q717 HydrophobicContact CD1-CG 4.37Å; L681-I719 HydrophobicContact CD2-CD1 3.73Å
682	S	90.3	Very high	87.7	Confident	23 Å²	23	32.9 Å²	32.9	16%	0.161	17%	0.171	C	C	.	.	H	α-helix	trans	-57.6	-33.8	174.5	-162.2	0	0	0	0	112.3	K678 A679 L680 T685 Q686 L965	K678-S682 WeakPolarHBondContact O-CB 3.38Å; K678-S682 PolarHBondContact O-N 3.23Å; A679-S682 PolarHBondContact O-N 3.06Å; L680-S682 PolarHBondContact O-N 3.36Å; S682-T685 WeakPolarHBondContact CA-OG1 3.37Å; S682-T685 PolarHBondContact O-OG1 2.89Å; S682-Q686 WeakPolarHBondContact O-CB 3.09Å; S682-Q686 PolarHBondContact O-N 3.46Å; S682-L965 WeakPolarHBondContact OG-CB 3.24Å
683	L	89.6	Confident	88.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71.9	-47.8	174	-171.3	71.2	0	0	0	112	A679 L680 L681 T685 Q686 F687 L777 L816 M818 L941 L965	A679-L683 PolarHBondContact O-N 3.49Å; L680-L683 VanDerWaalsContact O-CB 3.31Å; L680-L683 WeakPolarHBondContact O-CB 3.17Å; L680-L683 PolarHBondContact O-N 2.94Å; L680-L683 VanDerWaalsContact O-N 3.12Å; L681-L683 PolarHBondContact O-N 3.34Å; L683-T685 VanDerWaalsContact C-N 3.34Å; L683-T685 PolarHBondContact O-N 2.92Å; L683-Q686 PolarHBondContact O-N 2.94Å; L683-F687 HydrophobicContact CD1-CD2 4.15Å; L683-F687 HydrophobicContact CD1-CE2 3.67Å; L683-F687 HydrophobicContact CG-CD2 4.28Å; L683-F687 HydrophobicContact CG-CE2 4.24Å; L683-F687 WeakPolarHBondContact O-CD2 3.48Å; L683-F687 PolarHBondContact O-N 3.49Å; L683-L777 HydrophobicContact CD2-CD1 3.51Å; L683-L777 HydrophobicContact CD2-CD2 3.88Å; L683-L777 HydrophobicContact CD2-CG 4.37Å; L683-L816 HydrophobicContact CD2-CD1 4.49Å; L683-M818 HydrophobicContact CB-CE 4.32Å; L683-M818 HydrophobicContact CD2-CE 4.34Å; L683-L941 HydrophobicContact CD1-CD1 4.29Å; L683-L941 HydrophobicContact CD1-CD2 3.57Å; L683-L941 HydrophobicContact CD2-CD1 3.91Å; L683-L965 HydrophobicContact CB-CD2 4.12Å; L683-L965 HydrophobicContact CD1-CD2 3.52Å; L683-L965 HydrophobicContact CG-CD2 4.45Å
684	L	89.6	Confident	88.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.4	-40	179.6	-62.4	179	0	0	0	111.8	L680 L681 F687 N688 W689 L692 F710 I719 V748 L777	L680-L684 WeakPolarHBondContact O-CG 3.08Å; L680-L684 PolarHBondContact O-N 3.13Å; L681-L684 HydrophobicContact CD2-CD1 4.41Å; L681-L684 PolarHBondContact O-N 2.92Å; L681-L684 VanDerWaalsContact O-N 3.14Å; L684-F687 PolarHBondContact O-N 3.18Å; L684-N688 PolarHBondContact O-N 2.93Å; L684-N688 VanDerWaalsContact O-N 3.09Å; L684-W689 HydrophobicContact CD2-CB 4.35Å; L684-W689 HydrophobicContact CD2-CE3 3.78Å; L684-W689 PolarHBondContact O-N 3.26Å; L684-L692 HydrophobicContact CD1-CD2 3.58Å; L684-L692 HydrophobicContact CD2-CD2 4.5Å; L684-F710 HydrophobicContact CD1-CE2 3.97Å; L684-F710 HydrophobicContact CD1-CZ 3.78Å; L684-I719 HydrophobicContact CB-CD1 3.71Å; L684-I719 HydrophobicContact CD1-CD1 3.89Å; L684-I719 HydrophobicContact CD1-CG2 4.33Å; L684-I719 HydrophobicContact CG-CD1 4.47Å; L684-V748 HydrophobicContact CD2-CG1 4.2Å; L684-L777 HydrophobicContact CD2-CD2 4.25Å
685	T	86.4	Confident	88.9	Confident	67 Å²	67	28 Å²	28	41%	0.411	15%	0.145	S	C	.	.	H	α-helix	trans	-68.5	-36.5	175.5	54.1	0	0	0	0	112.5	L681 S682 L683 F687 N688	L681-T685 WeakPolarHBondContact O-CG2 3.46Å; L681-T685 PolarHBondContact O-N 3.35Å; L681-T685 PolarHBondContact O-OG1 2.88Å; S682-T685 WeakPolarHBondContact CA-OG1 3.37Å; S682-T685 PolarHBondContact O-OG1 2.89Å; L683-T685 VanDerWaalsContact C-N 3.34Å; L683-T685 PolarHBondContact O-N 2.92Å; T685-F687 PolarHBondContact O-N 2.83Å; T685-N688 PolarHBondContact O-N 3.24Å; T685-N688 VanDerWaalsContact O-N 3.16Å
686	Q	84.8	Confident	89	Confident	111 Å²	111	27.1 Å²	27.1	52%	0.519	14%	0.14	S	C	.	.	H	α-helix	trans	-62.3	-31.4	177.3	-173	67.3	6.9	0	0	112.2	S682 L683 L965	S682-Q686 WeakPolarHBondContact O-CB 3.09Å; S682-Q686 PolarHBondContact O-N 3.46Å; L683-Q686 PolarHBondContact O-N 2.94Å; Q686-L965 HydrophobicContact CB-CD2 4.37Å
687	F	83.6	Confident	88.8	Confident	39 Å²	39	26.2 Å²	26.2	17%	0.171	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	7.1	176.5	-65.6	-63.9	0	0	0	114.4	L683 L684 T685 W689 L983	L683-F687 HydrophobicContact CD1-CD2 4.15Å; L683-F687 HydrophobicContact CD1-CE2 3.67Å; L683-F687 HydrophobicContact CG-CD2 4.28Å; L683-F687 HydrophobicContact CG-CE2 4.24Å; L683-F687 WeakPolarHBondContact O-CD2 3.48Å; L683-F687 PolarHBondContact O-N 3.49Å; L684-F687 PolarHBondContact O-N 3.18Å; T685-F687 PolarHBondContact O-N 2.83Å; F687-W689 HydrophobicContact CB-CD2 3.73Å; F687-W689 HydrophobicContact CB-CE3 3.88Å; F687-W689 HydrophobicContact CB-CG 4.25Å; F687-W689 HydrophobicContact CB-CH2 4.24Å; F687-W689 HydrophobicContact CB-CZ2 4.1Å; F687-W689 HydrophobicContact CB-CZ3 4.14Å; F687-W689 HydrophobicContact CD2-CE3 4.3Å; F687-W689 AromaticContact CD2-CH2 3.99Å; F687-W689 HydrophobicContact CD2-CH2 3.99Å; F687-W689 AromaticContact CD2-CZ3 3.82Å; F687-W689 HydrophobicContact CD2-CZ3 3.82Å; F687-W689 HydrophobicContact CG-CE3 4.47Å; F687-W689 HydrophobicContact CG-CH2 4.17Å; F687-W689 HydrophobicContact CG-CZ2 4.34Å; F687-W689 HydrophobicContact CG-CZ3 4.24Å; F687-W689 PolarHBondContact O-N 2.65Å; F687-L983 HydrophobicContact CD1-CD1 3.85Å; F687-L983 HydrophobicContact CD1-CD2 4.28Å; F687-L983 HydrophobicContact CE1-CD1 4.01Å; F687-L983 HydrophobicContact CE1-CD2 4.35Å
688	N	85.3	Confident	88.3	Confident	116 Å²	116	27.9 Å²	27.9	62%	0.62	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	28.4	-176.6	-64.8	-62.1	0	0	0	115.2	L684 T685 S690 H987	L684-N688 PolarHBondContact O-N 2.93Å; L684-N688 VanDerWaalsContact O-N 3.09Å; T685-N688 PolarHBondContact O-N 3.24Å; T685-N688 VanDerWaalsContact O-N 3.16Å; N688-S690 PolarHBondContact O-N 2.98Å; N688-H987 PolarHBondContact O-CE1 3.3Å; N688-H987 PolarHBondContact O-ND1 3.26Å
689	W	87.8	Confident	87.4	Confident	10 Å²	10	28.2 Å²	28.2	4%	0.038	15%	0.151	C	C	.	.			trans	-78.7	118.9	177.2	-67.6	-32.9	0	0	0	110.9	L684 F687 V748 V775 L983 P984	L684-W689 HydrophobicContact CD2-CB 4.35Å; L684-W689 HydrophobicContact CD2-CE3 3.78Å; L684-W689 PolarHBondContact O-N 3.26Å; F687-W689 HydrophobicContact CB-CD2 3.73Å; F687-W689 HydrophobicContact CB-CE3 3.88Å; F687-W689 HydrophobicContact CB-CG 4.25Å; F687-W689 HydrophobicContact CB-CH2 4.24Å; F687-W689 HydrophobicContact CB-CZ2 4.1Å; F687-W689 HydrophobicContact CB-CZ3 4.14Å; F687-W689 HydrophobicContact CD2-CE3 4.3Å; F687-W689 AromaticContact CD2-CH2 3.99Å; F687-W689 HydrophobicContact CD2-CH2 3.99Å; F687-W689 AromaticContact CD2-CZ3 3.82Å; F687-W689 HydrophobicContact CD2-CZ3 3.82Å; F687-W689 HydrophobicContact CG-CE3 4.47Å; F687-W689 HydrophobicContact CG-CH2 4.17Å; F687-W689 HydrophobicContact CG-CZ2 4.34Å; F687-W689 HydrophobicContact CG-CZ3 4.24Å; F687-W689 PolarHBondContact O-N 2.65Å; W689-V748 HydrophobicContact CB-CG2 4.49Å; W689-V748 HydrophobicContact CD2-CG1 4.36Å; W689-V748 HydrophobicContact CD2-CG2 3.67Å; W689-V748 HydrophobicContact CE3-CG1 4.05Å; W689-V748 HydrophobicContact CE3-CG2 4.13Å; W689-V748 HydrophobicContact CG-CG2 3.85Å; W689-V748 HydrophobicContact CZ2-CG2 4.32Å; W689-V748 HydrophobicContact CZ3-CG1 4.49Å; W689-V775 HydrophobicContact CH2-CB 4.38Å; W689-V775 HydrophobicContact CH2-CG1 4.07Å; W689-V775 HydrophobicContact CH2-CG2 4.17Å; W689-V775 HydrophobicContact CZ2-CG2 4.27Å; W689-V775 HydrophobicContact CZ3-CG1 4.49Å; W689-L983 HydrophobicContact CH2-CD2 4.38Å; W689-L983 HydrophobicContact CZ2-CD2 3.9Å; W689-P984 HydrophobicContact CZ2-CG 4.12Å; W689-P984 PolarHBondContact NE1-O 3.01Å
690	S	86	Confident	86.5	Confident	33 Å²	33	30.3 Å²	30.3	23%	0.231	16%	0.16	C	C	.	.			trans	-122.6	0.6	-176.8	67	0	0	0	0	114.6	N688 C720 S986 H987 C988	N688-S690 PolarHBondContact O-N 2.98Å; S690-C720 PolarHBondContact O-N 2.67Å; S690-S986 PolarHBondContact N-O 3.08Å; S690-H987 WeakPolarHBondContact OG-CA 3.44Å; S690-C988 PolarHBondContact OG-N 2.88Å
691	L	87.2	Confident	85.5	Confident	33 Å²	33	33.7 Å²	33.7	17%	0.173	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	132.5	171.1	178.5	58.9	0	0	0	109.4	C720 N746 S986 C988	L691-C720 WeakPolarHBondContact CA-O 3.45Å; L691-C720 HydrophobicContact CD1-CB 4.4Å; L691-N746 VanDerWaalsContact CD2-OD1 3.31Å; L691-N746 WeakPolarHBondContact CD2-OD1 3Å; L691-N746 WeakPolarHBondContact CG-OD1 3.39Å; L691-S986 PolarHBondContact N-O 3.22Å; L691-S986 WeakPolarHBondContact O-CB 3.34Å; L691-S986 PolarHBondContact O-OG 2.99Å; L691-C988 HydrophobicContact CB-CB 4.19Å
692	L	90.8	Very high	84.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	160.3	-178.7	62.6	86.6	0	0	0	112.6	L684 V694 F710 I719 C720 I721 G722 V748 V750	L684-L692 HydrophobicContact CD1-CD2 3.58Å; L684-L692 HydrophobicContact CD2-CD2 4.5Å; L692-V694 HydrophobicContact CD1-CG2 3.39Å; L692-F710 HydrophobicContact CD1-CE1 4.25Å; L692-F710 HydrophobicContact CD2-CE1 4.34Å; L692-F710 HydrophobicContact CD2-CZ 3.93Å; L692-I719 HydrophobicContact CD2-CG2 3.63Å; L692-I719 HydrophobicContact CG-CG2 4.37Å; L692-C720 PolarHBondContact N-O 2.89Å; L692-C720 VanDerWaalsContact N-O 3.09Å; L692-I721 HydrophobicContact CD1-CG1 3.9Å; L692-G722 PolarHBondContact O-N 2.94Å; L692-V748 WeakPolarHBondContact CA-O 3.48Å; L692-V748 HydrophobicContact CB-CB 4.22Å; L692-V748 HydrophobicContact CB-CG1 4.18Å; L692-V748 WeakPolarHBondContact CB-O 3.35Å; L692-V750 HydrophobicContact CD1-CG2 4.08Å; L692-V750 HydrophobicContact CD2-CG2 4.05Å
693	S	90.7	Very high	84.3	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	153.8	164.5	-59	0	0	0	0	110	E723 N746 V748 V749 V750	S693-E723 CarbonylContact C-O 3.59Å; S693-E723 WeakPolarHBondContact CA-O 3.46Å; S693-E723 PolarHBondContact OG-OE2 3.38Å; S693-N746 WeakPolarHBondContact OG-CB 3.48Å; S693-N746 PolarHBondContact OG-ND2 2.89Å; S693-V748 PolarHBondContact N-O 3.1Å; S693-V749 WeakPolarHBondContact O-CA 3.35Å; S693-V750 PolarHBondContact O-N 2.88Å
694	V	91.8	Very high	84	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.3	176.1	-170.5	0	0	0	0	110.4	L692 V696 F707 F710 I721 E723 V724 F725 V750 F752	L692-V694 HydrophobicContact CD1-CG2 3.39Å; V694-V696 HydrophobicContact CG1-CG2 3.79Å; V694-F707 HydrophobicContact CB-CD2 4.43Å; V694-F707 HydrophobicContact CB-CE2 4.19Å; V694-F707 HydrophobicContact CG1-CD2 3.67Å; V694-F707 HydrophobicContact CG1-CE2 3.94Å; V694-F707 HydrophobicContact CG2-CE2 4.17Å; V694-F710 HydrophobicContact CG2-CE1 4.37Å; V694-I721 HydrophobicContact CG2-CD1 4.43Å; V694-I721 HydrophobicContact CG2-CG1 4.22Å; V694-I721 HydrophobicContact CG2-CG2 3.94Å; V694-E723 PolarHBondContact N-O 2.9Å; V694-V724 HydrophobicContact CB-CG2 4.46Å; V694-V724 CarbonylContact O-C 3.58Å; V694-V724 WeakPolarHBondContact O-CA 3.37Å; V694-F725 PolarHBondContact O-N 3.26Å; V694-V750 CarbonylContact C-O 3.59Å; V694-V750 WeakPolarHBondContact CA-O 3.43Å; V694-V750 WeakPolarHBondContact CG1-O 3.26Å; V694-F752 HydrophobicContact CG1-CD2 3.68Å; V694-F752 HydrophobicContact CG1-CE2 4.03Å
695	L	90.7	Very high	83.6	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126	174.9	-175.5	66.5	0	0	0	109.1	F725 I727 V749 V750 V751 F752 F758 F761	L695-F725 WeakPolarHBondContact CA-O 3.4Å; L695-F725 HydrophobicContact CD1-CB 3.66Å; L695-I727 HydrophobicContact CD1-CD1 3.73Å; L695-I727 HydrophobicContact CD1-CG1 3.63Å; L695-I727 HydrophobicContact CD2-CD1 4.08Å; L695-I727 HydrophobicContact CG-CD1 3.8Å; L695-I727 HydrophobicContact CG-CG1 4.21Å; L695-V749 HydrophobicContact CB-CG1 4.37Å; L695-V750 PolarHBondContact N-O 3.46Å; L695-V751 HydrophobicContact CB-CG2 4.36Å; L695-V751 HydrophobicContact CD2-CG1 4.26Å; L695-V751 HydrophobicContact CD2-CG2 4.25Å; L695-F752 PolarHBondContact O-N 2.94Å; L695-F758 HydrophobicContact CD2-CD2 3.67Å; L695-F758 HydrophobicContact CD2-CE2 4Å; L695-F761 HydrophobicContact CD1-CD2 3.64Å; L695-F761 HydrophobicContact CD1-CE2 3.69Å; L695-F761 HydrophobicContact CD1-CG 4.11Å; L695-F761 HydrophobicContact CD1-CZ 4.2Å; L695-F761 HydrophobicContact CD2-CB 4.26Å; L695-F761 HydrophobicContact CD2-CD1 3.46Å; L695-F761 VanDerWaalsContact CD2-CD1 3.46Å; L695-F761 HydrophobicContact CD2-CD2 4Å; L695-F761 HydrophobicContact CD2-CE1 3.64Å; L695-F761 HydrophobicContact CD2-CE2 4.16Å; L695-F761 HydrophobicContact CD2-CG 3.65Å; L695-F761 HydrophobicContact CD2-CZ 3.98Å; L695-F761 HydrophobicContact CG-CD2 4.5Å
696	V	89.8	Confident	83.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	126.6	-170.8	-170	0	0	0	0	111.1	V694 S698 L704 F707 V724 F725 F726 I727 F752	V694-V696 HydrophobicContact CG1-CG2 3.79Å; V696-S698 PolarHBondContact O-N 2.96Å; V696-L704 HydrophobicContact CG1-CD1 4.35Å; V696-F707 HydrophobicContact CG1-CB 4.28Å; V696-F707 HydrophobicContact CG1-CD1 4.5Å; V696-F707 HydrophobicContact CG2-CB 4.04Å; V696-F707 HydrophobicContact CG2-CD1 3.94Å; V696-F707 HydrophobicContact CG2-CD2 4.09Å; V696-F707 HydrophobicContact CG2-CE1 4.49Å; V696-F707 HydrophobicContact CG2-CG 3.72Å; V696-V724 HydrophobicContact CG2-CG1 4.04Å; V696-F725 PolarHBondContact N-O 2.8Å; V696-F726 HydrophobicContact CB-CD1 3.91Å; V696-F726 HydrophobicContact CB-CE1 4Å; V696-F726 HydrophobicContact CG1-CD1 4.19Å; V696-F726 HydrophobicContact CG1-CE1 4.08Å; V696-F726 HydrophobicContact CG2-CE1 4.35Å; V696-F726 CarbonylContact O-C 3.59Å; V696-F726 WeakPolarHBondContact O-CA 3.25Å; V696-I727 PolarHBondContact O-N 3.02Å; V696-F752 VanDerWaalsContact CA-O 3.3Å; V696-F752 WeakPolarHBondContact CA-O 3.39Å
697	S	85	Confident	83.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	116.6	165.3	-75.3	0	0	0	0	109.5	Q699 S703 F752 A753 S754 D757	S697-Q699 VanDerWaalsContact C-N 3.33Å; S697-Q699 PolarHBondContact O-N 2.88Å; S697-S703 PolarHBondContact O-OG 2.99Å; S697-F752 PolarHBondContact N-O 3.41Å; S697-A753 VanDerWaalsContact OG-CA 3.28Å; S697-A753 WeakPolarHBondContact OG-CA 3.29Å; S697-A753 WeakPolarHBondContact OG-CB 3.48Å; S697-S754 PolarHBondContact OG-N 3.41Å; S697-D757 WeakPolarHBondContact CB-OD2 3.35Å; S697-D757 VanDerWaalsContact OG-CB 3.25Å; S697-D757 WeakPolarHBondContact OG-CB 3.35Å; S697-D757 PolarHBondContact OG-OD2 3.19Å
698	S	80	Confident	84	Confident	37 Å²	37	36.2 Å²	36.2	26%	0.259	19%	0.192	S	C	.	.	S	Bend	trans	-70.5	-30.3	-175.7	68.6	0	0	0	0	113.3	V696 I727 D728	V696-S698 PolarHBondContact O-N 2.96Å; S698-I727 PolarHBondContact N-O 3.17Å; S698-I727 VanDerWaalsContact N-O 3.13Å; S698-I727 PolarHBondContact OG-O 2.98Å; S698-I727 VanDerWaalsContact OG-O 3.12Å; S698-D728 VanDerWaalsContact CB-OD1 3.23Å; S698-D728 WeakPolarHBondContact CB-OD1 3.36Å; S698-D728 PolarHBondContact OG-OD1 3.22Å
699	Q	70.8	Confident	84.1	Confident	122 Å²	122	32.2 Å²	32.2	57%	0.57	17%	0.17	S	C	*	.	S	Bend	trans	-90.2	-17	-172.8	-57	-165.7	-3	0	0	114.2	S697	S697-Q699 VanDerWaalsContact C-N 3.33Å; S697-Q699 PolarHBondContact O-N 2.88Å
700	H	73.1	Confident	84.3	Confident	44 Å²	44	31.7 Å²	31.7	20%	0.204	17%	0.168	C	C	.	.			trans	-97.3	119.8	179	178.9	39.6	0	0	0	109.9	D632 S703 L704	D632-H700 IonicContact OD1-CE1 3.7Å; D632-H700 IonicContact OD1-ND1 3.54Å; D632-H700 PolarHBondContact OD1-ND1 2.82Å; D632-H700 IonicContact OD2-CE1 3.74Å; D632-H700 IonicContact OD2-CG 2.68Å; D632-H700 IonicContact OD2-ND1 3.6Å; D632-H700 PolarHBondContact OD2-ND1 2.84Å; H700-S703 VanDerWaalsContact CB-OG 3.28Å; H700-S703 WeakPolarHBondContact CB-OG 3.3Å; H700-S703 PolarHBondContact CD2-OG 2.71Å; H700-S703 VanDerWaalsContact CD2-OG 3.32Å; H700-S703 PolarHBondContact O-N 2.78Å; H700-S703 PolarHBondContact O-OG 2.95Å; H700-L704 PolarHBondContact O-N 3.05Å
701	S	71.8	Confident	84.6	Confident	70 Å²	70	34.3 Å²	34.3	49%	0.49	18%	0.177	S	C	.	.	H	α-helix	trans	-71.9	-34.3	-168.6	67.2	0	0	0	0	112.9	D632 L704 E705	D632-S701 WeakPolarHBondContact OD2-CB 3.45Å; D632-S701 PolarHBondContact OD2-N 3.07Å; D632-S701 PolarHBondContact OD2-OG 3.18Å; S701-L704 PolarHBondContact O-N 2.88Å; S701-E705 PolarHBondContact O-N 3.25Å
702	A	74.2	Confident	84.6	Confident	11 Å²	11	36.5 Å²	36.5	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-40.1	177.1	0	0	0	0	0	112.2	L704 E705 A706	A702-L704 VanDerWaalsContact C-N 3.34Å; A702-L704 PolarHBondContact O-N 2.98Å; A702-E705 PolarHBondContact O-N 3Å; A702-A706 VanDerWaalsContact O-CB 3.28Å; A702-A706 WeakPolarHBondContact O-CB 3.21Å; A702-A706 PolarHBondContact O-N 3.35Å
703	S	81.1	Confident	84.5	Confident	7 Å²	7	37.7 Å²	37.7	5%	0.049	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-39	172.5	23.5	0	0	0	0	112.7	S697 H700 F707 F752	S697-S703 PolarHBondContact O-OG 2.99Å; H700-S703 VanDerWaalsContact CB-OG 3.28Å; H700-S703 WeakPolarHBondContact CB-OG 3.3Å; H700-S703 PolarHBondContact CD2-OG 2.71Å; H700-S703 VanDerWaalsContact CD2-OG 3.32Å; H700-S703 PolarHBondContact O-N 2.78Å; H700-S703 PolarHBondContact O-OG 2.95Å; S703-F707 VanDerWaalsContact O-CB 3.28Å; S703-F707 WeakPolarHBondContact O-CB 3.39Å; S703-F707 PolarHBondContact O-N 3.33Å; S703-F752 WeakPolarHBondContact CB-O 3.23Å
704	L	83.2	Confident	84.4	Confident	83 Å²	83	37.7 Å²	37.7	44%	0.435	20%	0.2	S	C	.	.	H	α-helix	trans	-68	-39.5	177.5	-161.7	78.7	0	0	0	111.9	V696 H700 S701 A702 K708 F726	V696-L704 HydrophobicContact CG1-CD1 4.35Å; H700-L704 PolarHBondContact O-N 3.05Å; S701-L704 PolarHBondContact O-N 2.88Å; A702-L704 VanDerWaalsContact C-N 3.34Å; A702-L704 PolarHBondContact O-N 2.98Å; L704-K708 VanDerWaalsContact O-CB 3.31Å; L704-K708 WeakPolarHBondContact O-CB 3.33Å; L704-K708 PolarHBondContact O-N 3.33Å; L704-F726 HydrophobicContact CD1-CE1 4.17Å
705	E	81	Confident	83.9	Confident	37 Å²	37	41.1 Å²	41.1	17%	0.173	22%	0.224	C	C	.	.	H	α-helix	trans	-67.7	-46.4	174.3	-165	-167	119.6	0	0	111.7	G659 S661 S673 S701 A702 F707 K708 M709	G659-E705 WeakPolarHBondContact CA-OE1 3.26Å; S661-E705 WeakPolarHBondContact CB-OE2 3.47Å; S673-E705 PolarHBondContact OG-OE1 3.01Å; S701-E705 PolarHBondContact O-N 3.25Å; A702-E705 PolarHBondContact O-N 3Å; E705-F707 VanDerWaalsContact C-N 3.35Å; E705-F707 PolarHBondContact O-N 3.18Å; E705-K708 PolarHBondContact O-N 2.73Å; E705-M709 HydrophobicContact CG-CG 4.44Å; E705-M709 WeakPolarHBondContact O-CG 3.08Å; E705-M709 PolarHBondContact O-N 2.02Å
706	A	85.6	Confident	83.6	Confident	6 Å²	6	45.5 Å²	45.5	5%	0.05	25%	0.251	C	S	.	.	H	α-helix	trans	-59.5	-45	178.1	0	0	0	0	0	111.5	L676 A702 F710 F752	L676-A706 HydrophobicContact CD2-CB 4.41Å; A702-A706 VanDerWaalsContact O-CB 3.28Å; A702-A706 WeakPolarHBondContact O-CB 3.21Å; A702-A706 PolarHBondContact O-N 3.35Å; A706-F710 VanDerWaalsContact O-CB 3.28Å; A706-F710 WeakPolarHBondContact O-CB 3.37Å; A706-F710 PolarHBondContact O-N 2.87Å; A706-F752 HydrophobicContact CB-CD1 3.61Å; A706-F752 HydrophobicContact CB-CE1 3.9Å; A706-F752 HydrophobicContact CB-CG 4.49Å
707	F	90.5	Very high	83.1	Confident	15 Å²	15	50.3 Å²	50.3	7%	0.066	27%	0.273	C	S	.	.	H	α-helix	trans	-58.7	-49.8	172.7	168.3	-122.7	0	0	0	112	V694 V696 S703 E705 M709 F710 E711 I721 V724 F726 F752	V694-F707 HydrophobicContact CB-CD2 4.43Å; V694-F707 HydrophobicContact CB-CE2 4.19Å; V694-F707 HydrophobicContact CG1-CD2 3.67Å; V694-F707 HydrophobicContact CG1-CE2 3.94Å; V694-F707 HydrophobicContact CG2-CE2 4.17Å; V696-F707 HydrophobicContact CG1-CB 4.28Å; V696-F707 HydrophobicContact CG1-CD1 4.5Å; V696-F707 HydrophobicContact CG2-CB 4.04Å; V696-F707 HydrophobicContact CG2-CD1 3.94Å; V696-F707 HydrophobicContact CG2-CD2 4.09Å; V696-F707 HydrophobicContact CG2-CE1 4.49Å; V696-F707 HydrophobicContact CG2-CG 3.72Å; S703-F707 VanDerWaalsContact O-CB 3.28Å; S703-F707 WeakPolarHBondContact O-CB 3.39Å; S703-F707 PolarHBondContact O-N 3.33Å; E705-F707 VanDerWaalsContact C-N 3.35Å; E705-F707 PolarHBondContact O-N 3.18Å; F707-M709 PolarHBondContact O-N 2.93Å; F707-F710 CarbonylContact O-C 3.41Å; F707-F710 WeakPolarHBondContact O-CA 3.48Å; F707-F710 WeakPolarHBondContact O-CB 2.99Å; F707-F710 PolarHBondContact O-N 3.34Å; F707-F710 VanDerWaalsContact O-N 3.1Å; F707-E711 HydrophobicContact CE2-CB 4.17Å; F707-E711 HydrophobicContact CZ-CB 4.38Å; F707-E711 WeakPolarHBondContact O-CB 3.25Å; F707-E711 PolarHBondContact O-N 2.9Å; F707-I721 HydrophobicContact CE2-CD1 4.32Å; F707-V724 HydrophobicContact CE1-CG1 4.23Å; F707-V724 HydrophobicContact CE2-CG1 4.41Å; F707-V724 HydrophobicContact CE2-CG2 4.31Å; F707-V724 HydrophobicContact CZ-CG1 3.92Å; F707-V724 HydrophobicContact CZ-CG2 3.92Å; F707-F726 HydrophobicContact CE1-CZ 4.28Å; F707-F752 HydrophobicContact CB-CB 4.4Å; F707-F752 HydrophobicContact CB-CD2 3.89Å; F707-F752 HydrophobicContact CB-CE2 4.42Å; F707-F752 HydrophobicContact CB-CG 4.19Å; F707-F752 HydrophobicContact CD2-CD2 4.3Å; F707-F752 HydrophobicContact CD2-CE2 4.4Å
708	K	88.1	Confident	82.8	Confident	136 Å²	136	52.1 Å²	52.1	59%	0.591	29%	0.292	S	S	*	.	H	α-helix	trans	-62.9	-40	-178.4	-176.1	-175.1	176.6	-168.8	0	112.9	L704 E705 F710 T712	L704-K708 VanDerWaalsContact O-CB 3.31Å; L704-K708 WeakPolarHBondContact O-CB 3.33Å; L704-K708 PolarHBondContact O-N 3.33Å; E705-K708 PolarHBondContact O-N 2.73Å; K708-F710 VanDerWaalsContact C-N 3.35Å; K708-T712 WeakPolarHBondContact O-CB 3.44Å; K708-T712 PolarHBondContact O-N 3.41Å; K708-T712 VanDerWaalsContact O-N 3.08Å; K708-T712 PolarHBondContact O-OG1 3.33Å
709	M	87.8	Confident	83.1	Confident	32 Å²	32	50.8 Å²	50.8	16%	0.158	28%	0.282	C	S	.	.	H	α-helix	trans	-66.5	-38.7	173.6	-71.2	-65.9	-171.1	0	0	111	E660 Q674 E705 F707 S713	E660-M709 HydrophobicContact CG-CE 4.39Å; Q674-M709 HydrophobicContact CG-CE 3.99Å; Q674-M709 HydrophobicContact CG-CG 4.25Å; Q674-M709 HydrophobicContact CG-SD 3.59Å; Q674-M709 VanDerWaalsContact CG-SD 3.59Å; E705-M709 HydrophobicContact CG-CG 4.44Å; E705-M709 WeakPolarHBondContact O-CG 3.08Å; E705-M709 PolarHBondContact O-N 2.02Å; F707-M709 PolarHBondContact O-N 2.93Å; M709-S713 WeakPolarHBondContact O-CB 3.32Å; M709-S713 PolarHBondContact O-N 2.73Å; M709-S713 PolarHBondContact O-OG 3.01Å
710	F	92.1	Very high	83.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-48.2	174.7	175.5	-99.8	0	0	0	112.8	L680 L681 L684 L692 V694 A706 F707 K708 T712 S713 A714 V750 F752	L680-F710 HydrophobicContact CB-CD2 4.17Å; L680-F710 HydrophobicContact CB-CE2 3.99Å; L680-F710 HydrophobicContact CD1-CD2 4Å; L680-F710 HydrophobicContact CD1-CE2 4.39Å; L681-F710 HydrophobicContact CD2-CE2 4.22Å; L681-F710 HydrophobicContact CG-CE2 4.48Å; L684-F710 HydrophobicContact CD1-CE2 3.97Å; L684-F710 HydrophobicContact CD1-CZ 3.78Å; L692-F710 HydrophobicContact CD1-CE1 4.25Å; L692-F710 HydrophobicContact CD2-CE1 4.34Å; L692-F710 HydrophobicContact CD2-CZ 3.93Å; V694-F710 HydrophobicContact CG2-CE1 4.37Å; A706-F710 VanDerWaalsContact O-CB 3.28Å; A706-F710 WeakPolarHBondContact O-CB 3.37Å; A706-F710 PolarHBondContact O-N 2.87Å; F707-F710 CarbonylContact O-C 3.41Å; F707-F710 WeakPolarHBondContact O-CA 3.48Å; F707-F710 WeakPolarHBondContact O-CB 2.99Å; F707-F710 PolarHBondContact O-N 3.34Å; F707-F710 VanDerWaalsContact O-N 3.1Å; K708-F710 VanDerWaalsContact C-N 3.35Å; F710-T712 PolarHBondContact O-N 2.76Å; F710-S713 CarbonylContact O-C 3.42Å; F710-S713 PolarHBondContact O-N 3.25Å; F710-S713 VanDerWaalsContact O-N 3.08Å; F710-A714 HydrophobicContact CE1-CB 4.43Å; F710-A714 HydrophobicContact CZ-CB 4.36Å; F710-A714 VanDerWaalsContact O-CB 3.25Å; F710-A714 WeakPolarHBondContact O-CB 3.48Å; F710-A714 PolarHBondContact O-N 3.49Å; F710-V750 HydrophobicContact CE1-CG1 4.48Å; F710-V750 HydrophobicContact CE1-CG2 4.34Å; F710-V750 HydrophobicContact CZ-CG1 4.47Å; F710-V750 HydrophobicContact CZ-CG2 4.08Å; F710-F752 HydrophobicContact CB-CE1 4.46Å; F710-F752 HydrophobicContact CB-CE2 3.98Å; F710-F752 HydrophobicContact CB-CZ 3.54Å; F710-F752 AromaticContact CD1-CE2 3.72Å; F710-F752 HydrophobicContact CD1-CE2 3.72Å; F710-F752 AromaticContact CD1-CZ 3.95Å; F710-F752 HydrophobicContact CD1-CZ 3.95Å; F710-F752 HydrophobicContact CD2-CZ 4.17Å; F710-F752 HydrophobicContact CE1-CE2 4.41Å; F710-F752 AromaticContact CG-CE2 3.89Å; F710-F752 HydrophobicContact CG-CE2 3.89Å; F710-F752 AromaticContact CG-CZ 3.62Å; F710-F752 HydrophobicContact CG-CZ 3.62Å
711	E	91	Very high	84.4	Confident	87 Å²	87	45.9 Å²	45.9	41%	0.407	26%	0.262	S	S	.	.	H	α-helix	trans	-54.6	-49	174.9	175.7	-174.8	-133.7	0	0	111.7	F707 S713 A714 S715 I721	F707-E711 HydrophobicContact CE2-CB 4.17Å; F707-E711 HydrophobicContact CZ-CB 4.38Å; F707-E711 WeakPolarHBondContact O-CB 3.25Å; F707-E711 PolarHBondContact O-N 2.9Å; E711-S713 VanDerWaalsContact C-N 3.29Å; E711-S713 PolarHBondContact O-N 3.28Å; E711-A714 PolarHBondContact O-N 3.4Å; E711-S715 WeakPolarHBondContact O-CB 3.23Å; E711-S715 PolarHBondContact O-N 2.84Å; E711-S715 PolarHBondContact O-OG 3.45Å; E711-I721 HydrophobicContact CB-CD1 4.05Å; E711-I721 HydrophobicContact CG-CD1 4.05Å
712	T	87.9	Confident	84.8	Confident	79 Å²	79	44.8 Å²	44.8	49%	0.485	26%	0.261	S	S	.	.	H	α-helix	trans	-61.4	-38.6	176.9	-54.3	0	0	0	0	111.3	K708 F710 S715 T716	K708-T712 WeakPolarHBondContact O-CB 3.44Å; K708-T712 PolarHBondContact O-N 3.41Å; K708-T712 VanDerWaalsContact O-N 3.08Å; K708-T712 PolarHBondContact O-OG1 3.33Å; F710-T712 PolarHBondContact O-N 2.76Å; T712-S715 PolarHBondContact O-OG 3.33Å; T712-S715 VanDerWaalsContact O-OG 3.12Å; T712-T716 WeakPolarHBondContact O-CG2 3.35Å
713	S	87.8	Confident	85.3	Confident	25 Å²	25	46.5 Å²	46.5	18%	0.175	27%	0.267	C	S	.	.	H	α-helix	trans	-75.7	-44.2	-179.3	-53	0	0	0	0	111.9	S677 M709 F710 E711 T716 Q717	S677-S713 PolarHBondContact OG-OG 3.21Å; M709-S713 WeakPolarHBondContact O-CB 3.32Å; M709-S713 PolarHBondContact O-N 2.73Å; M709-S713 PolarHBondContact O-OG 3.01Å; F710-S713 CarbonylContact O-C 3.42Å; F710-S713 PolarHBondContact O-N 3.25Å; F710-S713 VanDerWaalsContact O-N 3.08Å; E711-S713 VanDerWaalsContact C-N 3.29Å; E711-S713 PolarHBondContact O-N 3.28Å; S713-T716 PolarHBondContact O-N 3.27Å; S713-T716 PolarHBondContact O-OG1 2.69Å; S713-Q717 PolarHBondContact O-N 3.16Å
714	A	88.4	Confident	85.6	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.4	-44.7	-178.3	0	0	0	0	0	112.6	L681 F710 E711 T716 Q717 G718 I719	L681-A714 HydrophobicContact CD2-CB 3.96Å; F710-A714 HydrophobicContact CE1-CB 4.43Å; F710-A714 HydrophobicContact CZ-CB 4.36Å; F710-A714 VanDerWaalsContact O-CB 3.25Å; F710-A714 WeakPolarHBondContact O-CB 3.48Å; F710-A714 PolarHBondContact O-N 3.49Å; E711-A714 PolarHBondContact O-N 3.4Å; A714-T716 VanDerWaalsContact C-N 3.29Å; A714-T716 PolarHBondContact O-N 2.72Å; A714-Q717 PolarHBondContact O-N 2.73Å; A714-Q717 VanDerWaalsContact O-N 3.07Å; A714-G718 PolarHBondContact O-N 3.5Å; A714-I719 HydrophobicContact CB-CB 4.23Å; A714-I719 PolarHBondContact O-N 3Å
715	S	82.9	Confident	85.8	Confident	72 Å²	72	46.2 Å²	46.2	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-59.6	-37.5	175.7	53.3	0	0	0	0	112.5	E711 T712 Q717 G718	E711-S715 WeakPolarHBondContact O-CB 3.23Å; E711-S715 PolarHBondContact O-N 2.84Å; E711-S715 PolarHBondContact O-OG 3.45Å; T712-S715 PolarHBondContact O-OG 3.33Å; T712-S715 VanDerWaalsContact O-OG 3.12Å; S715-Q717 VanDerWaalsContact C-N 3.31Å; S715-Q717 PolarHBondContact O-N 3.38Å; S715-G718 PolarHBondContact O-N 2.64Å
716	T	82.8	Confident	86	Confident	93 Å²	93	48.6 Å²	48.6	57%	0.571	28%	0.276	S	S	*	.	H	α-helix	trans	-70.2	-23	175.5	66.1	0	0	0	0	114.5	T712 S713 A714	T712-T716 WeakPolarHBondContact O-CG2 3.35Å; S713-T716 PolarHBondContact O-N 3.27Å; S713-T716 PolarHBondContact O-OG1 2.69Å; A714-T716 VanDerWaalsContact C-N 3.29Å; A714-T716 PolarHBondContact O-N 2.72Å
717	Q	81.1	Confident	85.6	Confident	100 Å²	100	48.6 Å²	48.6	47%	0.467	28%	0.275	S	S	.	.	H	α-helix	trans	-92	-8.2	174.6	-65.5	-163.1	-1.4	0	0	113.5	L681 S713 A714 S715	L681-Q717 HydrophobicContact CD1-CG 4.37Å; S713-Q717 PolarHBondContact O-N 3.16Å; A714-Q717 PolarHBondContact O-N 2.73Å; A714-Q717 VanDerWaalsContact O-N 3.07Å; S715-Q717 VanDerWaalsContact C-N 3.31Å; S715-Q717 PolarHBondContact O-N 3.38Å
718	G	78.5	Confident	84.6	Confident	38 Å²	38	52.8 Å²	52.8	39%	0.392	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	22.9	-179.8	0	0	0	0	0	114.4	A714 S715	A714-G718 PolarHBondContact O-N 3.5Å; S715-G718 PolarHBondContact O-N 2.64Å
719	I	85	Confident	83.1	Confident	10 Å²	10	49.7 Å²	49.7	5%	0.051	29%	0.288	C	S	.	.			trans	-89.5	126.4	171	-60.2	-175.8	0	0	0	108.3	L681 L684 L692 A714	L681-I719 HydrophobicContact CD2-CD1 3.73Å; L684-I719 HydrophobicContact CB-CD1 3.71Å; L684-I719 HydrophobicContact CD1-CD1 3.89Å; L684-I719 HydrophobicContact CD1-CG2 4.33Å; L684-I719 HydrophobicContact CG-CD1 4.47Å; L692-I719 HydrophobicContact CD2-CG2 3.63Å; L692-I719 HydrophobicContact CG-CG2 4.37Å; A714-I719 HydrophobicContact CB-CB 4.23Å; A714-I719 PolarHBondContact O-N 3Å
720	C	85.7	Confident	81.4	Confident	14 Å²	14	53 Å²	53	10%	0.095	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	130.4	-176.2	-52.8	0	0	0	0	111.6	S690 L691 L692 C988 C995	S690-C720 PolarHBondContact O-N 2.67Å; L691-C720 WeakPolarHBondContact CA-O 3.45Å; L691-C720 HydrophobicContact CD1-CB 4.4Å; L692-C720 PolarHBondContact N-O 2.89Å; L692-C720 VanDerWaalsContact N-O 3.09Å; C720-C988 VanDerWaalsContact SG-SG 3.65Å; C720-C995 WeakPolarHBondContact CA-SG 3.42Å; C720-C995 HydrophobicContact CB-CB 4.44Å; C720-C995 WeakPolarHBondContact CB-SG 3.45Å; C720-C995 WeakPolarHBondContact SG-CB 3.3Å; C720-C995 CovalentContact SG-SG 2.04Å; C720-C995 PolarHBondContact SG-SG 3.32Å
721	I	86.3	Confident	79	Confident	48 Å²	48	57 Å²	57	25%	0.246	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	114.1	169.2	-63.4	163.3	0	0	0	106.9	L692 V694 F707 E711 V724	L692-I721 HydrophobicContact CD1-CG1 3.9Å; V694-I721 HydrophobicContact CG2-CD1 4.43Å; V694-I721 HydrophobicContact CG2-CG1 4.22Å; V694-I721 HydrophobicContact CG2-CG2 3.94Å; F707-I721 HydrophobicContact CE2-CD1 4.32Å; E711-I721 HydrophobicContact CB-CD1 4.05Å; E711-I721 HydrophobicContact CG-CD1 4.05Å; I721-V724 HydrophobicContact CG2-CG2 3.53Å
722	G	80.7	Confident	76.8	Confident	47 Å²	47	61.2 Å²	61.2	49%	0.485	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-35.4	-179.6	0	0	0	0	0	113.3	L692	L692-G722 PolarHBondContact O-N 2.94Å
723	E	84.9	Confident	74.4	Confident	47 Å²	47	61.4 Å²	61.4	22%	0.22	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	148	-178.6	-56.9	168.2	148.1	0	0	110.2	S693 V694 F725 P744 S745	S693-E723 CarbonylContact C-O 3.59Å; S693-E723 WeakPolarHBondContact CA-O 3.46Å; S693-E723 PolarHBondContact OG-OE2 3.38Å; V694-E723 PolarHBondContact N-O 2.9Å; E723-F725 HydrophobicContact CB-CD2 4.37Å; E723-F725 HydrophobicContact CB-CE2 3.68Å; E723-F725 HydrophobicContact CB-CZ 4.1Å; E723-F725 HydrophobicContact CG-CE2 4.37Å; E723-F725 HydrophobicContact CG-CZ 4.42Å; E723-F725 WeakPolarHBondContact OE2-CE2 3.45Å; E723-P744 WeakPolarHBondContact OE2-CA 3.41Å; E723-S745 VanDerWaalsContact OE1-CB 3.27Å; E723-S745 WeakPolarHBondContact OE1-CB 3.46Å; E723-S745 PolarHBondContact OE1-N 3.38Å; E723-S745 PolarHBondContact OE1-OG 2.9Å; E723-S745 PolarHBondContact OE2-N 3.14Å; E723-S745 PolarHBondContact OE2-OG 3.2Å
724	V	86.9	Confident	71.9	Confident	52 Å²	52	63.7 Å²	63.7	32%	0.315	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	118.2	169.5	-174.2	0	0	0	0	108.6	V694 V696 F707 I721 F726	V694-V724 HydrophobicContact CB-CG2 4.46Å; V694-V724 CarbonylContact O-C 3.58Å; V694-V724 WeakPolarHBondContact O-CA 3.37Å; V696-V724 HydrophobicContact CG2-CG1 4.04Å; F707-V724 HydrophobicContact CE1-CG1 4.23Å; F707-V724 HydrophobicContact CE2-CG1 4.41Å; F707-V724 HydrophobicContact CE2-CG2 4.31Å; F707-V724 HydrophobicContact CZ-CG1 3.92Å; F707-V724 HydrophobicContact CZ-CG2 3.92Å; I721-V724 HydrophobicContact CG2-CG2 3.53Å; V724-F726 HydrophobicContact CB-CE2 4.29Å; V724-F726 HydrophobicContact CG1-CD2 4.19Å; V724-F726 HydrophobicContact CG1-CE1 4.38Å; V724-F726 HydrophobicContact CG1-CE2 3.58Å; V724-F726 HydrophobicContact CG1-CZ 3.69Å
725	F	86.7	Confident	69.3	Low	32 Å²	32	68.9 Å²	68.9	14%	0.14	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.5	177	-61.5	-84.4	0	0	0	109.2	V694 L695 V696 E723 M742 P744	V694-F725 PolarHBondContact O-N 3.26Å; L695-F725 WeakPolarHBondContact CA-O 3.4Å; L695-F725 HydrophobicContact CD1-CB 3.66Å; V696-F725 PolarHBondContact N-O 2.8Å; E723-F725 HydrophobicContact CB-CD2 4.37Å; E723-F725 HydrophobicContact CB-CE2 3.68Å; E723-F725 HydrophobicContact CB-CZ 4.1Å; E723-F725 HydrophobicContact CG-CE2 4.37Å; E723-F725 HydrophobicContact CG-CZ 4.42Å; E723-F725 WeakPolarHBondContact OE2-CE2 3.45Å; F725-M742 HydrophobicContact CD1-CB 4.12Å; F725-M742 HydrophobicContact CD1-CG 4.23Å; F725-P744 HydrophobicContact CE2-CB 3.86Å; F725-P744 HydrophobicContact CZ-CB 4.43Å
726	F	84.8	Confident	66.9	Low	87 Å²	87	70.4 Å²	70.4	38%	0.382	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	126.5	172.2	-68.3	-82.3	0	0	0	109.6	V696 L704 F707 V724 M742	V696-F726 HydrophobicContact CB-CD1 3.91Å; V696-F726 HydrophobicContact CB-CE1 4Å; V696-F726 HydrophobicContact CG1-CD1 4.19Å; V696-F726 HydrophobicContact CG1-CE1 4.08Å; V696-F726 HydrophobicContact CG2-CE1 4.35Å; V696-F726 CarbonylContact O-C 3.59Å; V696-F726 WeakPolarHBondContact O-CA 3.25Å; L704-F726 HydrophobicContact CD1-CE1 4.17Å; F707-F726 HydrophobicContact CE1-CZ 4.28Å; V724-F726 HydrophobicContact CB-CE2 4.29Å; V724-F726 HydrophobicContact CG1-CD2 4.19Å; V724-F726 HydrophobicContact CG1-CE1 4.38Å; V724-F726 HydrophobicContact CG1-CE2 3.58Å; V724-F726 HydrophobicContact CG1-CZ 3.69Å; F726-M742 WeakPolarHBondContact O-CE 3.4Å
727	I	78.4	Confident	64.8	Low	6 Å²	6	73.1 Å²	73.1	3%	0.031	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	107.4	174.5	-47.8	169.1	0	0	0	108	L695 V696 S698 A753 D757 F761	L695-I727 HydrophobicContact CD1-CD1 3.73Å; L695-I727 HydrophobicContact CD1-CG1 3.63Å; L695-I727 HydrophobicContact CD2-CD1 4.08Å; L695-I727 HydrophobicContact CG-CD1 3.8Å; L695-I727 HydrophobicContact CG-CG1 4.21Å; V696-I727 PolarHBondContact O-N 3.02Å; S698-I727 PolarHBondContact N-O 3.17Å; S698-I727 VanDerWaalsContact N-O 3.13Å; S698-I727 PolarHBondContact OG-O 2.98Å; S698-I727 VanDerWaalsContact OG-O 3.12Å; I727-A753 HydrophobicContact CD1-CB 4.28Å; I727-D757 HydrophobicContact CB-CB 4.25Å; I727-D757 HydrophobicContact CD1-CB 3.76Å; I727-D757 HydrophobicContact CG2-CB 3.97Å; I727-F761 HydrophobicContact CD1-CB 4.02Å
728	D	69.1	Low	62.6	Low	103 Å²	103	72.5 Å²	72.5	55%	0.551	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-92.5	146	169.9	-69.2	-46.9	0	0	0	110.7	S698	S698-D728 VanDerWaalsContact CB-OD1 3.23Å; S698-D728 WeakPolarHBondContact CB-OD1 3.36Å; S698-D728 PolarHBondContact OG-OD1 3.22Å
729	L	57.3	Low	60.5	Low	71 Å²	71	78.3 Å²	78.3	37%	0.372	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-67.1	138.6	163.1	-68.8	-176.6	0	0	0	109.6	D731 R760	L729-D731 PolarHBondContact O-N 3.48Å; L729-R760 VanDerWaalsContact CD2-NH1 3.28Å
730	P	51.6	Low	58.8	Low	101 Å²	101	82.8 Å²	82.8	66%	0.656	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-62.1	127.4	159.8	27.9	-32.1	0	0	0	109.1	E732	P730-E732 PolarHBondContact O-N 3.4Å
731	D	40.4	Very low	57.3	Low	86 Å²	86	86.8 Å²	86.8	46%	0.46	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-46.2	139.9	168.4	-128.7	-8.5	0	0	0	108.1	M1 L729 K733	M1-D731 PolarHBondContact N-OD2 3.49Å; L729-D731 PolarHBondContact O-N 3.48Å; D731-K733 PolarHBondContact O-N 3.19Å
732	E	44.9	Very low	56.2	Low	174 Å²	174	87 Å²	87	81%	0.813	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	8.7	-176	-60.9	-177.3	128.5	0	0	115.7	P730	P730-E732 PolarHBondContact O-N 3.4Å
733	K	38.5	Very low	55.8	Low	83 Å²	83	86 Å²	86	36%	0.361	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	9.8	-158.8	-64.7	170.6	-148.9	-42.3	0	111.3	D731 E735	D731-K733 PolarHBondContact O-N 3.19Å; K733-E735 PolarHBondContact O-N 3.09Å; K733-E735 VanDerWaalsContact O-N 3.14Å
734	G	35	Very low	55.5	Low	74 Å²	74	84 Å²	84	76%	0.763	47%	0.465	S	S	*	.			trans	72	2.5	164.7	0	0	0	0	0	115.7	S736	G734-S736 PolarHBondContact O-N 3.15Å
735	E	34.8	Very low	55.1	Low	109 Å²	109	85.4 Å²	85.4	51%	0.509	48%	0.478	S	S	.	.			trans	-78.2	89.2	179.1	-71.8	175.6	91	0	0	109.2	R2 K733 Q737	R2-E735 IonicContact CZ-OE2 2.78Å; R2-E735 IonicContact NE-OE2 3.47Å; R2-E735 IonicContact NH2-OE2 2.86Å; R2-E735 PolarHBondContact NH2-OE2 3.32Å; K733-E735 PolarHBondContact O-N 3.09Å; K733-E735 VanDerWaalsContact O-N 3.14Å; E735-Q737 PolarHBondContact O-N 3.43Å
736	S	32.3	Very low	55	Low	103 Å²	103	84.8 Å²	84.8	72%	0.72	48%	0.476	S	S	*	.			trans	-55	99.9	176.4	-175	0	0	0	0	111.1	G734 S738	G734-S736 PolarHBondContact O-N 3.15Å; S736-S738 VanDerWaalsContact C-N 3.3Å; S736-S738 PolarHBondContact O-N 3.2Å
737	Q	37.5	Very low	55	Low	151 Å²	151	81 Å²	81	71%	0.706	46%	0.46	S	S	*	.			trans	-77.9	81	-179.7	-79.9	-161.4	-40	0	0	111.4	E735	E735-Q737 PolarHBondContact O-N 3.43Å
738	S	35	Very low	55.6	Low	87 Å²	87	80.7 Å²	80.7	61%	0.608	46%	0.459	S	S	*	.			trans	64.8	138.9	162.9	61.6	0	0	0	0	117.7	S736 V740	S736-S738 VanDerWaalsContact C-N 3.3Å; S736-S738 PolarHBondContact O-N 3.2Å; S738-V740 PolarHBondContact O-N 2.99Å
739	N	35.8	Very low	56.6	Low	159 Å²	159	75.8 Å²	75.8	85%	0.85	43%	0.433	S	S	*	.			trans	-76.1	60.3	175.8	-61.6	-25.9	0	0	0	111.7	E741	N739-E741 PolarHBondContact O-N 2.87Å
740	V	48.3	Very low	58.4	Low	105 Å²	105	72.4 Å²	72.4	64%	0.636	42%	0.415	S	S	*	.			trans	-76.7	107	167.3	-178.5	0	0	0	0	107.1	S738 M742	S738-V740 PolarHBondContact O-N 2.99Å; V740-M742 PolarHBondContact O-N 3.21Å
741	E	53.8	Low	60.3	Low	98 Å²	98	67.6 Å²	67.6	46%	0.458	38%	0.384	S	S	.	.			trans	-66.9	98.9	177.7	-75.1	179.8	94.5	0	0	110.3	N739 T743 N766 K769	N739-E741 PolarHBondContact O-N 2.87Å; E741-T743 HydrophobicContact CB-CG2 4.34Å; E741-T743 PolarHBondContact O-N 3.33Å; E741-N766 PolarHBondContact OE1-ND2 2.97Å; E741-K769 WeakPolarHBondContact OE1-CD 3.34Å; E741-K769 VanDerWaalsContact OE1-CE 3.28Å; E741-K769 WeakPolarHBondContact OE1-CE 3.37Å; E741-K769 IonicContact OE1-NZ 2.62Å; E741-K769 PolarHBondContact OE1-NZ 2.97Å; E741-K769 IonicContact OE2-NZ 3.78Å; E741-K769 PolarHBondContact OE2-NZ 3.41Å
742	M	63.3	Low	62.8	Low	51 Å²	51	63.6 Å²	63.6	25%	0.251	36%	0.362	S	S	.	.			trans	-70.6	67.8	170.8	-66.4	-173.3	174.8	0	0	110.7	F725 F726 V740 F761	F725-M742 HydrophobicContact CD1-CB 4.12Å; F725-M742 HydrophobicContact CD1-CG 4.23Å; F726-M742 WeakPolarHBondContact O-CE 3.4Å; V740-M742 PolarHBondContact O-N 3.21Å; M742-F761 HydrophobicContact CB-CD2 4.43Å; M742-F761 HydrophobicContact CB-CE2 4.16Å; M742-F761 WeakPolarHBondContact O-CE2 3.46Å
743	T	73.5	Confident	64.7	Low	26 Å²	26	55.6 Å²	55.6	16%	0.16	33%	0.325	C	S	.	.			trans	-113.3	110.5	177.4	54.3	0	0	0	0	109.5	E741 S745 N766 K769	E741-T743 HydrophobicContact CB-CG2 4.34Å; E741-T743 PolarHBondContact O-N 3.33Å; T743-S745 PolarHBondContact O-N 3.44Å; T743-N766 HydrophobicContact CG2-CB 3.8Å; T743-K769 HydrophobicContact CG2-CB 3.88Å; T743-K769 HydrophobicContact CG2-CD 4.12Å
744	P	78.3	Confident	66.7	Low	5 Å²	5	52.3 Å²	52.3	3%	0.032	31%	0.313	C	S	.	.			trans	-65.1	130.6	178.8	25.9	-33.5	0	0	0	110.7	E723 F725 V749 F761 V770	E723-P744 WeakPolarHBondContact OE2-CA 3.41Å; F725-P744 HydrophobicContact CE2-CB 3.86Å; F725-P744 HydrophobicContact CZ-CB 4.43Å; P744-V749 HydrophobicContact CB-CG2 3.81Å; P744-V749 HydrophobicContact CG-CG2 3.87Å; P744-F761 HydrophobicContact CG-CZ 4.43Å; P744-V770 HydrophobicContact CG-CG2 4.37Å
745	S	77.5	Confident	68.8	Low	83 Å²	83	49.2 Å²	49.2	58%	0.58	28%	0.28	S	S	*	.	S	Bend	trans	-84.6	-26.9	176.3	64.9	0	0	0	0	112.8	E723 T743	E723-S745 VanDerWaalsContact OE1-CB 3.27Å; E723-S745 WeakPolarHBondContact OE1-CB 3.46Å; E723-S745 PolarHBondContact OE1-N 3.38Å; E723-S745 PolarHBondContact OE1-OG 2.9Å; E723-S745 PolarHBondContact OE2-N 3.14Å; E723-S745 PolarHBondContact OE2-OG 3.2Å; T743-S745 PolarHBondContact O-N 3.44Å
746	N	84.7	Confident	70.7	Confident	19 Å²	19	45.2 Å²	45.2	10%	0.102	27%	0.266	C	S	.	.	S	Bend	trans	-85	139.4	177.3	-55	-68.8	0	0	0	111	L691 S693 V748	L691-N746 VanDerWaalsContact CD2-OD1 3.31Å; L691-N746 WeakPolarHBondContact CD2-OD1 3Å; L691-N746 WeakPolarHBondContact CG-OD1 3.39Å; S693-N746 WeakPolarHBondContact OG-CB 3.48Å; S693-N746 PolarHBondContact OG-ND2 2.89Å; N746-V748 VanDerWaalsContact C-N 3.26Å; N746-V748 PolarHBondContact O-N 3.32Å
747	P	85.9	Confident	72.9	Confident	7 Å²	7	41 Å²	41	5%	0.045	24%	0.235	C	C	.	.	S	Bend	trans	-79.1	-3.9	-174.6	34.8	-39.7	0	0	0	114.3	T774 V775 P984	P747-T774 CarbonylContact O-C 3.55Å; P747-T774 VanDerWaalsContact O-CA 3.32Å; P747-T774 WeakPolarHBondContact O-CA 3.34Å; P747-V775 PolarHBondContact O-N 2.61Å; P747-P984 HydrophobicContact CB-CB 3.54Å; P747-P984 HydrophobicContact CB-CG 4.22Å; P747-P984 HydrophobicContact CG-CB 3.62Å; P747-P984 HydrophobicContact CG-CG 4.45Å
748	V	90.1	Very high	75.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.7	173.4	-179.9	0	0	0	0	107.8	L684 W689 L692 S693 N746 P984	L684-V748 HydrophobicContact CD2-CG1 4.2Å; W689-V748 HydrophobicContact CB-CG2 4.49Å; W689-V748 HydrophobicContact CD2-CG1 4.36Å; W689-V748 HydrophobicContact CD2-CG2 3.67Å; W689-V748 HydrophobicContact CE3-CG1 4.05Å; W689-V748 HydrophobicContact CE3-CG2 4.13Å; W689-V748 HydrophobicContact CG-CG2 3.85Å; W689-V748 HydrophobicContact CZ2-CG2 4.32Å; W689-V748 HydrophobicContact CZ3-CG1 4.49Å; L692-V748 WeakPolarHBondContact CA-O 3.48Å; L692-V748 HydrophobicContact CB-CB 4.22Å; L692-V748 HydrophobicContact CB-CG1 4.18Å; L692-V748 WeakPolarHBondContact CB-O 3.35Å; S693-V748 PolarHBondContact N-O 3.1Å; N746-V748 VanDerWaalsContact C-N 3.26Å; N746-V748 PolarHBondContact O-N 3.32Å; V748-P984 HydrophobicContact CG2-CG 4.11Å
749	V	91.1	Very high	77.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	113.4	-175	-174.8	0	0	0	0	109.8	S693 L695 P744 V751 T774 V775 F776 L777	S693-V749 WeakPolarHBondContact O-CA 3.35Å; L695-V749 HydrophobicContact CB-CG1 4.37Å; P744-V749 HydrophobicContact CB-CG2 3.81Å; P744-V749 HydrophobicContact CG-CG2 3.87Å; V749-V751 HydrophobicContact CG1-CG2 4.33Å; V749-T774 HydrophobicContact CG2-CG2 4Å; V749-V775 PolarHBondContact N-O 2.71Å; V749-F776 HydrophobicContact CB-CD1 3.8Å; V749-F776 HydrophobicContact CB-CE1 4Å; V749-F776 HydrophobicContact CG1-CD1 3.98Å; V749-F776 HydrophobicContact CG1-CE1 4.05Å; V749-F776 HydrophobicContact CG2-CD1 4.39Å; V749-F776 HydrophobicContact CG2-CE1 4.14Å; V749-F776 WeakPolarHBondContact O-CA 3.43Å; V749-L777 PolarHBondContact O-N 2.63Å
750	V	93.8	Very high	79.3	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.3	176.5	-170.7	0	0	0	0	109.5	L692 S693 V694 L695 F710 F752 L777	L692-V750 HydrophobicContact CD1-CG2 4.08Å; L692-V750 HydrophobicContact CD2-CG2 4.05Å; S693-V750 PolarHBondContact O-N 2.88Å; V694-V750 CarbonylContact C-O 3.59Å; V694-V750 WeakPolarHBondContact CA-O 3.43Å; V694-V750 WeakPolarHBondContact CG1-O 3.26Å; L695-V750 PolarHBondContact N-O 3.46Å; F710-V750 HydrophobicContact CE1-CG1 4.48Å; F710-V750 HydrophobicContact CE1-CG2 4.34Å; F710-V750 HydrophobicContact CZ-CG1 4.47Å; F710-V750 HydrophobicContact CZ-CG2 4.08Å; V750-F752 HydrophobicContact CB-CE2 4.37Å; V750-F752 HydrophobicContact CG1-CD2 4.21Å; V750-F752 HydrophobicContact CG1-CE2 3.5Å; V750-F752 HydrophobicContact CG1-CZ 3.74Å; V750-L777 HydrophobicContact CG2-CD2 4.34Å
751	V	92.7	Very high	80.9	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	109.7	-171.3	-178.4	0	0	0	0	110.8	L695 V749 A753 F758 F776 L777 L778 T779	L695-V751 HydrophobicContact CB-CG2 4.36Å; L695-V751 HydrophobicContact CD2-CG1 4.26Å; L695-V751 HydrophobicContact CD2-CG2 4.25Å; V749-V751 HydrophobicContact CG1-CG2 4.33Å; V751-A753 HydrophobicContact CG1-CB 3.76Å; V751-F758 HydrophobicContact CG1-CB 4.4Å; V751-F758 HydrophobicContact CG1-CD2 3.77Å; V751-F758 HydrophobicContact CG1-CE2 4.21Å; V751-F758 HydrophobicContact CG1-CG 4.04Å; V751-F758 HydrophobicContact CG2-CD2 4.23Å; V751-F758 HydrophobicContact CG2-CE2 3.83Å; V751-F758 HydrophobicContact CG2-CZ 4.33Å; V751-F776 HydrophobicContact CG2-CD1 4.28Å; V751-L777 PolarHBondContact N-O 3.35Å; V751-L778 HydrophobicContact CB-CD2 3.98Å; V751-L778 HydrophobicContact CG1-CD2 4.29Å; V751-L778 HydrophobicContact CG2-CD2 3.93Å; V751-T779 PolarHBondContact O-N 3.21Å; V751-T779 PolarHBondContact O-OG1 3.07Å
752	F	91.2	Very high	82.1	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.009	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	72.8	168.8	-60.7	-74.7	0	0	0	108.7	L676 L680 V694 L695 V696 S697 S703 A706 F707 F710 V750 T779	L676-F752 HydrophobicContact CD2-CE1 4.36Å; L680-F752 HydrophobicContact CD1-CE1 3.9Å; L680-F752 HydrophobicContact CD1-CZ 3.73Å; V694-F752 HydrophobicContact CG1-CD2 3.68Å; V694-F752 HydrophobicContact CG1-CE2 4.03Å; L695-F752 PolarHBondContact O-N 2.94Å; V696-F752 VanDerWaalsContact CA-O 3.3Å; V696-F752 WeakPolarHBondContact CA-O 3.39Å; S697-F752 PolarHBondContact N-O 3.41Å; S703-F752 WeakPolarHBondContact CB-O 3.23Å; A706-F752 HydrophobicContact CB-CD1 3.61Å; A706-F752 HydrophobicContact CB-CE1 3.9Å; A706-F752 HydrophobicContact CB-CG 4.49Å; F707-F752 HydrophobicContact CB-CB 4.4Å; F707-F752 HydrophobicContact CB-CD2 3.89Å; F707-F752 HydrophobicContact CB-CE2 4.42Å; F707-F752 HydrophobicContact CB-CG 4.19Å; F707-F752 HydrophobicContact CD2-CD2 4.3Å; F707-F752 HydrophobicContact CD2-CE2 4.4Å; F710-F752 HydrophobicContact CB-CE1 4.46Å; F710-F752 HydrophobicContact CB-CE2 3.98Å; F710-F752 HydrophobicContact CB-CZ 3.54Å; F710-F752 AromaticContact CD1-CE2 3.72Å; F710-F752 HydrophobicContact CD1-CE2 3.72Å; F710-F752 AromaticContact CD1-CZ 3.95Å; F710-F752 HydrophobicContact CD1-CZ 3.95Å; F710-F752 HydrophobicContact CD2-CZ 4.17Å; F710-F752 HydrophobicContact CE1-CE2 4.41Å; F710-F752 AromaticContact CG-CE2 3.89Å; F710-F752 HydrophobicContact CG-CE2 3.89Å; F710-F752 AromaticContact CG-CZ 3.62Å; F710-F752 HydrophobicContact CG-CZ 3.62Å; V750-F752 HydrophobicContact CB-CE2 4.37Å; V750-F752 HydrophobicContact CG1-CD2 4.21Å; V750-F752 HydrophobicContact CG1-CE2 3.5Å; V750-F752 HydrophobicContact CG1-CZ 3.74Å; F752-T779 HydrophobicContact CD1-CG2 4.29Å; F752-T779 VanDerWaalsContact CD1-OG1 3.26Å; F752-T779 WeakPolarHBondContact CD1-OG1 3.4Å; F752-T779 HydrophobicContact CE1-CG2 4.02Å
753	A	86.4	Confident	82.7	Confident	5 Å²	5	19.9 Å²	19.9	4%	0.041	11%	0.109	C	C	.	.			trans	-138.1	160.2	-174.4	0	0	0	0	0	112.4	S697 I727 V751 D757 F758 S782	S697-A753 VanDerWaalsContact OG-CA 3.28Å; S697-A753 WeakPolarHBondContact OG-CA 3.29Å; S697-A753 WeakPolarHBondContact OG-CB 3.48Å; I727-A753 HydrophobicContact CD1-CB 4.28Å; V751-A753 HydrophobicContact CG1-CB 3.76Å; A753-D757 HydrophobicContact CB-CB 4.48Å; A753-F758 HydrophobicContact CB-CB 4.31Å; A753-S782 WeakPolarHBondContact O-CB 3.2Å; A753-S782 PolarHBondContact O-N 2.83Å
754	S	79.8	Confident	82.6	Confident	15 Å²	15	24.9 Å²	24.9	11%	0.105	13%	0.13	C	C	.	.			trans	-67.6	159.5	165.6	78.5	0	0	0	0	110.5	S697 A756 D757 F758	S697-S754 PolarHBondContact OG-N 3.41Å; S754-A756 PolarHBondContact O-N 2.96Å; S754-A756 PolarHBondContact OG-N 3.17Å; S754-D757 PolarHBondContact O-N 3.3Å; S754-D757 PolarHBondContact OG-N 2.88Å; S754-D757 PolarHBondContact OG-OD2 3.32Å; S754-F758 PolarHBondContact O-N 3.44Å
755	A	78.6	Confident	82.5	Confident	9 Å²	9	25.2 Å²	25.2	7%	0.074	13%	0.132	C	C	.	.	H	α-helix	trans	-56.9	-36.5	171.9	0	0	0	0	0	111.9	N759 Q781 Q788	A755-N759 VanDerWaalsContact O-CB 3.28Å; A755-N759 WeakPolarHBondContact O-CB 3.06Å; A755-N759 PolarHBondContact O-N 3.44Å; A755-Q781 WeakPolarHBondContact CB-O 3.42Å; A755-Q788 HydrophobicContact CB-CG 4.41Å; A755-Q788 PolarHBondContact O-OE1 3.26Å
756	A	74.1	Confident	82.3	Confident	24 Å²	24	24.2 Å²	24.2	20%	0.198	12%	0.12	C	C	.	.	H	α-helix	trans	-66.6	-46.4	-179.8	0	0	0	0	0	112.2	S754 R760 Q788	S754-A756 PolarHBondContact O-N 2.96Å; S754-A756 PolarHBondContact OG-N 3.17Å; A756-R760 WeakPolarHBondContact O-CB 3.45Å; A756-R760 WeakPolarHBondContact O-CD 3.49Å; A756-R760 WeakPolarHBondContact O-CG 3.4Å; A756-R760 PolarHBondContact O-N 2.92Å; A756-Q788 VanDerWaalsContact N-NE2 3.16Å
757	D	80.2	Confident	81.6	Confident	15 Å²	15	25.9 Å²	25.9	8%	0.08	13%	0.125	C	C	.	.	H	α-helix	trans	-73	-38.5	-177.2	-58.3	-39.8	0	0	0	111.3	S697 I727 A753 S754 R760 F761	S697-D757 WeakPolarHBondContact CB-OD2 3.35Å; S697-D757 VanDerWaalsContact OG-CB 3.25Å; S697-D757 WeakPolarHBondContact OG-CB 3.35Å; S697-D757 PolarHBondContact OG-OD2 3.19Å; I727-D757 HydrophobicContact CB-CB 4.25Å; I727-D757 HydrophobicContact CD1-CB 3.76Å; I727-D757 HydrophobicContact CG2-CB 3.97Å; A753-D757 HydrophobicContact CB-CB 4.48Å; S754-D757 PolarHBondContact O-N 3.3Å; S754-D757 PolarHBondContact OG-N 2.88Å; S754-D757 PolarHBondContact OG-OD2 3.32Å; D757-R760 WeakPolarHBondContact O-CB 3.25Å; D757-R760 PolarHBondContact O-N 3.01Å; D757-R760 IonicContact OD1-CZ 3.52Å; D757-R760 IonicContact OD1-NH1 3.46Å; D757-R760 PolarHBondContact OD1-NH1 3.03Å; D757-F761 WeakPolarHBondContact O-CB 3.28Å; D757-F761 PolarHBondContact O-N 3.48Å
758	F	85.5	Confident	80.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.7	-40.6	175.1	-171.7	-127.1	0	0	0	112.3	L695 V751 A753 S754 F761 L762 F776 L778 F785 F815	L695-F758 HydrophobicContact CD2-CD2 3.67Å; L695-F758 HydrophobicContact CD2-CE2 4Å; V751-F758 HydrophobicContact CG1-CB 4.4Å; V751-F758 HydrophobicContact CG1-CD2 3.77Å; V751-F758 HydrophobicContact CG1-CE2 4.21Å; V751-F758 HydrophobicContact CG1-CG 4.04Å; V751-F758 HydrophobicContact CG2-CD2 4.23Å; V751-F758 HydrophobicContact CG2-CE2 3.83Å; V751-F758 HydrophobicContact CG2-CZ 4.33Å; A753-F758 HydrophobicContact CB-CB 4.31Å; S754-F758 PolarHBondContact O-N 3.44Å; F758-F761 HydrophobicContact CD2-CD1 4.07Å; F758-F761 HydrophobicContact CE2-CD1 4.02Å; F758-F761 HydrophobicContact CE2-CE1 4.35Å; F758-F761 PolarHBondContact O-N 3Å; F758-L762 HydrophobicContact CD1-CD1 4.11Å; F758-L762 HydrophobicContact CE1-CD1 3.73Å; F758-L762 HydrophobicContact CE1-CG 4.35Å; F758-L762 HydrophobicContact CE2-CD1 4.43Å; F758-L762 HydrophobicContact CE2-CD2 4.27Å; F758-L762 HydrophobicContact CE2-CG 4.18Å; F758-L762 HydrophobicContact CZ-CD1 3.91Å; F758-L762 HydrophobicContact CZ-CD2 4.11Å; F758-L762 HydrophobicContact CZ-CG 4.09Å; F758-L762 WeakPolarHBondContact O-CG 3.42Å; F758-L762 PolarHBondContact O-N 3.03Å; F758-F776 HydrophobicContact CE2-CD1 4.06Å; F758-F776 HydrophobicContact CE2-CE1 4.42Å; F758-F776 HydrophobicContact CZ-CB 4.36Å; F758-F776 HydrophobicContact CZ-CD1 4.03Å; F758-F776 HydrophobicContact CZ-CG 4.19Å; F758-L778 HydrophobicContact CD1-CD2 3.96Å; F758-L778 HydrophobicContact CE1-CD1 4.39Å; F758-L778 HydrophobicContact CE1-CD2 3.37Å; F758-L778 HydrophobicContact CE2-CD2 4.36Å; F758-L778 HydrophobicContact CZ-CD2 3.61Å; F758-F785 HydrophobicContact CD1-CB 3.72Å; F758-F785 HydrophobicContact CD1-CD1 4.19Å; F758-F785 AromaticContact CD1-CD2 3.94Å; F758-F785 HydrophobicContact CD1-CD2 3.94Å; F758-F785 AromaticContact CD1-CG 3.69Å; F758-F785 HydrophobicContact CD1-CG 3.69Å; F758-F785 HydrophobicContact CE1-CB 4.43Å; F758-F785 HydrophobicContact CE1-CD1 4.14Å; F758-F785 AromaticContact CE1-CD2 3.86Å; F758-F785 HydrophobicContact CE1-CD2 3.86Å; F758-F785 HydrophobicContact CE1-CE1 4.33Å; F758-F785 HydrophobicContact CE1-CE2 4.06Å; F758-F785 AromaticContact CE1-CG 3.89Å; F758-F785 HydrophobicContact CE1-CG 3.89Å; F758-F785 HydrophobicContact CE1-CZ 4.28Å; F758-F815 HydrophobicContact CE1-CD1 4.43Å; F758-F815 HydrophobicContact CE1-CE1 4.2Å; F758-F815 HydrophobicContact CZ-CD1 4.45Å; F758-F815 HydrophobicContact CZ-CE1 4.04Å
759	N	79.5	Confident	80.1	Confident	12 Å²	12	41.7 Å²	41.7	6%	0.064	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-40.1	173.6	-170.1	17.9	0	0	0	111.8	A755 L762 K763 N789	A755-N759 VanDerWaalsContact O-CB 3.28Å; A755-N759 WeakPolarHBondContact O-CB 3.06Å; A755-N759 PolarHBondContact O-N 3.44Å; N759-L762 PolarHBondContact O-N 2.74Å; N759-K763 WeakPolarHBondContact O-CG 3.44Å; N759-K763 PolarHBondContact O-N 2.99Å; N759-N789 PolarHBondContact ND2-OD1 2.93Å
760	R	76.2	Confident	79.4	Confident	108 Å²	108	42 Å²	42	41%	0.408	19%	0.189	S	C	.	.	H	α-helix	trans	-59.6	-46.6	171.8	-73.8	164.5	-178.2	141.6	-0.5	112.1	L729 A756 D757 K763 Q764	L729-R760 VanDerWaalsContact CD2-NH1 3.28Å; A756-R760 WeakPolarHBondContact O-CB 3.45Å; A756-R760 WeakPolarHBondContact O-CD 3.49Å; A756-R760 WeakPolarHBondContact O-CG 3.4Å; A756-R760 PolarHBondContact O-N 2.92Å; D757-R760 WeakPolarHBondContact O-CB 3.25Å; D757-R760 PolarHBondContact O-N 3.01Å; D757-R760 IonicContact OD1-CZ 3.52Å; D757-R760 IonicContact OD1-NH1 3.46Å; D757-R760 PolarHBondContact OD1-NH1 3.03Å; R760-K763 PolarHBondContact O-N 2.88Å; R760-K763 VanDerWaalsContact O-N 3.16Å; R760-Q764 WeakPolarHBondContact O-CG 3.39Å; R760-Q764 PolarHBondContact O-N 3.35Å
761	F	81.6	Confident	78.5	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-47.4	176.5	169.7	-96.6	0	0	0	111.3	L695 I727 M742 P744 D757 F758 K763 Q764 V765 F776	L695-F761 HydrophobicContact CD1-CD2 3.64Å; L695-F761 HydrophobicContact CD1-CE2 3.69Å; L695-F761 HydrophobicContact CD1-CG 4.11Å; L695-F761 HydrophobicContact CD1-CZ 4.2Å; L695-F761 HydrophobicContact CD2-CB 4.26Å; L695-F761 HydrophobicContact CD2-CD1 3.46Å; L695-F761 VanDerWaalsContact CD2-CD1 3.46Å; L695-F761 HydrophobicContact CD2-CD2 4Å; L695-F761 HydrophobicContact CD2-CE1 3.64Å; L695-F761 HydrophobicContact CD2-CE2 4.16Å; L695-F761 HydrophobicContact CD2-CG 3.65Å; L695-F761 HydrophobicContact CD2-CZ 3.98Å; L695-F761 HydrophobicContact CG-CD2 4.5Å; I727-F761 HydrophobicContact CD1-CB 4.02Å; M742-F761 HydrophobicContact CB-CD2 4.43Å; M742-F761 HydrophobicContact CB-CE2 4.16Å; M742-F761 WeakPolarHBondContact O-CE2 3.46Å; P744-F761 HydrophobicContact CG-CZ 4.43Å; D757-F761 WeakPolarHBondContact O-CB 3.28Å; D757-F761 PolarHBondContact O-N 3.48Å; F758-F761 HydrophobicContact CD2-CD1 4.07Å; F758-F761 HydrophobicContact CE2-CD1 4.02Å; F758-F761 HydrophobicContact CE2-CE1 4.35Å; F758-F761 PolarHBondContact O-N 3Å; F761-K763 PolarHBondContact O-N 3.28Å; F761-Q764 PolarHBondContact O-N 3.33Å; F761-V765 HydrophobicContact CD1-CG2 3.9Å; F761-V765 HydrophobicContact CD2-CG2 3.91Å; F761-V765 HydrophobicContact CE1-CG2 3.56Å; F761-V765 HydrophobicContact CE2-CG2 3.57Å; F761-V765 HydrophobicContact CG-CG2 4.07Å; F761-V765 HydrophobicContact CZ-CG2 3.39Å; F761-V765 VanDerWaalsContact O-CG2 3.28Å; F761-V765 WeakPolarHBondContact O-CG2 3.34Å; F761-V765 PolarHBondContact O-N 3.48Å; F761-F776 HydrophobicContact CE1-CE1 4.12Å
762	L	80.7	Confident	77.6	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-27.9	176.2	-69.8	175.1	0	0	0	113.8	F758 N759 F785 Y808 W813	F758-L762 HydrophobicContact CD1-CD1 4.11Å; F758-L762 HydrophobicContact CE1-CD1 3.73Å; F758-L762 HydrophobicContact CE1-CG 4.35Å; F758-L762 HydrophobicContact CE2-CD1 4.43Å; F758-L762 HydrophobicContact CE2-CD2 4.27Å; F758-L762 HydrophobicContact CE2-CG 4.18Å; F758-L762 HydrophobicContact CZ-CD1 3.91Å; F758-L762 HydrophobicContact CZ-CD2 4.11Å; F758-L762 HydrophobicContact CZ-CG 4.09Å; F758-L762 WeakPolarHBondContact O-CG 3.42Å; F758-L762 PolarHBondContact O-N 3.03Å; N759-L762 PolarHBondContact O-N 2.74Å; L762-F785 HydrophobicContact CD1-CD2 3.58Å; L762-F785 HydrophobicContact CD1-CE2 3.63Å; L762-Y808 HydrophobicContact CB-CE1 4.07Å; L762-Y808 HydrophobicContact CD1-CE1 4.4Å; L762-W813 HydrophobicContact CD2-CZ3 4.28Å
763	K	74.6	Confident	76.9	Confident	83 Å²	83	53.8 Å²	53.8	36%	0.361	24%	0.244	S	C	.	.	H	α-helix	trans	-77.3	-27.4	170.9	-70.3	-175	179.4	-169.8	0	113.4	N759 R760 F761 E792 E804	N759-K763 WeakPolarHBondContact O-CG 3.44Å; N759-K763 PolarHBondContact O-N 2.99Å; R760-K763 PolarHBondContact O-N 2.88Å; R760-K763 VanDerWaalsContact O-N 3.16Å; F761-K763 PolarHBondContact O-N 3.28Å; K763-E792 IonicContact NZ-OE2 3.78Å; K763-E804 IonicContact NZ-OE2 3.63Å
764	Q	72.2	Confident	76.8	Confident	132 Å²	132	53.6 Å²	53.6	62%	0.617	24%	0.242	S	C	*	.	H	α-helix	trans	-94.2	-26.8	-177.5	-72.2	177.7	-9	0	0	114.9	R760 F761 N766	R760-Q764 WeakPolarHBondContact O-CG 3.39Å; R760-Q764 PolarHBondContact O-N 3.35Å; F761-Q764 PolarHBondContact O-N 3.33Å; Q764-N766 PolarHBondContact O-N 3.34Å
765	V	76.6	Confident	77.2	Confident	12 Å²	12	53.1 Å²	53.1	7%	0.073	24%	0.238	C	C	.	.	S	Bend	trans	-55.3	127.1	-179.4	158.8	0	0	0	0	111.3	F761 R767 V770	F761-V765 HydrophobicContact CD1-CG2 3.9Å; F761-V765 HydrophobicContact CD2-CG2 3.91Å; F761-V765 HydrophobicContact CE1-CG2 3.56Å; F761-V765 HydrophobicContact CE2-CG2 3.57Å; F761-V765 HydrophobicContact CG-CG2 4.07Å; F761-V765 HydrophobicContact CZ-CG2 3.39Å; F761-V765 VanDerWaalsContact O-CG2 3.28Å; F761-V765 WeakPolarHBondContact O-CG2 3.34Å; F761-V765 PolarHBondContact O-N 3.48Å; V765-R767 VanDerWaalsContact C-N 3.29Å; V765-R767 PolarHBondContact O-N 2.8Å; V765-V770 HydrophobicContact CG1-CG2 3.56Å
766	N	73.2	Confident	77.7	Confident	62 Å²	62	52.8 Å²	52.8	33%	0.332	24%	0.235	S	C	.	.			trans	-68.1	89.1	168.3	-179.2	-3.4	0	0	0	109.3	E741 T743 Q764 R768 K769	E741-N766 PolarHBondContact OE1-ND2 2.97Å; T743-N766 HydrophobicContact CG2-CB 3.8Å; Q764-N766 PolarHBondContact O-N 3.34Å; N766-R768 PolarHBondContact O-N 3.24Å; N766-R768 PolarHBondContact OD1-N 2.8Å; N766-K769 PolarHBondContact O-N 3.08Å
767	R	70.3	Confident	78.6	Confident	53 Å²	53	51.7 Å²	51.7	20%	0.2	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-48.5	-31.1	-173.1	-59	-179.2	-178.4	163.4	2.1	113.1	V765 K769 D807 R811 W813	V765-R767 VanDerWaalsContact C-N 3.29Å; V765-R767 PolarHBondContact O-N 2.8Å; R767-K769 VanDerWaalsContact C-N 3.27Å; R767-K769 PolarHBondContact O-N 2.98Å; R767-D807 IonicContact CZ-OD2 2.75Å; R767-D807 IonicContact NH1-OD2 3.65Å; R767-D807 PolarHBondContact NH1-OD2 2.88Å; R767-R811 PolarHBondContact O-NH1 2.66Å; R767-R811 PolarHBondContact O-NH2 3.35Å; R767-R811 VanDerWaalsContact O-NH2 3.1Å; R767-W813 HydrophobicContact CG-CH2 4.42Å
768	R	69.9	Low	79.1	Confident	227 Å²	227	51 Å²	51	86%	0.857	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-70.1	-14.4	179.7	-64.5	-175.4	-178.7	177.8	1.7	115	N766	N766-R768 PolarHBondContact O-N 3.24Å; N766-R768 PolarHBondContact OD1-N 2.8Å
769	K	74.1	Confident	79.2	Confident	113 Å²	113	51.3 Å²	51.3	49%	0.491	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-99.6	-17.3	-179.7	-72.3	-173.4	167.7	-177.8	0	114.4	E741 T743 N766 R767	E741-K769 WeakPolarHBondContact OE1-CD 3.34Å; E741-K769 VanDerWaalsContact OE1-CE 3.28Å; E741-K769 WeakPolarHBondContact OE1-CE 3.37Å; E741-K769 IonicContact OE1-NZ 2.62Å; E741-K769 PolarHBondContact OE1-NZ 2.97Å; E741-K769 IonicContact OE2-NZ 3.78Å; E741-K769 PolarHBondContact OE2-NZ 3.41Å; T743-K769 HydrophobicContact CG2-CB 3.88Å; T743-K769 HydrophobicContact CG2-CD 4.12Å; N766-K769 PolarHBondContact O-N 3.08Å; R767-K769 VanDerWaalsContact C-N 3.27Å; R767-K769 PolarHBondContact O-N 2.98Å
770	V	75.6	Confident	79.3	Confident	6 Å²	6	52 Å²	52	4%	0.036	24%	0.235	C	C	.	.	S	Bend	trans	-86	136.7	179.2	179.3	0	0	0	0	109.7	P744 V765 T774 W813	P744-V770 HydrophobicContact CG-CG2 4.37Å; V765-V770 HydrophobicContact CG1-CG2 3.56Å; V770-T774 HydrophobicContact CG1-CG2 4.11Å; V770-T774 WeakPolarHBondContact CG1-OG1 3.15Å; V770-W813 HydrophobicContact CB-CZ2 3.9Å; V770-W813 HydrophobicContact CG1-CZ2 3.81Å
771	R	76.1	Confident	79.4	Confident	109 Å²	109	51 Å²	51	41%	0.411	23%	0.234	S	C	.	.			trans	-61.7	145	178.9	-120.1	166.3	81.1	175.1	3.9	110.5	D773 T774 W813	R771-D773 VanDerWaalsContact C-N 3.26Å; R771-D773 WeakPolarHBondContact CB-OD1 3.2Å; R771-D773 VanDerWaalsContact CG-OD1 3.26Å; R771-D773 WeakPolarHBondContact CG-OD1 3.33Å; R771-D773 IonicContact CZ-OD1 3.65Å; R771-D773 IonicContact CZ-OD2 2.71Å; R771-D773 IonicContact NE-OD1 3.73Å; R771-D773 PolarHBondContact NE-OD1 3.36Å; R771-D773 IonicContact NE-OD2 2.63Å; R771-D773 PolarHBondContact NE-OD2 3.31Å; R771-D773 IonicContact NH2-OD1 2.9Å; R771-D773 IonicContact NH2-OD2 3.52Å; R771-D773 PolarHBondContact NH2-OD2 3.25Å; R771-D773 PolarHBondContact O-N 2.91Å; R771-T774 WeakPolarHBondContact O-CB 3.2Å; R771-T774 PolarHBondContact O-N 3.01Å; R771-T774 PolarHBondContact O-OG1 2.91Å; R771-W813 PolarHBondContact O-NE1 2.88Å
772	D	73.7	Confident	79.4	Confident	88 Å²	88	50.9 Å²	50.9	47%	0.471	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-17.8	-178	-68.1	-48.8	0	0	0	112.9	R811 Q812	D772-R811 IonicContact OD1-CZ 3.48Å; D772-R811 IonicContact OD1-NH1 2.72Å; D772-R811 PolarHBondContact OD1-NH1 3.37Å; D772-Q812 CarbonylContact O-C 3.56Å; D772-Q812 VanDerWaalsContact O-C 3.24Å
773	D	76.9	Confident	79.6	Confident	52 Å²	52	51.4 Å²	51.4	28%	0.278	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	19.4	173.1	65.6	-35.5	0	0	0	113.4	R771 V775	R771-D773 VanDerWaalsContact C-N 3.26Å; R771-D773 WeakPolarHBondContact CB-OD1 3.2Å; R771-D773 VanDerWaalsContact CG-OD1 3.26Å; R771-D773 WeakPolarHBondContact CG-OD1 3.33Å; R771-D773 IonicContact CZ-OD1 3.65Å; R771-D773 IonicContact CZ-OD2 2.71Å; R771-D773 IonicContact NE-OD1 3.73Å; R771-D773 PolarHBondContact NE-OD1 3.36Å; R771-D773 IonicContact NE-OD2 2.63Å; R771-D773 PolarHBondContact NE-OD2 3.31Å; R771-D773 IonicContact NH2-OD1 2.9Å; R771-D773 IonicContact NH2-OD2 3.52Å; R771-D773 PolarHBondContact NH2-OD2 3.25Å; R771-D773 PolarHBondContact O-N 2.91Å; D773-V775 PolarHBondContact O-N 2.74Å
774	T	83.7	Confident	79.7	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	23%	0.231	C	C	.	.			trans	-65.4	132.1	176.1	-67.9	0	0	0	0	111.9	P747 V749 V770 R771 F776 T814	P747-T774 CarbonylContact O-C 3.55Å; P747-T774 VanDerWaalsContact O-CA 3.32Å; P747-T774 WeakPolarHBondContact O-CA 3.34Å; V749-T774 HydrophobicContact CG2-CG2 4Å; V770-T774 HydrophobicContact CG1-CG2 4.11Å; V770-T774 WeakPolarHBondContact CG1-OG1 3.15Å; R771-T774 WeakPolarHBondContact O-CB 3.2Å; R771-T774 PolarHBondContact O-N 3.01Å; R771-T774 PolarHBondContact O-OG1 2.91Å; T774-F776 HydrophobicContact CG2-CD2 4.17Å; T774-F776 HydrophobicContact CG2-CE1 4.32Å; T774-F776 HydrophobicContact CG2-CE2 3.71Å; T774-F776 HydrophobicContact CG2-CZ 3.79Å; T774-T814 PolarHBondContact O-N 3.35Å; T774-T814 VanDerWaalsContact O-N 3.09Å
775	V	87.4	Confident	79.9	Confident	5 Å²	5	43.7 Å²	43.7	3%	0.03	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.1	174.7	-178.8	0	0	0	0	109.5	W689 P747 V749 D773 T814 L816 P984	W689-V775 HydrophobicContact CH2-CB 4.38Å; W689-V775 HydrophobicContact CH2-CG1 4.07Å; W689-V775 HydrophobicContact CH2-CG2 4.17Å; W689-V775 HydrophobicContact CZ2-CG2 4.27Å; W689-V775 HydrophobicContact CZ3-CG1 4.49Å; P747-V775 PolarHBondContact O-N 2.61Å; V749-V775 PolarHBondContact N-O 2.71Å; D773-V775 PolarHBondContact O-N 2.74Å; V775-T814 CarbonylContact C-O 3.51Å; V775-T814 WeakPolarHBondContact CA-O 3.26Å; V775-T814 HydrophobicContact CG1-CG2 4.42Å; V775-L816 HydrophobicContact CG1-CD1 4.18Å; V775-L816 HydrophobicContact CG1-CG 4.42Å; V775-P984 HydrophobicContact CG2-CG 3.86Å
776	F	89.6	Confident	79.5	Confident	2 Å²	2	44 Å²	44	1%	0.009	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.5	170.7	-66.9	-80.9	0	0	0	109.7	V749 V751 F758 F761 T774 L778 W813 T814 F815 L816	V749-F776 HydrophobicContact CB-CD1 3.8Å; V749-F776 HydrophobicContact CB-CE1 4Å; V749-F776 HydrophobicContact CG1-CD1 3.98Å; V749-F776 HydrophobicContact CG1-CE1 4.05Å; V749-F776 HydrophobicContact CG2-CD1 4.39Å; V749-F776 HydrophobicContact CG2-CE1 4.14Å; V749-F776 WeakPolarHBondContact O-CA 3.43Å; V751-F776 HydrophobicContact CG2-CD1 4.28Å; F758-F776 HydrophobicContact CE2-CD1 4.06Å; F758-F776 HydrophobicContact CE2-CE1 4.42Å; F758-F776 HydrophobicContact CZ-CB 4.36Å; F758-F776 HydrophobicContact CZ-CD1 4.03Å; F758-F776 HydrophobicContact CZ-CG 4.19Å; F761-F776 HydrophobicContact CE1-CE1 4.12Å; T774-F776 HydrophobicContact CG2-CD2 4.17Å; T774-F776 HydrophobicContact CG2-CE1 4.32Å; T774-F776 HydrophobicContact CG2-CE2 3.71Å; T774-F776 HydrophobicContact CG2-CZ 3.79Å; F776-L778 HydrophobicContact CB-CD2 4.2Å; F776-W813 HydrophobicContact CE2-CB 4.36Å; F776-W813 HydrophobicContact CE2-CD2 4.02Å; F776-W813 HydrophobicContact CE2-CE3 4.01Å; F776-W813 HydrophobicContact CE2-CG 4.2Å; F776-T814 PolarHBondContact N-O 3.39Å; F776-F815 HydrophobicContact CB-CD1 3.79Å; F776-F815 HydrophobicContact CB-CE1 4.11Å; F776-F815 HydrophobicContact CD2-CD1 4.13Å; F776-F815 AromaticContact CD2-CE1 3.69Å; F776-F815 HydrophobicContact CD2-CE1 3.69Å; F776-F815 HydrophobicContact CD2-CZ 4.18Å; F776-F815 HydrophobicContact CE2-CE1 4.42Å; F776-F815 HydrophobicContact CG-CD1 4.25Å; F776-F815 HydrophobicContact CG-CE1 4.06Å; F776-L816 PolarHBondContact O-N 3.35Å
777	L	92.4	Very high	79	Confident	1 Å²	1	46 Å²	46	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	96.9	178.6	-179.1	55.7	0	0	0	109.8	L680 L683 L684 V749 V750 V751 L816	L680-L777 HydrophobicContact CD2-CD1 4.1Å; L680-L777 HydrophobicContact CD2-CD2 3.64Å; L680-L777 HydrophobicContact CD2-CG 3.77Å; L683-L777 HydrophobicContact CD2-CD1 3.51Å; L683-L777 HydrophobicContact CD2-CD2 3.88Å; L683-L777 HydrophobicContact CD2-CG 4.37Å; L684-L777 HydrophobicContact CD2-CD2 4.25Å; V749-L777 PolarHBondContact O-N 2.63Å; V750-L777 HydrophobicContact CG2-CD2 4.34Å; V751-L777 PolarHBondContact N-O 3.35Å; L777-L816 CarbonylContact C-O 3.36Å; L777-L816 WeakPolarHBondContact CA-O 3.3Å; L777-L816 HydrophobicContact CD1-CB 4.04Å
778	L	91	Very high	78.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	138	-172	-51.2	179.7	0	0	0	112.1	V751 F758 F776 F785 F815 L816 S817 M818 I944	V751-L778 HydrophobicContact CB-CD2 3.98Å; V751-L778 HydrophobicContact CG1-CD2 4.29Å; V751-L778 HydrophobicContact CG2-CD2 3.93Å; F758-L778 HydrophobicContact CD1-CD2 3.96Å; F758-L778 HydrophobicContact CE1-CD1 4.39Å; F758-L778 HydrophobicContact CE1-CD2 3.37Å; F758-L778 HydrophobicContact CE2-CD2 4.36Å; F758-L778 HydrophobicContact CZ-CD2 3.61Å; F776-L778 HydrophobicContact CB-CD2 4.2Å; L778-F785 HydrophobicContact CD1-CD1 3.86Å; L778-F785 HydrophobicContact CD1-CE1 3.51Å; L778-F785 HydrophobicContact CD1-CZ 4.42Å; L778-F815 HydrophobicContact CD1-CB 4.27Å; L778-F815 HydrophobicContact CD1-CD1 4.24Å; L778-L816 PolarHBondContact N-O 2.91Å; L778-S817 VanDerWaalsContact O-CA 3.31Å; L778-S817 WeakPolarHBondContact O-CA 3.45Å; L778-S817 PolarHBondContact O-OG 2.92Å; L778-M818 PolarHBondContact O-N 3.15Å; L778-I944 HydrophobicContact CD1-CD1 4.12Å
779	T	88.6	Confident	77.2	Confident	8 Å²	8	37.7 Å²	37.7	5%	0.049	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	145.4	179.1	71	0	0	0	0	111.7	L676 L680 V751 F752 Q781 S782	L676-T779 HydrophobicContact CD1-CG2 4.31Å; L680-T779 HydrophobicContact CD1-CG2 3.96Å; L680-T779 HydrophobicContact CD2-CG2 3.89Å; V751-T779 PolarHBondContact O-N 3.21Å; V751-T779 PolarHBondContact O-OG1 3.07Å; F752-T779 HydrophobicContact CD1-CG2 4.29Å; F752-T779 VanDerWaalsContact CD1-OG1 3.26Å; F752-T779 WeakPolarHBondContact CD1-OG1 3.4Å; F752-T779 HydrophobicContact CE1-CG2 4.02Å; T779-Q781 PolarHBondContact O-N 2.78Å; T779-S782 PolarHBondContact N-OG 2.95Å; T779-S782 PolarHBondContact O-N 2.8Å; T779-S782 PolarHBondContact O-OG 3.5Å
780	G	80.2	Confident	75.7	Confident	27 Å²	27	34.4 Å²	34.4	28%	0.278	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	53.1	-135	178.6	0	0	0	0	0	112.7	S782 H783 Q819	G780-S782 PolarHBondContact O-N 2.6Å; G780-S782 VanDerWaalsContact O-N 3.08Å; G780-H783 PolarHBondContact O-N 2.79Å; G780-Q819 PolarHBondContact O-NE2 3.39Å
781	Q	78.4	Confident	74	Confident	85 Å²	85	38.3 Å²	38.3	40%	0.397	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-56.2	-25.5	-177.3	-69.9	-173.5	-7.7	0	0	115	A755 T779 H783 D784	A755-Q781 WeakPolarHBondContact CB-O 3.42Å; T779-Q781 PolarHBondContact O-N 2.78Å; Q781-H783 PolarHBondContact O-N 3.14Å; Q781-D784 PolarHBondContact O-N 2.87Å; Q781-D784 VanDerWaalsContact O-N 3.12Å
782	S	82	Confident	72.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-60.2	-12.2	179.5	62.7	0	0	0	0	114.3	A753 T779 G780 F785	A753-S782 WeakPolarHBondContact O-CB 3.2Å; A753-S782 PolarHBondContact O-N 2.83Å; T779-S782 PolarHBondContact N-OG 2.95Å; T779-S782 PolarHBondContact O-N 2.8Å; T779-S782 PolarHBondContact O-OG 3.5Å; G780-S782 PolarHBondContact O-N 2.6Å; G780-S782 VanDerWaalsContact O-N 3.08Å; S782-F785 WeakPolarHBondContact O-CD1 3.45Å
783	H	85.2	Confident	70.2	Confident	14 Å²	14	42.9 Å²	42.9	7%	0.065	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-61	-43.3	170.2	-179.6	106.8	0	0	0	113.9	G780 Q781 F785 S817	G780-H783 PolarHBondContact O-N 2.79Å; Q781-H783 PolarHBondContact O-N 3.14Å; H783-F785 WeakPolarHBondContact O-CD1 3.28Å; H783-F785 PolarHBondContact O-N 3.15Å; H783-S817 PolarHBondContact ND1-OG 3.43Å
784	D	75.8	Confident	68.4	Low	44 Å²	44	44.4 Å²	44.4	24%	0.235	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-81.6	11	-174	-78.7	-69.7	0	0	0	113.4	Q781 V786 R787	Q781-D784 PolarHBondContact O-N 2.87Å; Q781-D784 VanDerWaalsContact O-N 3.12Å; D784-V786 PolarHBondContact O-N 3.2Å; D784-V786 VanDerWaalsContact O-N 3.08Å; D784-R787 WeakPolarHBondContact O-CB 3.17Å; D784-R787 PolarHBondContact O-N 2.85Å; D784-R787 WeakPolarHBondContact OD1-CD 3.42Å; D784-R787 IonicContact OD1-NE 3.31Å
785	F	77.3	Confident	66.3	Low	9 Å²	9	48.8 Å²	48.8	4%	0.039	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-52.5	-35.3	-176.9	78.9	-77.3	0	0	0	114.2	F758 L762 L778 S782 H783 R787 F815 I944	F758-F785 HydrophobicContact CD1-CB 3.72Å; F758-F785 HydrophobicContact CD1-CD1 4.19Å; F758-F785 AromaticContact CD1-CD2 3.94Å; F758-F785 HydrophobicContact CD1-CD2 3.94Å; F758-F785 AromaticContact CD1-CG 3.69Å; F758-F785 HydrophobicContact CD1-CG 3.69Å; F758-F785 HydrophobicContact CE1-CB 4.43Å; F758-F785 HydrophobicContact CE1-CD1 4.14Å; F758-F785 AromaticContact CE1-CD2 3.86Å; F758-F785 HydrophobicContact CE1-CD2 3.86Å; F758-F785 HydrophobicContact CE1-CE1 4.33Å; F758-F785 HydrophobicContact CE1-CE2 4.06Å; F758-F785 AromaticContact CE1-CG 3.89Å; F758-F785 HydrophobicContact CE1-CG 3.89Å; F758-F785 HydrophobicContact CE1-CZ 4.28Å; L762-F785 HydrophobicContact CD1-CD2 3.58Å; L762-F785 HydrophobicContact CD1-CE2 3.63Å; L778-F785 HydrophobicContact CD1-CD1 3.86Å; L778-F785 HydrophobicContact CD1-CE1 3.51Å; L778-F785 HydrophobicContact CD1-CZ 4.42Å; S782-F785 WeakPolarHBondContact O-CD1 3.45Å; H783-F785 WeakPolarHBondContact O-CD1 3.28Å; H783-F785 PolarHBondContact O-N 3.15Å; F785-R787 PolarHBondContact O-N 3Å; F785-F815 HydrophobicContact CE1-CD1 4.2Å; F785-F815 HydrophobicContact CE2-CD1 4.38Å; F785-F815 HydrophobicContact CE2-CE1 4.04Å; F785-F815 HydrophobicContact CE2-CZ 4.35Å; F785-F815 AromaticContact CZ-CD1 3.62Å; F785-F815 HydrophobicContact CZ-CD1 3.62Å; F785-F815 HydrophobicContact CZ-CD2 4.41Å; F785-F815 AromaticContact CZ-CE1 3.73Å; F785-F815 HydrophobicContact CZ-CE1 3.73Å; F785-F815 AromaticContact CZ-CG 3.99Å; F785-F815 HydrophobicContact CZ-CG 3.99Å; F785-F815 HydrophobicContact CZ-CZ 4.18Å; F785-I944 HydrophobicContact CE1-CD1 4.36Å
786	V	69	Low	63.7	Low	19 Å²	19	52.6 Å²	52.6	12%	0.115	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-68.1	-23.1	-178.4	-156.5	0	0	0	0	112.5	D784 M805 I944 P951	D784-V786 PolarHBondContact O-N 3.2Å; D784-V786 VanDerWaalsContact O-N 3.08Å; V786-M805 HydrophobicContact CG1-CE 3.4Å; V786-I944 HydrophobicContact CG2-CG2 4.31Å; V786-P951 HydrophobicContact CB-CB 4.43Å; V786-P951 HydrophobicContact CB-CG 4.3Å; V786-P951 HydrophobicContact CG1-CB 3.94Å; V786-P951 HydrophobicContact CG1-CG 3.76Å; V786-P951 HydrophobicContact CG2-CB 4.42Å
787	R	62.2	Low	61	Low	104 Å²	104	58.8 Å²	58.8	39%	0.392	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-30.2	-173.3	-75.9	161.9	154.2	-125.6	-0.2	113.8	D784 F785 N789 S790 T879 S881	D784-R787 WeakPolarHBondContact O-CB 3.17Å; D784-R787 PolarHBondContact O-N 2.85Å; D784-R787 WeakPolarHBondContact OD1-CD 3.42Å; D784-R787 IonicContact OD1-NE 3.31Å; F785-R787 PolarHBondContact O-N 3Å; R787-N789 PolarHBondContact O-N 2.87Å; R787-N789 VanDerWaalsContact O-N 3.11Å; R787-S790 PolarHBondContact O-N 3.07Å; R787-S790 PolarHBondContact O-OG 2.87Å; R787-T879 PolarHBondContact NH1-O 3.16Å; R787-S881 PolarHBondContact NE-OG 2.69Å; R787-S881 VanDerWaalsContact NE-OG 3.17Å; R787-S881 VanDerWaalsContact NH2-CA 3.35Å; R787-S881 PolarHBondContact NH2-OG 3.41Å
788	Q	54.1	Low	58.1	Low	76 Å²	76	66.1 Å²	66.1	36%	0.355	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-59.4	-30.7	-175.1	-72.1	-171.4	-19.6	0	0	113.9	A755 A756 S790 F791	A755-Q788 HydrophobicContact CB-CG 4.41Å; A755-Q788 PolarHBondContact O-OE1 3.26Å; A756-Q788 VanDerWaalsContact N-NE2 3.16Å; Q788-S790 PolarHBondContact O-N 3.25Å; Q788-F791 PolarHBondContact O-N 2.95Å; Q788-F791 VanDerWaalsContact O-N 3.1Å
789	N	47	Very low	55.2	Low	28 Å²	28	72.8 Å²	72.8	15%	0.15	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-67	-0.2	176.8	-64.6	-21	0	0	0	113.8	N759 R787	N759-N789 PolarHBondContact ND2-OD1 2.93Å; R787-N789 PolarHBondContact O-N 2.87Å; R787-N789 VanDerWaalsContact O-N 3.11Å
790	S	43.4	Very low	52.6	Low	45 Å²	45	79.8 Å²	79.8	32%	0.315	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-91.5	-13.6	169.4	69	0	0	0	0	114.9	R787 Q788	R787-S790 PolarHBondContact O-N 3.07Å; R787-S790 PolarHBondContact O-OG 2.87Å; Q788-S790 PolarHBondContact O-N 3.25Å
791	F	39.5	Very low	50.4	Low	88 Å²	88	86.8 Å²	86.8	39%	0.386	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-32.9	-174.6	-160.2	-83.7	0	0	0	113.7	T550 Q788 R793 L852	T550-F791 VanDerWaalsContact CB-CZ 3.47Å; T550-F791 HydrophobicContact CG2-CD1 4.46Å; T550-F791 HydrophobicContact CG2-CE1 3.46Å; T550-F791 VanDerWaalsContact CG2-CE1 3.46Å; T550-F791 HydrophobicContact CG2-CZ 3.62Å; T550-F791 VanDerWaalsContact O-CE2 3.29Å; T550-F791 WeakPolarHBondContact O-CE2 3.3Å; Q788-F791 PolarHBondContact O-N 2.95Å; Q788-F791 VanDerWaalsContact O-N 3.1Å; F791-R793 PolarHBondContact O-N 2.82Å; F791-L852 HydrophobicContact CE2-CD1 4.25Å
792	E	37.1	Very low	48.6	Very low	136 Å²	136	85.2 Å²	85.2	64%	0.636	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-63.6	-10.4	178.1	-65.1	178.6	132.1	0	0	113.4	K763 S794	K763-E792 IonicContact NZ-OE2 3.78Å; E792-S794 VanDerWaalsContact C-N 3.34Å; E792-S794 PolarHBondContact O-N 2.92Å
793	R	34.6	Very low	46.8	Very low	157 Å²	157	92.7 Å²	92.7	59%	0.592	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-67.7	-18.9	-176	-79.4	-178.7	169.2	154.3	-1.4	116.3	F791	F791-R793 PolarHBondContact O-N 2.82Å
794	S	38.4	Very low	45.2	Very low	83 Å²	83	96.6 Å²	96.6	58%	0.58	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-88	-13.2	-174.7	56.4	0	0	0	0	114.3	E792	E792-S794 VanDerWaalsContact C-N 3.34Å; E792-S794 PolarHBondContact O-N 2.92Å
795	A	39.1	Very low	43.8	Very low	93 Å²	93	96.8 Å²	96.8	77%	0.769	50%	0.5	S	S	*	.	S	Bend	trans	-97.1	-18.5	-169.5	0	0	0	0	0	115.1
796	S	32.1	Very low	42.4	Very low	86 Å²	86	100 Å²	100	60%	0.601	52%	0.522	S	S	*	.			trans	-121.1	109.8	-176.9	50.1	0	0	0	0	112.7	N798	S796-N798 PolarHBondContact O-N 3.1Å
797	T	33.8	Very low	41.5	Very low	132 Å²	132	102.6 Å²	102.6	81%	0.81	54%	0.535	S	S	*	.	S	Bend	trans	-69.3	127.7	165.4	50.4	0	0	0	0	110.1
798	N	30.8	Very low	41.2	Very low	154 Å²	154	98.4 Å²	98.4	82%	0.824	52%	0.52	S	S	*	.	S	Bend	trans	65.4	84.9	175.7	-49.8	-29	0	0	0	115.8	S796	S796-N798 PolarHBondContact O-N 3.1Å
799	D	30.4	Very low	41	Very low	141 Å²	141	97.1 Å²	97.1	75%	0.754	52%	0.517	S	S	*	.				-160.7	-173.2	117.9	-132.9	-49.9	0	0	0	112.2
800	K	33.5	Very low	41.1	Very low	155 Å²	155	99.3 Å²	99.3	67%	0.674	54%	0.539	S	S	*	.			trans	-60.2	170	-168.9	-64.1	146.5	-171.9	167.2	0	116.5
801	F	34.9	Very low	41.7	Very low	173 Å²	173	100 Å²	100	76%	0.759	54%	0.535	S	S	*	.	S	Bend	trans	-36	137.7	156.3	-115.3	-103.1	0	0	0	112	E803	F801-E803 PolarHBondContact O-N 2.92Å
802	P	40.7	Very low	42.8	Very low	53 Å²	53	103.2 Å²	103.2	34%	0.344	55%	0.551	S	S	.	*			trans	-63.6	111.8	177.8	25.6	-33.3	0	0	0	110.5	E804 M805	P802-E804 PolarHBondContact O-N 2.95Å; P802-M805 PolarHBondContact O-N 2.86Å
803	E	44.5	Very low	44.7	Very low	156 Å²	156	97.6 Å²	97.6	73%	0.729	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-10.9	-176.7	-64.3	-174.9	152.4	0	0	113.1	F801 P806	F801-E803 PolarHBondContact O-N 2.92Å; E803-P806 WeakPolarHBondContact O-CD 3.27Å
804	E	50.9	Low	46.9	Very low	96 Å²	96	91.3 Å²	91.3	45%	0.449	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-26.7	-179.1	-54	-170.8	151.7	0	0	114.3	K763 P802 D807	K763-E804 IonicContact NZ-OE2 3.63Å; P802-E804 PolarHBondContact O-N 2.95Å; E804-D807 WeakPolarHBondContact O-CB 3.3Å; E804-D807 PolarHBondContact O-N 3.2Å
805	M	47.3	Very low	49.2	Very low	48 Å²	48	87.6 Å²	87.6	24%	0.236	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-38.2	-173.6	-147.6	73.9	157.1	0	0	114.3	V786 P802 D807 Y808	V786-M805 HydrophobicContact CG1-CE 3.4Å; P802-M805 PolarHBondContact O-N 2.86Å; M805-D807 PolarHBondContact O-N 3.48Å; M805-Y808 PolarHBondContact O-N 2.72Å; M805-Y808 HydrophobicContact SD-CD2 4.18Å; M805-Y808 HydrophobicContact SD-CE2 4.21Å
806	P	46.2	Very low	51.5	Low	77 Å²	77	83.9 Å²	83.9	50%	0.5	44%	0.444	S	S	.	.	H	α-helix	trans	-59.5	-23	174.7	-26.1	36.2	0	0	0	114.6	E803 Y808 V809 A810	E803-P806 WeakPolarHBondContact O-CD 3.27Å; P806-Y808 VanDerWaalsContact C-N 3.34Å; P806-Y808 PolarHBondContact O-N 3.01Å; P806-V809 CarbonylContact O-C 3.48Å; P806-V809 WeakPolarHBondContact O-CA 3.38Å; P806-V809 WeakPolarHBondContact O-CB 3.41Å; P806-V809 PolarHBondContact O-N 3.29Å; P806-V809 VanDerWaalsContact O-N 3.1Å; P806-A810 PolarHBondContact O-N 3.21Å
807	D	50.5	Low	54.2	Low	73 Å²	73	79.8 Å²	79.8	39%	0.39	42%	0.415	S	S	.	.	H	α-helix	trans	-73.4	-25.7	-176.1	-125.1	39.1	0	0	0	112.6	R767 E804 M805 V809 A810	R767-D807 IonicContact CZ-OD2 2.75Å; R767-D807 IonicContact NH1-OD2 3.65Å; R767-D807 PolarHBondContact NH1-OD2 2.88Å; E804-D807 WeakPolarHBondContact O-CB 3.3Å; E804-D807 PolarHBondContact O-N 3.2Å; M805-D807 PolarHBondContact O-N 3.48Å; D807-V809 VanDerWaalsContact C-N 3.35Å; D807-A810 PolarHBondContact O-N 2.78Å
808	Y	56.2	Low	57	Low	17 Å²	17	73.5 Å²	73.5	7%	0.067	38%	0.377	C	S	.	.	H	α-helix	trans	-69.6	-33.9	167.5	-58.6	-61.5	0	0	0	111.6	L762 M805 P806 A810 R811 W813	L762-Y808 HydrophobicContact CB-CE1 4.07Å; L762-Y808 HydrophobicContact CD1-CE1 4.4Å; M805-Y808 PolarHBondContact O-N 2.72Å; M805-Y808 HydrophobicContact SD-CD2 4.18Å; M805-Y808 HydrophobicContact SD-CE2 4.21Å; P806-Y808 VanDerWaalsContact C-N 3.34Å; P806-Y808 PolarHBondContact O-N 3.01Å; Y808-A810 VanDerWaalsContact C-N 3.28Å; Y808-R811 VanDerWaalsContact O-O 3.04Å; Y808-W813 HydrophobicContact CD1-CZ3 4.37Å
809	V	50.3	Low	59.6	Low	48 Å²	48	66.8 Å²	66.8	29%	0.291	34%	0.34	S	S	.	.	H	α-helix	trans	-74.7	-21.4	176.5	-164.2	0	0	0	0	111.6	P806 D807 R811 V946 K948	P806-V809 CarbonylContact O-C 3.48Å; P806-V809 WeakPolarHBondContact O-CA 3.38Å; P806-V809 WeakPolarHBondContact O-CB 3.41Å; P806-V809 PolarHBondContact O-N 3.29Å; P806-V809 VanDerWaalsContact O-N 3.1Å; D807-V809 VanDerWaalsContact C-N 3.35Å; V809-R811 VanDerWaalsContact C-N 3.28Å; V809-R811 PolarHBondContact O-N 3.4Å; V809-V946 HydrophobicContact CG2-CG1 4.05Å; V809-V946 WeakPolarHBondContact CG2-O 3.44Å; V809-K948 HydrophobicContact CG1-CG 3.93Å
810	A	49	Very low	62.3	Low	75 Å²	75	61 Å²	61	62%	0.62	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-8.7	179.1	0	0	0	0	0	113.9	P806 D807 Y808	P806-A810 PolarHBondContact O-N 3.21Å; D807-A810 PolarHBondContact O-N 2.78Å; Y808-A810 VanDerWaalsContact C-N 3.28Å
811	R	55.2	Low	64.6	Low	58 Å²	58	54.8 Å²	54.8	22%	0.219	29%	0.286	C	S	.	.	S	Bend	trans	-129.2	137.8	-177.2	-73.8	172.1	162.2	-95.2	2.9	110.1	R767 D772 Y808 V809 W813	R767-R811 PolarHBondContact O-NH1 2.66Å; R767-R811 PolarHBondContact O-NH2 3.35Å; R767-R811 VanDerWaalsContact O-NH2 3.1Å; D772-R811 IonicContact OD1-CZ 3.48Å; D772-R811 IonicContact OD1-NH1 2.72Å; D772-R811 PolarHBondContact OD1-NH1 3.37Å; Y808-R811 VanDerWaalsContact O-O 3.04Å; V809-R811 VanDerWaalsContact C-N 3.28Å; V809-R811 PolarHBondContact O-N 3.4Å; R811-W813 HydrophobicContact CB-CD2 4.41Å; R811-W813 HydrophobicContact CB-CG 4.45Å; R811-W813 PolarHBondContact O-N 2.83Å
812	Q	63.3	Low	66.5	Low	156 Å²	156	47.4 Å²	47.4	73%	0.729	26%	0.258	S	S	*	.			trans	-83.3	30.9	-168.6	-62.2	-175.5	-6.9	0	0	113.7	D772 T814	D772-Q812 CarbonylContact O-C 3.56Å; D772-Q812 VanDerWaalsContact O-C 3.24Å; Q812-T814 PolarHBondContact O-N 2.9Å
813	W	77.7	Confident	68.2	Low	19 Å²	19	46.5 Å²	46.5	7%	0.072	25%	0.251	C	S	.	.			trans	-61.3	134.2	177.5	-65	-15.1	0	0	0	111	L762 R767 V770 R771 F776 Y808 R811 F815	L762-W813 HydrophobicContact CD2-CZ3 4.28Å; R767-W813 HydrophobicContact CG-CH2 4.42Å; V770-W813 HydrophobicContact CB-CZ2 3.9Å; V770-W813 HydrophobicContact CG1-CZ2 3.81Å; R771-W813 PolarHBondContact O-NE1 2.88Å; F776-W813 HydrophobicContact CE2-CB 4.36Å; F776-W813 HydrophobicContact CE2-CD2 4.02Å; F776-W813 HydrophobicContact CE2-CE3 4.01Å; F776-W813 HydrophobicContact CE2-CG 4.2Å; Y808-W813 HydrophobicContact CD1-CZ3 4.37Å; R811-W813 HydrophobicContact CB-CD2 4.41Å; R811-W813 HydrophobicContact CB-CG 4.45Å; R811-W813 PolarHBondContact O-N 2.83Å; W813-F815 HydrophobicContact CB-CE2 4.13Å; W813-F815 HydrophobicContact CB-CZ 4.35Å; W813-F815 HydrophobicContact CE3-CZ 4.34Å
814	T	79.9	Confident	69.2	Low	24 Å²	24	42.6 Å²	42.6	15%	0.147	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.1	-177.6	-67.5	0	0	0	0	110.1	T774 V775 F776 Q812 L816 M978	T774-T814 PolarHBondContact O-N 3.35Å; T774-T814 VanDerWaalsContact O-N 3.09Å; V775-T814 CarbonylContact C-O 3.51Å; V775-T814 WeakPolarHBondContact CA-O 3.26Å; V775-T814 HydrophobicContact CG1-CG2 4.42Å; F776-T814 PolarHBondContact N-O 3.39Å; Q812-T814 PolarHBondContact O-N 2.9Å; T814-L816 HydrophobicContact CG2-CD2 4.36Å; T814-L816 HydrophobicContact CG2-CG 4.16Å; T814-M978 HydrophobicContact CG2-CE 3.68Å; T814-M978 HydrophobicContact CG2-SD 4.4Å; T814-M978 WeakPolarHBondContact OG1-CE 3.25Å
815	F	86.1	Confident	70.1	Confident	5 Å²	5	39.8 Å²	39.8	2%	0.022	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	104.7	178.3	-61.8	-86.5	0	0	0	109.7	F758 F776 L778 F785 W813 I944 V946	F758-F815 HydrophobicContact CE1-CD1 4.43Å; F758-F815 HydrophobicContact CE1-CE1 4.2Å; F758-F815 HydrophobicContact CZ-CD1 4.45Å; F758-F815 HydrophobicContact CZ-CE1 4.04Å; F776-F815 HydrophobicContact CB-CD1 3.79Å; F776-F815 HydrophobicContact CB-CE1 4.11Å; F776-F815 HydrophobicContact CD2-CD1 4.13Å; F776-F815 AromaticContact CD2-CE1 3.69Å; F776-F815 HydrophobicContact CD2-CE1 3.69Å; F776-F815 HydrophobicContact CD2-CZ 4.18Å; F776-F815 HydrophobicContact CE2-CE1 4.42Å; F776-F815 HydrophobicContact CG-CD1 4.25Å; F776-F815 HydrophobicContact CG-CE1 4.06Å; L778-F815 HydrophobicContact CD1-CB 4.27Å; L778-F815 HydrophobicContact CD1-CD1 4.24Å; F785-F815 HydrophobicContact CE1-CD1 4.2Å; F785-F815 HydrophobicContact CE2-CD1 4.38Å; F785-F815 HydrophobicContact CE2-CE1 4.04Å; F785-F815 HydrophobicContact CE2-CZ 4.35Å; F785-F815 AromaticContact CZ-CD1 3.62Å; F785-F815 HydrophobicContact CZ-CD1 3.62Å; F785-F815 HydrophobicContact CZ-CD2 4.41Å; F785-F815 AromaticContact CZ-CE1 3.73Å; F785-F815 HydrophobicContact CZ-CE1 3.73Å; F785-F815 AromaticContact CZ-CG 3.99Å; F785-F815 HydrophobicContact CZ-CG 3.99Å; F785-F815 HydrophobicContact CZ-CZ 4.18Å; W813-F815 HydrophobicContact CB-CE2 4.13Å; W813-F815 HydrophobicContact CB-CZ 4.35Å; W813-F815 HydrophobicContact CE3-CZ 4.34Å; F815-I944 HydrophobicContact CB-CB 3.98Å; F815-I944 PolarHBondContact O-N 3.1Å; F815-V946 HydrophobicContact CD2-CG2 4.31Å; F815-V946 HydrophobicContact CE2-CG2 4.3Å
816	L	88.7	Confident	71.3	Confident	15 Å²	15	42.1 Å²	42.1	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	140.6	170.6	-64.3	179.1	0	0	0	108.9	L683 V775 F776 L777 L778 T814 L941 Y942 N943	L683-L816 HydrophobicContact CD2-CD1 4.49Å; V775-L816 HydrophobicContact CG1-CD1 4.18Å; V775-L816 HydrophobicContact CG1-CG 4.42Å; F776-L816 PolarHBondContact O-N 3.35Å; L777-L816 CarbonylContact C-O 3.36Å; L777-L816 WeakPolarHBondContact CA-O 3.3Å; L777-L816 HydrophobicContact CD1-CB 4.04Å; L778-L816 PolarHBondContact N-O 2.91Å; T814-L816 HydrophobicContact CG2-CD2 4.36Å; T814-L816 HydrophobicContact CG2-CG 4.16Å; L816-L941 HydrophobicContact CB-CD1 4.37Å; L816-Y942 CarbonylContact C-O 3.57Å; L816-Y942 WeakPolarHBondContact CA-O 3.36Å; L816-N943 HydrophobicContact CD2-CB 4.24Å
817	S	89.1	Confident	73	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129	176.5	-168.7	0	0	0	0	112	L778 H783 Q819 L941 Y942	L778-S817 VanDerWaalsContact O-CA 3.31Å; L778-S817 WeakPolarHBondContact O-CA 3.45Å; L778-S817 PolarHBondContact O-OG 2.92Å; H783-S817 PolarHBondContact ND1-OG 3.43Å; S817-Q819 PolarHBondContact OG-NE2 3.27Å; S817-L941 WeakPolarHBondContact O-CA 3.49Å; S817-Y942 PolarHBondContact N-O 2.86Å; S817-Y942 PolarHBondContact O-N 2.55Å
818	M	90.8	Very high	74.4	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	111.6	176.3	-171.4	70.3	77.6	0	0	109.1	L676 A679 L680 L683 L778 F939 L941	L676-M818 HydrophobicContact CD1-CB 4.42Å; L676-M818 HydrophobicContact CD1-CG 4.11Å; A679-M818 HydrophobicContact CB-CE 4.15Å; A679-M818 HydrophobicContact CB-CG 4.15Å; A679-M818 HydrophobicContact CB-SD 4.11Å; L680-M818 HydrophobicContact CD2-CB 3.99Å; L680-M818 HydrophobicContact CD2-CG 4.39Å; L683-M818 HydrophobicContact CB-CE 4.32Å; L683-M818 HydrophobicContact CD2-CE 4.34Å; L778-M818 PolarHBondContact O-N 3.15Å; M818-F939 HydrophobicContact CG-CB 4.21Å; M818-F939 HydrophobicContact CG-CD1 4.07Å; M818-F939 HydrophobicContact CG-CG 4.45Å; M818-F939 HydrophobicContact SD-CB 3.82Å; M818-L941 HydrophobicContact CE-CD1 3.96Å; M818-L941 HydrophobicContact SD-CB 4.37Å; M818-L941 HydrophobicContact SD-CD1 4.43Å
819	Q	86.7	Confident	75.3	Confident	12 Å²	12	36.5 Å²	36.5	6%	0.056	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	152.7	-173.8	-67.5	-57.8	-29.7	0	0	113.1	G780 S817 S821 F939 T940 Y942	G780-Q819 PolarHBondContact O-NE2 3.39Å; S817-Q819 PolarHBondContact OG-NE2 3.27Å; Q819-S821 PolarHBondContact O-N 3.24Å; Q819-F939 CarbonylContact O-C 3.6Å; Q819-F939 WeakPolarHBondContact O-CA 3.39Å; Q819-F939 WeakPolarHBondContact O-CB 3.36Å; Q819-F939 WeakPolarHBondContact O-CD1 3.4Å; Q819-T940 PolarHBondContact N-O 2.98Å; Q819-T940 PolarHBondContact O-N 3.11Å; Q819-Y942 HydrophobicContact CB-CD2 4.27Å; Q819-Y942 HydrophobicContact CB-CE2 4.07Å; Q819-Y942 HydrophobicContact CG-CD2 4.27Å; Q819-Y942 HydrophobicContact CG-CE2 4.44Å
820	P	85.8	Confident	76.7	Confident	19 Å²	19	41.2 Å²	41.2	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	130.7	170.9	-25.8	37.2	0	0	0	112.6	P671 A822 V884 F888 F939	P671-P820 HydrophobicContact CG-CB 3.81Å; P671-P820 HydrophobicContact CG-CG 3.82Å; P820-A822 PolarHBondContact O-N 3.09Å; P820-V884 HydrophobicContact CB-CG1 4.3Å; P820-F888 HydrophobicContact CB-CE2 3.59Å; P820-F888 HydrophobicContact CB-CZ 3.83Å; P820-F939 HydrophobicContact CG-CE1 4.19Å
821	S	83.4	Confident	78.1	Confident	25 Å²	25	40.4 Å²	40.4	18%	0.175	23%	0.226	C	C	.	.			trans	-76.9	81.6	-176.6	-179.5	0	0	0	0	111.6	Q819 R938 Q958	Q819-S821 PolarHBondContact O-N 3.24Å; S821-R938 WeakPolarHBondContact CB-O 3.37Å; S821-R938 PolarHBondContact N-O 3.3Å; S821-Q958 PolarHBondContact OG-NE2 3.04Å
822	A	74.8	Confident	78.9	Confident	19 Å²	19	37.8 Å²	37.8	16%	0.157	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-63	146.4	-176.1	0	0	0	0	0	114.3	P820 G824 V884 R887 F888	P820-A822 PolarHBondContact O-N 3.09Å; A822-G824 PolarHBondContact O-N 3.43Å; A822-V884 HydrophobicContact CB-CG1 4.31Å; A822-R887 HydrophobicContact CB-CB 3.97Å; A822-F888 HydrophobicContact CB-CD2 4.11Å; A822-F888 HydrophobicContact CB-CE2 3.77Å
823	P	74.9	Confident	79.2	Confident	33 Å²	33	33.8 Å²	33.8	21%	0.214	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-69.5	127.3	178.4	27.4	-33.7	0	0	0	112	N825 R887 A891	P823-N825 PolarHBondContact O-N 3.11Å; P823-R887 HydrophobicContact CG-CB 4.3Å; P823-R887 WeakPolarHBondContact O-CD 3.19Å; P823-A891 HydrophobicContact CG-CB 4.05Å
824	G	67	Low	78.8	Confident	75 Å²	75	40 Å²	40	77%	0.773	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-67.8	118.2	-177.3	0	0	0	0	0	113.6	A822	A822-G824 PolarHBondContact O-N 3.43Å
825	N	69	Low	78	Confident	36 Å²	36	39.9 Å²	39.9	19%	0.193	23%	0.234	C	C	.	.			trans	-146.8	107	167.4	-177.6	19	0	0	0	111.7	P823 G827 M890	P823-N825 PolarHBondContact O-N 3.11Å; N825-G827 PolarHBondContact O-N 3.25Å; N825-G827 WeakPolarHBondContact OD1-CA 3.34Å; N825-G827 PolarHBondContact OD1-N 3.46Å; N825-M890 HydrophobicContact CB-CE 3.89Å; N825-M890 HydrophobicContact CB-SD 4.12Å; N825-M890 PolarHBondContact ND2-SD 2.95Å
826	D	72.6	Confident	76.9	Confident	97 Å²	97	45.7 Å²	45.7	52%	0.519	26%	0.256	S	S	.	.	H	α-helix	trans	-60.9	-26.8	170.4	-59.7	0.4	0	0	0	113.4	L828 A829 R830	D826-L828 VanDerWaalsContact C-N 3.29Å; D826-L828 PolarHBondContact O-N 3.11Å; D826-A829 PolarHBondContact O-N 3.42Å; D826-R830 VanDerWaalsContact CB-CZ 3.46Å; D826-R830 WeakPolarHBondContact O-CB 3.1Å; D826-R830 WeakPolarHBondContact O-CG 3.47Å; D826-R830 PolarHBondContact O-N 3.02Å; D826-R830 IonicContact OD2-CZ 2.64Å; D826-R830 IonicContact OD2-NE 2.74Å; D826-R830 IonicContact OD2-NH2 2.67Å; D826-R830 PolarHBondContact OD2-NH2 2.88Å
827	G	81.3	Confident	75.5	Confident	16 Å²	16	45.5 Å²	45.5	17%	0.165	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-38.8	-172.4	0	0	0	0	0	112.5	N825 R830 F831	N825-G827 PolarHBondContact O-N 3.25Å; N825-G827 WeakPolarHBondContact OD1-CA 3.34Å; N825-G827 PolarHBondContact OD1-N 3.46Å; G827-R830 PolarHBondContact O-N 2.84Å; G827-F831 WeakPolarHBondContact O-CB 3.27Å; G827-F831 PolarHBondContact O-N 3.45Å
828	L	81.2	Confident	74	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68	-45.9	175	-179.3	58.7	0	0	0	111.3	T560 Y563 D826 R830 F831 L832 E886 M890	T560-L828 HydrophobicContact CG2-CD1 4.2Å; T560-L828 HydrophobicContact CG2-CD2 4.13Å; Y563-L828 HydrophobicContact CD1-CD1 3.72Å; Y563-L828 HydrophobicContact CE1-CB 4.16Å; Y563-L828 HydrophobicContact CE1-CD1 4.22Å; Y563-L828 HydrophobicContact CG-CD1 3.92Å; D826-L828 VanDerWaalsContact C-N 3.29Å; D826-L828 PolarHBondContact O-N 3.11Å; L828-R830 VanDerWaalsContact C-N 3.3Å; L828-R830 PolarHBondContact O-N 3.27Å; L828-F831 WeakPolarHBondContact O-CB 3.5Å; L828-F831 PolarHBondContact O-N 2.59Å; L828-L832 HydrophobicContact CD1-CD1 3.95Å; L828-L832 HydrophobicContact CD1-CG 4.15Å; L828-L832 HydrophobicContact CG-CD1 3.97Å; L828-L832 WeakPolarHBondContact O-CG 3.43Å; L828-L832 PolarHBondContact O-N 3.44Å; L828-E886 HydrophobicContact CD2-CB 3.94Å; L828-M890 HydrophobicContact CB-SD 4.28Å; L828-M890 HydrophobicContact CD2-CB 4.27Å; L828-M890 HydrophobicContact CD2-SD 4.17Å
829	A	75	Confident	72.3	Confident	34 Å²	34	60.2 Å²	60.2	28%	0.281	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-39.6	175.2	0	0	0	0	0	112.3	D826 F831 S833 L883	D826-A829 PolarHBondContact O-N 3.42Å; A829-F831 VanDerWaalsContact C-N 3.3Å; A829-F831 PolarHBondContact O-N 3.22Å; A829-S833 WeakPolarHBondContact O-CB 3.14Å; A829-S833 PolarHBondContact O-N 3.37Å; A829-S833 PolarHBondContact O-OG 2.8Å; A829-L883 HydrophobicContact CB-CD1 3.57Å
830	R	78.7	Confident	70.8	Confident	146 Å²	146	61.5 Å²	61.5	55%	0.551	33%	0.328	S	S	*	.	H	α-helix	trans	-75.2	-12.9	175.8	-70.4	-171.8	-117	131.9	-12	114.2	D826 G827 L828 K834	D826-R830 VanDerWaalsContact CB-CZ 3.46Å; D826-R830 WeakPolarHBondContact O-CB 3.1Å; D826-R830 WeakPolarHBondContact O-CG 3.47Å; D826-R830 PolarHBondContact O-N 3.02Å; D826-R830 IonicContact OD2-CZ 2.64Å; D826-R830 IonicContact OD2-NE 2.74Å; D826-R830 IonicContact OD2-NH2 2.67Å; D826-R830 PolarHBondContact OD2-NH2 2.88Å; G827-R830 PolarHBondContact O-N 2.84Å; L828-R830 VanDerWaalsContact C-N 3.3Å; L828-R830 PolarHBondContact O-N 3.27Å; R830-K834 VanDerWaalsContact O-CD 3.32Å; R830-K834 WeakPolarHBondContact O-CD 3.42Å; R830-K834 VanDerWaalsContact O-CG 3.29Å; R830-K834 WeakPolarHBondContact O-CG 3.38Å
831	F	78.2	Confident	69.4	Low	59 Å²	59	66 Å²	66	26%	0.259	36%	0.357	S	S	.	.	H	α-helix	trans	-87.1	-51.3	170.2	175.1	-96.1	0	0	0	110.1	Y563 G827 L828 A829 S833 K834 A835	Y563-F831 HydrophobicContact CD2-CB 3.64Å; Y563-F831 AromaticContact CD2-CD1 3.82Å; Y563-F831 HydrophobicContact CD2-CD1 3.82Å; Y563-F831 AromaticContact CD2-CD2 3.68Å; Y563-F831 HydrophobicContact CD2-CD2 3.68Å; Y563-F831 HydrophobicContact CD2-CE1 4.35Å; Y563-F831 HydrophobicContact CD2-CE2 4.21Å; Y563-F831 AromaticContact CD2-CG 3.44Å; Y563-F831 HydrophobicContact CD2-CG 3.44Å; Y563-F831 VanDerWaalsContact CD2-CG 3.44Å; Y563-F831 HydrophobicContact CE2-CB 3.82Å; Y563-F831 HydrophobicContact CE2-CD2 4.35Å; Y563-F831 HydrophobicContact CE2-CG 4.12Å; Y563-F831 HydrophobicContact CG-CD1 4.19Å; Y563-F831 HydrophobicContact CG-CG 4.26Å; G827-F831 WeakPolarHBondContact O-CB 3.27Å; G827-F831 PolarHBondContact O-N 3.45Å; L828-F831 WeakPolarHBondContact O-CB 3.5Å; L828-F831 PolarHBondContact O-N 2.59Å; A829-F831 VanDerWaalsContact C-N 3.3Å; A829-F831 PolarHBondContact O-N 3.22Å; F831-S833 VanDerWaalsContact C-N 3.34Å; F831-S833 PolarHBondContact O-N 3.45Å; F831-K834 CarbonylContact O-C 3.59Å; F831-K834 WeakPolarHBondContact O-CA 3.45Å; F831-K834 PolarHBondContact O-N 2.94Å; F831-A835 PolarHBondContact O-N 2.9Å; F831-A835 VanDerWaalsContact O-N 3.07Å
832	L	73.3	Confident	68.4	Low	3 Å²	3	66 Å²	66	2%	0.016	36%	0.355	C	S	.	.	H	α-helix	trans	-62.3	-37.7	179.9	-64.2	170.2	0	0	0	112.1	A559 L828 K834 A835 M877 T879 L883	A559-L832 HydrophobicContact CB-CD2 3.67Å; L828-L832 HydrophobicContact CD1-CD1 3.95Å; L828-L832 HydrophobicContact CD1-CG 4.15Å; L828-L832 HydrophobicContact CG-CD1 3.97Å; L828-L832 WeakPolarHBondContact O-CG 3.43Å; L828-L832 PolarHBondContact O-N 3.44Å; L832-K834 PolarHBondContact O-N 3.47Å; L832-A835 WeakPolarHBondContact O-CB 3.38Å; L832-A835 PolarHBondContact O-N 3.41Å; L832-M877 HydrophobicContact CD2-SD 4.32Å; L832-T879 HydrophobicContact CD1-CG2 4.25Å; L832-L883 HydrophobicContact CD1-CD2 3.58Å
833	S	69.2	Low	67.7	Low	72 Å²	72	69.4 Å²	69.4	50%	0.503	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-7.9	173.4	68.3	0	0	0	0	114.9	A829 F831	A829-S833 WeakPolarHBondContact O-CB 3.14Å; A829-S833 PolarHBondContact O-N 3.37Å; A829-S833 PolarHBondContact O-OG 2.8Å; F831-S833 VanDerWaalsContact C-N 3.34Å; F831-S833 PolarHBondContact O-N 3.45Å
834	K	68.1	Low	67	Low	149 Å²	149	69.6 Å²	69.6	65%	0.648	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-2.2	172.3	-69.5	-176.3	-176.6	-176	0	113.1	R830 F831 L832 R836	R830-K834 VanDerWaalsContact O-CD 3.32Å; R830-K834 WeakPolarHBondContact O-CD 3.42Å; R830-K834 VanDerWaalsContact O-CG 3.29Å; R830-K834 WeakPolarHBondContact O-CG 3.38Å; F831-K834 CarbonylContact O-C 3.59Å; F831-K834 WeakPolarHBondContact O-CA 3.45Å; F831-K834 PolarHBondContact O-N 2.94Å; L832-K834 PolarHBondContact O-N 3.47Å; K834-R836 PolarHBondContact O-N 2.97Å; K834-R836 VanDerWaalsContact O-N 3.14Å
835	A	64	Low	66.8	Low	21 Å²	21	66.3 Å²	66.3	17%	0.174	34%	0.336	C	S	.	.			trans	-60.3	118.3	178.1	0	0	0	0	0	109.6	F831 L832	F831-A835 PolarHBondContact O-N 2.9Å; F831-A835 VanDerWaalsContact O-N 3.07Å; L832-A835 WeakPolarHBondContact O-CB 3.38Å; L832-A835 PolarHBondContact O-N 3.41Å
836	R	63.6	Low	66.8	Low	128 Å²	128	66.4 Å²	66.4	48%	0.483	34%	0.338	S	S	.	.			trans	-118.1	151	173.1	-67.1	-172.9	177.6	-140	-1.4	108.4	K834 K838 H839	K834-R836 PolarHBondContact O-N 2.97Å; K834-R836 VanDerWaalsContact O-N 3.14Å; R836-K838 PolarHBondContact O-N 3.19Å; R836-H839 PolarHBondContact O-N 3Å
837	P	59.7	Low	66.5	Low	11 Å²	11	63.7 Å²	63.7	7%	0.071	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-48.1	-36.4	174.9	-21.9	22.9	0	0	0	113.6	H839 L840 W849 I857 M875	P837-H839 PolarHBondContact O-N 3.34Å; P837-H839 VanDerWaalsContact O-N 3.12Å; P837-L840 PolarHBondContact O-N 3.45Å; P837-W849 HydrophobicContact CG-CB 4.05Å; P837-W849 HydrophobicContact CG-CD2 4.33Å; P837-W849 HydrophobicContact CG-CG 3.76Å; P837-I857 HydrophobicContact CG-CD1 3.89Å; P837-M875 HydrophobicContact CG-SD 4.26Å
838	K	55.8	Low	65.6	Low	176 Å²	176	63.1 Å²	63.1	77%	0.765	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-63.8	-11.5	179	-68.5	178.4	177.8	169.9	0	115	R836	R836-K838 PolarHBondContact O-N 3.19Å
839	H	55.9	Low	65	Low	134 Å²	134	63.6 Å²	63.6	62%	0.62	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-92.5	-16.3	179.2	-69.9	-60.5	0	0	0	114.6	R836 P837	R836-H839 PolarHBondContact O-N 3Å; P837-H839 PolarHBondContact O-N 3.34Å; P837-H839 VanDerWaalsContact O-N 3.12Å
840	L	56.2	Low	64.9	Low	38 Å²	38	62.2 Å²	62.2	20%	0.199	31%	0.312	C	S	.	.	S	Bend	trans	-129.1	98	173.7	-79.1	106.3	0	0	0	108.4	L522 P837 Q842 L845	L522-L840 HydrophobicContact CD2-CD2 4.05Å; P837-L840 PolarHBondContact O-N 3.45Å; L840-Q842 PolarHBondContact O-N 2.76Å; L840-L845 HydrophobicContact CB-CD2 3.39Å; L840-L845 HydrophobicContact CD1-CD2 4.36Å; L840-L845 HydrophobicContact CG-CD2 4.3Å
841	P	56.5	Low	64.4	Low	114 Å²	114	59.7 Å²	59.7	74%	0.74	31%	0.306	S	S	*	.			trans	-79.4	34.4	-160.7	33.4	-38.9	0	0	0	114.9
842	Q	61.3	Low	63.8	Low	25 Å²	25	59.3 Å²	59.3	12%	0.117	31%	0.306	C	S	.	.			trans	-92.2	133.2	179.5	-60.7	-60.4	-10.2	0	0	111.9	L522 L840 W844 L845 V846	L522-Q842 HydrophobicContact CD1-CG 3.82Å; L840-Q842 PolarHBondContact O-N 2.76Å; Q842-W844 VanDerWaalsContact C-N 3.28Å; Q842-W844 HydrophobicContact CB-CG 4.47Å; Q842-W844 PolarHBondContact O-N 2.76Å; Q842-L845 PolarHBondContact O-N 2.91Å; Q842-V846 PolarHBondContact O-N 2.75Å
843	P	59.4	Low	63.6	Low	91 Å²	91	62 Å²	62	59%	0.591	32%	0.321	S	S	*	.	H	α-helix	trans	-57.1	-37.1	180	-26.9	34.8	0	0	0	114	L845 V846 A847	P843-L845 VanDerWaalsContact C-N 3.27Å; P843-L845 PolarHBondContact O-N 2.94Å; P843-V846 PolarHBondContact O-N 2.83Å; P843-A847 PolarHBondContact O-N 3.26Å; P843-A847 VanDerWaalsContact O-N 3.08Å
844	W	60.2	Low	63.8	Low	37 Å²	37	63.3 Å²	63.3	14%	0.14	32%	0.322	C	S	.	.	H	α-helix	trans	-65.8	-30.1	179.6	74	-103.5	0	0	0	112.7	L522 L536 L555 Q842 A847 F848	L522-W844 HydrophobicContact CD2-CZ2 4.31Å; L536-W844 HydrophobicContact CB-CH2 4.24Å; L536-W844 HydrophobicContact CB-CZ3 4.43Å; L536-W844 HydrophobicContact CD1-CH2 3.82Å; L536-W844 HydrophobicContact CD1-CZ2 4.04Å; L555-W844 HydrophobicContact CD1-CH2 4.26Å; Q842-W844 VanDerWaalsContact C-N 3.28Å; Q842-W844 HydrophobicContact CB-CG 4.47Å; Q842-W844 PolarHBondContact O-N 2.76Å; W844-A847 PolarHBondContact O-N 2.99Å; W844-F848 HydrophobicContact CE3-CB 4.49Å; W844-F848 WeakPolarHBondContact O-CB 3.32Å; W844-F848 PolarHBondContact O-N 2.76Å
845	L	64.4	Low	64.4	Low	6 Å²	6	56.8 Å²	56.8	3%	0.031	30%	0.295	C	S	.	.	H	α-helix	trans	-76.5	-34.2	178.3	-172.7	70.2	0	0	0	111	L555 L840 Q842 P843 F848 W849	L555-L845 HydrophobicContact CD1-CD1 3.98Å; L555-L845 HydrophobicContact CD2-CD1 3.98Å; L840-L845 HydrophobicContact CB-CD2 3.39Å; L840-L845 HydrophobicContact CD1-CD2 4.36Å; L840-L845 HydrophobicContact CG-CD2 4.3Å; Q842-L845 PolarHBondContact O-N 2.91Å; P843-L845 VanDerWaalsContact C-N 3.27Å; P843-L845 PolarHBondContact O-N 2.94Å; L845-F848 HydrophobicContact CD1-CB 4.49Å; L845-F848 HydrophobicContact CD1-CD1 4.15Å; L845-F848 PolarHBondContact O-N 3.09Å; L845-W849 PolarHBondContact O-N 2.81Å
846	V	68.8	Low	65.1	Low	37 Å²	37	55.9 Å²	55.9	22%	0.224	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-50.7	169.6	-177.1	0	0	0	0	109.3	Q842 P843 F848 W849 E850 I857	Q842-V846 PolarHBondContact O-N 2.75Å; P843-V846 PolarHBondContact O-N 2.83Å; V846-F848 VanDerWaalsContact C-N 3.32Å; V846-F848 PolarHBondContact O-N 3.08Å; V846-W849 PolarHBondContact O-N 3.4Å; V846-W849 VanDerWaalsContact O-N 3.13Å; V846-E850 HydrophobicContact CG1-CG 4.37Å; V846-E850 VanDerWaalsContact O-CG 3.31Å; V846-E850 WeakPolarHBondContact O-CG 3.18Å; V846-E850 PolarHBondContact O-N 3.29Å; V846-I857 HydrophobicContact CG1-CB 4.06Å; V846-I857 HydrophobicContact CG1-CG2 4.11Å
847	A	65.1	Low	65.8	Low	40 Å²	40	53 Å²	53	33%	0.331	28%	0.281	S	S	.	.	H	α-helix	trans	-59.8	-37.9	176.8	0	0	0	0	0	113.4	P843 W844 E850 E851	P843-A847 PolarHBondContact O-N 3.26Å; P843-A847 VanDerWaalsContact O-N 3.08Å; W844-A847 PolarHBondContact O-N 2.99Å; A847-E850 PolarHBondContact O-N 3.11Å; A847-E851 WeakPolarHBondContact O-CB 3.15Å; A847-E851 PolarHBondContact O-N 2.92Å
848	F	63.7	Low	66.4	Low	4 Å²	4	54.3 Å²	54.3	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-59.6	-47.4	173	170.9	-87.8	0	0	0	111.8	P548 L555 W844 L845 V846 E851 L852	P548-F848 HydrophobicContact CB-CD2 4.11Å; L555-F848 HydrophobicContact CD2-CD1 3.94Å; L555-F848 HydrophobicContact CD2-CE1 3.4Å; L555-F848 HydrophobicContact CD2-CZ 3.78Å; W844-F848 HydrophobicContact CE3-CB 4.49Å; W844-F848 WeakPolarHBondContact O-CB 3.32Å; W844-F848 PolarHBondContact O-N 2.76Å; L845-F848 HydrophobicContact CD1-CB 4.49Å; L845-F848 HydrophobicContact CD1-CD1 4.15Å; L845-F848 PolarHBondContact O-N 3.09Å; V846-F848 VanDerWaalsContact C-N 3.32Å; V846-F848 PolarHBondContact O-N 3.08Å; F848-E851 PolarHBondContact O-N 3.42Å; F848-L852 HydrophobicContact CE1-CD2 3.83Å; F848-L852 HydrophobicContact CZ-CD2 4.15Å; F848-L852 WeakPolarHBondContact O-CB 3.41Å; F848-L852 PolarHBondContact O-N 2.78Å
849	W	68.8	Low	67.3	Low	11 Å²	11	51.1 Å²	51.1	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-66	-37.3	176.6	-79.8	107.3	0	0	0	112.3	P837 L845 V846 L852 L853 I857 M875 M877	P837-W849 HydrophobicContact CG-CB 4.05Å; P837-W849 HydrophobicContact CG-CD2 4.33Å; P837-W849 HydrophobicContact CG-CG 3.76Å; L845-W849 PolarHBondContact O-N 2.81Å; V846-W849 PolarHBondContact O-N 3.4Å; V846-W849 VanDerWaalsContact O-N 3.13Å; W849-L852 HydrophobicContact CE3-CD2 4.1Å; W849-L852 HydrophobicContact CZ3-CD2 4.17Å; W849-L853 HydrophobicContact CE3-CD1 4.07Å; W849-L853 HydrophobicContact CE3-CG 4.31Å; W849-L853 VanDerWaalsContact O-CB 3.23Å; W849-L853 WeakPolarHBondContact O-CB 3.44Å; W849-L853 WeakPolarHBondContact O-CD1 3.37Å; W849-L853 WeakPolarHBondContact O-CG 3.45Å; W849-L853 PolarHBondContact O-N 3.01Å; W849-I857 HydrophobicContact CB-CD1 3.71Å; W849-M875 HydrophobicContact CE3-CB 4.44Å; W849-M875 HydrophobicContact CH2-CB 4.2Å; W849-M875 WeakPolarHBondContact CH2-O 3.24Å; W849-M875 HydrophobicContact CZ3-CB 3.85Å; W849-M875 HydrophobicContact CZ3-CG 4.38Å; W849-M877 HydrophobicContact CH2-CB 4.5Å
850	E	72.6	Confident	68.1	Low	5 Å²	5	52.1 Å²	52.1	2%	0.023	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-42.4	176.7	-69.6	177.1	150.9	0	0	112.5	V846 A847 N854 C855 I857 S858 S861 F865	V846-E850 HydrophobicContact CG1-CG 4.37Å; V846-E850 VanDerWaalsContact O-CG 3.31Å; V846-E850 WeakPolarHBondContact O-CG 3.18Å; V846-E850 PolarHBondContact O-N 3.29Å; A847-E850 PolarHBondContact O-N 3.11Å; E850-N854 VanDerWaalsContact O-CA 3.25Å; E850-N854 WeakPolarHBondContact O-CA 3.29Å; E850-N854 PolarHBondContact O-N 3.41Å; E850-C855 WeakPolarHBondContact CA-O 3.4Å; E850-C855 VanDerWaalsContact CB-O 3.24Å; E850-C855 WeakPolarHBondContact CB-O 3.49Å; E850-C855 WeakPolarHBondContact CG-O 3.24Å; E850-C855 PolarHBondContact O-N 3.28Å; E850-C855 VanDerWaalsContact O-N 3.07Å; E850-I857 HydrophobicContact CG-CB 3.82Å; E850-I857 HydrophobicContact CG-CD1 3.87Å; E850-I857 HydrophobicContact CG-CG1 3.73Å; E850-I857 WeakPolarHBondContact OE1-CA 3.39Å; E850-I857 PolarHBondContact OE1-N 3.31Å; E850-S858 PolarHBondContact OE1-N 3.05Å; E850-S858 PolarHBondContact OE1-OG 3.06Å; E850-S861 VanDerWaalsContact CD-CB 3.44Å; E850-S861 WeakPolarHBondContact OE1-CB 3.35Å; E850-S861 PolarHBondContact OE1-OG 2.97Å; E850-S861 VanDerWaalsContact OE1-OG 3.07Å; E850-S861 VanDerWaalsContact OE2-CB 3.27Å; E850-S861 WeakPolarHBondContact OE2-CB 3.48Å; E850-S861 PolarHBondContact OE2-OG 3.49Å; E850-F865 HydrophobicContact CB-CD2 4.36Å; E850-F865 HydrophobicContact CB-CE2 3.64Å; E850-F865 HydrophobicContact CB-CZ 3.95Å
851	E	68.3	Low	68.9	Low	93 Å²	93	51.2 Å²	51.2	44%	0.435	29%	0.289	S	S	.	.	H	α-helix	trans	-73.7	-36.6	178.5	-165.2	157.3	-168.8	0	0	111.9	P548 A847 F848 F865	P548-E851 HydrophobicContact CB-CB 4.49Å; P548-E851 HydrophobicContact CB-CG 4.5Å; P548-E851 WeakPolarHBondContact CD-OE2 3.45Å; P548-E851 VanDerWaalsContact CG-OE2 3.23Å; P548-E851 WeakPolarHBondContact CG-OE2 3.24Å; A847-E851 WeakPolarHBondContact O-CB 3.15Å; A847-E851 PolarHBondContact O-N 2.92Å; F848-E851 PolarHBondContact O-N 3.42Å; E851-F865 HydrophobicContact CB-CZ 4.4Å
852	L	64.5	Low	70	Confident	50 Å²	50	48 Å²	48	26%	0.262	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-38.5	173.9	178.1	63.6	0	0	0	113.1	F791 F848 W849	F791-L852 HydrophobicContact CE2-CD1 4.25Å; F848-L852 HydrophobicContact CE1-CD2 3.83Å; F848-L852 HydrophobicContact CZ-CD2 4.15Å; F848-L852 WeakPolarHBondContact O-CB 3.41Å; F848-L852 PolarHBondContact O-N 2.78Å; W849-L852 HydrophobicContact CE3-CD2 4.1Å; W849-L852 HydrophobicContact CZ3-CD2 4.17Å
853	L	70.5	Confident	70.7	Confident	60 Å²	60	55.7 Å²	55.7	31%	0.314	30%	0.302	S	S	.	.	H	α-helix	trans	-91.6	-9.3	-179.8	-60.4	169.5	0	0	0	113.1	W849 C855 M875	W849-L853 HydrophobicContact CE3-CD1 4.07Å; W849-L853 HydrophobicContact CE3-CG 4.31Å; W849-L853 VanDerWaalsContact O-CB 3.23Å; W849-L853 WeakPolarHBondContact O-CB 3.44Å; W849-L853 WeakPolarHBondContact O-CD1 3.37Å; W849-L853 WeakPolarHBondContact O-CG 3.45Å; W849-L853 PolarHBondContact O-N 3.01Å; L853-C855 VanDerWaalsContact C-N 3.3Å; L853-C855 WeakPolarHBondContact CB-SG 3.48Å; L853-C855 PolarHBondContact O-N 2.87Å; L853-M875 HydrophobicContact CD1-CG 3.87Å; L853-M875 HydrophobicContact CD1-SD 3.87Å; L853-M875 HydrophobicContact CD2-CG 4.47Å
854	N	72.4	Confident	71.3	Confident	100 Å²	100	60 Å²	60	54%	0.535	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	44.3	-173.5	-159.4	10.6	0	0	0	112.8	E850 F865	E850-N854 VanDerWaalsContact O-CA 3.25Å; E850-N854 WeakPolarHBondContact O-CA 3.29Å; E850-N854 PolarHBondContact O-N 3.41Å; N854-F865 WeakPolarHBondContact OD1-CD1 3.42Å
855	C	80.7	Confident	72.1	Confident	12 Å²	12	59.7 Å²	59.7	8%	0.081	31%	0.307	C	S	.	.	S	Bend	trans	-153.7	155.3	-179.3	59.2	0	0	0	0	112	E850 L853 K867 C869	E850-C855 WeakPolarHBondContact CA-O 3.4Å; E850-C855 VanDerWaalsContact CB-O 3.24Å; E850-C855 WeakPolarHBondContact CB-O 3.49Å; E850-C855 WeakPolarHBondContact CG-O 3.24Å; E850-C855 PolarHBondContact O-N 3.28Å; E850-C855 VanDerWaalsContact O-N 3.07Å; L853-C855 VanDerWaalsContact C-N 3.3Å; L853-C855 WeakPolarHBondContact CB-SG 3.48Å; L853-C855 PolarHBondContact O-N 2.87Å; C855-K867 CarbonylContact C-O 3.59Å; C855-K867 WeakPolarHBondContact CA-O 3.3Å; C855-K867 WeakPolarHBondContact CB-O 3.36Å; C855-C869 HydrophobicContact CB-CB 4.08Å; C855-C869 WeakPolarHBondContact CB-SG 3.41Å; C855-C869 PolarHBondContact O-SG 3.36Å; C855-C869 WeakPolarHBondContact SG-CA 3.41Å; C855-C869 WeakPolarHBondContact SG-CB 3.46Å; C855-C869 CovalentContact SG-SG 2.04Å; C855-C869 PolarHBondContact SG-SG 3.28Å
856	A	79.8	Confident	72.7	Confident	2 Å²	2	66.5 Å²	66.5	2%	0.017	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-84	136.7	-179.4	0	0	0	0	0	113	V862 F865 K867 R868 C869	A856-V862 HydrophobicContact CB-CB 4.37Å; A856-V862 HydrophobicContact CB-CG2 3.86Å; A856-F865 HydrophobicContact CB-CB 4.46Å; A856-F865 HydrophobicContact CB-CD2 4.34Å; A856-K867 PolarHBondContact N-O 3.14Å; A856-R868 CarbonylContact O-C 3.58Å; A856-R868 WeakPolarHBondContact O-CA 3.32Å; A856-C869 PolarHBondContact O-N 2.91Å
857	I	76.8	Confident	73.4	Confident	67 Å²	67	71 Å²	71	34%	0.344	36%	0.36	S	S	.	.	S	Bend	trans	-111.3	-38.3	174.7	-61.3	171.8	0	0	0	109.7	P837 V846 W849 E850 C869	P837-I857 HydrophobicContact CG-CD1 3.89Å; V846-I857 HydrophobicContact CG1-CB 4.06Å; V846-I857 HydrophobicContact CG1-CG2 4.11Å; W849-I857 HydrophobicContact CB-CD1 3.71Å; E850-I857 HydrophobicContact CG-CB 3.82Å; E850-I857 HydrophobicContact CG-CD1 3.87Å; E850-I857 HydrophobicContact CG-CG1 3.73Å; E850-I857 WeakPolarHBondContact OE1-CA 3.39Å; E850-I857 PolarHBondContact OE1-N 3.31Å; I857-C869 HydrophobicContact CG1-CB 4.15Å; I857-C869 VanDerWaalsContact CG1-SG 3.52Å
858	S	73.6	Confident	74.1	Confident	38 Å²	38	76.7 Å²	76.7	27%	0.266	37%	0.373	S	S	.	.	S	Bend	trans	-89.8	155.5	169.9	85.2	0	0	0	0	111.6	E850 S861	E850-S858 PolarHBondContact OE1-N 3.05Å; E850-S858 PolarHBondContact OE1-OG 3.06Å; S858-S861 PolarHBondContact O-N 3.41Å; S858-S861 WeakPolarHBondContact OG-CB 3.3Å; S858-S861 PolarHBondContact OG-N 2.7Å; S858-S861 PolarHBondContact OG-OG 3.25Å
859	D	73.9	Confident	74.6	Confident	110 Å²	110	77.8 Å²	77.8	59%	0.588	38%	0.38	S	S	*	.	S	Bend	trans	-68.1	-35.9	175.9	-75.6	-43.7	0	0	0	112.4	S861 V862 R868	D859-S861 PolarHBondContact O-N 2.94Å; D859-V862 WeakPolarHBondContact O-CB 3.29Å; D859-V862 WeakPolarHBondContact O-CG2 3.49Å; D859-V862 PolarHBondContact O-N 3.15Å; D859-V862 VanDerWaalsContact O-N 3.17Å; D859-R868 IonicContact OD1-CZ 3.17Å; D859-R868 IonicContact OD1-NE 2.8Å; D859-R868 IonicContact OD1-NH2 2.7Å; D859-R868 PolarHBondContact OD1-NH2 3Å
860	D	72.2	Confident	74.8	Confident	155 Å²	155	83.7 Å²	83.7	83%	0.829	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.8	175.5	-60.3	-22.8	0	0	0	112.2
861	S	74.2	Confident	74.2	Confident	19 Å²	19	90.3 Å²	90.3	13%	0.133	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.9	-179.3	-63.8	0	0	0	0	114.4	E850 S858 D859 E863 R864 F865	E850-S861 VanDerWaalsContact CD-CB 3.44Å; E850-S861 WeakPolarHBondContact OE1-CB 3.35Å; E850-S861 PolarHBondContact OE1-OG 2.97Å; E850-S861 VanDerWaalsContact OE1-OG 3.07Å; E850-S861 VanDerWaalsContact OE2-CB 3.27Å; E850-S861 WeakPolarHBondContact OE2-CB 3.48Å; E850-S861 PolarHBondContact OE2-OG 3.49Å; S858-S861 PolarHBondContact O-N 3.41Å; S858-S861 WeakPolarHBondContact OG-CB 3.3Å; S858-S861 PolarHBondContact OG-N 2.7Å; S858-S861 PolarHBondContact OG-OG 3.25Å; D859-S861 PolarHBondContact O-N 2.94Å; S861-E863 VanDerWaalsContact C-N 3.35Å; S861-E863 PolarHBondContact O-N 3.41Å; S861-R864 WeakPolarHBondContact O-CB 3.47Å; S861-R864 PolarHBondContact O-N 3.19Å; S861-F865 PolarHBondContact O-N 3.31Å
862	V	78.6	Confident	73.5	Confident	47 Å²	47	93.2 Å²	93.2	29%	0.285	46%	0.458	S	S	.	.	H	α-helix	trans	-63.9	-38.2	-174	176.9	0	0	0	0	112.1	A856 D859 R864 N866 R868	A856-V862 HydrophobicContact CB-CB 4.37Å; A856-V862 HydrophobicContact CB-CG2 3.86Å; D859-V862 WeakPolarHBondContact O-CB 3.29Å; D859-V862 WeakPolarHBondContact O-CG2 3.49Å; D859-V862 PolarHBondContact O-N 3.15Å; D859-V862 VanDerWaalsContact O-N 3.17Å; V862-R864 PolarHBondContact O-N 3.24Å; V862-N866 PolarHBondContact O-N 3.22Å; V862-R868 HydrophobicContact CG2-CG 4.03Å
863	E	75.8	Confident	73.1	Confident	185 Å²	185	92.8 Å²	92.8	86%	0.864	46%	0.459	S	S	*	.	H	α-helix	trans	-62.2	-23.8	175.6	-63.4	-166.4	158.9	0	0	113.2	S861	S861-E863 VanDerWaalsContact C-N 3.35Å; S861-E863 PolarHBondContact O-N 3.41Å
864	R	73.5	Confident	72.2	Confident	181 Å²	181	95.7 Å²	95.7	68%	0.683	48%	0.481	S	S	*	.	H	α-helix	trans	-85.4	-41	-175	-164.8	-177.9	-160.7	140.3	-1	113	S861 V862	S861-R864 WeakPolarHBondContact O-CB 3.47Å; S861-R864 PolarHBondContact O-N 3.19Å; V862-R864 PolarHBondContact O-N 3.24Å
865	F	76.5	Confident	71.3	Confident	32 Å²	32	92.5 Å²	92.5	14%	0.14	46%	0.464	C	S	.	.	H	α-helix	trans	-105.5	-10.5	-172.4	-64	-76.7	0	0	0	113.9	E850 E851 N854 A856 S861 K867	E850-F865 HydrophobicContact CB-CD2 4.36Å; E850-F865 HydrophobicContact CB-CE2 3.64Å; E850-F865 HydrophobicContact CB-CZ 3.95Å; E851-F865 HydrophobicContact CB-CZ 4.4Å; N854-F865 WeakPolarHBondContact OD1-CD1 3.42Å; A856-F865 HydrophobicContact CB-CB 4.46Å; A856-F865 HydrophobicContact CB-CD2 4.34Å; S861-F865 PolarHBondContact O-N 3.31Å; F865-K867 PolarHBondContact O-N 3.37Å
866	N	77.1	Confident	70	Confident	149 Å²	149	94.5 Å²	94.5	80%	0.797	48%	0.481	S	S	*	.	S	Bend	trans	57.8	-8.6	-177.2	-64.2	-63.3	0	0	0	116.5	V862	V862-N866 PolarHBondContact O-N 3.22Å
867	K	82.5	Confident	68.8	Low	130 Å²	130	95.2 Å²	95.2	57%	0.565	48%	0.484	S	S	*	.	S	Bend	trans	-132.9	131.2	180	-174.3	-171.3	173.9	-170.5	0	109.3	C855 A856 F865	C855-K867 CarbonylContact C-O 3.59Å; C855-K867 WeakPolarHBondContact CA-O 3.3Å; C855-K867 WeakPolarHBondContact CB-O 3.36Å; A856-K867 PolarHBondContact N-O 3.14Å; F865-K867 PolarHBondContact O-N 3.37Å
868	R	80.2	Confident	67.6	Low	161 Å²	161	98.3 Å²	98.3	61%	0.608	50%	0.497	S	S	*	.	B	Isolated β-bridge	trans	-76.8	148.2	167.5	-78.8	-176.1	175.6	162.8	-2.5	111.1	A856 D859 V862	A856-R868 CarbonylContact O-C 3.58Å; A856-R868 WeakPolarHBondContact O-CA 3.32Å; D859-R868 IonicContact OD1-CZ 3.17Å; D859-R868 IonicContact OD1-NE 2.8Å; D859-R868 IonicContact OD1-NH2 2.7Å; D859-R868 PolarHBondContact OD1-NH2 3Å; V862-R868 HydrophobicContact CG2-CG 4.03Å
869	C	73.9	Confident	66.7	Low	26 Å²	26	97.8 Å²	97.8	18%	0.176	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-67.1	145.9	172.8	-58.4	0	0	0	0	111.4	C855 A856 I857	C855-C869 HydrophobicContact CB-CB 4.08Å; C855-C869 WeakPolarHBondContact CB-SG 3.41Å; C855-C869 PolarHBondContact O-SG 3.36Å; C855-C869 WeakPolarHBondContact SG-CA 3.41Å; C855-C869 WeakPolarHBondContact SG-CB 3.46Å; C855-C869 CovalentContact SG-SG 2.04Å; C855-C869 PolarHBondContact SG-SG 3.28Å; A856-C869 PolarHBondContact O-N 2.91Å; I857-C869 HydrophobicContact CG1-CB 4.15Å; I857-C869 VanDerWaalsContact CG1-SG 3.52Å
870	E	72.8	Confident	65.8	Low	135 Å²	135	93.3 Å²	93.3	63%	0.631	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-90.3	118.4	-175.4	-166.3	159.8	-146.1	0	0	109.3	D872 S873	E870-D872 PolarHBondContact O-N 3.38Å; E870-D872 VanDerWaalsContact O-N 3.09Å; E870-S873 WeakPolarHBondContact O-CB 3.41Å; E870-S873 PolarHBondContact O-N 3.4Å; E870-S873 PolarHBondContact O-OG 2.93Å
871	E	60.3	Low	64.8	Low	145 Å²	145	88.9 Å²	88.9	68%	0.678	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.5	-162.3	-67.8	-157.2	112.9	0	0	115.4
872	D	54.5	Low	64.2	Low	153 Å²	153	89.4 Å²	89.4	82%	0.818	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-1.8	177.7	-73.4	-42.1	0	0	0	113.8	E870	E870-D872 PolarHBondContact O-N 3.38Å; E870-D872 VanDerWaalsContact O-N 3.09Å
873	S	55.5	Low	64	Low	41 Å²	41	87.5 Å²	87.5	29%	0.287	44%	0.44	S	S	.	.	S	Bend	trans	-63.3	127.8	174.3	62.5	0	0	0	0	110.2	E870 M875	E870-S873 WeakPolarHBondContact O-CB 3.41Å; E870-S873 PolarHBondContact O-N 3.4Å; E870-S873 PolarHBondContact O-OG 2.93Å; S873-M875 PolarHBondContact O-N 2.94Å
874	P	51.7	Low	64.1	Low	121 Å²	121	79.4 Å²	79.4	79%	0.786	40%	0.403	S	S	*	.			trans	-72.4	96.2	-178.6	28	-33.3	0	0	0	109.6	A876	P874-A876 PolarHBondContact O-N 3.44Å
875	M	53.9	Low	64.5	Low	33 Å²	33	74 Å²	74	16%	0.163	38%	0.383	C	S	.	.			trans	-67.1	50	168.6	-69.1	177.7	-86.2	0	0	111.5	P837 W849 L853 S873 M877	P837-M875 HydrophobicContact CG-SD 4.26Å; W849-M875 HydrophobicContact CE3-CB 4.44Å; W849-M875 HydrophobicContact CH2-CB 4.2Å; W849-M875 WeakPolarHBondContact CH2-O 3.24Å; W849-M875 HydrophobicContact CZ3-CB 3.85Å; W849-M875 HydrophobicContact CZ3-CG 4.38Å; L853-M875 HydrophobicContact CD1-CG 3.87Å; L853-M875 HydrophobicContact CD1-SD 3.87Å; L853-M875 HydrophobicContact CD2-CG 4.47Å; S873-M875 PolarHBondContact O-N 2.94Å; M875-M877 PolarHBondContact O-N 3.03Å; M875-M877 VanDerWaalsContact O-N 3.15Å
876	A	52.9	Low	64.9	Low	54 Å²	54	72.6 Å²	72.6	45%	0.446	38%	0.377	S	S	.	.			trans	-70.6	108.9	177.4	0	0	0	0	0	108.6	P874 Q878	P874-A876 PolarHBondContact O-N 3.44Å; A876-Q878 PolarHBondContact O-N 3.32Å
877	M	54.8	Low	65.3	Low	17 Å²	17	67.7 Å²	67.7	8%	0.084	35%	0.347	C	S	.	.			trans	-55.2	113.1	171.7	-172.2	173.2	-166.1	0	0	109.3	N552 L555 S556 L832 W849 M875 T879	N552-M877 HydrophobicContact CB-CE 4.02Å; N552-M877 VanDerWaalsContact O-CE 3.28Å; N552-M877 WeakPolarHBondContact O-CE 3.15Å; L555-M877 HydrophobicContact CB-CE 3.63Å; L555-M877 HydrophobicContact CD2-CE 3.88Å; L555-M877 HydrophobicContact CG-CE 3.7Å; S556-M877 VanDerWaalsContact N-CE 3.25Å; L832-M877 HydrophobicContact CD2-SD 4.32Å; W849-M877 HydrophobicContact CH2-CB 4.5Å; M875-M877 PolarHBondContact O-N 3.03Å; M875-M877 VanDerWaalsContact O-N 3.15Å; M877-T879 HydrophobicContact CG-CG2 4.07Å; M877-T879 PolarHBondContact O-N 3.04Å; M877-T879 HydrophobicContact SD-CG2 4.46Å
878	Q	52.2	Low	65.5	Low	133 Å²	133	61.6 Å²	61.6	62%	0.621	32%	0.32	S	S	*	.			trans	-75.1	95.4	179.3	-67.6	-173.6	15.7	0	0	108.9	N552 A876	N552-Q878 PolarHBondContact ND2-O 3.02Å; A876-Q878 PolarHBondContact O-N 3.32Å
879	T	53.4	Low	65.9	Low	26 Å²	26	53.9 Å²	53.9	16%	0.16	29%	0.291	C	S	.	.			trans	-95.3	163.8	174.6	60.4	0	0	0	0	111	R787 L832 M877 L883	R787-T879 PolarHBondContact NH1-O 3.16Å; L832-T879 HydrophobicContact CD1-CG2 4.25Å; M877-T879 HydrophobicContact CG-CG2 4.07Å; M877-T879 PolarHBondContact O-N 3.04Å; M877-T879 HydrophobicContact SD-CG2 4.46Å; T879-L883 HydrophobicContact CG2-CD2 3.82Å; T879-L883 WeakPolarHBondContact OG1-CD2 3.33Å
880	S	54.2	Low	66.7	Low	16 Å²	16	53 Å²	53	11%	0.112	28%	0.284	C	S	.	.			trans	-48.1	148.2	170.6	66.4	0	0	0	0	111.9	E882 L883	S880-E882 PolarHBondContact O-N 3.19Å; S880-L883 PolarHBondContact O-N 2.79Å; S880-L883 VanDerWaalsContact OG-CA 3.3Å; S880-L883 WeakPolarHBondContact OG-CA 3.25Å; S880-L883 PolarHBondContact OG-N 3.12Å; S880-L883 VanDerWaalsContact OG-N 3.13Å
881	S	51.5	Low	67.4	Low	62 Å²	62	47.8 Å²	47.8	43%	0.434	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-30	-173.8	-53.8	0	0	0	0	113.6	R787	R787-S881 PolarHBondContact NE-OG 2.69Å; R787-S881 VanDerWaalsContact NE-OG 3.17Å; R787-S881 VanDerWaalsContact NH2-CA 3.35Å; R787-S881 PolarHBondContact NH2-OG 3.41Å
882	E	63.3	Low	68.8	Low	30 Å²	30	41 Å²	41	14%	0.14	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	2.8	-171.3	-66.7	179.7	-149.8	0	0	113.6	S880 V884 R887 Y942	S880-E882 PolarHBondContact O-N 3.19Å; E882-V884 HydrophobicContact CB-CG2 3.71Å; E882-V884 PolarHBondContact O-N 2.69Å; E882-R887 VanDerWaalsContact O-CD 3.22Å; E882-R887 WeakPolarHBondContact O-CD 3.39Å; E882-R887 PolarHBondContact O-NE 3.35Å; E882-R887 PolarHBondContact O-NH1 2.93Å; E882-Y942 VanDerWaalsContact CD-CZ 3.44Å; E882-Y942 WeakPolarHBondContact OE1-CE1 3.33Å; E882-Y942 WeakPolarHBondContact OE1-CE2 3.42Å; E882-Y942 PolarHBondContact OE1-OH 2.72Å; E882-Y942 WeakPolarHBondContact OE2-CE2 3.32Å; E882-Y942 PolarHBondContact OE2-OH 3.13Å
883	L	73.5	Confident	70.6	Confident	8 Å²	8	33.9 Å²	33.9	4%	0.042	20%	0.195	C	C	.	.			trans	49	41.9	-179.3	-74.5	158.3	0	0	0	112.1	A829 L832 T879 S880 E886 R887	A829-L883 HydrophobicContact CB-CD1 3.57Å; L832-L883 HydrophobicContact CD1-CD2 3.58Å; T879-L883 HydrophobicContact CG2-CD2 3.82Å; T879-L883 WeakPolarHBondContact OG1-CD2 3.33Å; S880-L883 PolarHBondContact O-N 2.79Å; S880-L883 VanDerWaalsContact OG-CA 3.3Å; S880-L883 WeakPolarHBondContact OG-CA 3.25Å; S880-L883 PolarHBondContact OG-N 3.12Å; S880-L883 VanDerWaalsContact OG-N 3.13Å; L883-E886 VanDerWaalsContact CA-OE2 3.31Å; L883-E886 WeakPolarHBondContact CA-OE2 3.21Å; L883-E886 HydrophobicContact CB-CB 4.42Å; L883-E886 HydrophobicContact CD2-CB 4.16Å; L883-E886 HydrophobicContact CD2-CG 4.07Å; L883-E886 WeakPolarHBondContact CD2-OE1 3.07Å; L883-E886 PolarHBondContact O-N 2.97Å; L883-R887 HydrophobicContact CB-CG 4.14Å; L883-R887 VanDerWaalsContact O-CB 3.22Å; L883-R887 WeakPolarHBondContact O-CB 3.19Å; L883-R887 WeakPolarHBondContact O-CD 3.4Å; L883-R887 WeakPolarHBondContact O-CG 3.45Å; L883-R887 PolarHBondContact O-N 2.92Å
884	V	78.2	Confident	72.3	Confident	14 Å²	14	32.3 Å²	32.3	9%	0.085	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-61.6	-165	-177.9	0	0	0	0	110.2	P820 A822 E882 E886 R887 F888	P820-V884 HydrophobicContact CB-CG1 4.3Å; A822-V884 HydrophobicContact CB-CG1 4.31Å; E882-V884 HydrophobicContact CB-CG2 3.71Å; E882-V884 PolarHBondContact O-N 2.69Å; V884-E886 VanDerWaalsContact C-N 3.29Å; V884-E886 PolarHBondContact O-N 3.44Å; V884-R887 PolarHBondContact O-N 3.39Å; V884-F888 HydrophobicContact CG1-CD2 3.99Å; V884-F888 HydrophobicContact CG1-CE2 3.96Å; V884-F888 VanDerWaalsContact O-CD2 3.26Å; V884-F888 WeakPolarHBondContact O-CD2 3.47Å; V884-F888 PolarHBondContact O-N 3.18Å
885	Y	81.5	Confident	74.1	Confident	67 Å²	67	27.6 Å²	27.6	26%	0.263	16%	0.157	S	C	.	.	H	α-helix	trans	-59.9	-40.2	-178.8	-60.4	-77.6	0	0	0	111.8	V655 L670 F888 L889	V655-Y885 HydrophobicContact CG1-CD1 3.67Å; V655-Y885 HydrophobicContact CG1-CG 4.19Å; L670-Y885 HydrophobicContact CD1-CD1 4.03Å; L670-Y885 HydrophobicContact CD1-CE1 3.78Å; L670-Y885 HydrophobicContact CD2-CD1 4.04Å; L670-Y885 HydrophobicContact CD2-CE1 4.26Å; Y885-F888 PolarHBondContact O-N 3.02Å; Y885-L889 WeakPolarHBondContact O-CB 3.35Å; Y885-L889 PolarHBondContact O-N 2.91Å
886	E	84.9	Confident	76	Confident	4 Å²	4	26.2 Å²	26.2	2%	0.019	15%	0.15	C	C	.	.	H	α-helix	trans	-66.7	-40.1	178.9	-56.9	95.6	141.1	0	0	112.3	S556 L557 T560 L828 L883 V884 L889 M890	S556-E886 WeakPolarHBondContact CB-OE1 3.26Å; S556-E886 PolarHBondContact OG-OE1 3.13Å; L557-E886 HydrophobicContact CD2-CG 4.04Å; L557-E886 HydrophobicContact CG-CG 4.49Å; T560-E886 WeakPolarHBondContact CG2-O 3.43Å; L828-E886 HydrophobicContact CD2-CB 3.94Å; L883-E886 VanDerWaalsContact CA-OE2 3.31Å; L883-E886 WeakPolarHBondContact CA-OE2 3.21Å; L883-E886 HydrophobicContact CB-CB 4.42Å; L883-E886 HydrophobicContact CD2-CB 4.16Å; L883-E886 HydrophobicContact CD2-CG 4.07Å; L883-E886 WeakPolarHBondContact CD2-OE1 3.07Å; L883-E886 PolarHBondContact O-N 2.97Å; V884-E886 VanDerWaalsContact C-N 3.29Å; V884-E886 PolarHBondContact O-N 3.44Å; E886-L889 PolarHBondContact O-N 3.36Å; E886-M890 VanDerWaalsContact O-CB 3.26Å; E886-M890 WeakPolarHBondContact O-CB 3.31Å; E886-M890 PolarHBondContact O-N 3.2Å
887	R	86.2	Confident	77.9	Confident	46 Å²	46	23.7 Å²	23.7	17%	0.174	13%	0.129	C	C	.	.	H	α-helix	trans	-69.2	-38.9	176.5	-75.8	167.5	177.6	179.4	-1.8	112.4	A822 P823 E882 L883 V884 A891	A822-R887 HydrophobicContact CB-CB 3.97Å; P823-R887 HydrophobicContact CG-CB 4.3Å; P823-R887 WeakPolarHBondContact O-CD 3.19Å; E882-R887 VanDerWaalsContact O-CD 3.22Å; E882-R887 WeakPolarHBondContact O-CD 3.39Å; E882-R887 PolarHBondContact O-NE 3.35Å; E882-R887 PolarHBondContact O-NH1 2.93Å; L883-R887 HydrophobicContact CB-CG 4.14Å; L883-R887 VanDerWaalsContact O-CB 3.22Å; L883-R887 WeakPolarHBondContact O-CB 3.19Å; L883-R887 WeakPolarHBondContact O-CD 3.4Å; L883-R887 WeakPolarHBondContact O-CG 3.45Å; L883-R887 PolarHBondContact O-N 2.92Å; V884-R887 PolarHBondContact O-N 3.39Å; R887-A891 WeakPolarHBondContact O-CB 3.44Å; R887-A891 PolarHBondContact O-N 3.12Å; R887-A891 VanDerWaalsContact O-N 3.09Å
888	F	86.8	Confident	79.7	Confident	1 Å²	1	25.2 Å²	25.2	0%	0.004	14%	0.137	C	C	.	.	H	α-helix	trans	-63.9	-43.2	171.3	-82.8	-78.3	0	0	0	111	I669 L670 P820 A822 V884 Y885 A891 A892 S935	I669-F888 HydrophobicContact CB-CB 4.47Å; I669-F888 HydrophobicContact CD1-CB 3.85Å; I669-F888 HydrophobicContact CG1-CB 4.08Å; I669-F888 WeakPolarHBondContact O-CD1 3.34Å; L670-F888 HydrophobicContact CD2-CD2 4.17Å; L670-F888 HydrophobicContact CD2-CG 4.34Å; P820-F888 HydrophobicContact CB-CE2 3.59Å; P820-F888 HydrophobicContact CB-CZ 3.83Å; A822-F888 HydrophobicContact CB-CD2 4.11Å; A822-F888 HydrophobicContact CB-CE2 3.77Å; V884-F888 HydrophobicContact CG1-CD2 3.99Å; V884-F888 HydrophobicContact CG1-CE2 3.96Å; V884-F888 VanDerWaalsContact O-CD2 3.26Å; V884-F888 WeakPolarHBondContact O-CD2 3.47Å; V884-F888 PolarHBondContact O-N 3.18Å; Y885-F888 PolarHBondContact O-N 3.02Å; F888-A891 PolarHBondContact O-N 3.17Å; F888-A892 WeakPolarHBondContact O-CB 3.43Å; F888-A892 PolarHBondContact O-N 2.97Å; F888-S935 WeakPolarHBondContact CD1-OG 3.37Å; F888-S935 WeakPolarHBondContact CE1-OG 3.41Å
889	L	88.7	Confident	81.6	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.8	-44.4	179.2	178	59.8	0	0	0	111.2	L557 T560 V561 V627 I653 V655 I669 Y885 E886 A891 A892 L893	L557-L889 HydrophobicContact CB-CD2 4.11Å; L557-L889 HydrophobicContact CD2-CB 4.37Å; L557-L889 HydrophobicContact CD2-CD2 3.78Å; T560-L889 HydrophobicContact CG2-CD2 4.49Å; T560-L889 HydrophobicContact CG2-CG 4.43Å; V561-L889 HydrophobicContact CG2-CD2 4.41Å; V627-L889 HydrophobicContact CG1-CD1 3.71Å; I653-L889 HydrophobicContact CG2-CD1 4.49Å; V655-L889 HydrophobicContact CG2-CB 4.5Å; V655-L889 HydrophobicContact CG2-CD1 4.27Å; V655-L889 HydrophobicContact CG2-CD2 4.39Å; I669-L889 HydrophobicContact CD1-CB 3.92Å; I669-L889 HydrophobicContact CD1-CD1 4.48Å; Y885-L889 WeakPolarHBondContact O-CB 3.35Å; Y885-L889 PolarHBondContact O-N 2.91Å; E886-L889 PolarHBondContact O-N 3.36Å; L889-A891 VanDerWaalsContact C-N 3.34Å; L889-A891 PolarHBondContact O-N 2.93Å; L889-A892 PolarHBondContact O-N 3.33Å; L889-L893 HydrophobicContact CD1-CD1 3.86Å; L889-L893 HydrophobicContact CD1-CG 3.94Å; L889-L893 HydrophobicContact CG-CD1 3.89Å; L889-L893 HydrophobicContact CG-CG 4.36Å; L889-L893 WeakPolarHBondContact O-CB 3.45Å; L889-L893 VanDerWaalsContact O-CG 3.28Å; L889-L893 WeakPolarHBondContact O-CG 3.33Å; L889-L893 PolarHBondContact O-N 3.16Å
890	M	89.6	Confident	83.4	Confident	6 Å²	6	18.8 Å²	18.8	3%	0.03	11%	0.106	C	C	.	.	H	α-helix	trans	-55.1	-48.1	174.5	-179.4	-159.5	70.7	0	0	111.5	T560 Y563 V564 N825 L828 E886 L893 E894	T560-M890 HydrophobicContact CG2-CB 3.85Å; Y563-M890 HydrophobicContact CE1-CG 4.42Å; Y563-M890 HydrophobicContact CE1-SD 4.12Å; V564-M890 HydrophobicContact CG2-CB 4.18Å; V564-M890 HydrophobicContact CG2-CG 3.77Å; N825-M890 HydrophobicContact CB-CE 3.89Å; N825-M890 HydrophobicContact CB-SD 4.12Å; N825-M890 PolarHBondContact ND2-SD 2.95Å; L828-M890 HydrophobicContact CB-SD 4.28Å; L828-M890 HydrophobicContact CD2-CB 4.27Å; L828-M890 HydrophobicContact CD2-SD 4.17Å; E886-M890 VanDerWaalsContact O-CB 3.26Å; E886-M890 WeakPolarHBondContact O-CB 3.31Å; E886-M890 PolarHBondContact O-N 3.2Å; M890-L893 PolarHBondContact O-N 3.35Å; M890-E894 WeakPolarHBondContact O-CG 3.45Å; M890-E894 PolarHBondContact O-N 3.22Å
891	A	88.5	Confident	85.2	Confident	26 Å²	26	18.2 Å²	18.2	22%	0.215	10%	0.101	C	C	.	.	H	α-helix	trans	-65	-42.3	179.5	0	0	0	0	0	112.6	P823 R887 F888 L889 G895	P823-A891 HydrophobicContact CG-CB 4.05Å; R887-A891 WeakPolarHBondContact O-CB 3.44Å; R887-A891 PolarHBondContact O-N 3.12Å; R887-A891 VanDerWaalsContact O-N 3.09Å; F888-A891 PolarHBondContact O-N 3.17Å; L889-A891 VanDerWaalsContact C-N 3.34Å; L889-A891 PolarHBondContact O-N 2.93Å; A891-G895 PolarHBondContact O-N 3.37Å
892	A	89.4	Confident	87.1	Confident	3 Å²	3	19 Å²	19	3%	0.025	10%	0.098	C	C	.	.	H	α-helix	trans	-64.4	-39.3	177.2	0	0	0	0	0	112.4	I653 I669 F888 L889 G895 W896	I653-A892 HydrophobicContact CG2-CB 4.03Å; I669-A892 HydrophobicContact CB-CB 4.33Å; I669-A892 HydrophobicContact CG2-CB 3.54Å; F888-A892 WeakPolarHBondContact O-CB 3.43Å; F888-A892 PolarHBondContact O-N 2.97Å; L889-A892 PolarHBondContact O-N 3.33Å; A892-G895 PolarHBondContact O-N 3.47Å; A892-W896 WeakPolarHBondContact O-CB 3.46Å; A892-W896 PolarHBondContact O-N 3.1Å
893	L	91.8	Very high	88.5	Confident	3 Å²	3	17.7 Å²	17.7	2%	0.016	9%	0.092	C	C	.	.	H	α-helix	trans	-72.1	-40.2	177.8	-69	176.1	0	0	0	112.8	L530 V561 V564 V627 I653 L889 M890 G895 W896 V897	L530-L893 HydrophobicContact CD2-CD2 3.82Å; V561-L893 HydrophobicContact CB-CD1 4.34Å; V561-L893 HydrophobicContact CG1-CD1 4.39Å; V561-L893 HydrophobicContact CG2-CD1 4.04Å; V564-L893 HydrophobicContact CB-CB 4.24Å; V564-L893 HydrophobicContact CG1-CB 3.81Å; V564-L893 HydrophobicContact CG2-CB 4.18Å; V564-L893 HydrophobicContact CG2-CD1 4.45Å; V627-L893 HydrophobicContact CG2-CD2 3.86Å; I653-L893 HydrophobicContact CD1-CD2 4.11Å; L889-L893 HydrophobicContact CD1-CD1 3.86Å; L889-L893 HydrophobicContact CD1-CG 3.94Å; L889-L893 HydrophobicContact CG-CD1 3.89Å; L889-L893 HydrophobicContact CG-CG 4.36Å; L889-L893 WeakPolarHBondContact O-CB 3.45Å; L889-L893 VanDerWaalsContact O-CG 3.28Å; L889-L893 WeakPolarHBondContact O-CG 3.33Å; L889-L893 PolarHBondContact O-N 3.16Å; M890-L893 PolarHBondContact O-N 3.35Å; L893-G895 VanDerWaalsContact C-N 3.32Å; L893-G895 PolarHBondContact O-N 3.34Å; L893-W896 PolarHBondContact O-N 3.13Å; L893-V897 WeakPolarHBondContact O-CG2 3.48Å; L893-V897 PolarHBondContact O-N 3.28Å
894	E	91.2	Very high	89.3	Confident	9 Å²	9	17.3 Å²	17.3	4%	0.042	9%	0.09	C	C	.	.	H	α-helix	trans	-60.5	-43.7	171.9	-74	-179.2	-174.7	0	0	111.2	V564 V568 K571 Y572 M890 V897 I898	V564-E894 HydrophobicContact CG1-CG 3.9Å; V564-E894 HydrophobicContact CG2-CG 4.46Å; V568-E894 HydrophobicContact CG2-CG 4.22Å; K571-E894 WeakPolarHBondContact CD-OE1 3.2Å; K571-E894 IonicContact NZ-OE1 2.78Å; K571-E894 PolarHBondContact NZ-OE1 3.33Å; K571-E894 IonicContact NZ-OE2 3.92Å; K571-E894 PolarHBondContact NZ-OE2 3.12Å; Y572-E894 HydrophobicContact CE2-CB 4.28Å; Y572-E894 HydrophobicContact CE2-CG 4.26Å; Y572-E894 WeakPolarHBondContact CE2-OE2 3.45Å; Y572-E894 PolarHBondContact OH-OE2 3.02Å; M890-E894 WeakPolarHBondContact O-CG 3.45Å; M890-E894 PolarHBondContact O-N 3.22Å; E894-V897 PolarHBondContact O-N 3.39Å; E894-I898 WeakPolarHBondContact O-CG1 3.41Å; E894-I898 PolarHBondContact O-N 3.45Å
895	G	90.6	Very high	89.9	Confident	22 Å²	22	20 Å²	20	23%	0.227	10%	0.101	C	C	.	.	H	α-helix	trans	-60.8	-43.3	173.1	0	0	0	0	0	113	A891 A892 L893 V897 I898 L899	A891-G895 PolarHBondContact O-N 3.37Å; A892-G895 PolarHBondContact O-N 3.47Å; L893-G895 VanDerWaalsContact C-N 3.32Å; L893-G895 PolarHBondContact O-N 3.34Å; G895-V897 PolarHBondContact O-N 2.91Å; G895-I898 PolarHBondContact O-N 3.35Å; G895-L899 WeakPolarHBondContact O-CG 3.31Å; G895-L899 PolarHBondContact O-N 3.23Å
896	W	92.6	Very high	90.3	Very high	3 Å²	3	22.1 Å²	22.1	1%	0.011	11%	0.112	C	C	.	.	H	α-helix	trans	-60.5	-41.9	178.1	165.6	70.6	0	0	0	112.2	L530 L565 L583 L624 A625 I653 A892 L893 I898 L899 T900 Y922 L933	L530-W896 HydrophobicContact CB-CH2 4.08Å; L530-W896 HydrophobicContact CB-CZ3 4.35Å; L530-W896 HydrophobicContact CD1-CD2 4.48Å; L530-W896 HydrophobicContact CD1-CE3 4.28Å; L530-W896 HydrophobicContact CD1-CH2 4.01Å; L530-W896 HydrophobicContact CD1-CZ2 4.21Å; L530-W896 HydrophobicContact CD1-CZ3 4.04Å; L530-W896 HydrophobicContact CD2-CE3 4.45Å; L530-W896 HydrophobicContact CD2-CZ3 4Å; L530-W896 HydrophobicContact CG-CH2 4.45Å; L530-W896 HydrophobicContact CG-CZ3 4.38Å; L565-W896 HydrophobicContact CD2-CZ3 4.48Å; L583-W896 HydrophobicContact CD2-CH2 4.2Å; L624-W896 HydrophobicContact CB-CZ2 4.14Å; A625-W896 HydrophobicContact CB-CZ2 4.04Å; I653-W896 HydrophobicContact CD1-CB 3.92Å; I653-W896 HydrophobicContact CD1-CG 4.07Å; A892-W896 WeakPolarHBondContact O-CB 3.46Å; A892-W896 PolarHBondContact O-N 3.1Å; L893-W896 PolarHBondContact O-N 3.13Å; W896-I898 VanDerWaalsContact C-N 3.35Å; W896-I898 PolarHBondContact O-N 3.09Å; W896-L899 PolarHBondContact O-N 3.39Å; W896-T900 PolarHBondContact NE1-OG1 3.06Å; W896-T900 VanDerWaalsContact O-CB 3.28Å; W896-T900 WeakPolarHBondContact O-CB 3.41Å; W896-T900 PolarHBondContact O-N 3.39Å; W896-T900 PolarHBondContact O-OG1 3.05Å; W896-Y922 PolarHBondContact NE1-OH 3.03Å; W896-L933 HydrophobicContact CB-CD1 4.16Å
897	V	93.1	Very high	90.5	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-64.4	-40.1	176.1	176.3	0	0	0	0	111.3	V568 L577 L578 L583 L893 E894 G895 T900 D901	V568-V897 HydrophobicContact CG1-CG1 4.16Å; V568-V897 HydrophobicContact CG1-CG2 4.29Å; V568-V897 HydrophobicContact CG2-CB 4.16Å; V568-V897 HydrophobicContact CG2-CG1 4.16Å; L577-V897 HydrophobicContact CB-CG1 4.48Å; L577-V897 HydrophobicContact CD1-CG1 4.1Å; L578-V897 HydrophobicContact CD1-CG1 4.48Å; L583-V897 HydrophobicContact CD1-CB 4.45Å; L583-V897 HydrophobicContact CD1-CG1 3.91Å; L583-V897 HydrophobicContact CD1-CG2 3.63Å; L893-V897 WeakPolarHBondContact O-CG2 3.48Å; L893-V897 PolarHBondContact O-N 3.28Å; E894-V897 PolarHBondContact O-N 3.39Å; G895-V897 PolarHBondContact O-N 2.91Å; V897-T900 PolarHBondContact O-N 3.06Å; V897-D901 WeakPolarHBondContact O-CB 3.26Å; V897-D901 PolarHBondContact O-N 3.22Å
898	I	92.5	Very high	90.5	Very high	50 Å²	50	21 Å²	21	26%	0.256	11%	0.11	S	C	.	.	H	α-helix	trans	-66.3	-44.3	177.9	-66.6	165	0	0	0	111.2	Y572 L575 L577 E894 G895 W896 T900 D901 E902	Y572-I898 HydrophobicContact CD2-CD1 4.44Å; Y572-I898 HydrophobicContact CE2-CD1 4.36Å; L575-I898 HydrophobicContact CD1-CG1 4.4Å; L577-I898 HydrophobicContact CD1-CG1 4.28Å; L577-I898 HydrophobicContact CD2-CG1 4.22Å; E894-I898 WeakPolarHBondContact O-CG1 3.41Å; E894-I898 PolarHBondContact O-N 3.45Å; G895-I898 PolarHBondContact O-N 3.35Å; W896-I898 VanDerWaalsContact C-N 3.35Å; W896-I898 PolarHBondContact O-N 3.09Å; I898-T900 VanDerWaalsContact C-N 3.34Å; I898-T900 PolarHBondContact O-N 3Å; I898-D901 PolarHBondContact O-N 3.17Å; I898-E902 PolarHBondContact O-N 2.76Å
899	L	91.8	Very high	90.3	Very high	22 Å²	22	28.9 Å²	28.9	12%	0.115	15%	0.146	C	C	.	.	H	α-helix	trans	-64.7	-37.2	174.4	-67.5	-176.2	0	0	0	112.1	G895 W896 E902 I903 M926 W929 L932 L933	G895-L899 WeakPolarHBondContact O-CG 3.31Å; G895-L899 PolarHBondContact O-N 3.23Å; W896-L899 PolarHBondContact O-N 3.39Å; L899-E902 PolarHBondContact O-N 3.43Å; L899-I903 WeakPolarHBondContact O-CG1 3.45Å; L899-I903 PolarHBondContact O-N 3.4Å; L899-M926 HydrophobicContact CB-CE 3.85Å; L899-M926 HydrophobicContact CB-SD 4.12Å; L899-M926 HydrophobicContact CD1-SD 4.23Å; L899-W929 HydrophobicContact CD1-CB 4.22Å; L899-W929 HydrophobicContact CD2-CE3 4.18Å; L899-L932 HydrophobicContact CD1-CB 4.28Å; L899-L932 HydrophobicContact CD2-CD1 4.12Å; L899-L933 HydrophobicContact CD1-CD1 4.5Å; L899-L933 HydrophobicContact CD1-CD2 3.55Å; L899-L933 HydrophobicContact CD1-CG 3.83Å; L899-L933 HydrophobicContact CG-CD2 4.22Å
900	T	92.3	Very high	89.7	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-64.6	-40.9	177	-60.8	0	0	0	0	111.4	L578 L624 W896 V897 I898 I903 Y904 F918 Y922 M926	L578-T900 HydrophobicContact CD1-CG2 4.17Å; L578-T900 HydrophobicContact CD2-CG2 4.34Å; L624-T900 HydrophobicContact CD1-CG2 4.23Å; W896-T900 PolarHBondContact NE1-OG1 3.06Å; W896-T900 VanDerWaalsContact O-CB 3.28Å; W896-T900 WeakPolarHBondContact O-CB 3.41Å; W896-T900 PolarHBondContact O-N 3.39Å; W896-T900 PolarHBondContact O-OG1 3.05Å; V897-T900 PolarHBondContact O-N 3.06Å; I898-T900 VanDerWaalsContact C-N 3.34Å; I898-T900 PolarHBondContact O-N 3Å; T900-I903 PolarHBondContact O-N 3.48Å; T900-Y904 WeakPolarHBondContact O-CB 3.42Å; T900-Y904 PolarHBondContact O-N 3.08Å; T900-F918 HydrophobicContact CG2-CZ 3.99Å; T900-Y922 HydrophobicContact CG2-CD2 4.48Å; T900-Y922 HydrophobicContact CG2-CE2 3.91Å; T900-M926 WeakPolarHBondContact OG1-CE 3.41Å
901	D	92.4	Very high	89.3	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-65.6	-40.7	174.7	-178.5	61.5	0	0	0	112.6	L577 L578 V897 I898 I903 Y904 K905	L577-D901 HydrophobicContact CD2-CB 3.87Å; L577-D901 WeakPolarHBondContact CD2-OD2 3.2Å; L578-D901 HydrophobicContact CD2-CB 4.15Å; L578-D901 HydrophobicContact CG-CB 4.12Å; L578-D901 PolarHBondContact N-OD1 2.03Å; V897-D901 WeakPolarHBondContact O-CB 3.26Å; V897-D901 PolarHBondContact O-N 3.22Å; I898-D901 PolarHBondContact O-N 3.17Å; D901-I903 PolarHBondContact O-N 3.49Å; D901-Y904 PolarHBondContact O-N 3.1Å; D901-K905 WeakPolarHBondContact O-CB 2.95Å; D901-K905 WeakPolarHBondContact O-CG 3.45Å; D901-K905 PolarHBondContact O-N 2.85Å; D901-K905 WeakPolarHBondContact OD1-CE 3.49Å; D901-K905 IonicContact OD1-NZ 2.59Å; D901-K905 PolarHBondContact OD1-NZ 3.09Å; D901-K905 VanDerWaalsContact OD2-CE 3.22Å; D901-K905 WeakPolarHBondContact OD2-CE 3.25Å; D901-K905 IonicContact OD2-NZ 2.7Å; D901-K905 PolarHBondContact OD2-NZ 2.86Å
902	E	91.4	Very high	88.8	Confident	79 Å²	79	45.7 Å²	45.7	37%	0.369	21%	0.214	S	C	.	.	H	α-helix	trans	-62.1	-39.7	172.7	-85.8	-71.3	122.1	0	0	112.6	I898 L899 K906 W929	I898-E902 PolarHBondContact O-N 2.76Å; L899-E902 PolarHBondContact O-N 3.43Å; E902-K906 WeakPolarHBondContact O-CB 3.4Å; E902-K906 VanDerWaalsContact O-CD 3.32Å; E902-K906 WeakPolarHBondContact O-CD 2.9Å; E902-K906 VanDerWaalsContact O-CG 3.27Å; E902-K906 WeakPolarHBondContact O-CG 3.38Å; E902-K906 PolarHBondContact O-N 3.41Å; E902-K906 VanDerWaalsContact OE2-CE 3.28Å; E902-K906 WeakPolarHBondContact OE2-CE 3.43Å; E902-K906 IonicContact OE2-NZ 2.67Å; E902-K906 PolarHBondContact OE2-NZ 2.79Å; E902-W929 HydrophobicContact CB-CZ3 3.97Å
903	I	91.4	Very high	88.3	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.015	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-46.4	173.1	-64.9	167.1	0	0	0	110.4	L899 T900 D901 K905 K906 V907 F918 Y922 A925 M926 W929	L899-I903 WeakPolarHBondContact O-CG1 3.45Å; L899-I903 PolarHBondContact O-N 3.4Å; T900-I903 PolarHBondContact O-N 3.48Å; D901-I903 PolarHBondContact O-N 3.49Å; I903-K905 PolarHBondContact O-N 2.9Å; I903-K906 PolarHBondContact O-N 3.41Å; I903-V907 HydrophobicContact CG2-CG2 4.36Å; I903-V907 WeakPolarHBondContact O-CG2 3.24Å; I903-V907 PolarHBondContact O-N 3.25Å; I903-V907 VanDerWaalsContact O-N 3.09Å; I903-F918 HydrophobicContact CB-CE2 4.38Å; I903-F918 HydrophobicContact CG2-CD2 4.06Å; I903-F918 HydrophobicContact CG2-CE2 3.94Å; I903-Y922 HydrophobicContact CB-CD2 4.45Å; I903-Y922 HydrophobicContact CD1-CD2 3.88Å; I903-Y922 HydrophobicContact CD1-CE2 4.2Å; I903-Y922 HydrophobicContact CG2-CD2 4.1Å; I903-A925 HydrophobicContact CD1-CB 3.8Å; I903-A925 HydrophobicContact CG1-CB 3.98Å; I903-A925 HydrophobicContact CG2-CB 4.28Å; I903-M926 HydrophobicContact CD1-CB 3.95Å; I903-M926 HydrophobicContact CD1-CE 3.96Å; I903-W929 HydrophobicContact CD1-CE3 4.19Å; I903-W929 HydrophobicContact CD1-CZ3 4.3Å; I903-W929 HydrophobicContact CG1-CE3 3.85Å; I903-W929 HydrophobicContact CG1-CH2 4.1Å; I903-W929 HydrophobicContact CG1-CZ3 3.46Å; I903-W929 VanDerWaalsContact CG1-CZ3 3.46Å
904	Y	91.5	Very high	87.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.1	-49.7	179.6	174.7	-118.8	0	0	0	111.7	L578 P579 V581 T900 D901 K906 V907 C908 L911 G913 L914 F918	L578-Y904 HydrophobicContact CD2-CD1 3.64Å; L578-Y904 HydrophobicContact CD2-CE1 4.41Å; L578-Y904 HydrophobicContact CD2-CG 3.77Å; P579-Y904 HydrophobicContact CG-CE1 4.05Å; P579-Y904 PolarHBondContact O-OH 2.72Å; P579-Y904 VanDerWaalsContact O-OH 3.06Å; V581-Y904 HydrophobicContact CG2-CE2 4.29Å; T900-Y904 WeakPolarHBondContact O-CB 3.42Å; T900-Y904 PolarHBondContact O-N 3.08Å; D901-Y904 PolarHBondContact O-N 3.1Å; Y904-K906 VanDerWaalsContact C-N 3.29Å; Y904-K906 PolarHBondContact O-N 3.27Å; Y904-V907 PolarHBondContact O-N 2.69Å; Y904-C908 HydrophobicContact CD2-CB 3.93Å; Y904-C908 HydrophobicContact CE2-CB 3.76Å; Y904-C908 PolarHBondContact O-N 3.08Å; Y904-L911 HydrophobicContact CD1-CD2 4.01Å; Y904-L911 HydrophobicContact CE1-CD2 3.66Å; Y904-L911 PolarHBondContact OH-O 2.73Å; Y904-G913 WeakPolarHBondContact CE2-O 3.48Å; Y904-G913 PolarHBondContact OH-N 2.87Å; Y904-G913 PolarHBondContact OH-O 3.19Å; Y904-L914 HydrophobicContact CD2-CD2 4.41Å; Y904-L914 HydrophobicContact CE2-CD2 4.36Å; Y904-F918 HydrophobicContact CD2-CD2 4.34Å
905	K	90.3	Very high	87.2	Confident	69 Å²	69	50.1 Å²	50.1	30%	0.3	25%	0.245	S	C	.	.	H	α-helix	trans	-64.5	-28.6	178.5	-73.1	168.9	174.6	168.1	0	113.5	L575 N576 D901 I903 L911	L575-K905 PolarHBondContact O-NZ 2.67Å; N576-K905 PolarHBondContact O-NZ 2.78Å; D901-K905 WeakPolarHBondContact O-CB 2.95Å; D901-K905 WeakPolarHBondContact O-CG 3.45Å; D901-K905 PolarHBondContact O-N 2.85Å; D901-K905 WeakPolarHBondContact OD1-CE 3.49Å; D901-K905 IonicContact OD1-NZ 2.59Å; D901-K905 PolarHBondContact OD1-NZ 3.09Å; D901-K905 VanDerWaalsContact OD2-CE 3.22Å; D901-K905 WeakPolarHBondContact OD2-CE 3.25Å; D901-K905 IonicContact OD2-NZ 2.7Å; D901-K905 PolarHBondContact OD2-NZ 2.86Å; I903-K905 PolarHBondContact O-N 2.9Å; K905-L911 HydrophobicContact CG-CD2 4.1Å
906	K	89.7	Confident	86.3	Confident	113 Å²	113	52.2 Å²	52.2	49%	0.491	25%	0.251	S	S	.	.	H	α-helix	trans	-82.7	-16.3	176.1	-75.7	166.4	179.6	152.4	0	114.4	E902 I903 Y904 W929	E902-K906 WeakPolarHBondContact O-CB 3.4Å; E902-K906 VanDerWaalsContact O-CD 3.32Å; E902-K906 WeakPolarHBondContact O-CD 2.9Å; E902-K906 VanDerWaalsContact O-CG 3.27Å; E902-K906 WeakPolarHBondContact O-CG 3.38Å; E902-K906 PolarHBondContact O-N 3.41Å; E902-K906 VanDerWaalsContact OE2-CE 3.28Å; E902-K906 WeakPolarHBondContact OE2-CE 3.43Å; E902-K906 IonicContact OE2-NZ 2.67Å; E902-K906 PolarHBondContact OE2-NZ 2.79Å; I903-K906 PolarHBondContact O-N 3.41Å; Y904-K906 VanDerWaalsContact C-N 3.29Å; Y904-K906 PolarHBondContact O-N 3.27Å; K906-W929 HydrophobicContact CD-CH2 3.98Å
907	V	88.2	Confident	85.8	Confident	20 Å²	20	56.4 Å²	56.4	12%	0.121	27%	0.271	C	S	.	.	H	α-helix	trans	-114.4	-43.2	-175.1	-180	0	0	0	0	113	I903 Y904 H909 E917 F918 R921	I903-V907 HydrophobicContact CG2-CG2 4.36Å; I903-V907 WeakPolarHBondContact O-CG2 3.24Å; I903-V907 PolarHBondContact O-N 3.25Å; I903-V907 VanDerWaalsContact O-N 3.09Å; Y904-V907 PolarHBondContact O-N 2.69Å; V907-H909 PolarHBondContact O-N 2.89Å; V907-E917 VanDerWaalsContact CG1-C 3.48Å; V907-E917 HydrophobicContact CG1-CB 3.51Å; V907-F918 HydrophobicContact CG1-CB 4.36Å; V907-R921 HydrophobicContact CG2-CB 4.43Å
908	C	86.7	Confident	85.4	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.034	27%	0.271	C	S	.	.			trans	-98.8	81.1	-178.9	-59.2	0	0	0	0	111.8	Y904 E910 L911 C915	Y904-C908 HydrophobicContact CD2-CB 3.93Å; Y904-C908 HydrophobicContact CE2-CB 3.76Å; Y904-C908 PolarHBondContact O-N 3.08Å; C908-E910 PolarHBondContact O-N 2.83Å; C908-L911 WeakPolarHBondContact O-CD2 3.31Å; C908-L911 PolarHBondContact O-N 2.81Å; C908-L911 VanDerWaalsContact O-N 3.12Å; C908-C915 WeakPolarHBondContact CA-SG 3.34Å; C908-C915 HydrophobicContact CB-CB 4Å; C908-C915 WeakPolarHBondContact CB-SG 3.2Å; C908-C915 WeakPolarHBondContact SG-CB 3.35Å; C908-C915 PolarHBondContact SG-N 3.04Å; C908-C915 CovalentContact SG-SG 2.05Å; C908-C915 PolarHBondContact SG-SG 2.89Å
909	H	82.6	Confident	84.8	Confident	167 Å²	167	56 Å²	56	77%	0.773	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-27.2	-176.2	-63.8	-48.9	0	0	0	115.6	V907	V907-H909 PolarHBondContact O-N 2.89Å
910	E	76.4	Confident	84.2	Confident	135 Å²	135	61.2 Å²	61.2	63%	0.631	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-19.5	180	-66.3	-157.1	169.9	0	0	114.9	C908 R912	C908-E910 PolarHBondContact O-N 2.83Å; E910-R912 HydrophobicContact CB-CG 4.36Å; E910-R912 PolarHBondContact O-N 2.78Å; E910-R912 IonicContact OE1-NH1 2.63Å; E910-R912 WeakPolarHBondContact OE2-CD 3.5Å; E910-R912 IonicContact OE2-CZ 2.67Å; E910-R912 IonicContact OE2-NE 3.4Å; E910-R912 IonicContact OE2-NH1 2.66Å; E910-R912 PolarHBondContact OE2-NH1 2.89Å
911	L	81.3	Confident	83.8	Confident	60 Å²	60	67.7 Å²	67.7	31%	0.314	32%	0.315	S	S	.	.			trans	52	15.2	-178.9	-58.3	174.5	0	0	0	116.5	P579 N580 Y904 K905 C908 G913	P579-L911 HydrophobicContact CG-CB 4.35Å; P579-L911 HydrophobicContact CG-CD2 4.45Å; N580-L911 PolarHBondContact ND2-O 3.42Å; Y904-L911 HydrophobicContact CD1-CD2 4.01Å; Y904-L911 HydrophobicContact CE1-CD2 3.66Å; Y904-L911 PolarHBondContact OH-O 2.73Å; K905-L911 HydrophobicContact CG-CD2 4.1Å; C908-L911 WeakPolarHBondContact O-CD2 3.31Å; C908-L911 PolarHBondContact O-N 2.81Å; C908-L911 VanDerWaalsContact O-N 3.12Å; L911-G913 VanDerWaalsContact C-N 3.27Å; L911-G913 PolarHBondContact O-N 3.04Å
912	R	77.8	Confident	83.6	Confident	190 Å²	190	67.6 Å²	67.6	72%	0.717	31%	0.314	S	S	*	.	S	Bend	trans	-75.5	-13.5	178.1	-71.9	178	174.7	149.4	-6.7	113.9	E910	E910-R912 HydrophobicContact CB-CG 4.36Å; E910-R912 PolarHBondContact O-N 2.78Å; E910-R912 IonicContact OE1-NH1 2.63Å; E910-R912 WeakPolarHBondContact OE2-CD 3.5Å; E910-R912 IonicContact OE2-CZ 2.67Å; E910-R912 IonicContact OE2-NE 3.4Å; E910-R912 IonicContact OE2-NH1 2.66Å; E910-R912 PolarHBondContact OE2-NH1 2.89Å
913	G	79.4	Confident	83.2	Confident	22 Å²	22	65 Å²	65	23%	0.227	31%	0.305	C	S	.	.	S	Bend	trans	156.5	-175.8	-172.8	0	0	0	0	0	109.9	Y904 L911	Y904-G913 WeakPolarHBondContact CE2-O 3.48Å; Y904-G913 PolarHBondContact OH-N 2.87Å; Y904-G913 PolarHBondContact OH-O 3.19Å; L911-G913 VanDerWaalsContact C-N 3.27Å; L911-G913 PolarHBondContact O-N 3.04Å
914	L	79.5	Confident	82.9	Confident	52 Å²	52	74.9 Å²	74.9	27%	0.272	34%	0.342	S	S	.	.			trans	-67	140.5	179	-62.3	161.9	0	0	0	111.2	V528 V581 Y904 F918 F919	V528-L914 HydrophobicContact CB-CD1 4.47Å; V528-L914 HydrophobicContact CG1-CD1 3.43Å; V528-L914 VanDerWaalsContact CG1-CD1 3.43Å; V528-L914 HydrophobicContact CG1-CD2 4.42Å; V528-L914 HydrophobicContact CG2-CD1 4.39Å; V581-L914 HydrophobicContact CG1-CD1 4.06Å; V581-L914 HydrophobicContact CG1-CD2 4.12Å; V581-L914 HydrophobicContact CG1-CG 4.09Å; V581-L914 HydrophobicContact CG2-CD2 4.09Å; V581-L914 HydrophobicContact CG2-CG 3.86Å; Y904-L914 HydrophobicContact CD2-CD2 4.41Å; Y904-L914 HydrophobicContact CE2-CD2 4.36Å; L914-F918 HydrophobicContact CD2-CD1 3.72Å; L914-F918 HydrophobicContact CD2-CE1 3.73Å; L914-F918 HydrophobicContact CD2-CG 4.45Å; L914-F918 HydrophobicContact CD2-CZ 4.47Å; L914-F919 HydrophobicContact CB-CE2 3.87Å; L914-F919 HydrophobicContact CB-CZ 4.27Å; L914-F919 HydrophobicContact CD1-CE2 4.39Å; L914-F919 HydrophobicContact CD1-CZ 3.94Å
915	C	80.7	Confident	82.8	Confident	35 Å²	35	76.2 Å²	76.2	24%	0.236	35%	0.352	C	S	.	.			trans	-118.2	149.5	179.1	68.4	0	0	0	0	110.7	C908 E917 F918	C908-C915 WeakPolarHBondContact CA-SG 3.34Å; C908-C915 HydrophobicContact CB-CB 4Å; C908-C915 WeakPolarHBondContact CB-SG 3.2Å; C908-C915 WeakPolarHBondContact SG-CB 3.35Å; C908-C915 PolarHBondContact SG-N 3.04Å; C908-C915 CovalentContact SG-SG 2.05Å; C908-C915 PolarHBondContact SG-SG 2.89Å; C915-E917 PolarHBondContact O-N 2.86Å; C915-F918 VanDerWaalsContact O-CB 3.29Å; C915-F918 WeakPolarHBondContact O-CB 3.48Å; C915-F918 PolarHBondContact O-N 3.03Å
916	D	71.9	Confident	82.8	Confident	65 Å²	65	72.9 Å²	72.9	35%	0.348	34%	0.338	S	S	.	.	H	α-helix	trans	-52.1	-34.9	-176.7	-59.6	37.2	0	0	0	113.4	G502 H504 F918 Q920	G502-D916 WeakPolarHBondContact CA-OD2 3.49Å; H504-D916 IonicContact CD2-OD1 3.82Å; H504-D916 IonicContact NE2-OD1 3.71Å; D916-F918 VanDerWaalsContact C-N 3.3Å; D916-F918 PolarHBondContact O-N 3.01Å; D916-Q920 WeakPolarHBondContact O-CG 3.3Å; D916-Q920 PolarHBondContact O-N 2.6Å; D916-Q920 PolarHBondContact O-NE2 2.82Å
917	E	80.8	Confident	82.5	Confident	92 Å²	92	69.7 Å²	69.7	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-65.6	-30.4	177.9	-68.1	-148.8	-135.5	0	0	113.4	V907 C915 Q920 R921	V907-E917 VanDerWaalsContact CG1-C 3.48Å; V907-E917 HydrophobicContact CG1-CB 3.51Å; C915-E917 PolarHBondContact O-N 2.86Å; E917-Q920 PolarHBondContact O-N 3.19Å; E917-R921 WeakPolarHBondContact O-CB 3.49Å; E917-R921 VanDerWaalsContact O-CG 3.32Å; E917-R921 WeakPolarHBondContact O-CG 3.44Å; E917-R921 PolarHBondContact O-N 2.94Å; E917-R921 IonicContact OE2-CZ 3.75Å; E917-R921 IonicContact OE2-NE 3.2Å; E917-R921 PolarHBondContact OE2-NE 2.73Å; E917-R921 IonicContact OE2-NH2 2.68Å; E917-R921 PolarHBondContact OE2-NH2 3.28Å
918	F	85.8	Confident	82.4	Confident	1 Å²	1	71.6 Å²	71.6	0%	0.004	34%	0.344	C	S	.	.	H	α-helix	trans	-63.1	-54.3	177.3	174.8	-100.1	0	0	0	110	L624 T900 I903 Y904 V907 L914 C915 D916 Q920 R921 Y922	L624-F918 HydrophobicContact CD1-CE1 3.97Å; L624-F918 HydrophobicContact CD1-CZ 4.12Å; L624-F918 HydrophobicContact CD2-CE1 3.82Å; L624-F918 HydrophobicContact CD2-CZ 4.46Å; T900-F918 HydrophobicContact CG2-CZ 3.99Å; I903-F918 HydrophobicContact CB-CE2 4.38Å; I903-F918 HydrophobicContact CG2-CD2 4.06Å; I903-F918 HydrophobicContact CG2-CE2 3.94Å; Y904-F918 HydrophobicContact CD2-CD2 4.34Å; V907-F918 HydrophobicContact CG1-CB 4.36Å; L914-F918 HydrophobicContact CD2-CD1 3.72Å; L914-F918 HydrophobicContact CD2-CE1 3.73Å; L914-F918 HydrophobicContact CD2-CG 4.45Å; L914-F918 HydrophobicContact CD2-CZ 4.47Å; C915-F918 VanDerWaalsContact O-CB 3.29Å; C915-F918 WeakPolarHBondContact O-CB 3.48Å; C915-F918 PolarHBondContact O-N 3.03Å; D916-F918 VanDerWaalsContact C-N 3.3Å; D916-F918 PolarHBondContact O-N 3.01Å; F918-Q920 PolarHBondContact O-N 2.81Å; F918-R921 PolarHBondContact O-N 2.77Å; F918-Y922 HydrophobicContact CE1-CD2 4.37Å; F918-Y922 HydrophobicContact CE1-CG 4.4Å; F918-Y922 AromaticContact CE2-CD2 3.8Å; F918-Y922 HydrophobicContact CE2-CD2 3.8Å; F918-Y922 HydrophobicContact CE2-CG 4.31Å; F918-Y922 AromaticContact CZ-CD2 3.62Å; F918-Y922 HydrophobicContact CZ-CD2 3.62Å; F918-Y922 HydrophobicContact CZ-CE2 4.29Å; F918-Y922 HydrophobicContact CZ-CG 4.07Å; F918-Y922 WeakPolarHBondContact O-CA 3.46Å; F918-Y922 WeakPolarHBondContact O-CB 3.42Å; F918-Y922 PolarHBondContact O-N 3.24Å
919	F	80.2	Confident	82.4	Confident	40 Å²	40	74.8 Å²	74.8	18%	0.175	36%	0.356	C	S	.	.	H	α-helix	trans	-57.7	-35.4	177.9	-66.5	-82.4	0	0	0	112.9	H504 V528 D621 L914 P923	H504-F919 AromaticContact CE1-CD2 3.27Å; H504-F919 WeakPolarHBondContact CE1-CD2 3.39Å; H504-F919 AromaticContact CE1-CE2 3.66Å; H504-F919 AromaticContact CE1-CG 3.69Å; H504-F919 AromaticContact NE2-CD2 3.61Å; V528-F919 HydrophobicContact CG1-CE1 4.12Å; V528-F919 HydrophobicContact CG1-CZ 4.2Å; D621-F919 WeakPolarHBondContact O-CD1 3.29Å; L914-F919 HydrophobicContact CB-CE2 3.87Å; L914-F919 HydrophobicContact CB-CZ 4.27Å; L914-F919 HydrophobicContact CD1-CE2 4.39Å; L914-F919 HydrophobicContact CD1-CZ 3.94Å; F919-P923 VanDerWaalsContact O-CD 3.29Å; F919-P923 WeakPolarHBondContact O-CD 3.37Å
920	Q	77.3	Confident	82.4	Confident	133 Å²	133	67.5 Å²	67.5	62%	0.621	32%	0.322	S	S	*	.	H	α-helix	trans	-73.6	-37.5	178.5	-68.4	177.4	50.7	0	0	113.9	D916 E917 F918	D916-Q920 WeakPolarHBondContact O-CG 3.3Å; D916-Q920 PolarHBondContact O-N 2.6Å; D916-Q920 PolarHBondContact O-NE2 2.82Å; E917-Q920 PolarHBondContact O-N 3.19Å; F918-Q920 PolarHBondContact O-N 2.81Å
921	R	83.9	Confident	82.6	Confident	136 Å²	136	67.1 Å²	67.1	51%	0.513	32%	0.32	S	S	.	.	H	α-helix	trans	-93.4	-33.9	-175.5	-64.1	-179.2	-172.6	-147.9	5.5	113.1	V907 E917 F918 R924 A925	V907-R921 HydrophobicContact CG2-CB 4.43Å; E917-R921 WeakPolarHBondContact O-CB 3.49Å; E917-R921 VanDerWaalsContact O-CG 3.32Å; E917-R921 WeakPolarHBondContact O-CG 3.44Å; E917-R921 PolarHBondContact O-N 2.94Å; E917-R921 IonicContact OE2-CZ 3.75Å; E917-R921 IonicContact OE2-NE 3.2Å; E917-R921 PolarHBondContact OE2-NE 2.73Å; E917-R921 IonicContact OE2-NH2 2.68Å; E917-R921 PolarHBondContact OE2-NH2 3.28Å; F918-R921 PolarHBondContact O-N 2.77Å; R921-R924 PolarHBondContact O-N 3.25Å; R921-R924 VanDerWaalsContact O-N 3.15Å; R921-A925 PolarHBondContact O-N 3.03Å
922	Y	88.9	Confident	82.8	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.008	33%	0.331	C	S	.	.	H	α-helix	trans	-54.2	-46.7	-170.4	164.8	-83	0	0	0	113.8	L624 W896 T900 I903 F918 R924 A925 M926	L624-Y922 HydrophobicContact CB-CE1 3.92Å; L624-Y922 HydrophobicContact CD2-CD1 4Å; L624-Y922 HydrophobicContact CD2-CE1 4.04Å; L624-Y922 HydrophobicContact CD2-CG 4.46Å; L624-Y922 WeakPolarHBondContact O-CE1 3.4Å; L624-Y922 PolarHBondContact O-OH 3.27Å; W896-Y922 PolarHBondContact NE1-OH 3.03Å; T900-Y922 HydrophobicContact CG2-CD2 4.48Å; T900-Y922 HydrophobicContact CG2-CE2 3.91Å; I903-Y922 HydrophobicContact CB-CD2 4.45Å; I903-Y922 HydrophobicContact CD1-CD2 3.88Å; I903-Y922 HydrophobicContact CD1-CE2 4.2Å; I903-Y922 HydrophobicContact CG2-CD2 4.1Å; F918-Y922 HydrophobicContact CE1-CD2 4.37Å; F918-Y922 HydrophobicContact CE1-CG 4.4Å; F918-Y922 AromaticContact CE2-CD2 3.8Å; F918-Y922 HydrophobicContact CE2-CD2 3.8Å; F918-Y922 HydrophobicContact CE2-CG 4.31Å; F918-Y922 AromaticContact CZ-CD2 3.62Å; F918-Y922 HydrophobicContact CZ-CD2 3.62Å; F918-Y922 HydrophobicContact CZ-CE2 4.29Å; F918-Y922 HydrophobicContact CZ-CG 4.07Å; F918-Y922 WeakPolarHBondContact O-CA 3.46Å; F918-Y922 WeakPolarHBondContact O-CB 3.42Å; F918-Y922 PolarHBondContact O-N 3.24Å; Y922-R924 VanDerWaalsContact C-N 3.26Å; Y922-R924 PolarHBondContact O-N 2.92Å; Y922-A925 PolarHBondContact O-N 3.12Å; Y922-M926 HydrophobicContact CE1-CB 4.32Å; Y922-M926 HydrophobicContact CE2-CB 4.11Å; Y922-M926 HydrophobicContact CE2-CE 3.6Å; Y922-M926 HydrophobicContact CE2-CG 4.38Å; Y922-M926 WeakPolarHBondContact O-CB 3.41Å; Y922-M926 PolarHBondContact O-N 3.38Å
923	P	84.2	Confident	82.9	Confident	26 Å²	26	60.7 Å²	60.7	17%	0.169	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-33.8	-178.2	-23.8	34.6	0	0	0	112.9	F649 F919 N927	F649-P923 HydrophobicContact CB-CB 4.21Å; F919-P923 VanDerWaalsContact O-CD 3.29Å; F919-P923 WeakPolarHBondContact O-CD 3.37Å; P923-N927 VanDerWaalsContact O-CB 3.28Å; P923-N927 WeakPolarHBondContact O-CB 3.48Å; P923-N927 PolarHBondContact O-N 3.03Å; P923-N927 PolarHBondContact O-ND2 3.33Å
924	R	85.2	Confident	82.6	Confident	210 Å²	210	64 Å²	64	79%	0.792	31%	0.308	S	S	*	.	H	α-helix	trans	-75.7	-42.6	176.9	-62.4	-178.4	-176	168.2	2.7	111.7	R921 Y922 A928	R921-R924 PolarHBondContact O-N 3.25Å; R921-R924 VanDerWaalsContact O-N 3.15Å; Y922-R924 VanDerWaalsContact C-N 3.26Å; Y922-R924 PolarHBondContact O-N 2.92Å; R924-A928 WeakPolarHBondContact O-CB 3.44Å; R924-A928 PolarHBondContact O-N 3.05Å; R924-A928 VanDerWaalsContact O-N 3.15Å
925	A	88.8	Confident	81.8	Confident	27 Å²	27	62.4 Å²	62.4	22%	0.223	30%	0.301	C	S	.	.	H	α-helix	trans	-66	-45.9	179	0	0	0	0	0	111.8	I903 R921 Y922 A928 W929	I903-A925 HydrophobicContact CD1-CB 3.8Å; I903-A925 HydrophobicContact CG1-CB 3.98Å; I903-A925 HydrophobicContact CG2-CB 4.28Å; R921-A925 PolarHBondContact O-N 3.03Å; Y922-A925 PolarHBondContact O-N 3.12Å; A925-A928 PolarHBondContact O-N 2.86Å; A925-W929 PolarHBondContact O-N 2.9Å; A925-W929 VanDerWaalsContact O-N 3.12Å
926	M	89.4	Confident	81.1	Confident	0 Å²	0	66 Å²	66	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65.3	-46.3	178.5	-174.6	58.6	77.3	0	0	111.5	P651 L899 T900 I903 Y922 A928 W929 L930	P651-M926 HydrophobicContact CB-CG 4.45Å; P651-M926 HydrophobicContact CG-CG 3.8Å; L899-M926 HydrophobicContact CB-CE 3.85Å; L899-M926 HydrophobicContact CB-SD 4.12Å; L899-M926 HydrophobicContact CD1-SD 4.23Å; T900-M926 WeakPolarHBondContact OG1-CE 3.41Å; I903-M926 HydrophobicContact CD1-CB 3.95Å; I903-M926 HydrophobicContact CD1-CE 3.96Å; Y922-M926 HydrophobicContact CE1-CB 4.32Å; Y922-M926 HydrophobicContact CE2-CB 4.11Å; Y922-M926 HydrophobicContact CE2-CE 3.6Å; Y922-M926 HydrophobicContact CE2-CG 4.38Å; Y922-M926 WeakPolarHBondContact O-CB 3.41Å; Y922-M926 PolarHBondContact O-N 3.38Å; M926-A928 VanDerWaalsContact C-N 3.26Å; M926-A928 PolarHBondContact O-N 3.05Å; M926-W929 CarbonylContact O-C 3.15Å; M926-W929 PolarHBondContact O-N 2.91Å; M926-L930 PolarHBondContact O-N 3.06Å
927	N	83.8	Confident	81.2	Confident	46 Å²	46	65.2 Å²	65.2	25%	0.246	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-34	176.9	-73.4	-28.7	0	0	0	112.8	F649 P923 W929	F649-N927 PolarHBondContact O-ND2 3.13Å; P923-N927 VanDerWaalsContact O-CB 3.28Å; P923-N927 WeakPolarHBondContact O-CB 3.48Å; P923-N927 PolarHBondContact O-N 3.03Å; P923-N927 PolarHBondContact O-ND2 3.33Å; N927-W929 VanDerWaalsContact C-N 3.33Å
928	A	85.8	Confident	81.5	Confident	60 Å²	60	65.4 Å²	65.4	50%	0.496	31%	0.307	S	S	.	.	H	α-helix	trans	-69.1	-29.5	173	0	0	0	0	0	113.2	R924 A925 M926 H931	R924-A928 WeakPolarHBondContact O-CB 3.44Å; R924-A928 PolarHBondContact O-N 3.05Å; R924-A928 VanDerWaalsContact O-N 3.15Å; A925-A928 PolarHBondContact O-N 2.86Å; M926-A928 VanDerWaalsContact C-N 3.26Å; M926-A928 PolarHBondContact O-N 3.05Å; A928-H931 PolarHBondContact O-CE1 2.77Å; A928-H931 VanDerWaalsContact O-CE1 3.22Å; A928-H931 PolarHBondContact O-ND1 3.38Å
929	W	87.6	Confident	81.6	Confident	72 Å²	72	65.6 Å²	65.6	27%	0.273	31%	0.308	S	S	.	.	H	α-helix	trans	-97.5	-5	-178.1	-65.1	-3.3	0	0	0	114.2	L899 E902 I903 K906 A925 M926 N927 H931 L932	L899-W929 HydrophobicContact CD1-CB 4.22Å; L899-W929 HydrophobicContact CD2-CE3 4.18Å; E902-W929 HydrophobicContact CB-CZ3 3.97Å; I903-W929 HydrophobicContact CD1-CE3 4.19Å; I903-W929 HydrophobicContact CD1-CZ3 4.3Å; I903-W929 HydrophobicContact CG1-CE3 3.85Å; I903-W929 HydrophobicContact CG1-CH2 4.1Å; I903-W929 HydrophobicContact CG1-CZ3 3.46Å; I903-W929 VanDerWaalsContact CG1-CZ3 3.46Å; K906-W929 HydrophobicContact CD-CH2 3.98Å; A925-W929 PolarHBondContact O-N 2.9Å; A925-W929 VanDerWaalsContact O-N 3.12Å; M926-W929 CarbonylContact O-C 3.15Å; M926-W929 PolarHBondContact O-N 2.91Å; N927-W929 VanDerWaalsContact C-N 3.33Å; W929-H931 PolarHBondContact O-N 2.67Å; W929-H931 VanDerWaalsContact O-N 3.07Å; W929-L932 HydrophobicContact CB-CD1 4.2Å; W929-L932 HydrophobicContact CG-CD1 4.43Å; W929-L932 VanDerWaalsContact O-CB 3.29Å; W929-L932 WeakPolarHBondContact O-CB 3.28Å; W929-L932 WeakPolarHBondContact O-CG 3.39Å; W929-L932 PolarHBondContact O-N 2.69Å
930	L	81.9	Confident	82	Confident	13 Å²	13	64.4 Å²	64.4	7%	0.068	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-48.5	-41.3	-178.3	-88.6	174.4	0	0	0	113.2	P651 I667 M926 L932 L933	P651-L930 HydrophobicContact CB-CD1 3.92Å; P651-L930 HydrophobicContact CB-CD2 3.64Å; P651-L930 HydrophobicContact CB-CG 4.12Å; I667-L930 HydrophobicContact CB-CD2 4.49Å; I667-L930 WeakPolarHBondContact CD1-O 3.43Å; I667-L930 HydrophobicContact CG2-CD2 3.82Å; M926-L930 PolarHBondContact O-N 3.06Å; L930-L932 PolarHBondContact O-N 2.58Å; L930-L933 HydrophobicContact CD2-CD1 4.16Å; L930-L933 WeakPolarHBondContact O-CB 3.3Å; L930-L933 PolarHBondContact O-N 2.81Å
931	H	81.3	Confident	82.6	Confident	127 Å²	127	58.1 Å²	58.1	59%	0.588	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-56	-23.6	-179.8	69.8	-87	0	0	0	114.1	A928 W929 L933 K934	A928-H931 PolarHBondContact O-CE1 2.77Å; A928-H931 VanDerWaalsContact O-CE1 3.22Å; A928-H931 PolarHBondContact O-ND1 3.38Å; W929-H931 PolarHBondContact O-N 2.67Å; W929-H931 VanDerWaalsContact O-N 3.07Å; H931-L933 VanDerWaalsContact C-N 3.25Å; H931-L933 PolarHBondContact O-N 2.81Å; H931-K934 WeakPolarHBondContact O-CB 3.42Å; H931-K934 PolarHBondContact O-N 2.97Å
932	L	84.4	Confident	82.7	Confident	105 Å²	105	53 Å²	53	55%	0.55	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-73.6	-13.3	175.6	-57.4	175.9	0	0	0	113.3	L899 W929 L930	L899-L932 HydrophobicContact CD1-CB 4.28Å; L899-L932 HydrophobicContact CD2-CD1 4.12Å; W929-L932 HydrophobicContact CB-CD1 4.2Å; W929-L932 HydrophobicContact CG-CD1 4.43Å; W929-L932 VanDerWaalsContact O-CB 3.29Å; W929-L932 WeakPolarHBondContact O-CB 3.28Å; W929-L932 WeakPolarHBondContact O-CG 3.39Å; W929-L932 PolarHBondContact O-N 2.69Å; L930-L932 PolarHBondContact O-N 2.58Å
933	L	80.7	Confident	82.5	Confident	11 Å²	11	53.4 Å²	53.4	6%	0.058	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-85	-10.5	173	-57.4	-178.4	0	0	0	112.9	I653 I667 W896 L899 L930 H931 S935	I653-L933 HydrophobicContact CD1-CD1 4.34Å; I667-L933 HydrophobicContact CD1-CB 4.27Å; W896-L933 HydrophobicContact CB-CD1 4.16Å; L899-L933 HydrophobicContact CD1-CD1 4.5Å; L899-L933 HydrophobicContact CD1-CD2 3.55Å; L899-L933 HydrophobicContact CD1-CG 3.83Å; L899-L933 HydrophobicContact CG-CD2 4.22Å; L930-L933 HydrophobicContact CD2-CD1 4.16Å; L930-L933 WeakPolarHBondContact O-CB 3.3Å; L930-L933 PolarHBondContact O-N 2.81Å; H931-L933 VanDerWaalsContact C-N 3.25Å; H931-L933 PolarHBondContact O-N 2.81Å; L933-S935 PolarHBondContact O-N 2.92Å
934	K	72.3	Confident	82.3	Confident	90 Å²	90	52.3 Å²	52.3	39%	0.391	25%	0.25	S	S	.	.			trans	-68.9	115.7	178.8	-162	-165.6	173.2	-147.4	0	109.6	I667 H931 D937	I667-K934 HydrophobicContact CD1-CB 4.1Å; H931-K934 WeakPolarHBondContact O-CB 3.42Å; H931-K934 PolarHBondContact O-N 2.97Å; K934-D937 VanDerWaalsContact CE-OD1 3.31Å; K934-D937 WeakPolarHBondContact CE-OD1 3.4Å; K934-D937 IonicContact NZ-OD1 3.42Å; K934-D937 PolarHBondContact NZ-OD1 2.79Å; K934-D937 IonicContact NZ-OD2 2.67Å; K934-D937 PolarHBondContact NZ-OD2 2.71Å
935	S	63	Low	81.8	Confident	19 Å²	19	45.6 Å²	45.6	13%	0.133	23%	0.228	C	C	.	.			trans	-107.9	137.6	-173.4	106	0	0	0	0	112.7	F888 L933	F888-S935 WeakPolarHBondContact CD1-OG 3.37Å; F888-S935 WeakPolarHBondContact CE1-OG 3.41Å; L933-S935 PolarHBondContact O-N 2.92Å
936	H	66.7	Low	80.9	Confident	110 Å²	110	45.4 Å²	45.4	51%	0.509	22%	0.224	S	C	.	.			trans	42.5	87.7	162.2	-54.3	96.8	0	0	0	117.2	R938	H936-R938 PolarHBondContact O-N 2.71Å
937	D	74.4	Confident	79.9	Confident	49 Å²	49	49 Å²	49	26%	0.262	24%	0.243	S	C	.	.			trans	-72.7	44.5	168.9	-72.5	-41.3	0	0	0	113.2	L675 K934 P961	L675-D937 HydrophobicContact CD1-CB 3.83Å; L675-D937 WeakPolarHBondContact CD1-OD1 3.22Å; K934-D937 VanDerWaalsContact CE-OD1 3.31Å; K934-D937 WeakPolarHBondContact CE-OD1 3.4Å; K934-D937 IonicContact NZ-OD1 3.42Å; K934-D937 PolarHBondContact NZ-OD1 2.79Å; K934-D937 IonicContact NZ-OD2 2.67Å; K934-D937 PolarHBondContact NZ-OD2 2.71Å; D937-P961 VanDerWaalsContact O-CD 3.23Å; D937-P961 WeakPolarHBondContact O-CD 3.42Å
938	R	86.1	Confident	78.9	Confident	97 Å²	97	56.2 Å²	56.2	37%	0.366	27%	0.272	S	S	.	.			trans	-116.6	146.5	-178	-69.1	-175.4	176.9	177.8	-3.3	111.4	S821 H936 W959 E962	S821-R938 WeakPolarHBondContact CB-O 3.37Å; S821-R938 PolarHBondContact N-O 3.3Å; H936-R938 PolarHBondContact O-N 2.71Å; R938-W959 WeakPolarHBondContact CA-O 3.46Å; R938-E962 IonicContact NH2-OE2 3.87Å
939	F	88.6	Confident	77.8	Confident	5 Å²	5	62.7 Å²	62.7	2%	0.022	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	145.8	177.5	-70.4	-104	0	0	0	110.9	P671 L675 L676 A679 M818 Q819 P820 Q958 W959	P671-F939 HydrophobicContact CB-CE2 3.72Å; P671-F939 HydrophobicContact CB-CZ 3.66Å; P671-F939 HydrophobicContact CG-CE1 4.03Å; P671-F939 HydrophobicContact CG-CE2 3.85Å; P671-F939 HydrophobicContact CG-CZ 3.43Å; P671-F939 VanDerWaalsContact CG-CZ 3.43Å; L675-F939 HydrophobicContact CB-CE2 3.91Å; L675-F939 HydrophobicContact CB-CZ 4.41Å; L676-F939 HydrophobicContact CB-CE1 3.96Å; L676-F939 HydrophobicContact CB-CZ 3.87Å; L676-F939 HydrophobicContact CD1-CD1 4.27Å; L676-F939 HydrophobicContact CD1-CE1 3.82Å; L676-F939 HydrophobicContact CG-CE1 4.46Å; A679-F939 HydrophobicContact CB-CB 4.43Å; A679-F939 HydrophobicContact CB-CD2 4.31Å; A679-F939 HydrophobicContact CB-CG 4.28Å; M818-F939 HydrophobicContact CG-CB 4.21Å; M818-F939 HydrophobicContact CG-CD1 4.07Å; M818-F939 HydrophobicContact CG-CG 4.45Å; M818-F939 HydrophobicContact SD-CB 3.82Å; Q819-F939 CarbonylContact O-C 3.6Å; Q819-F939 WeakPolarHBondContact O-CA 3.39Å; Q819-F939 WeakPolarHBondContact O-CB 3.36Å; Q819-F939 WeakPolarHBondContact O-CD1 3.4Å; P820-F939 HydrophobicContact CG-CE1 4.19Å; F939-Q958 CarbonylContact O-C 3.53Å; F939-Q958 WeakPolarHBondContact O-CA 3.46Å; F939-Q958 VanDerWaalsContact O-CG 3.28Å; F939-Q958 WeakPolarHBondContact O-CG 3.47Å; F939-W959 HydrophobicContact CB-CB 4.43Å; F939-W959 HydrophobicContact CB-CE3 4.47Å; F939-W959 AromaticContact CD2-CE3 3.71Å; F939-W959 HydrophobicContact CD2-CE3 3.71Å; F939-W959 AromaticContact CD2-CZ3 3.89Å; F939-W959 HydrophobicContact CD2-CZ3 3.89Å; F939-W959 HydrophobicContact CE2-CE3 4.48Å; F939-W959 HydrophobicContact CE2-CZ3 4.23Å; F939-W959 HydrophobicContact CG-CE3 4.5Å; F939-W959 PolarHBondContact N-O 3.21Å; F939-W959 PolarHBondContact O-N 3.45Å
940	T	88.3	Confident	76.6	Confident	14 Å²	14	60.6 Å²	60.6	9%	0.086	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	137.3	169.9	36.6	0	0	0	0	110.1	Q819 Y942 Q958	Q819-T940 PolarHBondContact N-O 2.98Å; Q819-T940 PolarHBondContact O-N 3.11Å; T940-Y942 WeakPolarHBondContact OG1-CE2 3.32Å; T940-Y942 PolarHBondContact OG1-OH 3.33Å; T940-Q958 HydrophobicContact CG2-CG 4.12Å
941	L	89.1	Confident	75.9	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.8	174.4	-178.8	71.2	0	0	0	108.6	L683 L816 S817 M818 V956 G957 L967	L683-L941 HydrophobicContact CD1-CD1 4.29Å; L683-L941 HydrophobicContact CD1-CD2 3.57Å; L683-L941 HydrophobicContact CD2-CD1 3.91Å; L816-L941 HydrophobicContact CB-CD1 4.37Å; S817-L941 WeakPolarHBondContact O-CA 3.49Å; M818-L941 HydrophobicContact CE-CD1 3.96Å; M818-L941 HydrophobicContact SD-CB 4.37Å; M818-L941 HydrophobicContact SD-CD1 4.43Å; L941-V956 HydrophobicContact CB-CG2 4.31Å; L941-V956 HydrophobicContact CD2-CG2 3.87Å; L941-V956 HydrophobicContact CG-CG2 3.76Å; L941-V956 VanDerWaalsContact O-CG2 3.29Å; L941-V956 WeakPolarHBondContact O-CG2 3.39Å; L941-V956 PolarHBondContact O-N 3.08Å; L941-G957 PolarHBondContact N-O 3.39Å; L941-G957 PolarHBondContact O-N 2.91Å; L941-L967 HydrophobicContact CD2-CD2 3.95Å
942	Y	86.4	Confident	75.4	Confident	28 Å²	28	58.9 Å²	58.9	11%	0.11	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	148.3	177.7	-64.8	-74.9	0	0	0	111.7	L816 S817 Q819 E882 T940 V953 E954 P955	L816-Y942 CarbonylContact C-O 3.57Å; L816-Y942 WeakPolarHBondContact CA-O 3.36Å; S817-Y942 PolarHBondContact N-O 2.86Å; S817-Y942 PolarHBondContact O-N 2.55Å; Q819-Y942 HydrophobicContact CB-CD2 4.27Å; Q819-Y942 HydrophobicContact CB-CE2 4.07Å; Q819-Y942 HydrophobicContact CG-CD2 4.27Å; Q819-Y942 HydrophobicContact CG-CE2 4.44Å; E882-Y942 VanDerWaalsContact CD-CZ 3.44Å; E882-Y942 WeakPolarHBondContact OE1-CE1 3.33Å; E882-Y942 WeakPolarHBondContact OE1-CE2 3.42Å; E882-Y942 PolarHBondContact OE1-OH 2.72Å; E882-Y942 WeakPolarHBondContact OE2-CE2 3.32Å; E882-Y942 PolarHBondContact OE2-OH 3.13Å; T940-Y942 WeakPolarHBondContact OG1-CE2 3.32Å; T940-Y942 PolarHBondContact OG1-OH 3.33Å; Y942-V953 HydrophobicContact CD1-CG1 3.86Å; Y942-V953 HydrophobicContact CG-CG1 4.03Å; Y942-E954 CarbonylContact C-O 3.54Å; Y942-E954 WeakPolarHBondContact CA-O 3.33Å; Y942-P955 HydrophobicContact CD1-CB 3.95Å; Y942-P955 HydrophobicContact CE1-CB 3.69Å; Y942-P955 HydrophobicContact CE1-CG 4.35Å
943	N	85.1	Confident	75	Confident	10 Å²	10	56.5 Å²	56.5	5%	0.053	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	124.5	166.7	-174.4	7.5	0	0	0	108.6	L816 E954 V956	L816-N943 HydrophobicContact CD2-CB 4.24Å; N943-E954 PolarHBondContact N-O 3.41Å; N943-E954 PolarHBondContact O-N 3.31Å; N943-V956 HydrophobicContact CB-CG1 3.71Å; N943-V956 HydrophobicContact CB-CG2 4.27Å
944	I	80.5	Confident	74.9	Confident	4 Å²	4	59 Å²	59	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	101.1	-179.4	-54	-177.8	0	0	0	108.5	L778 F785 V786 F815 A952 V953	L778-I944 HydrophobicContact CD1-CD1 4.12Å; F785-I944 HydrophobicContact CE1-CD1 4.36Å; V786-I944 HydrophobicContact CG2-CG2 4.31Å; F815-I944 HydrophobicContact CB-CB 3.98Å; F815-I944 PolarHBondContact O-N 3.1Å; I944-A952 CarbonylContact C-O 3.42Å; I944-A952 WeakPolarHBondContact CA-O 3.41Å; I944-V953 HydrophobicContact CG1-CG1 4.37Å; I944-V953 HydrophobicContact CG1-CG2 4.22Å; I944-V953 HydrophobicContact CG2-CG2 4.38Å
945	Q	73.6	Confident	75.3	Confident	69 Å²	69	58.2 Å²	58.2	32%	0.322	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	111.7	178.1	-63.5	-174.3	0.4	0	0	110	N947 P951 A952	Q945-N947 PolarHBondContact O-N 2.78Å; Q945-N947 VanDerWaalsContact O-N 3.16Å; Q945-P951 WeakPolarHBondContact O-CA 3.15Å; Q945-A952 PolarHBondContact N-O 3.1Å; Q945-A952 PolarHBondContact O-N 3.34Å
946	V	70.4	Confident	76.3	Confident	22 Å²	22	57.5 Å²	57.5	13%	0.133	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	91.9	176.5	-167.5	0	0	0	0	108.8	V809 F815	V809-V946 HydrophobicContact CG2-CG1 4.05Å; V809-V946 WeakPolarHBondContact CG2-O 3.44Å; F815-V946 HydrophobicContact CD2-CG2 4.31Å; F815-V946 HydrophobicContact CE2-CG2 4.3Å
947	N	67	Low	77.1	Confident	75 Å²	75	52.2 Å²	52.2	40%	0.401	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	164	178.8	-69.2	-35.6	0	0	0	111.3	Q945 E949 G950	Q945-N947 PolarHBondContact O-N 2.78Å; Q945-N947 VanDerWaalsContact O-N 3.16Å; N947-E949 PolarHBondContact O-N 3.45Å; N947-E949 VanDerWaalsContact O-N 3.17Å; N947-G950 WeakPolarHBondContact CB-O 3.45Å; N947-G950 PolarHBondContact N-O 3.06Å; N947-G950 VanDerWaalsContact N-O 3.08Å; N947-G950 CarbonylContact O-C 3.46Å; N947-G950 PolarHBondContact O-N 3.42Å
948	K	64.4	Low	77.8	Confident	198 Å²	198	53.2 Å²	53.2	86%	0.861	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.9	175.6	-65.4	-171	178.6	-179.3	0	113.7	V809	V809-K948 HydrophobicContact CG1-CG 3.93Å
949	E	62.7	Low	78	Confident	197 Å²	197	49.2 Å²	49.2	92%	0.921	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-10.5	178.1	-62.9	174.2	178.9	0	0	112.4	N947	N947-E949 PolarHBondContact O-N 3.45Å; N947-E949 VanDerWaalsContact O-N 3.17Å
950	G	61.4	Low	78	Confident	28 Å²	28	49.1 Å²	49.1	29%	0.289	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	131.7	172.7	-175.8	0	0	0	0	0	112.5	N947	N947-G950 WeakPolarHBondContact CB-O 3.45Å; N947-G950 PolarHBondContact N-O 3.06Å; N947-G950 VanDerWaalsContact N-O 3.08Å; N947-G950 CarbonylContact O-C 3.46Å; N947-G950 PolarHBondContact O-N 3.42Å
951	P	67.7	Low	77.8	Confident	67 Å²	67	52.2 Å²	52.2	44%	0.435	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	126.7	171.2	29.5	-33.4	0	0	0	111.2	V786 Q945	V786-P951 HydrophobicContact CB-CB 4.43Å; V786-P951 HydrophobicContact CB-CG 4.3Å; V786-P951 HydrophobicContact CG1-CB 3.94Å; V786-P951 HydrophobicContact CG1-CG 3.76Å; V786-P951 HydrophobicContact CG2-CB 4.42Å; Q945-P951 WeakPolarHBondContact O-CA 3.15Å
952	A	71.7	Confident	77.6	Confident	36 Å²	36	59.5 Å²	59.5	30%	0.298	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.3	165.7	0	0	0	0	0	109.5	I944 Q945	I944-A952 CarbonylContact C-O 3.42Å; I944-A952 WeakPolarHBondContact CA-O 3.41Å; Q945-A952 PolarHBondContact N-O 3.1Å; Q945-A952 PolarHBondContact O-N 3.34Å
953	V	75.2	Confident	77.3	Confident	55 Å²	55	62.7 Å²	62.7	33%	0.333	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	113.5	177	-175.9	0	0	0	0	107.9	Y942 I944	Y942-V953 HydrophobicContact CD1-CG1 3.86Å; Y942-V953 HydrophobicContact CG-CG1 4.03Å; I944-V953 HydrophobicContact CG1-CG1 4.37Å; I944-V953 HydrophobicContact CG1-CG2 4.22Å; I944-V953 HydrophobicContact CG2-CG2 4.38Å
954	E	78.2	Confident	77.3	Confident	63 Å²	63	65.3 Å²	65.3	29%	0.294	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.7	179.9	-65.6	-167.1	160	0	0	111.2	Y942 N943 V956 K974	Y942-E954 CarbonylContact C-O 3.54Å; Y942-E954 WeakPolarHBondContact CA-O 3.33Å; N943-E954 PolarHBondContact N-O 3.41Å; N943-E954 PolarHBondContact O-N 3.31Å; E954-V956 PolarHBondContact O-N 2.86Å; E954-K974 IonicContact OE1-NZ 3.38Å; E954-K974 PolarHBondContact OE1-NZ 2.89Å; E954-K974 WeakPolarHBondContact OE2-CD 3.5Å; E954-K974 IonicContact OE2-NZ 2.73Å; E954-K974 PolarHBondContact OE2-NZ 3.46Å
955	P	80	Confident	77.5	Confident	74 Å²	74	65.8 Å²	65.8	48%	0.481	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	125.1	170	26.6	-31.2	0	0	0	110	Y942	Y942-P955 HydrophobicContact CD1-CB 3.95Å; Y942-P955 HydrophobicContact CE1-CB 3.69Å; Y942-P955 HydrophobicContact CE1-CG 4.35Å
956	V	84.1	Confident	78.1	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.024	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-14.8	-177.4	-67.7	0	0	0	0	113.9	L941 N943 E954 H968 A971 I975	L941-V956 HydrophobicContact CB-CG2 4.31Å; L941-V956 HydrophobicContact CD2-CG2 3.87Å; L941-V956 HydrophobicContact CG-CG2 3.76Å; L941-V956 VanDerWaalsContact O-CG2 3.29Å; L941-V956 WeakPolarHBondContact O-CG2 3.39Å; L941-V956 PolarHBondContact O-N 3.08Å; N943-V956 HydrophobicContact CB-CG1 3.71Å; N943-V956 HydrophobicContact CB-CG2 4.27Å; E954-V956 PolarHBondContact O-N 2.86Å; V956-H968 PolarHBondContact O-N 2.94Å; V956-A971 HydrophobicContact CB-CB 3.66Å; V956-A971 HydrophobicContact CG1-CB 3.93Å; V956-A971 VanDerWaalsContact O-CB 3.24Å; V956-A971 WeakPolarHBondContact O-CB 3.13Å; V956-I975 HydrophobicContact CB-CD1 4.1Å; V956-I975 HydrophobicContact CG1-CD1 4.45Å; V956-I975 HydrophobicContact CG2-CD1 4.42Å
957	G	85.4	Confident	78.6	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	175.7	172.8	0	0	0	0	0	113.3	L941 V966	L941-G957 PolarHBondContact N-O 3.39Å; L941-G957 PolarHBondContact O-N 2.91Å; G957-V966 CarbonylContact C-O 3.59Å; G957-V966 WeakPolarHBondContact CA-O 3.37Å
958	Q	88.4	Confident	79.2	Confident	70 Å²	70	67.3 Å²	67.3	33%	0.327	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.9	177.8	-160.1	171.4	31.6	0	0	109.7	S821 F939 T940 V966	S821-Q958 PolarHBondContact OG-NE2 3.04Å; F939-Q958 CarbonylContact O-C 3.53Å; F939-Q958 WeakPolarHBondContact O-CA 3.46Å; F939-Q958 VanDerWaalsContact O-CG 3.28Å; F939-Q958 WeakPolarHBondContact O-CG 3.47Å; T940-Q958 HydrophobicContact CG2-CG 4.12Å; Q958-V966 PolarHBondContact N-O 3.45Å; Q958-V966 PolarHBondContact O-N 3.01Å
959	W	91	Very high	79.1	Confident	13 Å²	13	61.5 Å²	61.5	5%	0.049	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	136.6	174.3	179.5	92.8	0	0	0	110.6	L675 K678 A679 R938 F939 P961 S964 L965	L675-W959 HydrophobicContact CB-CH2 4.46Å; L675-W959 HydrophobicContact CB-CZ3 4.44Å; L675-W959 HydrophobicContact CD2-CH2 3.94Å; L675-W959 HydrophobicContact CD2-CZ3 4.37Å; K678-W959 HydrophobicContact CB-CH2 4.09Å; K678-W959 HydrophobicContact CB-CZ2 3.67Å; A679-W959 HydrophobicContact CB-CB 4.26Å; A679-W959 HydrophobicContact CB-CD2 3.58Å; A679-W959 HydrophobicContact CB-CE3 3.8Å; A679-W959 HydrophobicContact CB-CG 3.79Å; A679-W959 HydrophobicContact CB-CZ3 4.38Å; R938-W959 WeakPolarHBondContact CA-O 3.46Å; F939-W959 HydrophobicContact CB-CB 4.43Å; F939-W959 HydrophobicContact CB-CE3 4.47Å; F939-W959 AromaticContact CD2-CE3 3.71Å; F939-W959 HydrophobicContact CD2-CE3 3.71Å; F939-W959 AromaticContact CD2-CZ3 3.89Å; F939-W959 HydrophobicContact CD2-CZ3 3.89Å; F939-W959 HydrophobicContact CE2-CE3 4.48Å; F939-W959 HydrophobicContact CE2-CZ3 4.23Å; F939-W959 HydrophobicContact CG-CE3 4.5Å; F939-W959 PolarHBondContact N-O 3.21Å; F939-W959 PolarHBondContact O-N 3.45Å; W959-P961 HydrophobicContact CH2-CB 4.26Å; W959-S964 VanDerWaalsContact CA-O 3.3Å; W959-S964 WeakPolarHBondContact CA-O 3.35Å; W959-S964 VanDerWaalsContact CD1-C 3.48Å; W959-L965 HydrophobicContact CB-CD1 4.17Å
960	S	88.4	Confident	78.8	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	157.1	169.8	102	0	0	0	0	110.4	E962 D963 S964	S960-E962 PolarHBondContact O-N 2.73Å; S960-E962 PolarHBondContact OG-N 3.13Å; S960-E962 VanDerWaalsContact OG-N 3.07Å; S960-D963 WeakPolarHBondContact CB-OD2 3.17Å; S960-D963 PolarHBondContact OG-N 3.25Å; S960-D963 PolarHBondContact OG-OD2 3.35Å; S960-S964 PolarHBondContact N-O 3.49Å; S960-S964 VanDerWaalsContact O-CA 3.3Å; S960-S964 WeakPolarHBondContact O-CA 3.32Å; S960-S964 PolarHBondContact O-N 3.45Å
961	P	83.9	Confident	78.5	Confident	79 Å²	79	55.5 Å²	55.5	51%	0.513	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-9.6	174	29.4	-36.1	0	0	0	113.6	D937 W959	D937-P961 VanDerWaalsContact O-CD 3.23Å; D937-P961 WeakPolarHBondContact O-CD 3.42Å; W959-P961 HydrophobicContact CH2-CB 4.26Å
962	E	84.7	Confident	77.7	Confident	155 Å²	155	58.4 Å²	58.4	72%	0.724	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-44.5	-179.1	-60.3	173	141.6	0	0	111.2	R938 S960	R938-E962 IonicContact NH2-OE2 3.87Å; S960-E962 PolarHBondContact O-N 2.73Å; S960-E962 PolarHBondContact OG-N 3.13Å; S960-E962 VanDerWaalsContact OG-N 3.07Å
963	D	80.6	Confident	76.5	Confident	94 Å²	94	58.9 Å²	58.9	50%	0.503	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-10.9	-172.6	-47.5	-74.7	0	0	0	113.3	S960 V966	S960-D963 WeakPolarHBondContact CB-OD2 3.17Å; S960-D963 PolarHBondContact OG-N 3.25Å; S960-D963 PolarHBondContact OG-OD2 3.35Å; D963-V966 HydrophobicContact CB-CG2 4.14Å
964	S	84	Confident	75.4	Confident	66 Å²	66	60.7 Å²	60.7	46%	0.462	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	59.4	-148	-163.9	77.8	0	0	0	0	112.6	W959 S960	W959-S964 VanDerWaalsContact CA-O 3.3Å; W959-S964 WeakPolarHBondContact CA-O 3.35Å; W959-S964 VanDerWaalsContact CD1-C 3.48Å; S960-S964 PolarHBondContact N-O 3.49Å; S960-S964 VanDerWaalsContact O-CA 3.3Å; S960-S964 WeakPolarHBondContact O-CA 3.32Å; S960-S964 PolarHBondContact O-N 3.45Å
965	L	85.3	Confident	74.2	Confident	14 Å²	14	58.8 Å²	58.8	7%	0.073	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	116.1	177.6	178.8	65.2	0	0	0	110.6	S682 L683 Q686 W959 L967	S682-L965 WeakPolarHBondContact OG-CB 3.24Å; L683-L965 HydrophobicContact CB-CD2 4.12Å; L683-L965 HydrophobicContact CD1-CD2 3.52Å; L683-L965 HydrophobicContact CG-CD2 4.45Å; Q686-L965 HydrophobicContact CB-CD2 4.37Å; W959-L965 HydrophobicContact CB-CD1 4.17Å; L965-L967 HydrophobicContact CD1-CD2 4.47Å; L965-L967 HydrophobicContact CD2-CD2 4.41Å; L965-L967 HydrophobicContact CG-CD2 4.39Å
966	V	85.8	Confident	72.4	Confident	80 Å²	80	58.1 Å²	58.1	49%	0.485	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.2	173.3	-176.4	0	0	0	0	109.2	G957 Q958 D963	G957-V966 CarbonylContact C-O 3.59Å; G957-V966 WeakPolarHBondContact CA-O 3.37Å; Q958-V966 PolarHBondContact N-O 3.45Å; Q958-V966 PolarHBondContact O-N 3.01Å; D963-V966 HydrophobicContact CB-CG2 4.14Å
967	L	81.7	Confident	70.5	Confident	38 Å²	38	63.7 Å²	63.7	20%	0.199	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	146.5	171.3	-60.1	178.8	0	0	0	110	L941 L965	L941-L967 HydrophobicContact CD2-CD2 3.95Å; L965-L967 HydrophobicContact CD1-CD2 4.47Å; L965-L967 HydrophobicContact CD2-CD2 4.41Å; L965-L967 HydrophobicContact CG-CD2 4.39Å
968	H	79.1	Confident	68.9	Low	79 Å²	79	66.1 Å²	66.1	37%	0.366	38%	0.382	S	S	.	.			trans	-75	141.3	176.3	-66.2	-48.6	0	0	0	110.9	V956 S970 A971 E972	V956-H968 PolarHBondContact O-N 2.94Å; H968-S970 PolarHBondContact O-N 3.41Å; H968-S970 VanDerWaalsContact O-N 3.15Å; H968-A971 HydrophobicContact CB-CB 4.24Å; H968-A971 CarbonylContact O-C 3.57Å; H968-A971 VanDerWaalsContact O-CA 3.27Å; H968-A971 WeakPolarHBondContact O-CA 3.5Å; H968-A971 VanDerWaalsContact O-CB 3.26Å; H968-A971 WeakPolarHBondContact O-CB 3.17Å; H968-A971 PolarHBondContact O-N 3.03Å; H968-E972 PolarHBondContact O-N 2.98Å
969	A	61.1	Low	66.6	Low	76 Å²	76	65.5 Å²	65.5	63%	0.628	38%	0.382	S	S	*	.	H	α-helix	trans	-59.9	-27.9	176.9	0	0	0	0	0	113.7	A971 E972	A969-A971 VanDerWaalsContact C-N 3.31Å; A969-E972 PolarHBondContact O-N 3.41Å
970	S	57.1	Low	64.5	Low	96 Å²	96	71.1 Å²	71.1	67%	0.671	42%	0.417	S	S	*	.	H	α-helix	trans	-69.1	-29.6	170.4	-171.1	0	0	0	0	112.6	H968 K974	H968-S970 PolarHBondContact O-N 3.41Å; H968-S970 VanDerWaalsContact O-N 3.15Å; S970-K974 PolarHBondContact O-N 3.22Å
971	A	55	Low	62.5	Low	4 Å²	4	78.9 Å²	78.9	3%	0.033	45%	0.453	C	S	.	.	H	α-helix	trans	-77.9	-29.7	171.2	0	0	0	0	0	112.2	V956 H968 A969 G973 K974 I975	V956-A971 HydrophobicContact CB-CB 3.66Å; V956-A971 HydrophobicContact CG1-CB 3.93Å; V956-A971 VanDerWaalsContact O-CB 3.24Å; V956-A971 WeakPolarHBondContact O-CB 3.13Å; H968-A971 HydrophobicContact CB-CB 4.24Å; H968-A971 CarbonylContact O-C 3.57Å; H968-A971 VanDerWaalsContact O-CA 3.27Å; H968-A971 WeakPolarHBondContact O-CA 3.5Å; H968-A971 VanDerWaalsContact O-CB 3.26Å; H968-A971 WeakPolarHBondContact O-CB 3.17Å; H968-A971 PolarHBondContact O-N 3.03Å; A969-A971 VanDerWaalsContact C-N 3.31Å; A971-G973 VanDerWaalsContact C-N 3.26Å; A971-G973 PolarHBondContact O-N 3.47Å; A971-K974 PolarHBondContact O-N 3.45Å; A971-K974 VanDerWaalsContact O-N 3.16Å; A971-I975 HydrophobicContact CB-CD1 4.04Å; A971-I975 HydrophobicContact CB-CG1 4.36Å; A971-I975 WeakPolarHBondContact O-CA 3.3Å; A971-I975 WeakPolarHBondContact O-CB 2.81Å; A971-I975 WeakPolarHBondContact O-CG1 3.02Å; A971-I975 PolarHBondContact O-N 3.36Å
972	E	50	Low	61.2	Low	128 Å²	128	81.7 Å²	81.7	60%	0.598	45%	0.453	S	S	*	.	H	α-helix	trans	-56	-42.7	171.4	-65.3	-176.6	133	0	0	111.2	H968 A969 A976	H968-E972 PolarHBondContact O-N 2.98Å; A969-E972 PolarHBondContact O-N 3.41Å; E972-A976 WeakPolarHBondContact O-CB 3.34Å; E972-A976 PolarHBondContact O-N 2.85Å
973	G	47.1	Very low	60.2	Low	45 Å²	45	76.7 Å²	76.7	46%	0.464	43%	0.431	S	S	.	.	H	α-helix	trans	-70.2	-31	175.8	0	0	0	0	0	115.5	A971 N977	A971-G973 VanDerWaalsContact C-N 3.26Å; A971-G973 PolarHBondContact O-N 3.47Å; G973-N977 PolarHBondContact O-ND2 3.35Å
974	K	51.9	Low	59.8	Low	93 Å²	93	72.3 Å²	72.3	40%	0.404	41%	0.408	S	S	.	.	H	α-helix	trans	-89.1	-34.6	179.5	-80.4	-174.8	176.3	-176.8	0	113.5	E954 S970 A971 N977	E954-K974 IonicContact OE1-NZ 3.38Å; E954-K974 PolarHBondContact OE1-NZ 2.89Å; E954-K974 WeakPolarHBondContact OE2-CD 3.5Å; E954-K974 IonicContact OE2-NZ 2.73Å; E954-K974 PolarHBondContact OE2-NZ 3.46Å; S970-K974 PolarHBondContact O-N 3.22Å; A971-K974 PolarHBondContact O-N 3.45Å; A971-K974 VanDerWaalsContact O-N 3.16Å; K974-N977 WeakPolarHBondContact O-CB 3.43Å; K974-N977 PolarHBondContact O-N 3.11Å
975	I	53.2	Low	59.2	Low	24 Å²	24	74.6 Å²	74.6	12%	0.123	42%	0.415	C	S	.	.	H	α-helix	trans	-75.1	-34.8	173.1	-62.2	178.4	0	0	0	109.4	V956 A971 N977 M978	V956-I975 HydrophobicContact CB-CD1 4.1Å; V956-I975 HydrophobicContact CG1-CD1 4.45Å; V956-I975 HydrophobicContact CG2-CD1 4.42Å; A971-I975 HydrophobicContact CB-CD1 4.04Å; A971-I975 HydrophobicContact CB-CG1 4.36Å; A971-I975 WeakPolarHBondContact O-CA 3.3Å; A971-I975 WeakPolarHBondContact O-CB 2.81Å; A971-I975 WeakPolarHBondContact O-CG1 3.02Å; A971-I975 PolarHBondContact O-N 3.36Å; I975-N977 PolarHBondContact O-N 2.69Å; I975-M978 CarbonylContact O-C 3.39Å; I975-M978 VanDerWaalsContact O-CA 3.28Å; I975-M978 WeakPolarHBondContact O-CA 3.36Å; I975-M978 WeakPolarHBondContact O-CB 3.33Å; I975-M978 PolarHBondContact O-N 3.37Å
976	A	42.2	Very low	58.9	Low	60 Å²	60	74.1 Å²	74.1	50%	0.496	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-17	171.6	0	0	0	0	0	114.3	E972 M978 N979	E972-A976 WeakPolarHBondContact O-CB 3.34Å; E972-A976 PolarHBondContact O-N 2.85Å; A976-M978 CarbonylContact C-O 3.52Å; A976-M978 CarbonylContact O-C 3.47Å; A976-N979 PolarHBondContact O-N 2.68Å
977	N	45.4	Very low	58.5	Low	120 Å²	120	75.2 Å²	75.2	64%	0.642	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-16.8	167	-78.6	-23.1	0	0	0	112.6	G973 K974 I975 N979 R982	G973-N977 PolarHBondContact O-ND2 3.35Å; K974-N977 WeakPolarHBondContact O-CB 3.43Å; K974-N977 PolarHBondContact O-N 3.11Å; I975-N977 PolarHBondContact O-N 2.69Å; N977-N979 PolarHBondContact O-N 3.41Å; N977-R982 PolarHBondContact O-NH1 2.9Å
978	M	50.1	Low	58	Low	51 Å²	51	75 Å²	75	25%	0.251	41%	0.414	S	S	.	.	S	Bend	trans	-78.3	94.9	146.4	-52.9	171.1	167.6	0	0	105.7	T814 I975 A976 V980	T814-M978 HydrophobicContact CG2-CE 3.68Å; T814-M978 HydrophobicContact CG2-SD 4.4Å; T814-M978 WeakPolarHBondContact OG1-CE 3.25Å; I975-M978 CarbonylContact O-C 3.39Å; I975-M978 VanDerWaalsContact O-CA 3.28Å; I975-M978 WeakPolarHBondContact O-CA 3.36Å; I975-M978 WeakPolarHBondContact O-CB 3.33Å; I975-M978 PolarHBondContact O-N 3.37Å; A976-M978 CarbonylContact C-O 3.52Å; A976-M978 CarbonylContact O-C 3.47Å; M978-V980 PolarHBondContact O-N 3.33Å
979	N	40.7	Very low	57.3	Low	58 Å²	58	79 Å²	79	31%	0.31	43%	0.432	S	S	.	.			trans	-43.1	147	177.9	-59.6	27	0	0	0	110.1	A976 N977 E981 R982	A976-N979 PolarHBondContact O-N 2.68Å; N977-N979 PolarHBondContact O-N 3.41Å; N979-E981 HydrophobicContact CB-CB 4.07Å; N979-E981 HydrophobicContact CB-CG 4.43Å; N979-E981 PolarHBondContact ND2-OE2 3.42Å; N979-E981 PolarHBondContact O-N 3.46Å; N979-R982 HydrophobicContact CB-CB 4.48Å; N979-R982 HydrophobicContact CB-CG 4.18Å; N979-R982 WeakPolarHBondContact O-CB 3.11Å; N979-R982 PolarHBondContact O-N 3.49Å; N979-R982 PolarHBondContact OD1-NH1 3.12Å
980	V	46.7	Very low	56.9	Low	130 Å²	130	83 Å²	83	79%	0.788	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.9	171.6	-179.7	0	0	0	0	111.6	M978	M978-V980 PolarHBondContact O-N 3.33Å
981	E	47.7	Very low	56.8	Low	167 Å²	167	83.3 Å²	83.3	78%	0.78	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.6	172.6	-52.8	167.2	130.5	0	0	115.3	N979	N979-E981 HydrophobicContact CB-CB 4.07Å; N979-E981 HydrophobicContact CB-CG 4.43Å; N979-E981 PolarHBondContact ND2-OE2 3.42Å; N979-E981 PolarHBondContact O-N 3.46Å
982	R	56.3	Low	56.7	Low	138 Å²	138	90.8 Å²	90.8	52%	0.521	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-16.8	-177.2	-75.4	-176	-175.7	142.7	3.6	114.1	N977 N979	N977-R982 PolarHBondContact O-NH1 2.9Å; N979-R982 HydrophobicContact CB-CB 4.48Å; N979-R982 HydrophobicContact CB-CG 4.18Å; N979-R982 WeakPolarHBondContact O-CB 3.11Å; N979-R982 PolarHBondContact O-N 3.49Å; N979-R982 PolarHBondContact OD1-NH1 3.12Å
983	L	64.2	Low	56.8	Low	49 Å²	49	85.9 Å²	85.9	26%	0.257	46%	0.456	S	S	.	.	S	Bend	trans	-64.4	128.4	171.3	-75.9	163.4	0	0	0	108.1	F687 W689 N985	F687-L983 HydrophobicContact CD1-CD1 3.85Å; F687-L983 HydrophobicContact CD1-CD2 4.28Å; F687-L983 HydrophobicContact CE1-CD1 4.01Å; F687-L983 HydrophobicContact CE1-CD2 4.35Å; W689-L983 HydrophobicContact CH2-CD2 4.38Å; W689-L983 HydrophobicContact CZ2-CD2 3.9Å; L983-N985 PolarHBondContact O-N 2.93Å; L983-N985 VanDerWaalsContact O-N 3.14Å
984	P	71.8	Confident	57.1	Low	3 Å²	3	92.5 Å²	92.5	2%	0.019	47%	0.467	C	S	.	.			trans	-63.1	122.2	-174.8	22.9	-34	0	0	0	110.6	W689 P747 V748 V775 S986	W689-P984 HydrophobicContact CZ2-CG 4.12Å; W689-P984 PolarHBondContact NE1-O 3.01Å; P747-P984 HydrophobicContact CB-CB 3.54Å; P747-P984 HydrophobicContact CB-CG 4.22Å; P747-P984 HydrophobicContact CG-CB 3.62Å; P747-P984 HydrophobicContact CG-CG 4.45Å; V748-P984 HydrophobicContact CG2-CG 4.11Å; V775-P984 HydrophobicContact CG2-CG 3.86Å; P984-S986 VanDerWaalsContact C-N 3.32Å; P984-S986 PolarHBondContact O-N 3.26Å
985	N	71.7	Confident	57	Low	113 Å²	113	90.3 Å²	90.3	60%	0.604	46%	0.463	S	S	*	.			trans	-68.7	91.5	171.7	-174.4	-18.5	0	0	0	109.3	L983 H987	L983-N985 PolarHBondContact O-N 2.93Å; L983-N985 VanDerWaalsContact O-N 3.14Å; N985-H987 PolarHBondContact OD1-CD2 2.96Å; N985-H987 VanDerWaalsContact OD1-CG 3.27Å
986	S	78.4	Confident	56.5	Low	4 Å²	4	97.8 Å²	97.8	3%	0.028	49%	0.491	C	S	.	.			trans	-108.3	58.7	-178.7	-146.3	0	0	0	0	110.2	S690 L691 P984	S690-S986 PolarHBondContact N-O 3.08Å; L691-S986 PolarHBondContact N-O 3.22Å; L691-S986 WeakPolarHBondContact O-CB 3.34Å; L691-S986 PolarHBondContact O-OG 2.99Å; P984-S986 VanDerWaalsContact C-N 3.32Å; P984-S986 PolarHBondContact O-N 3.26Å
987	H	77.2	Confident	56.3	Low	104 Å²	104	99.8 Å²	99.8	48%	0.481	49%	0.493	S	S	.	.			trans	-92.2	146.1	174.7	-68.1	-23.6	0	0	0	111.9	N688 S690 N985	N688-H987 PolarHBondContact O-CE1 3.3Å; N688-H987 PolarHBondContact O-ND1 3.26Å; S690-H987 WeakPolarHBondContact OG-CA 3.44Å; N985-H987 PolarHBondContact OD1-CD2 2.96Å; N985-H987 VanDerWaalsContact OD1-CG 3.27Å
988	C	71.4	Confident	56	Low	34 Å²	34	98 Å²	98	23%	0.23	49%	0.486	C	S	.	.			trans	-90.3	108.7	179.2	-135.7	0	0	0	0	112.7	S690 L691 C720 C993	S690-C988 PolarHBondContact OG-N 2.88Å; L691-C988 HydrophobicContact CB-CB 4.19Å; C720-C988 VanDerWaalsContact SG-SG 3.65Å; C988-C993 WeakPolarHBondContact CA-SG 3.37Å; C988-C993 HydrophobicContact CB-CB 3.63Å; C988-C993 WeakPolarHBondContact CB-SG 3.31Å; C988-C993 WeakPolarHBondContact SG-CB 3.33Å; C988-C993 CovalentContact SG-SG 2.01Å; C988-C993 PolarHBondContact SG-SG 3.06Å
989	Q	64.1	Low	55.3	Low	161 Å²	161	102.5 Å²	102.5	75%	0.752	51%	0.507	S	S	*	.			trans	-101.9	128.7	178.4	-160.3	169	14.2	0	0	112.8	L992 C993	Q989-L992 PolarHBondContact O-N 3.32Å; Q989-C993 PolarHBondContact N-SG 3.45Å; Q989-C993 PolarHBondContact O-N 3.45Å; Q989-C993 PolarHBondContact O-SG 2.87Å
990	H	53.1	Low	55	Low	161 Å²	161	108.4 Å²	108.4	75%	0.745	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	138.3	174.6	-171.7	-85.4	0	0	0	110.6
991	P	53.9	Low	54.3	Low	103 Å²	103	108.7 Å²	108.7	67%	0.669	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	cis	-93.5	-4.3	15.3	37.4	-37.7	0	0	0	116.1	C993	P991-C993 PolarHBondContact O-N 2.94Å; P991-C993 VanDerWaalsContact O-N 3.16Å
992	L	53.3	Low	53.7	Low	161 Å²	161	106.1 Å²	106.1	84%	0.843	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-21	-179.1	-68.6	162.2	0	0	0	112.4	Q989 R994	Q989-L992 PolarHBondContact O-N 3.32Å; L992-R994 PolarHBondContact O-N 3.14Å
993	C	53.4	Low	52.5	Low	25 Å²	25	110.2 Å²	110.2	17%	0.169	52%	0.524	C	S	.	.			trans	-100.9	70.8	-170.8	-70.3	0	0	0	0	113.4	C988 Q989 P991 C995	C988-C993 WeakPolarHBondContact CA-SG 3.37Å; C988-C993 HydrophobicContact CB-CB 3.63Å; C988-C993 WeakPolarHBondContact CB-SG 3.31Å; C988-C993 WeakPolarHBondContact SG-CB 3.33Å; C988-C993 CovalentContact SG-SG 2.01Å; C988-C993 PolarHBondContact SG-SG 3.06Å; Q989-C993 PolarHBondContact N-SG 3.45Å; Q989-C993 PolarHBondContact O-N 3.45Å; Q989-C993 PolarHBondContact O-SG 2.87Å; P991-C993 PolarHBondContact O-N 2.94Å; P991-C993 VanDerWaalsContact O-N 3.16Å; C993-C995 PolarHBondContact O-N 3.28Å
994	R	51.4	Low	51	Low	183 Å²	183	114.8 Å²	114.8	69%	0.691	55%	0.548	S	S	*	.			trans	-90.2	49.7	176.6	-142.8	173.2	-169.7	-179.9	0.9	112.1	L992	L992-R994 PolarHBondContact O-N 3.14Å
995	C	50.1	Low	49.1	Very low	48 Å²	48	123.6 Å²	123.6	32%	0.324	59%	0.589	S	S	.	*			trans	-50.9	150	162.4	-102.6	0	0	0	0	110	C720 C993 D997	C720-C995 WeakPolarHBondContact CA-SG 3.42Å; C720-C995 HydrophobicContact CB-CB 4.44Å; C720-C995 WeakPolarHBondContact CB-SG 3.45Å; C720-C995 WeakPolarHBondContact SG-CB 3.3Å; C720-C995 CovalentContact SG-SG 2.04Å; C720-C995 PolarHBondContact SG-SG 3.32Å; C993-C995 PolarHBondContact O-N 3.28Å; C995-D997 VanDerWaalsContact C-N 3.29Å; C995-D997 PolarHBondContact O-N 2.69Å
996	Y	43.5	Very low	47.2	Very low	181 Å²	181	129.9 Å²	129.9	71%	0.71	60%	0.604	S	S	*	*			trans	-68.2	74.1	-175.2	-93.1	-94.8	0	0	0	113.4	V998	Y996-V998 HydrophobicContact CD1-CG2 4.08Å; Y996-V998 PolarHBondContact O-N 3.49Å
997	D	38.6	Very low	45.4	Very low	101 Å²	101	137.5 Å²	137.5	54%	0.54	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	26.6	175.3	-154.8	22.1	0	0	0	113.5	C995 R1000	C995-D997 VanDerWaalsContact C-N 3.29Å; C995-D997 PolarHBondContact O-N 2.69Å; D997-R1000 WeakPolarHBondContact OD1-CB 3.44Å
998	V	38.1	Very low	43.2	Very low	82 Å²	82	141.8 Å²	141.8	50%	0.497	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.7	-19.3	173.6	-170.4	0	0	0	0	110.6	Y996 F1002	Y996-V998 HydrophobicContact CD1-CG2 4.08Å; Y996-V998 PolarHBondContact O-N 3.49Å; V998-F1002 WeakPolarHBondContact O-CD2 3.44Å
999	Q	36	Very low	41.2	Very low	146 Å²	146	144.3 Å²	144.3	68%	0.682	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-25.2	-179	-93.4	-169.1	-3.9	0	0	115.7
1000	R	34.7	Very low	39.6	Very low	182 Å²	182	148.4 Å²	148.4	69%	0.687	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-41.5	-176.7	-76.1	-175.9	170.7	174.9	0.1	113.2	D997 F1002 R1003	D997-R1000 WeakPolarHBondContact OD1-CB 3.44Å; R1000-F1002 PolarHBondContact O-N 3.19Å; R1000-R1003 PolarHBondContact O-N 2.71Å
1001	N	31.2	Very low	38.4	Very low	137 Å²	137	152.9 Å²	152.9	73%	0.733	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-72.2	-14.4	177	-69.4	-25.2	0	0	0	113.5	R1003	N1001-R1003 VanDerWaalsContact C-N 3.26Å; N1001-R1003 PolarHBondContact O-N 3.12Å
1002	F	34.6	Very low	37.2	Very low	112 Å²	112	152.6 Å²	152.6	49%	0.491	71%	0.713	S	S	.	*	G	3₁₀ helix	trans	-84.8	14	174.9	-92.4	-93	0	0	0	114.7	V998 R1000 I1014	V998-F1002 WeakPolarHBondContact O-CD2 3.44Å; R1000-F1002 PolarHBondContact O-N 3.19Å; F1002-I1014 HydrophobicContact CE1-CD1 3.74Å; F1002-I1014 HydrophobicContact CE1-CG1 3.84Å; F1002-I1014 HydrophobicContact CE2-CG2 4.24Å; F1002-I1014 HydrophobicContact CZ-CB 4.16Å; F1002-I1014 HydrophobicContact CZ-CD1 3.76Å; F1002-I1014 HydrophobicContact CZ-CG1 3.64Å; F1002-I1014 HydrophobicContact CZ-CG2 3.76Å
1003	R	32.6	Very low	36	Very low	225 Å²	225	152.7 Å²	152.7	85%	0.849	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-107.2	4.6	-175.1	-120.9	178	-173.4	174.4	3.8	116.1	R1000 N1001	R1000-R1003 PolarHBondContact O-N 2.71Å; N1001-R1003 VanDerWaalsContact C-N 3.26Å; N1001-R1003 PolarHBondContact O-N 3.12Å
1004	L	32.4	Very low	35.1	Very low	144 Å²	144	156 Å²	156	75%	0.754	72%	0.724	S	S	*	*	S	Bend	trans	-106	163.1	163.4	-75.1	90.9	0	0	0	110.7	R1006	L1004-R1006 PolarHBondContact O-N 3.02Å
1005	E	31.7	Very low	34.1	Very low	189 Å²	189	152.9 Å²	152.9	88%	0.883	72%	0.718	S	S	*	*	S	Bend	trans	59.6	25.3	176	-55.9	-150.2	128.9	0	0	117.9
1006	R	31.8	Very low	33.6	Very low	244 Å²	244	154.8 Å²	154.8	92%	0.921	72%	0.724	S	S	*	*			trans	-88.5	-2.6	161.4	-134.7	175.9	-163.3	158.6	7.2	114.5	L1004	L1004-R1006 PolarHBondContact O-N 3.02Å
1007	E	39.4	Very low	33.1	Very low	165 Å²	165	150 Å²	150	77%	0.771	71%	0.71	S	S	*	*	S	Bend	trans	-77.6	139.1	157.9	-67.4	-164.1	141.2	0	0	110
1008	K	31.9	Very low	32.8	Very low	194 Å²	194	148.5 Å²	148.5	84%	0.843	70%	0.701	S	S	*	*	S	Bend	trans	68	103.6	-176.6	-55.9	164	-174.5	161.5	0	113.4	R1010	K1008-R1010 PolarHBondContact O-N 3.42Å
1009	G	29.4	Very low	32.5	Very low	87 Å²	87	149.1 Å²	149.1	90%	0.897	71%	0.706	S	S	*	*			trans	-68.8	112.9	-173.4	0	0	0	0	0	115.2
1010	R	30.5	Very low	32.5	Very low	246 Å²	246	146.3 Å²	146.3	93%	0.928	70%	0.699	S	S	*	*			trans	-138	155.3	150.8	-98.6	177.3	173	164.6	-2.2	109.2	K1008	K1008-R1010 PolarHBondContact O-N 3.42Å
1011	R	26.9	Very low	32.7	Very low	256 Å²	256	147.2 Å²	147.2	97%	0.966	71%	0.711	S	S	*	*			trans	-79.6	137.9	171.6	-67.2	178.2	-179	154.7	-0.3	108.9
1012	A	28.9	Very low	33	Very low	97 Å²	97	147.2 Å²	147.2	80%	0.802	71%	0.711	S	S	*	*			trans	-136.6	150.9	169.2	0	0	0	0	0	109.1
1013	E	29.7	Very low	33.2	Very low	163 Å²	163	147.9 Å²	147.9	76%	0.762	73%	0.73	S	S	*	*			trans	-90	170	-179.1	-68.8	170.5	92.5	0	0	111.3
1014	I	33.8	Very low	33.2	Very low	93 Å²	93	145 Å²	145	48%	0.477	73%	0.726	S	S	.	*			trans	-114.1	123.5	-173.6	-58.2	-171.4	0	0	0	110.2	F1002 I1016	F1002-I1014 HydrophobicContact CE1-CD1 3.74Å; F1002-I1014 HydrophobicContact CE1-CG1 3.84Å; F1002-I1014 HydrophobicContact CE2-CG2 4.24Å; F1002-I1014 HydrophobicContact CZ-CB 4.16Å; F1002-I1014 HydrophobicContact CZ-CD1 3.76Å; F1002-I1014 HydrophobicContact CZ-CG1 3.64Å; F1002-I1014 HydrophobicContact CZ-CG2 3.76Å; I1014-I1016 HydrophobicContact CG2-CG1 4.33Å
1015	E	31	Very low	33.4	Very low	118 Å²	118	143.9 Å²	143.9	55%	0.551	73%	0.725	S	S	*	*			trans	-105.9	144.8	172.6	-61	-171.5	154.5	0	0	112.1	T1029	E1015-T1029 HydrophobicContact CG-CG2 4.23Å; E1015-T1029 WeakPolarHBondContact OE1-CB 3.31Å; E1015-T1029 WeakPolarHBondContact OE1-CG2 3.46Å; E1015-T1029 WeakPolarHBondContact OE2-CG2 3.29Å
1016	I	38.4	Very low	33.3	Very low	88 Å²	88	138 Å²	138	45%	0.451	71%	0.705	S	S	.	*			trans	-133.3	83.2	-170.2	-53.6	169.8	0	0	0	108.5	I1014 L1028 P1030	I1014-I1016 HydrophobicContact CG2-CG1 4.33Å; I1016-L1028 CarbonylContact C-O 3.53Å; I1016-P1030 HydrophobicContact CB-CG 4.03Å; I1016-P1030 HydrophobicContact CD1-CG 4.23Å; I1016-P1030 HydrophobicContact CG1-CG 4.01Å
1017	L	33.1	Very low	33.2	Very low	82 Å²	82	130.2 Å²	130.2	43%	0.429	69%	0.688	S	S	.	*			trans	-67.2	142.7	179.7	-72.5	82.2	0	0	0	111.9	V1025 L1028	L1017-V1025 HydrophobicContact CD2-CG1 3.67Å; L1017-L1028 WeakPolarHBondContact CA-O 3.5Å
1018	M	32.2	Very low	33	Very low	69 Å²	69	126.7 Å²	126.7	34%	0.34	67%	0.673	S	S	.	*			trans	-115.1	129.9	162.9	-66.9	-157	-174.8	0	0	110.3	I1184	M1018-I1184 HydrophobicContact CE-CB 4.3Å; M1018-I1184 HydrophobicContact CE-CD1 3.65Å; M1018-I1184 HydrophobicContact CE-CG1 3.86Å
1019	P	33.2	Very low	33.1	Very low	95 Å²	95	119.2 Å²	119.2	62%	0.617	64%	0.644	S	S	*	*			trans	-78.5	137.9	174.4	32.1	-33.2	0	0	0	111
1020	T	34.5	Very low	33.6	Very low	87 Å²	87	117.6 Å²	117.6	53%	0.534	62%	0.618	S	S	.	*			trans	-90.6	172.3	167	53.8	0	0	0	0	110.7	N1022	T1020-N1022 PolarHBondContact O-N 3.22Å; T1020-N1022 VanDerWaalsContact O-N 3.14Å
1021	Q	40.1	Very low	33.9	Very low	200 Å²	200	112.9 Å²	112.9	94%	0.935	60%	0.6	S	S	*	*	S	Bend	trans	-74.7	-2	-165.9	-134.4	171.9	8.6	0	0	115.6
1022	N	36.9	Very low	34.6	Very low	137 Å²	137	104.1 Å²	104.1	73%	0.733	58%	0.578	S	S	*	*	S	Bend	trans	-121.1	151	173.5	-74.1	-33.3	0	0	0	109.7	T1020 E1024	T1020-N1022 PolarHBondContact O-N 3.22Å; T1020-N1022 VanDerWaalsContact O-N 3.14Å; N1022-E1024 PolarHBondContact O-N 3.35Å
1023	S	39.4	Very low	35.3	Very low	127 Å²	127	101.3 Å²	101.3	89%	0.888	56%	0.559	S	S	*	*	S	Bend	trans	-77.8	45.3	-166.8	60.2	0	0	0	0	115.7
1024	E	33.1	Very low	36.3	Very low	165 Å²	165	97.4 Å²	97.4	77%	0.771	54%	0.541	S	S	*	.			trans	-117.5	103.5	167.5	-70.3	-167.3	148.8	0	0	109.5	N1022 S1026	N1022-E1024 PolarHBondContact O-N 3.35Å; E1024-S1026 VanDerWaalsContact C-N 3.26Å; E1024-S1026 PolarHBondContact O-N 2.93Å
1025	V	35.3	Very low	37.5	Very low	120 Å²	120	95.4 Å²	95.4	73%	0.727	53%	0.527	S	S	*	.			trans	-73.3	82.3	-179.2	-175.8	0	0	0	0	109.7	L1017 S1027	L1017-V1025 HydrophobicContact CD2-CG1 3.67Å; V1025-S1027 PolarHBondContact O-N 2.95Å
1026	S	30	Very low	39	Very low	66 Å²	66	90.7 Å²	90.7	46%	0.462	50%	0.504	S	S	.	.			trans	-72	121.1	164.5	39.9	0	0	0	0	108.7	E1024 L1028	E1024-S1026 VanDerWaalsContact C-N 3.26Å; E1024-S1026 PolarHBondContact O-N 2.93Å; S1026-L1028 PolarHBondContact O-N 2.84Å
1027	S	29.1	Very low	40.1	Very low	80 Å²	80	91.9 Å²	91.9	56%	0.559	51%	0.512	S	S	*	.			trans	-69.4	93.3	179.9	47.4	0	0	0	0	110.6	V1025 T1029	V1025-S1027 PolarHBondContact O-N 2.95Å; S1027-T1029 PolarHBondContact O-N 3.32Å
1028	L	36.1	Very low	42	Very low	90 Å²	90	91.9 Å²	91.9	47%	0.471	51%	0.508	S	S	.	.			trans	-67.9	78.8	154.5	-90.1	84.3	0	0	0	108.1	I1016 L1017 S1026	I1016-L1028 CarbonylContact C-O 3.53Å; L1017-L1028 WeakPolarHBondContact CA-O 3.5Å; S1026-L1028 PolarHBondContact O-N 2.84Å
1029	T	34.3	Very low	44.1	Very low	37 Å²	37	91.3 Å²	91.3	23%	0.227	52%	0.52	C	S	.	.			trans	-59.3	131.8	156.3	76.7	0	0	0	0	106.1	E1015 S1027 R1031	E1015-T1029 HydrophobicContact CG-CG2 4.23Å; E1015-T1029 WeakPolarHBondContact OE1-CB 3.31Å; E1015-T1029 WeakPolarHBondContact OE1-CG2 3.46Å; E1015-T1029 WeakPolarHBondContact OE2-CG2 3.29Å; S1027-T1029 PolarHBondContact O-N 3.32Å; T1029-R1031 WeakPolarHBondContact O-CG 3.45Å; T1029-R1031 PolarHBondContact O-N 3Å
1030	P	38.5	Very low	46.5	Very low	54 Å²	54	90.9 Å²	90.9	35%	0.351	51%	0.506	S	S	.	.			trans	-63	96.4	166.8	26.5	-33.9	0	0	0	105.1	I1016 S1032	I1016-P1030 HydrophobicContact CB-CG 4.03Å; I1016-P1030 HydrophobicContact CD1-CG 4.23Å; I1016-P1030 HydrophobicContact CG1-CG 4.01Å; P1030-S1032 VanDerWaalsContact C-N 3.27Å; P1030-S1032 WeakPolarHBondContact O-CA 3.46Å; P1030-S1032 PolarHBondContact O-N 3.18Å
1031	R	36.8	Very low	48.8	Very low	146 Å²	146	87.2 Å²	87.2	55%	0.551	48%	0.483	S	S	*	.			trans	-60.7	82.8	-159.1	-85	167	160	-146.7	10.2	111.6	T1029 G1033 Q1034	T1029-R1031 WeakPolarHBondContact O-CG 3.45Å; T1029-R1031 PolarHBondContact O-N 3Å; R1031-G1033 PolarHBondContact O-N 3.23Å; R1031-Q1034 HydrophobicContact CB-CB 3.81Å; R1031-Q1034 HydrophobicContact CB-CG 3.73Å; R1031-Q1034 VanDerWaalsContact CD-OE1 3.26Å; R1031-Q1034 HydrophobicContact CG-CG 4.25Å; R1031-Q1034 WeakPolarHBondContact O-CB 3.44Å; R1031-Q1034 PolarHBondContact O-N 2.92Å
1032	S	41.5	Very low	50.9	Low	72 Å²	72	84.1 Å²	84.1	50%	0.503	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	116.9	-165.2	47.2	0	0	0	0	110.4	P1030 Q1034	P1030-S1032 VanDerWaalsContact C-N 3.27Å; P1030-S1032 WeakPolarHBondContact O-CA 3.46Å; P1030-S1032 PolarHBondContact O-N 3.18Å; S1032-Q1034 VanDerWaalsContact C-N 3.27Å; S1032-Q1034 PolarHBondContact O-N 2.87Å
1033	G	45.5	Very low	53.3	Low	39 Å²	39	83.6 Å²	83.6	40%	0.402	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	13.3	-174.8	0	0	0	0	0	115	R1031	R1031-G1033 PolarHBondContact O-N 3.23Å
1034	Q	50.7	Low	55.6	Low	81 Å²	81	78.2 Å²	78.2	38%	0.379	42%	0.416	S	S	.	.			trans	-68.6	167.8	163.8	-76.3	-157.6	14	0	0	112	R1031 S1032 D1098	R1031-Q1034 HydrophobicContact CB-CB 3.81Å; R1031-Q1034 HydrophobicContact CB-CG 3.73Å; R1031-Q1034 VanDerWaalsContact CD-OE1 3.26Å; R1031-Q1034 HydrophobicContact CG-CG 4.25Å; R1031-Q1034 WeakPolarHBondContact O-CB 3.44Å; R1031-Q1034 PolarHBondContact O-N 2.92Å; S1032-Q1034 VanDerWaalsContact C-N 3.27Å; S1032-Q1034 PolarHBondContact O-N 2.87Å; Q1034-D1098 PolarHBondContact O-N 3.12Å
1035	W	58.2	Low	58.3	Low	50 Å²	50	73.2 Å²	73.2	19%	0.189	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-100.3	126.7	-169.9	-172.5	97.1	0	0	0	108.7	N1037 N1041 Y1042 L1045 V1096	W1035-N1037 PolarHBondContact O-N 2.85Å; W1035-N1041 VanDerWaalsContact CH2-C 3.49Å; W1035-N1041 HydrophobicContact CH2-CB 3.44Å; W1035-N1041 VanDerWaalsContact CH2-CB 3.44Å; W1035-N1041 VanDerWaalsContact CZ2-C 3.4Å; W1035-N1041 HydrophobicContact CZ2-CB 3.55Å; W1035-N1041 WeakPolarHBondContact CZ2-O 3.13Å; W1035-N1041 HydrophobicContact CZ3-CB 4.13Å; W1035-Y1042 HydrophobicContact CE3-CE1 4.36Å; W1035-Y1042 AromaticContact CH2-CD1 3.38Å; W1035-Y1042 HydrophobicContact CH2-CD1 3.38Å; W1035-Y1042 AromaticContact CH2-CD2 3.54Å; W1035-Y1042 HydrophobicContact CH2-CD2 3.54Å; W1035-Y1042 AromaticContact CH2-CE1 3.47Å; W1035-Y1042 HydrophobicContact CH2-CE1 3.47Å; W1035-Y1042 VanDerWaalsContact CH2-CE1 3.47Å; W1035-Y1042 AromaticContact CH2-CE2 3.64Å; W1035-Y1042 HydrophobicContact CH2-CE2 3.64Å; W1035-Y1042 AromaticContact CH2-CG 3.4Å; W1035-Y1042 HydrophobicContact CH2-CG 3.4Å; W1035-Y1042 VanDerWaalsContact CH2-CG 3.4Å; W1035-Y1042 AromaticContact CH2-CZ 3.59Å; W1035-Y1042 VanDerWaalsContact CH2-N 3.3Å; W1035-Y1042 AromaticContact CZ2-CD1 3.93Å; W1035-Y1042 HydrophobicContact CZ2-CD1 3.93Å; W1035-Y1042 HydrophobicContact CZ2-CE1 4.16Å; W1035-Y1042 HydrophobicContact CZ2-CG 4.2Å; W1035-Y1042 HydrophobicContact CZ3-CD1 4Å; W1035-Y1042 AromaticContact CZ3-CD2 3.88Å; W1035-Y1042 HydrophobicContact CZ3-CD2 3.88Å; W1035-Y1042 AromaticContact CZ3-CE1 3.59Å; W1035-Y1042 HydrophobicContact CZ3-CE1 3.59Å; W1035-Y1042 AromaticContact CZ3-CE2 3.47Å; W1035-Y1042 HydrophobicContact CZ3-CE2 3.47Å; W1035-Y1042 VanDerWaalsContact CZ3-CE2 3.47Å; W1035-Y1042 HydrophobicContact CZ3-CG 4.12Å; W1035-Y1042 AromaticContact CZ3-CZ 3.29Å; W1035-L1045 HydrophobicContact CZ2-CB 4.47Å; W1035-L1045 HydrophobicContact CZ2-CD1 4.31Å; W1035-L1045 VanDerWaalsContact NE1-CD1 3.3Å; W1035-V1096 HydrophobicContact CZ2-CG1 4.28Å
1036	R	62.3	Low	60.9	Low	19 Å²	19	71.8 Å²	71.8	7%	0.072	39%	0.386	C	S	.	.			trans	-65.6	108.7	-172.8	-77.4	179.7	162.9	-171.8	-2.7	111.2	F1038 N1041 D1098 Y1252 D1256	R1036-F1038 HydrophobicContact CB-CD2 4.2Å; R1036-F1038 PolarHBondContact O-N 3.4Å; R1036-N1041 VanDerWaalsContact CB-ND2 3.31Å; R1036-N1041 WeakPolarHBondContact CB-ND2 3.46Å; R1036-N1041 PolarHBondContact O-ND2 2.92Å; R1036-D1098 WeakPolarHBondContact CG-OD1 3.37Å; R1036-D1098 WeakPolarHBondContact CG-OD2 3.37Å; R1036-D1098 IonicContact CZ-OD1 3.63Å; R1036-D1098 IonicContact NE-OD1 4Å; R1036-D1098 PolarHBondContact NE-OD1 3.08Å; R1036-D1098 IonicContact NH2-OD1 3.7Å; R1036-D1098 PolarHBondContact NH2-OD1 3.01Å; R1036-Y1252 PolarHBondContact NH2-OH 2.86Å; R1036-Y1252 VanDerWaalsContact NH2-OH 3.11Å; R1036-D1256 IonicContact CZ-OD2 3.73Å; R1036-D1256 IonicContact NH1-OD2 2.91Å; R1036-D1256 PolarHBondContact NH1-OD2 2.87Å
1037	N	61.8	Low	63.9	Low	113 Å²	113	70.5 Å²	70.5	60%	0.604	38%	0.375	S	S	*	.			trans	-70.4	34.3	-174.1	-80.5	-25.9	0	0	0	116.2	W1035 Y1042	W1035-N1037 PolarHBondContact O-N 2.85Å; N1037-Y1042 PolarHBondContact OD1-OH 3.31Å
1038	F	72	Confident	66.8	Low	83 Å²	83	66.9 Å²	66.9	36%	0.364	35%	0.349	S	S	.	.			trans	-81.3	135.1	166.1	-63.3	-74.3	0	0	0	110.3	R1036 W1040 N1041 P1253	R1036-F1038 HydrophobicContact CB-CD2 4.2Å; R1036-F1038 PolarHBondContact O-N 3.4Å; F1038-W1040 HydrophobicContact CB-CD2 3.77Å; F1038-W1040 HydrophobicContact CB-CE3 4.31Å; F1038-W1040 HydrophobicContact CB-CG 4.23Å; F1038-W1040 HydrophobicContact CB-CH2 4.13Å; F1038-W1040 HydrophobicContact CB-CZ2 3.56Å; F1038-W1040 HydrophobicContact CB-CZ3 4.47Å; F1038-W1040 AromaticContact CD1-CH2 3.49Å; F1038-W1040 HydrophobicContact CD1-CH2 3.49Å; F1038-W1040 VanDerWaalsContact CD1-CH2 3.49Å; F1038-W1040 AromaticContact CD1-CZ2 3.45Å; F1038-W1040 HydrophobicContact CD1-CZ2 3.45Å; F1038-W1040 VanDerWaalsContact CD1-CZ2 3.45Å; F1038-W1040 HydrophobicContact CD1-CZ3 4.25Å; F1038-W1040 AromaticContact CD2-CZ2 3.89Å; F1038-W1040 HydrophobicContact CD2-CZ2 3.89Å; F1038-W1040 HydrophobicContact CE1-CH2 4.04Å; F1038-W1040 HydrophobicContact CE1-CZ2 4.06Å; F1038-W1040 HydrophobicContact CE2-CZ2 4.44Å; F1038-W1040 HydrophobicContact CG-CD2 4.5Å; F1038-W1040 AromaticContact CG-CE2 3.69Å; F1038-W1040 AromaticContact CG-CH2 3.89Å; F1038-W1040 HydrophobicContact CG-CH2 3.89Å; F1038-W1040 AromaticContact CG-CZ2 3.35Å; F1038-W1040 HydrophobicContact CG-CZ2 3.35Å; F1038-W1040 PolarHBondContact O-N 2.92Å; F1038-W1040 VanDerWaalsContact O-N 3.1Å; F1038-N1041 WeakPolarHBondContact O-CB 3.26Å; F1038-N1041 PolarHBondContact O-N 2.68Å; F1038-P1253 HydrophobicContact CZ-CG 4.42Å
1039	G	78	Confident	69.5	Low	56 Å²	56	64.9 Å²	64.9	58%	0.577	34%	0.342	S	S	*	.	H	α-helix	trans	-55.1	-34.1	-176.1	0	0	0	0	0	114.6	N1041 Y1042	G1039-N1041 VanDerWaalsContact C-N 3.25Å; G1039-N1041 PolarHBondContact O-N 2.83Å; G1039-Y1042 PolarHBondContact O-N 3.07Å
1040	W	82.2	Confident	72.3	Confident	87 Å²	87	66.5 Å²	66.5	33%	0.33	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-24.8	177.3	56.9	71.1	0	0	0	113.7	F1038 Y1042 F1043 F1044 Y1254	F1038-W1040 HydrophobicContact CB-CD2 3.77Å; F1038-W1040 HydrophobicContact CB-CE3 4.31Å; F1038-W1040 HydrophobicContact CB-CG 4.23Å; F1038-W1040 HydrophobicContact CB-CH2 4.13Å; F1038-W1040 HydrophobicContact CB-CZ2 3.56Å; F1038-W1040 HydrophobicContact CB-CZ3 4.47Å; F1038-W1040 AromaticContact CD1-CH2 3.49Å; F1038-W1040 HydrophobicContact CD1-CH2 3.49Å; F1038-W1040 VanDerWaalsContact CD1-CH2 3.49Å; F1038-W1040 AromaticContact CD1-CZ2 3.45Å; F1038-W1040 HydrophobicContact CD1-CZ2 3.45Å; F1038-W1040 VanDerWaalsContact CD1-CZ2 3.45Å; F1038-W1040 HydrophobicContact CD1-CZ3 4.25Å; F1038-W1040 AromaticContact CD2-CZ2 3.89Å; F1038-W1040 HydrophobicContact CD2-CZ2 3.89Å; F1038-W1040 HydrophobicContact CE1-CH2 4.04Å; F1038-W1040 HydrophobicContact CE1-CZ2 4.06Å; F1038-W1040 HydrophobicContact CE2-CZ2 4.44Å; F1038-W1040 HydrophobicContact CG-CD2 4.5Å; F1038-W1040 AromaticContact CG-CE2 3.69Å; F1038-W1040 AromaticContact CG-CH2 3.89Å; F1038-W1040 HydrophobicContact CG-CH2 3.89Å; F1038-W1040 AromaticContact CG-CZ2 3.35Å; F1038-W1040 HydrophobicContact CG-CZ2 3.35Å; F1038-W1040 PolarHBondContact O-N 2.92Å; F1038-W1040 VanDerWaalsContact O-N 3.1Å; W1040-Y1042 VanDerWaalsContact C-N 3.33Å; W1040-Y1042 PolarHBondContact O-N 3.49Å; W1040-F1043 WeakPolarHBondContact O-CB 3.31Å; W1040-F1043 PolarHBondContact O-N 2.86Å; W1040-F1044 HydrophobicContact CB-CD2 4.38Å; W1040-F1044 HydrophobicContact CB-CE2 3.9Å; W1040-F1044 HydrophobicContact CB-CZ 4.37Å; W1040-F1044 AromaticContact CD1-CD2 3.96Å; W1040-F1044 AromaticContact CD1-CE2 3.56Å; W1040-F1044 HydrophobicContact CG-CE2 4.01Å; W1040-F1044 WeakPolarHBondContact O-CD2 3.17Å; W1040-F1044 VanDerWaalsContact O-CG 3.3Å; W1040-F1044 WeakPolarHBondContact O-CG 3.42Å; W1040-F1044 PolarHBondContact O-N 3.01Å; W1040-Y1254 AromaticContact CH2-CD1 3.95Å; W1040-Y1254 HydrophobicContact CH2-CD1 3.95Å; W1040-Y1254 AromaticContact CH2-CE1 3.58Å; W1040-Y1254 HydrophobicContact CH2-CE1 3.58Å; W1040-Y1254 HydrophobicContact CZ2-CD1 4.26Å; W1040-Y1254 HydrophobicContact CZ2-CE1 4.34Å; W1040-Y1254 HydrophobicContact CZ3-CD1 4.49Å; W1040-Y1254 HydrophobicContact CZ3-CE1 4Å
1041	N	82.8	Confident	74.9	Confident	9 Å²	9	65.2 Å²	65.2	5%	0.048	34%	0.343	C	S	.	.	H	α-helix	trans	-70.2	-29.7	178.1	-72.5	-20.6	0	0	0	112.3	W1035 R1036 F1038 G1039 F1044 L1045 V1096	W1035-N1041 VanDerWaalsContact CH2-C 3.49Å; W1035-N1041 HydrophobicContact CH2-CB 3.44Å; W1035-N1041 VanDerWaalsContact CH2-CB 3.44Å; W1035-N1041 VanDerWaalsContact CZ2-C 3.4Å; W1035-N1041 HydrophobicContact CZ2-CB 3.55Å; W1035-N1041 WeakPolarHBondContact CZ2-O 3.13Å; W1035-N1041 HydrophobicContact CZ3-CB 4.13Å; R1036-N1041 VanDerWaalsContact CB-ND2 3.31Å; R1036-N1041 WeakPolarHBondContact CB-ND2 3.46Å; R1036-N1041 PolarHBondContact O-ND2 2.92Å; F1038-N1041 WeakPolarHBondContact O-CB 3.26Å; F1038-N1041 PolarHBondContact O-N 2.68Å; G1039-N1041 VanDerWaalsContact C-N 3.25Å; G1039-N1041 PolarHBondContact O-N 2.83Å; N1041-F1044 PolarHBondContact O-N 2.87Å; N1041-L1045 VanDerWaalsContact O-CB 3.27Å; N1041-L1045 WeakPolarHBondContact O-CB 3.4Å; N1041-L1045 PolarHBondContact O-N 2.99Å; N1041-V1096 HydrophobicContact CB-CG1 4.1Å
1042	Y	84.6	Confident	77.6	Confident	136 Å²	136	59.6 Å²	59.6	53%	0.533	32%	0.324	S	S	.	.	H	α-helix	trans	-66.8	-45	175.1	-71.9	-70.8	0	0	0	109.6	W1035 N1037 G1039 W1040 L1045 V1046	W1035-Y1042 HydrophobicContact CE3-CE1 4.36Å; W1035-Y1042 AromaticContact CH2-CD1 3.38Å; W1035-Y1042 HydrophobicContact CH2-CD1 3.38Å; W1035-Y1042 AromaticContact CH2-CD2 3.54Å; W1035-Y1042 HydrophobicContact CH2-CD2 3.54Å; W1035-Y1042 AromaticContact CH2-CE1 3.47Å; W1035-Y1042 HydrophobicContact CH2-CE1 3.47Å; W1035-Y1042 VanDerWaalsContact CH2-CE1 3.47Å; W1035-Y1042 AromaticContact CH2-CE2 3.64Å; W1035-Y1042 HydrophobicContact CH2-CE2 3.64Å; W1035-Y1042 AromaticContact CH2-CG 3.4Å; W1035-Y1042 HydrophobicContact CH2-CG 3.4Å; W1035-Y1042 VanDerWaalsContact CH2-CG 3.4Å; W1035-Y1042 AromaticContact CH2-CZ 3.59Å; W1035-Y1042 VanDerWaalsContact CH2-N 3.3Å; W1035-Y1042 AromaticContact CZ2-CD1 3.93Å; W1035-Y1042 HydrophobicContact CZ2-CD1 3.93Å; W1035-Y1042 HydrophobicContact CZ2-CE1 4.16Å; W1035-Y1042 HydrophobicContact CZ2-CG 4.2Å; W1035-Y1042 HydrophobicContact CZ3-CD1 4Å; W1035-Y1042 AromaticContact CZ3-CD2 3.88Å; W1035-Y1042 HydrophobicContact CZ3-CD2 3.88Å; W1035-Y1042 AromaticContact CZ3-CE1 3.59Å; W1035-Y1042 HydrophobicContact CZ3-CE1 3.59Å; W1035-Y1042 AromaticContact CZ3-CE2 3.47Å; W1035-Y1042 HydrophobicContact CZ3-CE2 3.47Å; W1035-Y1042 VanDerWaalsContact CZ3-CE2 3.47Å; W1035-Y1042 HydrophobicContact CZ3-CG 4.12Å; W1035-Y1042 AromaticContact CZ3-CZ 3.29Å; N1037-Y1042 PolarHBondContact OD1-OH 3.31Å; G1039-Y1042 PolarHBondContact O-N 3.07Å; W1040-Y1042 VanDerWaalsContact C-N 3.33Å; W1040-Y1042 PolarHBondContact O-N 3.49Å; Y1042-L1045 PolarHBondContact O-N 3.04Å; Y1042-V1046 WeakPolarHBondContact O-CG2 3.49Å; Y1042-V1046 PolarHBondContact O-N 3.02Å
1043	F	88.2	Confident	80.1	Confident	125 Å²	125	61.6 Å²	61.6	55%	0.548	33%	0.329	S	S	.	.	H	α-helix	trans	-58.1	-51.6	173.3	174.1	-98.5	0	0	0	111.6	W1040 L1045 V1046 V1047	W1040-F1043 WeakPolarHBondContact O-CB 3.31Å; W1040-F1043 PolarHBondContact O-N 2.86Å; F1043-L1045 VanDerWaalsContact C-N 3.35Å; F1043-L1045 PolarHBondContact O-N 3.27Å; F1043-V1046 PolarHBondContact O-N 2.84Å; F1043-V1047 HydrophobicContact CD1-CG2 4.5Å; F1043-V1047 HydrophobicContact CD2-CG2 4.23Å; F1043-V1047 HydrophobicContact CE1-CG2 4.2Å; F1043-V1047 HydrophobicContact CE2-CG2 3.92Å; F1043-V1047 HydrophobicContact CZ-CG2 3.9Å; F1043-V1047 WeakPolarHBondContact O-CB 3.5Å; F1043-V1047 VanDerWaalsContact O-CG2 3.3Å; F1043-V1047 WeakPolarHBondContact O-CG2 3.36Å; F1043-V1047 PolarHBondContact O-N 2.79Å
1044	F	87.8	Confident	82.3	Confident	14 Å²	14	64 Å²	64	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-61.9	-38.3	178.3	-64.6	-41.4	0	0	0	113.2	W1040 N1041 N1048 A1257 V1260 I1261 F1264	W1040-F1044 HydrophobicContact CB-CD2 4.38Å; W1040-F1044 HydrophobicContact CB-CE2 3.9Å; W1040-F1044 HydrophobicContact CB-CZ 4.37Å; W1040-F1044 AromaticContact CD1-CD2 3.96Å; W1040-F1044 AromaticContact CD1-CE2 3.56Å; W1040-F1044 HydrophobicContact CG-CE2 4.01Å; W1040-F1044 WeakPolarHBondContact O-CD2 3.17Å; W1040-F1044 VanDerWaalsContact O-CG 3.3Å; W1040-F1044 WeakPolarHBondContact O-CG 3.42Å; W1040-F1044 PolarHBondContact O-N 3.01Å; N1041-F1044 PolarHBondContact O-N 2.87Å; F1044-N1048 WeakPolarHBondContact O-CB 3.25Å; F1044-N1048 PolarHBondContact O-N 3.31Å; F1044-A1257 HydrophobicContact CE2-CB 3.76Å; F1044-A1257 HydrophobicContact CZ-CB 4.23Å; F1044-V1260 HydrophobicContact CB-CG1 3.96Å; F1044-V1260 HydrophobicContact CD1-CG1 4.02Å; F1044-V1260 HydrophobicContact CD2-CG1 4.19Å; F1044-V1260 HydrophobicContact CG-CG1 3.81Å; F1044-I1261 HydrophobicContact CE1-CD1 4.24Å; F1044-I1261 HydrophobicContact CE1-CG1 3.8Å; F1044-I1261 HydrophobicContact CZ-CD1 3.91Å; F1044-I1261 HydrophobicContact CZ-CG1 3.88Å; F1044-F1264 AromaticContact CD1-CE2 3.89Å; F1044-F1264 HydrophobicContact CD1-CE2 3.89Å; F1044-F1264 HydrophobicContact CD1-CZ 4.43Å; F1044-F1264 HydrophobicContact CE1-CE2 4.21Å; F1044-F1264 HydrophobicContact CE1-CZ 4.3Å
1045	L	87.8	Confident	84.3	Confident	61 Å²	61	60.1 Å²	60.1	32%	0.319	31%	0.313	S	S	.	.	H	α-helix	trans	-67.8	-41.9	178	-173.9	149.7	0	0	0	111.7	W1035 N1041 Y1042 F1043 S1049	W1035-L1045 HydrophobicContact CZ2-CB 4.47Å; W1035-L1045 HydrophobicContact CZ2-CD1 4.31Å; W1035-L1045 VanDerWaalsContact NE1-CD1 3.3Å; N1041-L1045 VanDerWaalsContact O-CB 3.27Å; N1041-L1045 WeakPolarHBondContact O-CB 3.4Å; N1041-L1045 PolarHBondContact O-N 2.99Å; Y1042-L1045 PolarHBondContact O-N 3.04Å; F1043-L1045 VanDerWaalsContact C-N 3.35Å; F1043-L1045 PolarHBondContact O-N 3.27Å; L1045-S1049 VanDerWaalsContact O-CB 3.22Å; L1045-S1049 WeakPolarHBondContact O-CB 3.49Å; L1045-S1049 PolarHBondContact O-N 3.4Å; L1045-S1049 PolarHBondContact O-OG 3.15Å
1046	V	91.3	Very high	86	Confident	90 Å²	90	61.9 Å²	61.9	55%	0.545	33%	0.326	S	S	.	.	H	α-helix	trans	-67.5	-43.1	176.7	172.5	0	0	0	0	111.1	Y1042 F1043 S1049 T1050	Y1042-V1046 WeakPolarHBondContact O-CG2 3.49Å; Y1042-V1046 PolarHBondContact O-N 3.02Å; F1043-V1046 PolarHBondContact O-N 2.84Å; V1046-S1049 PolarHBondContact O-OG 2.88Å; V1046-T1050 WeakPolarHBondContact O-CB 3.47Å; V1046-T1050 WeakPolarHBondContact O-CG2 3.39Å; V1046-T1050 PolarHBondContact O-N 2.87Å; V1046-T1050 PolarHBondContact O-OG1 2.9Å
1047	V	91.7	Very high	87.3	Confident	38 Å²	38	63.8 Å²	63.8	23%	0.23	34%	0.343	C	S	.	.	H	α-helix	trans	-64.7	-46.1	175.8	172.9	0	0	0	0	111.1	F1043 T1050 L1051 F1264	F1043-V1047 HydrophobicContact CD1-CG2 4.5Å; F1043-V1047 HydrophobicContact CD2-CG2 4.23Å; F1043-V1047 HydrophobicContact CE1-CG2 4.2Å; F1043-V1047 HydrophobicContact CE2-CG2 3.92Å; F1043-V1047 HydrophobicContact CZ-CG2 3.9Å; F1043-V1047 WeakPolarHBondContact O-CB 3.5Å; F1043-V1047 VanDerWaalsContact O-CG2 3.3Å; F1043-V1047 WeakPolarHBondContact O-CG2 3.36Å; F1043-V1047 PolarHBondContact O-N 2.79Å; V1047-T1050 PolarHBondContact O-OG1 2.92Å; V1047-L1051 HydrophobicContact CG1-CD1 3.8Å; V1047-L1051 WeakPolarHBondContact O-CB 3.25Å; V1047-L1051 WeakPolarHBondContact O-CD1 3.32Å; V1047-L1051 VanDerWaalsContact O-CG 3.24Å; V1047-L1051 WeakPolarHBondContact O-CG 3.23Å; V1047-L1051 PolarHBondContact O-N 3.28Å; V1047-F1264 HydrophobicContact CG1-CD2 3.78Å; V1047-F1264 HydrophobicContact CG1-CE2 3.85Å
1048	N	91	Very high	88.7	Confident	4 Å²	4	59 Å²	59	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-67.1	-43.6	179.6	-165.5	37.8	0	0	0	112.2	F1044 T1050 L1051 V1052 Y1089 F1093	F1044-N1048 WeakPolarHBondContact O-CB 3.25Å; F1044-N1048 PolarHBondContact O-N 3.31Å; N1048-T1050 PolarHBondContact O-N 2.93Å; N1048-L1051 PolarHBondContact O-N 2.82Å; N1048-V1052 WeakPolarHBondContact O-CB 3.43Å; N1048-V1052 VanDerWaalsContact O-CG2 3.3Å; N1048-V1052 WeakPolarHBondContact O-CG2 3.28Å; N1048-V1052 PolarHBondContact O-N 2.89Å; N1048-Y1089 PolarHBondContact ND2-O 3.37Å; N1048-Y1089 VanDerWaalsContact OD1-CD1 3.25Å; N1048-Y1089 WeakPolarHBondContact OD1-CD1 3.35Å; N1048-Y1089 PolarHBondContact OD1-O 3.34Å; N1048-F1093 HydrophobicContact CB-CE1 4.2Å; N1048-F1093 HydrophobicContact CB-CZ 4.31Å; N1048-F1093 WeakPolarHBondContact ND2-CD2 3.31Å; N1048-F1093 VanDerWaalsContact ND2-CE1 3.31Å; N1048-F1093 WeakPolarHBondContact ND2-CE1 3.33Å; N1048-F1093 VanDerWaalsContact ND2-CE2 3.29Å; N1048-F1093 WeakPolarHBondContact ND2-CE2 3.47Å; N1048-F1093 WeakPolarHBondContact ND2-CZ 3.46Å
1049	S	92.1	Very high	89.5	Confident	48 Å²	48	57.4 Å²	57.4	34%	0.336	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-35.2	179.4	58.1	0	0	0	0	113	L1045 V1046 V1052 L1053	L1045-S1049 VanDerWaalsContact O-CB 3.22Å; L1045-S1049 WeakPolarHBondContact O-CB 3.49Å; L1045-S1049 PolarHBondContact O-N 3.4Å; L1045-S1049 PolarHBondContact O-OG 3.15Å; V1046-S1049 PolarHBondContact O-OG 2.88Å; S1049-V1052 PolarHBondContact O-N 3.49Å; S1049-L1053 WeakPolarHBondContact O-CB 2.93Å; S1049-L1053 PolarHBondContact O-N 2.97Å
1050	T	93.3	Very high	90	Very high	71 Å²	71	56.5 Å²	56.5	44%	0.436	30%	0.301	S	S	.	.	H	α-helix	trans	-68.8	-39.9	171.8	49.7	0	0	0	0	112.2	V1046 V1047 N1048 L1053 I1054	V1046-T1050 WeakPolarHBondContact O-CB 3.47Å; V1046-T1050 WeakPolarHBondContact O-CG2 3.39Å; V1046-T1050 PolarHBondContact O-N 2.87Å; V1046-T1050 PolarHBondContact O-OG1 2.9Å; V1047-T1050 PolarHBondContact O-OG1 2.92Å; N1048-T1050 PolarHBondContact O-N 2.93Å; T1050-L1053 PolarHBondContact O-N 2.97Å; T1050-I1054 WeakPolarHBondContact O-CB 3.23Å; T1050-I1054 WeakPolarHBondContact O-CD1 3.21Å; T1050-I1054 VanDerWaalsContact O-CG1 3.24Å; T1050-I1054 WeakPolarHBondContact O-CG1 3.3Å; T1050-I1054 PolarHBondContact O-N 3.47Å
1051	L	93.3	Very high	90.3	Very high	28 Å²	28	55.4 Å²	55.4	15%	0.147	30%	0.301	C	S	.	.	H	α-helix	trans	-65.7	-36.4	173.5	-69.4	168.3	0	0	0	112.8	V1047 N1048 I1054 T1055 Y1089	V1047-L1051 HydrophobicContact CG1-CD1 3.8Å; V1047-L1051 WeakPolarHBondContact O-CB 3.25Å; V1047-L1051 WeakPolarHBondContact O-CD1 3.32Å; V1047-L1051 VanDerWaalsContact O-CG 3.24Å; V1047-L1051 WeakPolarHBondContact O-CG 3.23Å; V1047-L1051 PolarHBondContact O-N 3.28Å; N1048-L1051 PolarHBondContact O-N 2.82Å; L1051-I1054 PolarHBondContact O-N 3.44Å; L1051-T1055 WeakPolarHBondContact O-CG2 3.43Å; L1051-T1055 PolarHBondContact O-N 3.36Å; L1051-T1055 PolarHBondContact O-OG1 3.4Å; L1051-Y1089 HydrophobicContact CB-CD1 4.21Å; L1051-Y1089 HydrophobicContact CB-CE1 3.72Å; L1051-Y1089 HydrophobicContact CB-CE2 4.41Å; L1051-Y1089 HydrophobicContact CD1-CE1 3.73Å; L1051-Y1089 HydrophobicContact CG-CE1 4.27Å
1052	V	93.9	Very high	90.3	Very high	27 Å²	27	56.8 Å²	56.8	16%	0.164	31%	0.308	C	S	.	.	H	α-helix	trans	-64.4	-44.3	170.8	170.3	0	0	0	0	111.1	N1048 S1049 I1054 T1055 L1056 Y1089 F1093	N1048-V1052 WeakPolarHBondContact O-CB 3.43Å; N1048-V1052 VanDerWaalsContact O-CG2 3.3Å; N1048-V1052 WeakPolarHBondContact O-CG2 3.28Å; N1048-V1052 PolarHBondContact O-N 2.89Å; S1049-V1052 PolarHBondContact O-N 3.49Å; V1052-I1054 VanDerWaalsContact C-N 3.35Å; V1052-I1054 PolarHBondContact O-N 2.95Å; V1052-T1055 VanDerWaalsContact CA-OG1 3.32Å; V1052-T1055 WeakPolarHBondContact CA-OG1 3.38Å; V1052-T1055 PolarHBondContact O-N 2.84Å; V1052-T1055 PolarHBondContact O-OG1 2.98Å; V1052-L1056 HydrophobicContact CG1-CD1 3.8Å; V1052-L1056 HydrophobicContact CG1-CG 4.28Å; V1052-L1056 WeakPolarHBondContact O-CB 3.37Å; V1052-L1056 VanDerWaalsContact O-CG 3.31Å; V1052-L1056 WeakPolarHBondContact O-CG 3.36Å; V1052-L1056 PolarHBondContact O-N 2.9Å; V1052-Y1089 HydrophobicContact CG2-CG 4.31Å; V1052-F1093 HydrophobicContact CG2-CE2 4.11Å; V1052-F1093 HydrophobicContact CG2-CZ 4.36Å
1053	L	93.9	Very high	90.4	Very high	115 Å²	115	53.9 Å²	53.9	60%	0.602	30%	0.301	S	S	*	.	H	α-helix	trans	-64.1	-39.6	176.8	-176.5	61.9	0	0	0	112	S1049 T1050 S1057	S1049-L1053 WeakPolarHBondContact O-CB 2.93Å; S1049-L1053 PolarHBondContact O-N 2.97Å; T1050-L1053 PolarHBondContact O-N 2.97Å; L1053-S1057 VanDerWaalsContact O-CB 3.31Å; L1053-S1057 WeakPolarHBondContact O-CB 3.4Å; L1053-S1057 PolarHBondContact O-N 3.4Å; L1053-S1057 PolarHBondContact O-OG 3.12Å
1054	I	92.2	Very high	90.2	Very high	88 Å²	88	54.3 Å²	54.3	45%	0.451	30%	0.303	S	S	.	.	H	α-helix	trans	-63.9	-45.9	174.6	-70.6	161.8	0	0	0	110.8	T1050 L1051 V1052 S1057 V1058 L1271	T1050-I1054 WeakPolarHBondContact O-CB 3.23Å; T1050-I1054 WeakPolarHBondContact O-CD1 3.21Å; T1050-I1054 VanDerWaalsContact O-CG1 3.24Å; T1050-I1054 WeakPolarHBondContact O-CG1 3.3Å; T1050-I1054 PolarHBondContact O-N 3.47Å; L1051-I1054 PolarHBondContact O-N 3.44Å; V1052-I1054 VanDerWaalsContact C-N 3.35Å; V1052-I1054 PolarHBondContact O-N 2.95Å; I1054-S1057 WeakPolarHBondContact O-CB 3.37Å; I1054-S1057 PolarHBondContact O-N 3.18Å; I1054-V1058 WeakPolarHBondContact O-CG2 3.24Å; I1054-V1058 PolarHBondContact O-N 3.15Å; I1054-L1271 HydrophobicContact CG2-CD2 4.37Å
1055	T	91.9	Very high	89.9	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67.6	-41.5	178.7	43.6	0	0	0	0	113.2	L1051 V1052 S1057 V1058 F1059 V1085 L1086 Y1089 L1271	L1051-T1055 WeakPolarHBondContact O-CG2 3.43Å; L1051-T1055 PolarHBondContact O-N 3.36Å; L1051-T1055 PolarHBondContact O-OG1 3.4Å; V1052-T1055 VanDerWaalsContact CA-OG1 3.32Å; V1052-T1055 WeakPolarHBondContact CA-OG1 3.38Å; V1052-T1055 PolarHBondContact O-N 2.84Å; V1052-T1055 PolarHBondContact O-OG1 2.98Å; T1055-S1057 VanDerWaalsContact C-N 3.28Å; T1055-S1057 PolarHBondContact O-N 2.88Å; T1055-V1058 PolarHBondContact O-N 3.4Å; T1055-F1059 WeakPolarHBondContact O-CB 3.25Å; T1055-F1059 PolarHBondContact O-N 2.95Å; T1055-V1085 HydrophobicContact CG2-CG1 3.9Å; T1055-L1086 WeakPolarHBondContact OG1-CD2 3.25Å; T1055-Y1089 HydrophobicContact CG2-CD2 4.08Å; T1055-Y1089 HydrophobicContact CG2-CE2 3.62Å; T1055-L1271 HydrophobicContact CG2-CD1 3.84Å; T1055-L1271 HydrophobicContact CG2-CD2 3.47Å; T1055-L1271 VanDerWaalsContact CG2-CD2 3.47Å; T1055-L1271 HydrophobicContact CG2-CG 4.22Å
1056	L	93.2	Very high	89.5	Confident	87 Å²	87	55.3 Å²	55.3	46%	0.455	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-36.2	172.3	-71	173.4	0	0	0	111.8	V1052 F1059 G1060 L1086	V1052-L1056 HydrophobicContact CG1-CD1 3.8Å; V1052-L1056 HydrophobicContact CG1-CG 4.28Å; V1052-L1056 WeakPolarHBondContact O-CB 3.37Å; V1052-L1056 VanDerWaalsContact O-CG 3.31Å; V1052-L1056 WeakPolarHBondContact O-CG 3.36Å; V1052-L1056 PolarHBondContact O-N 2.9Å; L1056-F1059 WeakPolarHBondContact O-CB 3.33Å; L1056-F1059 PolarHBondContact O-N 3.43Å; L1056-G1060 PolarHBondContact O-N 3.04Å; L1056-L1086 HydrophobicContact CD2-CD1 4.18Å; L1056-L1086 HydrophobicContact CD2-CD2 3.83Å; L1056-L1086 HydrophobicContact CG-CD2 4Å
1057	S	90.8	Very high	88.9	Confident	60 Å²	60	54.6 Å²	54.6	42%	0.42	31%	0.309	S	S	.	.	H	α-helix	trans	-65.4	-44.1	173.3	-59.7	0	0	0	0	111.7	L1053 I1054 T1055 F1059 G1060 I1061	L1053-S1057 VanDerWaalsContact O-CB 3.31Å; L1053-S1057 WeakPolarHBondContact O-CB 3.4Å; L1053-S1057 PolarHBondContact O-N 3.4Å; L1053-S1057 PolarHBondContact O-OG 3.12Å; I1054-S1057 WeakPolarHBondContact O-CB 3.37Å; I1054-S1057 PolarHBondContact O-N 3.18Å; T1055-S1057 VanDerWaalsContact C-N 3.28Å; T1055-S1057 PolarHBondContact O-N 2.88Å; S1057-F1059 VanDerWaalsContact C-N 3.34Å; S1057-F1059 PolarHBondContact O-N 3.46Å; S1057-G1060 PolarHBondContact O-N 3.29Å; S1057-I1061 WeakPolarHBondContact O-CB 3.35Å; S1057-I1061 WeakPolarHBondContact O-CD1 3.43Å; S1057-I1061 WeakPolarHBondContact O-CG1 3.32Å; S1057-I1061 PolarHBondContact O-N 3.44Å
1058	V	90	Very high	88.2	Confident	13 Å²	13	55.9 Å²	55.9	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-62.5	-40.5	173.7	169.9	0	0	0	0	111.2	I1054 T1055 I1061 I1062 L1082 F1275 L1279	I1054-V1058 WeakPolarHBondContact O-CG2 3.24Å; I1054-V1058 PolarHBondContact O-N 3.15Å; T1055-V1058 PolarHBondContact O-N 3.4Å; V1058-I1061 PolarHBondContact O-N 3.02Å; V1058-I1062 HydrophobicContact CG1-CD1 3.75Å; V1058-I1062 WeakPolarHBondContact O-CB 3.47Å; V1058-I1062 VanDerWaalsContact O-CG1 3.25Å; V1058-I1062 WeakPolarHBondContact O-CG1 3.3Å; V1058-I1062 PolarHBondContact O-N 2.97Å; V1058-L1082 HydrophobicContact CG1-CD1 4.26Å; V1058-F1275 HydrophobicContact CG1-CB 4.45Å; V1058-L1279 HydrophobicContact CG2-CD1 4.44Å; V1058-L1279 HydrophobicContact CG2-CD2 4.32Å
1059	F	90.1	Very high	87.1	Confident	49 Å²	49	63 Å²	63	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-60.5	-52.1	174.6	-162.9	-129.2	0	0	0	111.2	T1055 L1056 S1057 I1061 I1062 L1063 I1079 L1082	T1055-F1059 WeakPolarHBondContact O-CB 3.25Å; T1055-F1059 PolarHBondContact O-N 2.95Å; L1056-F1059 WeakPolarHBondContact O-CB 3.33Å; L1056-F1059 PolarHBondContact O-N 3.43Å; S1057-F1059 VanDerWaalsContact C-N 3.34Å; S1057-F1059 PolarHBondContact O-N 3.46Å; F1059-I1061 PolarHBondContact O-N 3.48Å; F1059-I1062 PolarHBondContact O-N 3.43Å; F1059-I1062 VanDerWaalsContact O-N 3.16Å; F1059-L1063 HydrophobicContact CD1-CD1 3.77Å; F1059-L1063 HydrophobicContact CD1-CG 4.46Å; F1059-L1063 HydrophobicContact CE1-CD1 3.67Å; F1059-L1063 HydrophobicContact CE1-CG 4.45Å; F1059-L1063 HydrophobicContact CG-CD1 4.3Å; F1059-L1063 HydrophobicContact CZ-CD1 4.13Å; F1059-L1063 WeakPolarHBondContact O-CB 3.3Å; F1059-L1063 WeakPolarHBondContact O-CG 3.37Å; F1059-L1063 PolarHBondContact O-N 3.01Å; F1059-I1079 HydrophobicContact CE2-CG2 4.07Å; F1059-L1082 HydrophobicContact CB-CD2 3.45Å; F1059-L1082 VanDerWaalsContact CB-CD2 3.45Å; F1059-L1082 HydrophobicContact CD2-CB 4.39Å; F1059-L1082 HydrophobicContact CD2-CD2 3.48Å; F1059-L1082 VanDerWaalsContact CD2-CD2 3.48Å; F1059-L1082 HydrophobicContact CG-CD2 3.85Å
1060	G	88.4	Confident	85.8	Confident	37 Å²	37	63.3 Å²	63.3	38%	0.381	35%	0.352	S	S	.	.	H	α-helix	trans	-59.8	-41.9	178.4	0	0	0	0	0	112.8	L1056 S1057 L1063 F1064	L1056-G1060 PolarHBondContact O-N 3.04Å; S1057-G1060 PolarHBondContact O-N 3.29Å; G1060-L1063 PolarHBondContact O-N 3.12Å; G1060-F1064 WeakPolarHBondContact O-CB 3.36Å; G1060-F1064 PolarHBondContact O-N 2.96Å
1061	I	87.5	Confident	84.4	Confident	64 Å²	64	62 Å²	62	33%	0.328	34%	0.344	S	S	.	.	H	α-helix	trans	-62.1	-43.3	174.7	-71.4	163.7	0	0	0	111.1	S1057 V1058 F1059 K1065 L1279 L1282	S1057-I1061 WeakPolarHBondContact O-CB 3.35Å; S1057-I1061 WeakPolarHBondContact O-CD1 3.43Å; S1057-I1061 WeakPolarHBondContact O-CG1 3.32Å; S1057-I1061 PolarHBondContact O-N 3.44Å; V1058-I1061 PolarHBondContact O-N 3.02Å; F1059-I1061 PolarHBondContact O-N 3.48Å; I1061-K1065 HydrophobicContact CG2-CG 4.43Å; I1061-K1065 VanDerWaalsContact O-CB 3.22Å; I1061-K1065 WeakPolarHBondContact O-CB 3.42Å; I1061-K1065 WeakPolarHBondContact O-CG 3.4Å; I1061-K1065 PolarHBondContact O-N 2.94Å; I1061-L1279 HydrophobicContact CG2-CD1 4.22Å; I1061-L1282 HydrophobicContact CG2-CD2 3.91Å
1062	I	84.1	Confident	82.6	Confident	37 Å²	37	67.5 Å²	67.5	19%	0.19	37%	0.366	C	S	.	.	H	α-helix	trans	-68.4	-46.2	178.6	-69.5	167.4	0	0	0	110.9	V1058 F1059 K1065 M1066 F1275	V1058-I1062 HydrophobicContact CG1-CD1 3.75Å; V1058-I1062 WeakPolarHBondContact O-CB 3.47Å; V1058-I1062 VanDerWaalsContact O-CG1 3.25Å; V1058-I1062 WeakPolarHBondContact O-CG1 3.3Å; V1058-I1062 PolarHBondContact O-N 2.97Å; F1059-I1062 PolarHBondContact O-N 3.43Å; F1059-I1062 VanDerWaalsContact O-N 3.16Å; I1062-K1065 PolarHBondContact O-N 3.09Å; I1062-M1066 HydrophobicContact CG2-CE 4.16Å; I1062-M1066 HydrophobicContact CG2-SD 4.41Å; I1062-M1066 WeakPolarHBondContact O-CG 3.49Å; I1062-M1066 PolarHBondContact O-N 3.44Å; I1062-F1275 HydrophobicContact CD1-CD1 3.78Å; I1062-F1275 HydrophobicContact CD1-CE1 4Å
1063	L	85.4	Confident	81.2	Confident	75 Å²	75	69 Å²	69	39%	0.393	39%	0.388	S	S	.	.	H	α-helix	trans	-58.2	-49.1	175.4	-70.7	179.2	0	0	0	111.4	F1059 G1060 K1065 M1066 A1067	F1059-L1063 HydrophobicContact CD1-CD1 3.77Å; F1059-L1063 HydrophobicContact CD1-CG 4.46Å; F1059-L1063 HydrophobicContact CE1-CD1 3.67Å; F1059-L1063 HydrophobicContact CE1-CG 4.45Å; F1059-L1063 HydrophobicContact CG-CD1 4.3Å; F1059-L1063 HydrophobicContact CZ-CD1 4.13Å; F1059-L1063 WeakPolarHBondContact O-CB 3.3Å; F1059-L1063 WeakPolarHBondContact O-CG 3.37Å; F1059-L1063 PolarHBondContact O-N 3.01Å; G1060-L1063 PolarHBondContact O-N 3.12Å; L1063-K1065 PolarHBondContact O-N 2.85Å; L1063-M1066 HydrophobicContact CD2-CE 3.75Å; L1063-M1066 PolarHBondContact O-N 2.9Å; L1063-A1067 WeakPolarHBondContact O-CB 3.48Å; L1063-A1067 PolarHBondContact O-N 2.82Å
1064	F	84.6	Confident	80	Confident	134 Å²	134	67 Å²	67	59%	0.588	38%	0.377	S	S	*	.	H	α-helix	trans	-60.3	-44.4	176.7	179.5	-102.2	0	0	0	112	G1060 M1066 A1067 C1068	G1060-F1064 WeakPolarHBondContact O-CB 3.36Å; G1060-F1064 PolarHBondContact O-N 2.96Å; F1064-M1066 VanDerWaalsContact C-N 3.32Å; F1064-M1066 PolarHBondContact O-N 3.12Å; F1064-A1067 PolarHBondContact O-N 3.42Å; F1064-C1068 WeakPolarHBondContact O-CB 3.37Å; F1064-C1068 PolarHBondContact O-N 3.32Å; F1064-C1068 PolarHBondContact O-SG 3.11Å; F1064-C1068 VanDerWaalsContact O-SG 3.39Å
1065	K	81.4	Confident	79.4	Confident	50 Å²	50	65.2 Å²	65.2	22%	0.217	37%	0.367	C	S	.	.	H	α-helix	trans	-70.5	-24.2	178.6	-73.1	-88	-178.3	168.5	0	113.6	I1061 I1062 L1063 V1070 V1071 L1282	I1061-K1065 HydrophobicContact CG2-CG 4.43Å; I1061-K1065 VanDerWaalsContact O-CB 3.22Å; I1061-K1065 WeakPolarHBondContact O-CB 3.42Å; I1061-K1065 WeakPolarHBondContact O-CG 3.4Å; I1061-K1065 PolarHBondContact O-N 2.94Å; I1062-K1065 PolarHBondContact O-N 3.09Å; L1063-K1065 PolarHBondContact O-N 2.85Å; K1065-V1070 HydrophobicContact CB-CB 4.44Å; K1065-V1070 HydrophobicContact CD-CB 3.93Å; K1065-V1070 HydrophobicContact CD-CG1 3.96Å; K1065-V1070 HydrophobicContact CD-CG2 4.01Å; K1065-V1070 WeakPolarHBondContact O-CB 3.31Å; K1065-V1070 PolarHBondContact O-N 3.17Å; K1065-V1071 HydrophobicContact CB-CG2 4.03Å; K1065-V1071 PolarHBondContact O-N 3.42Å; K1065-L1282 HydrophobicContact CB-CD1 4.08Å; K1065-L1282 HydrophobicContact CD-CD1 4.14Å; K1065-L1282 HydrophobicContact CD-CD2 4.19Å; K1065-L1282 HydrophobicContact CD-CG 4.23Å; K1065-L1282 HydrophobicContact CG-CD1 3.98Å; K1065-L1282 HydrophobicContact CG-CD2 4.1Å; K1065-L1282 HydrophobicContact CG-CG 4.4Å
1066	M	78.6	Confident	79.1	Confident	47 Å²	47	66.1 Å²	66.1	23%	0.232	37%	0.374	C	S	.	.	H	α-helix	trans	-75.6	-42.6	167.1	-71.2	-173.5	-52.5	0	0	111.7	I1062 L1063 F1064 C1068 H1069 V1071 Q1075 I1079	I1062-M1066 HydrophobicContact CG2-CE 4.16Å; I1062-M1066 HydrophobicContact CG2-SD 4.41Å; I1062-M1066 WeakPolarHBondContact O-CG 3.49Å; I1062-M1066 PolarHBondContact O-N 3.44Å; L1063-M1066 HydrophobicContact CD2-CE 3.75Å; L1063-M1066 PolarHBondContact O-N 2.9Å; F1064-M1066 VanDerWaalsContact C-N 3.32Å; F1064-M1066 PolarHBondContact O-N 3.12Å; M1066-C1068 VanDerWaalsContact C-N 3.31Å; M1066-C1068 PolarHBondContact O-N 3.2Å; M1066-H1069 WeakPolarHBondContact O-CA 3.37Å; M1066-H1069 PolarHBondContact O-N 3.04Å; M1066-V1071 HydrophobicContact CG-CB 4.22Å; M1066-Q1075 HydrophobicContact SD-CB 3.92Å; M1066-Q1075 HydrophobicContact SD-CG 4.07Å; M1066-I1079 HydrophobicContact CE-CD1 3.68Å; M1066-I1079 HydrophobicContact CE-CG1 4.16Å; M1066-I1079 HydrophobicContact SD-CD1 4.02Å
1067	A	80	Confident	78.8	Confident	74 Å²	74	62.5 Å²	62.5	61%	0.612	36%	0.355	S	S	*	.	H	α-helix	trans	-64	-36.2	178	0	0	0	0	0	112.2	L1063 F1064 H1069	L1063-A1067 WeakPolarHBondContact O-CB 3.48Å; L1063-A1067 PolarHBondContact O-N 2.82Å; F1064-A1067 PolarHBondContact O-N 3.42Å; A1067-H1069 PolarHBondContact O-CD2 3.3Å; A1067-H1069 PolarHBondContact O-N 3.5Å
1068	C	77	Confident	78.7	Confident	65 Å²	65	60.5 Å²	60.5	44%	0.439	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	12.3	170.3	-62.4	0	0	0	0	113.8	F1064 M1066 V1070	F1064-C1068 WeakPolarHBondContact O-CB 3.37Å; F1064-C1068 PolarHBondContact O-N 3.32Å; F1064-C1068 PolarHBondContact O-SG 3.11Å; F1064-C1068 VanDerWaalsContact O-SG 3.39Å; M1066-C1068 VanDerWaalsContact C-N 3.31Å; M1066-C1068 PolarHBondContact O-N 3.2Å; C1068-V1070 HydrophobicContact CB-CG2 3.81Å; C1068-V1070 WeakPolarHBondContact O-CG2 3.35Å; C1068-V1070 PolarHBondContact O-N 2.99Å
1069	H	67.7	Low	78.7	Confident	154 Å²	154	62.3 Å²	62.3	71%	0.713	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	19.2	179.7	-65.9	-84.9	0	0	0	116.3	M1066 A1067	M1066-H1069 WeakPolarHBondContact O-CA 3.37Å; M1066-H1069 PolarHBondContact O-N 3.04Å; A1067-H1069 PolarHBondContact O-CD2 3.3Å; A1067-H1069 PolarHBondContact O-N 3.5Å
1070	V	65	Low	78.8	Confident	55 Å²	55	61 Å²	61	33%	0.333	35%	0.349	S	S	.	.			trans	-73.9	-30.8	-177.8	-171	0	0	0	0	111.4	K1065 C1068 P1287	K1065-V1070 HydrophobicContact CB-CB 4.44Å; K1065-V1070 HydrophobicContact CD-CB 3.93Å; K1065-V1070 HydrophobicContact CD-CG1 3.96Å; K1065-V1070 HydrophobicContact CD-CG2 4.01Å; K1065-V1070 WeakPolarHBondContact O-CB 3.31Å; K1065-V1070 PolarHBondContact O-N 3.17Å; C1068-V1070 HydrophobicContact CB-CG2 3.81Å; C1068-V1070 WeakPolarHBondContact O-CG2 3.35Å; C1068-V1070 PolarHBondContact O-N 2.99Å; V1070-P1287 HydrophobicContact CG1-CG 3.63Å
1071	V	63.9	Low	79.1	Confident	43 Å²	43	59.2 Å²	59.2	26%	0.261	33%	0.331	S	S	.	.	S	Bend	trans	-102.4	103	178.5	-177.9	0	0	0	0	109.6	K1065 M1066 Q1075 L1282	K1065-V1071 HydrophobicContact CB-CG2 4.03Å; K1065-V1071 PolarHBondContact O-N 3.42Å; M1066-V1071 HydrophobicContact CG-CB 4.22Å; V1071-Q1075 HydrophobicContact CG1-CG 3.69Å; V1071-L1282 HydrophobicContact CG2-CD1 3.91Å
1072	K	55.6	Low	79.4	Confident	143 Å²	143	56.2 Å²	56.2	62%	0.622	32%	0.315	S	S	*	.			trans	-86.4	147.1	176.6	-66	-176.4	177.8	-178.6	0	111.5
1073	G	64.7	Low	79.8	Confident	60 Å²	60	56.6 Å²	56.6	62%	0.619	32%	0.32	S	S	*	.	S	Bend	trans	92.4	152.6	-178.9	0	0	0	0	0	113.9	Q1075	G1073-Q1075 PolarHBondContact O-N 3.32Å; G1073-Q1075 PolarHBondContact O-NE2 3.4Å
1074	N	68.6	Low	80.2	Confident	71 Å²	71	53 Å²	53	38%	0.38	30%	0.302	S	S	.	.			trans	-67.5	115.3	-173.5	-175.2	-2.3	0	0	0	112.1	S1076 Q1143	N1074-S1076 PolarHBondContact ND2-OG 3.22Å; N1074-S1076 WeakPolarHBondContact OD1-CB 3.47Å; N1074-S1076 PolarHBondContact OD1-N 3.01Å; N1074-S1076 PolarHBondContact OD1-OG 3.35Å; N1074-Q1143 PolarHBondContact ND2-OE1 2.81Å
1075	Q	78.8	Confident	80.7	Confident	51 Å²	51	46.6 Å²	46.6	24%	0.238	27%	0.274	C	S	.	.			trans	-96.6	9.4	177.7	-56.5	-55.5	-47.2	0	0	114	M1066 V1071 G1073 L1077 G1078 I1079	M1066-Q1075 HydrophobicContact SD-CB 3.92Å; M1066-Q1075 HydrophobicContact SD-CG 4.07Å; V1071-Q1075 HydrophobicContact CG1-CG 3.69Å; G1073-Q1075 PolarHBondContact O-N 3.32Å; G1073-Q1075 PolarHBondContact O-NE2 3.4Å; Q1075-L1077 VanDerWaalsContact C-N 3.33Å; Q1075-L1077 PolarHBondContact O-N 2.98Å; Q1075-G1078 CarbonylContact O-C 3.49Å; Q1075-G1078 VanDerWaalsContact O-CA 3.28Å; Q1075-G1078 WeakPolarHBondContact O-CA 2.98Å; Q1075-G1078 PolarHBondContact O-N 3.4Å; Q1075-I1079 HydrophobicContact CB-CG1 4.48Å; Q1075-I1079 WeakPolarHBondContact O-CG1 3.25Å; Q1075-I1079 PolarHBondContact O-N 3.1Å
1076	S	85.5	Confident	81.3	Confident	20 Å²	20	45.5 Å²	45.5	14%	0.14	27%	0.27	C	S	.	.	H	α-helix	trans	-54.4	-41.2	-169.9	66.5	0	0	0	0	114.5	N1074 G1078 I1079 C1080 W1147	N1074-S1076 PolarHBondContact ND2-OG 3.22Å; N1074-S1076 WeakPolarHBondContact OD1-CB 3.47Å; N1074-S1076 PolarHBondContact OD1-N 3.01Å; N1074-S1076 PolarHBondContact OD1-OG 3.35Å; S1076-G1078 VanDerWaalsContact C-N 3.34Å; S1076-I1079 PolarHBondContact O-N 3.08Å; S1076-C1080 WeakPolarHBondContact O-CB 3.17Å; S1076-C1080 PolarHBondContact O-N 2.76Å; S1076-W1147 PolarHBondContact OG-NE1 2.9Å
1077	L	88.1	Confident	82	Confident	11 Å²	11	46.8 Å²	46.8	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-67.1	-34.5	173.6	-70.1	173.2	0	0	0	112	Q1075 C1080 L1081 V1121 A1124	Q1075-L1077 VanDerWaalsContact C-N 3.33Å; Q1075-L1077 PolarHBondContact O-N 2.98Å; L1077-C1080 PolarHBondContact O-N 3.34Å; L1077-L1081 WeakPolarHBondContact O-CB 3.03Å; L1077-L1081 PolarHBondContact O-N 2.98Å; L1077-V1121 HydrophobicContact CB-CG1 4.28Å; L1077-V1121 HydrophobicContact CD2-CG1 4.46Å; L1077-V1121 WeakPolarHBondContact O-CG1 3.37Å; L1077-A1124 HydrophobicContact CD1-CB 4.31Å; L1077-A1124 HydrophobicContact CD2-CB 4.08Å
1078	G	88	Confident	82.7	Confident	17 Å²	17	43.3 Å²	43.3	18%	0.175	25%	0.247	C	C	.	.	H	α-helix	trans	-66.8	-40.3	172.6	0	0	0	0	0	113	Q1075 S1076 L1081 L1082 F1275	Q1075-G1078 CarbonylContact O-C 3.49Å; Q1075-G1078 VanDerWaalsContact O-CA 3.28Å; Q1075-G1078 WeakPolarHBondContact O-CA 2.98Å; Q1075-G1078 PolarHBondContact O-N 3.4Å; S1076-G1078 VanDerWaalsContact C-N 3.34Å; G1078-L1081 PolarHBondContact O-N 3.33Å; G1078-L1082 PolarHBondContact O-N 3.39Å; G1078-F1275 WeakPolarHBondContact O-CZ 3.5Å
1079	I	90	Very high	83.6	Confident	52 Å²	52	40.2 Å²	40.2	27%	0.267	23%	0.226	S	C	.	.	H	α-helix	trans	-61.3	-50.2	173.5	-62.1	168	0	0	0	109.5	F1059 M1066 Q1075 S1076 L1081 L1082 C1083	F1059-I1079 HydrophobicContact CE2-CG2 4.07Å; M1066-I1079 HydrophobicContact CE-CD1 3.68Å; M1066-I1079 HydrophobicContact CE-CG1 4.16Å; M1066-I1079 HydrophobicContact SD-CD1 4.02Å; Q1075-I1079 HydrophobicContact CB-CG1 4.48Å; Q1075-I1079 WeakPolarHBondContact O-CG1 3.25Å; Q1075-I1079 PolarHBondContact O-N 3.1Å; S1076-I1079 PolarHBondContact O-N 3.08Å; I1079-L1081 PolarHBondContact O-N 3.17Å; I1079-L1082 PolarHBondContact O-N 2.9Å; I1079-L1082 VanDerWaalsContact O-N 3.11Å; I1079-C1083 PolarHBondContact O-N 3.49Å; I1079-C1083 PolarHBondContact O-SG 2.95Å; I1079-C1083 VanDerWaalsContact O-SG 3.34Å
1080	C	92.9	Very high	84.7	Confident	21 Å²	21	35.9 Å²	35.9	14%	0.142	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-38.4	179.6	-169.2	0	0	0	0	112.8	S1076 L1077 L1082 C1083 G1084 V1121	S1076-C1080 WeakPolarHBondContact O-CB 3.17Å; S1076-C1080 PolarHBondContact O-N 2.76Å; L1077-C1080 PolarHBondContact O-N 3.34Å; C1080-L1082 VanDerWaalsContact C-N 3.31Å; C1080-L1082 PolarHBondContact O-N 2.88Å; C1080-C1083 WeakPolarHBondContact O-CB 3.34Å; C1080-C1083 PolarHBondContact O-N 3.22Å; C1080-G1084 PolarHBondContact O-N 3.41Å; C1080-V1121 HydrophobicContact CB-CG2 4.09Å
1081	L	94	Very high	86	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-42.7	173	-173	59.9	0	0	0	111.6	L1077 G1078 I1079 G1084 V1085 V1121 L1122 V1270 M1274 F1275	L1077-L1081 WeakPolarHBondContact O-CB 3.03Å; L1077-L1081 PolarHBondContact O-N 2.98Å; G1078-L1081 PolarHBondContact O-N 3.33Å; I1079-L1081 PolarHBondContact O-N 3.17Å; L1081-G1084 PolarHBondContact O-N 3.01Å; L1081-V1085 WeakPolarHBondContact O-CG2 3.26Å; L1081-V1085 PolarHBondContact O-N 2.77Å; L1081-V1121 HydrophobicContact CB-CG1 3.72Å; L1081-V1121 HydrophobicContact CD1-CB 4.28Å; L1081-V1121 HydrophobicContact CD1-CG1 4.15Å; L1081-V1121 HydrophobicContact CG-CG1 4.42Å; L1081-L1122 HydrophobicContact CD1-CD2 4.49Å; L1081-L1122 HydrophobicContact CD2-CD2 4.49Å; L1081-V1270 HydrophobicContact CD1-CG1 3.97Å; L1081-V1270 HydrophobicContact CD2-CG1 4.23Å; L1081-V1270 HydrophobicContact CG-CG1 4.16Å; L1081-M1274 HydrophobicContact CD2-CB 3.96Å; L1081-M1274 HydrophobicContact CD2-CG 3.86Å; L1081-M1274 HydrophobicContact CD2-SD 4.33Å; L1081-F1275 HydrophobicContact CB-CE2 4.47Å; L1081-F1275 HydrophobicContact CB-CZ 4.23Å; L1081-F1275 HydrophobicContact CD2-CE2 3.81Å; L1081-F1275 HydrophobicContact CD2-CZ 4.14Å; L1081-F1275 HydrophobicContact CG-CE2 4.08Å; L1081-F1275 HydrophobicContact CG-CZ 4.33Å
1082	L	93	Very high	87.4	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-71.8	-31.6	179	-148.7	91.7	0	0	0	112.1	V1058 F1059 G1078 I1079 C1080 G1084 V1085 L1086 L1271 F1275	V1058-L1082 HydrophobicContact CG1-CD1 4.26Å; F1059-L1082 HydrophobicContact CB-CD2 3.45Å; F1059-L1082 VanDerWaalsContact CB-CD2 3.45Å; F1059-L1082 HydrophobicContact CD2-CB 4.39Å; F1059-L1082 HydrophobicContact CD2-CD2 3.48Å; F1059-L1082 VanDerWaalsContact CD2-CD2 3.48Å; F1059-L1082 HydrophobicContact CG-CD2 3.85Å; G1078-L1082 PolarHBondContact O-N 3.39Å; I1079-L1082 PolarHBondContact O-N 2.9Å; I1079-L1082 VanDerWaalsContact O-N 3.11Å; C1080-L1082 VanDerWaalsContact C-N 3.31Å; C1080-L1082 PolarHBondContact O-N 2.88Å; L1082-G1084 VanDerWaalsContact C-N 3.35Å; L1082-V1085 PolarHBondContact O-N 3.05Å; L1082-L1086 WeakPolarHBondContact O-CB 3.48Å; L1082-L1086 WeakPolarHBondContact O-CG 3.45Å; L1082-L1086 PolarHBondContact O-N 3.38Å; L1082-L1271 HydrophobicContact CD1-CD1 3.81Å; L1082-F1275 HydrophobicContact CB-CZ 4.03Å; L1082-F1275 HydrophobicContact CD1-CD1 4.1Å; L1082-F1275 HydrophobicContact CD1-CD2 3.78Å; L1082-F1275 HydrophobicContact CD1-CE1 3.86Å; L1082-F1275 HydrophobicContact CD1-CE2 3.53Å; L1082-F1275 HydrophobicContact CD1-CG 4.05Å; L1082-F1275 HydrophobicContact CD1-CZ 3.57Å; L1082-F1275 HydrophobicContact CG-CZ 4.43Å
1083	C	93.5	Very high	89	Confident	44 Å²	44	27.6 Å²	27.6	30%	0.297	17%	0.171	S	C	.	.	H	α-helix	trans	-60.3	-43.5	167.7	-62.5	0	0	0	0	111.4	I1079 C1080 L1086 M1087	I1079-C1083 PolarHBondContact O-N 3.49Å; I1079-C1083 PolarHBondContact O-SG 2.95Å; I1079-C1083 VanDerWaalsContact O-SG 3.34Å; C1080-C1083 WeakPolarHBondContact O-CB 3.34Å; C1080-C1083 PolarHBondContact O-N 3.22Å; C1083-L1086 PolarHBondContact O-N 2.79Å; C1083-M1087 VanDerWaalsContact O-CG 3.29Å; C1083-M1087 WeakPolarHBondContact O-CG 3.25Å; C1083-M1087 PolarHBondContact O-N 2.04Å
1084	G	93.6	Very high	90.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.7	-41.1	174.1	0	0	0	0	0	113.3	C1080 L1081 L1082 M1087 L1088	C1080-G1084 PolarHBondContact O-N 3.41Å; L1081-G1084 PolarHBondContact O-N 3.01Å; L1082-G1084 VanDerWaalsContact C-N 3.35Å; G1084-M1087 WeakPolarHBondContact O-CB 3.3Å; G1084-M1087 PolarHBondContact O-N 3.09Å; G1084-L1088 PolarHBondContact O-N 3.24Å
1085	V	94.8	Very high	91	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.9	-41.1	174.2	170.3	0	0	0	0	111.5	T1055 L1081 L1082 M1087 L1088 Y1089 A1267 V1270	T1055-V1085 HydrophobicContact CG2-CG1 3.9Å; L1081-V1085 WeakPolarHBondContact O-CG2 3.26Å; L1081-V1085 PolarHBondContact O-N 2.77Å; L1082-V1085 PolarHBondContact O-N 3.05Å; V1085-M1087 VanDerWaalsContact C-N 3.34Å; V1085-L1088 PolarHBondContact O-N 3.24Å; V1085-Y1089 HydrophobicContact CG1-CD2 3.87Å; V1085-Y1089 HydrophobicContact CG1-CE2 3.52Å; V1085-Y1089 VanDerWaalsContact O-CD2 3.22Å; V1085-Y1089 WeakPolarHBondContact O-CD2 3.47Å; V1085-Y1089 PolarHBondContact O-N 3.19Å; V1085-Y1089 VanDerWaalsContact O-N 3.14Å; V1085-A1267 HydrophobicContact CG1-CB 4.39Å; V1085-V1270 HydrophobicContact CG2-CB 4.17Å; V1085-V1270 HydrophobicContact CG2-CG1 3.62Å
1086	L	94.7	Very high	91.3	Very high	27 Å²	27	21.2 Å²	21.2	14%	0.141	12%	0.124	C	C	.	.	H	α-helix	trans	-64.5	-36.5	173.1	-75	166.1	0	0	0	111.9	T1055 L1056 L1082 C1083 S1090	T1055-L1086 WeakPolarHBondContact OG1-CD2 3.25Å; L1056-L1086 HydrophobicContact CD2-CD1 4.18Å; L1056-L1086 HydrophobicContact CD2-CD2 3.83Å; L1056-L1086 HydrophobicContact CG-CD2 4Å; L1082-L1086 WeakPolarHBondContact O-CB 3.48Å; L1082-L1086 WeakPolarHBondContact O-CG 3.45Å; L1082-L1086 PolarHBondContact O-N 3.38Å; C1083-L1086 PolarHBondContact O-N 2.79Å; L1086-S1090 VanDerWaalsContact O-CB 3.27Å; L1086-S1090 WeakPolarHBondContact O-CB 3.24Å; L1086-S1090 PolarHBondContact O-N 3.47Å; L1086-S1090 PolarHBondContact O-OG 2.9Å
1087	M	93.7	Very high	91	Very high	73 Å²	73	24 Å²	24	36%	0.36	13%	0.133	S	C	.	.	H	α-helix	trans	-63.2	-46.7	172.6	-70.8	171.3	178.9	0	0	111.4	C1083 G1084 V1085 Y1089 S1090 T1091 F1113 S1114 V1117	C1083-M1087 VanDerWaalsContact O-CG 3.29Å; C1083-M1087 WeakPolarHBondContact O-CG 3.25Å; C1083-M1087 PolarHBondContact O-N 2.04Å; G1084-M1087 WeakPolarHBondContact O-CB 3.3Å; G1084-M1087 PolarHBondContact O-N 3.09Å; V1085-M1087 VanDerWaalsContact C-N 3.34Å; M1087-Y1089 PolarHBondContact O-N 3.27Å; M1087-S1090 WeakPolarHBondContact O-CB 3.41Å; M1087-S1090 PolarHBondContact O-N 3.14Å; M1087-S1090 VanDerWaalsContact O-N 3.11Å; M1087-T1091 WeakPolarHBondContact O-CG2 3.2Å; M1087-T1091 PolarHBondContact O-N 2.85Å; M1087-F1113 HydrophobicContact CE-CE1 4.39Å; M1087-F1113 HydrophobicContact SD-CD1 4.49Å; M1087-F1113 HydrophobicContact SD-CE1 3.99Å; M1087-S1114 WeakPolarHBondContact CB-OG 3.49Å; M1087-V1117 HydrophobicContact SD-CG2 4.42Å
1088	L	94.6	Very high	90.2	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-54.9	-54.3	176.6	-73.1	173.1	0	0	0	111.9	G1084 V1085 S1090 T1091 A1092 Y1115 L1263 A1267	G1084-L1088 PolarHBondContact O-N 3.24Å; V1085-L1088 PolarHBondContact O-N 3.24Å; L1088-S1090 VanDerWaalsContact C-N 3.29Å; L1088-S1090 PolarHBondContact O-N 3.45Å; L1088-T1091 PolarHBondContact O-N 3.45Å; L1088-T1091 VanDerWaalsContact O-N 3.14Å; L1088-T1091 PolarHBondContact O-OG1 3.37Å; L1088-A1092 PolarHBondContact O-N 3.02Å; L1088-Y1115 HydrophobicContact CD1-CD1 4.35Å; L1088-Y1115 HydrophobicContact CD1-CE1 3.91Å; L1088-Y1115 HydrophobicContact CD2-CD1 3.87Å; L1088-Y1115 HydrophobicContact CD2-CD2 3.87Å; L1088-Y1115 HydrophobicContact CD2-CE1 3.53Å; L1088-Y1115 HydrophobicContact CD2-CE2 3.52Å; L1088-Y1115 HydrophobicContact CD2-CG 4.02Å; L1088-Y1115 HydrophobicContact CG-CE1 4.41Å; L1088-L1263 HydrophobicContact CD2-CD2 3.77Å; L1088-A1267 HydrophobicContact CB-CB 3.95Å; L1088-A1267 HydrophobicContact CD1-CB 4.07Å
1089	Y	94.7	Very high	89.5	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.4	-34	176.6	-68.7	-57.6	0	0	0	113.1	N1048 L1051 V1052 T1055 V1085 M1087 A1092 F1264 A1267 T1268	N1048-Y1089 PolarHBondContact ND2-O 3.37Å; N1048-Y1089 VanDerWaalsContact OD1-CD1 3.25Å; N1048-Y1089 WeakPolarHBondContact OD1-CD1 3.35Å; N1048-Y1089 PolarHBondContact OD1-O 3.34Å; L1051-Y1089 HydrophobicContact CB-CD1 4.21Å; L1051-Y1089 HydrophobicContact CB-CE1 3.72Å; L1051-Y1089 HydrophobicContact CB-CE2 4.41Å; L1051-Y1089 HydrophobicContact CD1-CE1 3.73Å; L1051-Y1089 HydrophobicContact CG-CE1 4.27Å; V1052-Y1089 HydrophobicContact CG2-CG 4.31Å; T1055-Y1089 HydrophobicContact CG2-CD2 4.08Å; T1055-Y1089 HydrophobicContact CG2-CE2 3.62Å; V1085-Y1089 HydrophobicContact CG1-CD2 3.87Å; V1085-Y1089 HydrophobicContact CG1-CE2 3.52Å; V1085-Y1089 VanDerWaalsContact O-CD2 3.22Å; V1085-Y1089 WeakPolarHBondContact O-CD2 3.47Å; V1085-Y1089 PolarHBondContact O-N 3.19Å; V1085-Y1089 VanDerWaalsContact O-N 3.14Å; M1087-Y1089 PolarHBondContact O-N 3.27Å; Y1089-A1092 PolarHBondContact O-N 2.75Å; Y1089-F1264 HydrophobicContact CE1-CB 4.35Å; Y1089-A1267 HydrophobicContact CD1-CB 4.01Å; Y1089-A1267 HydrophobicContact CD2-CB 4.12Å; Y1089-A1267 HydrophobicContact CE1-CB 3.58Å; Y1089-A1267 HydrophobicContact CE2-CB 3.7Å; Y1089-A1267 HydrophobicContact CG-CB 4.27Å; Y1089-A1267 VanDerWaalsContact CZ-CB 3.42Å; Y1089-T1268 VanDerWaalsContact OH-CA 3.31Å; Y1089-T1268 WeakPolarHBondContact OH-CA 3.28Å; Y1089-T1268 PolarHBondContact OH-N 3.26Å; Y1089-T1268 VanDerWaalsContact OH-N 3.13Å; Y1089-T1268 PolarHBondContact OH-OG1 3.21Å
1090	S	91.7	Very high	88.8	Confident	64 Å²	64	24.6 Å²	24.6	45%	0.448	14%	0.135	S	C	.	.	H	α-helix	trans	-65.2	-39.4	174.7	-60.2	0	0	0	0	111.9	L1086 M1087 L1088 A1092 F1093	L1086-S1090 VanDerWaalsContact O-CB 3.27Å; L1086-S1090 WeakPolarHBondContact O-CB 3.24Å; L1086-S1090 PolarHBondContact O-N 3.47Å; L1086-S1090 PolarHBondContact O-OG 2.9Å; M1087-S1090 WeakPolarHBondContact O-CB 3.41Å; M1087-S1090 PolarHBondContact O-N 3.14Å; M1087-S1090 VanDerWaalsContact O-N 3.11Å; L1088-S1090 VanDerWaalsContact C-N 3.29Å; L1088-S1090 PolarHBondContact O-N 3.45Å; S1090-A1092 VanDerWaalsContact C-N 3.3Å; S1090-A1092 PolarHBondContact O-N 3.03Å; S1090-F1093 PolarHBondContact O-N 3.13Å
1091	T	92.4	Very high	87.9	Confident	9 Å²	9	28 Å²	28	6%	0.055	15%	0.152	C	C	.	.	H	α-helix	trans	-68.5	-28.3	179	61	0	0	0	0	113	M1087 L1088 F1093 L1094 F1095 G1110 L1263	M1087-T1091 WeakPolarHBondContact O-CG2 3.2Å; M1087-T1091 PolarHBondContact O-N 2.85Å; L1088-T1091 PolarHBondContact O-N 3.45Å; L1088-T1091 VanDerWaalsContact O-N 3.14Å; L1088-T1091 PolarHBondContact O-OG1 3.37Å; T1091-F1093 PolarHBondContact O-N 3.11Å; T1091-L1094 HydrophobicContact CG2-CD1 4.23Å; T1091-L1094 VanDerWaalsContact O-CB 3.27Å; T1091-L1094 WeakPolarHBondContact O-CB 3.38Å; T1091-L1094 PolarHBondContact O-N 2.98Å; T1091-F1095 WeakPolarHBondContact O-CD2 3.2Å; T1091-G1110 VanDerWaalsContact CG2-C 3.5Å; T1091-L1263 WeakPolarHBondContact OG1-CD2 3.43Å
1092	A	91.6	Very high	87.2	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-60.3	-32.1	176	0	0	0	0	0	112.6	L1088 Y1089 S1090 L1094 F1095 L1263	L1088-A1092 PolarHBondContact O-N 3.02Å; Y1089-A1092 PolarHBondContact O-N 2.75Å; S1090-A1092 VanDerWaalsContact C-N 3.3Å; S1090-A1092 PolarHBondContact O-N 3.03Å; A1092-L1094 VanDerWaalsContact C-N 3.3Å; A1092-L1094 PolarHBondContact O-N 3.04Å; A1092-F1095 PolarHBondContact O-N 3.46Å; A1092-L1263 HydrophobicContact CB-CB 4.19Å; A1092-L1263 HydrophobicContact CB-CD1 4.01Å
1093	F	90.1	Very high	86.9	Confident	56 Å²	56	31.9 Å²	31.9	25%	0.246	18%	0.18	C	C	.	.	H	α-helix	trans	-63.8	-33.2	173.6	-64.9	-64	0	0	0	112.9	N1048 V1052 S1090 T1091 F1095 V1096 F1097	N1048-F1093 HydrophobicContact CB-CE1 4.2Å; N1048-F1093 HydrophobicContact CB-CZ 4.31Å; N1048-F1093 WeakPolarHBondContact ND2-CD2 3.31Å; N1048-F1093 VanDerWaalsContact ND2-CE1 3.31Å; N1048-F1093 WeakPolarHBondContact ND2-CE1 3.33Å; N1048-F1093 VanDerWaalsContact ND2-CE2 3.29Å; N1048-F1093 WeakPolarHBondContact ND2-CE2 3.47Å; N1048-F1093 WeakPolarHBondContact ND2-CZ 3.46Å; V1052-F1093 HydrophobicContact CG2-CE2 4.11Å; V1052-F1093 HydrophobicContact CG2-CZ 4.36Å; S1090-F1093 PolarHBondContact O-N 3.13Å; T1091-F1093 PolarHBondContact O-N 3.11Å; F1093-F1095 PolarHBondContact O-N 2.76Å; F1093-V1096 PolarHBondContact O-N 3.31Å; F1093-F1097 HydrophobicContact CB-CE2 4.32Å; F1093-F1097 WeakPolarHBondContact O-CD2 3.45Å
1094	L	88.8	Confident	86.5	Confident	35 Å²	35	29.8 Å²	29.8	18%	0.183	17%	0.166	C	C	.	.	H	α-helix	trans	-63	-26.5	-179.6	-55.8	170.6	0	0	0	112.4	T1091 A1092 I1103 L1106 R1107	T1091-L1094 HydrophobicContact CG2-CD1 4.23Å; T1091-L1094 VanDerWaalsContact O-CB 3.27Å; T1091-L1094 WeakPolarHBondContact O-CB 3.38Å; T1091-L1094 PolarHBondContact O-N 2.98Å; A1092-L1094 VanDerWaalsContact C-N 3.3Å; A1092-L1094 PolarHBondContact O-N 3.04Å; L1094-I1103 WeakPolarHBondContact O-CG2 3.49Å; L1094-L1106 HydrophobicContact CD1-CB 3.86Å; L1094-L1106 WeakPolarHBondContact CD1-O 3.43Å; L1094-L1106 HydrophobicContact CD2-CB 4.12Å; L1094-L1106 HydrophobicContact CD2-CD1 4.38Å; L1094-R1107 HydrophobicContact CB-CG 3.88Å; L1094-R1107 PolarHBondContact O-NE 3.01Å; L1094-R1107 PolarHBondContact O-NH2 3.28Å
1095	F	87.6	Confident	86.1	Confident	9 Å²	9	34.8 Å²	34.8	4%	0.039	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-11.3	177.2	-70.6	-87.6	0	0	0	113.8	T1091 A1092 F1093 R1107 V1259 V1260 L1263	T1091-F1095 WeakPolarHBondContact O-CD2 3.2Å; A1092-F1095 PolarHBondContact O-N 3.46Å; F1093-F1095 PolarHBondContact O-N 2.76Å; F1095-R1107 HydrophobicContact CD1-CG 4.09Å; F1095-R1107 HydrophobicContact CD2-CG 4.28Å; F1095-R1107 HydrophobicContact CE1-CB 3.98Å; F1095-R1107 HydrophobicContact CE1-CG 3.95Å; F1095-R1107 HydrophobicContact CE2-CB 4.16Å; F1095-R1107 HydrophobicContact CE2-CG 4.13Å; F1095-R1107 HydrophobicContact CG-CG 4.25Å; F1095-R1107 HydrophobicContact CZ-CB 3.71Å; F1095-R1107 HydrophobicContact CZ-CG 3.96Å; F1095-R1107 PolarHBondContact O-NH2 3.07Å; F1095-R1107 VanDerWaalsContact O-NH2 3.15Å; F1095-V1259 HydrophobicContact CD1-CB 4.23Å; F1095-V1259 HydrophobicContact CD1-CG1 4.01Å; F1095-V1259 HydrophobicContact CD2-CG1 4.06Å; F1095-V1259 HydrophobicContact CE1-CB 4.24Å; F1095-V1259 HydrophobicContact CE1-CG1 3.74Å; F1095-V1259 HydrophobicContact CE1-CG2 4.49Å; F1095-V1259 HydrophobicContact CE2-CG1 3.8Å; F1095-V1259 HydrophobicContact CG-CG1 4.17Å; F1095-V1259 HydrophobicContact CZ-CG1 3.64Å; F1095-V1260 HydrophobicContact CB-CG2 3.68Å; F1095-L1263 HydrophobicContact CD2-CD1 4Å; F1095-L1263 HydrophobicContact CE2-CD1 4.07Å
1096	V	83.8	Confident	85.7	Confident	4 Å²	4	39 Å²	39	2%	0.024	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-36.9	179.2	-177.9	0	0	0	0	112.4	W1035 N1041 F1093	W1035-V1096 HydrophobicContact CZ2-CG1 4.28Å; N1041-V1096 HydrophobicContact CB-CG1 4.1Å; F1093-V1096 PolarHBondContact O-N 3.31Å
1097	F	79.4	Confident	85.4	Confident	79 Å²	79	38 Å²	38	35%	0.346	20%	0.202	S	C	.	.	B	Isolated β-bridge	trans	-73	153.4	174.9	-61.8	-73.1	0	0	0	112.2	F1093 I1103 R1107	F1093-F1097 HydrophobicContact CB-CE2 4.32Å; F1093-F1097 WeakPolarHBondContact O-CD2 3.45Å; F1097-I1103 HydrophobicContact CB-CD1 3.78Å; F1097-R1107 PolarHBondContact O-NH2 3.31Å
1098	D	71.5	Confident	85	Confident	38 Å²	38	34.8 Å²	34.8	20%	0.203	19%	0.185	C	C	.	.			trans	-66.3	147.8	175.9	-90.8	-54.5	0	0	0	113.5	Q1034 R1036 T1100 I1103	Q1034-D1098 PolarHBondContact O-N 3.12Å; R1036-D1098 WeakPolarHBondContact CG-OD1 3.37Å; R1036-D1098 WeakPolarHBondContact CG-OD2 3.37Å; R1036-D1098 IonicContact CZ-OD1 3.63Å; R1036-D1098 IonicContact NE-OD1 4Å; R1036-D1098 PolarHBondContact NE-OD1 3.08Å; R1036-D1098 IonicContact NH2-OD1 3.7Å; R1036-D1098 PolarHBondContact NH2-OD1 3.01Å; D1098-T1100 PolarHBondContact O-N 3.31Å; D1098-T1100 VanDerWaalsContact O-N 3.11Å; D1098-I1103 WeakPolarHBondContact O-CD1 3.3Å
1099	P	73.9	Confident	84.7	Confident	7 Å²	7	37.3 Å²	37.3	5%	0.045	20%	0.197	C	C	.	.			trans	-73.6	103.1	-171.7	26	-31.8	0	0	0	113	C1104 P1186	P1099-C1104 WeakPolarHBondContact CB-SG 3.36Å; P1099-P1186 HydrophobicContact CG-CB 4.03Å; P1099-P1186 HydrophobicContact CG-CG 4.08Å; P1099-P1186 WeakPolarHBondContact CG-O 3.49Å
1100	T	75.4	Confident	84.5	Confident	48 Å²	48	37.6 Å²	37.6	29%	0.294	20%	0.2	S	C	.	.			trans	-97.1	167.7	163.8	68.2	0	0	0	0	110.9	D1098 A1102 I1103 C1104	D1098-T1100 PolarHBondContact O-N 3.31Å; D1098-T1100 VanDerWaalsContact O-N 3.11Å; T1100-A1102 VanDerWaalsContact C-N 3.25Å; T1100-A1102 PolarHBondContact O-N 2.91Å; T1100-I1103 HydrophobicContact CG2-CD1 4.22Å; T1100-I1103 PolarHBondContact O-N 3.05Å; T1100-I1103 VanDerWaalsContact O-N 3.12Å; T1100-I1103 WeakPolarHBondContact OG1-CB 3.46Å; T1100-I1103 WeakPolarHBondContact OG1-CG1 3.49Å; T1100-I1103 PolarHBondContact OG1-N 3.46Å; T1100-C1104 WeakPolarHBondContact O-CB 3.44Å; T1100-C1104 PolarHBondContact O-N 3.35Å
1101	D	72.5	Confident	84.4	Confident	92 Å²	92	34.6 Å²	34.6	49%	0.492	18%	0.179	S	C	.	.	H	α-helix	trans	-54.2	-41.1	177.6	-80	-48.4	0	0	0	113.3	R1105 S1170	D1101-R1105 WeakPolarHBondContact O-CD 3.47Å; D1101-R1105 WeakPolarHBondContact O-CG 3.47Å; D1101-R1105 PolarHBondContact O-N 3.27Å; D1101-S1170 WeakPolarHBondContact OD1-CB 3.31Å; D1101-S1170 PolarHBondContact OD1-OG 2.87Å
1102	A	80.6	Confident	84.4	Confident	57 Å²	57	34.1 Å²	34.1	47%	0.471	18%	0.176	S	C	.	.	H	α-helix	trans	-68.8	-48	176	0	0	0	0	0	111.5	T1100 C1104 R1105 L1106	T1100-A1102 VanDerWaalsContact C-N 3.25Å; T1100-A1102 PolarHBondContact O-N 2.91Å; A1102-C1104 PolarHBondContact O-N 3.38Å; A1102-R1105 PolarHBondContact O-N 3.08Å; A1102-L1106 WeakPolarHBondContact O-CB 3.39Å; A1102-L1106 VanDerWaalsContact O-CG 3.23Å; A1102-L1106 WeakPolarHBondContact O-CG 3.18Å; A1102-L1106 PolarHBondContact O-N 3.09Å
1103	I	85	Confident	84.5	Confident	25 Å²	25	35.7 Å²	35.7	13%	0.128	18%	0.183	C	C	.	.	H	α-helix	trans	-64.3	-40.6	-178.1	-72.3	167	0	0	0	111.1	L1094 F1097 D1098 T1100 L1106 R1107	L1094-I1103 WeakPolarHBondContact O-CG2 3.49Å; F1097-I1103 HydrophobicContact CB-CD1 3.78Å; D1098-I1103 WeakPolarHBondContact O-CD1 3.3Å; T1100-I1103 HydrophobicContact CG2-CD1 4.22Å; T1100-I1103 PolarHBondContact O-N 3.05Å; T1100-I1103 VanDerWaalsContact O-N 3.12Å; T1100-I1103 WeakPolarHBondContact OG1-CB 3.46Å; T1100-I1103 WeakPolarHBondContact OG1-CG1 3.49Å; T1100-I1103 PolarHBondContact OG1-N 3.46Å; I1103-L1106 PolarHBondContact O-N 3.27Å; I1103-R1107 HydrophobicContact CG2-CG 4.23Å; I1103-R1107 WeakPolarHBondContact O-CB 3.28Å; I1103-R1107 VanDerWaalsContact O-CG 3.27Å; I1103-R1107 WeakPolarHBondContact O-CG 3.36Å; I1103-R1107 PolarHBondContact O-N 3.38Å
1104	C	85.8	Confident	84.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-52	175.3	-74.4	0	0	0	0	111.9	P1099 T1100 A1102 L1106 R1107 H1108 S1170 C1188 W1190	P1099-C1104 WeakPolarHBondContact CB-SG 3.36Å; T1100-C1104 WeakPolarHBondContact O-CB 3.44Å; T1100-C1104 PolarHBondContact O-N 3.35Å; A1102-C1104 PolarHBondContact O-N 3.38Å; C1104-L1106 VanDerWaalsContact C-N 3.25Å; C1104-L1106 PolarHBondContact O-N 3.01Å; C1104-R1107 WeakPolarHBondContact O-CB 3.46Å; C1104-R1107 PolarHBondContact O-N 3.21Å; C1104-R1107 VanDerWaalsContact O-N 3.13Å; C1104-H1108 PolarHBondContact O-N 3.31Å; C1104-H1108 VanDerWaalsContact O-N 3.15Å; C1104-S1170 VanDerWaalsContact CB-O 3.29Å; C1104-S1170 WeakPolarHBondContact CB-O 3.47Å; C1104-S1170 PolarHBondContact SG-O 3.39Å; C1104-S1170 VanDerWaalsContact SG-O 3.39Å; C1104-C1188 WeakPolarHBondContact CA-SG 3.4Å; C1104-C1188 HydrophobicContact CB-CB 3.72Å; C1104-C1188 WeakPolarHBondContact CB-SG 3.04Å; C1104-C1188 WeakPolarHBondContact SG-CA 3.35Å; C1104-C1188 WeakPolarHBondContact SG-CB 3.34Å; C1104-C1188 CovalentContact SG-SG 2.04Å; C1104-C1188 PolarHBondContact SG-SG 3.15Å; C1104-W1190 HydrophobicContact CB-CH2 4.17Å; C1104-W1190 HydrophobicContact CB-CZ2 4.15Å; C1104-W1190 WeakPolarHBondContact O-CH2 3.3Å; C1104-W1190 WeakPolarHBondContact O-CZ2 3.5Å
1105	R	84.5	Confident	84.9	Confident	105 Å²	105	31.5 Å²	31.5	40%	0.396	16%	0.163	S	C	.	.	H	α-helix	trans	-54.8	-43.3	176.7	-70.8	167.3	-172.3	-89.3	-9.3	111.3	D1101 A1102 F1109 A1165 S1170	D1101-R1105 WeakPolarHBondContact O-CD 3.47Å; D1101-R1105 WeakPolarHBondContact O-CG 3.47Å; D1101-R1105 PolarHBondContact O-N 3.27Å; A1102-R1105 PolarHBondContact O-N 3.08Å; R1105-F1109 WeakPolarHBondContact O-CB 3.16Å; R1105-F1109 PolarHBondContact O-N 2.95Å; R1105-A1165 PolarHBondContact NH1-O 3Å; R1105-S1170 PolarHBondContact NE-OG 3.46Å; R1105-S1170 PolarHBondContact NH2-OG 2.91Å
1106	L	88	Confident	85.3	Confident	88 Å²	88	31.1 Å²	31.1	46%	0.461	16%	0.161	S	C	.	.	H	α-helix	trans	-69.5	-36.5	177.7	-69.3	169.3	0	0	0	113.5	L1094 A1102 I1103 C1104 G1110	L1094-L1106 HydrophobicContact CD1-CB 3.86Å; L1094-L1106 WeakPolarHBondContact CD1-O 3.43Å; L1094-L1106 HydrophobicContact CD2-CB 4.12Å; L1094-L1106 HydrophobicContact CD2-CD1 4.38Å; A1102-L1106 WeakPolarHBondContact O-CB 3.39Å; A1102-L1106 VanDerWaalsContact O-CG 3.23Å; A1102-L1106 WeakPolarHBondContact O-CG 3.18Å; A1102-L1106 PolarHBondContact O-N 3.09Å; I1103-L1106 PolarHBondContact O-N 3.27Å; C1104-L1106 VanDerWaalsContact C-N 3.25Å; C1104-L1106 PolarHBondContact O-N 3.01Å; L1106-G1110 VanDerWaalsContact O-CA 3.29Å; L1106-G1110 WeakPolarHBondContact O-CA 3.33Å; L1106-G1110 PolarHBondContact O-N 2.62Å
1107	R	88.1	Confident	85.9	Confident	8 Å²	8	31.5 Å²	31.5	3%	0.03	16%	0.164	C	C	.	.	H	α-helix	trans	-59.3	-52.3	175.2	-80.1	170.8	175.8	-140.9	3.3	111.1	L1094 F1095 F1097 I1103 C1104 H1111 D1256	L1094-R1107 HydrophobicContact CB-CG 3.88Å; L1094-R1107 PolarHBondContact O-NE 3.01Å; L1094-R1107 PolarHBondContact O-NH2 3.28Å; F1095-R1107 HydrophobicContact CD1-CG 4.09Å; F1095-R1107 HydrophobicContact CD2-CG 4.28Å; F1095-R1107 HydrophobicContact CE1-CB 3.98Å; F1095-R1107 HydrophobicContact CE1-CG 3.95Å; F1095-R1107 HydrophobicContact CE2-CB 4.16Å; F1095-R1107 HydrophobicContact CE2-CG 4.13Å; F1095-R1107 HydrophobicContact CG-CG 4.25Å; F1095-R1107 HydrophobicContact CZ-CB 3.71Å; F1095-R1107 HydrophobicContact CZ-CG 3.96Å; F1095-R1107 PolarHBondContact O-NH2 3.07Å; F1095-R1107 VanDerWaalsContact O-NH2 3.15Å; F1097-R1107 PolarHBondContact O-NH2 3.31Å; I1103-R1107 HydrophobicContact CG2-CG 4.23Å; I1103-R1107 WeakPolarHBondContact O-CB 3.28Å; I1103-R1107 VanDerWaalsContact O-CG 3.27Å; I1103-R1107 WeakPolarHBondContact O-CG 3.36Å; I1103-R1107 PolarHBondContact O-N 3.38Å; C1104-R1107 WeakPolarHBondContact O-CB 3.46Å; C1104-R1107 PolarHBondContact O-N 3.21Å; C1104-R1107 VanDerWaalsContact O-N 3.13Å; R1107-H1111 PolarHBondContact O-N 3.1Å; R1107-D1256 IonicContact CZ-OD2 2.77Å; R1107-D1256 IonicContact NH1-OD1 3.64Å; R1107-D1256 PolarHBondContact NH1-OD1 3.44Å; R1107-D1256 IonicContact NH1-OD2 2.72Å; R1107-D1256 PolarHBondContact NH1-OD2 2.82Å; R1107-D1256 IonicContact NH2-OD2 2.76Å; R1107-D1256 PolarHBondContact NH2-OD2 2.99Å
1108	H	84.3	Confident	86.6	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.019	15%	0.147	C	C	.	.	H	α-helix	trans	-69.2	-48.8	-179.1	-177.9	-81.1	0	0	0	112	C1104 G1110 S1112 W1164 W1190 S1198	C1104-H1108 PolarHBondContact O-N 3.31Å; C1104-H1108 VanDerWaalsContact O-N 3.15Å; H1108-G1110 PolarHBondContact O-N 3.27Å; H1108-S1112 PolarHBondContact O-OG 3.07Å; H1108-W1164 AromaticContact CE1-CD2 3.91Å; H1108-W1164 AromaticContact CE1-CE3 3.62Å; H1108-W1164 AromaticContact CE1-CG 3.94Å; H1108-W1164 AromaticContact NE2-CD2 3.92Å; H1108-W1164 AromaticContact NE2-CE3 3.21Å; H1108-W1164 AromaticContact NE2-CZ3 3.77Å; H1108-W1190 HydrophobicContact CB-CE3 4.39Å; H1108-W1190 HydrophobicContact CB-CH2 3.34Å; H1108-W1190 HydrophobicContact CB-CZ2 3.6Å; H1108-W1190 HydrophobicContact CB-CZ3 3.76Å; H1108-S1198 WeakPolarHBondContact NE2-CB 3.41Å; H1108-S1198 PolarHBondContact NE2-OG 2.82Å
1109	F	89.2	Confident	87.8	Confident	54 Å²	54	26 Å²	26	24%	0.237	14%	0.138	C	C	.	.	H	α-helix	trans	-60.8	-46.7	177.8	-178.8	-82.8	0	0	0	111.4	R1105 F1113 M1158 N1161	R1105-F1109 WeakPolarHBondContact O-CB 3.16Å; R1105-F1109 PolarHBondContact O-N 2.95Å; F1109-F1113 HydrophobicContact CD1-CB 4.25Å; F1109-F1113 HydrophobicContact CE1-CB 3.99Å; F1109-F1113 HydrophobicContact CE1-CD1 4.11Å; F1109-F1113 HydrophobicContact CE1-CD2 4.28Å; F1109-F1113 AromaticContact CE1-CG 3.86Å; F1109-F1113 HydrophobicContact CE1-CG 3.86Å; F1109-F1113 HydrophobicContact CZ-CB 4.45Å; F1109-F1113 HydrophobicContact CZ-CD2 4.15Å; F1109-F1113 HydrophobicContact CZ-CG 4.19Å; F1109-F1113 WeakPolarHBondContact O-CB 3.36Å; F1109-F1113 PolarHBondContact O-N 3.14Å; F1109-F1113 VanDerWaalsContact O-N 3.14Å; F1109-M1158 HydrophobicContact CE2-SD 3.63Å; F1109-M1158 HydrophobicContact CZ-CE 3.92Å; F1109-M1158 HydrophobicContact CZ-SD 3.62Å; F1109-N1161 HydrophobicContact CD2-CB 3.68Å; F1109-N1161 HydrophobicContact CE2-CB 4.04Å; F1109-N1161 HydrophobicContact CG-CB 4.48Å; F1109-N1161 PolarHBondContact O-ND2 3.39Å
1110	G	89.3	Confident	88.8	Confident	7 Å²	7	25.6 Å²	25.6	7%	0.072	14%	0.135	C	C	.	.	H	α-helix	trans	-66.5	-47.8	-169.8	0	0	0	0	0	113.7	T1091 L1106 H1108 S1114	T1091-G1110 VanDerWaalsContact CG2-C 3.5Å; L1106-G1110 VanDerWaalsContact O-CA 3.29Å; L1106-G1110 WeakPolarHBondContact O-CA 3.33Å; L1106-G1110 PolarHBondContact O-N 2.62Å; H1108-G1110 PolarHBondContact O-N 3.27Å; G1110-S1114 VanDerWaalsContact O-CB 3.32Å; G1110-S1114 WeakPolarHBondContact O-CB 3.5Å; G1110-S1114 PolarHBondContact O-N 2.93Å; G1110-S1114 PolarHBondContact O-OG 3.41Å
1111	H	91.2	Very high	89.7	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.7	-62.1	-176.7	-173.5	-71.2	0	0	0	110.6	R1107 F1113 S1114 Y1115 H1199 W1240 E1262	R1107-H1111 PolarHBondContact O-N 3.1Å; H1111-F1113 PolarHBondContact O-N 2.91Å; H1111-S1114 PolarHBondContact O-N 2.75Å; H1111-Y1115 AromaticContact CE1-CD2 3.77Å; H1111-Y1115 AromaticContact CE1-CE2 3.3Å; H1111-Y1115 WeakPolarHBondContact CE1-CE2 3.29Å; H1111-Y1115 AromaticContact ND1-CD2 3.7Å; H1111-Y1115 AromaticContact ND1-CE2 3.61Å; H1111-Y1115 AromaticContact NE2-CE2 3.65Å; H1111-Y1115 WeakPolarHBondContact O-CD2 3.31Å; H1111-Y1115 PolarHBondContact O-N 2.61Å; H1111-H1199 AromaticContact CE1-CD2 3.9Å; H1111-H1199 AromaticContact CE1-NE2 3.9Å; H1111-H1199 AromaticContact CG-NE2 3.79Å; H1111-H1199 AromaticContact ND1-CD2 3.36Å; H1111-H1199 PolarHBondContact ND1-CD2 2.92Å; H1111-H1199 AromaticContact ND1-NE2 3.07Å; H1111-H1199 PolarHBondContact ND1-NE2 3.07Å; H1111-W1240 AromaticContact CE1-CH2 3.97Å; H1111-E1262 IonicContact CE1-OE2 3.32Å; H1111-E1262 PolarHBondContact CE1-OE2 3.28Å; H1111-E1262 IonicContact NE2-OE2 3.02Å; H1111-E1262 PolarHBondContact NE2-OE2 3.04Å
1112	S	91.7	Very high	90.7	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-64.4	-37.7	-177.1	-18.3	0	0	0	0	112.8	H1108 Y1115 S1116 Q1157 H1199	H1108-S1112 PolarHBondContact O-OG 3.07Å; S1112-Y1115 PolarHBondContact O-N 2.57Å; S1112-S1116 PolarHBondContact O-N 2.7Å; S1112-Q1157 VanDerWaalsContact CB-NE2 3.34Å; S1112-H1199 PolarHBondContact OG-CD2 3.34Å; S1112-H1199 PolarHBondContact OG-CE1 2.66Å; S1112-H1199 PolarHBondContact OG-NE2 3.41Å
1113	F	93.3	Very high	91.4	Very high	34 Å²	34	16.7 Å²	16.7	15%	0.149	8%	0.078	C	C	.	.	H	α-helix	trans	-62.6	-45.8	178	177.8	-102.3	0	0	0	111.9	M1087 F1109 H1111 Y1115 S1116 V1117 V1154 M1158	M1087-F1113 HydrophobicContact CE-CE1 4.39Å; M1087-F1113 HydrophobicContact SD-CD1 4.49Å; M1087-F1113 HydrophobicContact SD-CE1 3.99Å; F1109-F1113 HydrophobicContact CD1-CB 4.25Å; F1109-F1113 HydrophobicContact CE1-CB 3.99Å; F1109-F1113 HydrophobicContact CE1-CD1 4.11Å; F1109-F1113 HydrophobicContact CE1-CD2 4.28Å; F1109-F1113 AromaticContact CE1-CG 3.86Å; F1109-F1113 HydrophobicContact CE1-CG 3.86Å; F1109-F1113 HydrophobicContact CZ-CB 4.45Å; F1109-F1113 HydrophobicContact CZ-CD2 4.15Å; F1109-F1113 HydrophobicContact CZ-CG 4.19Å; F1109-F1113 WeakPolarHBondContact O-CB 3.36Å; F1109-F1113 PolarHBondContact O-N 3.14Å; F1109-F1113 VanDerWaalsContact O-N 3.14Å; H1111-F1113 PolarHBondContact O-N 2.91Å; F1113-Y1115 VanDerWaalsContact C-N 3.29Å; F1113-Y1115 PolarHBondContact O-N 3.3Å; F1113-S1116 WeakPolarHBondContact O-CB 3.46Å; F1113-S1116 PolarHBondContact O-N 2.97Å; F1113-S1116 VanDerWaalsContact O-N 3.07Å; F1113-S1116 PolarHBondContact O-OG 3.3Å; F1113-V1117 HydrophobicContact CE1-CG2 4.14Å; F1113-V1117 HydrophobicContact CZ-CG2 4.12Å; F1113-V1117 PolarHBondContact O-N 2.74Å; F1113-V1154 HydrophobicContact CD2-CG1 4.34Å; F1113-V1154 HydrophobicContact CE2-CG1 3.5Å; F1113-V1154 VanDerWaalsContact CE2-CG1 3.5Å; F1113-V1154 HydrophobicContact CZ-CG1 4.07Å; F1113-M1158 HydrophobicContact CD2-CE 4.26Å; F1113-M1158 HydrophobicContact CE2-CE 3.68Å; F1113-M1158 HydrophobicContact CZ-CE 4.33Å
1114	S	93.8	Very high	91.8	Very high	2 Å²	2	15.5 Å²	15.5	1%	0.014	7%	0.072	C	C	.	.	H	α-helix	trans	-60.8	-38.9	-178.2	-57.5	0	0	0	0	112	M1087 G1110 H1111 V1117 C1118	M1087-S1114 WeakPolarHBondContact CB-OG 3.49Å; G1110-S1114 VanDerWaalsContact O-CB 3.32Å; G1110-S1114 WeakPolarHBondContact O-CB 3.5Å; G1110-S1114 PolarHBondContact O-N 2.93Å; G1110-S1114 PolarHBondContact O-OG 3.41Å; H1111-S1114 PolarHBondContact O-N 2.75Å; S1114-V1117 PolarHBondContact O-N 2.9Å; S1114-C1118 PolarHBondContact O-N 3.33Å; S1114-C1118 VanDerWaalsContact O-N 3.09Å
1115	Y	95.1	Very high	91.9	Very high	1 Å²	1	16.1 Å²	16.1	0%	0.004	7%	0.074	C	C	.	.	H	α-helix	trans	-69	-35.1	174	-73.4	-67.4	0	0	0	113.9	L1088 H1111 S1112 F1113 V1117 C1118 F1119 V1202 W1240 E1262 L1263 S1266	L1088-Y1115 HydrophobicContact CD1-CD1 4.35Å; L1088-Y1115 HydrophobicContact CD1-CE1 3.91Å; L1088-Y1115 HydrophobicContact CD2-CD1 3.87Å; L1088-Y1115 HydrophobicContact CD2-CD2 3.87Å; L1088-Y1115 HydrophobicContact CD2-CE1 3.53Å; L1088-Y1115 HydrophobicContact CD2-CE2 3.52Å; L1088-Y1115 HydrophobicContact CD2-CG 4.02Å; L1088-Y1115 HydrophobicContact CG-CE1 4.41Å; H1111-Y1115 AromaticContact CE1-CD2 3.77Å; H1111-Y1115 AromaticContact CE1-CE2 3.3Å; H1111-Y1115 WeakPolarHBondContact CE1-CE2 3.29Å; H1111-Y1115 AromaticContact ND1-CD2 3.7Å; H1111-Y1115 AromaticContact ND1-CE2 3.61Å; H1111-Y1115 AromaticContact NE2-CE2 3.65Å; H1111-Y1115 WeakPolarHBondContact O-CD2 3.31Å; H1111-Y1115 PolarHBondContact O-N 2.61Å; S1112-Y1115 PolarHBondContact O-N 2.57Å; F1113-Y1115 VanDerWaalsContact C-N 3.29Å; F1113-Y1115 PolarHBondContact O-N 3.3Å; Y1115-V1117 VanDerWaalsContact C-N 3.27Å; Y1115-V1117 PolarHBondContact O-N 3.26Å; Y1115-C1118 PolarHBondContact O-N 2.97Å; Y1115-F1119 AromaticContact CD1-CE1 3.85Å; Y1115-F1119 HydrophobicContact CD1-CE1 3.85Å; Y1115-F1119 AromaticContact CD1-CE2 3.98Å; Y1115-F1119 HydrophobicContact CD1-CE2 3.98Å; Y1115-F1119 AromaticContact CD1-CZ 3.5Å; Y1115-F1119 HydrophobicContact CD1-CZ 3.5Å; Y1115-F1119 VanDerWaalsContact CD1-CZ 3.5Å; Y1115-F1119 HydrophobicContact CE1-CE1 4.45Å; Y1115-F1119 HydrophobicContact CE1-CZ 4.1Å; Y1115-F1119 HydrophobicContact CG-CE2 4.41Å; Y1115-F1119 HydrophobicContact CG-CZ 4.35Å; Y1115-F1119 WeakPolarHBondContact O-CB 3.35Å; Y1115-F1119 WeakPolarHBondContact O-CG 3.36Å; Y1115-F1119 PolarHBondContact O-N 3.15Å; Y1115-V1202 VanDerWaalsContact CB-CG1 3.42Å; Y1115-V1202 HydrophobicContact CD2-CG1 4.45Å; Y1115-V1202 HydrophobicContact CG-CG1 3.96Å; Y1115-W1240 AromaticContact CD1-CZ2 3.99Å; Y1115-W1240 HydrophobicContact CD1-CZ2 3.99Å; Y1115-W1240 HydrophobicContact CD2-CH2 4.1Å; Y1115-W1240 AromaticContact CD2-CZ2 3.67Å; Y1115-W1240 HydrophobicContact CD2-CZ2 3.67Å; Y1115-W1240 AromaticContact CE1-CZ2 3.98Å; Y1115-W1240 HydrophobicContact CE1-CZ2 3.98Å; Y1115-W1240 HydrophobicContact CE2-CH2 4.31Å; Y1115-W1240 AromaticContact CE2-CZ2 3.66Å; Y1115-W1240 HydrophobicContact CE2-CZ2 3.66Å; Y1115-W1240 HydrophobicContact CG-CH2 4.47Å; Y1115-W1240 AromaticContact CG-CZ2 3.85Å; Y1115-W1240 HydrophobicContact CG-CZ2 3.85Å; Y1115-W1240 AromaticContact CZ-CZ2 3.81Å; Y1115-E1262 PolarHBondContact OH-OE1 2.77Å; Y1115-E1262 PolarHBondContact OH-OE2 3.23Å; Y1115-L1263 HydrophobicContact CE2-CD2 3.88Å; Y1115-S1266 WeakPolarHBondContact CE1-OG 3.43Å; Y1115-S1266 WeakPolarHBondContact OH-CB 3.44Å; Y1115-S1266 PolarHBondContact OH-OG 2.65Å
1116	S	95.3	Very high	92.2	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-60.3	-38.2	175.3	77.2	0	0	0	0	112.2	S1112 F1113 G1120	S1112-S1116 PolarHBondContact O-N 2.7Å; F1113-S1116 WeakPolarHBondContact O-CB 3.46Å; F1113-S1116 PolarHBondContact O-N 2.97Å; F1113-S1116 VanDerWaalsContact O-N 3.07Å; F1113-S1116 PolarHBondContact O-OG 3.3Å; S1116-G1120 WeakPolarHBondContact O-CA 3.29Å; S1116-G1120 PolarHBondContact O-N 3.49Å
1117	V	95.3	Very high	92.3	Very high	12 Å²	12	8.9 Å²	8.9	7%	0.073	5%	0.046	C	C	.	.	H	α-helix	trans	-66.6	-53.3	173.2	179.5	0	0	0	0	110.5	M1087 F1113 S1114 Y1115 V1121 V1154	M1087-V1117 HydrophobicContact SD-CG2 4.42Å; F1113-V1117 HydrophobicContact CE1-CG2 4.14Å; F1113-V1117 HydrophobicContact CZ-CG2 4.12Å; F1113-V1117 PolarHBondContact O-N 2.74Å; S1114-V1117 PolarHBondContact O-N 2.9Å; Y1115-V1117 VanDerWaalsContact C-N 3.27Å; Y1115-V1117 PolarHBondContact O-N 3.26Å; V1117-V1121 WeakPolarHBondContact O-CB 3.23Å; V1117-V1121 VanDerWaalsContact O-CG2 3.26Å; V1117-V1121 WeakPolarHBondContact O-CG2 3.49Å; V1117-V1121 PolarHBondContact O-N 3.1Å; V1117-V1154 HydrophobicContact CG2-CG1 4.31Å; V1117-V1154 HydrophobicContact CG2-CG2 3.96Å
1118	C	95.1	Very high	92.2	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-58.7	-51.7	-178.7	-77.6	0	0	0	0	113.1	S1114 Y1115 V1121 L1122	S1114-C1118 PolarHBondContact O-N 3.33Å; S1114-C1118 VanDerWaalsContact O-N 3.09Å; Y1115-C1118 PolarHBondContact O-N 2.97Å; C1118-V1121 PolarHBondContact O-N 3.38Å; C1118-L1122 WeakPolarHBondContact O-CG 3.42Å; C1118-L1122 PolarHBondContact O-N 2.89Å
1119	F	95.6	Very high	92.2	Very high	1 Å²	1	11.8 Å²	11.8	0%	0.004	6%	0.06	C	C	.	.	H	α-helix	trans	-74.9	-34.3	-176.4	-60.6	-12.4	0	0	0	111.8	Y1115 V1121 L1122 I1123 V1202 L1205 L1206 L1236	Y1115-F1119 AromaticContact CD1-CE1 3.85Å; Y1115-F1119 HydrophobicContact CD1-CE1 3.85Å; Y1115-F1119 AromaticContact CD1-CE2 3.98Å; Y1115-F1119 HydrophobicContact CD1-CE2 3.98Å; Y1115-F1119 AromaticContact CD1-CZ 3.5Å; Y1115-F1119 HydrophobicContact CD1-CZ 3.5Å; Y1115-F1119 VanDerWaalsContact CD1-CZ 3.5Å; Y1115-F1119 HydrophobicContact CE1-CE1 4.45Å; Y1115-F1119 HydrophobicContact CE1-CZ 4.1Å; Y1115-F1119 HydrophobicContact CG-CE2 4.41Å; Y1115-F1119 HydrophobicContact CG-CZ 4.35Å; Y1115-F1119 WeakPolarHBondContact O-CB 3.35Å; Y1115-F1119 WeakPolarHBondContact O-CG 3.36Å; Y1115-F1119 PolarHBondContact O-N 3.15Å; F1119-V1121 VanDerWaalsContact C-N 3.32Å; F1119-V1121 PolarHBondContact O-N 3.45Å; F1119-L1122 HydrophobicContact CD1-CD1 4.15Å; F1119-L1122 PolarHBondContact O-N 2.75Å; F1119-I1123 WeakPolarHBondContact O-CG1 3.35Å; F1119-I1123 PolarHBondContact O-N 2.68Å; F1119-V1202 HydrophobicContact CD2-CG1 3.88Å; F1119-V1202 WeakPolarHBondContact CD2-O 3.47Å; F1119-V1202 HydrophobicContact CE2-CG1 3.53Å; F1119-L1205 HydrophobicContact CB-CB 3.88Å; F1119-L1205 HydrophobicContact CB-CD1 4.45Å; F1119-L1205 HydrophobicContact CD2-CB 4.22Å; F1119-L1206 HydrophobicContact CD2-CB 3.93Å; F1119-L1206 HydrophobicContact CE1-CD1 4.28Å; F1119-L1206 HydrophobicContact CE2-CB 3.72Å; F1119-L1206 HydrophobicContact CE2-CD1 4.34Å; F1119-L1206 HydrophobicContact CE2-CD2 4.3Å; F1119-L1206 HydrophobicContact CE2-CG 4.33Å; F1119-L1206 HydrophobicContact CZ-CB 4.32Å; F1119-L1206 HydrophobicContact CZ-CD1 4.11Å; F1119-L1206 HydrophobicContact CZ-CD2 4.26Å; F1119-L1206 HydrophobicContact CZ-CG 4.46Å; F1119-L1236 HydrophobicContact CE1-CD1 3.91Å
1120	G	95.3	Very high	91.9	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-58.8	-42.1	170.4	0	0	0	0	0	112.6	S1116 I1123 A1124	S1116-G1120 WeakPolarHBondContact O-CA 3.29Å; S1116-G1120 PolarHBondContact O-N 3.49Å; G1120-I1123 PolarHBondContact O-N 2.83Å; G1120-A1124 WeakPolarHBondContact O-CB 3.26Å; G1120-A1124 PolarHBondContact O-N 3.28Å
1121	V	94.8	Very high	91.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-69.5	-38.2	175.5	175.2	0	0	0	0	112.2	L1077 C1080 L1081 V1117 C1118 F1119 I1123 A1124 K1125 L1150	L1077-V1121 HydrophobicContact CB-CG1 4.28Å; L1077-V1121 HydrophobicContact CD2-CG1 4.46Å; L1077-V1121 WeakPolarHBondContact O-CG1 3.37Å; C1080-V1121 HydrophobicContact CB-CG2 4.09Å; L1081-V1121 HydrophobicContact CB-CG1 3.72Å; L1081-V1121 HydrophobicContact CD1-CB 4.28Å; L1081-V1121 HydrophobicContact CD1-CG1 4.15Å; L1081-V1121 HydrophobicContact CG-CG1 4.42Å; V1117-V1121 WeakPolarHBondContact O-CB 3.23Å; V1117-V1121 VanDerWaalsContact O-CG2 3.26Å; V1117-V1121 WeakPolarHBondContact O-CG2 3.49Å; V1117-V1121 PolarHBondContact O-N 3.1Å; C1118-V1121 PolarHBondContact O-N 3.38Å; F1119-V1121 VanDerWaalsContact C-N 3.32Å; F1119-V1121 PolarHBondContact O-N 3.45Å; V1121-I1123 VanDerWaalsContact C-N 3.35Å; V1121-I1123 PolarHBondContact O-N 2.8Å; V1121-A1124 PolarHBondContact O-N 2.9Å; V1121-K1125 WeakPolarHBondContact O-CB 3Å; V1121-K1125 PolarHBondContact O-N 3.35Å; V1121-L1150 HydrophobicContact CG2-CD1 3.68Å; V1121-L1150 HydrophobicContact CG2-CD2 3.77Å; V1121-L1150 HydrophobicContact CG2-CG 4.39Å
1122	L	94.1	Very high	90.8	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-59.4	-44.6	173.3	-72.4	177.9	0	0	0	111.5	L1081 C1118 F1119 A1126 A1209 L1229 M1274	L1081-L1122 HydrophobicContact CD1-CD2 4.49Å; L1081-L1122 HydrophobicContact CD2-CD2 4.49Å; C1118-L1122 WeakPolarHBondContact O-CG 3.42Å; C1118-L1122 PolarHBondContact O-N 2.89Å; F1119-L1122 HydrophobicContact CD1-CD1 4.15Å; F1119-L1122 PolarHBondContact O-N 2.75Å; L1122-A1126 VanDerWaalsContact O-CB 3.31Å; L1122-A1126 WeakPolarHBondContact O-CB 3.5Å; L1122-A1126 PolarHBondContact O-N 3.11Å; L1122-A1209 HydrophobicContact CB-CB 4.47Å; L1122-L1229 HydrophobicContact CB-CD2 4.14Å; L1122-L1229 HydrophobicContact CD2-CD2 3.94Å; L1122-L1229 HydrophobicContact CD2-CG 4.22Å; L1122-M1274 HydrophobicContact CD2-CG 4.34Å; L1122-M1274 HydrophobicContact CD2-SD 3.94Å
1123	I	94.5	Very high	89.9	Confident	10 Å²	10	22.4 Å²	22.4	5%	0.051	11%	0.109	C	C	.	.	H	α-helix	trans	-62	-52.4	175.4	-67.5	165.2	0	0	0	110.7	F1119 G1120 V1121 K1125 A1126 T1127 L1149 I1153 L1205 V1208 A1209 I1212	F1119-I1123 WeakPolarHBondContact O-CG1 3.35Å; F1119-I1123 PolarHBondContact O-N 2.68Å; G1120-I1123 PolarHBondContact O-N 2.83Å; V1121-I1123 VanDerWaalsContact C-N 3.35Å; V1121-I1123 PolarHBondContact O-N 2.8Å; I1123-K1125 VanDerWaalsContact C-N 3.29Å; I1123-K1125 PolarHBondContact O-N 2.89Å; I1123-A1126 PolarHBondContact O-N 3.21Å; I1123-T1127 PolarHBondContact O-N 2.91Å; I1123-T1127 PolarHBondContact O-OG1 2.67Å; I1123-L1149 HydrophobicContact CG2-CD2 4.37Å; I1123-I1153 HydrophobicContact CD1-CD1 4.3Å; I1123-I1153 HydrophobicContact CG2-CD1 4.47Å; I1123-L1205 HydrophobicContact CD1-CB 4.36Å; I1123-L1205 HydrophobicContact CD1-CD2 3.9Å; I1123-V1208 HydrophobicContact CD1-CB 4.33Å; I1123-V1208 HydrophobicContact CD1-CG1 4.01Å; I1123-V1208 HydrophobicContact CG1-CG1 4.33Å; I1123-A1209 HydrophobicContact CG1-CB 3.8Å; I1123-I1212 HydrophobicContact CG2-CD1 4.06Å
1124	A	93	Very high	88.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.7	-42.1	-178.8	0	0	0	0	0	112.2	L1077 G1120 V1121 Q1128 L1149	L1077-A1124 HydrophobicContact CD1-CB 4.31Å; L1077-A1124 HydrophobicContact CD2-CB 4.08Å; G1120-A1124 WeakPolarHBondContact O-CB 3.26Å; G1120-A1124 PolarHBondContact O-N 3.28Å; V1121-A1124 PolarHBondContact O-N 2.9Å; A1124-Q1128 WeakPolarHBondContact O-CB 3.49Å; A1124-Q1128 PolarHBondContact O-N 3.28Å; A1124-L1149 HydrophobicContact CB-CD2 4.38Å
1125	K	89.6	Confident	87.4	Confident	12 Å²	12	28.7 Å²	28.7	5%	0.052	15%	0.148	C	C	.	.	H	α-helix	trans	-68.4	-41.3	176.9	-175.7	-176.1	177.5	-171.4	0	112.8	V1121 I1123 T1127 Q1128 L1129 E1225 L1229 M1274	V1121-K1125 WeakPolarHBondContact O-CB 3Å; V1121-K1125 PolarHBondContact O-N 3.35Å; I1123-K1125 VanDerWaalsContact C-N 3.29Å; I1123-K1125 PolarHBondContact O-N 2.89Å; K1125-T1127 VanDerWaalsContact C-N 3.33Å; K1125-Q1128 PolarHBondContact O-N 2.99Å; K1125-L1129 HydrophobicContact CG-CD1 4.43Å; K1125-L1129 WeakPolarHBondContact O-CG 3.3Å; K1125-L1129 PolarHBondContact O-N 3.16Å; K1125-E1225 WeakPolarHBondContact CE-OE1 3.42Å; K1125-E1225 IonicContact NZ-OE1 2.7Å; K1125-E1225 PolarHBondContact NZ-OE1 3.37Å; K1125-L1229 HydrophobicContact CB-CD1 4.32Å; K1125-L1229 HydrophobicContact CD-CD1 4.01Å; K1125-L1229 HydrophobicContact CG-CD1 4.02Å; K1125-M1274 HydrophobicContact CD-SD 4.47Å; K1125-M1274 PolarHBondContact NZ-SD 2.81Å
1126	A	90	Very high	85.5	Confident	2 Å²	2	30.6 Å²	30.6	2%	0.017	17%	0.168	C	C	.	.	H	α-helix	trans	-63.8	-40.4	176.6	0	0	0	0	0	111.6	L1122 I1123 R1130 I1212 N1216 L1229	L1122-A1126 VanDerWaalsContact O-CB 3.31Å; L1122-A1126 WeakPolarHBondContact O-CB 3.5Å; L1122-A1126 PolarHBondContact O-N 3.11Å; I1123-A1126 PolarHBondContact O-N 3.21Å; A1126-R1130 PolarHBondContact O-N 2.96Å; A1126-I1212 HydrophobicContact CB-CG2 3.72Å; A1126-N1216 PolarHBondContact O-ND2 3.39Å; A1126-L1229 HydrophobicContact CB-CD1 3.97Å; A1126-L1229 HydrophobicContact CB-CD2 4.22Å
1127	T	89.5	Confident	83.2	Confident	39 Å²	39	37.5 Å²	37.5	24%	0.239	20%	0.203	C	C	.	.	H	α-helix	trans	-66.8	-43.4	173.9	-59.2	0	0	0	0	111.9	I1123 K1125 L1129 R1130 N1131 Y1146	I1123-T1127 PolarHBondContact O-N 2.91Å; I1123-T1127 PolarHBondContact O-OG1 2.67Å; K1125-T1127 VanDerWaalsContact C-N 3.33Å; T1127-L1129 VanDerWaalsContact C-N 3.33Å; T1127-L1129 PolarHBondContact O-N 3.48Å; T1127-R1130 PolarHBondContact O-N 2.82Å; T1127-N1131 WeakPolarHBondContact O-CB 3.14Å; T1127-N1131 PolarHBondContact O-N 2.99Å; T1127-N1131 PolarHBondContact O-OD1 3.4Å; T1127-Y1146 HydrophobicContact CG2-CE1 4.3Å
1128	Q	87.2	Confident	80.9	Confident	64 Å²	64	44 Å²	44	30%	0.299	24%	0.237	S	C	.	.	H	α-helix	trans	-56.2	-45.3	174.9	-173.9	-167.8	11.4	0	0	112.1	A1124 K1125 N1131 S1132 Y1146	A1124-Q1128 WeakPolarHBondContact O-CB 3.49Å; A1124-Q1128 PolarHBondContact O-N 3.28Å; K1125-Q1128 PolarHBondContact O-N 2.99Å; Q1128-N1131 PolarHBondContact O-N 2.89Å; Q1128-S1132 PolarHBondContact O-N 3.39Å; Q1128-Y1146 VanDerWaalsContact CA-CE1 3.5Å; Q1128-Y1146 HydrophobicContact CB-CD1 4.05Å; Q1128-Y1146 HydrophobicContact CB-CE1 3.75Å; Q1128-Y1146 HydrophobicContact CB-CE2 4.32Å; Q1128-Y1146 HydrophobicContact CB-CG 4.47Å; Q1128-Y1146 HydrophobicContact CG-CD2 4.42Å; Q1128-Y1146 HydrophobicContact CG-CE1 4.32Å; Q1128-Y1146 HydrophobicContact CG-CE2 4Å
1129	L	82.8	Confident	78.9	Confident	10 Å²	10	45.9 Å²	45.9	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-43.6	179.4	-73.4	167	0	0	0	111.9	K1125 T1127 S1132 N1222 E1225 T1226 L1229	K1125-L1129 HydrophobicContact CG-CD1 4.43Å; K1125-L1129 WeakPolarHBondContact O-CG 3.3Å; K1125-L1129 PolarHBondContact O-N 3.16Å; T1127-L1129 VanDerWaalsContact C-N 3.33Å; T1127-L1129 PolarHBondContact O-N 3.48Å; L1129-S1132 PolarHBondContact O-N 3.23Å; L1129-S1132 PolarHBondContact O-OG 3.37Å; L1129-N1222 HydrophobicContact CD2-CB 4.13Å; L1129-E1225 HydrophobicContact CD1-CB 4.24Å; L1129-E1225 HydrophobicContact CD1-CG 4.12Å; L1129-T1226 HydrophobicContact CB-CG2 3.91Å; L1129-T1226 HydrophobicContact CD1-CG2 3.84Å; L1129-T1226 HydrophobicContact CG-CG2 4.44Å; L1129-L1229 HydrophobicContact CD1-CD1 4.31Å
1130	R	83.5	Confident	77.2	Confident	115 Å²	115	55.9 Å²	55.9	43%	0.434	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-47.9	174.8	-176.4	-179.6	-179.9	155.4	-6.4	112.2	A1126 T1127 S1132 E1133 T1134 N1216	A1126-R1130 PolarHBondContact O-N 2.96Å; T1127-R1130 PolarHBondContact O-N 2.82Å; R1130-S1132 PolarHBondContact O-N 3.37Å; R1130-E1133 PolarHBondContact O-N 2.97Å; R1130-T1134 PolarHBondContact O-N 3.18Å; R1130-T1134 VanDerWaalsContact O-N 3.12Å; R1130-T1134 PolarHBondContact O-OG1 3.22Å; R1130-N1216 WeakPolarHBondContact CD-OD1 3.41Å
1131	N	82.6	Confident	75.9	Confident	31 Å²	31	58.7 Å²	58.7	17%	0.166	31%	0.311	C	S	.	.	H	α-helix	trans	-59.7	-34.6	179.3	-68.7	-5.4	0	0	0	111.6	T1127 Q1128 E1133 T1134 L1135 I1141 Y1146	T1127-N1131 WeakPolarHBondContact O-CB 3.14Å; T1127-N1131 PolarHBondContact O-N 2.99Å; T1127-N1131 PolarHBondContact O-OD1 3.4Å; Q1128-N1131 PolarHBondContact O-N 2.89Å; N1131-E1133 PolarHBondContact O-N 3.18Å; N1131-T1134 PolarHBondContact O-N 3.13Å; N1131-T1134 PolarHBondContact O-OG1 3.33Å; N1131-L1135 HydrophobicContact CB-CD1 4.41Å; N1131-L1135 WeakPolarHBondContact O-CB 3.39Å; N1131-L1135 WeakPolarHBondContact O-CG 3.32Å; N1131-L1135 PolarHBondContact O-N 3.32Å; N1131-I1141 HydrophobicContact CB-CD1 4.18Å; N1131-Y1146 WeakPolarHBondContact CB-OH 3.19Å; N1131-Y1146 PolarHBondContact ND2-OH 2.89Å
1132	S	74.7	Confident	75.2	Confident	43 Å²	43	61.8 Å²	61.8	30%	0.301	33%	0.332	S	S	.	.	H	α-helix	trans	-70.4	-8.4	175.1	82.6	0	0	0	0	114.7	Q1128 L1129 R1130 R1221	Q1128-S1132 PolarHBondContact O-N 3.39Å; L1129-S1132 PolarHBondContact O-N 3.23Å; L1129-S1132 PolarHBondContact O-OG 3.37Å; R1130-S1132 PolarHBondContact O-N 3.37Å; S1132-R1221 PolarHBondContact O-NH1 3.33Å
1133	E	73.3	Confident	74.4	Confident	95 Å²	95	66.5 Å²	66.5	44%	0.444	35%	0.354	S	S	.	.	H	α-helix	trans	-99.5	-43.8	171.6	-165.3	169	-108.5	0	0	110.6	R1130 N1131 L1135 V1219	R1130-E1133 PolarHBondContact O-N 2.97Å; N1131-E1133 PolarHBondContact O-N 3.18Å; E1133-L1135 VanDerWaalsContact C-N 3.32Å; E1133-L1135 PolarHBondContact O-N 3.34Å; E1133-V1219 HydrophobicContact CB-CG1 4.46Å; E1133-V1219 WeakPolarHBondContact OE1-CA 3.3Å; E1133-V1219 WeakPolarHBondContact OE1-CG1 3.31Å; E1133-V1219 WeakPolarHBondContact OE2-CG2 3.48Å
1134	T	72.2	Confident	73.9	Confident	98 Å²	98	75.1 Å²	75.1	60%	0.601	39%	0.386	S	S	*	.	H	α-helix	trans	-69.9	-21.8	-177.7	56.2	0	0	0	0	114.8	R1130 N1131	R1130-T1134 PolarHBondContact O-N 3.18Å; R1130-T1134 VanDerWaalsContact O-N 3.12Å; R1130-T1134 PolarHBondContact O-OG1 3.22Å; N1131-T1134 PolarHBondContact O-N 3.13Å; N1131-T1134 PolarHBondContact O-OG1 3.33Å
1135	L	61.3	Low	73.6	Confident	70 Å²	70	79.1 Å²	79.1	37%	0.366	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	4.2	-176.8	-66.4	169.7	0	0	0	114.4	N1131 E1133 G1139 I1141	N1131-L1135 HydrophobicContact CB-CD1 4.41Å; N1131-L1135 WeakPolarHBondContact O-CB 3.39Å; N1131-L1135 WeakPolarHBondContact O-CG 3.32Å; N1131-L1135 PolarHBondContact O-N 3.32Å; E1133-L1135 VanDerWaalsContact C-N 3.32Å; E1133-L1135 PolarHBondContact O-N 3.34Å; L1135-G1139 PolarHBondContact O-N 3.37Å; L1135-G1139 VanDerWaalsContact O-N 3.14Å; L1135-I1141 HydrophobicContact CD1-CB 4.47Å; L1135-I1141 HydrophobicContact CD1-CD1 3.64Å; L1135-I1141 HydrophobicContact CD1-CG1 3.66Å
1136	G	55.7	Low	73.7	Confident	41 Å²	41	79.2 Å²	79.2	42%	0.423	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	-134.8	176	0	0	0	0	0	114.3	R1221	G1136-R1221 PolarHBondContact O-NH1 3.4Å
1137	I	47.4	Very low	73.8	Confident	144 Å²	144	84.3 Å²	84.3	74%	0.738	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-26.7	179.8	-62.8	175.6	0	0	0	111.6
1138	N	45.8	Very low	73.9	Confident	148 Å²	148	87.9 Å²	87.9	79%	0.791	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-18.3	-168.1	-63.1	5	0	0	0	114.3
1139	G	54.6	Low	74.1	Confident	41 Å²	41	87.5 Å²	87.5	42%	0.423	44%	0.444	S	S	.	.			trans	-84.6	117.9	-179.8	0	0	0	0	0	112.4	L1135	L1135-G1139 PolarHBondContact O-N 3.37Å; L1135-G1139 VanDerWaalsContact O-N 3.14Å
1140	Y	58.6	Low	74.6	Confident	210 Å²	210	87.5 Å²	87.5	82%	0.824	44%	0.444	S	S	*	.			trans	-104.5	130.1	175.9	71.3	-82.1	0	0	0	111
1141	I	69.4	Low	75.1	Confident	59 Å²	59	88.9 Å²	88.9	30%	0.303	45%	0.453	S	S	.	.			trans	-97.5	128	161.2	-79.9	174.9	0	0	0	108.1	N1131 L1135 Q1143 N1145 Y1146	N1131-I1141 HydrophobicContact CB-CD1 4.18Å; L1135-I1141 HydrophobicContact CD1-CB 4.47Å; L1135-I1141 HydrophobicContact CD1-CD1 3.64Å; L1135-I1141 HydrophobicContact CD1-CG1 3.66Å; I1141-Q1143 PolarHBondContact O-N 3.16Å; I1141-N1145 HydrophobicContact CG2-CB 3.95Å; I1141-Y1146 HydrophobicContact CG2-CE2 3.81Å; I1141-Y1146 WeakPolarHBondContact CG2-OH 3.41Å
1142	S	78.9	Confident	75.7	Confident	65 Å²	65	93.8 Å²	93.8	46%	0.455	47%	0.473	S	S	.	.			trans	-54	130	175.1	-178.7	0	0	0	0	110.9	W1144 N1145	S1142-W1144 PolarHBondContact O-N 3.36Å; S1142-W1144 VanDerWaalsContact O-N 3.12Å; S1142-N1145 WeakPolarHBondContact O-CB 3.48Å; S1142-N1145 PolarHBondContact O-N 3.45Å
1143	Q	77	Confident	76.7	Confident	99 Å²	99	92.1 Å²	92.1	46%	0.463	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22	-174.6	-67.9	161.4	2.1	0	0	112.2	N1074 I1141 N1145 Y1146	N1074-Q1143 PolarHBondContact ND2-OE1 2.81Å; I1141-Q1143 PolarHBondContact O-N 3.16Å; Q1143-N1145 PolarHBondContact O-N 2.73Å; Q1143-Y1146 PolarHBondContact O-N 3.38Å
1144	W	85.4	Confident	77.8	Confident	191 Å²	191	88.8 Å²	88.8	72%	0.723	45%	0.447	S	S	*	.	H	α-helix	trans	-56.9	-30.2	170.6	-71.7	102	0	0	0	114	S1142 Y1146 W1147 L1148	S1142-W1144 PolarHBondContact O-N 3.36Å; S1142-W1144 VanDerWaalsContact O-N 3.12Å; W1144-Y1146 VanDerWaalsContact C-N 3.33Å; W1144-Y1146 PolarHBondContact O-N 3.08Å; W1144-W1147 WeakPolarHBondContact O-CB 3.45Å; W1144-W1147 PolarHBondContact O-N 3.02Å; W1144-W1147 VanDerWaalsContact O-N 3.13Å; W1144-L1148 WeakPolarHBondContact O-CG 3.44Å; W1144-L1148 PolarHBondContact O-N 3.44Å
1145	N	86.8	Confident	78.8	Confident	85 Å²	85	86.4 Å²	86.4	46%	0.455	43%	0.434	S	S	.	.	H	α-helix	trans	-61.3	-41.9	179.1	-168	4.8	0	0	0	111.6	I1141 S1142 Q1143 W1147 L1148 L1149	I1141-N1145 HydrophobicContact CG2-CB 3.95Å; S1142-N1145 WeakPolarHBondContact O-CB 3.48Å; S1142-N1145 PolarHBondContact O-N 3.45Å; Q1143-N1145 PolarHBondContact O-N 2.73Å; N1145-W1147 VanDerWaalsContact C-N 3.32Å; N1145-W1147 PolarHBondContact O-N 2.95Å; N1145-L1148 PolarHBondContact O-N 3.45Å; N1145-L1149 PolarHBondContact O-N 2.81Å
1146	Y	90.7	Very high	80.4	Confident	14 Å²	14	85.2 Å²	85.2	6%	0.055	43%	0.43	C	S	.	.	H	α-helix	trans	-70.5	-28.8	176.9	-50.8	-70.3	0	0	0	112.7	T1127 Q1128 N1131 I1141 Q1143 W1144 L1150	T1127-Y1146 HydrophobicContact CG2-CE1 4.3Å; Q1128-Y1146 VanDerWaalsContact CA-CE1 3.5Å; Q1128-Y1146 HydrophobicContact CB-CD1 4.05Å; Q1128-Y1146 HydrophobicContact CB-CE1 3.75Å; Q1128-Y1146 HydrophobicContact CB-CE2 4.32Å; Q1128-Y1146 HydrophobicContact CB-CG 4.47Å; Q1128-Y1146 HydrophobicContact CG-CD2 4.42Å; Q1128-Y1146 HydrophobicContact CG-CE1 4.32Å; Q1128-Y1146 HydrophobicContact CG-CE2 4Å; N1131-Y1146 WeakPolarHBondContact CB-OH 3.19Å; N1131-Y1146 PolarHBondContact ND2-OH 2.89Å; I1141-Y1146 HydrophobicContact CG2-CE2 3.81Å; I1141-Y1146 WeakPolarHBondContact CG2-OH 3.41Å; Q1143-Y1146 PolarHBondContact O-N 3.38Å; W1144-Y1146 VanDerWaalsContact C-N 3.33Å; W1144-Y1146 PolarHBondContact O-N 3.08Å; Y1146-L1150 WeakPolarHBondContact O-CB 3.2Å; Y1146-L1150 PolarHBondContact O-N 3.43Å; Y1146-L1150 VanDerWaalsContact O-N 3.12Å
1147	W	91.7	Very high	82.2	Confident	109 Å²	109	83.3 Å²	83.3	41%	0.413	41%	0.41	S	S	.	.	H	α-helix	trans	-72.8	-38.9	172.6	-84	98.8	0	0	0	112.7	S1076 W1144 N1145 L1150 F1151	S1076-W1147 PolarHBondContact OG-NE1 2.9Å; W1144-W1147 WeakPolarHBondContact O-CB 3.45Å; W1144-W1147 PolarHBondContact O-N 3.02Å; W1144-W1147 VanDerWaalsContact O-N 3.13Å; N1145-W1147 VanDerWaalsContact C-N 3.32Å; N1145-W1147 PolarHBondContact O-N 2.95Å; W1147-L1150 HydrophobicContact CE3-CD2 4.46Å; W1147-L1150 PolarHBondContact O-N 3.18Å; W1147-F1151 WeakPolarHBondContact O-CB 3.48Å; W1147-F1151 PolarHBondContact O-N 3.38Å
1148	L	91.7	Very high	84.3	Confident	114 Å²	114	79.6 Å²	79.6	60%	0.597	39%	0.39	S	S	*	.	H	α-helix	trans	-64.3	-42.8	174.1	-71.7	169.3	0	0	0	111.5	W1144 N1145 L1150 F1151 F1152	W1144-L1148 WeakPolarHBondContact O-CG 3.44Å; W1144-L1148 PolarHBondContact O-N 3.44Å; N1145-L1148 PolarHBondContact O-N 3.45Å; L1148-L1150 PolarHBondContact O-N 3.04Å; L1148-F1151 PolarHBondContact O-N 2.93Å; L1148-F1152 PolarHBondContact O-N 3.31Å
1149	L	92	Very high	86.5	Confident	56 Å²	56	75.3 Å²	75.3	29%	0.293	38%	0.376	S	S	.	.	H	α-helix	trans	-59	-45.4	173.2	177.1	61.4	0	0	0	112	I1123 A1124 N1145 I1153	I1123-L1149 HydrophobicContact CG2-CD2 4.37Å; A1124-L1149 HydrophobicContact CB-CD2 4.38Å; N1145-L1149 PolarHBondContact O-N 2.81Å; L1149-I1153 HydrophobicContact CD1-CD1 4.04Å; L1149-I1153 HydrophobicContact CG-CD1 4.15Å; L1149-I1153 WeakPolarHBondContact O-CG1 3.47Å; L1149-I1153 PolarHBondContact O-N 2.88Å; L1149-I1153 VanDerWaalsContact O-N 3.17Å
1150	L	94	Very high	88.2	Confident	10 Å²	10	76.2 Å²	76.2	5%	0.052	37%	0.37	C	S	.	.	H	α-helix	trans	-64.9	-44.9	177.2	178.3	62.6	0	0	0	112.1	V1121 Y1146 W1147 L1148 F1152 I1153 V1154	V1121-L1150 HydrophobicContact CG2-CD1 3.68Å; V1121-L1150 HydrophobicContact CG2-CD2 3.77Å; V1121-L1150 HydrophobicContact CG2-CG 4.39Å; Y1146-L1150 WeakPolarHBondContact O-CB 3.2Å; Y1146-L1150 PolarHBondContact O-N 3.43Å; Y1146-L1150 VanDerWaalsContact O-N 3.12Å; W1147-L1150 HydrophobicContact CE3-CD2 4.46Å; W1147-L1150 PolarHBondContact O-N 3.18Å; L1148-L1150 PolarHBondContact O-N 3.04Å; L1150-F1152 VanDerWaalsContact C-N 3.34Å; L1150-F1152 PolarHBondContact O-N 3.22Å; L1150-I1153 PolarHBondContact O-N 3.46Å; L1150-V1154 HydrophobicContact CD1-CG2 3.97Å; L1150-V1154 HydrophobicContact CG-CG2 4.44Å; L1150-V1154 WeakPolarHBondContact O-CG2 3.5Å; L1150-V1154 PolarHBondContact O-N 3.21Å
1151	F	94.2	Very high	89.6	Confident	144 Å²	144	66.3 Å²	66.3	63%	0.632	33%	0.331	S	S	*	.	H	α-helix	trans	-57.2	-47.5	177.4	177.3	-98.3	0	0	0	111	W1147 L1148 I1153 V1154 S1155	W1147-F1151 WeakPolarHBondContact O-CB 3.48Å; W1147-F1151 PolarHBondContact O-N 3.38Å; L1148-F1151 PolarHBondContact O-N 2.93Å; F1151-I1153 PolarHBondContact O-N 2.75Å; F1151-V1154 PolarHBondContact O-N 3.23Å; F1151-S1155 WeakPolarHBondContact O-CB 3.39Å; F1151-S1155 PolarHBondContact O-N 3.49Å; F1151-S1155 PolarHBondContact O-OG 3.39Å
1152	F	95	Very high	90.4	Very high	133 Å²	133	67.5 Å²	67.5	58%	0.583	34%	0.338	S	S	*	.	H	α-helix	trans	-56.9	-50.3	176	178.8	-101.2	0	0	0	112.5	L1148 L1150 V1154 S1155 V1156	L1148-F1152 PolarHBondContact O-N 3.31Å; L1150-F1152 VanDerWaalsContact C-N 3.34Å; L1150-F1152 PolarHBondContact O-N 3.22Å; F1152-V1154 PolarHBondContact O-N 2.77Å; F1152-S1155 PolarHBondContact O-N 3.44Å; F1152-V1156 HydrophobicContact CZ-CG2 4.39Å; F1152-V1156 WeakPolarHBondContact O-CG2 3.33Å; F1152-V1156 PolarHBondContact O-N 3.11Å
1153	I	95.5	Very high	90.7	Very high	9 Å²	9	69.4 Å²	69.4	5%	0.046	34%	0.34	C	S	.	.	H	α-helix	trans	-60.1	-44.5	-179.4	-69.5	167.7	0	0	0	111.6	I1123 L1149 L1150 F1151 L1205	I1123-I1153 HydrophobicContact CD1-CD1 4.3Å; I1123-I1153 HydrophobicContact CG2-CD1 4.47Å; L1149-I1153 HydrophobicContact CD1-CD1 4.04Å; L1149-I1153 HydrophobicContact CG-CD1 4.15Å; L1149-I1153 WeakPolarHBondContact O-CG1 3.47Å; L1149-I1153 PolarHBondContact O-N 2.88Å; L1149-I1153 VanDerWaalsContact O-N 3.17Å; L1150-I1153 PolarHBondContact O-N 3.46Å; F1151-I1153 PolarHBondContact O-N 2.75Å; I1153-L1205 HydrophobicContact CG1-CD2 4.4Å; I1153-L1205 HydrophobicContact CG2-CD1 3.6Å; I1153-L1205 HydrophobicContact CG2-CD2 3.71Å; I1153-L1205 HydrophobicContact CG2-CG 4.33Å
1154	V	95	Very high	90.9	Very high	25 Å²	25	67 Å²	67	15%	0.152	33%	0.327	C	S	.	.	H	α-helix	trans	-71.8	-36.2	-179.4	175.7	0	0	0	0	111.5	F1113 V1117 L1150 F1151 F1152 V1156 Q1157 M1158	F1113-V1154 HydrophobicContact CD2-CG1 4.34Å; F1113-V1154 HydrophobicContact CE2-CG1 3.5Å; F1113-V1154 VanDerWaalsContact CE2-CG1 3.5Å; F1113-V1154 HydrophobicContact CZ-CG1 4.07Å; V1117-V1154 HydrophobicContact CG2-CG1 4.31Å; V1117-V1154 HydrophobicContact CG2-CG2 3.96Å; L1150-V1154 HydrophobicContact CD1-CG2 3.97Å; L1150-V1154 HydrophobicContact CG-CG2 4.44Å; L1150-V1154 WeakPolarHBondContact O-CG2 3.5Å; L1150-V1154 PolarHBondContact O-N 3.21Å; F1151-V1154 PolarHBondContact O-N 3.23Å; F1152-V1154 PolarHBondContact O-N 2.77Å; V1154-V1156 VanDerWaalsContact C-N 3.33Å; V1154-V1156 PolarHBondContact O-N 2.9Å; V1154-Q1157 PolarHBondContact O-N 2.76Å; V1154-M1158 WeakPolarHBondContact O-CB 3.49Å; V1154-M1158 PolarHBondContact O-N 2.82Å
1155	S	94.1	Very high	90.4	Very high	47 Å²	47	59.3 Å²	59.3	33%	0.329	30%	0.304	S	S	.	.	H	α-helix	trans	-63.2	-34.6	176.4	-67.1	0	0	0	0	113.3	F1151 F1152 M1158 A1159	F1151-S1155 WeakPolarHBondContact O-CB 3.39Å; F1151-S1155 PolarHBondContact O-N 3.49Å; F1151-S1155 PolarHBondContact O-OG 3.39Å; F1152-S1155 PolarHBondContact O-N 3.44Å; S1155-M1158 PolarHBondContact O-N 3Å; S1155-A1159 PolarHBondContact O-N 2.97Å
1156	V	94.8	Very high	90	Very high	46 Å²	46	61 Å²	61	28%	0.279	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-48.9	176.7	172.9	0	0	0	0	111.2	F1152 V1154 M1158 A1159 L1160 Y1201	F1152-V1156 HydrophobicContact CZ-CG2 4.39Å; F1152-V1156 WeakPolarHBondContact O-CG2 3.33Å; F1152-V1156 PolarHBondContact O-N 3.11Å; V1154-V1156 VanDerWaalsContact C-N 3.33Å; V1154-V1156 PolarHBondContact O-N 2.9Å; V1156-M1158 VanDerWaalsContact C-N 3.34Å; V1156-M1158 PolarHBondContact O-N 3.09Å; V1156-A1159 PolarHBondContact O-N 3.26Å; V1156-L1160 HydrophobicContact CG1-CD1 4.38Å; V1156-L1160 WeakPolarHBondContact O-CG 3.46Å; V1156-L1160 PolarHBondContact O-N 2.97Å; V1156-Y1201 HydrophobicContact CB-CE1 3.96Å; V1156-Y1201 HydrophobicContact CB-CE2 4.43Å; V1156-Y1201 HydrophobicContact CG1-CD1 4.19Å; V1156-Y1201 HydrophobicContact CG1-CD2 4.11Å; V1156-Y1201 HydrophobicContact CG1-CE1 3.8Å; V1156-Y1201 HydrophobicContact CG1-CE2 3.74Å; V1156-Y1201 HydrophobicContact CG1-CG 4.33Å
1157	Q	94.2	Very high	89	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-67.9	-34.3	177.3	-169	69.3	49.9	0	0	112.1	S1112 V1154 A1159 L1160 N1161 S1198 Y1201	S1112-Q1157 VanDerWaalsContact CB-NE2 3.34Å; V1154-Q1157 PolarHBondContact O-N 2.76Å; Q1157-A1159 VanDerWaalsContact C-N 3.34Å; Q1157-A1159 PolarHBondContact O-N 2.81Å; Q1157-L1160 PolarHBondContact O-N 3.29Å; Q1157-N1161 PolarHBondContact NE2-OD1 3.36Å; Q1157-N1161 WeakPolarHBondContact O-CB 3.18Å; Q1157-N1161 VanDerWaalsContact O-CG 3.27Å; Q1157-N1161 PolarHBondContact O-N 3.24Å; Q1157-N1161 PolarHBondContact O-OD1 3.3Å; Q1157-S1198 PolarHBondContact NE2-O 3.15Å; Q1157-Y1201 HydrophobicContact CB-CD1 4.26Å; Q1157-Y1201 HydrophobicContact CB-CE1 4.49Å
1158	M	92	Very high	87.7	Confident	66 Å²	66	68.9 Å²	68.9	33%	0.325	35%	0.346	S	S	.	.	H	α-helix	trans	-56.6	-47.3	173.2	178.6	68.4	77.4	0	0	111.3	F1109 F1113 V1154 S1155 V1156 N1161 L1162	F1109-M1158 HydrophobicContact CE2-SD 3.63Å; F1109-M1158 HydrophobicContact CZ-CE 3.92Å; F1109-M1158 HydrophobicContact CZ-SD 3.62Å; F1113-M1158 HydrophobicContact CD2-CE 4.26Å; F1113-M1158 HydrophobicContact CE2-CE 3.68Å; F1113-M1158 HydrophobicContact CZ-CE 4.33Å; V1154-M1158 WeakPolarHBondContact O-CB 3.49Å; V1154-M1158 PolarHBondContact O-N 2.82Å; S1155-M1158 PolarHBondContact O-N 3Å; V1156-M1158 VanDerWaalsContact C-N 3.34Å; V1156-M1158 PolarHBondContact O-N 3.09Å; M1158-N1161 PolarHBondContact O-N 3.18Å; M1158-L1162 HydrophobicContact CG-CD1 3.94Å; M1158-L1162 WeakPolarHBondContact O-CB 3.44Å; M1158-L1162 VanDerWaalsContact O-CG 3.27Å; M1158-L1162 WeakPolarHBondContact O-CG 3.42Å; M1158-L1162 PolarHBondContact O-N 2.97Å; M1158-L1162 HydrophobicContact SD-CD1 4.13Å; M1158-L1162 HydrophobicContact SD-CG 4.31Å
1159	A	91.8	Very high	86	Confident	59 Å²	59	69.9 Å²	69.9	49%	0.488	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-45.3	178.7	0	0	0	0	0	112.4	S1155 V1156 Q1157 N1161 L1162 Q1163	S1155-A1159 PolarHBondContact O-N 2.97Å; V1156-A1159 PolarHBondContact O-N 3.26Å; Q1157-A1159 VanDerWaalsContact C-N 3.34Å; Q1157-A1159 PolarHBondContact O-N 2.81Å; A1159-N1161 PolarHBondContact O-N 3.1Å; A1159-L1162 PolarHBondContact O-N 3.04Å; A1159-Q1163 PolarHBondContact O-N 2.69Å; A1159-Q1163 VanDerWaalsContact O-N 3.08Å
1160	L	90.4	Very high	84.5	Confident	60 Å²	60	67.5 Å²	67.5	31%	0.314	34%	0.339	S	S	.	.	H	α-helix	trans	-59.6	-46	175.9	-66.8	172.1	0	0	0	111.5	V1156 Q1157 L1162 Q1163 W1164 Y1201	V1156-L1160 HydrophobicContact CG1-CD1 4.38Å; V1156-L1160 WeakPolarHBondContact O-CG 3.46Å; V1156-L1160 PolarHBondContact O-N 2.97Å; Q1157-L1160 PolarHBondContact O-N 3.29Å; L1160-L1162 PolarHBondContact O-N 2.86Å; L1160-Q1163 PolarHBondContact O-N 3.02Å; L1160-W1164 PolarHBondContact O-N 3.29Å; L1160-Y1201 HydrophobicContact CD1-CG 4.44Å
1161	N	88	Confident	82.7	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-66.3	-37	179.9	-72.4	6.8	0	0	0	112.6	F1109 Q1157 M1158 A1159 W1164 A1165	F1109-N1161 HydrophobicContact CD2-CB 3.68Å; F1109-N1161 HydrophobicContact CE2-CB 4.04Å; F1109-N1161 HydrophobicContact CG-CB 4.48Å; F1109-N1161 PolarHBondContact O-ND2 3.39Å; Q1157-N1161 PolarHBondContact NE2-OD1 3.36Å; Q1157-N1161 WeakPolarHBondContact O-CB 3.18Å; Q1157-N1161 VanDerWaalsContact O-CG 3.27Å; Q1157-N1161 PolarHBondContact O-N 3.24Å; Q1157-N1161 PolarHBondContact O-OD1 3.3Å; M1158-N1161 PolarHBondContact O-N 3.18Å; A1159-N1161 PolarHBondContact O-N 3.1Å; N1161-W1164 PolarHBondContact O-N 3.43Å; N1161-A1165 WeakPolarHBondContact O-CB 3.07Å; N1161-A1165 PolarHBondContact O-N 2.96Å
1162	L	86.2	Confident	80.9	Confident	84 Å²	84	66 Å²	66	44%	0.44	34%	0.343	S	S	.	.	H	α-helix	trans	-66.6	-43.6	177.5	-76.1	169.9	0	0	0	112.1	M1158 A1159 L1160 W1164 A1165 I1166	M1158-L1162 HydrophobicContact CG-CD1 3.94Å; M1158-L1162 WeakPolarHBondContact O-CB 3.44Å; M1158-L1162 VanDerWaalsContact O-CG 3.27Å; M1158-L1162 WeakPolarHBondContact O-CG 3.42Å; M1158-L1162 PolarHBondContact O-N 2.97Å; M1158-L1162 HydrophobicContact SD-CD1 4.13Å; M1158-L1162 HydrophobicContact SD-CG 4.31Å; A1159-L1162 PolarHBondContact O-N 3.04Å; L1160-L1162 PolarHBondContact O-N 2.86Å; L1162-W1164 PolarHBondContact O-N 3.39Å; L1162-A1165 PolarHBondContact O-N 3.38Å; L1162-I1166 WeakPolarHBondContact O-CD1 3.38Å; L1162-I1166 VanDerWaalsContact O-CG1 3.27Å; L1162-I1166 WeakPolarHBondContact O-CG1 3.45Å; L1162-I1166 PolarHBondContact O-N 3.08Å; L1162-I1166 VanDerWaalsContact O-N 3.1Å
1163	Q	85.1	Confident	78.9	Confident	106 Å²	106	63.8 Å²	63.8	50%	0.495	34%	0.336	S	S	.	.	H	α-helix	trans	-53	-46.1	174.9	-179.6	-177.7	3.4	0	0	110.9	A1159 L1160 I1166 F1167	A1159-Q1163 PolarHBondContact O-N 2.69Å; A1159-Q1163 VanDerWaalsContact O-N 3.08Å; L1160-Q1163 PolarHBondContact O-N 3.02Å; Q1163-I1166 PolarHBondContact O-N 2.69Å; Q1163-F1167 HydrophobicContact CG-CD2 3.92Å; Q1163-F1167 HydrophobicContact CG-CE2 4.16Å; Q1163-F1167 WeakPolarHBondContact O-CD2 3.38Å; Q1163-F1167 PolarHBondContact O-N 3.29Å; Q1163-F1167 VanDerWaalsContact O-N 3.17Å
1164	W	80.4	Confident	76.7	Confident	49 Å²	49	66.9 Å²	66.9	19%	0.186	35%	0.35	C	S	.	.	H	α-helix	trans	-70.2	-37.3	-178.6	-76	54.8	0	0	0	113.1	H1108 L1160 N1161 L1162 I1166 E1194	H1108-W1164 AromaticContact CE1-CD2 3.91Å; H1108-W1164 AromaticContact CE1-CE3 3.62Å; H1108-W1164 AromaticContact CE1-CG 3.94Å; H1108-W1164 AromaticContact NE2-CD2 3.92Å; H1108-W1164 AromaticContact NE2-CE3 3.21Å; H1108-W1164 AromaticContact NE2-CZ3 3.77Å; L1160-W1164 PolarHBondContact O-N 3.29Å; N1161-W1164 PolarHBondContact O-N 3.43Å; L1162-W1164 PolarHBondContact O-N 3.39Å; W1164-I1166 PolarHBondContact O-N 3.09Å; W1164-E1194 HydrophobicContact CH2-CB 3.71Å; W1164-E1194 HydrophobicContact CH2-CG 4.09Å; W1164-E1194 WeakPolarHBondContact CH2-O 3.36Å; W1164-E1194 HydrophobicContact CZ3-CB 3.63Å; W1164-E1194 HydrophobicContact CZ3-CG 4.29Å; W1164-E1194 VanDerWaalsContact CZ3-O 3.22Å; W1164-E1194 WeakPolarHBondContact CZ3-O 3.21Å
1165	A	75.8	Confident	74.7	Confident	29 Å²	29	71.3 Å²	71.3	24%	0.24	37%	0.368	C	S	.	.	H	α-helix	trans	-70.7	-17	176.3	0	0	0	0	0	114.1	R1105 N1161 L1162	R1105-A1165 PolarHBondContact NH1-O 3Å; N1161-A1165 WeakPolarHBondContact O-CB 3.07Å; N1161-A1165 PolarHBondContact O-N 2.96Å; L1162-A1165 PolarHBondContact O-N 3.38Å
1166	I	76.8	Confident	72.6	Confident	121 Å²	121	71.8 Å²	71.8	62%	0.621	37%	0.366	S	S	*	.	H	α-helix	trans	-90.7	-46.1	177.8	-69	165.4	0	0	0	111.4	L1162 Q1163 W1164	L1162-I1166 WeakPolarHBondContact O-CD1 3.38Å; L1162-I1166 VanDerWaalsContact O-CG1 3.27Å; L1162-I1166 WeakPolarHBondContact O-CG1 3.45Å; L1162-I1166 PolarHBondContact O-N 3.08Å; L1162-I1166 VanDerWaalsContact O-N 3.1Å; Q1163-I1166 PolarHBondContact O-N 2.69Å; W1164-I1166 PolarHBondContact O-N 3.09Å
1167	F	69.7	Low	70.2	Confident	156 Å²	156	75.2 Å²	75.2	68%	0.684	39%	0.387	S	S	*	.	H	α-helix	trans	-95.4	2.5	-167.6	-65.7	-64.7	0	0	0	116.3	Q1163	Q1163-F1167 HydrophobicContact CG-CD2 3.92Å; Q1163-F1167 HydrophobicContact CG-CE2 4.16Å; Q1163-F1167 WeakPolarHBondContact O-CD2 3.38Å; Q1163-F1167 PolarHBondContact O-N 3.29Å; Q1163-F1167 VanDerWaalsContact O-N 3.17Å
1168	R	65	Low	67.7	Low	132 Å²	132	76.8 Å²	76.8	50%	0.498	40%	0.403	S	S	.	.	S	Bend	trans	-127	143.5	177.7	-75.2	-63.5	-165.9	-146.3	7.9	113.3	E1194	R1168-E1194 IonicContact CZ-OE1 3.1Å; R1168-E1194 IonicContact NE-OE1 3.58Å; R1168-E1194 PolarHBondContact NE-OE1 3.4Å; R1168-E1194 IonicContact NH2-OE1 2.95Å; R1168-E1194 PolarHBondContact NH2-OE1 3.01Å
1169	N	56.2	Low	65.4	Low	134 Å²	134	81.4 Å²	81.4	72%	0.717	43%	0.429	S	S	*	.			trans	-69.5	137.8	172.9	-72	-8.9	0	0	0	110.3
1170	S	59.7	Low	62.9	Low	6 Å²	6	87.2 Å²	87.2	4%	0.042	45%	0.446	C	S	.	.	S	Bend	trans	-82.1	-35.5	-166.3	21.1	0	0	0	0	114.8	D1101 C1104 R1105 C1188 G1189	D1101-S1170 WeakPolarHBondContact OD1-CB 3.31Å; D1101-S1170 PolarHBondContact OD1-OG 2.87Å; C1104-S1170 VanDerWaalsContact CB-O 3.29Å; C1104-S1170 WeakPolarHBondContact CB-O 3.47Å; C1104-S1170 PolarHBondContact SG-O 3.39Å; C1104-S1170 VanDerWaalsContact SG-O 3.39Å; R1105-S1170 PolarHBondContact NE-OG 3.46Å; R1105-S1170 PolarHBondContact NH2-OG 2.91Å; S1170-C1188 WeakPolarHBondContact O-CA 3.36Å; S1170-G1189 PolarHBondContact O-N 3.04Å; S1170-G1189 VanDerWaalsContact O-N 3.1Å
1171	V	57.7	Low	60.4	Low	45 Å²	45	87.3 Å²	87.3	27%	0.273	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	143	179.8	179.3	0	0	0	0	111	P1186 K1187	V1171-P1186 HydrophobicContact CG1-CB 4.24Å; V1171-K1187 WeakPolarHBondContact CA-O 3.44Å
1172	V	55.3	Low	58.2	Low	79 Å²	79	93 Å²	93	48%	0.479	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	139.7	173	174.7	0	0	0	0	108.4	K1187	V1172-K1187 PolarHBondContact N-O 2.94Å; V1172-K1187 PolarHBondContact O-N 3.41Å
1173	L	53.7	Low	56.5	Low	86 Å²	86	94.3 Å²	94.3	45%	0.45	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	128.3	175.1	-64.5	171.8	0	0	0	109.8	I1184	L1173-I1184 HydrophobicContact CB-CG2 4.13Å; L1173-I1184 HydrophobicContact CD2-CG2 3.99Å; L1173-I1184 HydrophobicContact CG-CG2 4.44Å
1174	H	48.5	Very low	55	Low	73 Å²	73	92.8 Å²	92.8	34%	0.338	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.5	176.3	-158.7	-63.8	0	0	0	109.4	V1185 K1187	H1174-V1185 WeakPolarHBondContact CA-O 3.45Å; H1174-V1185 WeakPolarHBondContact CB-O 3.38Å; H1174-V1185 PolarHBondContact N-O 3.09Å; H1174-V1185 PolarHBondContact O-N 3.31Å; H1174-K1187 HydrophobicContact CB-CB 4.11Å
1175	F	52.5	Low	54.1	Low	118 Å²	118	92.2 Å²	92.2	52%	0.518	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	134.9	170.1	-57.8	-86.8	0	0	0	108.7	I1184	F1175-I1184 HydrophobicContact CD1-CD1 4.32Å; F1175-I1184 HydrophobicContact CD1-CG1 3.88Å; F1175-I1184 HydrophobicContact CE1-CD1 3.79Å; F1175-I1184 HydrophobicContact CE1-CG1 3.85Å
1176	I	50.9	Low	53.4	Low	58 Å²	58	92.9 Å²	92.9	30%	0.297	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	98.9	169	-56.8	-176.8	0	0	0	106.2	G1178 F1183 V1185 Y1252	I1176-G1178 PolarHBondContact O-N 3.46Å; I1176-F1183 HydrophobicContact CB-CD2 4.5Å; I1176-F1183 HydrophobicContact CG2-CD2 4.47Å; I1176-F1183 PolarHBondContact N-O 2.94Å; I1176-F1183 PolarHBondContact O-N 2.86Å; I1176-V1185 HydrophobicContact CD1-CB 4.25Å; I1176-V1185 HydrophobicContact CD1-CG2 3.7Å; I1176-V1185 HydrophobicContact CG1-CG2 4.26Å; I1176-Y1252 HydrophobicContact CD1-CD1 4.25Å; I1176-Y1252 HydrophobicContact CD1-CE1 4.25Å
1177	T	44.4	Very low	53.3	Low	117 Å²	117	89.4 Å²	89.4	72%	0.718	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	104.7	174.1	51.7	0	0	0	0	109.1	D1182	T1177-D1182 WeakPolarHBondContact CA-OD1 3.37Å
1178	G	42	Very low	53.8	Low	33 Å²	33	82.3 Å²	82.3	34%	0.34	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	144	173	0	0	0	0	0	110.5	I1176 H1180 S1181	I1176-G1178 PolarHBondContact O-N 3.46Å; G1178-H1180 PolarHBondContact O-N 3.06Å; G1178-S1181 PolarHBondContact N-O 3.43Å; G1178-S1181 CarbonylContact O-C 3.56Å; G1178-S1181 PolarHBondContact O-N 2.95Å
1179	D	42.9	Very low	54.1	Low	164 Å²	164	77.2 Å²	77.2	88%	0.877	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-24.3	-171.2	-136.9	1.7	0	0	0	115.1
1180	H	40.4	Very low	55.1	Low	180 Å²	180	72.2 Å²	72.2	83%	0.833	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	7.1	179.3	-64.2	-17.6	0	0	0	115	G1178	G1178-H1180 PolarHBondContact O-N 3.06Å
1181	S	37.4	Very low	56.2	Low	62 Å²	62	75.4 Å²	75.4	43%	0.434	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	137.8	165.9	-12	0	0	0	0	112.3	G1178 F1183	G1178-S1181 PolarHBondContact N-O 3.43Å; G1178-S1181 CarbonylContact O-C 3.56Å; G1178-S1181 PolarHBondContact O-N 2.95Å; S1181-F1183 VanDerWaalsContact CB-CZ 3.46Å; S1181-F1183 WeakPolarHBondContact O-CE2 3.44Å; S1181-F1183 WeakPolarHBondContact OG-CZ 3.23Å
1182	D	42.2	Very low	57.4	Low	122 Å²	122	75.4 Å²	75.4	65%	0.652	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.1	167.3	-68	-44.4	0	0	0	111.1	T1177	T1177-D1182 WeakPolarHBondContact CA-OD1 3.37Å
1183	F	49.3	Very low	58.9	Low	110 Å²	110	78.2 Å²	78.2	48%	0.482	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.6	174.9	-41.3	-80.2	0	0	0	110.5	I1176 S1181 V1185	I1176-F1183 HydrophobicContact CB-CD2 4.5Å; I1176-F1183 HydrophobicContact CG2-CD2 4.47Å; I1176-F1183 PolarHBondContact N-O 2.94Å; I1176-F1183 PolarHBondContact O-N 2.86Å; S1181-F1183 VanDerWaalsContact CB-CZ 3.46Å; S1181-F1183 WeakPolarHBondContact O-CE2 3.44Å; S1181-F1183 WeakPolarHBondContact OG-CZ 3.23Å; F1183-V1185 HydrophobicContact CB-CG2 4.28Å
1184	I	53.2	Low	60.3	Low	75 Å²	75	75.7 Å²	75.7	39%	0.385	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	115.1	168.8	-54.2	-179.6	0	0	0	107.9	M1018 L1173 F1175	M1018-I1184 HydrophobicContact CE-CB 4.3Å; M1018-I1184 HydrophobicContact CE-CD1 3.65Å; M1018-I1184 HydrophobicContact CE-CG1 3.86Å; L1173-I1184 HydrophobicContact CB-CG2 4.13Å; L1173-I1184 HydrophobicContact CD2-CG2 3.99Å; L1173-I1184 HydrophobicContact CG-CG2 4.44Å; F1175-I1184 HydrophobicContact CD1-CD1 4.32Å; F1175-I1184 HydrophobicContact CD1-CG1 3.88Å; F1175-I1184 HydrophobicContact CE1-CD1 3.79Å; F1175-I1184 HydrophobicContact CE1-CG1 3.85Å
1185	V	62	Low	62.1	Low	36 Å²	36	72.4 Å²	72.4	22%	0.218	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125	179.8	-173.6	0	0	0	0	109	H1174 I1176 F1183 Y1252	H1174-V1185 WeakPolarHBondContact CA-O 3.45Å; H1174-V1185 WeakPolarHBondContact CB-O 3.38Å; H1174-V1185 PolarHBondContact N-O 3.09Å; H1174-V1185 PolarHBondContact O-N 3.31Å; I1176-V1185 HydrophobicContact CD1-CB 4.25Å; I1176-V1185 HydrophobicContact CD1-CG2 3.7Å; I1176-V1185 HydrophobicContact CG1-CG2 4.26Å; F1183-V1185 HydrophobicContact CB-CG2 4.28Å; V1185-Y1252 HydrophobicContact CG1-CE1 4.3Å
1186	P	62.6	Low	63.9	Low	43 Å²	43	68.5 Å²	68.5	28%	0.279	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	143.4	174.1	29.1	-34.6	0	0	0	110.4	P1099 V1171 Y1252	P1099-P1186 HydrophobicContact CG-CB 4.03Å; P1099-P1186 HydrophobicContact CG-CG 4.08Å; P1099-P1186 WeakPolarHBondContact CG-O 3.49Å; V1171-P1186 HydrophobicContact CG1-CB 4.24Å; P1186-Y1252 PolarHBondContact O-OH 3.09Å
1187	K	74	Confident	65.6	Low	49 Å²	49	69.7 Å²	69.7	21%	0.213	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	153.9	176.7	-171.6	-170.1	169.3	-170.5	0	108.7	V1171 V1172 H1174 Y1252	V1171-K1187 WeakPolarHBondContact CA-O 3.44Å; V1172-K1187 PolarHBondContact N-O 2.94Å; V1172-K1187 PolarHBondContact O-N 3.41Å; H1174-K1187 HydrophobicContact CB-CB 4.11Å; K1187-Y1252 HydrophobicContact CG-CE2 4.3Å
1188	C	79.4	Confident	67.7	Low	7 Å²	7	64.6 Å²	64.6	5%	0.047	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	144.9	169.3	-55.5	0	0	0	0	111.3	C1104 S1170 W1190	C1104-C1188 WeakPolarHBondContact CA-SG 3.4Å; C1104-C1188 HydrophobicContact CB-CB 3.72Å; C1104-C1188 WeakPolarHBondContact CB-SG 3.04Å; C1104-C1188 WeakPolarHBondContact SG-CA 3.35Å; C1104-C1188 WeakPolarHBondContact SG-CB 3.34Å; C1104-C1188 CovalentContact SG-SG 2.04Å; C1104-C1188 PolarHBondContact SG-SG 3.15Å; S1170-C1188 WeakPolarHBondContact O-CA 3.36Å; C1188-W1190 VanDerWaalsContact C-N 3.3Å; C1188-W1190 HydrophobicContact CB-CD2 4.38Å; C1188-W1190 VanDerWaalsContact CB-CE2 3.47Å; C1188-W1190 HydrophobicContact CB-CH2 4.43Å; C1188-W1190 HydrophobicContact CB-CZ2 3.49Å; C1188-W1190 VanDerWaalsContact CB-CZ2 3.49Å; C1188-W1190 PolarHBondContact O-N 2.8Å; C1188-W1190 VanDerWaalsContact O-N 3.09Å
1189	G	71.7	Confident	70	Confident	24 Å²	24	63.1 Å²	63.1	25%	0.247	34%	0.336	C	S	.	.	S	Bend	trans	-74.8	8.1	-163.4	0	0	0	0	0	118.9	S1170	S1170-G1189 PolarHBondContact O-N 3.04Å; S1170-G1189 VanDerWaalsContact O-N 3.1Å
1190	W	77.3	Confident	72.3	Confident	29 Å²	29	58.9 Å²	58.9	11%	0.11	32%	0.319	C	S	.	.			trans	-93.2	149.5	178.9	27.6	71.3	0	0	0	113.5	C1104 H1108 C1188 E1194	C1104-W1190 HydrophobicContact CB-CH2 4.17Å; C1104-W1190 HydrophobicContact CB-CZ2 4.15Å; C1104-W1190 WeakPolarHBondContact O-CH2 3.3Å; C1104-W1190 WeakPolarHBondContact O-CZ2 3.5Å; H1108-W1190 HydrophobicContact CB-CE3 4.39Å; H1108-W1190 HydrophobicContact CB-CH2 3.34Å; H1108-W1190 HydrophobicContact CB-CZ2 3.6Å; H1108-W1190 HydrophobicContact CB-CZ3 3.76Å; C1188-W1190 VanDerWaalsContact C-N 3.3Å; C1188-W1190 HydrophobicContact CB-CD2 4.38Å; C1188-W1190 VanDerWaalsContact CB-CE2 3.47Å; C1188-W1190 HydrophobicContact CB-CH2 4.43Å; C1188-W1190 HydrophobicContact CB-CZ2 3.49Å; C1188-W1190 VanDerWaalsContact CB-CZ2 3.49Å; C1188-W1190 PolarHBondContact O-N 2.8Å; C1188-W1190 VanDerWaalsContact O-N 3.09Å; W1190-E1194 HydrophobicContact CB-CB 4.32Å
1191	T	82.2	Confident	74.9	Confident	73 Å²	73	52.3 Å²	52.3	45%	0.448	29%	0.287	S	S	.	.			trans	-75.6	164.3	167.6	64.6	0	0	0	0	111.7	E1194 F1195	T1191-E1194 WeakPolarHBondContact CB-OE2 3.43Å; T1191-E1194 WeakPolarHBondContact CG2-OE2 3.3Å; T1191-E1194 PolarHBondContact N-OE2 3.06Å; T1191-E1194 WeakPolarHBondContact O-CB 3.22Å; T1191-E1194 PolarHBondContact O-N 3.36Å; T1191-E1194 WeakPolarHBondContact OG1-CB 3.47Å; T1191-E1194 VanDerWaalsContact OG1-CD 3.3Å; T1191-E1194 VanDerWaalsContact OG1-CG 3.22Å; T1191-E1194 WeakPolarHBondContact OG1-CG 3.27Å; T1191-E1194 PolarHBondContact OG1-N 2.87Å; T1191-E1194 PolarHBondContact OG1-OE2 3.08Å; T1191-F1195 PolarHBondContact O-N 3.29Å
1192	D	84.2	Confident	77.6	Confident	45 Å²	45	49.3 Å²	49.3	24%	0.241	27%	0.267	C	S	.	.	H	α-helix	trans	-66.5	-40	-178.8	-60.5	-45.8	0	0	0	112.4	E1194 F1195 L1196 Y1247 K1255	D1192-E1194 VanDerWaalsContact C-N 3.34Å; D1192-F1195 PolarHBondContact O-N 3.3Å; D1192-L1196 WeakPolarHBondContact O-CD1 3.48Å; D1192-L1196 PolarHBondContact O-N 3.34Å; D1192-Y1247 HydrophobicContact CB-CE1 4.08Å; D1192-K1255 IonicContact OD1-NZ 3.84Å; D1192-K1255 PolarHBondContact OD1-NZ 2.83Å; D1192-K1255 IonicContact OD2-NZ 3.96Å; D1192-K1255 PolarHBondContact OD2-NZ 3.17Å
1193	H	85.3	Confident	80.1	Confident	138 Å²	138	46 Å²	46	64%	0.639	25%	0.25	S	S	*	.	H	α-helix	trans	-64.1	-39.7	176.5	-62.2	-58.1	0	0	0	112	L1196 T1197	H1193-L1196 PolarHBondContact O-N 3.15Å; H1193-T1197 WeakPolarHBondContact O-CB 3.35Å; H1193-T1197 PolarHBondContact O-N 2.96Å; H1193-T1197 PolarHBondContact O-OG1 3.19Å
1194	E	84.3	Confident	82.2	Confident	33 Å²	33	45.4 Å²	45.4	15%	0.154	25%	0.252	C	S	.	.	H	α-helix	trans	-60.4	-54.3	173	-80.9	173.1	129.6	0	0	110.6	W1164 R1168 W1190 T1191 D1192 L1196 T1197 S1198	W1164-E1194 HydrophobicContact CH2-CB 3.71Å; W1164-E1194 HydrophobicContact CH2-CG 4.09Å; W1164-E1194 WeakPolarHBondContact CH2-O 3.36Å; W1164-E1194 HydrophobicContact CZ3-CB 3.63Å; W1164-E1194 HydrophobicContact CZ3-CG 4.29Å; W1164-E1194 VanDerWaalsContact CZ3-O 3.22Å; W1164-E1194 WeakPolarHBondContact CZ3-O 3.21Å; R1168-E1194 IonicContact CZ-OE1 3.1Å; R1168-E1194 IonicContact NE-OE1 3.58Å; R1168-E1194 PolarHBondContact NE-OE1 3.4Å; R1168-E1194 IonicContact NH2-OE1 2.95Å; R1168-E1194 PolarHBondContact NH2-OE1 3.01Å; W1190-E1194 HydrophobicContact CB-CB 4.32Å; T1191-E1194 WeakPolarHBondContact CB-OE2 3.43Å; T1191-E1194 WeakPolarHBondContact CG2-OE2 3.3Å; T1191-E1194 PolarHBondContact N-OE2 3.06Å; T1191-E1194 WeakPolarHBondContact O-CB 3.22Å; T1191-E1194 PolarHBondContact O-N 3.36Å; T1191-E1194 WeakPolarHBondContact OG1-CB 3.47Å; T1191-E1194 VanDerWaalsContact OG1-CD 3.3Å; T1191-E1194 VanDerWaalsContact OG1-CG 3.22Å; T1191-E1194 WeakPolarHBondContact OG1-CG 3.27Å; T1191-E1194 PolarHBondContact OG1-N 2.87Å; T1191-E1194 PolarHBondContact OG1-OE2 3.08Å; D1192-E1194 VanDerWaalsContact C-N 3.34Å; E1194-L1196 VanDerWaalsContact C-N 3.26Å; E1194-L1196 PolarHBondContact O-N 3.16Å; E1194-T1197 PolarHBondContact O-N 3.41Å; E1194-S1198 PolarHBondContact O-N 2.78Å
1195	F	86.9	Confident	84.3	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-59.2	-33.9	-179.5	-176.2	-103.2	0	0	0	113.2	T1191 D1192 S1198 H1199 W1243 Y1247 V1259	T1191-F1195 PolarHBondContact O-N 3.29Å; D1192-F1195 PolarHBondContact O-N 3.3Å; F1195-S1198 PolarHBondContact O-OG 2.86Å; F1195-H1199 AromaticContact CE2-CE1 3.83Å; F1195-H1199 AromaticContact CZ-CE1 3.93Å; F1195-H1199 PolarHBondContact O-CE1 3.32Å; F1195-H1199 PolarHBondContact O-ND1 3.01Å; F1195-W1243 HydrophobicContact CE1-CH2 4.36Å; F1195-W1243 AromaticContact CE1-CZ2 3.82Å; F1195-W1243 HydrophobicContact CE1-CZ2 3.82Å; F1195-W1243 HydrophobicContact CZ-CZ2 4.45Å; F1195-Y1247 HydrophobicContact CD1-CD1 4.48Å; F1195-Y1247 HydrophobicContact CD1-CD2 4.31Å; F1195-Y1247 AromaticContact CD1-CE1 3.8Å; F1195-Y1247 HydrophobicContact CD1-CE1 3.8Å; F1195-Y1247 AromaticContact CD1-CE2 3.6Å; F1195-Y1247 HydrophobicContact CD1-CE2 3.6Å; F1195-Y1247 AromaticContact CD1-CZ 3.3Å; F1195-Y1247 VanDerWaalsContact CD1-OH 3.31Å; F1195-Y1247 WeakPolarHBondContact CD1-OH 3.4Å; F1195-Y1247 HydrophobicContact CE1-CD2 4.16Å; F1195-Y1247 AromaticContact CE1-CE2 3.51Å; F1195-Y1247 HydrophobicContact CE1-CE2 3.51Å; F1195-Y1247 AromaticContact CE1-CZ 3.74Å; F1195-V1259 HydrophobicContact CE1-CG2 4.19Å; F1195-V1259 HydrophobicContact CZ-CG2 4.35Å
1196	L	89.9	Confident	85.9	Confident	36 Å²	36	40.7 Å²	40.7	19%	0.188	23%	0.226	C	C	.	.	H	α-helix	trans	-71.3	-38.1	172.2	-95.1	72.7	0	0	0	112.9	D1192 H1193 E1194 S1198 H1199 Y1247 L1248	D1192-L1196 WeakPolarHBondContact O-CD1 3.48Å; D1192-L1196 PolarHBondContact O-N 3.34Å; H1193-L1196 PolarHBondContact O-N 3.15Å; E1194-L1196 VanDerWaalsContact C-N 3.26Å; E1194-L1196 PolarHBondContact O-N 3.16Å; L1196-S1198 PolarHBondContact O-N 3.49Å; L1196-H1199 PolarHBondContact O-N 3.24Å; L1196-Y1247 HydrophobicContact CD1-CD1 3.37Å; L1196-Y1247 HydrophobicContact CD1-CE1 3.95Å; L1196-Y1247 HydrophobicContact CD1-CG 3.92Å; L1196-L1248 HydrophobicContact CD2-CD1 3.82Å; L1196-L1248 HydrophobicContact CD2-CD2 4Å; L1196-L1248 HydrophobicContact CD2-CG 3.79Å
1197	T	86.9	Confident	87.5	Confident	84 Å²	84	42.5 Å²	42.5	52%	0.515	23%	0.233	S	C	.	.	H	α-helix	trans	-67	-35.7	-173.8	-64.1	0	0	0	0	112.7	H1193 E1194 H1199 S1200	H1193-T1197 WeakPolarHBondContact O-CB 3.35Å; H1193-T1197 PolarHBondContact O-N 2.96Å; H1193-T1197 PolarHBondContact O-OG1 3.19Å; E1194-T1197 PolarHBondContact O-N 3.41Å; T1197-H1199 PolarHBondContact O-N 3.2Å; T1197-H1199 VanDerWaalsContact O-N 3.17Å; T1197-S1200 VanDerWaalsContact O-CB 3.32Å; T1197-S1200 WeakPolarHBondContact O-CB 3.45Å; T1197-S1200 PolarHBondContact O-N 2.81Å; T1197-S1200 VanDerWaalsContact O-N 3.16Å; T1197-S1200 PolarHBondContact O-OG 3.43Å
1198	S	87.4	Confident	88.5	Confident	9 Å²	9	43 Å²	43	6%	0.063	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.4	177.4	58.7	0	0	0	0	114.4	H1108 Q1157 E1194 F1195 L1196	H1108-S1198 WeakPolarHBondContact NE2-CB 3.41Å; H1108-S1198 PolarHBondContact NE2-OG 2.82Å; Q1157-S1198 PolarHBondContact NE2-O 3.15Å; E1194-S1198 PolarHBondContact O-N 2.78Å; F1195-S1198 PolarHBondContact O-OG 2.86Å; L1196-S1198 PolarHBondContact O-N 3.49Å
1199	H	91.4	Very high	89.2	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.009	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-0.4	176.8	-62.5	86	0	0	0	114.2	H1111 S1112 F1195 L1196 T1197 Y1201 V1202 V1203 W1240	H1111-H1199 AromaticContact CE1-CD2 3.9Å; H1111-H1199 AromaticContact CE1-NE2 3.9Å; H1111-H1199 AromaticContact CG-NE2 3.79Å; H1111-H1199 AromaticContact ND1-CD2 3.36Å; H1111-H1199 PolarHBondContact ND1-CD2 2.92Å; H1111-H1199 AromaticContact ND1-NE2 3.07Å; H1111-H1199 PolarHBondContact ND1-NE2 3.07Å; S1112-H1199 PolarHBondContact OG-CD2 3.34Å; S1112-H1199 PolarHBondContact OG-CE1 2.66Å; S1112-H1199 PolarHBondContact OG-NE2 3.41Å; F1195-H1199 AromaticContact CE2-CE1 3.83Å; F1195-H1199 AromaticContact CZ-CE1 3.93Å; F1195-H1199 PolarHBondContact O-CE1 3.32Å; F1195-H1199 PolarHBondContact O-ND1 3.01Å; L1196-H1199 PolarHBondContact O-N 3.24Å; T1197-H1199 PolarHBondContact O-N 3.2Å; T1197-H1199 VanDerWaalsContact O-N 3.17Å; H1199-Y1201 VanDerWaalsContact C-N 3.35Å; H1199-Y1201 PolarHBondContact O-N 3.44Å; H1199-V1202 WeakPolarHBondContact O-CB 3.4Å; H1199-V1202 PolarHBondContact O-N 3.39Å; H1199-V1202 VanDerWaalsContact O-N 3.09Å; H1199-V1203 PolarHBondContact O-N 3.37Å; H1199-V1203 VanDerWaalsContact O-N 3.15Å; H1199-W1240 HydrophobicContact CB-CH2 4.49Å; H1199-W1240 HydrophobicContact CB-CZ3 4.11Å
1200	S	91	Very high	90.4	Very high	76 Å²	76	45.5 Å²	45.5	53%	0.531	24%	0.241	S	C	.	.	H	α-helix	trans	-55.5	-42.5	-179.4	53	0	0	0	0	113.9	T1197 V1203 L1204	T1197-S1200 VanDerWaalsContact O-CB 3.32Å; T1197-S1200 WeakPolarHBondContact O-CB 3.45Å; T1197-S1200 PolarHBondContact O-N 2.81Å; T1197-S1200 VanDerWaalsContact O-N 3.16Å; T1197-S1200 PolarHBondContact O-OG 3.43Å; S1200-V1203 PolarHBondContact O-N 3.03Å; S1200-L1204 PolarHBondContact O-N 3.2Å
1201	Y	95.2	Very high	91.2	Very high	41 Å²	41	49.2 Å²	49.2	16%	0.161	26%	0.258	C	S	.	.	H	α-helix	trans	-65.7	-37.3	176.3	-176.9	-110.1	0	0	0	112.5	V1156 Q1157 L1160 H1199 V1203 L1204 L1205	V1156-Y1201 HydrophobicContact CB-CE1 3.96Å; V1156-Y1201 HydrophobicContact CB-CE2 4.43Å; V1156-Y1201 HydrophobicContact CG1-CD1 4.19Å; V1156-Y1201 HydrophobicContact CG1-CD2 4.11Å; V1156-Y1201 HydrophobicContact CG1-CE1 3.8Å; V1156-Y1201 HydrophobicContact CG1-CE2 3.74Å; V1156-Y1201 HydrophobicContact CG1-CG 4.33Å; Q1157-Y1201 HydrophobicContact CB-CD1 4.26Å; Q1157-Y1201 HydrophobicContact CB-CE1 4.49Å; L1160-Y1201 HydrophobicContact CD1-CG 4.44Å; H1199-Y1201 VanDerWaalsContact C-N 3.35Å; H1199-Y1201 PolarHBondContact O-N 3.44Å; Y1201-V1203 PolarHBondContact O-N 3.07Å; Y1201-L1204 WeakPolarHBondContact O-CB 3.38Å; Y1201-L1204 PolarHBondContact O-N 2.78Å; Y1201-L1205 HydrophobicContact CD1-CD1 4.01Å; Y1201-L1205 HydrophobicContact CD1-CG 4.31Å; Y1201-L1205 HydrophobicContact CE1-CD1 3.68Å; Y1201-L1205 HydrophobicContact CE1-CD2 4.21Å; Y1201-L1205 HydrophobicContact CE1-CG 4.01Å; Y1201-L1205 WeakPolarHBondContact O-CG 3.32Å; Y1201-L1205 PolarHBondContact O-N 2.73Å
1202	V	93.9	Very high	91.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.7	-42	176.7	170.3	0	0	0	0	111.5	Y1115 F1119 H1199 L1204 L1205 L1206 W1240	Y1115-V1202 VanDerWaalsContact CB-CG1 3.42Å; Y1115-V1202 HydrophobicContact CD2-CG1 4.45Å; Y1115-V1202 HydrophobicContact CG-CG1 3.96Å; F1119-V1202 HydrophobicContact CD2-CG1 3.88Å; F1119-V1202 WeakPolarHBondContact CD2-O 3.47Å; F1119-V1202 HydrophobicContact CE2-CG1 3.53Å; H1199-V1202 WeakPolarHBondContact O-CB 3.4Å; H1199-V1202 PolarHBondContact O-N 3.39Å; H1199-V1202 VanDerWaalsContact O-N 3.09Å; V1202-L1204 VanDerWaalsContact C-N 3.34Å; V1202-L1204 PolarHBondContact O-N 3.05Å; V1202-L1205 PolarHBondContact O-N 3.07Å; V1202-L1206 PolarHBondContact O-N 2.63Å; V1202-L1206 VanDerWaalsContact O-N 3.1Å; V1202-W1240 HydrophobicContact CB-CH2 4.26Å; V1202-W1240 HydrophobicContact CG1-CH2 3.43Å; V1202-W1240 VanDerWaalsContact CG1-CH2 3.43Å; V1202-W1240 HydrophobicContact CG1-CZ2 3.73Å; V1202-W1240 HydrophobicContact CG1-CZ3 4.05Å
1203	V	93.5	Very high	92	Very high	51 Å²	51	45.2 Å²	45.2	31%	0.309	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-39.9	175.2	177.7	0	0	0	0	111.4	H1199 S1200 Y1201 L1206 L1207 W1240	H1199-V1203 PolarHBondContact O-N 3.37Å; H1199-V1203 VanDerWaalsContact O-N 3.15Å; S1200-V1203 PolarHBondContact O-N 3.03Å; Y1201-V1203 PolarHBondContact O-N 3.07Å; V1203-L1206 PolarHBondContact O-N 3.49Å; V1203-L1207 HydrophobicContact CG1-CD1 4.32Å; V1203-L1207 WeakPolarHBondContact O-CG 3.1Å; V1203-L1207 PolarHBondContact O-N 2.71Å; V1203-L1207 VanDerWaalsContact O-N 3.11Å; V1203-W1240 HydrophobicContact CG2-CE3 3.63Å; V1203-W1240 HydrophobicContact CG2-CZ3 3.89Å
1204	L	95	Very high	92.3	Very high	99 Å²	99	42.3 Å²	42.3	52%	0.518	22%	0.22	S	C	.	.	H	α-helix	trans	-62	-44.1	175.1	-179.6	63.5	0	0	0	112	S1200 Y1201 V1202 L1206 L1207 V1208	S1200-L1204 PolarHBondContact O-N 3.2Å; Y1201-L1204 WeakPolarHBondContact O-CB 3.38Å; Y1201-L1204 PolarHBondContact O-N 2.78Å; V1202-L1204 VanDerWaalsContact C-N 3.34Å; V1202-L1204 PolarHBondContact O-N 3.05Å; L1204-L1206 VanDerWaalsContact C-N 3.31Å; L1204-L1206 PolarHBondContact O-N 3.22Å; L1204-L1207 PolarHBondContact O-N 2.94Å; L1204-V1208 WeakPolarHBondContact O-CG2 3.29Å; L1204-V1208 PolarHBondContact O-N 3.05Å
1205	L	96.6	Very high	92.6	Very high	10 Å²	10	42.5 Å²	42.5	5%	0.052	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-40.2	175.4	-68	176.6	0	0	0	112	F1119 I1123 I1153 Y1201 V1202 V1208 A1209	F1119-L1205 HydrophobicContact CB-CB 3.88Å; F1119-L1205 HydrophobicContact CB-CD1 4.45Å; F1119-L1205 HydrophobicContact CD2-CB 4.22Å; I1123-L1205 HydrophobicContact CD1-CB 4.36Å; I1123-L1205 HydrophobicContact CD1-CD2 3.9Å; I1153-L1205 HydrophobicContact CG1-CD2 4.4Å; I1153-L1205 HydrophobicContact CG2-CD1 3.6Å; I1153-L1205 HydrophobicContact CG2-CD2 3.71Å; I1153-L1205 HydrophobicContact CG2-CG 4.33Å; Y1201-L1205 HydrophobicContact CD1-CD1 4.01Å; Y1201-L1205 HydrophobicContact CD1-CG 4.31Å; Y1201-L1205 HydrophobicContact CE1-CD1 3.68Å; Y1201-L1205 HydrophobicContact CE1-CD2 4.21Å; Y1201-L1205 HydrophobicContact CE1-CG 4.01Å; Y1201-L1205 WeakPolarHBondContact O-CG 3.32Å; Y1201-L1205 PolarHBondContact O-N 2.73Å; V1202-L1205 PolarHBondContact O-N 3.07Å; L1205-V1208 PolarHBondContact O-N 3.19Å; L1205-A1209 WeakPolarHBondContact O-CB 3.25Å; L1205-A1209 PolarHBondContact O-N 2.67Å
1206	L	95.7	Very high	92.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-41.6	178	-178.2	56.3	0	0	0	112.3	F1119 V1202 V1203 L1204 A1209 W1210 L1236 L1237 W1240	F1119-L1206 HydrophobicContact CD2-CB 3.93Å; F1119-L1206 HydrophobicContact CE1-CD1 4.28Å; F1119-L1206 HydrophobicContact CE2-CB 3.72Å; F1119-L1206 HydrophobicContact CE2-CD1 4.34Å; F1119-L1206 HydrophobicContact CE2-CD2 4.3Å; F1119-L1206 HydrophobicContact CE2-CG 4.33Å; F1119-L1206 HydrophobicContact CZ-CB 4.32Å; F1119-L1206 HydrophobicContact CZ-CD1 4.11Å; F1119-L1206 HydrophobicContact CZ-CD2 4.26Å; F1119-L1206 HydrophobicContact CZ-CG 4.46Å; V1202-L1206 PolarHBondContact O-N 2.63Å; V1202-L1206 VanDerWaalsContact O-N 3.1Å; V1203-L1206 PolarHBondContact O-N 3.49Å; L1204-L1206 VanDerWaalsContact C-N 3.31Å; L1204-L1206 PolarHBondContact O-N 3.22Å; L1206-A1209 PolarHBondContact O-N 3.43Å; L1206-W1210 WeakPolarHBondContact O-CB 3.25Å; L1206-W1210 PolarHBondContact O-N 3.36Å; L1206-L1236 HydrophobicContact CD1-CB 3.82Å; L1206-L1236 HydrophobicContact CD1-CD1 4.09Å; L1206-L1236 HydrophobicContact CD2-CB 4.04Å; L1206-L1237 HydrophobicContact CD2-CD2 3.89Å; L1206-L1237 HydrophobicContact CD2-CG 4.29Å; L1206-L1237 HydrophobicContact CG-CD2 3.83Å; L1206-L1237 HydrophobicContact CG-CG 4.24Å; L1206-W1240 HydrophobicContact CD2-CB 4.38Å; L1206-W1240 HydrophobicContact CD2-CG 4.05Å
1207	L	95.8	Very high	92.4	Very high	82 Å²	82	44.9 Å²	44.9	43%	0.429	23%	0.23	S	C	.	.	H	α-helix	trans	-64.3	-42.1	175.8	-70.5	167.5	0	0	0	111.9	V1203 L1204 W1210 F1211 L1237	V1203-L1207 HydrophobicContact CG1-CD1 4.32Å; V1203-L1207 WeakPolarHBondContact O-CG 3.1Å; V1203-L1207 PolarHBondContact O-N 2.71Å; V1203-L1207 VanDerWaalsContact O-N 3.11Å; L1204-L1207 PolarHBondContact O-N 2.94Å; L1207-W1210 PolarHBondContact O-N 3.33Å; L1207-F1211 WeakPolarHBondContact O-CB 3.36Å; L1207-F1211 PolarHBondContact O-N 3.43Å; L1207-L1237 HydrophobicContact CD2-CD2 3.79Å; L1207-L1237 HydrophobicContact CG-CD2 4.41Å
1208	V	95.7	Very high	92.1	Very high	60 Å²	60	46.3 Å²	46.3	36%	0.364	23%	0.234	S	C	.	.	H	α-helix	trans	-64.2	-45	175	171.4	0	0	0	0	111.2	I1123 L1204 L1205 W1210 F1211 I1212	I1123-V1208 HydrophobicContact CD1-CB 4.33Å; I1123-V1208 HydrophobicContact CD1-CG1 4.01Å; I1123-V1208 HydrophobicContact CG1-CG1 4.33Å; L1204-V1208 WeakPolarHBondContact O-CG2 3.29Å; L1204-V1208 PolarHBondContact O-N 3.05Å; L1205-V1208 PolarHBondContact O-N 3.19Å; V1208-W1210 VanDerWaalsContact C-N 3.34Å; V1208-W1210 PolarHBondContact O-N 3.44Å; V1208-F1211 PolarHBondContact O-N 3.31Å; V1208-I1212 HydrophobicContact CG1-CD1 3.7Å; V1208-I1212 HydrophobicContact CG1-CG1 4.43Å; V1208-I1212 VanDerWaalsContact O-CG1 3.31Å; V1208-I1212 WeakPolarHBondContact O-CG1 3.33Å; V1208-I1212 PolarHBondContact O-N 2.87Å
1209	A	94.3	Very high	91.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.8	-43.7	176	0	0	0	0	0	111.8	L1122 I1123 L1205 L1206 S1213	L1122-A1209 HydrophobicContact CB-CB 4.47Å; I1123-A1209 HydrophobicContact CG1-CB 3.8Å; L1205-A1209 WeakPolarHBondContact O-CB 3.25Å; L1205-A1209 PolarHBondContact O-N 2.67Å; L1206-A1209 PolarHBondContact O-N 3.43Å; A1209-S1213 VanDerWaalsContact O-CB 3.31Å; A1209-S1213 WeakPolarHBondContact O-CB 3.24Å; A1209-S1213 PolarHBondContact O-N 2.94Å; A1209-S1213 PolarHBondContact O-OG 3.39Å
1210	W	95.4	Very high	90.5	Very high	82 Å²	82	54.2 Å²	54.2	31%	0.311	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-48	176.1	-179.1	83.5	0	0	0	112.2	L1206 L1207 V1208 S1213 F1214 C1233 S1234 L1237	L1206-W1210 WeakPolarHBondContact O-CB 3.25Å; L1206-W1210 PolarHBondContact O-N 3.36Å; L1207-W1210 PolarHBondContact O-N 3.33Å; V1208-W1210 VanDerWaalsContact C-N 3.34Å; V1208-W1210 PolarHBondContact O-N 3.44Å; W1210-S1213 WeakPolarHBondContact O-CB 3.32Å; W1210-S1213 PolarHBondContact O-N 2.97Å; W1210-F1214 HydrophobicContact CZ2-CD2 4.32Å; W1210-F1214 WeakPolarHBondContact O-CB 3.42Å; W1210-F1214 PolarHBondContact O-N 2.94Å; W1210-C1233 HydrophobicContact CB-CB 3.87Å; W1210-C1233 HydrophobicContact CG-CB 4.36Å; W1210-S1234 PolarHBondContact NE1-OG 2.82Å; W1210-S1234 VanDerWaalsContact NE1-OG 3.11Å; W1210-L1237 HydrophobicContact CB-CD1 4.03Å; W1210-L1237 HydrophobicContact CD2-CD1 4.02Å; W1210-L1237 HydrophobicContact CG-CD1 3.59Å
1211	F	94.7	Very high	89.3	Confident	107 Å²	107	56.1 Å²	56.1	47%	0.469	26%	0.263	S	S	.	.	H	α-helix	trans	-61.8	-47.2	-179.4	-179.9	-100.2	0	0	0	112.3	L1207 V1208 S1213 F1214 V1215	L1207-F1211 WeakPolarHBondContact O-CB 3.36Å; L1207-F1211 PolarHBondContact O-N 3.43Å; V1208-F1211 PolarHBondContact O-N 3.31Å; F1211-S1213 VanDerWaalsContact C-N 3.3Å; F1211-S1213 PolarHBondContact O-N 2.93Å; F1211-F1214 PolarHBondContact O-N 2.98Å; F1211-V1215 HydrophobicContact CE1-CG2 4.21Å; F1211-V1215 HydrophobicContact CZ-CG2 4.16Å; F1211-V1215 WeakPolarHBondContact O-CG2 3.25Å; F1211-V1215 PolarHBondContact O-N 2.92Å
1212	I	92.2	Very high	88	Confident	33 Å²	33	58 Å²	58	17%	0.169	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-42	176.4	-63.8	168.6	0	0	0	110.1	I1123 A1126 V1208 F1214 V1215 N1216	I1123-I1212 HydrophobicContact CG2-CD1 4.06Å; A1126-I1212 HydrophobicContact CB-CG2 3.72Å; V1208-I1212 HydrophobicContact CG1-CD1 3.7Å; V1208-I1212 HydrophobicContact CG1-CG1 4.43Å; V1208-I1212 VanDerWaalsContact O-CG1 3.31Å; V1208-I1212 WeakPolarHBondContact O-CG1 3.33Å; V1208-I1212 PolarHBondContact O-N 2.87Å; I1212-F1214 VanDerWaalsContact C-N 3.34Å; I1212-F1214 PolarHBondContact O-N 3.29Å; I1212-V1215 PolarHBondContact O-N 3.43Å; I1212-N1216 WeakPolarHBondContact CG2-ND2 3.35Å; I1212-N1216 VanDerWaalsContact O-CB 3.29Å; I1212-N1216 WeakPolarHBondContact O-CB 3.48Å; I1212-N1216 PolarHBondContact O-N 3.38Å; I1212-N1216 PolarHBondContact O-ND2 3.48Å; I1212-N1216 PolarHBondContact O-OD1 2.96Å
1213	S	90.5	Very high	86.5	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.007	30%	0.303	C	S	.	.	H	α-helix	trans	-64	-36.8	176.6	-57.5	0	0	0	0	113.1	A1209 W1210 F1211 N1216 R1217 L1229	A1209-S1213 VanDerWaalsContact O-CB 3.31Å; A1209-S1213 WeakPolarHBondContact O-CB 3.24Å; A1209-S1213 PolarHBondContact O-N 2.94Å; A1209-S1213 PolarHBondContact O-OG 3.39Å; W1210-S1213 WeakPolarHBondContact O-CB 3.32Å; W1210-S1213 PolarHBondContact O-N 2.97Å; F1211-S1213 VanDerWaalsContact C-N 3.3Å; F1211-S1213 PolarHBondContact O-N 2.93Å; S1213-N1216 CarbonylContact O-C 3.54Å; S1213-N1216 PolarHBondContact O-N 3Å; S1213-R1217 PolarHBondContact O-N 3.47Å; S1213-R1217 VanDerWaalsContact O-N 3.14Å; S1213-L1229 VanDerWaalsContact OG-CD2 3.26Å; S1213-L1229 WeakPolarHBondContact OG-CD2 3.47Å
1214	F	92.2	Very high	85.6	Confident	77 Å²	77	67.8 Å²	67.8	34%	0.338	31%	0.312	S	S	.	.	H	α-helix	trans	-67.8	-44.5	178.8	-178.7	-92.6	0	0	0	111.5	W1210 F1211 I1212 N1216 R1217 L1230	W1210-F1214 HydrophobicContact CZ2-CD2 4.32Å; W1210-F1214 WeakPolarHBondContact O-CB 3.42Å; W1210-F1214 PolarHBondContact O-N 2.94Å; F1211-F1214 PolarHBondContact O-N 2.98Å; I1212-F1214 VanDerWaalsContact C-N 3.34Å; I1212-F1214 PolarHBondContact O-N 3.29Å; F1214-N1216 VanDerWaalsContact C-N 3.31Å; F1214-N1216 PolarHBondContact O-N 3.35Å; F1214-R1217 VanDerWaalsContact CZ-NH1 3.31Å; F1214-R1217 WeakPolarHBondContact O-CB 3.14Å; F1214-R1217 VanDerWaalsContact O-CD 3.25Å; F1214-R1217 WeakPolarHBondContact O-CD 3.39Å; F1214-R1217 WeakPolarHBondContact O-CG 3.36Å; F1214-R1217 PolarHBondContact O-N 3.34Å; F1214-L1230 HydrophobicContact CB-CD1 4.04Å; F1214-L1230 HydrophobicContact CD2-CD1 4.44Å
1215	V	91.1	Very high	85	Confident	37 Å²	37	63.9 Å²	63.9	22%	0.224	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-41.6	172.7	175.5	0	0	0	0	110.6	W19 F1211 I1212 R1217	W19-V1215 HydrophobicContact CH2-CG1 4.35Å; W19-V1215 HydrophobicContact CH2-CG2 4.16Å; W19-V1215 HydrophobicContact CZ3-CG2 4.13Å; F1211-V1215 HydrophobicContact CE1-CG2 4.21Å; F1211-V1215 HydrophobicContact CZ-CG2 4.16Å; F1211-V1215 WeakPolarHBondContact O-CG2 3.25Å; F1211-V1215 PolarHBondContact O-N 2.92Å; I1212-V1215 PolarHBondContact O-N 3.43Å; V1215-R1217 VanDerWaalsContact C-N 3.27Å; V1215-R1217 PolarHBondContact O-N 3.01Å
1216	N	87.1	Confident	84.4	Confident	5 Å²	5	63.5 Å²	63.5	3%	0.027	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-81.7	6.7	-176.7	-60.1	-7.7	0	0	0	114.4	A1126 R1130 I1212 S1213 F1214 N1218 V1219 T1226	A1126-N1216 PolarHBondContact O-ND2 3.39Å; R1130-N1216 WeakPolarHBondContact CD-OD1 3.41Å; I1212-N1216 WeakPolarHBondContact CG2-ND2 3.35Å; I1212-N1216 VanDerWaalsContact O-CB 3.29Å; I1212-N1216 WeakPolarHBondContact O-CB 3.48Å; I1212-N1216 PolarHBondContact O-N 3.38Å; I1212-N1216 PolarHBondContact O-ND2 3.48Å; I1212-N1216 PolarHBondContact O-OD1 2.96Å; S1213-N1216 CarbonylContact O-C 3.54Å; S1213-N1216 PolarHBondContact O-N 3Å; F1214-N1216 VanDerWaalsContact C-N 3.31Å; F1214-N1216 PolarHBondContact O-N 3.35Å; N1216-N1218 PolarHBondContact O-N 3.2Å; N1216-N1218 VanDerWaalsContact O-N 3.09Å; N1216-V1219 HydrophobicContact CB-CG2 4.16Å; N1216-V1219 VanDerWaalsContact O-CG2 3.25Å; N1216-V1219 WeakPolarHBondContact O-CG2 3.4Å; N1216-V1219 PolarHBondContact O-N 3.48Å; N1216-T1226 HydrophobicContact CB-CG2 4.19Å; N1216-T1226 VanDerWaalsContact O-CB 3.26Å; N1216-T1226 WeakPolarHBondContact O-CB 3.08Å; N1216-T1226 PolarHBondContact O-OG1 2.93Å
1217	R	85.1	Confident	84.1	Confident	86 Å²	86	68.6 Å²	68.6	33%	0.325	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-61.8	-19.6	-174.5	74.8	-172.8	-178.6	178.6	0.3	115.5	S1213 F1214 V1215 L1230	S1213-R1217 PolarHBondContact O-N 3.47Å; S1213-R1217 VanDerWaalsContact O-N 3.14Å; F1214-R1217 VanDerWaalsContact CZ-NH1 3.31Å; F1214-R1217 WeakPolarHBondContact O-CB 3.14Å; F1214-R1217 VanDerWaalsContact O-CD 3.25Å; F1214-R1217 WeakPolarHBondContact O-CD 3.39Å; F1214-R1217 WeakPolarHBondContact O-CG 3.36Å; F1214-R1217 PolarHBondContact O-N 3.34Å; V1215-R1217 VanDerWaalsContact C-N 3.27Å; V1215-R1217 PolarHBondContact O-N 3.01Å; R1217-L1230 HydrophobicContact CB-CD2 3.83Å
1218	N	81.6	Confident	83.9	Confident	114 Å²	114	69.2 Å²	69.2	61%	0.61	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-91	-18	-176.5	-74.3	-7.6	0	0	0	113.7	N1216 K1220	N1216-N1218 PolarHBondContact O-N 3.2Å; N1216-N1218 VanDerWaalsContact O-N 3.09Å; N1218-K1220 PolarHBondContact O-N 3.3Å
1219	V	76.7	Confident	83.7	Confident	7 Å²	7	66.4 Å²	66.4	4%	0.042	29%	0.288	C	S	.	.			trans	-56.1	120	179.7	-178.5	0	0	0	0	109.2	E1133 N1216 R1221 T1226	E1133-V1219 HydrophobicContact CB-CG1 4.46Å; E1133-V1219 WeakPolarHBondContact OE1-CA 3.3Å; E1133-V1219 WeakPolarHBondContact OE1-CG1 3.31Å; E1133-V1219 WeakPolarHBondContact OE2-CG2 3.48Å; N1216-V1219 HydrophobicContact CB-CG2 4.16Å; N1216-V1219 VanDerWaalsContact O-CG2 3.25Å; N1216-V1219 WeakPolarHBondContact O-CG2 3.4Å; N1216-V1219 PolarHBondContact O-N 3.48Å; V1219-R1221 HydrophobicContact CG1-CB 4.32Å; V1219-T1226 HydrophobicContact CB-CG2 3.83Å; V1219-T1226 HydrophobicContact CG1-CG2 4.18Å; V1219-T1226 HydrophobicContact CG2-CG2 4.15Å; V1219-T1226 PolarHBondContact O-OG1 3.08Å
1220	K	68	Low	83.6	Confident	169 Å²	169	67.4 Å²	67.4	74%	0.735	29%	0.293	S	S	*	.			trans	-89.8	-21.9	-178.7	-66	-175.4	-172.5	176.7	0	113.3	N1218	N1218-K1220 PolarHBondContact O-N 3.3Å
1221	R	65.5	Low	83.5	Confident	116 Å²	116	69 Å²	69	44%	0.438	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	151.4	-176	-146.9	170.7	-170.4	170.5	4.1	111.2	S1132 G1136 V1219	S1132-R1221 PolarHBondContact O-NH1 3.33Å; G1136-R1221 PolarHBondContact O-NH1 3.4Å; V1219-R1221 HydrophobicContact CG1-CB 4.32Å
1222	N	68	Low	83.5	Confident	81 Å²	81	64 Å²	64	43%	0.433	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	66.7	-178.3	-156.1	33.9	0	0	0	114.9	L1129 K1224 E1225	L1129-N1222 HydrophobicContact CD2-CB 4.13Å; N1222-K1224 PolarHBondContact O-N 3.33Å; N1222-E1225 PolarHBondContact ND2-OE2 2.83Å; N1222-E1225 VanDerWaalsContact O-CB 3.25Å; N1222-E1225 WeakPolarHBondContact O-CB 3.38Å; N1222-E1225 PolarHBondContact O-N 3.01Å
1223	Y	63	Low	83.6	Confident	144 Å²	144	62.4 Å²	62.4	57%	0.565	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	29.7	173.9	-65	-80.1	0	0	0	115.8	E1225 L1281 I1360	Y1223-E1225 PolarHBondContact O-N 3.04Å; Y1223-L1281 HydrophobicContact CD1-CD1 4.17Å; Y1223-L1281 HydrophobicContact CD2-CD1 4.28Å; Y1223-L1281 HydrophobicContact CE1-CD1 4.4Å; Y1223-L1281 HydrophobicContact CE2-CD1 4.49Å; Y1223-L1281 HydrophobicContact CG-CD1 4.12Å; Y1223-I1360 VanDerWaalsContact OH-CD1 3.23Å; Y1223-I1360 WeakPolarHBondContact OH-CD1 3.2Å
1224	K	73.4	Confident	83.8	Confident	113 Å²	113	64.5 Å²	64.5	49%	0.491	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	32.1	-176.2	-53.5	158.2	-173.3	159.5	0	112.3	N1222 T1226 R1227	N1222-K1224 PolarHBondContact O-N 3.33Å; K1224-T1226 PolarHBondContact O-N 2.68Å; K1224-T1226 VanDerWaalsContact O-N 3.12Å; K1224-R1227 HydrophobicContact CB-CG 4.39Å; K1224-R1227 WeakPolarHBondContact O-CB 3.47Å; K1224-R1227 PolarHBondContact O-N 2.98Å
1225	E	82.3	Confident	83.9	Confident	17 Å²	17	65 Å²	65	8%	0.079	29%	0.291	C	S	.	.	H	α-helix	trans	-55	-29.4	-178.2	-176	170.4	-143.6	0	0	113.3	K1125 L1129 N1222 Y1223 R1227 W1228 L1229 K1278	K1125-E1225 WeakPolarHBondContact CE-OE1 3.42Å; K1125-E1225 IonicContact NZ-OE1 2.7Å; K1125-E1225 PolarHBondContact NZ-OE1 3.37Å; L1129-E1225 HydrophobicContact CD1-CB 4.24Å; L1129-E1225 HydrophobicContact CD1-CG 4.12Å; N1222-E1225 PolarHBondContact ND2-OE2 2.83Å; N1222-E1225 VanDerWaalsContact O-CB 3.25Å; N1222-E1225 WeakPolarHBondContact O-CB 3.38Å; N1222-E1225 PolarHBondContact O-N 3.01Å; Y1223-E1225 PolarHBondContact O-N 3.04Å; E1225-R1227 VanDerWaalsContact C-N 3.29Å; E1225-R1227 PolarHBondContact O-N 3.27Å; E1225-W1228 PolarHBondContact O-N 2.88Å; E1225-L1229 PolarHBondContact O-N 3.24Å; E1225-K1278 WeakPolarHBondContact OE1-CE 3.32Å; E1225-K1278 IonicContact OE1-NZ 3.16Å; E1225-K1278 PolarHBondContact OE1-NZ 3.05Å; E1225-K1278 IonicContact OE2-NZ 2.74Å
1226	T	85.2	Confident	84.1	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-33.6	173.2	51.3	0	0	0	0	113.7	L1129 N1216 V1219 K1224 L1229 L1230	L1129-T1226 HydrophobicContact CB-CG2 3.91Å; L1129-T1226 HydrophobicContact CD1-CG2 3.84Å; L1129-T1226 HydrophobicContact CG-CG2 4.44Å; N1216-T1226 HydrophobicContact CB-CG2 4.19Å; N1216-T1226 VanDerWaalsContact O-CB 3.26Å; N1216-T1226 WeakPolarHBondContact O-CB 3.08Å; N1216-T1226 PolarHBondContact O-OG1 2.93Å; V1219-T1226 HydrophobicContact CB-CG2 3.83Å; V1219-T1226 HydrophobicContact CG1-CG2 4.18Å; V1219-T1226 HydrophobicContact CG2-CG2 4.15Å; V1219-T1226 PolarHBondContact O-OG1 3.08Å; K1224-T1226 PolarHBondContact O-N 2.68Å; K1224-T1226 VanDerWaalsContact O-N 3.12Å; T1226-L1229 WeakPolarHBondContact O-CB 3.39Å; T1226-L1229 PolarHBondContact O-N 3.11Å; T1226-L1230 PolarHBondContact O-N 2.86Å
1227	R	88.6	Confident	84.5	Confident	107 Å²	107	64.7 Å²	64.7	40%	0.404	29%	0.287	S	S	.	.	H	α-helix	trans	-68.4	-42.1	175.8	-64.9	-172.6	175	-167.7	-3.2	111.5	K1224 E1225 L1229 L1230 Y1231	K1224-R1227 HydrophobicContact CB-CG 4.39Å; K1224-R1227 WeakPolarHBondContact O-CB 3.47Å; K1224-R1227 PolarHBondContact O-N 2.98Å; E1225-R1227 VanDerWaalsContact C-N 3.29Å; E1225-R1227 PolarHBondContact O-N 3.27Å; R1227-L1229 VanDerWaalsContact C-N 3.26Å; R1227-L1229 PolarHBondContact O-N 3.4Å; R1227-L1230 PolarHBondContact O-N 3.01Å; R1227-Y1231 HydrophobicContact CB-CE2 4.05Å; R1227-Y1231 WeakPolarHBondContact O-CD2 3.19Å; R1227-Y1231 PolarHBondContact O-N 3.06Å
1228	W	90.7	Very high	85	Confident	96 Å²	96	63.7 Å²	63.7	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-62.6	-35.6	173.6	-63.8	99.5	0	0	0	111.8	E1225 Y1231 T1232 L1273 M1274 P1277	E1225-W1228 PolarHBondContact O-N 2.88Å; W1228-Y1231 HydrophobicContact CE3-CD2 4.43Å; W1228-Y1231 PolarHBondContact O-N 2.88Å; W1228-T1232 WeakPolarHBondContact O-CB 3.48Å; W1228-T1232 PolarHBondContact O-N 3Å; W1228-T1232 PolarHBondContact O-OG1 3.37Å; W1228-L1273 HydrophobicContact CE3-CB 4.42Å; W1228-L1273 HydrophobicContact CE3-CD2 3.94Å; W1228-L1273 HydrophobicContact CZ3-CD2 3.91Å; W1228-M1274 HydrophobicContact CB-CE 3.87Å; W1228-M1274 WeakPolarHBondContact O-CE 3.42Å; W1228-P1277 HydrophobicContact CD2-CG 3.6Å; W1228-P1277 HydrophobicContact CE3-CG 3.78Å; W1228-P1277 HydrophobicContact CG-CG 4.19Å; W1228-P1277 HydrophobicContact CH2-CG 3.99Å; W1228-P1277 HydrophobicContact CZ2-CB 4.4Å; W1228-P1277 HydrophobicContact CZ2-CG 3.81Å; W1228-P1277 HydrophobicContact CZ3-CG 3.97Å
1229	L	91.6	Very high	85.6	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-45.5	174.5	-134.9	159.9	0	0	0	111.1	L1122 K1125 A1126 L1129 S1213 E1225 T1226 R1227 T1232 C1233 M1274	L1122-L1229 HydrophobicContact CB-CD2 4.14Å; L1122-L1229 HydrophobicContact CD2-CD2 3.94Å; L1122-L1229 HydrophobicContact CD2-CG 4.22Å; K1125-L1229 HydrophobicContact CB-CD1 4.32Å; K1125-L1229 HydrophobicContact CD-CD1 4.01Å; K1125-L1229 HydrophobicContact CG-CD1 4.02Å; A1126-L1229 HydrophobicContact CB-CD1 3.97Å; A1126-L1229 HydrophobicContact CB-CD2 4.22Å; L1129-L1229 HydrophobicContact CD1-CD1 4.31Å; S1213-L1229 VanDerWaalsContact OG-CD2 3.26Å; S1213-L1229 WeakPolarHBondContact OG-CD2 3.47Å; E1225-L1229 PolarHBondContact O-N 3.24Å; T1226-L1229 WeakPolarHBondContact O-CB 3.39Å; T1226-L1229 PolarHBondContact O-N 3.11Å; R1227-L1229 VanDerWaalsContact C-N 3.26Å; R1227-L1229 PolarHBondContact O-N 3.4Å; L1229-T1232 WeakPolarHBondContact O-CB 3.42Å; L1229-T1232 PolarHBondContact O-N 2.96Å; L1229-C1233 PolarHBondContact O-N 2.93Å; L1229-C1233 PolarHBondContact O-SG 2.87Å; L1229-C1233 VanDerWaalsContact O-SG 3.41Å; L1229-M1274 VanDerWaalsContact CA-CE 3.48Å; L1229-M1274 HydrophobicContact CB-CE 4.05Å; L1229-M1274 HydrophobicContact CG-CE 4.08Å; L1229-M1274 HydrophobicContact CG-SD 4.25Å; L1229-M1274 VanDerWaalsContact N-CE 3.34Å
1230	L	93.1	Very high	86.4	Confident	21 Å²	21	59.9 Å²	59.9	11%	0.11	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-45.5	172.7	177.6	58.8	0	0	0	112.7	F1214 R1217 T1226 R1227 T1232 C1233 S1234	F1214-L1230 HydrophobicContact CB-CD1 4.04Å; F1214-L1230 HydrophobicContact CD2-CD1 4.44Å; R1217-L1230 HydrophobicContact CB-CD2 3.83Å; T1226-L1230 PolarHBondContact O-N 2.86Å; R1227-L1230 PolarHBondContact O-N 3.01Å; L1230-T1232 VanDerWaalsContact C-N 3.31Å; L1230-T1232 PolarHBondContact O-N 3.14Å; L1230-C1233 PolarHBondContact O-N 2.9Å; L1230-S1234 VanDerWaalsContact O-CB 3.26Å; L1230-S1234 WeakPolarHBondContact O-CB 3.22Å; L1230-S1234 PolarHBondContact O-N 2.85Å; L1230-S1234 PolarHBondContact O-OG 3.37Å
1231	Y	93.8	Very high	87.6	Confident	116 Å²	116	57.2 Å²	57.2	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-62.4	-39.3	177.5	-60.3	-35.6	0	0	0	111.7	R1227 W1228 S1234 L1235	R1227-Y1231 HydrophobicContact CB-CE2 4.05Å; R1227-Y1231 WeakPolarHBondContact O-CD2 3.19Å; R1227-Y1231 PolarHBondContact O-N 3.06Å; W1228-Y1231 HydrophobicContact CE3-CD2 4.43Å; W1228-Y1231 PolarHBondContact O-N 2.88Å; Y1231-S1234 PolarHBondContact O-N 2.84Å; Y1231-L1235 WeakPolarHBondContact O-CB 3.48Å; Y1231-L1235 WeakPolarHBondContact O-CG 3.31Å; Y1231-L1235 PolarHBondContact O-N 3.43Å
1232	T	94.1	Very high	88.9	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-54.4	175.8	-54.6	0	0	0	0	111	W1228 L1229 L1230 S1234 L1235 L1236 I1269 V1270 L1273 M1274	W1228-T1232 WeakPolarHBondContact O-CB 3.48Å; W1228-T1232 PolarHBondContact O-N 3Å; W1228-T1232 PolarHBondContact O-OG1 3.37Å; L1229-T1232 WeakPolarHBondContact O-CB 3.42Å; L1229-T1232 PolarHBondContact O-N 2.96Å; L1230-T1232 VanDerWaalsContact C-N 3.31Å; L1230-T1232 PolarHBondContact O-N 3.14Å; T1232-S1234 VanDerWaalsContact C-N 3.31Å; T1232-S1234 PolarHBondContact O-N 3.17Å; T1232-L1235 PolarHBondContact O-N 3.38Å; T1232-L1236 HydrophobicContact CG2-CD1 4.04Å; T1232-L1236 VanDerWaalsContact O-CG 3.31Å; T1232-L1236 WeakPolarHBondContact O-CG 3.36Å; T1232-L1236 PolarHBondContact O-N 2.76Å; T1232-L1236 VanDerWaalsContact O-N 3.14Å; T1232-I1269 HydrophobicContact CG2-CG2 4.31Å; T1232-V1270 HydrophobicContact CG2-CB 4.46Å; T1232-V1270 HydrophobicContact CG2-CG2 3.9Å; T1232-L1273 VanDerWaalsContact OG1-CB 3.25Å; T1232-L1273 WeakPolarHBondContact OG1-CB 3.3Å; T1232-M1274 WeakPolarHBondContact OG1-CE 3.35Å
1233	C	94.6	Very high	90.1	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63	-37	178.9	-61.3	0	0	0	0	112.5	W1210 L1229 L1230 L1235 L1236 L1237	W1210-C1233 HydrophobicContact CB-CB 3.87Å; W1210-C1233 HydrophobicContact CG-CB 4.36Å; L1229-C1233 PolarHBondContact O-N 2.93Å; L1229-C1233 PolarHBondContact O-SG 2.87Å; L1229-C1233 VanDerWaalsContact O-SG 3.41Å; L1230-C1233 PolarHBondContact O-N 2.9Å; C1233-L1235 VanDerWaalsContact C-N 3.33Å; C1233-L1235 PolarHBondContact O-N 2.94Å; C1233-L1236 PolarHBondContact O-N 2.99Å; C1233-L1237 WeakPolarHBondContact O-CG 3.28Å; C1233-L1237 PolarHBondContact O-N 3.41Å
1234	S	93.5	Very high	91.5	Very high	46 Å²	46	48.2 Å²	48.2	32%	0.322	24%	0.239	S	C	.	.	H	α-helix	trans	-69.9	-27.4	-179.2	-56.3	0	0	0	0	113.5	W1210 L1230 Y1231 T1232 P1238	W1210-S1234 PolarHBondContact NE1-OG 2.82Å; W1210-S1234 VanDerWaalsContact NE1-OG 3.11Å; L1230-S1234 VanDerWaalsContact O-CB 3.26Å; L1230-S1234 WeakPolarHBondContact O-CB 3.22Å; L1230-S1234 PolarHBondContact O-N 2.85Å; L1230-S1234 PolarHBondContact O-OG 3.37Å; Y1231-S1234 PolarHBondContact O-N 2.84Å; T1232-S1234 VanDerWaalsContact C-N 3.31Å; T1232-S1234 PolarHBondContact O-N 3.17Å; S1234-P1238 WeakPolarHBondContact O-CD 3.22Å
1235	L	95.7	Very high	92.3	Very high	88 Å²	88	45.2 Å²	45.2	46%	0.461	24%	0.236	S	C	.	.	H	α-helix	trans	-84.4	-27.1	174.6	-76.9	162.9	0	0	0	112.9	Y1231 T1232 C1233 P1238 V1239 I1269 L1273	Y1231-L1235 WeakPolarHBondContact O-CB 3.48Å; Y1231-L1235 WeakPolarHBondContact O-CG 3.31Å; Y1231-L1235 PolarHBondContact O-N 3.43Å; T1232-L1235 PolarHBondContact O-N 3.38Å; C1233-L1235 VanDerWaalsContact C-N 3.33Å; C1233-L1235 PolarHBondContact O-N 2.94Å; L1235-P1238 WeakPolarHBondContact O-CD 3.38Å; L1235-P1238 WeakPolarHBondContact O-CG 3.47Å; L1235-V1239 WeakPolarHBondContact O-CG2 3.22Å; L1235-I1269 HydrophobicContact CB-CD1 4.37Å; L1235-I1269 HydrophobicContact CB-CG2 3.92Å; L1235-L1273 HydrophobicContact CD1-CD1 3.69Å
1236	L	95.5	Very high	92.7	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-72.1	-38.2	176.2	-72.5	167.4	0	0	0	113	F1119 L1206 T1232 C1233 V1239 W1240 I1269 V1270	F1119-L1236 HydrophobicContact CE1-CD1 3.91Å; L1206-L1236 HydrophobicContact CD1-CB 3.82Å; L1206-L1236 HydrophobicContact CD1-CD1 4.09Å; L1206-L1236 HydrophobicContact CD2-CB 4.04Å; T1232-L1236 HydrophobicContact CG2-CD1 4.04Å; T1232-L1236 VanDerWaalsContact O-CG 3.31Å; T1232-L1236 WeakPolarHBondContact O-CG 3.36Å; T1232-L1236 PolarHBondContact O-N 2.76Å; T1232-L1236 VanDerWaalsContact O-N 3.14Å; C1233-L1236 PolarHBondContact O-N 2.99Å; L1236-V1239 PolarHBondContact O-N 3.21Å; L1236-W1240 PolarHBondContact O-N 3.37Å; L1236-I1269 HydrophobicContact CD2-CB 4.46Å; L1236-I1269 HydrophobicContact CD2-CG2 4.31Å; L1236-I1269 HydrophobicContact CG-CG2 4.16Å; L1236-V1270 HydrophobicContact CD1-CG2 4.08Å
1237	L	94.4	Very high	93	Very high	34 Å²	34	45.7 Å²	45.7	18%	0.178	24%	0.241	C	C	.	.	H	α-helix	trans	-53.2	-53	179.7	-75.9	169.9	0	0	0	114.3	L1206 L1207 W1210 C1233 V1239 W1240 I1241	L1206-L1237 HydrophobicContact CD2-CD2 3.89Å; L1206-L1237 HydrophobicContact CD2-CG 4.29Å; L1206-L1237 HydrophobicContact CG-CD2 3.83Å; L1206-L1237 HydrophobicContact CG-CG 4.24Å; L1207-L1237 HydrophobicContact CD2-CD2 3.79Å; L1207-L1237 HydrophobicContact CG-CD2 4.41Å; W1210-L1237 HydrophobicContact CB-CD1 4.03Å; W1210-L1237 HydrophobicContact CD2-CD1 4.02Å; W1210-L1237 HydrophobicContact CG-CD1 3.59Å; C1233-L1237 WeakPolarHBondContact O-CG 3.28Å; C1233-L1237 PolarHBondContact O-N 3.41Å; L1237-V1239 VanDerWaalsContact C-N 3.32Å; L1237-V1239 PolarHBondContact O-N 3.42Å; L1237-W1240 PolarHBondContact O-N 2.82Å; L1237-I1241 WeakPolarHBondContact O-CG1 3.46Å; L1237-I1241 PolarHBondContact O-N 2.89Å
1238	P	95.2	Very high	93.1	Very high	65 Å²	65	45 Å²	45	42%	0.422	24%	0.244	S	C	.	.	H	α-helix	trans	-67.4	-29	178.9	26.1	-34.8	0	0	0	113.3	S1234 L1235 T1242	S1234-P1238 WeakPolarHBondContact O-CD 3.22Å; L1235-P1238 WeakPolarHBondContact O-CD 3.38Å; L1235-P1238 WeakPolarHBondContact O-CG 3.47Å; P1238-T1242 WeakPolarHBondContact O-CB 3.38Å; P1238-T1242 PolarHBondContact O-N 3.28Å; P1238-T1242 PolarHBondContact O-OG1 3.22Å
1239	V	94.9	Very high	93	Very high	34 Å²	34	47.3 Å²	47.3	21%	0.206	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-46.8	173.8	173.3	0	0	0	0	110.2	L1235 L1236 L1237 T1242 W1243 E1262 I1269	L1235-V1239 WeakPolarHBondContact O-CG2 3.22Å; L1236-V1239 PolarHBondContact O-N 3.21Å; L1237-V1239 VanDerWaalsContact C-N 3.32Å; L1237-V1239 PolarHBondContact O-N 3.42Å; V1239-T1242 PolarHBondContact O-N 3.26Å; V1239-W1243 WeakPolarHBondContact O-CB 3.19Å; V1239-W1243 PolarHBondContact O-N 3.15Å; V1239-E1262 HydrophobicContact CG1-CG 4.38Å; V1239-I1269 HydrophobicContact CG2-CD1 4.05Å
1240	W	93.9	Very high	92.8	Very high	8 Å²	8	50 Å²	50	3%	0.03	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-39.8	177.9	-87.5	70.3	0	0	0	113.4	H1111 Y1115 H1199 V1202 V1203 L1206 L1236 L1237 W1243 T1244 E1262	H1111-W1240 AromaticContact CE1-CH2 3.97Å; Y1115-W1240 AromaticContact CD1-CZ2 3.99Å; Y1115-W1240 HydrophobicContact CD1-CZ2 3.99Å; Y1115-W1240 HydrophobicContact CD2-CH2 4.1Å; Y1115-W1240 AromaticContact CD2-CZ2 3.67Å; Y1115-W1240 HydrophobicContact CD2-CZ2 3.67Å; Y1115-W1240 AromaticContact CE1-CZ2 3.98Å; Y1115-W1240 HydrophobicContact CE1-CZ2 3.98Å; Y1115-W1240 HydrophobicContact CE2-CH2 4.31Å; Y1115-W1240 AromaticContact CE2-CZ2 3.66Å; Y1115-W1240 HydrophobicContact CE2-CZ2 3.66Å; Y1115-W1240 HydrophobicContact CG-CH2 4.47Å; Y1115-W1240 AromaticContact CG-CZ2 3.85Å; Y1115-W1240 HydrophobicContact CG-CZ2 3.85Å; Y1115-W1240 AromaticContact CZ-CZ2 3.81Å; H1199-W1240 HydrophobicContact CB-CH2 4.49Å; H1199-W1240 HydrophobicContact CB-CZ3 4.11Å; V1202-W1240 HydrophobicContact CB-CH2 4.26Å; V1202-W1240 HydrophobicContact CG1-CH2 3.43Å; V1202-W1240 VanDerWaalsContact CG1-CH2 3.43Å; V1202-W1240 HydrophobicContact CG1-CZ2 3.73Å; V1202-W1240 HydrophobicContact CG1-CZ3 4.05Å; V1203-W1240 HydrophobicContact CG2-CE3 3.63Å; V1203-W1240 HydrophobicContact CG2-CZ3 3.89Å; L1206-W1240 HydrophobicContact CD2-CB 4.38Å; L1206-W1240 HydrophobicContact CD2-CG 4.05Å; L1236-W1240 PolarHBondContact O-N 3.37Å; L1237-W1240 PolarHBondContact O-N 2.82Å; W1240-W1243 HydrophobicContact CE3-CE3 4.08Å; W1240-W1243 AromaticContact CE3-CZ3 3.96Å; W1240-W1243 HydrophobicContact CE3-CZ3 3.96Å; W1240-W1243 HydrophobicContact CH2-CZ3 4.35Å; W1240-W1243 HydrophobicContact CZ3-CE3 4.19Å; W1240-W1243 HydrophobicContact CZ3-CH2 4.35Å; W1240-W1243 AromaticContact CZ3-CZ3 3.65Å; W1240-W1243 HydrophobicContact CZ3-CZ3 3.65Å; W1240-T1244 WeakPolarHBondContact O-CB 3.35Å; W1240-T1244 PolarHBondContact O-N 3.37Å; W1240-T1244 PolarHBondContact O-OG1 3.36Å; W1240-E1262 PolarHBondContact NE1-OE1 2.78Å
1241	I	92.8	Very high	92.2	Very high	113 Å²	113	53.1 Å²	53.1	58%	0.579	30%	0.299	S	S	*	.	H	α-helix	trans	-63.7	-41.7	173.7	-66.8	164.8	0	0	0	110.9	L1237 T1244 A1245	L1237-I1241 WeakPolarHBondContact O-CG1 3.46Å; L1237-I1241 PolarHBondContact O-N 2.89Å; I1241-T1244 PolarHBondContact O-OG1 3.32Å; I1241-T1244 VanDerWaalsContact O-OG1 3.08Å; I1241-A1245 WeakPolarHBondContact O-CB 3.37Å; I1241-A1245 PolarHBondContact O-N 2.86Å
1242	T	92.2	Very high	91.2	Very high	100 Å²	100	49.7 Å²	49.7	61%	0.613	29%	0.285	S	S	*	.	H	α-helix	trans	-68.8	-41.4	179.2	-54.3	0	0	0	0	111.8	P1238 V1239 G1246	P1238-T1242 WeakPolarHBondContact O-CB 3.38Å; P1238-T1242 PolarHBondContact O-N 3.28Å; P1238-T1242 PolarHBondContact O-OG1 3.22Å; V1239-T1242 PolarHBondContact O-N 3.26Å; T1242-G1246 PolarHBondContact O-N 3.06Å
1243	W	93.9	Very high	90.1	Very high	7 Å²	7	51.4 Å²	51.4	3%	0.027	30%	0.296	C	S	.	.	H	α-helix	trans	-66	-47.4	177.4	169.3	83	0	0	0	112.5	F1195 V1239 W1240 A1245 G1246 Y1247 E1262	F1195-W1243 HydrophobicContact CE1-CH2 4.36Å; F1195-W1243 AromaticContact CE1-CZ2 3.82Å; F1195-W1243 HydrophobicContact CE1-CZ2 3.82Å; F1195-W1243 HydrophobicContact CZ-CZ2 4.45Å; V1239-W1243 WeakPolarHBondContact O-CB 3.19Å; V1239-W1243 PolarHBondContact O-N 3.15Å; W1240-W1243 HydrophobicContact CE3-CE3 4.08Å; W1240-W1243 AromaticContact CE3-CZ3 3.96Å; W1240-W1243 HydrophobicContact CE3-CZ3 3.96Å; W1240-W1243 HydrophobicContact CH2-CZ3 4.35Å; W1240-W1243 HydrophobicContact CZ3-CE3 4.19Å; W1240-W1243 HydrophobicContact CZ3-CH2 4.35Å; W1240-W1243 AromaticContact CZ3-CZ3 3.65Å; W1240-W1243 HydrophobicContact CZ3-CZ3 3.65Å; W1243-A1245 VanDerWaalsContact C-N 3.35Å; W1243-A1245 PolarHBondContact O-N 3.2Å; W1243-G1246 PolarHBondContact O-N 3.19Å; W1243-Y1247 WeakPolarHBondContact O-CB 3.4Å; W1243-Y1247 PolarHBondContact O-N 2.98Å; W1243-E1262 HydrophobicContact CB-CB 4.25Å; W1243-E1262 HydrophobicContact CB-CG 3.81Å; W1243-E1262 VanDerWaalsContact CD1-CB 3.45Å; W1243-E1262 HydrophobicContact CD2-CG 4.02Å; W1243-E1262 HydrophobicContact CG-CB 3.87Å; W1243-E1262 HydrophobicContact CG-CG 3.57Å
1244	T	91.3	Very high	89.6	Confident	44 Å²	44	57.2 Å²	57.2	27%	0.27	32%	0.319	S	S	.	.	H	α-helix	trans	-60.3	-42.6	178.1	43.1	0	0	0	0	112.2	W1240 I1241	W1240-T1244 WeakPolarHBondContact O-CB 3.35Å; W1240-T1244 PolarHBondContact O-N 3.37Å; W1240-T1244 PolarHBondContact O-OG1 3.36Å; I1241-T1244 PolarHBondContact O-OG1 3.32Å; I1241-T1244 VanDerWaalsContact O-OG1 3.08Å
1245	A	91.8	Very high	89.3	Confident	50 Å²	50	55.9 Å²	55.9	41%	0.413	31%	0.307	S	S	.	.	H	α-helix	trans	-65.5	-45.9	173.5	0	0	0	0	0	112	I1241 W1243 Y1247 L1248 L1249	I1241-A1245 WeakPolarHBondContact O-CB 3.37Å; I1241-A1245 PolarHBondContact O-N 2.86Å; W1243-A1245 VanDerWaalsContact C-N 3.35Å; W1243-A1245 PolarHBondContact O-N 3.2Å; A1245-Y1247 PolarHBondContact O-N 3.44Å; A1245-L1248 PolarHBondContact O-N 3.02Å; A1245-L1249 WeakPolarHBondContact O-CG 3.49Å; A1245-L1249 PolarHBondContact O-N 3.46Å
1246	G	90.9	Very high	88.8	Confident	13 Å²	13	52.7 Å²	52.7	13%	0.134	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-41.3	180	0	0	0	0	0	113.3	T1242 W1243 L1248 L1249 I1250 L1258	T1242-G1246 PolarHBondContact O-N 3.06Å; W1243-G1246 PolarHBondContact O-N 3.19Å; G1246-L1248 VanDerWaalsContact C-N 3.28Å; G1246-L1248 PolarHBondContact O-N 3.11Å; G1246-L1249 PolarHBondContact O-N 2.92Å; G1246-I1250 VanDerWaalsContact O-CB 3.24Å; G1246-I1250 WeakPolarHBondContact O-CB 3.47Å; G1246-I1250 VanDerWaalsContact O-CG1 3.28Å; G1246-I1250 WeakPolarHBondContact O-CG1 3.36Å; G1246-I1250 PolarHBondContact O-N 2.77Å; G1246-L1258 VanDerWaalsContact C-CD2 3.41Å
1247	Y	91.6	Very high	88.5	Confident	16 Å²	16	53.3 Å²	53.3	6%	0.063	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-31.4	-177.1	-166.1	-79.5	0	0	0	112.7	D1192 F1195 L1196 W1243 A1245 K1255 L1258 V1259	D1192-Y1247 HydrophobicContact CB-CE1 4.08Å; F1195-Y1247 HydrophobicContact CD1-CD1 4.48Å; F1195-Y1247 HydrophobicContact CD1-CD2 4.31Å; F1195-Y1247 AromaticContact CD1-CE1 3.8Å; F1195-Y1247 HydrophobicContact CD1-CE1 3.8Å; F1195-Y1247 AromaticContact CD1-CE2 3.6Å; F1195-Y1247 HydrophobicContact CD1-CE2 3.6Å; F1195-Y1247 AromaticContact CD1-CZ 3.3Å; F1195-Y1247 VanDerWaalsContact CD1-OH 3.31Å; F1195-Y1247 WeakPolarHBondContact CD1-OH 3.4Å; F1195-Y1247 HydrophobicContact CE1-CD2 4.16Å; F1195-Y1247 AromaticContact CE1-CE2 3.51Å; F1195-Y1247 HydrophobicContact CE1-CE2 3.51Å; F1195-Y1247 AromaticContact CE1-CZ 3.74Å; L1196-Y1247 HydrophobicContact CD1-CD1 3.37Å; L1196-Y1247 HydrophobicContact CD1-CE1 3.95Å; L1196-Y1247 HydrophobicContact CD1-CG 3.92Å; W1243-Y1247 WeakPolarHBondContact O-CB 3.4Å; W1243-Y1247 PolarHBondContact O-N 2.98Å; A1245-Y1247 PolarHBondContact O-N 3.44Å; Y1247-K1255 HydrophobicContact CD1-CD 4.47Å; Y1247-K1255 HydrophobicContact CD2-CB 4.41Å; Y1247-K1255 HydrophobicContact CE1-CD 4.11Å; Y1247-K1255 HydrophobicContact CE2-CB 4.04Å; Y1247-K1255 HydrophobicContact CE2-CD 4.43Å; Y1247-K1255 VanDerWaalsContact O-CE 3.24Å; Y1247-K1255 WeakPolarHBondContact O-CE 3.46Å; Y1247-L1258 VanDerWaalsContact N-CD2 3.26Å; Y1247-V1259 HydrophobicContact CD2-CG2 4.07Å; Y1247-V1259 HydrophobicContact CE2-CG2 3.86Å
1248	L	90.1	Very high	88.4	Confident	92 Å²	92	53 Å²	53	48%	0.482	29%	0.294	S	S	.	.	H	α-helix	trans	-78.9	-29.2	176.1	-68.8	173	0	0	0	113.2	L1196 A1245 G1246	L1196-L1248 HydrophobicContact CD2-CD1 3.82Å; L1196-L1248 HydrophobicContact CD2-CD2 4Å; L1196-L1248 HydrophobicContact CD2-CG 3.79Å; A1245-L1248 PolarHBondContact O-N 3.02Å; G1246-L1248 VanDerWaalsContact C-N 3.28Å; G1246-L1248 PolarHBondContact O-N 3.11Å
1249	L	89.3	Confident	88.2	Confident	145 Å²	145	50 Å²	50	76%	0.759	28%	0.275	S	S	*	.	H	α-helix	trans	-94.1	-27.5	-175	-66.6	172.2	0	0	0	114	A1245 G1246	A1245-L1249 WeakPolarHBondContact O-CG 3.49Å; A1245-L1249 PolarHBondContact O-N 3.46Å; G1246-L1249 PolarHBondContact O-N 2.92Å
1250	I	86	Confident	88.1	Confident	58 Å²	58	48.5 Å²	48.5	30%	0.297	27%	0.266	S	S	.	.	S	Bend	trans	-91.3	128.9	-173.1	-68.7	171.9	0	0	0	110.3	G1246 Y1254 K1255 L1258	G1246-I1250 VanDerWaalsContact O-CB 3.24Å; G1246-I1250 WeakPolarHBondContact O-CB 3.47Å; G1246-I1250 VanDerWaalsContact O-CG1 3.28Å; G1246-I1250 WeakPolarHBondContact O-CG1 3.36Å; G1246-I1250 PolarHBondContact O-N 2.77Å; I1250-Y1254 HydrophobicContact CG2-CG 4.48Å; I1250-K1255 WeakPolarHBondContact O-CE 3.49Å; I1250-K1255 WeakPolarHBondContact O-CG 3.19Å; I1250-L1258 HydrophobicContact CD1-CD1 4.23Å; I1250-L1258 HydrophobicContact CD1-CD2 4.28Å
1251	P	81.4	Confident	88	Confident	86 Å²	86	51.7 Å²	51.7	56%	0.558	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-71.2	160	179	29	-35.1	0	0	0	113.2	Y1254	P1251-Y1254 HydrophobicContact CG-CD2 4.46Å; P1251-Y1254 PolarHBondContact O-N 3.19Å; P1251-Y1254 VanDerWaalsContact O-N 3.15Å
1252	Y	72.7	Confident	88	Confident	44 Å²	44	46.4 Å²	46.4	17%	0.173	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	136.7	162	-167	-110	0	0	0	108.4	R1036 I1176 V1185 P1186 K1187	R1036-Y1252 PolarHBondContact NH2-OH 2.86Å; R1036-Y1252 VanDerWaalsContact NH2-OH 3.11Å; I1176-Y1252 HydrophobicContact CD1-CD1 4.25Å; I1176-Y1252 HydrophobicContact CD1-CE1 4.25Å; V1185-Y1252 HydrophobicContact CG1-CE1 4.3Å; P1186-Y1252 PolarHBondContact O-OH 3.09Å; K1187-Y1252 HydrophobicContact CG-CE2 4.3Å
1253	P	71.1	Confident	88.1	Confident	36 Å²	36	41.7 Å²	41.7	23%	0.234	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93	-6.6	16.9	36.5	-37.5	0	0	0	116.3	F1038 K1255	F1038-P1253 HydrophobicContact CZ-CG 4.42Å; P1253-K1255 PolarHBondContact O-N 3.39Å; P1253-K1255 VanDerWaalsContact O-N 3.08Å
1254	Y	83.5	Confident	87.9	Confident	122 Å²	122	43 Å²	43	48%	0.478	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-13.4	-166.4	-55	-80.2	0	0	0	115.1	W1040 I1250 P1251 D1256 A1257 L1258	W1040-Y1254 AromaticContact CH2-CD1 3.95Å; W1040-Y1254 HydrophobicContact CH2-CD1 3.95Å; W1040-Y1254 AromaticContact CH2-CE1 3.58Å; W1040-Y1254 HydrophobicContact CH2-CE1 3.58Å; W1040-Y1254 HydrophobicContact CZ2-CD1 4.26Å; W1040-Y1254 HydrophobicContact CZ2-CE1 4.34Å; W1040-Y1254 HydrophobicContact CZ3-CD1 4.49Å; W1040-Y1254 HydrophobicContact CZ3-CE1 4Å; I1250-Y1254 HydrophobicContact CG2-CG 4.48Å; P1251-Y1254 HydrophobicContact CG-CD2 4.46Å; P1251-Y1254 PolarHBondContact O-N 3.19Å; P1251-Y1254 VanDerWaalsContact O-N 3.15Å; Y1254-D1256 VanDerWaalsContact C-N 3.34Å; Y1254-D1256 PolarHBondContact O-N 3.18Å; Y1254-A1257 WeakPolarHBondContact O-CB 3.39Å; Y1254-A1257 PolarHBondContact O-N 2.91Å; Y1254-A1257 VanDerWaalsContact O-N 3.16Å; Y1254-L1258 PolarHBondContact O-N 3.04Å; Y1254-L1258 VanDerWaalsContact O-N 3.1Å
1255	K	87.6	Confident	88	Confident	18 Å²	18	42.4 Å²	42.4	8%	0.078	23%	0.23	C	C	.	.	H	α-helix	trans	-55.9	-40.2	179	-67.2	-176.8	174.8	-177.3	0	114	D1192 Y1247 I1250 P1253 A1257 L1258 V1259	D1192-K1255 IonicContact OD1-NZ 3.84Å; D1192-K1255 PolarHBondContact OD1-NZ 2.83Å; D1192-K1255 IonicContact OD2-NZ 3.96Å; D1192-K1255 PolarHBondContact OD2-NZ 3.17Å; Y1247-K1255 HydrophobicContact CD1-CD 4.47Å; Y1247-K1255 HydrophobicContact CD2-CB 4.41Å; Y1247-K1255 HydrophobicContact CE1-CD 4.11Å; Y1247-K1255 HydrophobicContact CE2-CB 4.04Å; Y1247-K1255 HydrophobicContact CE2-CD 4.43Å; Y1247-K1255 VanDerWaalsContact O-CE 3.24Å; Y1247-K1255 WeakPolarHBondContact O-CE 3.46Å; I1250-K1255 WeakPolarHBondContact O-CE 3.49Å; I1250-K1255 WeakPolarHBondContact O-CG 3.19Å; P1253-K1255 PolarHBondContact O-N 3.39Å; P1253-K1255 VanDerWaalsContact O-N 3.08Å; K1255-A1257 VanDerWaalsContact C-N 3.34Å; K1255-A1257 PolarHBondContact O-N 2.82Å; K1255-L1258 WeakPolarHBondContact O-CB 3.36Å; K1255-L1258 PolarHBondContact O-N 2.96Å; K1255-V1259 WeakPolarHBondContact O-CG2 3.49Å; K1255-V1259 PolarHBondContact O-N 3.24Å; K1255-V1259 VanDerWaalsContact O-N 3.1Å
1256	D	85.6	Confident	88.1	Confident	21 Å²	21	40 Å²	40	11%	0.112	21%	0.211	C	C	.	.	H	α-helix	trans	-66.1	-37.8	178.9	-79.1	-17.3	0	0	0	111.5	R1036 R1107 Y1254 V1259 V1260	R1036-D1256 IonicContact CZ-OD2 3.73Å; R1036-D1256 IonicContact NH1-OD2 2.91Å; R1036-D1256 PolarHBondContact NH1-OD2 2.87Å; R1107-D1256 IonicContact CZ-OD2 2.77Å; R1107-D1256 IonicContact NH1-OD1 3.64Å; R1107-D1256 PolarHBondContact NH1-OD1 3.44Å; R1107-D1256 IonicContact NH1-OD2 2.72Å; R1107-D1256 PolarHBondContact NH1-OD2 2.82Å; R1107-D1256 IonicContact NH2-OD2 2.76Å; R1107-D1256 PolarHBondContact NH2-OD2 2.99Å; Y1254-D1256 VanDerWaalsContact C-N 3.34Å; Y1254-D1256 PolarHBondContact O-N 3.18Å; D1256-V1259 PolarHBondContact O-N 3.28Å; D1256-V1260 WeakPolarHBondContact O-CG2 3.03Å; D1256-V1260 PolarHBondContact O-N 2.89Å; D1256-V1260 VanDerWaalsContact O-N 3.09Å
1257	A	88.5	Confident	88.3	Confident	13 Å²	13	39.4 Å²	39.4	11%	0.107	20%	0.204	C	C	.	.	H	α-helix	trans	-65.3	-38.6	174.2	0	0	0	0	0	111.8	F1044 Y1254 K1255 V1259 V1260 I1261	F1044-A1257 HydrophobicContact CE2-CB 3.76Å; F1044-A1257 HydrophobicContact CZ-CB 4.23Å; Y1254-A1257 WeakPolarHBondContact O-CB 3.39Å; Y1254-A1257 PolarHBondContact O-N 2.91Å; Y1254-A1257 VanDerWaalsContact O-N 3.16Å; K1255-A1257 VanDerWaalsContact C-N 3.34Å; K1255-A1257 PolarHBondContact O-N 2.82Å; A1257-V1259 VanDerWaalsContact C-N 3.33Å; A1257-V1259 PolarHBondContact O-N 3.29Å; A1257-V1260 PolarHBondContact O-N 3.49Å; A1257-I1261 WeakPolarHBondContact O-CB 3Å; A1257-I1261 VanDerWaalsContact O-CG1 3.25Å; A1257-I1261 WeakPolarHBondContact O-CG1 3.34Å; A1257-I1261 PolarHBondContact O-N 2.03Å
1258	L	91.6	Very high	88.4	Confident	28 Å²	28	41.1 Å²	41.1	15%	0.147	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-38.2	174.9	-172.6	74.6	0	0	0	112.3	G1246 Y1247 I1250 Y1254 K1255 I1261 E1262	G1246-L1258 VanDerWaalsContact C-CD2 3.41Å; Y1247-L1258 VanDerWaalsContact N-CD2 3.26Å; I1250-L1258 HydrophobicContact CD1-CD1 4.23Å; I1250-L1258 HydrophobicContact CD1-CD2 4.28Å; Y1254-L1258 PolarHBondContact O-N 3.04Å; Y1254-L1258 VanDerWaalsContact O-N 3.1Å; K1255-L1258 WeakPolarHBondContact O-CB 3.36Å; K1255-L1258 PolarHBondContact O-N 2.96Å; L1258-I1261 PolarHBondContact O-N 2.87Å; L1258-E1262 PolarHBondContact O-N 2.9Å
1259	V	92.1	Very high	88.7	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-68.4	-39.4	175.9	177.1	0	0	0	0	111.6	F1095 F1195 Y1247 K1255 D1256 A1257 I1261 E1262 L1263	F1095-V1259 HydrophobicContact CD1-CB 4.23Å; F1095-V1259 HydrophobicContact CD1-CG1 4.01Å; F1095-V1259 HydrophobicContact CD2-CG1 4.06Å; F1095-V1259 HydrophobicContact CE1-CB 4.24Å; F1095-V1259 HydrophobicContact CE1-CG1 3.74Å; F1095-V1259 HydrophobicContact CE1-CG2 4.49Å; F1095-V1259 HydrophobicContact CE2-CG1 3.8Å; F1095-V1259 HydrophobicContact CG-CG1 4.17Å; F1095-V1259 HydrophobicContact CZ-CG1 3.64Å; F1195-V1259 HydrophobicContact CE1-CG2 4.19Å; F1195-V1259 HydrophobicContact CZ-CG2 4.35Å; Y1247-V1259 HydrophobicContact CD2-CG2 4.07Å; Y1247-V1259 HydrophobicContact CE2-CG2 3.86Å; K1255-V1259 WeakPolarHBondContact O-CG2 3.49Å; K1255-V1259 PolarHBondContact O-N 3.24Å; K1255-V1259 VanDerWaalsContact O-N 3.1Å; D1256-V1259 PolarHBondContact O-N 3.28Å; A1257-V1259 VanDerWaalsContact C-N 3.33Å; A1257-V1259 PolarHBondContact O-N 3.29Å; V1259-I1261 VanDerWaalsContact C-N 3.3Å; V1259-I1261 PolarHBondContact O-N 3.06Å; V1259-E1262 PolarHBondContact O-N 2.79Å; V1259-L1263 HydrophobicContact CG1-CD1 4.09Å; V1259-L1263 HydrophobicContact CG1-CG 4.46Å; V1259-L1263 WeakPolarHBondContact O-CG 3.32Å; V1259-L1263 PolarHBondContact O-N 2.82Å
1260	V	91.8	Very high	88.9	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.024	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-39.4	171.5	173.7	0	0	0	0	111.3	F1044 F1095 D1256 A1257 E1262 L1263 F1264	F1044-V1260 HydrophobicContact CB-CG1 3.96Å; F1044-V1260 HydrophobicContact CD1-CG1 4.02Å; F1044-V1260 HydrophobicContact CD2-CG1 4.19Å; F1044-V1260 HydrophobicContact CG-CG1 3.81Å; F1095-V1260 HydrophobicContact CB-CG2 3.68Å; D1256-V1260 WeakPolarHBondContact O-CG2 3.03Å; D1256-V1260 PolarHBondContact O-N 2.89Å; D1256-V1260 VanDerWaalsContact O-N 3.09Å; A1257-V1260 PolarHBondContact O-N 3.49Å; V1260-E1262 VanDerWaalsContact C-N 3.29Å; V1260-E1262 PolarHBondContact O-N 2.95Å; V1260-L1263 PolarHBondContact O-N 3.07Å; V1260-F1264 VanDerWaalsContact O-CD1 3.3Å; V1260-F1264 WeakPolarHBondContact O-CD1 3.36Å; V1260-F1264 WeakPolarHBondContact O-CG 3.38Å; V1260-F1264 PolarHBondContact O-N 3.01Å
1261	I	91.9	Very high	89.3	Confident	74 Å²	74	29.6 Å²	29.6	38%	0.379	16%	0.156	S	C	.	.	H	α-helix	trans	-64.9	-30.8	176.9	-72.8	165.6	0	0	0	112.5	F1044 A1257 L1258 V1259 F1264 S1265	F1044-I1261 HydrophobicContact CE1-CD1 4.24Å; F1044-I1261 HydrophobicContact CE1-CG1 3.8Å; F1044-I1261 HydrophobicContact CZ-CD1 3.91Å; F1044-I1261 HydrophobicContact CZ-CG1 3.88Å; A1257-I1261 WeakPolarHBondContact O-CB 3Å; A1257-I1261 VanDerWaalsContact O-CG1 3.25Å; A1257-I1261 WeakPolarHBondContact O-CG1 3.34Å; A1257-I1261 PolarHBondContact O-N 2.03Å; L1258-I1261 PolarHBondContact O-N 2.87Å; V1259-I1261 VanDerWaalsContact C-N 3.3Å; V1259-I1261 PolarHBondContact O-N 3.06Å; I1261-F1264 VanDerWaalsContact CA-CE1 3.42Å; I1261-F1264 HydrophobicContact CB-CE1 4.12Å; I1261-F1264 HydrophobicContact CG1-CE1 4.17Å; I1261-F1264 HydrophobicContact CG1-CZ 4.2Å; I1261-F1264 HydrophobicContact CG2-CE1 4.21Å; I1261-F1264 WeakPolarHBondContact O-CD1 3.24Å; I1261-F1264 WeakPolarHBondContact O-CE1 3.23Å; I1261-S1265 WeakPolarHBondContact O-CB 3.15Å; I1261-S1265 PolarHBondContact O-OG 2.86Å
1262	E	93.7	Very high	89.8	Confident	3 Å²	3	28.1 Å²	28.1	1%	0.014	15%	0.151	C	C	.	.	H	α-helix	trans	-74.1	-54.5	173.2	-168.6	-74.9	137	0	0	110.9	H1111 Y1115 V1239 W1240 W1243 L1258 V1259 V1260 F1264 S1265 S1266	H1111-E1262 IonicContact CE1-OE2 3.32Å; H1111-E1262 PolarHBondContact CE1-OE2 3.28Å; H1111-E1262 IonicContact NE2-OE2 3.02Å; H1111-E1262 PolarHBondContact NE2-OE2 3.04Å; Y1115-E1262 PolarHBondContact OH-OE1 2.77Å; Y1115-E1262 PolarHBondContact OH-OE2 3.23Å; V1239-E1262 HydrophobicContact CG1-CG 4.38Å; W1240-E1262 PolarHBondContact NE1-OE1 2.78Å; W1243-E1262 HydrophobicContact CB-CB 4.25Å; W1243-E1262 HydrophobicContact CB-CG 3.81Å; W1243-E1262 VanDerWaalsContact CD1-CB 3.45Å; W1243-E1262 HydrophobicContact CD2-CG 4.02Å; W1243-E1262 HydrophobicContact CG-CB 3.87Å; W1243-E1262 HydrophobicContact CG-CG 3.57Å; L1258-E1262 PolarHBondContact O-N 2.9Å; V1259-E1262 PolarHBondContact O-N 2.79Å; V1260-E1262 VanDerWaalsContact C-N 3.29Å; V1260-E1262 PolarHBondContact O-N 2.95Å; E1262-F1264 PolarHBondContact O-N 2.85Å; E1262-S1265 PolarHBondContact O-N 2.84Å; E1262-S1265 PolarHBondContact O-OG 2.98Å; E1262-S1266 PolarHBondContact O-N 2.93Å; E1262-S1266 PolarHBondContact O-OG 2.77Å
1263	L	93.6	Very high	90.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.3	-46.1	-177.7	-77.1	170.1	0	0	0	113.5	L1088 T1091 A1092 F1095 Y1115 V1259 V1260 S1265 S1266 A1267	L1088-L1263 HydrophobicContact CD2-CD2 3.77Å; T1091-L1263 WeakPolarHBondContact OG1-CD2 3.43Å; A1092-L1263 HydrophobicContact CB-CB 4.19Å; A1092-L1263 HydrophobicContact CB-CD1 4.01Å; F1095-L1263 HydrophobicContact CD2-CD1 4Å; F1095-L1263 HydrophobicContact CE2-CD1 4.07Å; Y1115-L1263 HydrophobicContact CE2-CD2 3.88Å; V1259-L1263 HydrophobicContact CG1-CD1 4.09Å; V1259-L1263 HydrophobicContact CG1-CG 4.46Å; V1259-L1263 WeakPolarHBondContact O-CG 3.32Å; V1259-L1263 PolarHBondContact O-N 2.82Å; V1260-L1263 PolarHBondContact O-N 3.07Å; L1263-S1265 VanDerWaalsContact C-N 3.33Å; L1263-S1265 PolarHBondContact O-N 3.3Å; L1263-S1266 PolarHBondContact O-OG 2.86Å; L1263-A1267 VanDerWaalsContact O-CB 3.25Å; L1263-A1267 WeakPolarHBondContact O-CB 3.37Å; L1263-A1267 PolarHBondContact O-N 2.82Å
1264	F	91.1	Very high	91.6	Very high	35 Å²	35	26 Å²	26	15%	0.154	14%	0.141	C	C	.	.	H	α-helix	trans	-76	-21.5	-175.3	78.7	-8.7	0	0	0	113.2	F1044 V1047 Y1089 V1260 I1261 E1262 T1268	F1044-F1264 AromaticContact CD1-CE2 3.89Å; F1044-F1264 HydrophobicContact CD1-CE2 3.89Å; F1044-F1264 HydrophobicContact CD1-CZ 4.43Å; F1044-F1264 HydrophobicContact CE1-CE2 4.21Å; F1044-F1264 HydrophobicContact CE1-CZ 4.3Å; V1047-F1264 HydrophobicContact CG1-CD2 3.78Å; V1047-F1264 HydrophobicContact CG1-CE2 3.85Å; Y1089-F1264 HydrophobicContact CE1-CB 4.35Å; V1260-F1264 VanDerWaalsContact O-CD1 3.3Å; V1260-F1264 WeakPolarHBondContact O-CD1 3.36Å; V1260-F1264 WeakPolarHBondContact O-CG 3.38Å; V1260-F1264 PolarHBondContact O-N 3.01Å; I1261-F1264 VanDerWaalsContact CA-CE1 3.42Å; I1261-F1264 HydrophobicContact CB-CE1 4.12Å; I1261-F1264 HydrophobicContact CG1-CE1 4.17Å; I1261-F1264 HydrophobicContact CG1-CZ 4.2Å; I1261-F1264 HydrophobicContact CG2-CE1 4.21Å; I1261-F1264 WeakPolarHBondContact O-CD1 3.24Å; I1261-F1264 WeakPolarHBondContact O-CE1 3.23Å; E1262-F1264 PolarHBondContact O-N 2.85Å; F1264-T1268 VanDerWaalsContact O-CB 3.32Å; F1264-T1268 WeakPolarHBondContact O-CB 3.34Å; F1264-T1268 PolarHBondContact O-N 2.05Å; F1264-T1268 PolarHBondContact O-OG1 2.91Å
1265	S	92.4	Very high	91.9	Very high	32 Å²	32	20.9 Å²	20.9	22%	0.224	12%	0.121	C	C	.	.	H	α-helix	trans	-90.2	-42.6	-176.1	61.4	0	0	0	0	110.5	I1261 E1262 L1263 A1267 T1268 I1269	I1261-S1265 WeakPolarHBondContact O-CB 3.15Å; I1261-S1265 PolarHBondContact O-OG 2.86Å; E1262-S1265 PolarHBondContact O-N 2.84Å; E1262-S1265 PolarHBondContact O-OG 2.98Å; L1263-S1265 VanDerWaalsContact C-N 3.33Å; L1263-S1265 PolarHBondContact O-N 3.3Å; S1265-A1267 PolarHBondContact O-N 3.29Å; S1265-T1268 PolarHBondContact O-N 3.26Å; S1265-I1269 WeakPolarHBondContact O-CB 3.22Å; S1265-I1269 WeakPolarHBondContact O-CD1 3.16Å; S1265-I1269 WeakPolarHBondContact O-CG1 3.1Å; S1265-I1269 PolarHBondContact O-N 3.38Å
1266	S	94.6	Very high	91.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.9	-46.1	171.7	72.1	0	0	0	0	111.7	Y1115 E1262 L1263 T1268 I1269 V1270	Y1115-S1266 WeakPolarHBondContact CE1-OG 3.43Å; Y1115-S1266 WeakPolarHBondContact OH-CB 3.44Å; Y1115-S1266 PolarHBondContact OH-OG 2.65Å; E1262-S1266 PolarHBondContact O-N 2.93Å; E1262-S1266 PolarHBondContact O-OG 2.77Å; L1263-S1266 PolarHBondContact O-OG 2.86Å; S1266-T1268 PolarHBondContact O-N 2.99Å; S1266-I1269 PolarHBondContact O-N 3.45Å; S1266-V1270 WeakPolarHBondContact O-CG2 3.17Å; S1266-V1270 PolarHBondContact O-N 2.94Å
1267	A	94.5	Very high	91.8	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.4	-37.1	177.7	0	0	0	0	0	112.2	V1085 L1088 Y1089 L1263 S1265 L1271	V1085-A1267 HydrophobicContact CG1-CB 4.39Å; L1088-A1267 HydrophobicContact CB-CB 3.95Å; L1088-A1267 HydrophobicContact CD1-CB 4.07Å; Y1089-A1267 HydrophobicContact CD1-CB 4.01Å; Y1089-A1267 HydrophobicContact CD2-CB 4.12Å; Y1089-A1267 HydrophobicContact CE1-CB 3.58Å; Y1089-A1267 HydrophobicContact CE2-CB 3.7Å; Y1089-A1267 HydrophobicContact CG-CB 4.27Å; Y1089-A1267 VanDerWaalsContact CZ-CB 3.42Å; L1263-A1267 VanDerWaalsContact O-CB 3.25Å; L1263-A1267 WeakPolarHBondContact O-CB 3.37Å; L1263-A1267 PolarHBondContact O-N 2.82Å; S1265-A1267 PolarHBondContact O-N 3.29Å; A1267-L1271 VanDerWaalsContact O-CB 3.3Å; A1267-L1271 WeakPolarHBondContact O-CB 3.31Å; A1267-L1271 PolarHBondContact O-N 3Å
1268	T	94.1	Very high	91.4	Very high	51 Å²	51	24.7 Å²	24.7	31%	0.313	15%	0.146	S	C	.	.	H	α-helix	trans	-67.6	-43.4	174.5	-62.7	0	0	0	0	111.5	Y1089 F1264 S1265 S1266 L1271 A1272	Y1089-T1268 VanDerWaalsContact OH-CA 3.31Å; Y1089-T1268 WeakPolarHBondContact OH-CA 3.28Å; Y1089-T1268 PolarHBondContact OH-N 3.26Å; Y1089-T1268 VanDerWaalsContact OH-N 3.13Å; Y1089-T1268 PolarHBondContact OH-OG1 3.21Å; F1264-T1268 VanDerWaalsContact O-CB 3.32Å; F1264-T1268 WeakPolarHBondContact O-CB 3.34Å; F1264-T1268 PolarHBondContact O-N 2.05Å; F1264-T1268 PolarHBondContact O-OG1 2.91Å; S1265-T1268 PolarHBondContact O-N 3.26Å; S1266-T1268 PolarHBondContact O-N 2.99Å; T1268-L1271 PolarHBondContact O-N 3.19Å; T1268-A1272 VanDerWaalsContact O-CB 3.27Å; T1268-A1272 WeakPolarHBondContact O-CB 3.18Å; T1268-A1272 PolarHBondContact O-N 3.31Å
1269	I	95.3	Very high	90.9	Very high	32 Å²	32	25.5 Å²	25.5	16%	0.164	15%	0.15	C	C	.	.	H	α-helix	trans	-59.1	-48.3	176.8	-71.7	162.6	0	0	0	110.4	T1232 L1235 L1236 V1239 S1265 S1266 L1273	T1232-I1269 HydrophobicContact CG2-CG2 4.31Å; L1235-I1269 HydrophobicContact CB-CD1 4.37Å; L1235-I1269 HydrophobicContact CB-CG2 3.92Å; L1236-I1269 HydrophobicContact CD2-CB 4.46Å; L1236-I1269 HydrophobicContact CD2-CG2 4.31Å; L1236-I1269 HydrophobicContact CG-CG2 4.16Å; V1239-I1269 HydrophobicContact CG2-CD1 4.05Å; S1265-I1269 WeakPolarHBondContact O-CB 3.22Å; S1265-I1269 WeakPolarHBondContact O-CD1 3.16Å; S1265-I1269 WeakPolarHBondContact O-CG1 3.1Å; S1265-I1269 PolarHBondContact O-N 3.38Å; S1266-I1269 PolarHBondContact O-N 3.45Å; I1269-L1273 HydrophobicContact CG2-CD1 3.87Å; I1269-L1273 WeakPolarHBondContact O-CB 3.43Å; I1269-L1273 WeakPolarHBondContact O-CG 3.27Å; I1269-L1273 PolarHBondContact O-N 2.96Å
1270	V	94.3	Very high	90.5	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-61.9	-47.8	177	174.1	0	0	0	0	111	L1081 V1085 T1232 L1236 S1266 M1274	L1081-V1270 HydrophobicContact CD1-CG1 3.97Å; L1081-V1270 HydrophobicContact CD2-CG1 4.23Å; L1081-V1270 HydrophobicContact CG-CG1 4.16Å; V1085-V1270 HydrophobicContact CG2-CB 4.17Å; V1085-V1270 HydrophobicContact CG2-CG1 3.62Å; T1232-V1270 HydrophobicContact CG2-CB 4.46Å; T1232-V1270 HydrophobicContact CG2-CG2 3.9Å; L1236-V1270 HydrophobicContact CD1-CG2 4.08Å; S1266-V1270 WeakPolarHBondContact O-CG2 3.17Å; S1266-V1270 PolarHBondContact O-N 2.94Å; V1270-M1274 HydrophobicContact CG1-CG 4.33Å; V1270-M1274 WeakPolarHBondContact O-CB 3.47Å; V1270-M1274 WeakPolarHBondContact O-CG 3.43Å; V1270-M1274 PolarHBondContact O-N 3.43Å
1271	L	93.1	Very high	89.7	Confident	19 Å²	19	34.7 Å²	34.7	10%	0.099	19%	0.19	C	C	.	.	H	α-helix	trans	-60.3	-53.3	-179.7	-177.9	67.1	0	0	0	112.1	I1054 T1055 L1082 A1267 T1268 L1273 F1275 G1276	I1054-L1271 HydrophobicContact CG2-CD2 4.37Å; T1055-L1271 HydrophobicContact CG2-CD1 3.84Å; T1055-L1271 HydrophobicContact CG2-CD2 3.47Å; T1055-L1271 VanDerWaalsContact CG2-CD2 3.47Å; T1055-L1271 HydrophobicContact CG2-CG 4.22Å; L1082-L1271 HydrophobicContact CD1-CD1 3.81Å; A1267-L1271 VanDerWaalsContact O-CB 3.3Å; A1267-L1271 WeakPolarHBondContact O-CB 3.31Å; A1267-L1271 PolarHBondContact O-N 3Å; T1268-L1271 PolarHBondContact O-N 3.19Å; L1271-L1273 PolarHBondContact O-N 3.03Å; L1271-F1275 HydrophobicContact CD1-CB 4.29Å; L1271-F1275 HydrophobicContact CD1-CD2 4.12Å; L1271-F1275 HydrophobicContact CD1-CG 4.42Å; L1271-F1275 WeakPolarHBondContact O-CB 3.38Å; L1271-F1275 PolarHBondContact O-N 2.93Å; L1271-G1276 PolarHBondContact O-N 3Å
1272	A	92	Very high	88.8	Confident	55 Å²	55	33 Å²	33	46%	0.455	18%	0.181	S	C	.	.	H	α-helix	trans	-62.6	-41	-173.9	0	0	0	0	0	112.1	T1268 G1276	T1268-A1272 VanDerWaalsContact O-CB 3.27Å; T1268-A1272 WeakPolarHBondContact O-CB 3.18Å; T1268-A1272 PolarHBondContact O-N 3.31Å; A1272-G1276 VanDerWaalsContact O-CA 3.24Å; A1272-G1276 WeakPolarHBondContact O-CA 3.27Å; A1272-G1276 PolarHBondContact O-N 3.05Å; A1272-G1276 VanDerWaalsContact O-N 3.12Å
1273	L	92.8	Very high	87.8	Confident	31 Å²	31	37.7 Å²	37.7	16%	0.162	21%	0.206	C	C	.	.	H	α-helix	trans	-88.5	-30.9	-174.4	-60.7	171.5	0	0	0	113.5	W1228 T1232 L1235 I1269 L1271 P1277	W1228-L1273 HydrophobicContact CE3-CB 4.42Å; W1228-L1273 HydrophobicContact CE3-CD2 3.94Å; W1228-L1273 HydrophobicContact CZ3-CD2 3.91Å; T1232-L1273 VanDerWaalsContact OG1-CB 3.25Å; T1232-L1273 WeakPolarHBondContact OG1-CB 3.3Å; L1235-L1273 HydrophobicContact CD1-CD1 3.69Å; I1269-L1273 HydrophobicContact CG2-CD1 3.87Å; I1269-L1273 WeakPolarHBondContact O-CB 3.43Å; I1269-L1273 WeakPolarHBondContact O-CG 3.27Å; I1269-L1273 PolarHBondContact O-N 2.96Å; L1271-L1273 PolarHBondContact O-N 3.03Å; L1273-P1277 WeakPolarHBondContact O-CD 3.08Å
1274	M	89.9	Confident	86.9	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-86.4	-34	178	-67.1	-77.2	100.5	0	0	113.7	L1081 L1122 K1125 W1228 L1229 T1232 V1270	L1081-M1274 HydrophobicContact CD2-CB 3.96Å; L1081-M1274 HydrophobicContact CD2-CG 3.86Å; L1081-M1274 HydrophobicContact CD2-SD 4.33Å; L1122-M1274 HydrophobicContact CD2-CG 4.34Å; L1122-M1274 HydrophobicContact CD2-SD 3.94Å; K1125-M1274 HydrophobicContact CD-SD 4.47Å; K1125-M1274 PolarHBondContact NZ-SD 2.81Å; W1228-M1274 HydrophobicContact CB-CE 3.87Å; W1228-M1274 WeakPolarHBondContact O-CE 3.42Å; L1229-M1274 VanDerWaalsContact CA-CE 3.48Å; L1229-M1274 HydrophobicContact CB-CE 4.05Å; L1229-M1274 HydrophobicContact CG-CE 4.08Å; L1229-M1274 HydrophobicContact CG-SD 4.25Å; L1229-M1274 VanDerWaalsContact N-CE 3.34Å; T1232-M1274 WeakPolarHBondContact OG1-CE 3.35Å; V1270-M1274 HydrophobicContact CG1-CG 4.33Å; V1270-M1274 WeakPolarHBondContact O-CB 3.47Å; V1270-M1274 WeakPolarHBondContact O-CG 3.43Å; V1270-M1274 PolarHBondContact O-N 3.43Å
1275	F	89.1	Confident	85.7	Confident	14 Å²	14	40.9 Å²	40.9	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-111.5	-27.5	-175.1	-63.1	-89.7	0	0	0	113.4	V1058 I1062 G1078 L1081 L1082 L1271 K1278 L1279	V1058-F1275 HydrophobicContact CG1-CB 4.45Å; I1062-F1275 HydrophobicContact CD1-CD1 3.78Å; I1062-F1275 HydrophobicContact CD1-CE1 4Å; G1078-F1275 WeakPolarHBondContact O-CZ 3.5Å; L1081-F1275 HydrophobicContact CB-CE2 4.47Å; L1081-F1275 HydrophobicContact CB-CZ 4.23Å; L1081-F1275 HydrophobicContact CD2-CE2 3.81Å; L1081-F1275 HydrophobicContact CD2-CZ 4.14Å; L1081-F1275 HydrophobicContact CG-CE2 4.08Å; L1081-F1275 HydrophobicContact CG-CZ 4.33Å; L1082-F1275 HydrophobicContact CB-CZ 4.03Å; L1082-F1275 HydrophobicContact CD1-CD1 4.1Å; L1082-F1275 HydrophobicContact CD1-CD2 3.78Å; L1082-F1275 HydrophobicContact CD1-CE1 3.86Å; L1082-F1275 HydrophobicContact CD1-CE2 3.53Å; L1082-F1275 HydrophobicContact CD1-CG 4.05Å; L1082-F1275 HydrophobicContact CD1-CZ 3.57Å; L1082-F1275 HydrophobicContact CG-CZ 4.43Å; L1271-F1275 HydrophobicContact CD1-CB 4.29Å; L1271-F1275 HydrophobicContact CD1-CD2 4.12Å; L1271-F1275 HydrophobicContact CD1-CG 4.42Å; L1271-F1275 WeakPolarHBondContact O-CB 3.38Å; L1271-F1275 PolarHBondContact O-N 2.93Å; F1275-K1278 PolarHBondContact O-N 3.32Å; F1275-K1278 VanDerWaalsContact O-N 3.08Å; F1275-L1279 WeakPolarHBondContact O-CB 3.49Å; F1275-L1279 PolarHBondContact O-N 3.07Å
1276	G	87.1	Confident	83.9	Confident	33 Å²	33	43.4 Å²	43.4	34%	0.34	23%	0.231	S	C	.	.	H	α-helix	trans	-51.4	-51.2	175.7	0	0	0	0	0	113.8	L1271 A1272 K1278 L1279 Y1280	L1271-G1276 PolarHBondContact O-N 3Å; A1272-G1276 VanDerWaalsContact O-CA 3.24Å; A1272-G1276 WeakPolarHBondContact O-CA 3.27Å; A1272-G1276 PolarHBondContact O-N 3.05Å; A1272-G1276 VanDerWaalsContact O-N 3.12Å; G1276-K1278 VanDerWaalsContact C-N 3.32Å; G1276-K1278 PolarHBondContact O-N 2.82Å; G1276-L1279 PolarHBondContact O-N 3.43Å; G1276-Y1280 WeakPolarHBondContact O-CB 3.46Å; G1276-Y1280 PolarHBondContact O-N 3.33Å
1277	P	84.7	Confident	81.9	Confident	29 Å²	29	45.9 Å²	45.9	19%	0.188	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-37.1	176.1	-25	34.7	0	0	0	113.5	W1228 L1273 L1281	W1228-P1277 HydrophobicContact CD2-CG 3.6Å; W1228-P1277 HydrophobicContact CE3-CG 3.78Å; W1228-P1277 HydrophobicContact CG-CG 4.19Å; W1228-P1277 HydrophobicContact CH2-CG 3.99Å; W1228-P1277 HydrophobicContact CZ2-CB 4.4Å; W1228-P1277 HydrophobicContact CZ2-CG 3.81Å; W1228-P1277 HydrophobicContact CZ3-CG 3.97Å; L1273-P1277 WeakPolarHBondContact O-CD 3.08Å; P1277-L1281 WeakPolarHBondContact O-CG 3.24Å; P1277-L1281 PolarHBondContact O-N 3.38Å; P1277-L1281 VanDerWaalsContact O-N 3.13Å
1278	K	80.1	Confident	79.7	Confident	71 Å²	71	48.8 Å²	48.8	31%	0.309	26%	0.264	S	S	.	.	H	α-helix	trans	-71.9	-42.1	179.1	-64.5	-167.8	177.5	-172.8	0	112.1	E1225 F1275 G1276 L1281 L1282	E1225-K1278 WeakPolarHBondContact OE1-CE 3.32Å; E1225-K1278 IonicContact OE1-NZ 3.16Å; E1225-K1278 PolarHBondContact OE1-NZ 3.05Å; E1225-K1278 IonicContact OE2-NZ 2.74Å; F1275-K1278 PolarHBondContact O-N 3.32Å; F1275-K1278 VanDerWaalsContact O-N 3.08Å; G1276-K1278 VanDerWaalsContact C-N 3.32Å; G1276-K1278 PolarHBondContact O-N 2.82Å; K1278-L1281 PolarHBondContact O-N 3.25Å; K1278-L1282 WeakPolarHBondContact O-CB 3.04Å; K1278-L1282 PolarHBondContact O-N 3.11Å
1279	L	81.5	Confident	77.2	Confident	44 Å²	44	50.6 Å²	50.6	23%	0.23	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-40.9	177.2	-160.6	79.4	0	0	0	110.7	V1058 I1061 F1275 G1276 L1282 L1283	V1058-L1279 HydrophobicContact CG2-CD1 4.44Å; V1058-L1279 HydrophobicContact CG2-CD2 4.32Å; I1061-L1279 HydrophobicContact CG2-CD1 4.22Å; F1275-L1279 WeakPolarHBondContact O-CB 3.49Å; F1275-L1279 PolarHBondContact O-N 3.07Å; G1276-L1279 PolarHBondContact O-N 3.43Å; L1279-L1282 PolarHBondContact O-N 3.37Å; L1279-L1283 HydrophobicContact CD2-CD1 4.11Å; L1279-L1283 HydrophobicContact CG-CD1 3.81Å; L1279-L1283 HydrophobicContact CG-CG 4.34Å; L1279-L1283 VanDerWaalsContact O-CB 3.3Å; L1279-L1283 WeakPolarHBondContact O-CB 3.3Å; L1279-L1283 VanDerWaalsContact O-CG 3.26Å; L1279-L1283 WeakPolarHBondContact O-CG 3.3Å; L1279-L1283 PolarHBondContact O-N 2.75Å
1280	Y	82.4	Confident	74.8	Confident	142 Å²	142	52.2 Å²	52.2	56%	0.557	28%	0.28	S	S	*	.	H	α-helix	trans	-57.9	-51.7	173.4	178.9	-96.2	0	0	0	111.9	G1276 L1282 L1283 C1284 Y1285	G1276-Y1280 WeakPolarHBondContact O-CB 3.46Å; G1276-Y1280 PolarHBondContact O-N 3.33Å; Y1280-L1282 VanDerWaalsContact C-N 3.32Å; Y1280-L1282 PolarHBondContact O-N 3.14Å; Y1280-L1283 PolarHBondContact O-N 3.35Å; Y1280-C1284 VanDerWaalsContact O-CB 3.31Å; Y1280-C1284 WeakPolarHBondContact O-CB 3.45Å; Y1280-C1284 PolarHBondContact O-N 3.43Å; Y1280-Y1285 HydrophobicContact CE1-CE2 4.35Å
1281	L	75.3	Confident	72.1	Confident	57 Å²	57	57.4 Å²	57.4	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-58.9	-42.1	176.5	-72.2	168.4	0	0	0	112	Y1223 P1277 K1278 Y1285	Y1223-L1281 HydrophobicContact CD1-CD1 4.17Å; Y1223-L1281 HydrophobicContact CD2-CD1 4.28Å; Y1223-L1281 HydrophobicContact CE1-CD1 4.4Å; Y1223-L1281 HydrophobicContact CE2-CD1 4.49Å; Y1223-L1281 HydrophobicContact CG-CD1 4.12Å; P1277-L1281 WeakPolarHBondContact O-CG 3.24Å; P1277-L1281 PolarHBondContact O-N 3.38Å; P1277-L1281 VanDerWaalsContact O-N 3.13Å; K1278-L1281 PolarHBondContact O-N 3.25Å; L1281-Y1285 HydrophobicContact CD2-CD2 4.43Å; L1281-Y1285 HydrophobicContact CD2-CE2 4.32Å; L1281-Y1285 WeakPolarHBondContact O-CB 3.33Å; L1281-Y1285 PolarHBondContact O-N 3.24Å
1282	L	72.6	Confident	69.6	Low	37 Å²	37	62.5 Å²	62.5	19%	0.194	32%	0.323	C	S	.	.	H	α-helix	trans	-76.7	-18.7	-176.8	179.4	145.5	0	0	0	114.7	I1061 K1065 V1071 K1278 L1279 Y1280	I1061-L1282 HydrophobicContact CG2-CD2 3.91Å; K1065-L1282 HydrophobicContact CB-CD1 4.08Å; K1065-L1282 HydrophobicContact CD-CD1 4.14Å; K1065-L1282 HydrophobicContact CD-CD2 4.19Å; K1065-L1282 HydrophobicContact CD-CG 4.23Å; K1065-L1282 HydrophobicContact CG-CD1 3.98Å; K1065-L1282 HydrophobicContact CG-CD2 4.1Å; K1065-L1282 HydrophobicContact CG-CG 4.4Å; V1071-L1282 HydrophobicContact CG2-CD1 3.91Å; K1278-L1282 WeakPolarHBondContact O-CB 3.04Å; K1278-L1282 PolarHBondContact O-N 3.11Å; L1279-L1282 PolarHBondContact O-N 3.37Å; Y1280-L1282 VanDerWaalsContact C-N 3.32Å; Y1280-L1282 PolarHBondContact O-N 3.14Å
1283	L	73.4	Confident	66.9	Low	103 Å²	103	65.6 Å²	65.6	54%	0.539	34%	0.339	S	S	.	.	H	α-helix	trans	-98.7	-40.2	176.9	-71.1	174.8	0	0	0	113	L1279 Y1280	L1279-L1283 HydrophobicContact CD2-CD1 4.11Å; L1279-L1283 HydrophobicContact CG-CD1 3.81Å; L1279-L1283 HydrophobicContact CG-CG 4.34Å; L1279-L1283 VanDerWaalsContact O-CB 3.3Å; L1279-L1283 WeakPolarHBondContact O-CB 3.3Å; L1279-L1283 VanDerWaalsContact O-CG 3.26Å; L1279-L1283 WeakPolarHBondContact O-CG 3.3Å; L1279-L1283 PolarHBondContact O-N 2.75Å; Y1280-L1283 PolarHBondContact O-N 3.35Å
1284	C	74.6	Confident	64.2	Low	37 Å²	37	70.6 Å²	70.6	25%	0.25	37%	0.37	C	S	.	.	H	α-helix	trans	-82.4	-17.3	-176	-68.2	0	0	0	0	113.8	Y1280 K1363	Y1280-C1284 VanDerWaalsContact O-CB 3.31Å; Y1280-C1284 WeakPolarHBondContact O-CB 3.45Å; Y1280-C1284 PolarHBondContact O-N 3.43Å; C1284-K1363 WeakPolarHBondContact O-CB 3.42Å; C1284-K1363 PolarHBondContact O-N 3.08Å
1285	Y	64.9	Low	61.5	Low	64 Å²	64	73.2 Å²	73.2	25%	0.251	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	150	-177.9	-56	-101.1	0	0	0	111.7	Y1280 L1281 I1360 L1361 K1362	Y1280-Y1285 HydrophobicContact CE1-CE2 4.35Å; L1281-Y1285 HydrophobicContact CD2-CD2 4.43Å; L1281-Y1285 HydrophobicContact CD2-CE2 4.32Å; L1281-Y1285 WeakPolarHBondContact O-CB 3.33Å; L1281-Y1285 PolarHBondContact O-N 3.24Å; Y1285-I1360 VanDerWaalsContact CB-CG2 3.43Å; Y1285-I1360 HydrophobicContact CD1-CG2 3.62Å; Y1285-I1360 HydrophobicContact CE1-CG2 4.49Å; Y1285-I1360 HydrophobicContact CG-CG2 3.66Å; Y1285-L1361 VanDerWaalsContact CA-O 3.29Å; Y1285-L1361 WeakPolarHBondContact CA-O 3.22Å; Y1285-K1362 HydrophobicContact CD1-CB 4.05Å; Y1285-K1362 HydrophobicContact CE1-CB 3.95Å; Y1285-K1362 HydrophobicContact CE1-CG 4.13Å
1286	E	55.7	Low	58.6	Low	86 Å²	86	80.6 Å²	80.6	40%	0.402	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.6	-177.9	-166.1	137.2	-121.7	0	0	108.6	V1288 L1361 K1363	E1286-V1288 PolarHBondContact O-N 3.45Å; E1286-L1361 PolarHBondContact N-O 3.07Å; E1286-L1361 PolarHBondContact O-N 2.7Å; E1286-L1361 VanDerWaalsContact O-N 3.12Å; E1286-K1363 IonicContact OE1-NZ 2.89Å; E1286-K1363 PolarHBondContact OE1-NZ 3.3Å; E1286-K1363 WeakPolarHBondContact OE2-CD 3.42Å; E1286-K1363 WeakPolarHBondContact OE2-CE 3.34Å; E1286-K1363 IonicContact OE2-NZ 2.63Å; E1286-K1363 PolarHBondContact OE2-NZ 3.34Å
1287	P	51.6	Low	56.1	Low	51 Å²	51	85.6 Å²	85.6	33%	0.331	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	104.8	179.5	29.4	-30.9	0	0	0	109.2	V1070	V1070-P1287 HydrophobicContact CG1-CG 3.63Å
1288	V	48.8	Very low	53.6	Low	61 Å²	61	93 Å²	93	37%	0.37	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	120.8	170.3	175.1	0	0	0	0	107.9	E1286 I1290 V1359 L1361	E1286-V1288 PolarHBondContact O-N 3.45Å; V1288-I1290 HydrophobicContact CG1-CG1 4.21Å; V1288-I1290 PolarHBondContact O-N 2.93Å; V1288-V1359 PolarHBondContact N-O 3.06Å; V1288-V1359 PolarHBondContact O-N 3.25Å; V1288-L1361 HydrophobicContact CB-CD1 4.22Å; V1288-L1361 HydrophobicContact CG2-CD1 3.86Å
1289	L	42.5	Very low	51.2	Low	89 Å²	89	96.7 Å²	96.7	47%	0.466	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	114.1	165.3	-82.7	64.3	0	0	0	106.8	Y1356	L1289-Y1356 HydrophobicContact CB-CD1 4.19Å; L1289-Y1356 HydrophobicContact CD2-CD1 4.03Å; L1289-Y1356 HydrophobicContact CD2-CD2 4.34Å; L1289-Y1356 HydrophobicContact CD2-CG 3.82Å; L1289-Y1356 HydrophobicContact CG-CD1 4.48Å; L1289-Y1356 HydrophobicContact CG-CG 4.4Å
1290	I	43.8	Very low	48.7	Very low	67 Å²	67	101.4 Å²	101.4	34%	0.344	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.2	166.6	-56.5	-176.2	0	0	0	106.5	V1288 Y1292 Q1357 V1359	V1288-I1290 HydrophobicContact CG1-CG1 4.21Å; V1288-I1290 PolarHBondContact O-N 2.93Å; I1290-Y1292 HydrophobicContact CB-CD2 4.46Å; I1290-Y1292 HydrophobicContact CB-CE2 3.83Å; I1290-Y1292 HydrophobicContact CG2-CD2 4.14Å; I1290-Y1292 HydrophobicContact CG2-CE1 4.41Å; I1290-Y1292 HydrophobicContact CG2-CE2 3.69Å; I1290-Y1292 WeakPolarHBondContact O-CD2 3.42Å; I1290-Q1357 PolarHBondContact N-O 2.94Å; I1290-V1359 HydrophobicContact CD1-CB 4.27Å; I1290-V1359 HydrophobicContact CD1-CG2 3.76Å; I1290-V1359 HydrophobicContact CG1-CG2 4.26Å
1291	E	37.8	Very low	46.2	Very low	111 Å²	111	102.6 Å²	102.6	52%	0.519	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.5	119.7	172.3	-173.5	157.4	-124.1	0	0	108.8	S1354 Y1356	E1291-S1354 WeakPolarHBondContact OE1-CB 3.16Å; E1291-S1354 PolarHBondContact OE1-OG 2.66Å; E1291-Y1356 HydrophobicContact CB-CD1 4.22Å; E1291-Y1356 HydrophobicContact CB-CE1 3.96Å; E1291-Y1356 HydrophobicContact CG-CD1 4.47Å; E1291-Y1356 HydrophobicContact CG-CE1 3.94Å; E1291-Y1356 WeakPolarHBondContact OE1-CE1 3.06Å; E1291-Y1356 VanDerWaalsContact OE1-CZ 3.32Å; E1291-Y1356 PolarHBondContact OE1-OH 3.06Å
1292	Y	41.4	Very low	44	Very low	125 Å²	125	103.9 Å²	103.9	49%	0.49	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-97.6	120.1	179.4	-71.8	-92.8	0	0	0	109.4	I1290 T1294 Q1357	I1290-Y1292 HydrophobicContact CB-CD2 4.46Å; I1290-Y1292 HydrophobicContact CB-CE2 3.83Å; I1290-Y1292 HydrophobicContact CG2-CD2 4.14Å; I1290-Y1292 HydrophobicContact CG2-CE1 4.41Å; I1290-Y1292 HydrophobicContact CG2-CE2 3.69Å; I1290-Y1292 WeakPolarHBondContact O-CD2 3.42Å; Y1292-T1294 PolarHBondContact O-N 2.04Å; Y1292-Q1357 HydrophobicContact CE2-CB 4.27Å
1293	P	35.1	Very low	42	Very low	121 Å²	121	108 Å²	108	79%	0.786	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-69.3	118.9	173.6	28.3	-32.7	0	0	0	109.5	G1295	P1293-G1295 PolarHBondContact O-N 2.95Å
1294	T	35.9	Very low	40	Very low	135 Å²	135	112.7 Å²	112.7	83%	0.828	62%	0.621	S	S	*	*			trans	-77.7	74.1	175.3	50.2	0	0	0	0	110.5	Y1292	Y1292-T1294 PolarHBondContact O-N 2.04Å
1295	G	32.9	Very low	38	Very low	60 Å²	60	118.6 Å²	118.6	62%	0.619	65%	0.645	S	S	*	*			trans	-80.8	143.5	169.9	0	0	0	0	0	111.7	P1293 V1297	P1293-G1295 PolarHBondContact O-N 2.95Å; G1295-V1297 PolarHBondContact O-N 2.92Å
1296	N	28	Very low	36.5	Very low	170 Å²	170	122.6 Å²	122.6	91%	0.909	67%	0.67	S	S	*	*			trans	-65.8	114.7	-180	-60.4	-16.1	0	0	0	111
1297	V	34.8	Very low	35.4	Very low	138 Å²	138	128.4 Å²	128.4	84%	0.836	69%	0.689	S	S	*	*			trans	-138.8	132.8	163.2	-174.6	0	0	0	0	107.8	G1295	G1295-V1297 PolarHBondContact O-N 2.92Å
1298	E	31.8	Very low	34.6	Very low	183 Å²	183	131.8 Å²	131.8	86%	0.855	71%	0.705	S	S	*	*			trans	-85.3	179.3	-176.3	-63.5	170.5	128.5	0	0	112
1299	D	30.9	Very low	34.2	Very low	150 Å²	150	135.6 Å²	135.6	80%	0.802	72%	0.723	S	S	*	*			trans	-34.1	129.8	-177.1	-60.9	-49.9	0	0	0	116.2
1300	N	29.3	Very low	33.9	Very low	143 Å²	143	139.7 Å²	139.7	77%	0.765	74%	0.739	S	S	*	*				-167.5	141.5	118.6	-102	-64.7	0	0	0	115.2	S1302	N1300-S1302 PolarHBondContact O-N 3.25Å; N1300-S1302 PolarHBondContact O-OG 3.47Å
1301	D	29.9	Very low	33.7	Very low	167 Å²	167	139.8 Å²	139.8	89%	0.893	75%	0.75	S	S	*	*	S	Bend	trans	-6.6	91.6	158.8	-164.6	20.3	0	0	0	117.7
1302	S	28.4	Very low	33.6	Very low	84 Å²	84	143.6 Å²	143.6	59%	0.587	76%	0.761	S	S	*	*			trans	-162.7	-5	178.1	50.5	0	0	0	0	117	N1300 K1304	N1300-S1302 PolarHBondContact O-N 3.25Å; N1300-S1302 PolarHBondContact O-OG 3.47Å; S1302-K1304 PolarHBondContact O-N 3.01Å
1303	S	30.3	Very low	33.3	Very low	124 Å²	124	144.9 Å²	144.9	87%	0.867	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	17.4	-169.6	65	0	0	0	0	116.4
1304	K	31.3	Very low	33.2	Very low	201 Å²	201	146.2 Å²	146.2	87%	0.874	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-12.8	-177.5	-142.9	174.4	-172.2	175.1	0	114	S1302	S1302-K1304 PolarHBondContact O-N 3.01Å
1305	E	32.5	Very low	32.9	Very low	160 Å²	160	148.4 Å²	148.4	75%	0.748	77%	0.771	S	S	*	*			trans	-93.2	-2.6	-171.6	-59.7	-165.9	138.1	0	0	115.2	Y1307	E1305-Y1307 PolarHBondContact O-N 3.39Å
1306	L	33.7	Very low	32.6	Very low	148 Å²	148	152 Å²	152	78%	0.775	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	37.6	-171.7	-153.9	75.2	0	0	0	114.8
1307	Y	33.2	Very low	32.8	Very low	208 Å²	208	149.6 Å²	149.6	82%	0.816	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137	-17.9	176.9	-92.3	-81.3	0	0	0	115.4	E1305 L1309	E1305-Y1307 PolarHBondContact O-N 3.39Å; Y1307-L1309 PolarHBondContact O-N 3.07Å
1308	D	35.2	Very low	32.5	Very low	123 Å²	123	147.3 Å²	147.3	66%	0.658	77%	0.77	S	S	*	*			trans	-91.8	18.2	-169.3	-77.2	-51.3	0	0	0	116	E1310 A1311	D1308-E1310 PolarHBondContact O-N 3.22Å; D1308-A1311 WeakPolarHBondContact O-CB 3.2Å; D1308-A1311 PolarHBondContact O-N 3.31Å; D1308-A1311 VanDerWaalsContact O-N 3.08Å
1309	L	38.8	Very low	32.4	Very low	141 Å²	141	144 Å²	144	74%	0.738	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-7.3	179.7	-120	167.4	0	0	0	114.5	Y1307	Y1307-L1309 PolarHBondContact O-N 3.07Å
1310	E	38.1	Very low	32.5	Very low	174 Å²	174	141.1 Å²	141.1	81%	0.813	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-16	175.7	-147	154.9	-150.3	0	0	112.2	D1308 Y1312	D1308-E1310 PolarHBondContact O-N 3.22Å; E1310-Y1312 VanDerWaalsContact C-N 3.34Å; E1310-Y1312 PolarHBondContact O-N 2.95Å
1311	A	39.3	Very low	32.8	Very low	70 Å²	70	140.2 Å²	140.2	58%	0.579	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-15.3	177.3	0	0	0	0	0	114.5	D1308	D1308-A1311 WeakPolarHBondContact O-CB 3.2Å; D1308-A1311 PolarHBondContact O-N 3.31Å; D1308-A1311 VanDerWaalsContact O-N 3.08Å
1312	Y	34.8	Very low	33	Very low	191 Å²	191	136 Å²	136	75%	0.749	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-13.6	-175.1	-168.2	-101.4	0	0	0	114.3	E1310	E1310-Y1312 VanDerWaalsContact C-N 3.34Å; E1310-Y1312 PolarHBondContact O-N 2.95Å
1313	F	35.8	Very low	33.1	Very low	152 Å²	152	138 Å²	138	67%	0.667	78%	0.778	S	S	*	*	S	Bend	trans	-105.4	-10	-174.2	-76.5	-74.7	0	0	0	115.4
1314	D	32.6	Very low	33.2	Very low	148 Å²	148	137.8 Å²	137.8	79%	0.791	78%	0.777	S	S	*	*	S	Bend	trans	-107.4	47.2	-177.2	-81.2	-16.8	0	0	0	112.9
1315	Q	29.6	Very low	34	Very low	181 Å²	181	134.2 Å²	134.2	85%	0.846	77%	0.774	S	S	*	*			trans	-130.8	121.1	165.3	-71.6	-163	2.4	0	0	113.8
1316	T	26.9	Very low	34.1	Very low	135 Å²	135	131.8 Å²	131.8	83%	0.828	78%	0.781	S	S	*	*			trans	-125.6	149.5	164.6	55.6	0	0	0	0	108.5
1317	P	32.6	Very low	34.2	Very low	120 Å²	120	128.1 Å²	128.1	78%	0.779	78%	0.779	S	S	*	*			cis	-130.2	-171.9	-21.6	39.8	-23.4	0	0	0	112.7
1318	A	26.7	Very low	34.1	Very low	90 Å²	90	124.3 Å²	124.3	74%	0.744	78%	0.783	S	S	*	*			trans	79.6	121.5	158.9	0	0	0	0	0	121.9
1319	S	29.9	Very low	34.8	Very low	115 Å²	115	124 Å²	124	80%	0.804	79%	0.787	S	S	*	*			trans	48	117.5	141.9	57.6	0	0	0	0	124.8
1320	A	33.8	Very low	34.6	Very low	89 Å²	89	125.3 Å²	125.3	74%	0.736	79%	0.794	S	S	*	*				89.3	103.6	127.6	0	0	0	0	0	124.3
1321	S	34.7	Very low	34.5	Very low	123 Å²	123	122 Å²	122	86%	0.86	79%	0.791	S	S	*	*			trans	55.7	132.2	130.9	62.4	0	0	0	0	125.3
1322	G	34.3	Very low	34.5	Very low	79 Å²	79	122.7 Å²	122.7	81%	0.814	80%	0.796	S	S	*	*			trans	166.4	137.7	156.6	0	0	0	0	0	115.5
1323	C	30.5	Very low	34.5	Very low	127 Å²	127	119.2 Å²	119.2	86%	0.858	80%	0.798	S	S	*	*			trans	-120.8	156.7	-161.7	-55.1	0	0	0	0	119
1324	S	33.4	Very low	34.4	Very low	119 Å²	119	123.1 Å²	123.1	83%	0.832	81%	0.809	S	S	*	*			trans	102	152.4	135.8	-68	0	0	0	0	125.1
1325	P	48.1	Very low	34.7	Very low	126 Å²	126	121 Å²	121	82%	0.818	80%	0.803	S	S	*	*			trans	-141	-171.8	-162.6	44.6	-24	0	0	0	118.3
1326	A	33.7	Very low	34.9	Very low	108 Å²	108	116.7 Å²	116.7	89%	0.893	80%	0.798	S	S	*	*			trans	157.2	154.7	140.7	0	0	0	0	0	117
1327	G	35.3	Very low	35.2	Very low	71 Å²	71	120.2 Å²	120.2	73%	0.732	80%	0.802	S	S	*	*			trans	157.3	35	151.4	0	0	0	0	0	131
1328	S	33	Very low	35.2	Very low	128 Å²	128	119.5 Å²	119.5	90%	0.895	80%	0.8	S	S	*	*			trans	69.9	165.5	144.8	84.6	0	0	0	0	125.1
1329	P	49.6	Very low	35.6	Very low	117 Å²	117	121.2 Å²	121.2	76%	0.76	80%	0.801	S	S	*	*			trans	-140.9	-161.4	-150	48.5	-31.1	0	0	0	119.7
1330	L	34.3	Very low	35.7	Very low	168 Å²	168	120.6 Å²	120.6	88%	0.88	80%	0.797	S	S	*	*			trans	141	163.3	155.5	-78.1	164.3	0	0	0	112.4
1331	S	36.6	Very low	35.8	Very low	106 Å²	106	122 Å²	122	74%	0.741	80%	0.801	S	S	*	*			cis	-176.7	-178.8	-23.4	70.6	0	0	0	0	109
1332	A	39.3	Very low	35.7	Very low	83 Å²	83	119.4 Å²	119.4	69%	0.686	79%	0.794	S	S	*	*			cis	-169.2	170.2	-0.3	0	0	0	0	0	113.1
1333	C	33.2	Very low	35.8	Very low	119 Å²	119	123 Å²	123	80%	0.804	80%	0.795	S	S	*	*			trans	72.2	149.2	150.3	-75.9	0	0	0	0	123.9
1334	R	34.2	Very low	36.1	Very low	233 Å²	233	123 Å²	123	88%	0.879	79%	0.791	S	S	*	*			cis	-167.7	-168.5	-22.9	-131.3	-168.5	177.8	176.6	1	112.9
1335	P	39.5	Very low	36.2	Very low	105 Å²	105	121.5 Å²	121.5	68%	0.682	79%	0.786	S	S	*	*				-137.8	174.2	-119.8	48.6	-29.6	0	0	0	121.8
1336	A	32.8	Very low	35.6	Very low	89 Å²	89	121 Å²	121	74%	0.736	79%	0.786	S	S	*	*			trans	44.3	146.4	135.7	0	0	0	0	0	126.4
1337	F	33.6	Very low	35.6	Very low	209 Å²	209	123.1 Å²	123.1	92%	0.917	78%	0.781	S	S	*	*				-160.9	171.4	127.9	-117.9	-80.3	0	0	0	112.7
1338	S	32.2	Very low	35.6	Very low	105 Å²	105	127 Å²	127	73%	0.734	79%	0.785	S	S	*	*			trans	-148.9	-159.3	-162.4	63.2	0	0	0	0	115.5
1339	V	34.9	Very low	35.7	Very low	126 Å²	126	126 Å²	126	76%	0.764	77%	0.774	S	S	*	*			trans	99.7	116.9	-174	176.4	0	0	0	0	112.4
1340	S	33.4	Very low	34.7	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	77%	0.774	S	S	*	*			cis	84.2	149.6	39.9	96.6	0	0	0	0	114
1341	S	34.7	Very low	34.6	Very low	118 Å²	118	124.5 Å²	124.5	83%	0.825	77%	0.768	S	S	*	*			cis	-166.8	163.9	9.3	33.7	0	0	0	0	111.9
1342	G	34.1	Very low	34.3	Very low	69 Å²	69	127.6 Å²	127.6	71%	0.711	78%	0.777	S	S	*	*			trans	124.7	137.3	167.8	0	0	0	0	0	114
1343	D	35.5	Very low	33.8	Very low	155 Å²	155	129.1 Å²	129.1	83%	0.829	78%	0.782	S	S	*	*			cis	-154.8	171.6	-3.3	-126.6	-41.1	0	0	0	114
1344	T	36.8	Very low	33.8	Very low	127 Å²	127	125.5 Å²	125.5	78%	0.779	76%	0.759	S	S	*	*			trans	-41.7	162.4	177.9	49.3	0	0	0	0	118.9
1345	A	35.4	Very low	33.8	Very low	87 Å²	87	123.4 Å²	123.4	72%	0.719	76%	0.756	S	S	*	*			cis	-165	162.8	-14.5	0	0	0	0	0	109.1
1346	S	35.7	Very low	33.7	Very low	117 Å²	117	123.3 Å²	123.3	82%	0.818	74%	0.743	S	S	*	*				-166.9	145.7	91.6	60	0	0	0	0	113.5
1347	N	33.4	Very low	34	Very low	151 Å²	151	124.6 Å²	124.6	81%	0.807	73%	0.733	S	S	*	*			trans	-91.8	158.7	-171.8	-58.1	-37.1	0	0	0	115
1348	L	34.6	Very low	34.3	Very low	153 Å²	153	117.3 Å²	117.3	80%	0.801	71%	0.711	S	S	*	*				-170.4	128.3	113.2	-120.9	73.8	0	0	0	113.3
1349	T	35.5	Very low	34.8	Very low	108 Å²	108	114.8 Å²	114.8	66%	0.663	69%	0.691	S	S	*	*			trans	28.3	140.5	133.2	61.1	0	0	0	0	121
1350	D	29.7	Very low	35.5	Very low	143 Å²	143	112.8 Å²	112.8	77%	0.765	68%	0.676	S	S	*	*			cis	-168.7	-179.7	4.7	-131.2	-49.2	0	0	0	115.1
1351	S	31.8	Very low	35.9	Very low	109 Å²	109	112.1 Å²	112.1	76%	0.762	66%	0.664	S	S	*	*			trans	94.4	139.1	150	77.4	0	0	0	0	121
1352	N	29.1	Very low	36.1	Very low	172 Å²	172	114.2 Å²	114.2	92%	0.92	66%	0.658	S	S	*	*			trans	-80.2	154	-176.5	-64.5	-57.2	0	0	0	113.4
1353	S	30.5	Very low	36.6	Very low	114 Å²	114	115.5 Å²	115.5	80%	0.797	64%	0.644	S	S	*	*			trans	-144.7	124.8	164.9	-175.4	0	0	0	0	111.2
1354	S	33.2	Very low	36.9	Very low	44 Å²	44	114 Å²	114	31%	0.308	65%	0.646	S	S	.	*			trans	-76.7	152.8	178.6	42.3	0	0	0	0	112.3	E1291 Y1356	E1291-S1354 WeakPolarHBondContact OE1-CB 3.16Å; E1291-S1354 PolarHBondContact OE1-OG 2.66Å; S1354-Y1356 WeakPolarHBondContact O-CD2 3.24Å; S1354-Y1356 PolarHBondContact O-N 3.01Å; S1354-Y1356 PolarHBondContact OG-OH 2.9Å
1355	K	33.2	Very low	37.1	Very low	188 Å²	188	117.2 Å²	117.2	82%	0.817	65%	0.649	S	S	*	*			trans	-82.8	98.1	177.5	-84.9	-176.1	176.4	174.3	0	111.1
1356	Y	36.6	Very low	37.1	Very low	104 Å²	104	115.7 Å²	115.7	41%	0.408	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.2	121.7	172.4	-57.3	-72.9	0	0	0	112.7	L1289 E1291 S1354	L1289-Y1356 HydrophobicContact CB-CD1 4.19Å; L1289-Y1356 HydrophobicContact CD2-CD1 4.03Å; L1289-Y1356 HydrophobicContact CD2-CD2 4.34Å; L1289-Y1356 HydrophobicContact CD2-CG 3.82Å; L1289-Y1356 HydrophobicContact CG-CD1 4.48Å; L1289-Y1356 HydrophobicContact CG-CG 4.4Å; E1291-Y1356 HydrophobicContact CB-CD1 4.22Å; E1291-Y1356 HydrophobicContact CB-CE1 3.96Å; E1291-Y1356 HydrophobicContact CG-CD1 4.47Å; E1291-Y1356 HydrophobicContact CG-CE1 3.94Å; E1291-Y1356 WeakPolarHBondContact OE1-CE1 3.06Å; E1291-Y1356 VanDerWaalsContact OE1-CZ 3.32Å; E1291-Y1356 PolarHBondContact OE1-OH 3.06Å; S1354-Y1356 WeakPolarHBondContact O-CD2 3.24Å; S1354-Y1356 PolarHBondContact O-N 3.01Å; S1354-Y1356 PolarHBondContact OG-OH 2.9Å
1357	Q	39	Very low	37.2	Very low	116 Å²	116	119.5 Å²	119.5	54%	0.542	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103	134	167.9	-167.6	158.4	-26.5	0	0	109.8	I1290 Y1292	I1290-Q1357 PolarHBondContact N-O 2.94Å; Y1292-Q1357 HydrophobicContact CE2-CB 4.27Å
1358	A	40.1	Very low	37.4	Very low	55 Å²	55	121.1 Å²	121.1	46%	0.455	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.9	116.3	-175.3	0	0	0	0	0	110.7
1359	V	43.7	Very low	37.6	Very low	52 Å²	52	118.3 Å²	118.3	32%	0.315	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100	131.3	175	179.9	0	0	0	0	109.5	V1288 I1290 L1361	V1288-V1359 PolarHBondContact N-O 3.06Å; V1288-V1359 PolarHBondContact O-N 3.25Å; I1290-V1359 HydrophobicContact CD1-CB 4.27Å; I1290-V1359 HydrophobicContact CD1-CG2 3.76Å; I1290-V1359 HydrophobicContact CG1-CG2 4.26Å; V1359-L1361 HydrophobicContact CG1-CG 4.34Å; V1359-L1361 PolarHBondContact O-N 3.42Å
1360	I	48.6	Very low	37.9	Very low	85 Å²	85	117.5 Å²	117.5	44%	0.436	62%	0.618	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93	90.4	-171.2	-61.3	179.6	0	0	0	109	Y1223 Y1285	Y1223-I1360 VanDerWaalsContact OH-CD1 3.23Å; Y1223-I1360 WeakPolarHBondContact OH-CD1 3.2Å; Y1285-I1360 VanDerWaalsContact CB-CG2 3.43Å; Y1285-I1360 HydrophobicContact CD1-CG2 3.62Å; Y1285-I1360 HydrophobicContact CE1-CG2 4.49Å; Y1285-I1360 HydrophobicContact CG-CG2 3.66Å
1361	L	42.8	Very low	38.5	Very low	88 Å²	88	113.3 Å²	113.3	46%	0.461	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.5	134.1	-176.7	-76.7	172.2	0	0	0	112.4	Y1285 E1286 V1288 V1359	Y1285-L1361 VanDerWaalsContact CA-O 3.29Å; Y1285-L1361 WeakPolarHBondContact CA-O 3.22Å; E1286-L1361 PolarHBondContact N-O 3.07Å; E1286-L1361 PolarHBondContact O-N 2.7Å; E1286-L1361 VanDerWaalsContact O-N 3.12Å; V1288-L1361 HydrophobicContact CB-CD1 4.22Å; V1288-L1361 HydrophobicContact CG2-CD1 3.86Å; V1359-L1361 HydrophobicContact CG1-CG 4.34Å; V1359-L1361 PolarHBondContact O-N 3.42Å
1362	K	39.6	Very low	38.9	Very low	162 Å²	162	111 Å²	111	70%	0.704	59%	0.591	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.3	121.6	-176.9	-171	172.8	-175.3	170.5	0	111	Y1285 S1364	Y1285-K1362 HydrophobicContact CD1-CB 4.05Å; Y1285-K1362 HydrophobicContact CE1-CB 3.95Å; Y1285-K1362 HydrophobicContact CE1-CG 4.13Å; K1362-S1364 PolarHBondContact O-N 2.7Å
1363	K	43.7	Very low	39.6	Very low	96 Å²	96	107 Å²	107	42%	0.417	57%	0.573	S	S	.	*			trans	-74.6	102.6	-167.7	-159.1	154.7	-177	157	0	112.5	C1284 E1286 K1365 S1366	C1284-K1363 WeakPolarHBondContact O-CB 3.42Å; C1284-K1363 PolarHBondContact O-N 3.08Å; E1286-K1363 IonicContact OE1-NZ 2.89Å; E1286-K1363 PolarHBondContact OE1-NZ 3.3Å; E1286-K1363 WeakPolarHBondContact OE2-CD 3.42Å; E1286-K1363 WeakPolarHBondContact OE2-CE 3.34Å; E1286-K1363 IonicContact OE2-NZ 2.63Å; E1286-K1363 PolarHBondContact OE2-NZ 3.34Å; K1363-K1365 PolarHBondContact O-N 3.09Å; K1363-S1366 PolarHBondContact O-N 3.17Å
1364	S	42.5	Very low	40.3	Very low	124 Å²	124	105.8 Å²	105.8	87%	0.867	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-12.6	-167.2	-165.5	0	0	0	0	116.9	K1362	K1362-S1364 PolarHBondContact O-N 2.7Å
1365	K	39.4	Very low	40.7	Very low	194 Å²	194	107.3 Å²	107.3	84%	0.843	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-5.8	-175.1	-72.5	-178	173.9	177.7	0	116.1	K1363 K1367	K1363-K1365 PolarHBondContact O-N 3.09Å; K1365-K1367 PolarHBondContact O-N 3.11Å
1366	S	36.6	Very low	41.1	Very low	55 Å²	55	102.3 Å²	102.3	39%	0.385	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.4	-13.9	-167.3	-156.1	0	0	0	0	116.7	K1363 K1368 V1369	K1363-S1366 PolarHBondContact O-N 3.17Å; S1366-K1368 PolarHBondContact O-N 3.19Å; S1366-V1369 PolarHBondContact O-N 2.93Å; S1366-V1369 VanDerWaalsContact O-N 3.09Å
1367	K	36.7	Very low	41	Very low	196 Å²	196	101.6 Å²	101.6	85%	0.852	59%	0.585	S	S	*	*	H	α-helix	trans	-57.8	-20.8	-177.4	-92.4	-171.8	174.4	-177.2	0	115.1	K1365	K1365-K1367 PolarHBondContact O-N 3.11Å
1368	K	38	Very low	40.8	Very low	185 Å²	185	109.6 Å²	109.6	80%	0.804	61%	0.611	S	S	*	*	H	α-helix	trans	-86.3	-23.9	177.6	-72.5	-168.8	173.5	-172.1	0	114.7	S1366 A1372	S1366-K1368 PolarHBondContact O-N 3.19Å; K1368-A1372 PolarHBondContact O-N 3.39Å
1369	V	39.8	Very low	40.8	Very low	95 Å²	95	112.3 Å²	112.3	58%	0.576	62%	0.618	S	S	*	*	H	α-helix	trans	-85.3	-42.1	-175.3	-177.1	0	0	0	0	111.2	S1366 A1371 A1372 T1373	S1366-V1369 PolarHBondContact O-N 2.93Å; S1366-V1369 VanDerWaalsContact O-N 3.09Å; V1369-A1371 VanDerWaalsContact C-N 3.25Å; V1369-A1371 PolarHBondContact O-N 3.06Å; V1369-A1372 PolarHBondContact O-N 2.86Å; V1369-A1372 VanDerWaalsContact O-N 3.13Å; V1369-T1373 PolarHBondContact O-N 3.45Å; V1369-T1373 VanDerWaalsContact O-N 3.16Å; V1369-T1373 PolarHBondContact O-OG1 3.17Å
1370	V	41.8	Very low	40.7	Very low	90 Å²	90	115.5 Å²	115.5	55%	0.545	63%	0.634	S	S	.	*	H	α-helix	trans	-63.1	-33.7	177.3	-177.1	0	0	0	0	111.7	T1373 T1374	V1370-T1373 WeakPolarHBondContact CA-OG1 3.45Å; V1370-T1373 PolarHBondContact O-OG1 3.32Å; V1370-T1374 PolarHBondContact O-N 2.91Å; V1370-T1374 PolarHBondContact O-OG1 3.33Å
1371	A	41.2	Very low	40.3	Very low	55 Å²	55	117.2 Å²	117.2	46%	0.455	65%	0.645	S	S	.	*	H	α-helix	trans	-69.3	-36.5	174.5	0	0	0	0	0	113.1	V1369 T1374 A1375	V1369-A1371 VanDerWaalsContact C-N 3.25Å; V1369-A1371 PolarHBondContact O-N 3.06Å; A1371-T1374 PolarHBondContact O-OG1 2.86Å; A1371-A1375 VanDerWaalsContact O-CB 3.3Å; A1371-A1375 WeakPolarHBondContact O-CB 3.11Å; A1371-A1375 PolarHBondContact O-N 2.79Å; A1371-A1375 VanDerWaalsContact O-N 3.1Å
1372	A	41.1	Very low	40.1	Very low	61 Å²	61	118.9 Å²	118.9	50%	0.504	66%	0.656	S	S	.	*	H	α-helix	trans	-68.4	-37.2	177.2	0	0	0	0	0	112	K1368 V1369 A1376	K1368-A1372 PolarHBondContact O-N 3.39Å; V1369-A1372 PolarHBondContact O-N 2.86Å; V1369-A1372 VanDerWaalsContact O-N 3.13Å; A1372-A1376 PolarHBondContact O-N 2.72Å
1373	T	44	Very low	40.1	Very low	89 Å²	89	116.2 Å²	116.2	55%	0.546	65%	0.653	S	S	.	*	H	α-helix	trans	-75.5	-26.3	178	44.9	0	0	0	0	114.1	V1369 V1370	V1369-T1373 PolarHBondContact O-N 3.45Å; V1369-T1373 VanDerWaalsContact O-N 3.16Å; V1369-T1373 PolarHBondContact O-OG1 3.17Å; V1370-T1373 WeakPolarHBondContact CA-OG1 3.45Å; V1370-T1373 PolarHBondContact O-OG1 3.32Å
1374	T	44.9	Very low	39.9	Very low	87 Å²	87	117.5 Å²	117.5	53%	0.534	67%	0.669	S	S	.	*	H	α-helix	trans	-86.3	-17.5	173.3	50.7	0	0	0	0	113.6	V1370 A1371	V1370-T1374 PolarHBondContact O-N 2.91Å; V1370-T1374 PolarHBondContact O-OG1 3.33Å; A1371-T1374 PolarHBondContact O-OG1 2.86Å
1375	A	42.1	Very low	39.7	Very low	76 Å²	76	117.1 Å²	117.1	63%	0.628	66%	0.655	S	S	*	*	S	Bend	trans	-86	-5.3	171.2	0	0	0	0	0	114.1	A1371	A1371-A1375 VanDerWaalsContact O-CB 3.3Å; A1371-A1375 WeakPolarHBondContact O-CB 3.11Å; A1371-A1375 PolarHBondContact O-N 2.79Å; A1371-A1375 VanDerWaalsContact O-N 3.1Å
1376	A	40.9	Very low	39.7	Very low	84 Å²	84	111.2 Å²	111.2	69%	0.694	64%	0.64	S	S	*	*	S	Bend	trans	-111.7	7.5	174.1	0	0	0	0	0	113.1	A1372	A1372-A1376 PolarHBondContact O-N 2.72Å
1377	A	35.4	Very low	40	Very low	88 Å²	88	115.8 Å²	115.8	73%	0.727	66%	0.661	S	S	*	*			trans	-122	21.5	174.8	0	0	0	0	0	111.6
1378	R	34.2	Very low	40.3	Very low	284 Å²	284	108.5 Å²	108.5	100%	1.072	64%	0.644	S	S	*	*			trans	-130	0	165.7	-88.7	-174.3	168.6	-174.8	-3.5	107.2

Retrieved 1,378 of 1,378 residues in 1149.2 ms (Link to these results)

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